Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
3155 | 1d8v RC | 4522 | cing | recoord | 1-original | 5 | XPLOR/CNS | dihedral angle |
!V2
assign (resid 1 and name c) (resid 2 and name n)
(resid 2 and name ca) (resid 2 and name c) 1.0 -110 50 2
!N3
assign (resid 2 and name c) (resid 3 and name n)
(resid 3 and name ca) (resid 3 and name c) 1.0 -110 50 2
!F4
assign (resid 3 and name c) (resid 4 and name n)
(resid 4 and name ca) (resid 4 and name c) 1.0 -110 50 2
!D5 If -130 40 are used, consistent violations
!assign (resid 4 and name c) (resid 5 and name n)
! (resid 5 and name ca) (resid 5 and name c) 1.0 -110 50 2
!S7 Type I tight turn-res #2
assign (resid 6 and name c) (resid 7 and name n)
(resid 7 and name ca) (resid 7 and name c) 1.0 -60 30 2
!S7 Type I tight turn-res #2-psi
assign (resid 7 and name n) (resid 7 and name ca)
(resid 7 and name c) (resid 8 and name n ) 1.0 -30 30 2
!T8 Type I tight turn-res #3-phi
assign (resid 7 and name c) (resid 8 and name n)
(resid 8 and name ca) (resid 8 and name c) 1.0 -90 30 2
!!T8 Type I tight turn-res #3-psi
assign (resid 8 and name n) (resid 8 and name ca)
(resid 8 and name c) (resid 9 and name n ) 1.0 30 30 2
!T24 Indicated by strong HN-HA noe
!assign (resid 23 and name c) (resid 24 and name n)
! (resid 24 and name ca) (resid 24 and name c) 1.0 60 10 2
!Y32 Indicated by strong HN-HA noe
assign (resid 31 and name c) (resid 32 and name n)
(resid 32 and name ca) (resid 32 and name c) 1.0 40 15 2
!D33 Indicated by strong HN-HA noe
assign (resid 32 and name c) (resid 33 and name n)
(resid 33 and name ca) (resid 33 and name c) 1.0 40 15 2
!S42 extracted from Ad's program
assign (resid 41 and name c) (resid 42 and name n)
(resid 42 and name ca) (resid 42 and name c) 1.0 -60 30 2
!D43 Indicated by strong HN-HA noe
!assign (resid 42 and name c) (resid 43 and name n)
! (resid 43 and name ca) (resid 43 and name c) 1.0 40 15 2
!S44 extracted from Ad's program
assign (resid 43 and name c) (resid 44 and name n)
(resid 44 and name ca) (resid 44 and name c) 1.0 -110 50 2
!R45
assign (resid 44 and name c) (resid 45 and name n)
(resid 45 and name ca) (resid 45 and name c) 1.0 -110 50 2
!R46
assign (resid 45 and name c) (resid 46 and name n)
(resid 46 and name ca) (resid 46 and name c) 1.0 -110 50 2
!F47
assign (resid 46 and name c) (resid 47 and name n)
(resid 47 and name ca) (resid 47 and name c) 1.0 -110 50 2
!I48
assign (resid 47 and name c) (resid 48 and name n)
(resid 48 and name ca) (resid 48 and name c) 1.0 -110 50 2
!L49
assign (resid 48 and name c) (resid 49 and name n)
(resid 49 and name ca) (resid 49 and name c) 1.0 -110 50 2
!L50
assign (resid 49 and name c) (resid 50 and name n)
(resid 50 and name ca) (resid 50 and name c) 1.0 -110 50 2
!N51
assign (resid 50 and name c) (resid 51 and name n)
(resid 51 and name ca) (resid 51 and name c) 1.0 -110 50 2
!L52
assign (resid 51 and name c) (resid 52 and name n)
(resid 52 and name ca) (resid 52 and name c) 1.0 -110 50 2
!T53
assign (resid 52 and name c) (resid 53 and name n)
(resid 53 and name ca) (resid 53 and name c) 1.0 -110 50 2
!S54
!assign (resid 53 and name c) (resid 54 and name n)
! (resid 54 and name ca) (resid 54 and name c) 1.0 -110 50 2
!Y57 Indicated by strong HN-HA noe
assign (resid 56 and name c) (resid 57 and name n)
(resid 57 and name ca) (resid 57 and name c) 1.0 40 15 2
!T59
assign (resid 56 and name c) (resid 59 and name n)
(resid 59 and name ca) (resid 59 and name c) 1.0 -110 50 2
!I60
assign (resid 59 and name c) (resid 60 and name n)
(resid 60 and name ca) (resid 60 and name c) 1.0 -110 50 2
!S61
assign (resid 60 and name c) (resid 61 and name n)
(resid 61 and name ca) (resid 61 and name c) 1.0 -110 50 2
!V62
assign (resid 61 and name c) (resid 62 and name n)
(resid 62 and name ca) (resid 62 and name c) 1.0 -110 50 2
!A63
assign (resid 62 and name c) (resid 63 and name n)
(resid 63 and name ca) (resid 63 and name c) 1.0 -110 50 2
!I64
assign (resid 63 and name c) (resid 64 and name n)
(resid 64 and name ca) (resid 64 and name c) 1.0 -110 50 2
!D65
!assign (resid 64 and name c) (resid 65 and name n)
! (resid 65 and name ca) (resid 65 and name c) 1.0 -110 50 2
!N68 from Ad's program
assign (resid 67 and name c) (resid 68 and name n)
(resid 68 and name ca) (resid 68 and name c) 1.0 -60 30 2
!V69 Indicated by strong HN-HA noe
assign (resid 68 and name c) (resid 69 and name n)
(resid 69 and name ca) (resid 69 and name c) 1.0 40 15 2
!Y70
assign (resid 69 and name c) (resid 70 and name n)
(resid 70 and name ca) (resid 70 and name c) 1.0 -110 50 2
!V72
assign (resid 71 and name c) (resid 72 and name n)
(resid 72 and name ca) (resid 72 and name c) 1.0 -110 50 2
!A73
assign (resid 72 and name c) (resid 73 and name n)
(resid 73 and name ca) (resid 73 and name c) 1.0 -110 50 2
!Y74
assign (resid 73 and name c) (resid 74 and name n)
(resid 74 and name ca) (resid 74 and name c) 1.0 -110 50 2
!Y75
assign (resid 74 and name c) (resid 75 and name n)
(resid 75 and name ca) (resid 75 and name c) 1.0 -110 50 2
!Y76
assign (resid 75 and name c) (resid 76 and name n)
(resid 76 and name ca) (resid 76 and name c) 1.0 -110 50 2
!R77 Indicated bye strong HN-HA noe
assign (resid 76 and name c) (resid 77 and name n)
(resid 77 and name ca) (resid 77 and name c) 1.0 40 15 2
!V79
assign (resid 78 and name c) (resid 79 and name n)
(resid 79 and name ca) (resid 79 and name c) 1.0 -110 50 2
!S80
assign (resid 79 and name c) (resid 80 and name n)
(resid 80 and name ca) (resid 80 and name c) 1.0 -110 50 2
!Y81
assign (resid 80 and name c) (resid 81 and name n)
(resid 81 and name ca) (resid 81 and name c) 1.0 -110 50 2
!F82
assign (resid 81 and name c) (resid 82 and name n)
(resid 82 and name ca) (resid 82 and name c) 1.0 -110 50 2
!F83
assign (resid 82 and name c) (resid 83 and name n)
(resid 83 and name ca) (resid 83 and name c) 1.0 -60 30 2
!E85 Indicated by HN-HA noe
assign (resid 84 and name c) (resid 85 and name n)
(resid 85 and name ca) (resid 85 and name c) 1.0 60 10 2
!S86
assign (resid 85 and name c) (resid 86 and name n)
(resid 86 and name ca) (resid 86 and name c) 1.0 -110 50 2
!R99
assign (resid 98 and name c) (resid 99 and name n)
(resid 99 and name ca) (resid 99 and name c) 1.0 -110 50 2
!K100
assign (resid 99 and name c) (resid 100 and name n)
(resid 100 and name ca) (resid 100 and name c) 1.0 -110 50 2
!I101
assign (resid 100 and name c) (resid 101 and name n)
(resid 101 and name ca) (resid 101 and name c) 1.0 -110 50 2
!T102
assign (resid 101 and name c) (resid 102 and name n)
(resid 102 and name ca) (resid 102 and name c) 1.0 -110 50 2
!Y105
assign (resid 104 and name c) (resid 105 and name n)
(resid 105 and name ca) (resid 105 and name c) 1.0 -110 50 2
!T106
assign (resid 105 and name c) (resid 106 and name n)
(resid 106 and name ca) (resid 106 and name c) 1.0 -110 50 2
!H117 Indicated by strong HN-HA noe
assign (resid 116 and name c) (resid 117 and name n)
(resid 117 and name ca) (resid 117 and name c) 1.0 40 15 2
!I119
assign (resid 118 and name c) (resid 119 and name n)
(resid 119 and name ca) (resid 119 and name c) 1.0 -110 50 2
!A174
assign (resid 173 and name c) (resid 174 and name n)
(resid 174 and name ca) (resid 174 and name c) 1.0 -110 50 2
!T175
assign (resid 174 and name c) (resid 175 and name n)
(resid 175 and name ca) (resid 175 and name c) 1.0 -110 50 2
!N176
assign (resid 175 and name c) (resid 176 and name n)
(resid 176 and name ca) (resid 176 and name c) 1.0 -110 50 2
!F177
assign (resid 176 and name c) (resid 177 and name n)
(resid 177 and name ca) (resid 177 and name c) 1.0 -110 50 2
!K178
assign (resid 177 and name c) (resid 178 and name n)
(resid 178 and name ca) (resid 178 and name c) 1.0 -110 50 2
!N180
assign (resid 179 and name c) (resid 180 and name n)
(resid 180 and name ca) (resid 180 and name c) 1.0 -110 50 2
!G204 Indicated by strong HN-HA noe
!assign (resid 203 and name c) (resid 204 and name n)
! (resid 204 and name ca) (resid 204 and name c) 1.0 40 15 2
!G205 Indicated by strong HN-HA noe
!assign (resid 204 and name c) (resid 205 and name n)
! (resid 205 and name ca) (resid 205 and name c) 1.0 40 15 2
!N209
assign (resid 208 and name c) (resid 209 and name n)
(resid 209 and name ca) (resid 209 and name c) 1.0 -110 50 2
!V211
assign (resid 210 and name c) (resid 211 and name n)
(resid 211 and name ca) (resid 211 and name c) 1.0 -110 50 2
!D212
assign (resid 211 and name c) (resid 212 and name n)
(resid 212 and name ca) (resid 212 and name c) 1.0 -110 50 2
!L213
assign (resid 212 and name c) (resid 213 and name n)
(resid 213 and name ca) (resid 213 and name c) 1.0 -110 50 2
!I214
assign (resid 213 and name c) (resid 214 and name n)
(resid 214 and name ca) (resid 214 and name c) 1.0 -110 50 2
!K215
assign (resid 214 and name c) (resid 215 and name n)
(resid 215 and name ca) (resid 215 and name c) 1.0 -110 50 2
!G218 from Ad's program
!assign (resid 217 and name c) (resid 218 and name n)
! (resid 218 and name ca) (resid 218 and name c) 1.0 60 40 2
!R220
assign (resid 119 and name c) (resid 220 and name n)
(resid 220 and name ca) (resid 220 and name c) 1.0 -110 50 2
!F221
assign (resid 220 and name c) (resid 221 and name n)
(resid 221 and name ca) (resid 221 and name c) 1.0 -110 50 2
!Q222
assign (resid 221 and name c) (resid 222 and name n)
(resid 222 and name ca) (resid 222 and name c) 1.0 -110 50 2
!V223
assign (resid 222 and name c) (resid 223 and name n)
(resid 223 and name ca) (resid 223 and name c) 1.0 -110 50 2
!T224
assign (resid 223 and name c) (resid 224 and name n)
(resid 224 and name ca) (resid 224 and name c) 1.0 -110 50 2
!!!!!!!!!!!!!!!Alpha helix!!!!!!!!!!!!!!!!!!!
!K12
assign (resid 11 and name c) (resid 12 and name n)
(resid 12 and name ca) (resid 12 and name c) 1.0 -60 30 2
!T13
assign (resid 12 and name c) (resid 13 and name n)
(resid 13 and name ca) (resid 13 and name c) 1.0 -60 30 2
!T14
assign (resid 13 and name c) (resid 14 and name n)
(resid 14 and name ca) (resid 14 and name c) 1.0 -60 30 2
!T15
assign (resid 14 and name c) (resid 15 and name n)
(resid 15 and name ca) (resid 15 and name c) 1.0 -60 30 2
!K16
assign (resid 15 and name c) (resid 16 and name n)
(resid 16 and name ca) (resid 16 and name c) 1.0 -60 30 2
!F17
assign (resid 16 and name c) (resid 17 and name n)
(resid 17 and name ca) (resid 17 and name c) 1.0 -60 30 2
!I18
assign (resid 17 and name c) (resid 18 and name n)
(resid 18 and name ca) (resid 18 and name c) 1.0 -60 30 2
!E19
assign (resid 18 and name c) (resid 19 and name n)
(resid 19 and name ca) (resid 19 and name c) 1.0 -60 30 2
!D20
assign (resid 19 and name c) (resid 20 and name n)
(resid 20 and name ca) (resid 20 and name c) 1.0 -60 30 2
!F21
assign (resid 20 and name c) (resid 21 and name n)
(resid 21 and name ca) (resid 21 and name c) 1.0 -60 30 2
!R22
assign (resid 21 and name c) (resid 22 and name n)
(resid 22 and name ca) (resid 22 and name c) 1.0 -60 30 2
!R23
assign (resid 22 and name c) (resid 23 and name n)
(resid 23 and name ca) (resid 23 and name c) 1.0 -60 30 2
!E89
assign (resid 88 and name c) (resid 89 and name n)
(resid 89 and name ca) (resid 89 and name c) 1.0 -60 30 2
!A90
assign (resid 89 and name c) (resid 90 and name n)
(resid 90 and name ca) (resid 90 and name c) 1.0 -60 30 2
!Y91
assign (resid 90 and name c) (resid 91 and name n)
(resid 91 and name ca) (resid 91 and name c) 1.0 -60 30 2
!N92
assign (resid 91 and name c) (resid 92 and name n)
(resid 92 and name ca) (resid 92 and name c) 1.0 -60 30 2
!I93
assign (resid 92 and name c) (resid 93 and name n)
(resid 93 and name ca) (resid 93 and name c) 1.0 -80 30 2
!L94
assign (resid 93 and name c) (resid 94 and name n)
(resid 94 and name ca) (resid 94 and name c) 1.0 -60 30 2
!F95 from Ad's program
assign (resid 94 and name c) (resid 95 and name n)
(resid 95 and name ca) (resid 95 and name c) 1.0 -60 30 2
!Y109
assign (resid 108 and name c) (resid 109 and name n)
(resid 109 and name ca) (resid 109 and name c) 1.0 -60 30 2
!E110
assign (resid 109 and name c) (resid 110 and name n)
(resid 110 and name ca) (resid 110 and name c) 1.0 -60 30 2
!N111
assign (resid 110 and name c) (resid 111 and name n)
(resid 111 and name ca) (resid 111 and name c) 1.0 -60 30 2
!L112
assign (resid 111 and name c) (resid 112 and name n)
(resid 112 and name ca) (resid 112 and name c) 1.0 -60 30 2
!Q113
assign (resid 112 and name c) (resid 113 and name n)
(resid 113 and name ca) (resid 113 and name c) 1.0 -60 30 2
!T114
assign (resid 113 and name c) (resid 114 and name n)
(resid 114 and name ca) (resid 114 and name c) 1.0 -60 30 2
!A115
assign (resid 114 and name c) (resid 115 and name n)
(resid 115 and name ca) (resid 115 and name c) 1.0 -60 30 2
!A116
assign (resid 115 and name c) (resid 116 and name n)
(resid 116 and name ca) (resid 116 and name c) 1.0 -60 30 2
!S131
assign (resid 130 and name c) (resid 131 and name n)
(resid 131 and name ca) (resid 131 and name c) 1.0 -60 30 2
!S132
assign (resid 131 and name c) (resid 132 and name n)
(resid 132 and name ca) (resid 132 and name c) 1.0 -60 30 2
!A133
assign (resid 132 and name c) (resid 133 and name n)
(resid 133 and name ca) (resid 133 and name c) 1.0 -60 30 2
!I134
assign (resid 133 and name c) (resid 134 and name n)
(resid 134 and name ca) (resid 134 and name c) 1.0 -60 30 2
!T135
assign (resid 134 and name c) (resid 135 and name n)
(resid 135 and name ca) (resid 135 and name c) 1.0 -60 30 2
!T136
assign (resid 135 and name c) (resid 136 and name n)
(resid 136 and name ca) (resid 136 and name c) 1.0 -60 30 2
!L137
assign (resid 136 and name c) (resid 137 and name n)
(resid 137 and name ca) (resid 137 and name c) 1.0 -60 30 2
!F138
assign (resid 137 and name c) (resid 138 and name n)
(resid 138 and name ca) (resid 138 and name c) 1.0 -60 30 2
!S147
assign (resid 146 and name c) (resid 147 and name n)
(resid 147 and name ca) (resid 147 and name c) 1.0 -60 30 2
!A148
assign (resid 147 and name c) (resid 148 and name n)
(resid 148 and name ca) (resid 148 and name c) 1.0 -60 30 2
!L149
assign (resid 148 and name c) (resid 149 and name n)
(resid 149 and name ca) (resid 149 and name c) 1.0 -60 30 2
!L150
assign (resid 149 and name c) (resid 150 and name n)
(resid 150 and name ca) (resid 150 and name c) 1.0 -60 30 2
!V151
assign (resid 150 and name c) (resid 151 and name n)
(resid 151 and name ca) (resid 151 and name c) 1.0 -60 30 2
!L152
assign (resid 151 and name c) (resid 152 and name n)
(resid 152 and name ca) (resid 152 and name c) 1.0 -60 30 2
!I153
assign (resid 152 and name c) (resid 153 and name n)
(resid 153 and name ca) (resid 153 and name c) 1.0 -60 30 2
!Q154
assign (resid 153 and name c) (resid 154 and name n)
(resid 154 and name ca) (resid 154 and name c) 1.0 -60 30 2
!A160
assign (resid 159 and name c) (resid 160 and name n)
(resid 160 and name ca) (resid 160 and name c) 1.0 -60 30 2
!Y164
!assign (resid 163 and name c) (resid 164 and name n)
! (resid 164 and name ca) (resid 164 and name c) 1.0 -60 30 2
!I165
assign (resid 164 and name c) (resid 165 and name n)
(resid 165 and name ca) (resid 165 and name c) 1.0 -60 30 2
!E166
assign (resid 165 and name c) (resid 166 and name n)
(resid 166 and name ca) (resid 166 and name c) 1.0 -60 30 2
!R167
assign (resid 166 and name c) (resid 167 and name n)
(resid 167 and name ca) (resid 167 and name c) 1.0 -60 30 2
!H168
assign (resid 167 and name c) (resid 168 and name n)
(resid 168 and name ca) (resid 168 and name c) 1.0 -60 30 2
!A182
assign (resid 181 and name c) (resid 182 and name n)
(resid 182 and name ca) (resid 182 and name c) 1.0 -60 30 2
!I183
assign (resid 182 and name c) (resid 183 and name n)
(resid 183 and name ca) (resid 183 and name c) 1.0 -60 30 2
!I184
assign (resid 183 and name c) (resid 184 and name n)
(resid 184 and name ca) (resid 184 and name c) 1.0 -60 30 2
!S185
assign (resid 184 and name c) (resid 185 and name n)
(resid 185 and name ca) (resid 185 and name c) 1.0 -60 30 2
!L186
assign (resid 185 and name c) (resid 186 and name n)
(resid 186 and name ca) (resid 186 and name c) 1.0 -60 30 2
!E187
assign (resid 186 and name c) (resid 187 and name n)
(resid 187 and name ca) (resid 187 and name c) 1.0 -60 30 2
!N188
assign (resid 187 and name c) (resid 188 and name n)
(resid 188 and name ca) (resid 188 and name c) 1.0 -60 30 2
!W190
assign (resid 189 and name c) (resid 190 and name n)
(resid 190 and name ca) (resid 190 and name c) 1.0 -60 30 2
!S191
assign (resid 190 and name c) (resid 191 and name n)
(resid 191 and name ca) (resid 191 and name c) 1.0 -60 30 2
!A192
assign (resid 191 and name c) (resid 192 and name n)
(resid 192 and name ca) (resid 192 and name c) 1.0 -60 30 2
!L193
assign (resid 192 and name c) (resid 193 and name n)
(resid 193 and name ca) (resid 193 and name c) 1.0 -60 30 2
!S194
assign (resid 193 and name c) (resid 194 and name n)
(resid 194 and name ca) (resid 194 and name c) 1.0 -60 30 2
!K195
assign (resid 194 and name c) (resid 195 and name n)
(resid 195 and name ca) (resid 195 and name c) 1.0 -60 30 2
!Q196
assign (resid 195 and name c) (resid 196 and name n)
(resid 196 and name ca) (resid 196 and name c) 1.0 -60 30 2
!I197
assign (resid 196 and name c) (resid 197 and name n)
(resid 197 and name ca) (resid 197 and name c) 1.0 -60 30 2
!E198
assign (resid 197 and name c) (resid 198 and name n)
(resid 198 and name ca) (resid 198 and name c) 1.0 -60 30 2
!L199
assign (resid 198 and name c) (resid 199 and name n)
(resid 199 and name ca) (resid 199 and name c) 1.0 -60 30 2
!A200
assign (resid 199 and name c) (resid 200 and name n)
(resid 200 and name ca) (resid 200 and name c) 1.0 -60 30 2
!Q201
assign (resid 200 and name c) (resid 201 and name n)
(resid 201 and name ca) (resid 201 and name c) 1.0 -60 30 2
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
! C-Terminal portion
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
!N225
assign (resid 224 and name c) (resid 225 and name n)
(resid 225 and name ca) (resid 225 and name c) 1.0 -110 50 2
!S228
assign (resid 227 and name c) (resid 228 and name n)
(resid 228 and name ca) (resid 228 and name c) 1.0 -110 50 2
!K232
assign (resid 231 and name c) (resid 232 and name n)
(resid 232 and name ca) (resid 232 and name c) 1.0 -110 50 2
N234
assign (resid 233 and name c) (resid 234 and name n)
(resid 234 and name ca) (resid 234 and name c) 1.0 -110 50 2
!I235
assign (resid 234 and name c) (resid 235 and name n)
(resid 235 and name ca) (resid 235 and name c) 1.0 -110 50 2
!K236
assign (resid 235 and name c) (resid 236 and name n)
(resid 236 and name ca) (resid 236 and name c) 1.0 -110 50 2
!L237
assign (resid 236 and name c) (resid 237 and name n)
(resid 237 and name ca) (resid 237 and name c) 1.0 -110 50 2
!L238
assign (resid 237 and name c) (resid 238 and name n)
(resid 238 and name ca) (resid 238 and name c) 1.0 -110 50 2
!I246
assign (resid 245 and name c) (resid 246 and name n)
(resid 246 and name ca) (resid 246 and name c) 1.0 -110 50 2
!I248
assign (resid 247 and name c) (resid 248 and name n)
(resid 248 and name ca) (resid 248 and name c) 1.0 -110 50 2
!I250
assign (resid 249 and name c) (resid 250 and name n)
(resid 250 and name ca) (resid 250 and name c) 1.0 -110 50 2
!E248 Indicated by strong HN-HA noe
!assign (resid 247 and name c) (resid 248 and name n)
! (resid 248 and name ca) (resid 248 and name c) 1.0 +60 10 2
!N249 Indicated by strong HN-HA noe
assign (resid 248 and name c) (resid 249 and name n)
(resid 249 and name ca) (resid 249 and name c) 1.0 +60 10 2
!T253 Indicated by strong HN-HA noe
assign (resid 252 and name c) (resid 253 and name n)
(resid 253 and name ca) (resid 253 and name c) 1.0 +60 10 2
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
!non-secondary structural region, interpretated from J and noe pattern
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
!F27
assign (resid 26 and name c) (resid 27 and name n)
(resid 27 and name ca) (resid 27 and name c) 1.0 -110 50 2
!K30
assign (resid 29 and name c) (resid 30 and name n)
(resid 30 and name ca) (resid 30 and name c) 1.0 -110 50 2
!L37
!assign (resid 36 and name c) (resid 37 and name n)
! (resid 37 and name ca) (resid 37 and name c) 1.0 -110 50 2
!S39
assign (resid 38 and name c) (resid 39 and name n)
(resid 39 and name ca) (resid 39 and name c) 1.0 -110 50 2
!T40
assign (resid 39 and name c) (resid 40 and name n)
(resid 40 and name ca) (resid 40 and name c) 1.0 -110 50 2
!I41
assign (resid 40 and name c) (resid 41 and name n)
(resid 41 and name ca) (resid 41 and name c) 1.0 -110 50 2
!T67
assign (resid 66 and name c) (resid 67 and name n)
(resid 67 and name ca) (resid 67 and name c) 1.0 -110 50 2
!T72
assign (resid 71 and name c) (resid 72 and name n)
(resid 72 and name ca) (resid 72 and name c) 1.0 -110 50 2
!T98
assign (resid 97 and name c) (resid 98 and name n)
(resid 98 and name ca) (resid 98 and name c) 1.0 -110 50 2
!102
assign (resid 101 and name c) (resid 102 and name n)
(resid 102 and name ca) (resid 102 and name c) 1.0 -110 50 2
!K118
assign (resid 117 and name c) (resid 118 and name n)
(resid 118 and name ca) (resid 118 and name c) 1.0 -110 50 2
!I123
assign (resid 122 and name c) (resid 123 and name n)
(resid 123 and name ca) (resid 123 and name c) 1.0 -110 50 2
!N141
assign (resid 140 and name c) (resid 141 and name n)
(resid 141 and name ca) (resid 141 and name c) 1.0 -110 50 2
A142 extracted from Ad's program
assign (resid 141 and name c) (resid 142 and name n)
(resid 142 and name ca) (resid 142 and name c) 1.0 -60 30 2
!S144
assign (resid 143 and name c) (resid 144 and name n)
(resid 144 and name ca) (resid 144 and name c) 1.0 -60 30 2
!R161
assign (resid 160 and name c) (resid 161 and name n)
(resid 161 and name ca) (resid 161 and name c) 1.0 -110 50 2
!F162
!assign (resid 161 and name c) (resid 162 and name n)
! (resid 162 and name ca) (resid 162 and name c) 1.0 -110 50 2
!S175
assign (resid 174 and name c) (resid 175 and name n)
(resid 175 and name ca) (resid 175 and name c) 1.0 -110 50 2
!N202
assign (resid 201 and name c) (resid 202 and name n)
(resid 202 and name ca) (resid 202 and name c) 1.0 -110 50 2
!!Added phi based on Ad's program's prediction
!S28
assign (resid 27 and name c) (resid 28 and name n)
(resid 28 and name ca) (resid 28 and name c) 1.0 -60 30 2
!V71
assign (resid 70 and name c) (resid 71 and name n)
(resid 71 and name ca) (resid 71 and name c) 1.0 -110 50 2
!N108
assign (resid 107 and name c) (resid 108 and name n)
(resid 108 and name ca) (resid 108 and name c) 1.0 -110 50 2
!Y140
assign (resid 139 and name c) (resid 140 and name n)
(resid 140 and name ca) (resid 140 and name c) 1.0 -60 30 2
!Q143
assign (resid 142 and name c) (resid 143 and name n)
(resid 143 and name ca) (resid 143 and name c) 1.0 -110 50 2
!V230
assign (resid 229 and name c) (resid 230 and name n)
(resid 230 and name ca) (resid 230 and name c) 1.0 -60 30 2
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
!chi.tbl chi dihedral angle constraints
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
!set message=on echo=on end
!set message=off echo=off end
!restraints dihedral reset
!nassign=800
!!D1
ASSIGN (RESID 1 AND NAME N) (RESID 1 AND NAME CA)
(RESID 1 AND NAME CB) (RESID 1 AND NAME CG) 1.0 -60.0 30.0 2
!!D5
ASSIGN (RESID 5 AND NAME N) (RESID 5 AND NAME CA)
(RESID 5 AND NAME CB) (RESID 5 AND NAME CG) 1.0 180 40 2
!!D20
ASSIGN (RESID 20 AND NAME N) (RESID 20 AND NAME CA)
(RESID 20 AND NAME CB) (RESID 20 AND NAME CG) 1.0 180 40 2
!!D33
ASSIGN (RESID 33 AND NAME N) (RESID 33 AND NAME CA)
(RESID 33 AND NAME CB) (RESID 33 AND NAME CG) 1.0 180.0 20.0 2
!!D43
ASSIGN (RESID 43 AND NAME N) (RESID 43 AND NAME CA)
(RESID 43 AND NAME CB) (RESID 43 AND NAME CG) 1.0 -60.0 30.0 2
!!D124
ASSIGN (RESID 124 AND NAME N) (RESID 124 AND NAME CA)
(RESID 124 AND NAME CB) (RESID 124 AND NAME CG) 1.0 -60.0 30.0 2
!!D212
ASSIGN (RESID 212 AND NAME N) (RESID 212 AND NAME CA)
(RESID 212 AND NAME CB) (RESID 212 AND NAME CG) 1.0 -60.0 30.0 2
!!D227
ASSIGN (RESID 227 AND NAME N) (RESID 227 AND NAME CA)
(RESID 227 AND NAME CB) (RESID 227 AND NAME CG) 1.0 -60.0 30.0 2
!!D229
ASSIGN (RESID 229 AND NAME N) (RESID 229 AND NAME CA)
(RESID 229 AND NAME CB) (RESID 229 AND NAME CG) 1.0 -60.0 30.0 2
!!N3
ASSIGN (RESID 3 AND NAME N) (RESID 3 AND NAME CA)
(RESID 3 AND NAME CB) (RESID 3 AND NAME CG) 1.0 -60.0 30.0 2
!!N92
ASSIGN (RESID 92 AND NAME N) (RESID 92 AND NAME CA)
(RESID 92 AND NAME CB) (RESID 92 AND NAME CG) 1.0 -60.0 30.0 2
!!N108
ASSIGN (RESID 108 AND NAME N) (RESID 108 AND NAME CA)
(RESID 108 AND NAME CB) (RESID 108 AND NAME CG) 1.0 -60.0 30.0 2
!!N111
ASSIGN (RESID 111 AND NAME N) (RESID 111 AND NAME CA)
(RESID 111 AND NAME CB) (RESID 111 AND NAME CG) 1.0 -60.0 30.0 2
!!N122
ASSIGN (RESID 122 AND NAME N) (RESID 122 AND NAME CA)
(RESID 122 AND NAME CB) (RESID 122 AND NAME CG) 1.0 -60.0 30.0 2
!!N141
ASSIGN (RESID 141 AND NAME N) (RESID 141 AND NAME CA)
(RESID 141 AND NAME CB) (RESID 141 AND NAME CG) 1.0 180 40 2
!!N176
ASSIGN (RESID 176 AND NAME N) (RESID 176 AND NAME CA)
(RESID 176 AND NAME CB) (RESID 176 AND NAME CG) 1.0 180 40 2
!!N180
ASSIGN (RESID 180 AND NAME N) (RESID 180 AND NAME CA)
(RESID 180 AND NAME CB) (RESID 180 AND NAME CG) 1.0 60.0 30.0 2
!!N188
ASSIGN (RESID 188 AND NAME N) (RESID 188 AND NAME CA)
(RESID 188 AND NAME CB) (RESID 188 AND NAME CG) 1.0 -60.0 30.0 2
!!N202
ASSIGN (RESID 202 AND NAME N) (RESID 202 AND NAME CA)
(RESID 202 AND NAME CB) (RESID 202 AND NAME CG) 1.0 -60.0 30.0 2
!!N209
ASSIGN (RESID 209 AND NAME N) (RESID 209 AND NAME CA)
(RESID 209 AND NAME CB) (RESID 209 AND NAME CG) 1.0 -60.0 30.0 2
!!N234
ASSIGN (RESID 234 AND NAME N) (RESID 234 AND NAME CA)
(RESID 234 AND NAME CB) (RESID 234 AND NAME CG) 1.0 180 40 2
!!N249
ASSIGN (RESID 249 AND NAME N) (RESID 249 AND NAME CA)
(RESID 249 AND NAME CB) (RESID 249 AND NAME CG) 1.0 -60.0 30.0 2
!!N263
ASSIGN (RESID 263 AND NAME N) (RESID 263 AND NAME CA)
(RESID 263 AND NAME CB) (RESID 263 AND NAME CG) 1.0 -60.0 30.0 2
!!F4
ASSIGN (RESID 4 AND NAME N) (RESID 4 AND NAME CA)
(RESID 4 AND NAME CB) (RESID 4 AND NAME CG) 1.0 180 40 2
!!F21
ASSIGN (RESID 21 AND NAME N) (RESID 21 AND NAME CA)
(RESID 21 AND NAME CB) (RESID 21 AND NAME CG) 1.0 180 40 2
!!F47
!ASSIGN (RESID 47 AND NAME N) (RESID 47 AND NAME CA)
! (RESID 47 AND NAME CB) (RESID 47 AND NAME CG) 1.0 180 40 2
!!F83
!ASSIGN (RESID 83 AND NAME N) (RESID 83 AND NAME CA)
! (RESID 83 AND NAME CB) (RESID 83 AND NAME CG) 1.0 60.0 30.0 2
!!F162
!ASSIGN (RESID 162 AND NAME N) (RESID 162 AND NAME CA)
! (RESID 162 AND NAME CB) (RESID 162 AND NAME CG) 1.0 60.0 30.0 2
!!F207
ASSIGN (RESID 207 AND NAME N) (RESID 207 AND NAME CA)
(RESID 207 AND NAME CB) (RESID 207 AND NAME CG) 1.0 -60.0 30.0 2
!!F221
ASSIGN (RESID 221 AND NAME N) (RESID 221 AND NAME CA)
(RESID 221 AND NAME CB) (RESID 221 AND NAME CG) 1.0 -60.0 30.0 2
!!F250
ASSIGN (RESID 250 AND NAME N) (RESID 250 AND NAME CA)
(RESID 250 AND NAME CB) (RESID 250 AND NAME CG) 1.0 -60.0 30.0 2
!!L6
ASSIGN (RESID 6 AND NAME N) (RESID 6 AND NAME CA)
(RESID 6 AND NAME CB) (RESID 6 AND NAME CG) 1.0 180 40 2
!!L25
ASSIGN (RESID 25 AND NAME N) (RESID 25 AND NAME CA)
(RESID 25 AND NAME CB) (RESID 25 AND NAME CG) 1.0 60.0 30.0 2
!!L49
ASSIGN (RESID 49 AND NAME N) (RESID 49 AND NAME CA)
(RESID 49 AND NAME CB) (RESID 49 AND NAME CG) 1.0 -60.0 30.0 2
!!L94
ASSIGN (RESID 94 AND NAME N) (RESID 94 AND NAME CA)
(RESID 94 AND NAME CB) (RESID 94 AND NAME CG) 1.0 -60.0 30.0 2
!!L112
!ASSIGN (RESID 112 AND NAME N) (RESID 112 AND NAME CA)
! (RESID 112 AND NAME CB) (RESID 112 AND NAME CG) 1.0 60.0 30.0 2
!!L127
ASSIGN (RESID 127 AND NAME N) (RESID 127 AND NAME CA)
(RESID 127 AND NAME CB) (RESID 127 AND NAME CG) 1.0 -60.0 30.0 2
!!L149
ASSIGN (RESID 149 AND NAME N) (RESID 149 AND NAME CA)
(RESID 149 AND NAME CB) (RESID 149 AND NAME CG) 1.0 60.0 30.0 2
!!L150
ASSIGN (RESID 150 AND NAME N) (RESID 150 AND NAME CA)
(RESID 150 AND NAME CB) (RESID 150 AND NAME CG) 1.0 -60.0 30.0 2
!!L181
ASSIGN (RESID 181 AND NAME N) (RESID 181 AND NAME CA)
(RESID 181 AND NAME CB) (RESID 181 AND NAME CG) 1.0 -60.0 30.0 2
!!L199
ASSIGN (RESID 199 AND NAME N) (RESID 199 AND NAME CA)
(RESID 199 AND NAME CB) (RESID 199 AND NAME CG) 1.0 -60.0 30.0 2
!!L213
ASSIGN (RESID 213 AND NAME N) (RESID 213 AND NAME CA)
(RESID 213 AND NAME CB) (RESID 213 AND NAME CG) 1.0 60.0 30.0 2
!!L237
ASSIGN (RESID 237 AND NAME N) (RESID 237 AND NAME CA)
(RESID 237 AND NAME CB) (RESID 237 AND NAME CG) 1.0 60.0 30.0 2
!!L238
!ASSIGN (RESID 238 AND NAME N) (RESID 238 AND NAME CA)
! (RESID 238 AND NAME CB) (RESID 238 AND NAME CG) 1.0 -60.0 30.0 2
!!K12
ASSIGN (RESID 12 AND NAME N) (RESID 12 AND NAME CA)
(RESID 12 AND NAME CB) (RESID 12 AND NAME CG) 1.0 180 40 2
!!K16
ASSIGN (RESID 16 AND NAME N) (RESID 16 AND NAME CA)
(RESID 16 AND NAME CB) (RESID 16 AND NAME CG) 1.0 180 40 2
!!K84
ASSIGN (RESID 84 AND NAME N) (RESID 84 AND NAME CA)
(RESID 84 AND NAME CB) (RESID 84 AND NAME CG) 1.0 180 40 2
!!K96
ASSIGN (RESID 96 AND NAME N) (RESID 96 AND NAME CA)
(RESID 96 AND NAME CB) (RESID 96 AND NAME CG) 1.0 -60.0 30.0 2
!!K100
ASSIGN (RESID 100 AND NAME N) (RESID 100 AND NAME CA)
(RESID 100 AND NAME CB) (RESID 100 AND NAME CG) 1.0 60.0 30.0 2
!!K118
ASSIGN (RESID 118 AND NAME N) (RESID 118 AND NAME CA)
(RESID 118 AND NAME CB) (RESID 118 AND NAME CG) 1.0 -60.0 30.0 2
!!K171
ASSIGN (RESID 171 AND NAME N) (RESID 171 AND NAME CA)
(RESID 171 AND NAME CB) (RESID 171 AND NAME CG) 1.0 -60.0 30.0 2
!!K178
ASSIGN (RESID 178 AND NAME N) (RESID 178 AND NAME CA)
(RESID 178 AND NAME CB) (RESID 178 AND NAME CG) 1.0 60.0 30.0 2
!!K195
ASSIGN (RESID 195 AND NAME N) (RESID 195 AND NAME CA)
(RESID 195 AND NAME CB) (RESID 195 AND NAME CG) 1.0 60.0 30.0 2
!!K206
!ASSIGN (RESID 206 AND NAME N) (RESID 206 AND NAME CA)
! (RESID 206 AND NAME CB) (RESID 206 AND NAME CG) 1.0 -60.0 30.0 2
!!K215
ASSIGN (RESID 215 AND NAME N) (RESID 215 AND NAME CA)
(RESID 215 AND NAME CB) (RESID 215 AND NAME CG) 1.0 60.0 30.0 2
!!K232
ASSIGN (RESID 232 AND NAME N) (RESID 232 AND NAME CA)
(RESID 232 AND NAME CB) (RESID 232 AND NAME CG) 1.0 -60.0 30.0 2
!!E19
ASSIGN (RESID 19 AND NAME N) (RESID 19 AND NAME CA)
(RESID 19 AND NAME CB) (RESID 19 AND NAME CG) 1.0 -60.0 30.0 2
!!E58
ASSIGN (RESID 58 AND NAME N) (RESID 58 AND NAME CA)
(RESID 58 AND NAME CB) (RESID 58 AND NAME CG) 1.0 180 40 2
!!E85
ASSIGN (RESID 85 AND NAME N) (RESID 85 AND NAME CA)
(RESID 85 AND NAME CB) (RESID 85 AND NAME CG) 1.0 -60.0 30.0 2
!!E110
ASSIGN (RESID 110 AND NAME N) (RESID 110 AND NAME CA)
(RESID 110 AND NAME CB) (RESID 110 AND NAME CG) 1.0 -60.0 30.0 2
!!E219
ASSIGN (RESID 219 AND NAME N) (RESID 219 AND NAME CA)
(RESID 219 AND NAME CB) (RESID 219 AND NAME CG) 1.0 -60.0 30.0 2
!!E248
ASSIGN (RESID 248 AND NAME N) (RESID 248 AND NAME CA)
(RESID 248 AND NAME CB) (RESID 248 AND NAME CG) 1.0 -60.0 30.0 2
!!Y32
ASSIGN (RESID 32 AND NAME N) (RESID 32 AND NAME CA)
(RESID 32 AND NAME CB) (RESID 32 AND NAME CG) 1.0 -60.0 30.0 2
!!Y38
!ASSIGN (RESID 38 AND NAME N) (RESID 38 AND NAME CA)
! (RESID 38 AND NAME CB) (RESID 38 AND NAME CG) 1.0 180 40 2
!!Y55
ASSIGN (RESID 55 AND NAME N) (RESID 55 AND NAME CA)
(RESID 55 AND NAME CB) (RESID 55 AND NAME CG) 1.0 180 40 2
!!Y70
ASSIGN (RESID 70 AND NAME N) (RESID 70 AND NAME CA)
(RESID 70 AND NAME CB) (RESID 70 AND NAME CG) 1.0 60.0 30.0 2
!!Y81
ASSIGN (RESID 81 AND NAME N) (RESID 81 AND NAME CA)
(RESID 81 AND NAME CB) (RESID 81 AND NAME CG) 1.0 60.0 30.0 2
!!Y91
ASSIGN (RESID 91 AND NAME N) (RESID 91 AND NAME CA)
(RESID 91 AND NAME CB) (RESID 91 AND NAME CG) 1.0 -60.0 30.0 2
!!Y105
ASSIGN (RESID 105 AND NAME N) (RESID 105 AND NAME CA)
(RESID 105 AND NAME CB) (RESID 105 AND NAME CG) 1.0 -60.0 30.0 2
!!Y109
ASSIGN (RESID 109 AND NAME N) (RESID 109 AND NAME CA)
(RESID 109 AND NAME CB) (RESID 109 AND NAME CG) 1.0 -60.0 30.0 2
!!Y172
ASSIGN (RESID 172 AND NAME N) (RESID 172 AND NAME CA)
(RESID 172 AND NAME CB) (RESID 172 AND NAME CG) 1.0 -60.0 30.0 2
!!R45
ASSIGN (RESID 45 AND NAME N) (RESID 45 AND NAME CA)
(RESID 45 AND NAME CB) (RESID 45 AND NAME CG) 1.0 180 40 2
!!R99
ASSIGN (RESID 99 AND NAME N) (RESID 99 AND NAME CA)
(RESID 99 AND NAME CB) (RESID 99 AND NAME CG) 1.0 -60.0 30.0 2
!!R167
ASSIGN (RESID 167 AND NAME N) (RESID 167 AND NAME CA)
(RESID 167 AND NAME CB) (RESID 167 AND NAME CG) 1.0 -60.0 30.0 2
!!R208
ASSIGN (RESID 208 AND NAME N) (RESID 208 AND NAME CA)
(RESID 208 AND NAME CB) (RESID 208 AND NAME CG) 1.0 -60.0 30.0 2
!!R220
!ASSIGN (RESID 220 AND NAME N) (RESID 220 AND NAME CA)
! (RESID 220 AND NAME CB) (RESID 220 AND NAME CG) 1.0 60.0 30.0 2
!!Q113
ASSIGN (RESID 113 AND NAME N) (RESID 113 AND NAME CA)
(RESID 113 AND NAME CB) (RESID 113 AND NAME CG) 1.0 180 40 2
!!Q143
ASSIGN (RESID 143 AND NAME N) (RESID 143 AND NAME CA)
(RESID 143 AND NAME CB) (RESID 143 AND NAME CG) 1.0 -60.0 30.0 2
!!Q189
ASSIGN (RESID 189 AND NAME N) (RESID 189 AND NAME CA)
(RESID 189 AND NAME CB) (RESID 189 AND NAME CG) 1.0 -60.0 30.0 2
!!Q201
ASSIGN (RESID 201 AND NAME N) (RESID 201 AND NAME CA)
(RESID 201 AND NAME CB) (RESID 201 AND NAME CG) 1.0 -60.0 30.0 2
!!Q203
ASSIGN (RESID 203 AND NAME N) (RESID 203 AND NAME CA)
(RESID 203 AND NAME CB) (RESID 203 AND NAME CG) 1.0 -60.0 30.0 2
!!Q222
ASSIGN (RESID 222 AND NAME N) (RESID 222 AND NAME CA)
(RESID 222 AND NAME CB) (RESID 222 AND NAME CG) 1.0 -60.0 30.0 2
!!H168
ASSIGN (RESID 168 AND NAME N) (RESID 168 AND NAME CA)
(RESID 168 AND NAME CB) (RESID 168 AND NAME CG) 1.0 -60.0 30.0 2
!!M254
ASSIGN (RESID 254 AND NAME N) (RESID 254 AND NAME CA)
(RESID 254 AND NAME CB) (RESID 254 AND NAME CG) 1.0 -60.0 30.0 2
!!S28
ASSIGN (RESID 28 AND NAME N) (RESID 28 AND NAME CA)
(RESID 28 AND NAME CB) (RESID 28 AND NAME OG) 1.0 60.0 30.0 2
!!S39
ASSIGN (RESID 39 AND NAME N) (RESID 39 AND NAME CA)
(RESID 39 AND NAME CB) (RESID 39 AND NAME OG) 1.0 180 40 2
!!S42
ASSIGN (RESID 42 AND NAME N) (RESID 42 AND NAME CA)
(RESID 42 AND NAME CB) (RESID 42 AND NAME OG) 1.0 180 40 2
!!S44
ASSIGN (RESID 44 AND NAME N) (RESID 44 AND NAME CA)
(RESID 44 AND NAME CB) (RESID 44 AND NAME OG) 1.0 180 40 2
!!S61
ASSIGN (RESID 61 AND NAME N) (RESID 61 AND NAME CA)
(RESID 61 AND NAME CB) (RESID 61 AND NAME OG) 1.0 -60.0 30.0 2
!!S86
ASSIGN (RESID 86 AND NAME N) (RESID 86 AND NAME CA)
(RESID 86 AND NAME CB) (RESID 86 AND NAME OG) 1.0 -60.0 30.0 2
!!S147
ASSIGN (RESID 147 AND NAME N) (RESID 147 AND NAME CA)
(RESID 147 AND NAME CB) (RESID 147 AND NAME OG) 1.0 60.0 30.0 2
!!S260
ASSIGN (RESID 260 AND NAME N) (RESID 260 AND NAME CA)
(RESID 260 AND NAME CB) (RESID 260 AND NAME OG) 1.0 180 40 2
!!V2
ASSIGN (RESID 2 AND NAME N) (RESID 2 AND NAME CA)
(RESID 2 AND NAME CB) (RESID 2 AND NAME CG1) 1.0 180 40 2
!!V31
ASSIGN (RESID 31 AND NAME N) (RESID 31 AND NAME CA)
(RESID 31 AND NAME CB) (RESID 31 AND NAME CG1) 1.0 180 40 2
!!V72
!ASSIGN (RESID 72 AND NAME N) (RESID 72 AND NAME CA)
! (RESID 72 AND NAME CB) (RESID 72 AND NAME CG1) 1.0 -60.0 30.0 2
!!V79
ASSIGN (RESID 79 AND NAME N) (RESID 79 AND NAME CA)
(RESID 79 AND NAME CB) (RESID 79 AND NAME CG1) 1.0 180 40 2
!!V151
ASSIGN (RESID 151 AND NAME N) (RESID 151 AND NAME CA)
(RESID 151 AND NAME CB) (RESID 151 AND NAME CG1) 1.0 180 40 2
!!V169
ASSIGN (RESID 169 AND NAME N) (RESID 169 AND NAME CA)
(RESID 169 AND NAME CB) (RESID 169 AND NAME CG1) 1.0 180 40 2
!!V173
ASSIGN (RESID 173 AND NAME N) (RESID 173 AND NAME CA)
(RESID 173 AND NAME CB) (RESID 173 AND NAME CG1) 1.0 180 40 2
!!V211
ASSIGN (RESID 211 AND NAME N) (RESID 211 AND NAME CA)
(RESID 211 AND NAME CB) (RESID 211 AND NAME CG1) 1.0 180 40 2
!!V226
ASSIGN (RESID 226 AND NAME N) (RESID 226 AND NAME CA)
(RESID 226 AND NAME CB) (RESID 226 AND NAME CG1) 1.0 -60.0 30.0 2
!!V230
ASSIGN (RESID 230 AND NAME N) (RESID 230 AND NAME CA)
(RESID 230 AND NAME CB) (RESID 230 AND NAME CG1) 1.0 180 40 2
!!V231
ASSIGN (RESID 231 AND NAME N) (RESID 231 AND NAME CA)
(RESID 231 AND NAME CB) (RESID 231 AND NAME CG1) 1.0 180 40 2
!!V261
ASSIGN (RESID 261 AND NAME N) (RESID 261 AND NAME CA)
(RESID 261 AND NAME CB) (RESID 261 AND NAME CG1) 1.0 180 40 2
!!V262
ASSIGN (RESID 262 AND NAME N) (RESID 262 AND NAME CA)
(RESID 262 AND NAME CB) (RESID 262 AND NAME CG1) 1.0 180 40 2
!!I18
ASSIGN (RESID 18 AND NAME N) (RESID 18 AND NAME CA)
(RESID 18 AND NAME CB) (RESID 18 AND NAME CG1) 1.0 -60.0 30.0 2
!!I41
ASSIGN (RESID 41 AND NAME N) (RESID 41 AND NAME CA)
(RESID 41 AND NAME CB) (RESID 41 AND NAME CG1) 1.0 60.0 30.0 2
!!I48
ASSIGN (RESID 48 AND NAME N) (RESID 48 AND NAME CA)
(RESID 48 AND NAME CB) (RESID 48 AND NAME CG1) 1.0 60.0 30.0 2
!!I60
ASSIGN (RESID 60 AND NAME N) (RESID 60 AND NAME CA)
(RESID 60 AND NAME CB) (RESID 60 AND NAME CG1) 1.0 60.0 30.0 2
!!I64
ASSIGN (RESID 64 AND NAME N) (RESID 64 AND NAME CA)
(RESID 64 AND NAME CB) (RESID 64 AND NAME CG1) 1.0 60.0 30.0 2
!!I93
ASSIGN (RESID 93 AND NAME N) (RESID 93 AND NAME CA)
(RESID 93 AND NAME CB) (RESID 93 AND NAME CG1) 1.0 -60.0 30.0 2
!!I101
!ASSIGN (RESID 101 AND NAME N) (RESID 101 AND NAME CA)
! (RESID 101 AND NAME CB) (RESID 101 AND NAME CG1) 1.0 -60.0 30.0 2
!!I119
ASSIGN (RESID 119 AND NAME N) (RESID 119 AND NAME CA)
(RESID 119 AND NAME CB) (RESID 119 AND NAME CG1) 1.0 60.0 30.0 2
!!I123
ASSIGN (RESID 123 AND NAME N) (RESID 123 AND NAME CA)
(RESID 123 AND NAME CB) (RESID 123 AND NAME CG1) 1.0 -60.0 30.0 2
!!I153
ASSIGN (RESID 153 AND NAME N) (RESID 153 AND NAME CA)
(RESID 153 AND NAME CB) (RESID 153 AND NAME CG1) 1.0 -60.0 30.0 2
!!I165
ASSIGN (RESID 165 AND NAME N) (RESID 165 AND NAME CA)
(RESID 165 AND NAME CB) (RESID 165 AND NAME CG1) 1.0 -60.0 30.0 2
!!I183
ASSIGN (RESID 183 AND NAME N) (RESID 183 AND NAME CA)
(RESID 183 AND NAME CB) (RESID 183 AND NAME CG1) 1.0 -60.0 30.0 2
!!I184
ASSIGN (RESID 184 AND NAME N) (RESID 184 AND NAME CA)
(RESID 184 AND NAME CB) (RESID 184 AND NAME CG1) 1.0 -60.0 30.0 2
!!I197
ASSIGN (RESID 197 AND NAME N) (RESID 197 AND NAME CA)
(RESID 197 AND NAME CB) (RESID 197 AND NAME CG1) 1.0 -60.0 30.0 2
!!I214
ASSIGN (RESID 214 AND NAME N) (RESID 214 AND NAME CA)
(RESID 214 AND NAME CB) (RESID 214 AND NAME CG1) 1.0 -60.0 30.0 2
!!I251
ASSIGN (RESID 251 AND NAME N) (RESID 251 AND NAME CA)
(RESID 251 AND NAME CB) (RESID 251 AND NAME CG1) 1.0 60.0 30.0 2
!!T15
ASSIGN (RESID 15 AND NAME N) (RESID 15 AND NAME CA)
(RESID 15 AND NAME CB) (RESID 15 AND NAME OG1) 1.0 -60.0 30.0 2
!!T40
ASSIGN (RESID 40 AND NAME N) (RESID 40 AND NAME CA)
(RESID 40 AND NAME CB) (RESID 40 AND NAME OG1) 1.0 -60.0 30.0 2
!!T53
ASSIGN (RESID 53 AND NAME N) (RESID 53 AND NAME CA)
(RESID 53 AND NAME CB) (RESID 53 AND NAME OG1) 1.0 -60.0 30.0 2
!!T59
ASSIGN (RESID 59 AND NAME N) (RESID 59 AND NAME CA)
(RESID 59 AND NAME CB) (RESID 59 AND NAME OG1) 1.0 -60.0 30.0 2
!!T135
ASSIGN (RESID 135 AND NAME N) (RESID 135 AND NAME CA)
(RESID 135 AND NAME CB) (RESID 135 AND NAME OG1) 1.0 -60.0 30.0 2
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
!psi angle constains were generated based on noe data
!and chemical shift/x-ray pdb data base using Ad's
!program
!psi for those with positive phi angles
!!Y32
assign (resid 32 and name n) (resid 32 and name ca)
(resid 32 and name c) (resid 33 and name n ) 1.0 40 50 2
!!D33
assign (resid 33 and name n) (resid 33 and name ca)
(resid 33 and name c) (resid 34 and name n ) 1.0 40 50 2
!!Y57
assign (resid 57 and name n) (resid 57 and name ca)
(resid 57 and name c) (resid 58 and name n ) 1.0 40 50 2
!!V69
assign (resid 69 and name n) (resid 69 and name ca)
(resid 69 and name c) (resid 70 and name n ) 1.0 40 50 2
!!R77
!assign (resid 77 and name n) (resid 77 and name ca)
! (resid 77 and name c) (resid 78 and name n ) 1.0 40 50 2
!!E85
assign (resid 85 and name n) (resid 85 and name ca)
(resid 85 and name c) (resid 86 and name n ) 1.0 40 50 2
!!H117
assign (resid 117 and name n) (resid 117 and name ca)
(resid 117 and name c) (resid 118 and name n ) 1.0 40 50 2
!!T217
!assign (resid 217 and name n) (resid 217 and name ca)
! (resid 217 and name c) (resid 218 and name n ) 1.0 40 50 2
!!E248
assign (resid 248 and name n) (resid 248 and name ca)
(resid 248 and name c) (resid 249 and name n ) 1.0 40 50 2
!!N249
assign (resid 249 and name n) (resid 249 and name ca)
(resid 249 and name c) (resid 250 and name n ) 1.0 40 50 2
!!T253
assign (resid 253 and name n) (resid 253 and name ca)
(resid 253 and name c) (resid 254 and name n ) 1.0 40 50 2