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23Q.lib
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!!index array str
"23Q"
!entry.23Q.unit.atoms table str name str type int typex int resx int flags int seq int elmnt dbl chg
"N1" "n3" 0 1 131072 1 7 -0.725600
"C4" "c6" 0 1 131072 2 6 -0.019400
"C5" "c6" 0 1 131072 3 6 -0.071400
"C6" "c6" 0 1 131072 4 6 0.179800
"C7" "ca" 0 1 131072 5 6 -0.059300
"C8" "c6" 0 1 131072 6 6 0.171500
"C10" "ca" 0 1 131072 7 6 -0.082300
"C13" "ca" 0 1 131072 8 6 0.116100
"C15" "ca" 0 1 131072 9 6 -0.075000
"C22" "ca" 0 1 131072 10 6 -0.104000
"C26" "c3" 0 1 131072 11 6 0.145900
"F21" "f" 0 1 131072 12 9 -0.267000
"C18" "ca" 0 1 131072 13 6 -0.131300
"C25" "ca" 0 1 131072 14 6 -0.086000
"C23" "ca" 0 1 131072 15 6 -0.115000
"N17" "n8" 0 1 131072 16 7 -0.995200
"C2" "c6" 0 1 131072 17 6 0.239800
"C3" "ca" 0 1 131072 18 6 -0.070300
"C9" "ca" 0 1 131072 19 6 -0.167000
"C16" "c6" 0 1 131072 20 6 -0.026100
"C14" "c6" 0 1 131072 21 6 0.175800
"C12" "ca" 0 1 131072 22 6 -0.172000
"O20" "os" 0 1 131072 23 8 -0.321100
"C11" "ca" 0 1 131072 24 6 0.109100
"O19" "os" 0 1 131072 25 8 -0.321100
"C27" "c3" 0 1 131072 26 6 0.145900
"H4" "hc" 0 1 131072 27 1 0.084700
"H5" "hc" 0 1 131072 28 1 0.058700
"H5A" "hc" 0 1 131072 29 1 0.058700
"H6" "h1" 0 1 131072 30 1 0.033200
"H6A" "h1" 0 1 131072 31 1 0.033200
"H8" "h1" 0 1 131072 32 1 0.008700
"H15" "ha" 0 1 131072 33 1 0.119000
"H22" "ha" 0 1 131072 34 1 0.111000
"H24" "h1" 0 1 131072 35 1 0.047700
"H24A" "h1" 0 1 131072 36 1 0.047700
"H26" "h1" 0 1 131072 37 1 0.039033
"H26A" "h1" 0 1 131072 38 1 0.039033
"H26B" "h1" 0 1 131072 39 1 0.039033
"H25" "ha" 0 1 131072 40 1 0.115000
"H23" "ha" 0 1 131072 41 1 0.115000
"HN17" "hn" 0 1 131072 42 1 0.396500
"HN1A" "hn" 0 1 131072 43 1 0.396500
"H2" "h1" 0 1 131072 44 1 0.024700
"H9" "ha" 0 1 131072 45 1 0.116000
"H16" "hc" 0 1 131072 46 1 0.054200
"H16A" "hc" 0 1 131072 47 1 0.054200
"H14" "h1" 0 1 131072 48 1 0.032700
"H14A" "h1" 0 1 131072 49 1 0.032700
"H12" "ha" 0 1 131072 50 1 0.117000
"H27" "h1" 0 1 131072 51 1 0.038367
"H27A" "h1" 0 1 131072 52 1 0.038367
"H27B" "h1" 0 1 131072 53 1 0.038367
"C24" "c3" 0 1 131072 54 6 0.233900
!entry.23Q.unit.atomspertinfo table str pname str ptype int ptypex int pelmnt dbl pchg
"N1" "n3" 0 -1 0.0
"C4" "c6" 0 -1 0.0
"C5" "c6" 0 -1 0.0
"C6" "c6" 0 -1 0.0
"C7" "ca" 0 -1 0.0
"C8" "c6" 0 -1 0.0
"C10" "ca" 0 -1 0.0
"C13" "ca" 0 -1 0.0
"C15" "ca" 0 -1 0.0
"C22" "ca" 0 -1 0.0
"C26" "c3" 0 -1 0.0
"F21" "f" 0 -1 0.0
"C18" "ca" 0 -1 0.0
"C25" "ca" 0 -1 0.0
"C23" "ca" 0 -1 0.0
"N17" "n8" 0 -1 0.0
"C2" "c6" 0 -1 0.0
"C3" "ca" 0 -1 0.0
"C9" "ca" 0 -1 0.0
"C16" "c6" 0 -1 0.0
"C14" "c6" 0 -1 0.0
"C12" "ca" 0 -1 0.0
"O20" "os" 0 -1 0.0
"C11" "ca" 0 -1 0.0
"O19" "os" 0 -1 0.0
"C27" "c3" 0 -1 0.0
"H4" "hc" 0 -1 0.0
"H5" "hc" 0 -1 0.0
"H5A" "hc" 0 -1 0.0
"H6" "h1" 0 -1 0.0
"H6A" "h1" 0 -1 0.0
"H8" "h1" 0 -1 0.0
"H15" "ha" 0 -1 0.0
"H22" "ha" 0 -1 0.0
"H24" "h1" 0 -1 0.0
"H24A" "h1" 0 -1 0.0
"H26" "h1" 0 -1 0.0
"H26A" "h1" 0 -1 0.0
"H26B" "h1" 0 -1 0.0
"H25" "ha" 0 -1 0.0
"H23" "ha" 0 -1 0.0
"HN17" "hn" 0 -1 0.0
"HN1A" "hn" 0 -1 0.0
"H2" "h1" 0 -1 0.0
"H9" "ha" 0 -1 0.0
"H16" "hc" 0 -1 0.0
"H16A" "hc" 0 -1 0.0
"H14" "h1" 0 -1 0.0
"H14A" "h1" 0 -1 0.0
"H12" "ha" 0 -1 0.0
"H27" "h1" 0 -1 0.0
"H27A" "h1" 0 -1 0.0
"H27B" "h1" 0 -1 0.0
"C24" "c3" 0 -1 0.0
!entry.23Q.unit.boundbox array dbl
-1.000000
0.0
0.0
0.0
0.0
!entry.23Q.unit.childsequence single int
2
!entry.23Q.unit.connect array int
0
0
!entry.23Q.unit.connectivity table int atom1x int atom2x int flags
1 4 1
1 17 1
1 21 1
2 4 1
2 6 1
2 7 1
2 27 1
3 6 1
3 17 1
3 28 1
3 29 1
4 30 1
4 31 1
5 18 4
5 20 1
5 22 4
6 16 1
6 32 1
7 9 4
7 10 4
8 22 4
8 23 1
8 24 4
9 13 4
9 33 1
10 15 4
10 34 1
11 23 1
11 37 1
11 38 1
11 39 1
12 54 1
13 14 4
13 54 1
14 15 4
14 40 1
15 41 1
16 42 1
16 43 1
17 18 1
17 44 1
18 19 4
19 24 4
19 45 1
20 21 1
20 46 1
20 47 1
21 48 1
21 49 1
22 50 1
24 25 1
25 26 1
26 51 1
26 52 1
26 53 1
35 54 1
36 54 1
!entry.23Q.unit.hierarchy table str abovetype int abovex str belowtype int belowx
"U" 0 "R" 1
"R" 1 "A" 1
"R" 1 "A" 2
"R" 1 "A" 3
"R" 1 "A" 4
"R" 1 "A" 5
"R" 1 "A" 6
"R" 1 "A" 7
"R" 1 "A" 8
"R" 1 "A" 9
"R" 1 "A" 10
"R" 1 "A" 11
"R" 1 "A" 12
"R" 1 "A" 13
"R" 1 "A" 14
"R" 1 "A" 15
"R" 1 "A" 16
"R" 1 "A" 17
"R" 1 "A" 18
"R" 1 "A" 19
"R" 1 "A" 20
"R" 1 "A" 21
"R" 1 "A" 22
"R" 1 "A" 23
"R" 1 "A" 24
"R" 1 "A" 25
"R" 1 "A" 26
"R" 1 "A" 27
"R" 1 "A" 28
"R" 1 "A" 29
"R" 1 "A" 30
"R" 1 "A" 31
"R" 1 "A" 32
"R" 1 "A" 33
"R" 1 "A" 34
"R" 1 "A" 35
"R" 1 "A" 36
"R" 1 "A" 37
"R" 1 "A" 38
"R" 1 "A" 39
"R" 1 "A" 40
"R" 1 "A" 41
"R" 1 "A" 42
"R" 1 "A" 43
"R" 1 "A" 44
"R" 1 "A" 45
"R" 1 "A" 46
"R" 1 "A" 47
"R" 1 "A" 48
"R" 1 "A" 49
"R" 1 "A" 50
"R" 1 "A" 51
"R" 1 "A" 52
"R" 1 "A" 53
"R" 1 "A" 54
!entry.23Q.unit.name single str
"23Q"
!entry.23Q.unit.positions table dbl x dbl y dbl z
0.128000 -1.292000 -0.074000
-2.028000 -0.133000 0.129000
0.131000 1.116000 0.152000
-1.257000 -1.296000 -0.494000
2.911000 -1.323000 0.180000
-1.344000 1.190000 -0.220000
-3.476000 -0.162000 -0.290000
5.055000 -0.191000 0.311000
-4.479000 -0.398000 0.644000
-3.848000 0.041000 -1.619000
7.065000 -1.304000 0.876000
-7.330000 0.604000 1.769000
-5.822000 -0.443000 0.279000
-6.169000 -0.239000 -1.052000
-5.182000 0.0 -1.998000
-1.977000 2.285000 0.497000
0.811000 -0.083000 -0.508000
2.294000 -0.145000 -0.203000
3.075000 1.009000 -0.354000
2.127000 -2.599000 0.296000
0.826000 -2.496000 -0.473000
4.288000 -1.332000 0.438000
6.381000 -0.116000 0.535000
4.433000 1.006000 -0.100000
5.245000 2.075000 -0.216000
4.677000 3.302000 -0.621000
-1.979000 -0.247000 1.217000
0.614000 2.046000 -0.153000
0.236000 1.034000 1.238000
-1.351000 -1.260000 -1.594000
-1.712000 -2.235000 -0.173000
-1.397000 1.317000 -1.315000
-4.207000 -0.561000 1.682000
-3.091000 0.231000 -2.371000
-6.497000 -1.190000 2.176000
-7.740000 -1.175000 0.910000
8.116000 -1.041000 0.970000
6.721000 -1.719000 1.827000
6.961000 -2.071000 0.103000
-7.210000 -0.274000 -1.353000
-5.452000 0.156000 -3.034000
-1.548000 3.159000 0.217000
-2.948000 2.361000 0.218000
0.706000 0.035000 -1.605000
2.602000 1.923000 -0.687000
2.716000 -3.438000 -0.081000
1.910000 -2.816000 1.346000
0.194000 -3.357000 -0.250000
1.024000 -2.521000 -1.559000
4.744000 -2.268000 0.736000
4.230000 3.239000 -1.617000
3.917000 3.655000 0.082000
5.488000 4.026000 -0.648000
-6.880000 -0.641000 1.316000
!entry.23Q.unit.residueconnect table int c1x int c2x int c3x int c4x int c5x int c6x
0 0 0 0 0 0
!entry.23Q.unit.residues table str name int seq int childseq int startatomx str restype int imagingx
"23Q" 1 55 1 "?" 0
!entry.23Q.unit.residuesPdbSequenceNumber array int
0
!entry.23Q.unit.solventcap array dbl
-1.000000
0.0
0.0
0.0
0.0
!entry.23Q.unit.velocities table dbl x dbl y dbl z
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0