NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing in_recoord stage position program type subtype subsubtype
26554 2mob 4486 cing recoord 1-original 2 XPLOR/CNS distance NOE simple


!BETA SHEET CONSTRAINTS -- Long Range NOEs
!NOEs in the sheet
!
!A 37 HA - D 81 HA xxxxx 120ms2d
assign (resid 37 and name ha) (resid 81 and name ha) 1.8 0 0.9
!V 39 HA - K 79 HA 1.8E+5 150msc13 
assign (resid 39 and name ha) (resid 79 and name ha) 1.8 0 0.9
!V 41 HA - W 77 HA 6.4E+6 150msc13d2o
assign (resid 41 and name ha) (resid 77 and name ha) 1.8 0 0.9
!L 42 HN - W 77 HA 2.0E+6 150ms
assign (resid 42 and name hn) (resid 77 and name ha) 1.8 0 0.9
!M 43 HA - F 75 HA 1.4E+6 150msc13d2o
assign (resid 43 and name ha) (resid 75 and name ha) 1.8 0 0.9
!K 44 HN - F 75 HA 5.20E+5 100ms
assign (resid 44 and name hn) (resid 75 and name ha) 1.8 0 1.7
!V 68 HN - A 80 HA 2.7E+6 150ms
assign (resid 68 and name hn) (resid 80 and name ha) 1.8 0 1.7
!V 69 HA - I 78 HA 3.0E+5 150ms13c
assign (resid 69 and name ha) (resid 78 and name ha) 1.8 0 0.9
!V 69 HA - K 79 HN 1.8E+5 150ms13c
assign (resid 69 and name ha) (resid 79 and name hn) 1.8 0 1.7
!K 72 HN - F 75 HN 2.66E+5 100ms
assign (resid 72 and name hn) (resid 75 and name hn) 1.8 0 1.7
!K 72 HN - W 76 HA 1.9E+5 150ms
assign (resid 72 and name hn) (resid 76 and name ha) 1.8 0 1.7
!W 76 HA - D 71 HA 2.2E+5 150msc13
assign (resid 76 and name ha) (resid 71 and name ha) 1.8 0 0.9
!W 77 HN - E 70 HB* 1.77E+5 150ms
assign (resid 77 and name hn) (resid 70 and name hb*) 1.8 0 1.7
!W 77 HA - V 41 HA 4.0E+6 150msc13d20
assign (resid 77 and name ha) (resid 41 and name ha) 1.8 0 0.9
!W 77 HB1 - E 70 HG* 1.4E+5 150msc13
assign (resid 77 and name hb*) (resid 70 and name hg*) 1.8 0 1.5
!W 77 HB1 - E 70 HB2 4.6E+5 150msc13
assign (resid 77 and name hb*) (resid 70 and name hb*) 1.8 0 1.5
!W 77 HB2 - E 70 HG* 1.4E+5 150msc13
assign (resid 77 and name hb*) (resid 70 and name hg*) 1.8 0 1.5
!W 77 HB2 - E 70 HB2 4.1E+5 150msc13
assign (resid 77 and name hb*) (resid 70 and name hb*) 1.8 0 1.5
!I 78 HN - L 40 HN overlap with diagonal
assign (resid 78 and name hn) (resid 40 and name hn) 1.8 0 1.7
!I 78 HN - V 41 HA 1.6E+6 150ms
assign (resid 78 and name hn) (resid 41 and name ha) 1.8 0 1.7
!K 79 HN - V 68 HN 3.4E+5 150ms
assign (resid 79 and name hn) (resid 68 and name hn) 1.8 0 1.7
!K 79 HN - V 69 HA 5.6E+5 150ms
assign (resid 79 and name hn) (resid 69 and name ha) 1.8 0 1.7
!I 84 HN - T 125 HA 2.33E+6 150ms
assign (resid 84 and name hn) (resid 125 and name ha) 1.8 0 1.7
!E 85 HA - T 123 HA 5.7E+5 150msc13
assign (resid 85 and name ha) (resid 123 and name ha) 1.8 0 0.9
!I 86 HN - T 123 HA 3.6E+5 150ms
assign (resid 86 and name hn) (resid 123 and name ha) 1.8 0 1.7
!D 87 HA - K 121 HA 4.3E+5 150msc13
assign (resid 87 and name ha) (resid 121 and name ha) 1.8 0 0.9
!A 88 HN - K 121 HA 6.2E+5 150ms
assign (resid 88 and name hn) (resid 121 and name ha) 1.8 0 1.7
!A 115 HA - I 124 HA 4.3E+5 150msc13
assign (resid 115 and name ha) (resid 124 and name ha) 1.8 0 0.9
!Y 116 HN - T 123 HN 4.20E+5 100ms
assign (resid 116 and name hn) (resid 123 and name hn) 1.8 0 1.7
!Y 116 HN - I 124 HA 8.64E+5 150ms
assign (resid 116 and name hn) (resid 124 and name ha) 1.8 0 1.7
!T 117 HA - F 122 HA 3.1E+5 150msc13
assign (resid 117 and name ha) (resid 122 and name ha) 1.8 0 0.9
!T 117 HA - T 123 HN 1.5E+5 150msc13
assign (resid 117 and name ha) (resid 123 and name hn) 1.8 0 1.7
!L 118 HN - K 121 HN 3.5E+5 150ms
assign (resid 118 and name hn) (resid 121 and name hn) 1.8 0 1.7
!K 121 HN - L 118 HN 1.2E+6 150ms
assign (resid 121 and name hn) (resid 118 and name hn) 1.8 0 1.7
!K 121 HN - T 120 HN 1.2E+6 150ms
assign (resid 121 and name hn) (resid 120 and name hn) 1.8 0 1.7
!K 121 HA - D 87 HA 3.5E+5 150msc13
assign (resid 121 and name ha) (resid 87 and name ha) 1.8 0 0.9
!F 122 HA - T 117 HA 1.9E+6 150msc13d2o
assign (resid 122 and name ha) (resid 117 and name ha) 1.8 0 0.9
!T 123 HN - A 115 HA 2.85E+5 100ms
assign (resid 123 and name hn) (resid 115 and name ha) 1.8 0 1.7
!T 123 HN - Y 116 HN 3.42E+5 100ms
assign (resid 123 and name hn) (resid 116 and name hn) 1.8 0 1.7
!T 123 HA - E 85 HA 2.8E+5 150msc13
assign (resid 123 and name ha) (resid 85 and name ha) 1.8 0 0.9
!I 124 HN - E 85 HA 2.72E+5 100ms #wrong assign on V69HA
assign (resid 124 and name hn) (resid 85 and name ha) 1.8 0 1.7
!I 124 HA - A 115 HA 2.3E+5 150msc13
assign (resid 124 and name ha) (resid 115 and name ha) 1.8 0 0.9

!
!BETA-SHEET long range NOEs from sidechain
!
!L 40 HB1 - I 78 HA 1.3E+5 150msc13
assign (resid 40 and name hb*) (resid 78 and name ha) 1.8 0 4.2
!L 40 HB1 - I 78 HB 3.9E+5 150msc13
assign (resid 40 and name hb*) (resid 78 and name hb) 1.8 0 3.2
!L 40 HB2 - I 78 HB 2.57E+5 150msc13
assign (resid 40 and name hb*) (resid 78 and name hb) 1.8 0 3.2
!L 42 HN - W 76 HB1 2.7E+5 150ms
assign (resid 42 and name hn) (resid 76 and name hb*) 1.8 0 3.2
!L 42 HB* - W 76 HB1 4.07E+5 150msc13
assign (resid 42 and name hb*) (resid 76 and name hb*) 1.8 0 3.2
!M 43 HB1 - F 75 HA 1.7E+5 150msc13
assign (resid 43 and name hb*) (resid 75 and name ha) 1.8 0 3.2
!M 43 HB2 - F 75 HA 1.3E+5 150msc13
assign (resid 43 and name hb*) (resid 75 and name ha) 1.8 0 3.2
!V 68 HN - K 79 HD* 3.1E+5 150ms
assign (resid 68 and name hn) (resid 79 and name hd*) 1.8 0 3.2
!E 70 HN - W 77 HB* 2.9E+5 150ms
assign (resid 70 and name hn) (resid 77 and name hb*) 1.8 0 3.2
!E 70 HB2 - W 77 HB* 6.0E+5 150msc13
assign (resid 70 and name hb*) (resid 77 and name hb*) 1.8 0 3.2
!K 72 HN - W 77 HE1 2.42E+5 100ms
!assign (resid 72 and name hn) (resid 77 and name he1) 1.8 0 3.2
!W 76 HE1 - L 42 HN 2.1E+5 150ms
assign (resid 76 and name he1) (resid 42 and name hn) 1.8 0 4.2
!W 77 HE1 - V 41 HB 5.5E+5 150ms
assign (resid 77 and name he1) (resid 41 and name hb) 1.8 0 3.2
!W 77 HE1 - V 41 HG1* 2.3E+5 150ms
assign (resid 77 and name he1) (resid 41 and name hg*) 1.8 0 3.2
!W 77 HE1 - F 75 HB2 4.8E+5 150ms
assign (resid 77 and name he1) (resid 75 and name hb*) 1.8 0 3.2
!W 77 HE1 - K 72 HN 2.12E+5 100ms
!assign (resid 77 and name he1) (resid 72 and name hn) 1.8 0 3.2
!W 77 HE1 - K 72 HB* 4.18E+5 100ms
!assign (resid 77 and name he1) (resid 72 and name hb*) 1.8 0 3.2
!W 77 HE1 - K 72 HG* 3.18E+5 100ms
!assign (resid 77 and name he1) (resid 72 and name hg*) 1.8 0 3.2
!W 77 HB1 - V 41 HG2* 2.0E+5 150msc13
assign (resid 77 and name hb*) (resid 41 and name hg*) 1.8 0 3.2
!W 77 HB2 - V 41 HG2* 1.6E+5 150msc13
assign (resid 77 and name hb*) (resid 41 and name hg*) 1.8 0 3.2
!I 78 HG2* - L 40 HN 2.36E+5 150msc13
assign (resid 78 and name hg2*) (resid 40 and name hn) 1.8 0 3.2
!K 79 HG2 - A 39 HA 1.69E+5 150msc13
assign (resid 79 and name hg*) (resid 39 and name ha) 1.8 0 4.2
!K 79 HG2 - V 68 HA 2.4E+5 150msc13
assign (resid 79 and name hg*) (resid 68 and name ha) 1.8 0 3.2
!A 83 HA - T 125 HB 1.6E+5 150msc13 #not sure
assign (resid 83 and name ha) (resid 125 and name hb) 1.8 0 3.2
!E 85 HB* - T 123 HA 1.7E+5 150msc13
assign (resid 85 and name hb*) (resid 123 and name ha) 1.8 0 3.2
!I 86 HD1* - F 122 HE* 1.2E+5 150msc13
assign (resid 86 and name hd1*) (resid 122 and name he*) 1.8 0 4.2
!I 86 HD1* - F 122 HD* 6.4E+5 150msc13d2o
assign (resid 86 and name hd1*) (resid 122 and name hd*) 1.8 0 3.2
!D 87 HA - K 121 HB1 5.36E+5 150msc13d2o
assign (resid 87 and name ha) (resid 121 and name hb*) 1.8 0 3.2
!D 87 HA - K 121 HB2 1.15E+6 150msc13d2o
assign (resid 87 and name ha) (resid 121 and name hb*) 1.8 0 3.2
!D 87 HA - K 121 HG1 6.79E+5 150msc13d2o
assign (resid 87 and name ha) (resid 121 and name hg*) 1.8 0 3.2
!D 87 HA - K 121 HG2 1.23E+6 150msc13d2o
assign (resid 87 and name ha) (resid 121 and name hg*) 1.8 0 3.2
!I 124 HG12 - A 115 HA 1.18E+5 150msc13
assign (resid 124 and name hg1*) (resid 115 and name ha) 1.8 0 3.2
!I 124 HG2* - T 115 HA 2.79E+5 150msc13
assign (resid 124 and name hg2*) (resid 115 and name ha) 1.8 0 3.2
!I 124 HD1* - A 115 HA 2.27E+5 150msc13
assign (resid 124 and name hd1*) (resid 115 and name ha) 1.8 0 3.2
!T 125 HB - T 123 HG* 1.8E+5 150msc13
assign (resid 125 and name hb) (resid 123 and name hg*) 1.8 0 3.2


!
!LONG RANGE NOEs
!
!N 36 HA - S 126 HA 6.9E+5 150msc13d2o
assign (resid 36 and name ha) (resid 126 and name ha) 1.8 0 3.2
!N 36 HA - S 126 HB1 2.4E+8 150msc13d2o
assign (resid 36 and name ha) (resid 126 and name hb*) 1.8 0 3.2
!N 36 HA - S 126 HB2 1.8E+6 150msc13d2o
assign (resid 36 and name ha) (resid 126 and name hb*) 1.8 0 3.2
!V 38 HG2* - T 125 HA 4.3E+5 150msc13
assign (resid 38 and name hg*) (resid 125 and name ha) 1.8 0 3.2
!V 38 HG2* - S 126 HB1 9.8E+5 150msc13d2o
assign (resid 38 and name hg*) (resid 126 and name hb*) 1.8 0 3.2
!V 38 HG2* - S 126 HB2 5.7E+5 150msc13d2o
assign (resid 38 and name hg*) (resid 126 and name hb*) 1.8 0 3.2
!L 40 HA - T 111 HA 1.97E+6 150msc13d
assign (resid 40 and name ha) (resid 111 and name ha) 1.8 0 3.2
!V 41 HB - I 106 HN 3.7E+5 150msc13
!assign (resid 41 and name hb) (resid 106 and name hn) 1.8 0 3.2
!V 41 HB - S 109 HB1 2.4E+5 150msc13
assign (resid 41 and name hb) (resid 109 and name hb*) 1.8 0 3.2
!V 41 HB - S 109 HB2 3.7E+5 150msc13
assign (resid 41 and name hb) (resid 109 and name hb*) 1.8 0 3.2
!V 41 HG1* - F 75 HB1 4.35E+5 150msc13
!assign (resid 41 and name hg*) (resid 75 and name hb*) 1.8 0 3.2
!V 41 HG1* - F 75 HB2 4.35E+5 150msc13
!assign (resid 41 and name hg1*) (resid 75 and name hb2) 1.8 0 3.2
!V 41 HG1* - W 77 HD1 1.85E+5 150msc13
assign (resid 41 and name hg*) (resid 77 and name hd1) 1.8 0 3.2
!V 41 HG1* - W 77 HZ2 2.66E+5 150msc13
assign (resid 41 and name hg*) (resid 77 and name hz2) 1.8 0 3.2
!V 41 HG1* - W 77 HH2 2.66E+5 150msc13
assign (resid 41 and name hg*) (resid 77 and name hh2) 1.8 0 3.2
!V 41 HG1* - S 109 HB1 2.55E+5 150msc13
assign (resid 41 and name hg*) (resid 109 and name hb*) 1.8 0 3.2
!V 41 HG1* - S 109 HB2 3.3E+5 150msc13
assign (resid 41 and name hg*) (resid 109 and name hb*) 1.8 0 3.2
!V 41 HG2* - W 77 HD1 2.4E+5 150msc13
assign (resid 41 and name hg*) (resid 77 and name hd1) 1.8 0 3.2
!V 41 HG2* - S 109 HB1 2.30E+5 150msc13
assign (resid 41 and name hg*) (resid 109 and name hb*) 1.8 0 3.2
!V 41 HG2* - S 109 HB2 2.3E+5 150msc13
assign (resid 41 and name hg*) (resid 109 and name hb*) 1.8 0 3.2
!L 42 HA - V 108 HA xxxx    120ms2d
assign (resid 42 and name ha) (resid 108 and name ha) 1.8 0 3.2
!M 43 HB1 - N 107 HB1 1.7E+5 150msc13
assign (resid 43 and name hb*) (resid 107 and name hb*) 1.8 0 3.2
!M 43 HB2 - N 107 HB1 1.4E+5 150msc13
assign (resid 43 and name hb*) (resid 107 and name hb*) 1.8 0 3.2
!K 44 HD1 - G 74 HA1 1.30E+5 150msc13
!assign (resid 44 and name hd*) (resid 74 and name ha*) 1.8 0 4.2
!K 44 HD1 - G 74 HA2 1.56E+5 150msc13
!assign (resid 44 and name hd*) (resid 74 and name ha*) 1.8 0 4.2
!S 45 HN - W 76 HE1 3.05E+5 100ms
assign (resid 45 and name hn) (resid 76 and name he1) 1.8 0 4.2
!I 48 HN - W 76 HE1 1.87E+5 200ms
assign (resid 48 and name hn) (resid 76 and name he1) 1.8 0 4.2
!I 48 HG2* - W 76 HB1 1.6E+5 150msc13
assign (resid 48 and name hg2*) (resid 76 and name hb*) 1.8 0 3.2
!I 48 HG2* - W 76 HH2 2.6E+5 150msc13
assign (resid 48 and name hg2*) (resid 76 and name hh2) 1.8 0 3.2
!I 48 HG2* - W 76 HZ3 3.0E+5 150msc13
assign (resid 48 and name hg2*) (resid 76 and name hz3) 1.8 0 3.2
!I 48 HD1* - W 76 HD1 150msc13
assign (resid 48 and name hd1*) (resid 76 and name hd1) 1.8 0 3.2
!I 48 HD1* - W 76 HE3 150msc13
assign (resid 48 and name hd1*) (resid 76 and name he3) 1.8 0 3.2
!I 48 HD1* - W 76 HZ* 150msc13
assign (resid 48 and name hd1*) (resid 76 and name hz*) 1.8 0 4.2
!D 49 HN - W 76 HE1 2.98E+5 200ms
assign (resid 49 and name hn) (resid 76 and name he1) 1.8 0 3.2
!D 49 HN - I 78 HA 2.02E+5 100ms
!assign (resid 49 and name hn) (resid 78 and name ha) 1.8 0 5.2
!D 49 HN - I 78 HB 2.62E+5 100ms
!assign (resid 49 and name hn) (resid 78 and name hb) 1.8 0 5.2
!I 51 HD1* - W 76 HD1 150msc13
assign (resid 51 and name hd1*) (resid 76 and name hd1) 1.8 0 5.2
!I 51 HD1* - W 76 HE3 150msc13
assign (resid 51 and name hd1*) (resid 76 and name he3) 1.8 0 5.2
!I 52 HD1* - W 76 HB* 3.7E+5 150msc13
assign (resid 52 and name hd1*) (resid 76 and name hb*) 1.8 0 5.2
!I 52 HD1* - I 78 HB 1.62E+5 150msc13
assign (resid 52 and name hd1*) (resid 78 and name hb) 1.8 0 3.2
!I 52 HD1* - I 78 HG11 3.11E+5 150msc13
assign (resid 52 and name hd1*) (resid 78 and name hg1*) 1.8 0 3.2
!G 60 HN - D 103 HA 1.48E+6 200ms
!assign (resid 60 and name hn) (resid 103 and name ha) 1.8 0 3.2
!G 60 HN - L 104 HB* 3.83E+5 200ms
!assign (resid 60 and name hn) (resid 104 and name hb*) 1.8 0 3.2
!G 60 HN - L 105 HB* 4.58E+5 200ms
!assign (resid 60 and name hn) (resid 105 and name hb*) 1.8 0 3.2
!K 61 HN - D 103 HA 7.67E+5 200ms
!assign (resid 61 and name hn) (resid 103 and name ha) 1.8 0 3.2
!K 61 HN - L 105 HA 2.13E+5 200ms
!assign (resid 61 and name hn) (resid 105 and name ha) 1.8 0 3.2
!S 66 HB1 - D 81 HB* 7.2E+5 150msc13d2o
!assign (resid 66 and name hb*) (resid 81 and name hb*) 1.8 0 3.2
!S 66 HB2 - D 81 HB* 6.2E+5 150msc13d2o
!assign (resid 66 and name hb2) (resid 81 and name hb*) 1.8 0 3.2
!V 68 HN - A 80 HN 2.69E+5 100ms
!assign (resid 68 and name hn) (resid 80 and name hn) 1.8 0 4.2
!V 69 HG1* - I 52 HG2* 3.82E+5 150msc13
assign (resid 69 and name hg*) (resid 52 and name hg2*) 1.8 0 3.2
!V 69 HG1* - I 52 HD1* 3.82E+5 150msc13
assign (resid 69 and name hg*) (resid 52 and name hd1*) 1.8 0 3.2
!V 69 HG2* - I 52 HG2* 6.37E+5 150msc13
assign (resid 69 and name hg*) (resid 52 and name hg2*) 1.8 0 3.2
!V 69 HG2* - I 52 HD1* 2.45E+5 150msc13
assign (resid 69 and name hg*) (resid 52 and name hd1*) 1.8 0 3.2
!G 74 HA1 - K 44 HD1 2.2E+5 150msc13D
assign (resid 74 and name ha*) (resid 44 and name hd*) 1.8 0 4.2
!G 74 HA2 - K 44 HD1 2.2E+5 150msc13
assign (resid 74 and name ha*) (resid 44 and name hd*) 1.8 0 4.2
!F 75 HB1 - V 41 HG1* 6.52E+5 150msc13
!assign (resid 75 and name hb*) (resid 41 and name hg*) 1.8 0 3.2
!F 75 HB2 - V 41 HG1* 4.92E+5 150msc13
!assign (resid 75 and name hb2) (resid 41 and name hg1*) 1.8 0 3.2
!W 76 HE1 - I 52 HB 6.50E+5 150ms
assign (resid 76 and name he1) (resid 52 and name hb) 1.8 0 3.2
!I 78 HD1* - I 52 HB 2.7E+5 150msc13
assign (resid 78 and name hd1*) (resid 52 and name hb*) 1.8 0 3.2
!I 78 HD1* - I 52 HG2* 1.5E+5 150msc13
assign (resid 78 and name hd1*) (resid 52 and name hg2*) 1.8 0 4.2
!I 78 HD1* - I 52HD1* 7.8E+5 150msc13
assign (resid 78 and name hd1*) (resid 52 and name hd1*) 1.8 0 3.2
!A 83 HA - V 38 HG2* 2.9E+5 150msc13
assign (resid 83 and name ha) (resid 38 and name hg*) 1.8 0 3.2
!I 84 HD1* - L 40 HN 1.76E+5 150msc13
assign (resid 84 and name hd1*) (resid 40 and name hn) 1.8 0 4.2
!I 84 HD1* - L 40 HD2* 4.08E+5 150msc13
assign (resid 84 and name hd1*) (resid 40 and name hd*) 1.8 0 4.2
!A 88 HN - T 120 HG2* 1.8E+5 150ms
!assign (resid 88 and name hn) (resid 120 and name hg2*) 1.8 0 3.2
!A 88 HB* - F 99 HD* 3.1E+5 150msc13
assign (resid 88 and name hb*) (resid 99 and name hd*) 1.8 0 4.2
!A 88 HB* - F 99 HE* 3.1E+5 150msc13
assign (resid 88 and name hb*) (resid 99 and name he*) 1.8 0 4.2
!A 88 HB* - S 100 HA 6.0E+5 150msc13
assign (resid 88 and name hb*) (resid 100 and name ha) 1.8 0 3.2
!A 88 HB* - V 101 HN 2.5E+5 150msc13
assign (resid 88 and name hb*) (resid 101 and name hn) 1.8 0 3.2
!A 88 HB* - V 101 HA 4.48E+5 150msc13
assign (resid 88 and name hb*) (resid 101 and name ha) 1.8 0 4.2
!A 88 HB* - V 101 HG* 7.1E+5 150msc13
assign (resid 88 and name hb*) (resid 101 and name hg*) 1.8 0 4.2
!A 89 HB* - S 100 HA 2.3E+5 150msc13
assign (resid 89 and name hb*) (resid 100 and name ha) 1.8 0 4.2
!A 91 HA - V 101 HG2* 8.21E+5 150msc13
!assign (resid 91 and name ha) (resid 101 and name hg*) 1.8 0 4.2
!A 91 HB* - F 99 HD* 2.3E+5 150msc13
assign (resid 91 and name hb*) (resid 99 and name hd*) 1.8 0 4.2
!A 91 HB* - F 99 HE* 2.3E+5 150msc13
assign (resid 91 and name hb*) (resid 99 and name he*) 1.8 0 4.2
!V 101 HA - A 88 HB* 7.2E+5 150msc13
assign (resid 101 and name ha) (resid 88 and name hb*) 1.8 0 4.2
!L 105 HN - A 88 HG* 1.1E+6 150ms
!assign (resid 105 and name hn) (resid 88 and name hg*) 1.8 0 4.2
!L 105 HN - A 89 HG* 1.1E+6 150ms
!assign (resid 105 and name hn) (resid 89 and name hg*) 1.8 0 4.2
!V 108 HA - L 42 HA 1.7E+5 150msc13
assign (resid 108 and name ha) (resid 42 and name ha) 1.8 0 3.2
!S 109 HB1 - V 41 HB 2.1E+5 150msc13
assign (resid 109 and name hb*) (resid 41 and name hb) 1.8 0 3.2
!S 109 HB1 - V 41 HG1* 2.1E+5 150msc13
assign (resid 109 and name hb*) (resid 41 and name hg*) 1.8 0 3.2
!S 109 HB1 - V 41 HG2* 1.7E+5 150msc13
assign (resid 109 and name hb*) (resid 41 and name hg*) 1.8 0 3.2
!S 109 HB2 - V 41 HB 3.6E+5 150msc13
assign (resid 109 and name hb*) (resid 41 and name hb) 1.8 0 3.2
!S 109 HB2 - V 41 HG1* 3.1E+5 150msc13
assign (resid 109 and name hb*) (resid 41 and name hg*) 1.8 0 3.2
!S 109 HB2 - V 41 HG2* 1.8E+5 150msc13
assign (resid 109 and name hb*) (resid 41 and name hg*) 1.8 0 3.2
!S 109 HB1 - W 77 aro 2.28E+5 150msc13
!S 109 HB1 - W 77 aro 1.32E+5 150msc13
!S 109 HB2 - W 77 aro 2.28E+5 150msc13
!S 109 HB2 - W 77 aro 1.32E+5 150msc13
assign (resid 109 and name hb*) (resid 77 and name hh2) 1.8 0 3.2
assign (resid 109 and name hb*) (resid 77 and name hz2) 1.8 0 3.2
!S 110 HN - V 41 HN 3.54E+5 150ms
assign (resid 110 and name hn) (resid 41 and name hn) 1.8 0 3.2
!G 113 HA2 - I 124 HG2* 4.57E+5 150msc13
!assign (resid 113 and name ha2) (resid 124 and name hg2*) 1.8 0 3.2
!G 113 HN - T 125 HN 2.7E+5 150ms
assign (resid 113 and name hn) (resid 125 and name hn) 1.8 0 3.2
!I 124 HG2* - G 113 HA1 3.44E+5 150msc13
!assign (resid 124 and name hg2*) (resid 113 and name ha*) 1.8 0 3.2
!I 124 HG2* - G 113 HA1 3.44E+5 150msc13
!assign (resid 124 and name hg2*) (resid 113 and name ha2) 1.8 0 3.2
!S 126 HN - A 83 HA 2.33E+6 150ms
assign (resid 126 and name hn) (resid 83 and name ha) 1.8 0 3.2
!S 126 HB1 - N 36 HA 1.1E+6 150msc13d2o
assign (resid 126 and name hb*) (resid 36 and name ha) 1.8 0 3.2
!S 126 HB2 - N 36 HA 9.4E+5 150msc13d2o
assign (resid 126 and name hb*) (resid 36 and name ha) 1.8 0 3.2
!S 126 HB2 - V 38 HG1* 2.45E+5 130msc13d2o
assign (resid 126 and name hb*) (resid 36 and name hg*) 1.8 0 3.2
!I 138 HN - G 59 HN 2.0E+5 150ms





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