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20E.lib
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!!index array str
"20E"
!entry.20E.unit.atoms table str name str type int typex int resx int flags int seq int elmnt dbl chg
"C19" "c3" 0 1 131072 1 6 -0.090100
"C10" "c6" 0 1 131072 2 6 -0.025000
"C1" "c6" 0 1 131072 3 6 -0.066400
"C2" "c6" 0 1 131072 4 6 0.131300
"O2" "oh" 0 1 131072 5 8 -0.665000
"C3" "c6" 0 1 131072 6 6 0.143300
"O3" "oh" 0 1 131072 7 8 -0.654000
"C4" "c6" 0 1 131072 8 6 -0.060400
"C5" "c6" 0 1 131072 9 6 -0.158700
"C6" "c" 0 1 131072 10 6 0.575300
"O6" "o" 0 1 131072 11 8 -0.519100
"C7" "ce" 0 1 131072 12 6 -0.313200
"C8" "c2" 0 1 131072 13 6 -0.052400
"C9" "c6" 0 1 131072 14 6 -0.023500
"C11" "c6" 0 1 131072 15 6 -0.066400
"C12" "c6" 0 1 131072 16 6 -0.061400
"C13" "c5" 0 1 131072 17 6 -0.026000
"C18" "c3" 0 1 131072 18 6 -0.095100
"C14" "c5" 0 1 131072 19 6 0.201200
"O14" "oh" 0 1 131072 20 8 -0.658000
"C15" "c5" 0 1 131072 21 6 -0.106400
"C16" "c5" 0 1 131072 22 6 -0.062400
"C17" "c5" 0 1 131072 23 6 -0.074700
"C20" "c3" 0 1 131072 24 6 0.165000
"O20" "oh" 0 1 131072 25 8 -0.674000
"C21" "c3" 0 1 131072 26 6 -0.123100
"C22" "c3" 0 1 131072 27 6 0.184300
"O22" "oh" 0 1 131072 28 8 -0.661000
"C23" "c3" 0 1 131072 29 6 -0.099400
"C24" "c3" 0 1 131072 30 6 -0.057400
"C25" "c3" 0 1 131072 31 6 0.184000
"C26" "c3" 0 1 131072 32 6 -0.121100
"C27" "c3" 0 1 131072 33 6 -0.121100
"O25" "oh" 0 1 131072 34 8 -0.660000
"H191" "hc" 0 1 131072 35 1 0.040367
"H192" "hc" 0 1 131072 36 1 0.040367
"H193" "hc" 0 1 131072 37 1 0.040367
"H11" "hc" 0 1 131072 38 1 0.060200
"H12" "hc" 0 1 131072 39 1 0.060200
"H2" "h1" 0 1 131072 40 1 0.038700
"HO2" "ho" 0 1 131072 41 1 0.445000
"H3" "h1" 0 1 131072 42 1 0.028700
"HO3" "ho" 0 1 131072 43 1 0.455000
"H41" "hc" 0 1 131072 44 1 0.057700
"H42" "hc" 0 1 131072 45 1 0.057700
"H5" "hc" 0 1 131072 46 1 0.094700
"H7" "ha" 0 1 131072 47 1 0.198000
"H9" "hc" 0 1 131072 48 1 0.067700
"H111" "hc" 0 1 131072 49 1 0.043200
"H112" "hc" 0 1 131072 50 1 0.043200
"H121" "hc" 0 1 131072 51 1 0.051200
"H122" "hc" 0 1 131072 52 1 0.051200
"H181" "hc" 0 1 131072 53 1 0.038700
"H182" "hc" 0 1 131072 54 1 0.038700
"H183" "hc" 0 1 131072 55 1 0.038700
"HO14" "ho" 0 1 131072 56 1 0.444000
"H151" "hc" 0 1 131072 57 1 0.052200
"H152" "hc" 0 1 131072 58 1 0.052200
"H161" "hc" 0 1 131072 59 1 0.057200
"H162" "hc" 0 1 131072 60 1 0.057200
"H17" "hc" 0 1 131072 61 1 0.070700
"HO20" "ho" 0 1 131072 62 1 0.450000
"H211" "hc" 0 1 131072 63 1 0.044367
"H212" "hc" 0 1 131072 64 1 0.044367
"H213" "hc" 0 1 131072 65 1 0.044367
"H22" "h1" 0 1 131072 66 1 0.062700
"HO22" "ho" 0 1 131072 67 1 0.457000
"H231" "hc" 0 1 131072 68 1 0.053700
"H232" "hc" 0 1 131072 69 1 0.053700
"H241" "hc" 0 1 131072 70 1 0.051200
"H242" "hc" 0 1 131072 71 1 0.051200
"H261" "hc" 0 1 131072 72 1 0.039533
"H262" "hc" 0 1 131072 73 1 0.039533
"H263" "hc" 0 1 131072 74 1 0.039533
"H271" "hc" 0 1 131072 75 1 0.039533
"H272" "hc" 0 1 131072 76 1 0.039533
"H273" "hc" 0 1 131072 77 1 0.039533
"HO25" "ho" 0 1 131072 78 1 0.437000
!entry.20E.unit.atomspertinfo table str pname str ptype int ptypex int pelmnt dbl pchg
"C19" "c3" 0 -1 0.0
"C10" "c6" 0 -1 0.0
"C1" "c6" 0 -1 0.0
"C2" "c6" 0 -1 0.0
"O2" "oh" 0 -1 0.0
"C3" "c6" 0 -1 0.0
"O3" "oh" 0 -1 0.0
"C4" "c6" 0 -1 0.0
"C5" "c6" 0 -1 0.0
"C6" "c" 0 -1 0.0
"O6" "o" 0 -1 0.0
"C7" "ce" 0 -1 0.0
"C8" "c2" 0 -1 0.0
"C9" "c6" 0 -1 0.0
"C11" "c6" 0 -1 0.0
"C12" "c6" 0 -1 0.0
"C13" "c5" 0 -1 0.0
"C18" "c3" 0 -1 0.0
"C14" "c5" 0 -1 0.0
"O14" "oh" 0 -1 0.0
"C15" "c5" 0 -1 0.0
"C16" "c5" 0 -1 0.0
"C17" "c5" 0 -1 0.0
"C20" "c3" 0 -1 0.0
"O20" "oh" 0 -1 0.0
"C21" "c3" 0 -1 0.0
"C22" "c3" 0 -1 0.0
"O22" "oh" 0 -1 0.0
"C23" "c3" 0 -1 0.0
"C24" "c3" 0 -1 0.0
"C25" "c3" 0 -1 0.0
"C26" "c3" 0 -1 0.0
"C27" "c3" 0 -1 0.0
"O25" "oh" 0 -1 0.0
"H191" "hc" 0 -1 0.0
"H192" "hc" 0 -1 0.0
"H193" "hc" 0 -1 0.0
"H11" "hc" 0 -1 0.0
"H12" "hc" 0 -1 0.0
"H2" "h1" 0 -1 0.0
"HO2" "ho" 0 -1 0.0
"H3" "h1" 0 -1 0.0
"HO3" "ho" 0 -1 0.0
"H41" "hc" 0 -1 0.0
"H42" "hc" 0 -1 0.0
"H5" "hc" 0 -1 0.0
"H7" "ha" 0 -1 0.0
"H9" "hc" 0 -1 0.0
"H111" "hc" 0 -1 0.0
"H112" "hc" 0 -1 0.0
"H121" "hc" 0 -1 0.0
"H122" "hc" 0 -1 0.0
"H181" "hc" 0 -1 0.0
"H182" "hc" 0 -1 0.0
"H183" "hc" 0 -1 0.0
"HO14" "ho" 0 -1 0.0
"H151" "hc" 0 -1 0.0
"H152" "hc" 0 -1 0.0
"H161" "hc" 0 -1 0.0
"H162" "hc" 0 -1 0.0
"H17" "hc" 0 -1 0.0
"HO20" "ho" 0 -1 0.0
"H211" "hc" 0 -1 0.0
"H212" "hc" 0 -1 0.0
"H213" "hc" 0 -1 0.0
"H22" "h1" 0 -1 0.0
"HO22" "ho" 0 -1 0.0
"H231" "hc" 0 -1 0.0
"H232" "hc" 0 -1 0.0
"H241" "hc" 0 -1 0.0
"H242" "hc" 0 -1 0.0
"H261" "hc" 0 -1 0.0
"H262" "hc" 0 -1 0.0
"H263" "hc" 0 -1 0.0
"H271" "hc" 0 -1 0.0
"H272" "hc" 0 -1 0.0
"H273" "hc" 0 -1 0.0
"HO25" "ho" 0 -1 0.0
!entry.20E.unit.boundbox array dbl
-1.000000
0.0
0.0
0.0
0.0
!entry.20E.unit.childsequence single int
2
!entry.20E.unit.connect array int
0
0
!entry.20E.unit.connectivity table int atom1x int atom2x int flags
1 2 1
1 35 1
1 36 1
1 37 1
2 3 1
2 9 1
2 14 1
3 4 1
3 38 1
3 39 1
4 5 1
4 6 1
4 40 1
5 41 1
6 7 1
6 8 1
6 42 1
7 43 1
8 9 1
8 44 1
8 45 1
9 10 1
9 46 1
10 11 2
10 12 1
12 13 2
12 47 1
13 14 1
13 19 1
14 15 1
14 48 1
15 16 1
15 49 1
15 50 1
16 17 1
16 51 1
16 52 1
17 18 1
17 19 1
17 23 1
18 53 1
18 54 1
18 55 1
19 20 1
19 21 1
20 56 1
21 22 1
21 57 1
21 58 1
22 23 1
22 59 1
22 60 1
23 24 1
23 61 1
24 25 1
24 26 1
24 27 1
25 62 1
26 63 1
26 64 1
26 65 1
27 28 1
27 29 1
27 66 1
28 67 1
29 30 1
29 68 1
29 69 1
30 31 1
30 70 1
30 71 1
31 32 1
31 33 1
31 34 1
32 72 1
32 73 1
32 74 1
33 75 1
33 76 1
33 77 1
34 78 1
!entry.20E.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
"R" 1 "A" 55
"R" 1 "A" 56
"R" 1 "A" 57
"R" 1 "A" 58
"R" 1 "A" 59
"R" 1 "A" 60
"R" 1 "A" 61
"R" 1 "A" 62
"R" 1 "A" 63
"R" 1 "A" 64
"R" 1 "A" 65
"R" 1 "A" 66
"R" 1 "A" 67
"R" 1 "A" 68
"R" 1 "A" 69
"R" 1 "A" 70
"R" 1 "A" 71
"R" 1 "A" 72
"R" 1 "A" 73
"R" 1 "A" 74
"R" 1 "A" 75
"R" 1 "A" 76
"R" 1 "A" 77
"R" 1 "A" 78
!entry.20E.unit.name single str
"20E"
!entry.20E.unit.positions table dbl x dbl y dbl z
4.038000 -0.186000 2.269000
4.109000 -0.395000 0.752000
4.835000 -1.726000 0.496000
5.167000 -1.977000 -0.965000
5.889000 -3.193000 -1.037000
5.984000 -0.828000 -1.561000
7.267000 -0.761000 -0.979000
5.279000 0.499000 -1.338000
4.965000 0.732000 0.149000
4.305000 2.078000 0.300000
4.950000 3.097000 0.476000
2.855000 2.115000 0.125000
2.119000 1.003000 0.005000
2.698000 -0.386000 0.108000
1.728000 -1.377000 0.777000
0.269000 -1.264000 0.337000
-0.244000 0.174000 0.458000
-0.141000 0.655000 1.912000
0.672000 1.057000 -0.422000
0.644000 0.507000 -1.737000
-0.044000 2.395000 -0.433000
-1.528000 2.002000 -0.532000
-1.635000 0.493000 -0.170000
-2.941000 0.093000 0.585000
-3.283000 1.005000 1.619000
-2.837000 -1.320000 1.157000
-4.141000 0.160000 -0.402000
-4.352000 1.479000 -0.857000
-5.446000 -0.428000 0.144000
-6.585000 -0.328000 -0.865000
-7.923000 -0.912000 -0.401000
-8.967000 -0.708000 -1.499000
-7.811000 -2.401000 -0.076000
-8.291000 -0.182000 0.763000
3.400000 0.653000 2.552000
3.664000 -1.071000 2.786000
5.036000 0.014000 2.664000
5.762000 -1.720000 1.078000
4.243000 -2.559000 0.883000
4.238000 -2.058000 -1.546000
5.941000 -3.463000 -1.960000
6.068000 -0.994000 -2.648000
7.601000 -1.663000 -0.910000
5.904000 1.309000 -1.720000
4.367000 0.516000 -1.941000
5.910000 0.773000 0.696000
2.401000 3.097000 0.042000
2.795000 -0.719000 -0.932000
2.070000 -2.392000 0.568000
1.774000 -1.266000 1.861000
0.151000 -1.611000 -0.692000
-0.309000 -1.951000 0.953000
0.893000 0.730000 2.252000
-0.577000 1.644000 2.067000
-0.629000 -0.040000 2.598000
1.035000 1.154000 -2.333000
0.158000 2.956000 0.481000
0.280000 3.033000 -1.260000
-2.116000 2.621000 0.143000
-1.911000 2.182000 -1.534000
-1.667000 -0.080000 -1.100000
-2.592000 1.006000 2.286000
-3.740000 -1.598000 1.696000
-2.670000 -2.061000 0.373000
-2.017000 -1.406000 1.867000
-3.858000 -0.419000 -1.289000
-4.407000 2.041000 -0.078000
-5.286000 -1.478000 0.386000
-5.722000 0.068000 1.079000
-6.747000 0.717000 -1.141000
-6.296000 -0.844000 -1.787000
-8.680000 -1.222000 -2.417000
-9.941000 -1.104000 -1.199000
-9.093000 0.350000 -1.732000
-7.125000 -2.586000 0.750000
-8.783000 -2.817000 0.202000
-7.456000 -2.968000 -0.938000
-9.124000 -0.533000 1.090000
!entry.20E.unit.residueconnect table int c1x int c2x int c3x int c4x int c5x int c6x
0 0 0 0 0 0
!entry.20E.unit.residues table str name int seq int childseq int startatomx str restype int imagingx
"20E" 1 79 1 "?" 0
!entry.20E.unit.residuesPdbSequenceNumber array int
0
!entry.20E.unit.solventcap array dbl
-1.000000
0.0
0.0
0.0
0.0
!entry.20E.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
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0
0.0 0.0 0.0