id,foldx_SAEM,Tmax_SAEM,Cmax_SAEM,alpha_SAEM,FB_SAEM,beta_SAEM,Ftoci_SAEM,Fster_SAEM,foldx_mean,Tmax_mean,Cmax_mean,alpha_mean,FB_mean,beta_mean,Ftoci_mean,Fster_mean,foldx_sd,Tmax_sd,Cmax_sd,alpha_sd,FB_sd,beta_sd,Ftoci_sd,Fster_sd,STERSTT,TOCI1T,STERST_comed,TOCI1_comed
1,1.85554e+07,10.4661,1.31221e+06,0.192471,0.00594609,0.00448795,1.28144,0.963942,3.79051e+07,10.4884,1.16094e+06,0.178999,0.00869771,0.00592462,1.26715,0.964232,3.42283e+08,0.587279,885990,0.164084,0.00634706,0.00575465,0,0,9.587,10.485,1,1
2,242168,5.94629,30535,0.787725,0.00744149,0.00652776,1.28144,0.963942,125407,5.58469,23734.3,0.562535,0.00754894,0.00534718,1.26715,0.964232,742550,1.09427,8666.99,0.340282,0.0037205,0.00512182,0,0,0.108,1.82,1,1
3,53690.1,13.5764,347418,0.124659,0.00686012,0.00476134,1.28144,0.963942,57256,13.0423,274476,0.0976734,0.00791476,0.00466569,1.26715,0.964232,70512.2,0.92135,130585,0.0418262,0.00492954,0.0051279,0,0,9999,5.474,0,1
4,12435.8,11.1513,335510,0.145154,0.0110533,0.00413303,1.28144,0.963942,9929.94,11.2727,326900,0.158991,0.00962403,0.00391467,1.26715,0.964232,7882.21,0.814073,121851,0.0873434,0.00551584,0.00333026,0,0,9999,9999,0,0
5,102757,5.91242,325838,0.413374,0.0036235,0.00457458,1.28144,0.963942,173344,5.82545,320706,0.391843,0.00398049,0.00584095,1.26715,0.964232,577770,0.571446,104177,0.0837154,0.00193908,0.00535626,0,0,87.466,9999,1,0
6,1.02792e+06,8.33729,91851.6,0.190088,0.00773909,0.00671649,1.28144,0.963942,3.51504e+06,8.70435,120650,0.235274,0.00874954,0.00678783,1.26715,0.964232,2.05229e+07,0.948916,69844.2,0.106763,0.00586082,0.00800326,0,0,9999,9999,0,0
7,86413.5,13.2257,181589,0.120054,0.0038995,0.0227571,1.28144,0.963942,60360.3,13.001,153529,0.114056,0.00336693,0.0150908,1.26715,0.964232,105872,0.707423,62506,0.014159,0.00323865,0.0146809,0,0,9999,9999,0,0
8,100299,4.86405,314537,0.0631051,0.00697704,0.0103204,1.28144,0.963942,461498,4.80173,335885,0.0707298,0.00808113,0.00534575,1.26715,0.964232,2.06486e+06,0.574059,80282.8,0.0312365,0.0070335,0.00577627,0,0,9.531,9.017,1,1
9,40093.3,12.8369,233478,0.104087,0.00452535,0.00759386,1.28144,0.963942,49931.8,12.3975,212265,0.0950752,0.00495173,0.00747807,1.26715,0.964232,291467,1.94809,98971.6,0.0245803,0.0031701,0.0100259,0,0,9999,9999,0,0
10,156360,9.57902,105234,0.041093,0.00815803,0.00547892,1.28144,0.963942,132153,9.73582,101984,0.039932,0.00990645,0.00555508,1.26715,0.964232,405111,1.13405,36345.3,0.0148131,0.00880663,0.00501752,0,0,9999,9999,0,0
11,40003.4,12.9801,705951,0.130971,0.00485465,0.00499228,1.28144,0.963942,49017.9,12.9803,741795,0.140808,0.00558248,0.00533276,1.26715,0.964232,90649.9,1.01387,378603,0.0458989,0.00367014,0.00524701,0,0,9999,9999,0,0
12,9.19941e+08,10.4179,1.28647e+07,0.0277214,0.00822709,0.00584798,1.28144,0.963942,7.17629e+08,10.4834,1.47466e+07,0.0329807,0.0102843,0.00424777,1.26715,0.964232,9.2252e+08,0.318989,6.27187e+06,0.02872,0.0113291,0.0045155,0,0,5.532,5.105,1,1
13,18703.5,7.84133,162213,0.107183,0.00670815,0.00739347,1.28144,0.963942,13381.5,7.77091,130264,0.0905394,0.00560662,0.00498242,1.26715,0.964232,8702.99,0.437729,34521.3,0.0224357,0.0032556,0.00346719,0,0,4.458,4.038,1,1
14,7.6216e+06,8.21652,86112.3,0.594215,0.00959319,0.00452962,1.28144,0.963942,6.02374e+06,7.23657,152711,0.537196,0.00665165,0.00432096,1.26715,0.964232,4.05873e+07,1.66359,97510.6,0.232833,0.00383094,0.00415961,0,0,8.41,6.92,1,1
15,350832,6.70607,7.79619e+06,0.258272,0.0252184,0.00235783,1.28144,0.963942,406843,6.94919,8.0768e+06,0.307066,0.0307269,0.00302426,1.26715,0.964232,1.54706e+06,0.998921,3.44226e+06,0.1098,0.0134044,0.00230819,0,0,9999,9999,0,0
16,2.82079e+06,12.7769,784948,0.0382861,0.00791978,0.00703315,1.28144,0.963942,2.16744e+06,13.3099,1.0151e+06,0.049129,0.0082391,0.00611727,1.26715,0.964232,5.76736e+06,1.36863,619913,0.0307261,0.00621412,0.00684694,0,0,9999,9999,0,0
17,1.88301e+06,7.34055,261914,0.359303,0.00745723,0.00544483,1.28144,0.963942,134747,7.35441,220262,0.301129,0.00873219,0.00413182,1.26715,0.964232,285218,1.04724,113779,0.102199,0.00570689,0.00395019,0,0,9999,9999,0,0
18,1245.48,10.3906,225654,0.476127,0.00742829,0.00807463,1.28144,0.963942,744.518,9.90919,158953,0.331224,0.00948561,0.00593056,1.26715,0.964232,711.6,0.793727,66761,0.136704,0.00463541,0.00535944,0,0,9999,8.494,0,1
19,171696,7.31613,97717.9,0.20017,0.0035368,0.00495002,1.28144,0.963942,773072,7.22363,111787,0.225323,0.0039221,0.00655772,1.26715,0.964232,2.4039e+06,0.734893,31257.4,0.0372039,0.00176283,0.00591163,0,0,9999,9999,0,0
20,92295.4,5.23955,44969.2,0.433232,0.00627934,0.00498557,1.28144,0.963942,70720.9,4.96461,43751.4,0.412788,0.00896785,0.00664074,1.26715,0.964232,110775,0.592906,18196.9,0.1299,0.00439877,0.00195218,0,0,9999,9999,0,0
21,632486,7.08269,197400,0.109947,0.0027201,0.00274056,1.28144,0.963942,7.83307e+06,6.90825,178557,0.101426,0.00327113,0.00299155,1.26715,0.964232,7.52381e+07,0.632792,48349.6,0.0150286,0.00112567,0.00141086,0,0,9999,9999,0,0
22,1917.13,16.2021,225560,0.349827,0.0100566,0.00488736,1.28144,0.963942,2418.65,15.2993,195083,0.360349,0.0127677,0.00524808,1.26715,0.964232,2962.78,1.99676,119944,0.241216,0.00643427,0.00457491,0,0,9999,9999,0,0
23,178154,12.925,253901,0.420121,0.00718745,0.00391585,1.28144,0.963942,166648,12.9129,273293,0.418105,0.00732457,0.00454829,1.26715,0.964232,223145,0.754714,145077,0.130206,0.00423647,0.00473924,0,0,9999,9999,0,0
24,160075,16.4721,453105,0.201712,0.00866508,0.00705929,1.28144,0.963942,85874.5,14.2475,171754,0.212993,0.00734986,0.00543642,1.26715,0.964232,144204,2.12653,209932,0.15732,0.00476056,0.00673946,0,0,7.452,6.294,1,1
25,90503.1,7.20735,508709,0.166916,0.00319122,0.0104038,1.28144,0.963942,4521.56,7.54807,466112,0.159862,0.0035614,0.00985967,1.26715,0.964232,12239.1,1.4973,166607,0.0334962,0.00343088,0.0121215,0,0,9999,9999,0,0
26,1.88867e+07,16.2037,6.42286e+06,0.0302561,0.00963533,0.00391251,1.28144,0.963942,2.4622e+07,15.9653,5.89265e+06,0.0259323,0.00831532,0.00547255,1.26715,0.964232,2.39551e+07,0.67601,1.81951e+06,0.00888596,0.00696585,0.0071499,0,0,9999,6.824,0,1
27,756636,11.595,378717,0.070418,0.00638884,0.00586129,1.28144,0.963942,648213,12.1491,510360,0.0810549,0.00593335,0.00486916,1.26715,0.964232,1.49724e+06,0.886604,189611,0.0174858,0.00396643,0.00457107,0,0,9999,9999,0,0
28,514061,11.2281,54726.1,0.208391,0.0100241,0.00547022,1.28144,0.963942,451409,11.247,57879.6,0.212249,0.00984596,0.00468157,1.26715,0.964232,1.88892e+06,0.706273,23877,0.0724036,0.00591271,0.00373818,0,0,9999,10.849,0,1
29,34505,10.0124,73330,0.169371,0.00651683,0.00447878,1.28144,0.963942,40545.9,10.1348,82513.1,0.184612,0.00889811,0.00501012,1.26715,0.964232,62093.9,1.85951,53600.7,0.085366,0.00836839,0.00487168,0,0,9999,9999,0,0
30,5.10519e+06,5.27147,24693.3,0.112468,0.0100851,0.0105964,1.28144,0.963942,643151,5.40512,23474.5,0.107269,0.00787128,0.00676965,1.26715,0.964232,1.94102e+06,0.791538,8500.74,0.0385523,0.00476475,0.0040621,0,0,9999,9999,0,0
31,378307,9.83077,46632.9,0.283955,0.00478614,0.0341033,1.28144,0.963942,257111,9.90111,49253.6,0.298289,0.0054911,0.0231533,1.26715,0.964232,495907,0.532268,13596.1,0.0612655,0.0036539,0.0160764,0,0,142.563,5.063,1,1
32,3.8869e+06,5.81328,97725.3,0.0826939,0.00583456,0.027168,1.28144,0.963942,8.89425e+06,5.76195,90939.1,0.0870274,0.00397981,0.0194286,1.26715,0.964232,1.06129e+08,1.09261,25190.8,0.022654,0.00340842,0.0144353,0,0,9999,6.408,0,1
33,2.19491e+06,9.82154,269943,0.347304,0.00306025,0.00812048,1.28144,0.963942,698441,10.1285,233470,0.344007,0.00322723,0.00744849,1.26715,0.964232,2.42556e+06,1.15057,109407,0.0547418,0.00155809,0.00733951,0,0,30.538,16.913,1,1
34,1.58386e+06,18.4106,186302,0.295075,0.00893532,0.00303252,1.28144,0.963942,1.08279e+06,18.9523,223571,0.330064,0.00837518,0.00287422,1.26715,0.964232,2.36189e+06,1.21086,122162,0.141999,0.00417784,0.00190271,0,0,3.527,3.038,1,1
35,159623,9.22914,110428,0.380825,0.00519402,0.00419464,1.28144,0.963942,998086,8.93974,106977,0.362962,0.00544234,0.00501004,1.26715,0.964232,4.56395e+06,1.14144,40772.9,0.0739277,0.00261814,0.0040828,0,0,9999,9999,0,0
36,553.765,8.03377,78905.7,0.386272,0.00489957,0.00445987,1.28144,0.963942,874.464,7.77095,66253.1,0.406662,0.00597182,0.00627562,1.26715,0.964232,1386.24,1.12324,37688.1,0.176662,0.00452171,0.00603,0,0,4.573,3.945,1,1
37,61505,10.0825,347279,0.138963,0.00713483,0.00425798,1.28144,0.963942,52970.4,9.78453,242916,0.112167,0.0099418,0.00436818,1.26715,0.964232,63433.8,0.543639,104635,0.0465389,0.00629624,0.00310586,0,0,9999,9999,0,0
38,2.35977e+06,7.37215,430843,0.254133,0.00551946,0.00535488,1.28144,0.963942,767521,7.33071,352267,0.222691,0.006294,0.00570968,1.26715,0.964232,2.63744e+06,0.607804,185832,0.0632821,0.00330718,0.00484725,0,0,9999,9999,0,0
39,2.37889e+06,6.19873,243028,0.092228,0.00859648,0.00469206,1.28144,0.963942,2.01857e+06,6.07533,246547,0.0941242,0.00972329,0.00467331,1.26715,0.964232,8.80302e+06,1.10145,80302.3,0.0314575,0.00618006,0.00608406,0,0,10.535,9.447,1,1
40,331025,12.2806,143129,0.379673,0.00590014,0.00327274,1.28144,0.963942,407954,12.2233,114517,0.362004,0.0063393,0.00386505,1.26715,0.964232,979855,1.13419,76149.2,0.13253,0.0036559,0.00265382,0,0,9999,9999,0,0
41,67146.2,7.18646,270721,0.11859,0.0081879,0.00473263,1.28144,0.963942,28661,7.66085,308959,0.134666,0.00944928,0.00389622,1.26715,0.964232,63036.3,0.708437,146429,0.0469932,0.00554813,0.00410675,0,0,9999,9999,0,0
42,1.50364e+06,7.73801,203708,0.0803148,0.00925692,0.00666865,1.28144,0.963942,2.10487e+06,8.11067,195147,0.0776573,0.00886656,0.00573449,1.26715,0.964232,6.90235e+06,2.10191,82496.2,0.0291605,0.00696388,0.00585838,0,0,9999,23.109,0,1
43,561668,7.33141,477738,0.331341,0.00823337,0.00570142,1.28144,0.963942,1.9365e+06,6.99431,445030,0.291526,0.00755421,0.00389944,1.26715,0.964232,4.94113e+06,0.368736,156940,0.0683147,0.00415919,0.00267003,0,0,9999,9999,0,0
44,4649.16,9.93586,130564,0.151872,0.0129891,0.00627485,1.28144,0.963942,6059.03,9.06387,111910,0.11996,0.0113498,0.00469143,1.26715,0.964232,22211.7,1.2971,55658.6,0.0693039,0.00606501,0.0032626,0,0,9999,9999,0,0
45,68004,13.5125,165106,0.0722993,0.00732591,0.00642803,1.28144,0.963942,79142,13.9438,211304,0.0881742,0.00844107,0.00442901,1.26715,0.964232,70915.8,1.2234,108817,0.0429881,0.00459539,0.00500102,0,0,9999,9999,0,0
46,1.15597e+06,22.8055,195368,0.185234,0.00848333,0.00650804,1.28144,0.963942,1.27148e+06,23.0152,243948,0.215796,0.008866,0.00555396,1.26715,0.964232,1.53537e+06,1.31186,159817,0.184164,0.00718634,0.00517681,0,0,4.539,3.994,1,1
47,2.44118e+06,9.39409,242269,0.168962,0.00583951,0.00453495,1.28144,0.963942,3.06666e+06,9.67177,269875,0.178989,0.0072525,0.00552101,1.26715,0.964232,1.29933e+07,1.28583,105238,0.0484125,0.00474411,0.00679917,0,0,9999,9999,0,0
48,2855.57,15.705,608808,0.181019,0.00897213,0.0038517,1.28144,0.963942,1577.17,15.1209,411321,0.131771,0.0110428,0.0038458,1.26715,0.964232,1614.7,1.66116,256041,0.0778114,0.00680209,0.00281192,0,0,9999,9999,0,0
49,211865,9.85095,1.09054e+06,0.216846,0.00850753,0.00357431,1.28144,0.963942,202584,9.9133,1.04522e+06,0.226365,0.00933365,0.00420423,1.26715,0.964232,183363,0.507721,369667,0.0563019,0.00383228,0.002768,0,0,9999,9999,0,0
50,1.16465e+06,6.75289,221711,0.216573,0.0133591,0.00304403,1.28144,0.963942,598880,6.77213,305051,0.284499,0.014301,0.00462154,1.26715,0.964232,2.58185e+06,1.4857,186926,0.140854,0.00668345,0.00371557,0,0,9999,9999,0,0
51,1.01778e+07,11.7076,94501.1,0.470205,0.00658265,0.00751144,1.28144,0.963942,3.28217e+06,11.9482,126179,0.506159,0.0051015,0.00661907,1.26715,0.964232,8.00695e+06,1.07736,57128.8,0.214341,0.00283801,0.00330551,0,0,174.569,9999,1,0
52,336636,6.02728,68192.8,0.0756901,0.0115384,0.00307811,1.28144,0.963942,344072,5.98798,66034.4,0.0722512,0.0117815,0.00287025,1.26715,0.964232,1.16755e+06,0.594115,16484.1,0.0190138,0.0058565,0.00181104,0,0,13.53,4.981,1,1
53,324611,12.0336,1.72807e+06,0.142892,0.0106948,0.00454707,1.28144,0.963942,192540,12.3623,1.76624e+06,0.210722,0.0177371,0.00317366,1.26715,0.964232,179075,0.998185,854456,0.307541,0.0134972,0.00238202,0,0,6.535,5.621,1,1
54,74385.4,6.08341,97737.9,0.0639404,0.00839118,0.00281761,1.28144,0.963942,66682.8,5.90324,85534.1,0.0485884,0.00756823,0.00339048,1.26715,0.964232,260578,0.58031,27686.1,0.0189635,0.00381968,0.00246848,0,0,9999,9999,0,0
55,91508.6,11.017,611488,0.111057,0.00565652,0.00736242,1.28144,0.963942,98059.9,11.4453,843826,0.121867,0.00458467,0.00602003,1.26715,0.964232,79052.3,0.895015,333244,0.0459555,0.00238956,0.00384324,0,0,5.517,1.028,1,1
56,453483,9.04284,78395.4,0.064957,0.00680154,0.00618225,1.28144,0.963942,361017,9.4718,93034.5,0.0682184,0.0105437,0.0052005,1.26715,0.964232,407683,0.916064,30211.8,0.0311034,0.00907531,0.0045628,0,0,9999,4.224,0,1
57,7.97517e+06,7.27363,1.60313e+06,0.0829106,0.00825265,0.00533918,1.28144,0.963942,9.63209e+06,7.45212,1.96595e+06,0.10473,0.00890995,0.00557232,1.26715,0.964232,6.10961e+07,0.390902,833630,0.0441172,0.00777017,0.00582029,0,0,9999,9999,0,0
58,5090.9,10.7524,516764,0.49503,0.00546211,0.00766445,1.28144,0.963942,8285.53,10.5393,551931,0.482124,0.0058777,0.00500628,1.26715,0.964232,11299.3,0.675167,218862,0.164427,0.00291483,0.00668908,0,0,9999,5.351,0,1
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