2026-05-24 16:44:26,220 INFO - start - parameters: File name /home/rpdock/web/media/jobs/0c17a33b-57b0-4db6-9093-e9acf9d964c1//ref_struc/na-prot_401/na-prot_401.pdb Steps 1000 Temp. start 15000.0 Temp. end 295.0 False 2026-05-24 16:44:26,532 INFO - step #1 R -522256.61 -1217918.58 -1104338.03 1800000.00 T= 15000.00 K 2026-05-24 16:44:26,600 INFO - step #2 T -603582.73 -1167661.27 -1035921.45 1600000.00 T= 14985.30 K 2026-05-24 16:44:26,663 INFO - step #3 T -924502.77 -1182059.13 -1042443.64 1300000.00 T= 14970.59 K 2026-05-24 16:44:26,797 INFO - step #4 T -953763.95 -1158907.34 -994856.61 1200000.00 T= 14926.48 K 2026-05-24 16:44:26,985 INFO - step #5 T -1036102.14 -1270295.45 -1065806.69 1300000.00 T= 14867.66 K 2026-05-24 16:44:27,165 INFO - step #6 R -1603046.68 -1447020.50 -1256026.18 1100000.00 T= 14808.84 K 2026-05-24 16:44:27,305 INFO - step #7 T -1688704.42 -1442645.59 -1246058.83 1000000.00 T= 14764.72 K 2026-05-24 16:44:27,554 INFO - step #8 R -1678903.80 -1423244.90 -1255658.89 1000000.00 T= 14676.49 K 2026-05-24 16:44:27,887 INFO - step #9 T -1648650.28 -1351015.28 -1197635.00 900000.00 T= 14558.85 K 2026-05-24 16:44:27,989 INFO - step #10 R -1683015.53 -1371281.74 -1211733.79 900000.00 T= 14529.44 K 2026-05-24 16:44:28,210 INFO - step #11 R -1606619.48 -1326803.58 -1179815.91 900000.00 T= 14455.92 K 2026-05-24 16:44:28,277 INFO - step #12 R -1213575.37 -1395353.41 -1218221.96 1400000.00 T= 14441.21 K 2026-05-24 16:44:28,390 INFO - step #13 R -1217730.45 -1395353.41 -1222377.04 1400000.00 T= 14426.51 K 2026-05-24 16:44:28,454 INFO - step #14 R -1263092.10 -1421240.22 -1241851.89 1400000.00 T= 14411.80 K 2026-05-24 16:44:28,557 INFO - step #15 T -1337562.44 -1248100.81 -1089461.63 1000000.00 T= 14382.39 K 2026-05-24 16:44:28,626 INFO - step #16 R -1338545.32 -1256553.21 -1081992.11 1000000.00 T= 14367.69 K 2026-05-24 16:44:28,690 INFO - step #17 T -1771203.21 -1103748.61 -967454.60 300000.00 T= 14352.98 K 2026-05-24 16:44:28,751 INFO - step #18 R -1813617.39 -1118938.42 -994678.98 300000.00 T= 14338.28 K 2026-05-24 16:44:28,814 INFO - step #19 R -1935568.39 -1136949.06 -998619.33 200000.00 T= 14323.57 K 2026-05-24 16:44:28,877 INFO - step #20 R -1935100.72 -1136481.39 -998619.33 200000.00 T= 14308.87 K 2026-05-24 16:44:28,937 INFO - step #21 T -1942607.91 -1060896.02 -881711.89 0.00 T= 14294.16 K 2026-05-24 16:44:29,071 INFO - step #22 R -1945553.47 -1063156.47 -882397.00 0.00 T= 14250.05 K 2026-05-24 16:44:29,132 INFO - step #23 R -1955498.79 -1061651.03 -893847.76 0.00 T= 14235.34 K 2026-05-24 16:44:29,261 INFO - step #24 R -1951488.31 -1063569.91 -887918.41 0.00 T= 14191.23 K 2026-05-24 16:44:29,358 INFO - step #25 R -2040304.98 -1114669.96 -925635.02 0.00 T= 14161.82 K 2026-05-24 16:44:29,491 INFO - step #26 T -1919953.85 -1088693.03 -931260.83 100000.00 T= 14117.70 K 2026-05-24 16:44:29,554 INFO - step #27 R -2064739.37 -1118348.66 -946390.71 0.00 T= 14103.00 K 2026-05-24 16:44:29,738 INFO - step #28 T -2062292.99 -1195877.63 -1066415.36 200000.00 T= 14073.59 K 2026-05-24 16:44:29,803 INFO - step #29 T -1994405.32 -1263638.55 -1130766.76 400000.00 T= 14058.88 K 2026-05-24 16:44:29,867 INFO - step #30 R -1931615.46 -1226421.91 -1105193.55 400000.00 T= 14044.18 K 2026-05-24 16:44:29,931 INFO - step #31 R -1991178.27 -1255675.77 -1135502.50 400000.00 T= 14029.47 K 2026-05-24 16:44:29,998 INFO - step #32 R -2009215.23 -1272311.88 -1136903.35 400000.00 T= 14014.77 K 2026-05-24 16:44:30,062 INFO - step #33 R -2110338.19 -1262196.76 -1148141.44 300000.00 T= 14000.06 K 2026-05-24 16:44:30,129 INFO - step #34 T -2137400.15 -1338918.89 -1198481.26 400000.00 T= 13985.36 K 2026-05-24 16:44:30,196 INFO - step #35 R -2137400.15 -1338918.89 -1198481.26 400000.00 T= 13970.65 K 2026-05-24 16:44:30,638 INFO - step #36 R -2144053.85 -1332441.19 -1211612.66 400000.00 T= 13808.90 K 2026-05-24 16:44:30,743 INFO - step #37 R -2118198.46 -1318300.10 -1199898.37 400000.00 T= 13779.49 K 2026-05-24 16:44:30,957 INFO - step #38 R -2136964.38 -1328712.56 -1208251.82 400000.00 T= 13705.96 K 2026-05-24 16:44:31,249 INFO - step #39 T -1911646.03 -1227496.99 -1084149.03 400000.00 T= 13603.03 K 2026-05-24 16:44:31,389 INFO - step #40 R -2061432.98 -1251315.33 -1110117.65 300000.00 T= 13558.91 K 2026-05-24 16:44:31,650 INFO - step #41 R -2027454.59 -1295019.11 -1132435.48 400000.00 T= 13514.80 K 2026-05-24 16:44:31,941 INFO - step #42 R -2033435.31 -1301389.93 -1132045.38 400000.00 T= 13411.86 K 2026-05-24 16:44:32,047 INFO - step #43 T -2058246.10 -1251876.43 -1106369.67 300000.00 T= 13382.45 K 2026-05-24 16:44:32,109 INFO - step #44 R -2006886.54 -1173597.81 -1033288.73 200000.00 T= 13367.75 K 2026-05-24 16:44:32,211 INFO - step #45 R -2012482.25 -1181348.17 -1031134.08 200000.00 T= 13338.34 K 2026-05-24 16:44:32,464 INFO - step #46 R -2035435.49 -1189485.81 -1045949.68 200000.00 T= 13250.11 K 2026-05-24 16:44:32,600 INFO - step #47 T -1992843.89 -1159390.72 -1033453.18 200000.00 T= 13205.99 K 2026-05-24 16:44:32,701 INFO - step #48 R -1936754.34 -1131848.41 -1004905.93 200000.00 T= 13176.58 K 2026-05-24 16:44:32,765 INFO - step #49 R -1980276.80 -1154333.11 -1025943.68 200000.00 T= 13161.88 K 2026-05-24 16:44:32,828 INFO - step #50 T -1945957.74 -1138015.56 -1007942.18 200000.00 T= 13147.17 K 2026-05-24 16:44:32,892 INFO - step #51 T -1937113.72 -1137292.59 -999821.13 200000.00 T= 13132.47 K 2026-05-24 16:44:32,957 INFO - step #52 T -1945440.85 -1083708.16 -961732.69 100000.00 T= 13117.76 K 2026-05-24 16:44:33,057 INFO - step #53 T -1877109.88 -1066029.01 -911080.88 100000.00 T= 13088.35 K 2026-05-24 16:44:33,185 INFO - step #54 T -1774102.59 -1066555.31 -907547.28 200000.00 T= 13044.24 K 2026-05-24 16:44:33,439 INFO - step #55 R -1855949.53 -1095266.70 -960682.83 200000.00 T= 13014.83 K 2026-05-24 16:44:33,585 INFO - step #56 R -1853605.49 -1095756.19 -957849.30 200000.00 T= 12970.71 K 2026-05-24 16:44:33,687 INFO - step #57 R -1797948.82 -1067582.64 -930366.19 200000.00 T= 12941.30 K 2026-05-24 16:44:33,749 INFO - step #58 T -1700370.61 -954995.45 -845375.16 100000.00 T= 12926.60 K 2026-05-24 16:44:33,810 INFO - step #59 T -1769640.76 -985789.24 -883851.52 100000.00 T= 12911.89 K 2026-05-24 16:44:33,884 INFO - step #60 R -1792541.73 -1004711.22 -887830.50 100000.00 T= 12897.19 K 2026-05-24 16:44:33,948 INFO - step #61 T -1665455.61 -995080.08 -870375.53 200000.00 T= 12882.48 K 2026-05-24 16:44:34,017 INFO - step #62 R -1815701.63 -1023025.68 -892675.96 100000.00 T= 12867.78 K 2026-05-24 16:44:34,154 INFO - step #63 T -1852102.11 -1036813.81 -915288.30 100000.00 T= 12823.66 K 2026-05-24 16:44:34,251 INFO - step #64 T -1829912.82 -1014945.96 -914966.87 100000.00 T= 12794.25 K 2026-05-24 16:44:34,346 INFO - step #65 T -1707159.26 -995170.31 -911988.95 200000.00 T= 12764.84 K 2026-05-24 16:44:34,445 INFO - step #66 T -1757931.00 -1136294.77 -1021636.23 400000.00 T= 12735.43 K 2026-05-24 16:44:34,510 INFO - step #67 R -1911319.80 -1163496.72 -1047823.08 300000.00 T= 12720.73 K 2026-05-24 16:44:34,908 INFO - step #68 R -1902688.84 -1161788.16 -1040900.68 300000.00 T= 12573.68 K 2026-05-24 16:44:35,081 INFO - step #69 R -1985183.68 -1157355.38 -1027828.30 200000.00 T= 12514.86 K 2026-05-24 16:44:35,632 INFO - step #70 R -1976027.88 -1149555.37 -1026472.51 200000.00 T= 12382.51 K 2026-05-24 16:44:35,948 INFO - step #71 R -1855104.89 -1137531.69 -1017573.20 300000.00 T= 12264.87 K 2026-05-24 16:44:36,016 INFO - step #72 R -1851541.47 -1137489.34 -1014052.14 300000.00 T= 12250.17 K 2026-05-24 16:44:36,077 INFO - step #73 T -1452179.29 -904559.79 -847619.50 300000.00 T= 12235.46 K 2026-05-24 16:44:36,238 INFO - step #74 R -1585233.83 -974955.96 -910277.87 300000.00 T= 12176.64 K 2026-05-24 16:44:36,335 INFO - step #75 T -1762259.38 -1030291.30 -931968.08 200000.00 T= 12147.23 K 2026-05-24 16:44:36,401 INFO - step #76 R -1965458.31 -1082318.58 -983139.73 100000.00 T= 12132.53 K 2026-05-24 16:44:37,659 INFO - step #77 T -1745381.70 -1022542.70 -922839.01 200000.00 T= 11617.85 K 2026-05-24 16:44:37,795 INFO - step #78 R -1533426.46 -1139264.66 -994161.80 600000.00 T= 11573.74 K 2026-05-24 16:44:37,859 INFO - step #79 R -1414050.20 -1127957.82 -986092.38 700000.00 T= 11559.03 K 2026-05-24 16:44:37,924 INFO - step #80 R -1514898.61 -1123070.40 -991828.20 600000.00 T= 11544.33 K 2026-05-24 16:44:37,989 INFO - step #81 T -1505157.99 -1122904.50 -982253.49 600000.00 T= 11529.62 K 2026-05-24 16:44:38,056 INFO - step #82 R -1528535.66 -1127876.15 -1000659.51 600000.00 T= 11514.92 K 2026-05-24 16:44:38,132 INFO - step #83 R -1528678.53 -1128782.80 -999895.73 600000.00 T= 11500.21 K 2026-05-24 16:44:38,195 INFO - step #84 R -1404594.33 -1109622.41 -994971.92 700000.00 T= 11485.51 K 2026-05-24 16:44:38,258 INFO - step #85 R -1413088.84 -1119375.65 -993713.19 700000.00 T= 11470.80 K 2026-05-24 16:44:38,354 INFO - step #86 R -1404329.07 -1114423.73 -989905.34 700000.00 T= 11441.39 K 2026-05-24 16:44:38,659 INFO - step #87 R -1485050.88 -1154746.52 -1030304.35 700000.00 T= 11426.69 K 2026-05-24 16:44:38,758 INFO - step #88 T -1745648.11 -1091543.95 -954104.16 300000.00 T= 11397.28 K 2026-05-24 16:44:38,822 INFO - step #89 R -1843501.34 -1150494.88 -993006.46 300000.00 T= 11382.57 K 2026-05-24 16:44:38,960 INFO - step #90 R -1847803.81 -1149625.19 -998178.62 300000.00 T= 11338.46 K 2026-05-24 16:44:39,127 INFO - step #91 T -1777727.72 -1145593.07 -1032134.66 400000.00 T= 11279.64 K 2026-05-24 16:44:39,296 INFO - step #92 R -1760304.89 -1136471.34 -1023833.54 400000.00 T= 11220.82 K 2026-05-24 16:44:39,433 INFO - step #93 R -1780853.88 -1145076.55 -1035777.32 400000.00 T= 11176.70 K 2026-05-24 16:44:39,609 INFO - step #94 T -1865809.34 -1145848.20 -1019961.14 300000.00 T= 11117.88 K 2026-05-24 16:44:39,714 INFO - step #95 R -1830546.24 -1128074.82 -1002471.43 300000.00 T= 11088.47 K 2026-05-24 16:44:39,868 INFO - step #96 R -1861443.15 -1142494.51 -1018948.64 300000.00 T= 11044.36 K 2026-05-24 16:44:40,056 INFO - step #97 R -1881481.18 -1153669.74 -1027811.44 300000.00 T= 10985.54 K 2026-05-24 16:44:40,126 INFO - step #98 T -1754176.93 -1091400.92 -962776.01 300000.00 T= 10970.83 K 2026-05-24 16:44:40,427 INFO - step #99 R -1806886.22 -1118681.52 -988204.70 300000.00 T= 10867.90 K 2026-05-24 16:44:40,538 INFO - step #100 R -1836782.40 -1139830.56 -996951.84 300000.00 T= 10838.49 K 2026-05-24 16:44:40,774 INFO - step #101 R -1749884.07 -1356659.24 -1193224.83 800000.00 T= 10764.96 K 2026-05-24 16:44:41,178 INFO - step #102 T -1696757.15 -1204143.43 -1092613.72 600000.00 T= 10647.32 K 2026-05-24 16:44:41,246 INFO - step #103 R -1707286.44 -1202692.74 -1104593.69 600000.00 T= 10632.62 K 2026-05-24 16:44:41,729 INFO - step #104 R -1673299.25 -1187937.55 -1085361.70 600000.00 T= 10470.86 K 2026-05-24 16:44:41,802 INFO - step #105 T -1536914.88 -1366376.26 -1270538.62 1100000.00 T= 10456.16 K 2026-05-24 16:44:42,090 INFO - step #106 R -1414015.27 -1340345.45 -1273669.81 1200000.00 T= 10367.93 K 2026-05-24 16:44:42,164 INFO - step #107 T -1602348.41 -1297023.92 -1205324.49 900000.00 T= 10353.22 K 2026-05-24 16:44:42,675 INFO - step #108 T -1536515.58 -1420379.02 -1316136.56 1200000.00 T= 10294.40 K 2026-05-24 16:44:42,793 INFO - step #109 T -1905611.03 -1321651.09 -1183959.94 600000.00 T= 10264.99 K 2026-05-24 16:44:42,946 INFO - step #110 T -1928981.94 -1310438.89 -1118543.05 500000.00 T= 10220.88 K 2026-05-24 16:44:43,019 INFO - step #111 T -2000491.83 -1399087.01 -1201404.82 600000.00 T= 10206.17 K 2026-05-24 16:44:43,097 INFO - step #112 T -2113612.25 -1454808.61 -1258803.65 600000.00 T= 10191.47 K 2026-05-24 16:44:43,172 INFO - step #113 R -2096776.98 -1445938.19 -1250838.79 600000.00 T= 10176.76 K 2026-05-24 16:44:43,258 INFO - step #114 R -2311280.50 -1463207.57 -1248072.93 400000.00 T= 10162.06 K 2026-05-24 16:44:44,482 INFO - step #115 R -2311280.50 -1463207.57 -1248072.93 400000.00 T= 9720.91 K 2026-05-24 16:44:44,596 INFO - step #116 T -2352564.51 -1443263.85 -1209300.66 300000.00 T= 9691.50 K 2026-05-24 16:44:44,666 INFO - step #117 R -2347234.03 -1440017.97 -1207216.06 300000.00 T= 9676.79 K 2026-05-24 16:44:45,787 INFO - step #118 T -2273942.34 -1478578.47 -1295363.88 500000.00 T= 9279.76 K 2026-05-24 16:44:45,985 INFO - step #119 T -2307867.09 -1454368.24 -1253498.85 400000.00 T= 9220.94 K 2026-05-24 16:44:46,174 INFO - step #120 R -2020576.05 -1342229.05 -1178347.00 500000.00 T= 9162.12 K 2026-05-24 16:44:46,243 INFO - step #121 T -2215143.56 -1304856.26 -1110287.30 200000.00 T= 9147.41 K 2026-05-24 16:44:46,351 INFO - step #122 R -2342848.18 -1390021.18 -1152827.01 200000.00 T= 9118.00 K 2026-05-24 16:44:46,535 INFO - step #123 R -2322958.86 -1383435.71 -1139523.14 200000.00 T= 9059.18 K 2026-05-24 16:44:46,645 INFO - step #124 R -2270485.95 -1346181.29 -1124304.67 200000.00 T= 9029.77 K 2026-05-24 16:44:46,752 INFO - step #125 R -2342354.90 -1393514.92 -1148839.99 200000.00 T= 9000.36 K 2026-05-24 16:44:46,938 INFO - step #126 T -2342072.17 -1398169.05 -1143903.12 200000.00 T= 8941.54 K 2026-05-24 16:44:47,009 INFO - step #127 R -2350407.18 -1406059.95 -1144347.23 200000.00 T= 8926.84 K 2026-05-24 16:44:47,083 INFO - step #128 R -2318525.76 -1378475.74 -1140050.01 200000.00 T= 8912.13 K 2026-05-24 16:44:47,198 INFO - step #129 R -2303195.95 -1371181.54 -1132014.41 200000.00 T= 8882.72 K 2026-05-24 16:44:47,346 INFO - step #130 T -2378712.38 -1395482.26 -1183230.12 200000.00 T= 8838.61 K 2026-05-24 16:44:47,668 INFO - step #131 R -2326281.05 -1359675.75 -1166605.30 200000.00 T= 8735.67 K 2026-05-24 16:44:47,742 INFO - step #132 T -2375946.46 -1455972.12 -1219974.34 300000.00 T= 8720.97 K 2026-05-24 16:44:47,816 INFO - step #133 R -2403053.48 -1468186.86 -1234866.61 300000.00 T= 8706.26 K 2026-05-24 16:44:48,251 INFO - step #134 R -2415928.10 -1474992.99 -1240935.10 300000.00 T= 8691.56 K 2026-05-24 16:44:48,366 INFO - step #135 T -2512918.24 -1458732.35 -1254185.89 200000.00 T= 8662.15 K 2026-05-24 16:44:48,438 INFO - step #136 R -2366527.84 -1441031.11 -1225496.72 300000.00 T= 8647.44 K 2026-05-24 16:44:48,732 INFO - step #137 T -2397620.18 -1444496.69 -1253123.49 300000.00 T= 8559.21 K 2026-05-24 16:44:49,430 INFO - step #138 R -2421749.37 -1456961.70 -1264787.68 300000.00 T= 8323.93 K 2026-05-24 16:44:49,689 INFO - step #139 R -2333211.36 -1423033.09 -1210178.27 300000.00 T= 8235.70 K 2026-05-24 16:44:50,004 INFO - step #140 R -2345071.16 -1430301.44 -1214769.72 300000.00 T= 8132.77 K 2026-05-24 16:44:50,080 INFO - step #141 R -2336355.39 -1424229.09 -1212126.30 300000.00 T= 8118.06 K 2026-05-24 16:44:50,689 INFO - step #142 R -2330007.47 -1423011.56 -1206995.90 300000.00 T= 7897.49 K 2026-05-24 16:44:50,845 INFO - step #143 T -2260045.35 -1354216.76 -1105828.59 200000.00 T= 7853.37 K 2026-05-24 16:44:51,024 INFO - step #144 R -2248191.35 -1349032.99 -1099158.36 200000.00 T= 7794.55 K 2026-05-24 16:44:51,431 INFO - step #145 R -2284135.66 -1352084.03 -1132051.63 200000.00 T= 7647.50 K 2026-05-24 16:44:51,726 INFO - step #146 T -2414006.98 -1423595.85 -1190411.14 200000.00 T= 7544.57 K 2026-05-24 16:44:51,796 INFO - step #147 R -2418449.11 -1475752.14 -1242696.97 300000.00 T= 7529.86 K 2026-05-24 16:44:51,944 INFO - step #148 R -2377563.39 -1510760.30 -1266803.09 400000.00 T= 7485.75 K 2026-05-24 16:44:52,089 INFO - step #149 T -2322484.87 -1422875.92 -1199608.95 300000.00 T= 7441.63 K 2026-05-24 16:44:52,269 INFO - step #150 R -2363799.14 -1407466.54 -1156332.60 200000.00 T= 7382.81 K 2026-05-24 16:44:52,638 INFO - step #151 R -2364000.46 -1407667.86 -1156332.60 200000.00 T= 7250.47 K 2026-05-24 16:44:53,581 INFO - step #152 R -2365634.80 -1409302.20 -1156332.60 200000.00 T= 6897.55 K 2026-05-24 16:44:53,761 INFO - step #153 R -2368847.39 -1410662.75 -1158184.64 200000.00 T= 6838.73 K 2026-05-24 16:44:53,901 INFO - step #154 R -2363799.14 -1407466.54 -1156332.60 200000.00 T= 6794.61 K 2026-05-24 16:44:55,035 INFO - step #155 R -2377579.99 -1415540.63 -1162039.37 200000.00 T= 6368.17 K 2026-05-24 16:44:55,411 INFO - step #156 T -2478219.04 -1513231.99 -1264987.05 300000.00 T= 6235.82 K 2026-05-24 16:44:55,713 INFO - step #157 T -2539315.19 -1487768.22 -1251546.97 200000.00 T= 6132.89 K 2026-05-24 16:44:57,587 INFO - step #158 R -2557854.74 -1495677.04 -1262177.70 200000.00 T= 5427.05 K 2026-05-24 16:44:57,842 INFO - step #159 R -2558686.24 -1496508.54 -1262177.70 200000.00 T= 5338.82 K 2026-05-24 16:44:58,028 INFO - step #160 R -2522236.25 -1482570.48 -1239665.77 200000.00 T= 5280.00 K 2026-05-24 16:44:59,507 INFO - step #161 R -2546896.37 -1492062.68 -1254833.69 200000.00 T= 4721.21 K 2026-05-24 16:45:00,323 INFO - step #162 R -2556480.32 -1495677.04 -1260803.28 200000.00 T= 4603.57 K 2026-05-24 16:45:02,444 INFO - step #163 R -2557854.74 -1495677.04 -1262177.70 200000.00 T= 3853.61 K 2026-05-24 16:45:03,191 INFO - step #164 R -2546888.39 -1491901.19 -1254987.20 200000.00 T= 3588.92 K 2026-05-24 16:45:09,711 INFO - step #165 R -2549144.57 -1494310.88 -1254833.69 200000.00 T= 1147.89 K 2026-05-24 16:45:12,857 INFO - save short traj 2026-05-24 16:45:12,889 INFO - save best.pdb 2026-05-24 16:45:12,913 INFO - save plot e_step.png 2026-05-24 16:45:13,365 INFO - done 2026-05-24 16:45:14,165 INFO - start - parameters: File name /home/rpdock/web/media/jobs/0c17a33b-57b0-4db6-9093-e9acf9d964c1//ref_struc/na-prot_401/na-prot_401.pdb Steps 1000 Temp. start 15000.0 Temp. end 295.0 False 2026-05-24 16:45:14,467 INFO - step #1 T -1032300.47 -1395976.78 -1236323.69 1600000.00 T= 15000.00 K 2026-05-24 16:45:14,533 INFO - step #2 T -1546335.00 -1284823.68 -1161511.32 900000.00 T= 14985.30 K 2026-05-24 16:45:14,635 INFO - step #3 R -1830064.75 -1223723.12 -1106341.64 500000.00 T= 14955.89 K 2026-05-24 16:45:14,698 INFO - step #4 R -1931397.86 -1229639.70 -1101758.16 400000.00 T= 14941.18 K 2026-05-24 16:45:15,104 INFO - step #5 T -1877520.75 -1096171.85 -981348.91 200000.00 T= 14794.13 K 2026-05-24 16:45:15,308 INFO - step #6 R -1889545.00 -1103993.10 -985551.90 200000.00 T= 14720.61 K 2026-05-24 16:45:15,370 INFO - step #7 R -1868384.94 -1091713.31 -976671.63 200000.00 T= 14705.90 K 2026-05-24 16:45:15,436 INFO - step #8 R -1891015.96 -1099234.43 -991781.53 200000.00 T= 14691.20 K 2026-05-24 16:45:15,502 INFO - step #9 R -1707030.94 -1113856.30 -993174.64 400000.00 T= 14676.49 K 2026-05-24 16:45:15,568 INFO - step #10 R -1916780.48 -1108969.41 -1007811.07 200000.00 T= 14661.79 K 2026-05-24 16:45:15,855 INFO - step #11 T -1925213.96 -1127620.68 -997593.28 200000.00 T= 14558.85 K 2026-05-24 16:45:15,917 INFO - step #12 T -1715873.34 -983828.80 -832044.53 100000.00 T= 14544.15 K 2026-05-24 16:45:16,048 INFO - step #13 T -1823256.59 -1093109.94 -930146.66 200000.00 T= 14500.03 K 2026-05-24 16:45:16,200 INFO - step #14 R -1902063.77 -1074452.60 -927611.18 100000.00 T= 14470.62 K 2026-05-24 16:45:16,333 INFO - step #15 R -1907940.75 -1079866.27 -928074.47 100000.00 T= 14426.51 K 2026-05-24 16:45:16,430 INFO - step #16 T -1781689.57 -1103264.06 -978425.51 300000.00 T= 14397.10 K 2026-05-24 16:45:16,492 INFO - step #17 R -1775808.26 -1097693.95 -978114.31 300000.00 T= 14382.39 K 2026-05-24 16:45:16,590 INFO - step #18 R -1772061.98 -1095188.25 -976873.73 300000.00 T= 14352.98 K 2026-05-24 16:45:16,722 INFO - step #19 R -1792604.09 -1111077.86 -981526.23 300000.00 T= 14308.87 K 2026-05-24 16:45:16,784 INFO - step #20 T -1728542.65 -1083889.31 -944653.34 300000.00 T= 14294.16 K 2026-05-24 16:45:16,883 INFO - step #21 R -1863451.96 -1149800.01 -1013651.95 300000.00 T= 14264.75 K 2026-05-24 16:45:16,944 INFO - step #22 T -1783940.73 -1062963.72 -920977.00 200000.00 T= 14250.05 K 2026-05-24 16:45:17,010 INFO - step #23 R -1798762.23 -1063353.63 -935408.60 200000.00 T= 14235.34 K 2026-05-24 16:45:17,311 INFO - step #24 R -1881086.56 -1044593.57 -936492.99 100000.00 T= 14117.70 K 2026-05-24 16:45:17,375 INFO - step #25 R -1688610.58 -1059334.45 -929276.13 300000.00 T= 14103.00 K 2026-05-24 16:45:17,439 INFO - step #26 T -1698901.30 -1123977.91 -974923.39 400000.00 T= 14088.29 K 2026-05-24 16:45:17,845 INFO - step #27 T -1673619.06 -1011313.60 -862305.46 200000.00 T= 13970.65 K 2026-05-24 16:45:17,908 INFO - step #28 R -1674745.90 -1013083.28 -861662.62 200000.00 T= 13955.95 K 2026-05-24 16:45:17,971 INFO - step #29 R -1694555.47 -967286.87 -827268.61 100000.00 T= 13941.24 K 2026-05-24 16:45:18,036 INFO - step #30 T -1680234.03 -1044988.05 -935245.98 300000.00 T= 13926.54 K 2026-05-24 16:45:18,100 INFO - step #31 R -1852953.70 -1080276.57 -972677.13 200000.00 T= 13911.83 K 2026-05-24 16:45:18,197 INFO - step #32 R -1853348.37 -1080671.24 -972677.13 200000.00 T= 13882.42 K 2026-05-24 16:45:18,327 INFO - step #33 R -1841626.35 -1073647.63 -967978.72 200000.00 T= 13838.31 K 2026-05-24 16:45:18,426 INFO - step #34 R -1819648.78 -1062560.28 -957088.50 200000.00 T= 13808.90 K 2026-05-24 16:45:18,489 INFO - step #35 R -1840208.98 -1077303.69 -962905.28 200000.00 T= 13794.19 K 2026-05-24 16:45:18,765 INFO - step #36 R -1847528.85 -1083785.30 -963743.55 200000.00 T= 13691.26 K 2026-05-24 16:45:18,829 INFO - step #37 R -1708261.91 -1056444.48 -951817.43 300000.00 T= 13676.55 K 2026-05-24 16:45:18,966 INFO - step #38 R -1532183.01 -1026680.75 -905502.26 400000.00 T= 13632.44 K 2026-05-24 16:45:19,031 INFO - step #39 R -1747888.02 -1082214.39 -965673.63 300000.00 T= 13617.73 K 2026-05-24 16:45:19,129 INFO - step #40 T -1672462.60 -992331.97 -880130.63 200000.00 T= 13588.32 K 2026-05-24 16:45:19,414 INFO - step #41 T -1631169.32 -915192.97 -815976.36 100000.00 T= 13529.50 K 2026-05-24 16:45:19,475 INFO - step #42 R -1478612.29 -883446.76 -795165.53 200000.00 T= 13514.80 K 2026-05-24 16:45:19,539 INFO - step #43 R -1473738.24 -935932.52 -837805.72 300000.00 T= 13500.09 K 2026-05-24 16:45:19,602 INFO - step #44 R -1554506.17 -922729.41 -831776.75 200000.00 T= 13485.39 K 2026-05-24 16:45:19,731 INFO - step #45 T -1427151.38 -927833.77 -799317.61 300000.00 T= 13441.27 K 2026-05-24 16:45:19,792 INFO - step #46 R -1550732.44 -935027.27 -815705.17 200000.00 T= 13426.57 K 2026-05-24 16:45:19,856 INFO - step #47 R -1667298.87 -936690.59 -830608.27 100000.00 T= 13411.86 K 2026-05-24 16:45:19,921 INFO - step #48 R -1846618.01 -973673.37 -872944.64 0.00 T= 13397.16 K 2026-05-24 16:45:20,088 INFO - step #49 T -1847398.60 -973403.59 -873995.02 0.00 T= 13338.34 K 2026-05-24 16:45:20,152 INFO - step #50 R -1857184.05 -982818.86 -874365.19 0.00 T= 13323.63 K 2026-05-24 16:45:20,214 INFO - step #51 R -1891973.31 -1001808.02 -890165.29 0.00 T= 13308.93 K 2026-05-24 16:45:20,311 INFO - step #52 R -1868353.14 -986644.44 -881708.69 0.00 T= 13279.52 K 2026-05-24 16:45:20,509 INFO - step #53 T -1670296.89 -915198.75 -755098.14 0.00 T= 13205.99 K 2026-05-24 16:45:20,572 INFO - step #54 R -1673050.51 -964951.44 -808099.08 100000.00 T= 13191.29 K 2026-05-24 16:45:20,870 INFO - step #55 T -1683652.08 -952281.04 -831371.04 100000.00 T= 13147.17 K 2026-05-24 16:45:20,932 INFO - step #56 R -1659665.76 -938599.68 -821066.07 100000.00 T= 13132.47 K 2026-05-24 16:45:21,043 INFO - step #57 R -1663598.26 -944473.44 -819124.82 100000.00 T= 13103.06 K 2026-05-24 16:45:21,106 INFO - step #58 T -1900940.77 -1059211.53 -941729.24 100000.00 T= 13088.35 K 2026-05-24 16:45:21,168 INFO - step #59 R -1796831.67 -1055800.25 -941031.41 200000.00 T= 13073.65 K 2026-05-24 16:45:21,372 INFO - step #60 T -1785671.24 -1053453.99 -932217.25 200000.00 T= 13000.12 K 2026-05-24 16:45:21,472 INFO - step #61 R -1812757.62 -1057042.49 -955715.13 200000.00 T= 12970.71 K 2026-05-24 16:45:21,537 INFO - step #62 T -1718085.68 -1219985.36 -1098100.32 600000.00 T= 12956.01 K 2026-05-24 16:45:21,717 INFO - step #63 R -1714479.94 -1222026.24 -1092453.70 600000.00 T= 12897.19 K 2026-05-24 16:45:21,783 INFO - step #64 R -1732999.76 -1236342.11 -1096657.65 600000.00 T= 12882.48 K 2026-05-24 16:45:21,885 INFO - step #65 R -1742664.79 -1238557.24 -1104107.54 600000.00 T= 12853.07 K 2026-05-24 16:45:21,951 INFO - step #66 T -1920867.91 -1227617.26 -1093250.65 400000.00 T= 12838.37 K 2026-05-24 16:45:22,161 INFO - step #67 R -1947700.80 -1237272.81 -1110427.99 400000.00 T= 12764.84 K 2026-05-24 16:45:22,261 INFO - step #68 T -1917440.84 -1119161.23 -998279.62 200000.00 T= 12735.43 K 2026-05-24 16:45:22,363 INFO - step #69 T -1898430.99 -1159764.45 -1038666.55 300000.00 T= 12706.02 K 2026-05-24 16:45:22,462 INFO - step #70 R -2004033.66 -1172716.88 -1031316.78 200000.00 T= 12676.61 K 2026-05-24 16:45:22,834 INFO - step #71 R -2020842.66 -1174889.81 -1045952.85 200000.00 T= 12617.79 K 2026-05-24 16:45:22,935 INFO - step #72 R -1988161.55 -1158136.06 -1030025.49 200000.00 T= 12588.38 K 2026-05-24 16:45:23,002 INFO - step #73 R -1915183.09 -1167048.05 -1048135.04 300000.00 T= 12573.68 K 2026-05-24 16:45:23,253 INFO - step #74 R -1774414.44 -1149079.56 -1025334.88 400000.00 T= 12485.45 K 2026-05-24 16:45:23,318 INFO - step #75 R -1805236.21 -1158316.05 -1046920.16 400000.00 T= 12470.74 K 2026-05-24 16:45:23,600 INFO - step #76 T -1842190.95 -1185052.42 -1057138.53 400000.00 T= 12367.81 K 2026-05-24 16:45:23,847 INFO - step #77 R -1862670.09 -1131062.01 -1031608.08 300000.00 T= 12279.58 K 2026-05-24 16:45:24,022 INFO - step #78 R -1853598.37 -1127035.90 -1026562.47 300000.00 T= 12220.76 K 2026-05-24 16:45:24,229 INFO - step #79 R -1859237.14 -1128556.49 -1030680.64 300000.00 T= 12147.23 K 2026-05-24 16:45:24,368 INFO - step #80 R -1860992.29 -1129090.64 -1031901.65 300000.00 T= 12103.12 K 2026-05-24 16:45:24,504 INFO - step #81 T -1792644.84 -1099144.42 -993500.42 300000.00 T= 12059.00 K 2026-05-24 16:45:24,569 INFO - step #82 R -1810727.50 -1108047.61 -1002679.90 300000.00 T= 12044.30 K 2026-05-24 16:45:24,709 INFO - step #83 T -1563558.45 -1185977.50 -1077580.95 700000.00 T= 12000.18 K 2026-05-24 16:45:24,813 INFO - step #84 R -1843952.43 -1177536.17 -1066416.26 400000.00 T= 11970.77 K 2026-05-24 16:45:24,955 INFO - step #85 R -1846473.56 -1174362.85 -1072110.71 400000.00 T= 11926.66 K 2026-05-24 16:45:25,057 INFO - step #86 R -1836686.65 -1172858.78 -1063827.87 400000.00 T= 11897.25 K 2026-05-24 16:45:25,275 INFO - step #87 R -1852209.09 -1177562.00 -1074647.09 400000.00 T= 11823.72 K 2026-05-24 16:45:25,590 INFO - step #88 R -1892043.98 -1151011.85 -1041032.12 300000.00 T= 11809.02 K 2026-05-24 16:45:25,735 INFO - step #89 R -1917213.80 -1214452.71 -1102761.09 400000.00 T= 11764.90 K 2026-05-24 16:45:25,957 INFO - step #90 R -1914126.14 -1212448.15 -1101677.99 400000.00 T= 11691.38 K 2026-05-24 16:45:26,720 INFO - step #91 R -1816152.40 -1156577.72 -1059574.68 400000.00 T= 11397.28 K 2026-05-24 16:45:26,859 INFO - step #92 R -1897314.71 -1199392.05 -1097922.66 400000.00 T= 11353.16 K 2026-05-24 16:45:27,001 INFO - step #93 R -1892342.07 -1196228.50 -1096113.57 400000.00 T= 11309.05 K 2026-05-24 16:45:27,066 INFO - step #94 R -1900897.82 -1198577.96 -1102319.86 400000.00 T= 11294.34 K 2026-05-24 16:45:27,170 INFO - step #95 R -1864958.98 -1196151.20 -1068807.78 400000.00 T= 11264.93 K 2026-05-24 16:45:27,345 INFO - step #96 R -1889603.85 -1200672.75 -1088931.10 400000.00 T= 11206.11 K 2026-05-24 16:45:27,900 INFO - step #97 R -1888326.68 -1191931.29 -1096395.39 400000.00 T= 11000.24 K 2026-05-24 16:45:28,042 INFO - step #98 R -1927752.12 -1217530.97 -1110221.15 400000.00 T= 10956.13 K 2026-05-24 16:45:28,602 INFO - step #99 R -1859792.99 -1191598.59 -1068194.40 400000.00 T= 10750.26 K 2026-05-24 16:45:28,678 INFO - step #100 R -1869993.37 -1194490.19 -1075503.17 400000.00 T= 10735.55 K 2026-05-24 16:45:28,931 INFO - step #101 R -1864499.13 -1196124.61 -1068374.52 400000.00 T= 10647.32 K 2026-05-24 16:45:29,001 INFO - step #102 R -1866853.57 -1198479.05 -1068374.52 400000.00 T= 10632.62 K 2026-05-24 16:45:29,101 INFO - step #103 T -1905653.17 -1181351.73 -1024301.44 300000.00 T= 10603.21 K 2026-05-24 16:45:29,236 INFO - step #104 R -2046500.76 -1200505.37 -1045995.39 200000.00 T= 10559.09 K 2026-05-24 16:45:29,372 INFO - step #105 R -2052700.63 -1202754.73 -1049945.90 200000.00 T= 10514.98 K 2026-05-24 16:45:29,471 INFO - step #106 R -2033009.23 -1195696.21 -1037313.02 200000.00 T= 10485.57 K 2026-05-24 16:45:29,643 INFO - step #107 T -2039436.86 -1090725.09 -948711.78 0.00 T= 10426.75 K 2026-05-24 16:45:30,115 INFO - step #108 R -2038858.08 -1081088.25 -957769.83 0.00 T= 10367.93 K 2026-05-24 16:45:30,252 INFO - step #109 R -1955228.06 -1091301.82 -963926.24 100000.00 T= 10323.81 K 2026-05-24 16:45:30,386 INFO - step #110 R -2054618.16 -1078406.51 -976211.65 0.00 T= 10279.70 K 2026-05-24 16:45:31,170 INFO - step #111 R -2045117.86 -1069805.75 -975312.11 0.00 T= 9970.89 K 2026-05-24 16:45:31,236 INFO - step #112 R -2046265.59 -1069823.43 -976442.15 0.00 T= 9956.19 K 2026-05-24 16:45:31,480 INFO - step #113 R -2038564.48 -1067819.94 -970744.54 0.00 T= 9867.96 K 2026-05-24 16:45:31,864 INFO - step #114 R -2038169.81 -1067425.27 -970744.54 0.00 T= 9720.91 K 2026-05-24 16:45:32,276 INFO - step #115 R -2000841.81 -1055385.48 -945456.33 0.00 T= 9559.15 K 2026-05-24 16:45:32,444 INFO - step #116 R -2115728.27 -1132125.84 -983602.43 0.00 T= 9500.33 K 2026-05-24 16:45:32,684 INFO - step #117 R -2110930.05 -1133437.13 -977492.91 0.00 T= 9412.10 K 2026-05-24 16:45:32,748 INFO - step #118 R -2043284.13 -1088315.82 -954968.31 0.00 T= 9397.40 K 2026-05-24 16:45:32,845 INFO - step #119 R -2049229.77 -1091794.82 -957434.95 0.00 T= 9367.99 K 2026-05-24 16:45:32,908 INFO - step #120 R -2054598.14 -1094047.74 -960550.40 0.00 T= 9353.28 K 2026-05-24 16:45:33,333 INFO - step #121 R -2061230.91 -1089203.29 -972027.62 0.00 T= 9191.53 K 2026-05-24 16:45:33,469 INFO - step #122 T -2052301.12 -1095974.62 -956326.50 0.00 T= 9147.41 K 2026-05-24 16:45:33,744 INFO - step #123 R -1908172.38 -1061557.07 -946615.31 100000.00 T= 9044.48 K 2026-05-24 16:45:33,810 INFO - step #124 R -2035799.98 -1081775.21 -954024.78 0.00 T= 9029.77 K 2026-05-24 16:45:33,874 INFO - step #125 R -2037528.73 -1083503.95 -954024.78 0.00 T= 9015.07 K 2026-05-24 16:45:34,062 INFO - step #126 R -2084226.44 -1121922.79 -962303.65 0.00 T= 8956.25 K 2026-05-24 16:45:34,165 INFO - step #127 R -2022545.63 -1073283.23 -949262.40 0.00 T= 8926.84 K 2026-05-24 16:45:34,400 INFO - step #128 R -2027662.08 -1081559.98 -946102.10 0.00 T= 8838.61 K 2026-05-24 16:45:34,464 INFO - step #129 R -2016906.76 -1075143.86 -941762.90 0.00 T= 8823.90 K 2026-05-24 16:45:34,561 INFO - step #130 R -2031153.99 -1076385.05 -954768.94 0.00 T= 8794.49 K 2026-05-24 16:45:34,625 INFO - step #131 T -2000163.26 -1064078.94 -936084.32 0.00 T= 8779.79 K 2026-05-24 16:45:34,760 INFO - step #132 T -1831885.40 -980213.40 -851672.00 0.00 T= 8735.67 K 2026-05-24 16:45:35,193 INFO - step #133 R -1824117.37 -974156.11 -849961.26 0.00 T= 8720.97 K 2026-05-24 16:45:35,291 INFO - step #134 R -1895967.87 -1000539.75 -895428.12 0.00 T= 8691.56 K 2026-05-24 16:45:35,424 INFO - step #135 R -1895617.65 -1002162.22 -893455.43 0.00 T= 8647.44 K 2026-05-24 16:45:35,731 INFO - step #136 T -2018375.48 -1067550.33 -950825.16 0.00 T= 8529.80 K 2026-05-24 16:45:36,081 INFO - step #137 R -1976430.46 -1039153.09 -937277.37 0.00 T= 8397.46 K 2026-05-24 16:45:36,145 INFO - step #138 R -1968394.34 -1038553.14 -929841.20 0.00 T= 8382.75 K 2026-05-24 16:45:36,221 INFO - step #139 R -1969766.99 -1041102.50 -928664.48 0.00 T= 8368.05 K 2026-05-24 16:45:36,321 INFO - step #140 R -1949321.06 -1032111.19 -917209.86 0.00 T= 8338.64 K 2026-05-24 16:45:36,385 INFO - step #141 T -1905276.63 -1060993.99 -944282.65 100000.00 T= 8323.93 K 2026-05-24 16:45:36,735 INFO - step #142 R -1913762.24 -1068411.14 -945351.09 100000.00 T= 8191.59 K 2026-05-24 16:45:36,873 INFO - step #143 R -1871326.89 -1052703.07 -918623.83 100000.00 T= 8147.47 K 2026-05-24 16:45:36,975 INFO - step #144 R -1872832.28 -1131692.90 -941139.38 200000.00 T= 8118.06 K 2026-05-24 16:45:37,219 INFO - step #145 T -1864294.96 -1152559.17 -1011735.79 300000.00 T= 8029.83 K 2026-05-24 16:45:37,320 INFO - step #146 T -1802313.49 -1196371.37 -1005942.12 400000.00 T= 8000.42 K 2026-05-24 16:45:37,384 INFO - step #147 T -1808342.06 -1182458.62 -1025883.44 400000.00 T= 7985.72 K 2026-05-24 16:45:37,449 INFO - step #148 R -1708105.26 -1181471.38 -1026633.88 500000.00 T= 7971.01 K 2026-05-24 16:45:37,514 INFO - step #149 R -1716677.08 -1186366.53 -1030310.55 500000.00 T= 7956.31 K 2026-05-24 16:45:37,617 INFO - step #150 T -1894403.67 -1227183.30 -1067220.37 400000.00 T= 7926.90 K 2026-05-24 16:45:37,757 INFO - step #151 R -1823613.58 -1118699.50 -1004914.08 300000.00 T= 7882.78 K 2026-05-24 16:45:37,832 INFO - step #152 R -1815810.28 -1114018.45 -1001791.83 300000.00 T= 7868.08 K 2026-05-24 16:45:37,931 INFO - step #153 R -1832516.65 -1191439.73 -1041076.92 400000.00 T= 7838.67 K 2026-05-24 16:45:37,995 INFO - step #154 T -1857721.69 -1157527.62 -1000194.07 300000.00 T= 7823.96 K 2026-05-24 16:45:38,061 INFO - step #155 R -1724296.15 -1132166.20 -992129.95 400000.00 T= 7809.26 K 2026-05-24 16:45:38,127 INFO - step #156 R -1723020.21 -1131143.51 -991876.70 400000.00 T= 7794.55 K 2026-05-24 16:45:38,300 INFO - step #157 R -1972737.86 -1154275.94 -1018461.92 200000.00 T= 7735.73 K 2026-05-24 16:45:38,365 INFO - step #158 T -1863333.10 -1087881.89 -975451.22 200000.00 T= 7721.03 K 2026-05-24 16:45:38,572 INFO - step #159 T -1519935.03 -1005085.78 -914849.25 400000.00 T= 7647.50 K 2026-05-24 16:45:38,636 INFO - step #160 R -1522392.89 -997962.91 -924429.97 400000.00 T= 7632.80 K 2026-05-24 16:45:38,734 INFO - step #161 R -1513592.59 -998609.96 -914982.63 400000.00 T= 7603.39 K 2026-05-24 16:45:38,972 INFO - step #162 T -1707408.18 -1007276.70 -900131.48 200000.00 T= 7515.16 K 2026-05-24 16:45:39,042 INFO - step #163 R -1717772.84 -1009715.35 -908057.49 200000.00 T= 7500.45 K 2026-05-24 16:45:39,104 INFO - step #164 R -1688942.92 -988000.24 -900942.68 200000.00 T= 7485.75 K 2026-05-24 16:45:39,616 INFO - step #165 T -1895151.91 -1115080.70 -980071.22 200000.00 T= 7471.04 K 2026-05-24 16:45:39,681 INFO - step #166 R -1908080.09 -1116829.32 -991250.77 200000.00 T= 7456.34 K 2026-05-24 16:45:39,855 INFO - step #167 R -1908553.05 -1117442.91 -991110.14 200000.00 T= 7397.52 K 2026-05-24 16:45:39,960 INFO - step #168 T -1945957.69 -1136229.51 -1009728.18 200000.00 T= 7368.11 K 2026-05-24 16:45:40,247 INFO - step #169 R -1992956.12 -1161214.86 -1031741.26 200000.00 T= 7265.17 K 2026-05-24 16:45:40,500 INFO - step #170 R -1991348.53 -1159607.27 -1031741.26 200000.00 T= 7176.94 K 2026-05-24 16:45:40,996 INFO - step #171 R -1965243.87 -1144350.91 -1020892.97 200000.00 T= 6985.78 K 2026-05-24 16:45:41,063 INFO - step #172 R -1944400.61 -1140570.44 -1003830.17 200000.00 T= 6971.07 K 2026-05-24 16:45:41,235 INFO - step #173 T -2021935.71 -1069959.42 -951976.29 0.00 T= 6912.25 K 2026-05-24 16:45:41,478 INFO - step #174 R -1743677.13 -1030765.90 -912911.23 200000.00 T= 6824.02 K 2026-05-24 16:45:41,543 INFO - step #175 R -1892007.62 -1051676.83 -940330.79 100000.00 T= 6809.32 K 2026-05-24 16:45:41,646 INFO - step #176 R -2010223.74 -1068643.71 -941580.02 0.00 T= 6779.91 K 2026-05-24 16:45:41,744 INFO - step #177 R -2023402.70 -1075691.89 -947710.81 0.00 T= 6750.50 K 2026-05-24 16:45:41,809 INFO - step #178 R -2037533.15 -1076885.75 -960647.40 0.00 T= 6735.79 K 2026-05-24 16:45:41,980 INFO - step #179 R -2018399.45 -1066208.41 -952191.03 0.00 T= 6676.97 K 2026-05-24 16:45:42,115 INFO - step #180 R -2030297.68 -1071269.95 -959027.73 0.00 T= 6632.86 K 2026-05-24 16:45:42,252 INFO - step #181 R -1983008.99 -1056643.77 -926365.22 0.00 T= 6588.74 K 2026-05-24 16:45:42,803 INFO - step #182 R -1991789.96 -1056177.56 -935612.39 0.00 T= 6368.17 K 2026-05-24 16:45:42,936 INFO - step #183 R -1955799.30 -1049936.40 -905862.90 0.00 T= 6324.05 K 2026-05-24 16:45:43,248 INFO - step #184 T -1850613.78 -1110564.80 -940048.98 200000.00 T= 6206.41 K 2026-05-24 16:45:43,313 INFO - step #185 T -1861827.79 -1153699.42 -1008128.37 300000.00 T= 6191.71 K 2026-05-24 16:45:43,413 INFO - step #186 T -1991753.02 -1232504.81 -1059248.21 300000.00 T= 6162.30 K 2026-05-24 16:45:43,513 INFO - step #187 T -1999452.04 -1172266.36 -1027185.68 200000.00 T= 6132.89 K 2026-05-24 16:45:43,576 INFO - step #188 T -2051343.23 -1092410.66 -958932.57 0.00 T= 6118.18 K 2026-05-24 16:45:44,533 INFO - step #189 T -2001079.26 -1235526.04 -1065553.22 300000.00 T= 5735.85 K 2026-05-24 16:45:44,677 INFO - step #190 R -1959524.04 -1222355.53 -1037168.51 300000.00 T= 5691.74 K 2026-05-24 16:45:44,742 INFO - step #191 R -1882170.41 -1226447.09 -1055723.31 400000.00 T= 5677.03 K 2026-05-24 16:45:44,919 INFO - step #192 R -1877926.27 -1224402.21 -1053524.06 400000.00 T= 5618.21 K 2026-05-24 16:45:45,172 INFO - step #193 R -1880049.94 -1225402.50 -1054647.44 400000.00 T= 5529.98 K 2026-05-24 16:45:45,678 INFO - step #194 R -1890007.41 -1233478.28 -1056529.13 400000.00 T= 5338.82 K 2026-05-24 16:45:45,779 INFO - step #195 T -1983985.18 -1158166.23 -1025818.95 200000.00 T= 5309.41 K 2026-05-24 16:45:45,918 INFO - step #196 R -2000997.77 -1178484.14 -1022513.62 200000.00 T= 5265.29 K 2026-05-24 16:45:45,981 INFO - step #197 R -1992748.10 -1159380.43 -1033367.67 200000.00 T= 5250.59 K 2026-05-24 16:45:46,085 INFO - step #198 R -1985188.80 -1159748.56 -1025440.24 200000.00 T= 5221.18 K 2026-05-24 16:45:46,151 INFO - step #199 R -1993813.90 -1164203.54 -1029610.36 200000.00 T= 5206.47 K 2026-05-24 16:45:46,216 INFO - step #200 R -1992254.25 -1164177.60 -1028076.65 200000.00 T= 5191.77 K 2026-05-24 16:45:47,373 INFO - step #201 R -2027865.35 -1252488.16 -1075377.19 300000.00 T= 5177.06 K 2026-05-24 16:45:48,239 INFO - step #202 T -1887964.98 -1160571.31 -1027393.67 300000.00 T= 5088.83 K 2026-05-24 16:45:48,306 INFO - step #203 T -1995648.31 -1053867.85 -941780.46 0.00 T= 5074.13 K 2026-05-24 16:45:48,406 INFO - step #204 R -1990819.56 -1052822.62 -937996.94 0.00 T= 5044.72 K 2026-05-24 16:45:48,468 INFO - step #205 R -2007056.46 -1068031.88 -939024.58 0.00 T= 5030.01 K 2026-05-24 16:45:48,534 INFO - step #206 R -2004349.17 -1060320.71 -944028.47 0.00 T= 5015.31 K 2026-05-24 16:45:48,877 INFO - step #207 R -2007056.46 -1068031.88 -939024.58 0.00 T= 4882.96 K 2026-05-24 16:45:49,015 INFO - step #208 R -2005661.80 -1062656.41 -943005.39 0.00 T= 4838.85 K 2026-05-24 16:45:49,081 INFO - step #209 R -1986725.02 -1050264.31 -936460.72 0.00 T= 4824.14 K 2026-05-24 16:45:49,321 INFO - step #210 R -1968341.97 -1041585.18 -926756.79 0.00 T= 4735.91 K 2026-05-24 16:45:49,431 INFO - step #211 R -1996995.66 -1062643.63 -934352.03 0.00 T= 4706.50 K 2026-05-24 16:45:49,533 INFO - step #212 R -1946133.33 -1031256.38 -914876.96 0.00 T= 4677.09 K 2026-05-24 16:45:49,880 INFO - step #213 R -1936760.41 -1021970.36 -914790.05 0.00 T= 4544.75 K 2026-05-24 16:45:49,981 INFO - step #214 R -1944368.63 -1029914.43 -914454.20 0.00 T= 4515.34 K 2026-05-24 16:45:50,045 INFO - step #215 R -1938182.17 -1018044.72 -920137.45 0.00 T= 4500.63 K 2026-05-24 16:45:50,180 INFO - step #216 R -1943470.96 -1028589.15 -914881.81 0.00 T= 4456.52 K 2026-05-24 16:45:50,451 INFO - step #217 R -1936291.24 -1022213.98 -914077.26 0.00 T= 4353.58 K 2026-05-24 16:45:50,547 INFO - step #218 R -1969715.77 -1036970.09 -932745.67 0.00 T= 4324.17 K 2026-05-24 16:45:50,683 INFO - step #219 R -1955750.06 -1035721.99 -920028.07 0.00 T= 4280.06 K 2026-05-24 16:45:50,750 INFO - step #220 R -1967670.55 -1030879.70 -936790.85 0.00 T= 4265.35 K 2026-05-24 16:45:51,081 INFO - step #221 R -1974269.62 -1037277.82 -936991.80 0.00 T= 4147.71 K 2026-05-24 16:45:51,283 INFO - step #222 R -1971094.71 -1040913.51 -930181.20 0.00 T= 4074.19 K 2026-05-24 16:45:51,696 INFO - step #223 R -1991411.31 -1051813.64 -939597.67 0.00 T= 3912.43 K 2026-05-24 16:45:51,865 INFO - step #224 R -1997870.72 -1054427.57 -943443.15 0.00 T= 3853.61 K 2026-05-24 16:45:52,247 INFO - step #225 R -1980863.55 -1048350.89 -932512.66 0.00 T= 3706.56 K 2026-05-24 16:45:52,516 INFO - step #226 R -1971311.86 -1040263.71 -931048.14 0.00 T= 3603.63 K 2026-05-24 16:45:53,015 INFO - step #227 R -1997531.86 -1055126.55 -942405.31 0.00 T= 3412.46 K 2026-05-24 16:45:53,080 INFO - step #228 R -1994032.27 -1051846.89 -942185.38 0.00 T= 3397.76 K 2026-05-24 16:45:53,227 INFO - step #229 R -2012093.28 -1065274.89 -946818.39 0.00 T= 3353.64 K 2026-05-24 16:45:53,418 INFO - step #230 T -2079890.30 -1142454.43 -1037435.87 100000.00 T= 3294.82 K 2026-05-24 16:45:53,483 INFO - step #231 R -2082730.85 -1140060.50 -1042670.35 100000.00 T= 3280.12 K 2026-05-24 16:45:53,725 INFO - step #232 R -2109810.22 -1153076.78 -1056733.44 100000.00 T= 3191.89 K 2026-05-24 16:45:55,875 INFO - step #233 T -2106190.25 -1159555.81 -1046634.44 100000.00 T= 2324.29 K 2026-05-24 16:45:57,357 INFO - step #234 R -2106190.25 -1159555.81 -1046634.44 100000.00 T= 1736.09 K 2026-05-24 16:45:58,146 INFO - step #235 R -2113816.90 -1162987.30 -1050829.61 100000.00 T= 1427.29 K 2026-05-24 16:46:01,119 INFO - save long traj 2026-05-24 16:46:01,155 INFO - save best.pdb 2026-05-24 16:46:01,177 INFO - save plot e_step.png 2026-05-24 16:46:01,602 INFO - done