Project ID: plumID:22.012
Source: Ayala_et_al_2022_PLUMED/plumed_DNAJB1_wt+cluster2.dat
Originally used with PLUMED version: 2.6
Stable: zipped raw stdout - zipped raw stderr - stderr
Master: zipped raw stdout - zipped raw stderr - stderr

Click on the labels of the actions for more information on what each action computes
tested onv2.9
tested onmaster
###ATOMS of DNAJB1 CHAIN B, predicted to be involved in binding###

D167:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3150-3161 L168:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3162-3180 R169:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3181-3204 V170:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3205-3220 S171:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3221-3231 L172:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3232-3250 E173:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3251-3265 E174:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3266-3280 I175:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3281-3299 E214:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3944-3958 G215:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3959-3965 T216:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=3966-3979 P274:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4878-4891 L276:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4906-4924
V238:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4305-4320 L239:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4321-4339 K240:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4340-4361 D241:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4362-4373 K242:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4374-4395 P243:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4396-4409 H244:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4410-4426 N245:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4427-4440 I246:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4441-4459 F247:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4460-4479 K248:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4480-4501 R249:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=4502-4525
###ATOMS of HTT, predicted to be involved in binding###
P93:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7497-7510 P94:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7511-7524 P95:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7525-7538 P96:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7539-7552 P97:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7553-7566 P98:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7567-7580 P99:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7581-7594 P100:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7595-7608 P101:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7609-7622 P102:
CENTER
Calculate the center for a group of atoms, with arbitrary weights. More details
ATOMS
the group of atoms that you are calculating the Gyration Tensor for
=7623-7636
CONTACTMAP
Calculate the distances between a number of pairs of atoms and transform each distance by a switching function. More details
...
ATOMS1
the atoms involved in each of the contacts you wish to calculate
=D167,P93
ATOMS2
the atoms involved in each of the contacts you wish to calculate
=L168,P93
ATOMS3
the atoms involved in each of the contacts you wish to calculate
=R169,P93
ATOMS4
the atoms involved in each of the contacts you wish to calculate
=V170,P93
ATOMS5
the atoms involved in each of the contacts you wish to calculate
=S171,P93
ATOMS6
the atoms involved in each of the contacts you wish to calculate
=L172,P93
ATOMS7
the atoms involved in each of the contacts you wish to calculate
=E173,P93
ATOMS8
the atoms involved in each of the contacts you wish to calculate
=E174,P93
ATOMS9
the atoms involved in each of the contacts you wish to calculate
=I175,P93
ATOMS10
the atoms involved in each of the contacts you wish to calculate
=E214,P93
ATOMS11
the atoms involved in each of the contacts you wish to calculate
=G215,P93
ATOMS12
the atoms involved in each of the contacts you wish to calculate
=T216,P93
ATOMS13
the atoms involved in each of the contacts you wish to calculate
=P274,P93
ATOMS14
the atoms involved in each of the contacts you wish to calculate
=L276,P93
ATOMS15
the atoms involved in each of the contacts you wish to calculate
=V238,P93
ATOMS16
the atoms involved in each of the contacts you wish to calculate
=L239,P93
ATOMS17
the atoms involved in each of the contacts you wish to calculate
=K240,P93
ATOMS18
the atoms involved in each of the contacts you wish to calculate
=D241,P93
ATOMS19
the atoms involved in each of the contacts you wish to calculate
=K242,P93
ATOMS20
the atoms involved in each of the contacts you wish to calculate
=P243,P93
ATOMS21
the atoms involved in each of the contacts you wish to calculate
=H244,P93
ATOMS22
the atoms involved in each of the contacts you wish to calculate
=N245,P93
ATOMS23
the atoms involved in each of the contacts you wish to calculate
=I246,P93
ATOMS24
the atoms involved in each of the contacts you wish to calculate
=F247,P93
ATOMS25
the atoms involved in each of the contacts you wish to calculate
=K248,P93
ATOMS26
the atoms involved in each of the contacts you wish to calculate
=R249,P93
ATOMS27
the atoms involved in each of the contacts you wish to calculate
=D167,P94
ATOMS28
the atoms involved in each of the contacts you wish to calculate
=L168,P94
ATOMS29
the atoms involved in each of the contacts you wish to calculate
=R169,P94
ATOMS30
the atoms involved in each of the contacts you wish to calculate
=V170,P94
ATOMS31
the atoms involved in each of the contacts you wish to calculate
=S171,P94
ATOMS32
the atoms involved in each of the contacts you wish to calculate
=L172,P94
ATOMS33
the atoms involved in each of the contacts you wish to calculate
=E173,P94
ATOMS34
the atoms involved in each of the contacts you wish to calculate
=E174,P94
ATOMS35
the atoms involved in each of the contacts you wish to calculate
=I175,P94
ATOMS36
the atoms involved in each of the contacts you wish to calculate
=E214,P94
ATOMS37
the atoms involved in each of the contacts you wish to calculate
=G215,P94
ATOMS38
the atoms involved in each of the contacts you wish to calculate
=T216,P94
ATOMS39
the atoms involved in each of the contacts you wish to calculate
=P274,P94
ATOMS40
the atoms involved in each of the contacts you wish to calculate
=L276,P94
ATOMS41
the atoms involved in each of the contacts you wish to calculate
=V238,P94
ATOMS42
the atoms involved in each of the contacts you wish to calculate
=L239,P94
ATOMS43
the atoms involved in each of the contacts you wish to calculate
=K240,P94
ATOMS44
the atoms involved in each of the contacts you wish to calculate
=D241,P94
ATOMS45
the atoms involved in each of the contacts you wish to calculate
=K242,P94
ATOMS46
the atoms involved in each of the contacts you wish to calculate
=P243,P94
ATOMS47
the atoms involved in each of the contacts you wish to calculate
=H244,P94
ATOMS48
the atoms involved in each of the contacts you wish to calculate
=N245,P94
ATOMS49
the atoms involved in each of the contacts you wish to calculate
=I246,P94
ATOMS50
the atoms involved in each of the contacts you wish to calculate
=F247,P94
ATOMS51
the atoms involved in each of the contacts you wish to calculate
=K248,P94
ATOMS52
the atoms involved in each of the contacts you wish to calculate
=R249,P94
ATOMS53
the atoms involved in each of the contacts you wish to calculate
=D167,P95
ATOMS54
the atoms involved in each of the contacts you wish to calculate
=L168,P95
ATOMS55
the atoms involved in each of the contacts you wish to calculate
=R169,P95
ATOMS56
the atoms involved in each of the contacts you wish to calculate
=V170,P95
ATOMS57
the atoms involved in each of the contacts you wish to calculate
=S171,P95
ATOMS58
the atoms involved in each of the contacts you wish to calculate
=L172,P95
ATOMS59
the atoms involved in each of the contacts you wish to calculate
=E173,P95
ATOMS60
the atoms involved in each of the contacts you wish to calculate
=E174,P95
ATOMS61
the atoms involved in each of the contacts you wish to calculate
=I175,P95
ATOMS62
the atoms involved in each of the contacts you wish to calculate
=E214,P95
ATOMS63
the atoms involved in each of the contacts you wish to calculate
=G215,P95
ATOMS64
the atoms involved in each of the contacts you wish to calculate
=T216,P95
ATOMS65
the atoms involved in each of the contacts you wish to calculate
=P274,P95
ATOMS66
the atoms involved in each of the contacts you wish to calculate
=L276,P95
ATOMS67
the atoms involved in each of the contacts you wish to calculate
=V238,P95
ATOMS68
the atoms involved in each of the contacts you wish to calculate
=L239,P95
ATOMS69
the atoms involved in each of the contacts you wish to calculate
=K240,P95
ATOMS70
the atoms involved in each of the contacts you wish to calculate
=D241,P95
ATOMS71
the atoms involved in each of the contacts you wish to calculate
=K242,P95
ATOMS72
the atoms involved in each of the contacts you wish to calculate
=P243,P95
ATOMS73
the atoms involved in each of the contacts you wish to calculate
=H244,P95
ATOMS74
the atoms involved in each of the contacts you wish to calculate
=N245,P95
ATOMS75
the atoms involved in each of the contacts you wish to calculate
=I246,P95
ATOMS76
the atoms involved in each of the contacts you wish to calculate
=F247,P95
ATOMS77
the atoms involved in each of the contacts you wish to calculate
=K248,P95
ATOMS78
the atoms involved in each of the contacts you wish to calculate
=R249,P95
ATOMS79
the atoms involved in each of the contacts you wish to calculate
=D167,P96
ATOMS80
the atoms involved in each of the contacts you wish to calculate
=L168,P96
ATOMS81
the atoms involved in each of the contacts you wish to calculate
=R169,P96
ATOMS82
the atoms involved in each of the contacts you wish to calculate
=V170,P96
ATOMS83
the atoms involved in each of the contacts you wish to calculate
=S171,P96
ATOMS84
the atoms involved in each of the contacts you wish to calculate
=L172,P96
ATOMS85
the atoms involved in each of the contacts you wish to calculate
=E173,P96
ATOMS86
the atoms involved in each of the contacts you wish to calculate
=E174,P96
ATOMS87
the atoms involved in each of the contacts you wish to calculate
=I175,P96
ATOMS88
the atoms involved in each of the contacts you wish to calculate
=E214,P96
ATOMS89
the atoms involved in each of the contacts you wish to calculate
=G215,P96
ATOMS90
the atoms involved in each of the contacts you wish to calculate
=T216,P96
ATOMS91
the atoms involved in each of the contacts you wish to calculate
=P274,P96
ATOMS92
the atoms involved in each of the contacts you wish to calculate
=L276,P96
ATOMS93
the atoms involved in each of the contacts you wish to calculate
=V238,P96
ATOMS94
the atoms involved in each of the contacts you wish to calculate
=L239,P96
ATOMS95
the atoms involved in each of the contacts you wish to calculate
=K240,P96
ATOMS96
the atoms involved in each of the contacts you wish to calculate
=D241,P96
ATOMS97
the atoms involved in each of the contacts you wish to calculate
=K242,P96
ATOMS98
the atoms involved in each of the contacts you wish to calculate
=P243,P96
ATOMS99
the atoms involved in each of the contacts you wish to calculate
=H244,P96
ATOMS100
the atoms involved in each of the contacts you wish to calculate
=N245,P96
ATOMS101
the atoms involved in each of the contacts you wish to calculate
=I246,P96
ATOMS102
the atoms involved in each of the contacts you wish to calculate
=F247,P96
ATOMS103
the atoms involved in each of the contacts you wish to calculate
=K248,P96
ATOMS104
the atoms involved in each of the contacts you wish to calculate
=R249,P96
ATOMS105
the atoms involved in each of the contacts you wish to calculate
=D167,P97
ATOMS106
the atoms involved in each of the contacts you wish to calculate
=L168,P97
ATOMS107
the atoms involved in each of the contacts you wish to calculate
=R169,P97
ATOMS108
the atoms involved in each of the contacts you wish to calculate
=V170,P97
ATOMS109
the atoms involved in each of the contacts you wish to calculate
=S171,P97
ATOMS110
the atoms involved in each of the contacts you wish to calculate
=L172,P97
ATOMS111
the atoms involved in each of the contacts you wish to calculate
=E173,P97
ATOMS112
the atoms involved in each of the contacts you wish to calculate
=E174,P97
ATOMS113
the atoms involved in each of the contacts you wish to calculate
=I175,P97
ATOMS114
the atoms involved in each of the contacts you wish to calculate
=E214,P97
ATOMS115
the atoms involved in each of the contacts you wish to calculate
=G215,P97
ATOMS116
the atoms involved in each of the contacts you wish to calculate
=T216,P97
ATOMS117
the atoms involved in each of the contacts you wish to calculate
=P274,P97
ATOMS118
the atoms involved in each of the contacts you wish to calculate
=L276,P97
ATOMS119
the atoms involved in each of the contacts you wish to calculate
=V238,P97
ATOMS120
the atoms involved in each of the contacts you wish to calculate
=L239,P97
ATOMS121
the atoms involved in each of the contacts you wish to calculate
=K240,P97
ATOMS122
the atoms involved in each of the contacts you wish to calculate
=D241,P97
ATOMS123
the atoms involved in each of the contacts you wish to calculate
=K242,P97
ATOMS124
the atoms involved in each of the contacts you wish to calculate
=P243,P97
ATOMS125
the atoms involved in each of the contacts you wish to calculate
=H244,P97
ATOMS126
the atoms involved in each of the contacts you wish to calculate
=N245,P97
ATOMS127
the atoms involved in each of the contacts you wish to calculate
=I246,P97
ATOMS128
the atoms involved in each of the contacts you wish to calculate
=F247,P97
ATOMS129
the atoms involved in each of the contacts you wish to calculate
=K248,P97
ATOMS130
the atoms involved in each of the contacts you wish to calculate
=R249,P97
ATOMS131
the atoms involved in each of the contacts you wish to calculate
=D167,P98
ATOMS132
the atoms involved in each of the contacts you wish to calculate
=L168,P98
ATOMS133
the atoms involved in each of the contacts you wish to calculate
=R169,P98
ATOMS134
the atoms involved in each of the contacts you wish to calculate
=V170,P98
ATOMS135
the atoms involved in each of the contacts you wish to calculate
=S171,P98
ATOMS136
the atoms involved in each of the contacts you wish to calculate
=L172,P98
ATOMS137
the atoms involved in each of the contacts you wish to calculate
=E173,P98
ATOMS138
the atoms involved in each of the contacts you wish to calculate
=E174,P98
ATOMS139
the atoms involved in each of the contacts you wish to calculate
=I175,P98
ATOMS140
the atoms involved in each of the contacts you wish to calculate
=E214,P98
ATOMS141
the atoms involved in each of the contacts you wish to calculate
=G215,P98
ATOMS142
the atoms involved in each of the contacts you wish to calculate
=T216,P98
ATOMS143
the atoms involved in each of the contacts you wish to calculate
=P274,P98
ATOMS144
the atoms involved in each of the contacts you wish to calculate
=L276,P98
ATOMS145
the atoms involved in each of the contacts you wish to calculate
=V238,P98
ATOMS146
the atoms involved in each of the contacts you wish to calculate
=L239,P98
ATOMS147
the atoms involved in each of the contacts you wish to calculate
=K240,P98
ATOMS148
the atoms involved in each of the contacts you wish to calculate
=D241,P98
ATOMS149
the atoms involved in each of the contacts you wish to calculate
=K242,P98
ATOMS150
the atoms involved in each of the contacts you wish to calculate
=P243,P98
ATOMS151
the atoms involved in each of the contacts you wish to calculate
=H244,P98
ATOMS152
the atoms involved in each of the contacts you wish to calculate
=N245,P98
ATOMS153
the atoms involved in each of the contacts you wish to calculate
=I246,P98
ATOMS154
the atoms involved in each of the contacts you wish to calculate
=F247,P98
ATOMS155
the atoms involved in each of the contacts you wish to calculate
=K248,P98
ATOMS156
the atoms involved in each of the contacts you wish to calculate
=R249,P98
ATOMS157
the atoms involved in each of the contacts you wish to calculate
=D167,P99
ATOMS158
the atoms involved in each of the contacts you wish to calculate
=L168,P99
ATOMS159
the atoms involved in each of the contacts you wish to calculate
=R169,P99
ATOMS160
the atoms involved in each of the contacts you wish to calculate
=V170,P99
ATOMS161
the atoms involved in each of the contacts you wish to calculate
=S171,P99
ATOMS162
the atoms involved in each of the contacts you wish to calculate
=L172,P99
ATOMS163
the atoms involved in each of the contacts you wish to calculate
=E173,P99
ATOMS164
the atoms involved in each of the contacts you wish to calculate
=E174,P99
ATOMS165
the atoms involved in each of the contacts you wish to calculate
=I175,P99
ATOMS166
the atoms involved in each of the contacts you wish to calculate
=E214,P99
ATOMS167
the atoms involved in each of the contacts you wish to calculate
=G215,P99
ATOMS168
the atoms involved in each of the contacts you wish to calculate
=T216,P99
ATOMS169
the atoms involved in each of the contacts you wish to calculate
=P274,P99
ATOMS170
the atoms involved in each of the contacts you wish to calculate
=L276,P99
ATOMS171
the atoms involved in each of the contacts you wish to calculate
=V238,P99
ATOMS172
the atoms involved in each of the contacts you wish to calculate
=L239,P99
ATOMS173
the atoms involved in each of the contacts you wish to calculate
=K240,P99
ATOMS174
the atoms involved in each of the contacts you wish to calculate
=D241,P99
ATOMS175
the atoms involved in each of the contacts you wish to calculate
=K242,P99
ATOMS176
the atoms involved in each of the contacts you wish to calculate
=P243,P99
ATOMS177
the atoms involved in each of the contacts you wish to calculate
=H244,P99
ATOMS178
the atoms involved in each of the contacts you wish to calculate
=N245,P99
ATOMS179
the atoms involved in each of the contacts you wish to calculate
=I246,P99
ATOMS180
the atoms involved in each of the contacts you wish to calculate
=F247,P99
ATOMS181
the atoms involved in each of the contacts you wish to calculate
=K248,P99
ATOMS182
the atoms involved in each of the contacts you wish to calculate
=R249,P99
ATOMS183
the atoms involved in each of the contacts you wish to calculate
=D167,P100
ATOMS184
the atoms involved in each of the contacts you wish to calculate
=L168,P100
ATOMS185
the atoms involved in each of the contacts you wish to calculate
=R169,P100
ATOMS186
the atoms involved in each of the contacts you wish to calculate
=V170,P100
ATOMS187
the atoms involved in each of the contacts you wish to calculate
=S171,P100
ATOMS188
the atoms involved in each of the contacts you wish to calculate
=L172,P100
ATOMS189
the atoms involved in each of the contacts you wish to calculate
=E173,P100
ATOMS190
the atoms involved in each of the contacts you wish to calculate
=E174,P100
ATOMS191
the atoms involved in each of the contacts you wish to calculate
=I175,P100
ATOMS192
the atoms involved in each of the contacts you wish to calculate
=E214,P100
ATOMS193
the atoms involved in each of the contacts you wish to calculate
=G215,P100
ATOMS194
the atoms involved in each of the contacts you wish to calculate
=T216,P100
ATOMS195
the atoms involved in each of the contacts you wish to calculate
=P274,P100
ATOMS196
the atoms involved in each of the contacts you wish to calculate
=L276,P100
ATOMS197
the atoms involved in each of the contacts you wish to calculate
=V238,P100
ATOMS198
the atoms involved in each of the contacts you wish to calculate
=L239,P100
ATOMS199
the atoms involved in each of the contacts you wish to calculate
=K240,P100
ATOMS200
the atoms involved in each of the contacts you wish to calculate
=D241,P100
ATOMS201
the atoms involved in each of the contacts you wish to calculate
=K242,P100
ATOMS202
the atoms involved in each of the contacts you wish to calculate
=P243,P100
ATOMS203
the atoms involved in each of the contacts you wish to calculate
=H244,P100
ATOMS204
the atoms involved in each of the contacts you wish to calculate
=N245,P100
ATOMS205
the atoms involved in each of the contacts you wish to calculate
=I246,P100
ATOMS206
the atoms involved in each of the contacts you wish to calculate
=F247,P100
ATOMS207
the atoms involved in each of the contacts you wish to calculate
=K248,P100
ATOMS208
the atoms involved in each of the contacts you wish to calculate
=R249,P100
ATOMS209
the atoms involved in each of the contacts you wish to calculate
=D167,P101
ATOMS210
the atoms involved in each of the contacts you wish to calculate
=L168,P101
ATOMS211
the atoms involved in each of the contacts you wish to calculate
=R169,P101
ATOMS212
the atoms involved in each of the contacts you wish to calculate
=V170,P101
ATOMS213
the atoms involved in each of the contacts you wish to calculate
=S171,P101
ATOMS214
the atoms involved in each of the contacts you wish to calculate
=L172,P101
ATOMS215
the atoms involved in each of the contacts you wish to calculate
=E173,P101
ATOMS216
the atoms involved in each of the contacts you wish to calculate
=E174,P101
ATOMS217
the atoms involved in each of the contacts you wish to calculate
=I175,P101
ATOMS218
the atoms involved in each of the contacts you wish to calculate
=E214,P101
ATOMS219
the atoms involved in each of the contacts you wish to calculate
=G215,P101
ATOMS220
the atoms involved in each of the contacts you wish to calculate
=T216,P101
ATOMS221
the atoms involved in each of the contacts you wish to calculate
=P274,P101
ATOMS222
the atoms involved in each of the contacts you wish to calculate
=L276,P101
ATOMS223
the atoms involved in each of the contacts you wish to calculate
=V238,P101
ATOMS224
the atoms involved in each of the contacts you wish to calculate
=L239,P101
ATOMS225
the atoms involved in each of the contacts you wish to calculate
=K240,P101
ATOMS226
the atoms involved in each of the contacts you wish to calculate
=D241,P101
ATOMS227
the atoms involved in each of the contacts you wish to calculate
=K242,P101
ATOMS228
the atoms involved in each of the contacts you wish to calculate
=P243,P101
ATOMS229
the atoms involved in each of the contacts you wish to calculate
=H244,P101
ATOMS230
the atoms involved in each of the contacts you wish to calculate
=N245,P101
ATOMS231
the atoms involved in each of the contacts you wish to calculate
=I246,P101
ATOMS232
the atoms involved in each of the contacts you wish to calculate
=F247,P101
ATOMS233
the atoms involved in each of the contacts you wish to calculate
=K248,P101
ATOMS234
the atoms involved in each of the contacts you wish to calculate
=R249,P101
ATOMS235
the atoms involved in each of the contacts you wish to calculate
=D167,P102
ATOMS236
the atoms involved in each of the contacts you wish to calculate
=L168,P102
ATOMS237
the atoms involved in each of the contacts you wish to calculate
=R169,P102
ATOMS238
the atoms involved in each of the contacts you wish to calculate
=V170,P102
ATOMS239
the atoms involved in each of the contacts you wish to calculate
=S171,P102
ATOMS240
the atoms involved in each of the contacts you wish to calculate
=L172,P102
ATOMS241
the atoms involved in each of the contacts you wish to calculate
=E173,P102
ATOMS242
the atoms involved in each of the contacts you wish to calculate
=E174,P102
ATOMS243
the atoms involved in each of the contacts you wish to calculate
=I175,P102
ATOMS244
the atoms involved in each of the contacts you wish to calculate
=E214,P102
ATOMS245
the atoms involved in each of the contacts you wish to calculate
=G215,P102
ATOMS246
the atoms involved in each of the contacts you wish to calculate
=T216,P102
ATOMS247
the atoms involved in each of the contacts you wish to calculate
=P274,P102
ATOMS248
the atoms involved in each of the contacts you wish to calculate
=L276,P102
ATOMS249
the atoms involved in each of the contacts you wish to calculate
=V238,P102
ATOMS250
the atoms involved in each of the contacts you wish to calculate
=L239,P102
ATOMS251
the atoms involved in each of the contacts you wish to calculate
=K240,P102
ATOMS252
the atoms involved in each of the contacts you wish to calculate
=D241,P102
ATOMS253
the atoms involved in each of the contacts you wish to calculate
=K242,P102
ATOMS254
the atoms involved in each of the contacts you wish to calculate
=P243,P102
ATOMS255
the atoms involved in each of the contacts you wish to calculate
=H244,P102
ATOMS256
the atoms involved in each of the contacts you wish to calculate
=N245,P102
ATOMS257
the atoms involved in each of the contacts you wish to calculate
=I246,P102
ATOMS258
the atoms involved in each of the contacts you wish to calculate
=F247,P102
ATOMS259
the atoms involved in each of the contacts you wish to calculate
=K248,P102
ATOMS260
the atoms involved in each of the contacts you wish to calculate
=R249,P102
SWITCH
The switching functions to use for each of the contacts in your map
={RATIONAL R_0=1}
LABEL
a label for the action so that its output can be referenced in the input to other actions
=contact ... CONTACTMAP
PRINT
Print quantities to a file. More details
ARG
the input for this action is the scalar output from one or more other actions
=contact
FILE
the name of the file on which to output these quantities
=contact_map