Wednesday, September 25 2024 03:39:51
UNRES
4.51s
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CTEST_FULL_OUTPUT ishiftca= 1 ilastca= 76 init_dfa_vars finished! ishiftca= 1 ilastca= 76 init_dfa_vars finished! read_dfa_info finished! T 22707984 1 T 22707984 4 T 22707984 6 T 22707984 19 T 22707984 23 T 22707984 24 T 22707984 29 T 22707984 33 T 22707984 34 T 22707984 37 T 22707984 38 T 22707984 39 T 22707984 44 T 22707984 55 T 22707984 74 T 22707984 77 T 22707984 84 T 22707984 85 T 22707984 86 T 22707984 87 T 22707984 90 T 22707984 98 T 22707984 102 T 22707984 104 T 22707984 109 T 22707984 115 T 22707984 126 T 22707984 127 T 22707984 131 T 22707984 132 T 22707984 136 T 22707984 140 T 22707984 149 T 22707984 158 T 22707984 160 T 22707984 168 T 22707984 172 T 22707984 175 T 22707984 177 T 22707984 180 T 22707984 182 T 22707984 185 T 22707984 195 T 22707984 197 T 22707984 198 T 22707984 200 T 22707984 204 T 22707984 209 T 22707984 210 T 22707984 213 T 22707984 214 T 22707984 216 T 22707984 217 T 22707984 221 T 22707984 224 T 22707984 234 T 22707984 235 T 22707984 239 T 22707984 251 T 22707984 253 T 22707984 255 T 22707984 2 T 22707984 3 T 22707984 11 T 22707984 13 T 22707984 15 T 22707984 16 T 22707984 17 T 22707984 25 T 22707984 30 T 22707984 42 T 22707984 62 T 22707984 63 T 22707984 65 T 22707984 73 T 22707984 75 T 22707984 80 T 22707984 93 T 22707984 96 T 22707984 119 T 22707984 120 T 22707984 123 T 22707984 128 T 22707984 129 T 22707984 130 T 22707984 133 T 22707984 135 T 22707984 137 T 22707984 138 T 22707984 143 T 22707984 151 T 22707984 154 T 22707984 155 T 22707984 156 T 22707984 157 T 22707984 159 T 22707984 162 T 22707984 163 T 22707984 164 T 22707984 167 T 22707984 169 T 22707984 181 T 22707984 183 T 22707984 184 T 22707984 188 T 22707984 190 T 22707984 191 T 22707984 196 T 22707984 199 T 22707984 201 T 22707984 202 T 22707984 205 T 22707984 207 T 22707984 211 T 22707984 215 T 22707984 220 T 22707984 222 T 22707984 223 T 22707984 225 T 22707984 230 T 22707984 236 T 22707984 238 T 22707984 240 T 22707984 241 T 22707984 242 T 22707984 246 T 22707984 249 T 22707984 256 T 22707984 258 T 22707984 7 T 22707984 8 T 22707984 9 T 22707984 18 T 22707984 20 T 22707984 22 T 22707984 27 T 22707984 41 T 22707984 45 T 22707984 49 T 22707984 50 T 22707984 52 T 22707984 57 T 22707984 58 T 22707984 59 T 22707984 60 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 22707984 67 T 22707984 69 T 22707984 91 T 22707984 94 T 22707984 95 T 22707984 101 T 22707984 103 T 22707984 107 T 22707984 110 T 22707984 113 T 22707984 114 T 22707984 118 T 22707984 122 T 22707984 142 T 22707984 147 T 22707984 150 T 22707984 152 T 22707984 153 T 22707984 161 T 22707984 166 T 22707984 171 T 22707984 173 T 22707984 174 T 22707984 194 T 22707984 212 T 22707984 218 T 22707984 227 T 22707984 228 T 22707984 233 T 22707984 252 T 22707984 5 T 22707984 12 T 22707984 28 T 22707984 35 T 22707984 36 T 22707984 47 T 22707984 51 T 22707984 56 T 22707984 61 T 22707984 64 T 22707984 66 T 22707984 68 T 22707984 72 T 22707984 76 T 22707984 78 T 22707984 79 T 22707984 81 T 22707984 83 T 22707984 89 T 22707984 92 T 22707984 97 T 22707984 99 T 22707984 105 T 22707984 106 T 22707984 108 T 22707984 111 T 22707984 112 T 22707984 116 T 22707984 117 T 22707984 121 T 22707984 124 T 22707984 125 T 22707984 134 T 22707984 144 T 22707984 145 T 22707984 146 T 22707984 170 T 22707984 176 T 22707984 178 T 22707984 179 T 22707984 186 T 22707984 187 T 22707984 189 T 22707984 192 T 22707984 203 T 22707984 206 T 22707984 229 T 22707984 232 T 22707984 237 T 22707984 243 T 22707984 244 T 22707984 245 T 22707984 248 T 22707984 257 T 22707984 10 T 22707984 14 T 22707984 21 T 22707984 26 T 22707984 31 T 22707984 32 T 22707984 40 T 22707984 43 T 22707984 46 T 22707984 48 T 22707984 53 T 22707984 54 T 22707984 70 T 22707984 71 T 22707984 82 T 22707984 88 T 22707984 100 T 22707984 139 T 22707984 141 T 22707984 148 T 22707984 165 T 22707984 193 T 22707984 208 T 22707984 219 T 22707984 226 T 22707984 231 T 22707984 247 T 22707984 250 T 22707984 254 THERE ARE 5 FAMILIES OF CONFORMATIONS dfa_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY -5.27237E+02 AVE RMSD 0.00 dfa_wham_T280K_0001.pdb:REMARK clustering ENERGY -5.25449E+02 RMS 0.00 dfa_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY -5.27201E+02 AVE RMSD 0.00 dfa_wham_T280K_0002.pdb:REMARK clustering ENERGY -5.25448E+02 RMS 0.00 dfa_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY -5.27199E+02 AVE RMSD 0.00 dfa_wham_T280K_0003.pdb:REMARK clustering ENERGY -5.25446E+02 RMS 0.00 dfa_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY -5.27195E+02 AVE RMSD 0.00 dfa_wham_T280K_0004.pdb:REMARK clustering ENERGY -5.25447E+02 RMS 0.00 dfa_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY -5.26973E+02 AVE RMSD 0.00 dfa_wham_T280K_0005.pdb:REMARK clustering ENERGY -5.25446E+02 RMS 0.00
