NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
561648 |
2m02   |
17937 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
assign (resid 25 and name cb ) (resid 25 and name cg ) 2.125 1.125 1.125 !L51/62CB-CG strong intra
OR (resid 36 and name cb ) (resid 36 and name cg )
assign (resid 25 and name cg ) (resid 25 and name c ) 2.75 1.75 1.75 !L51CG-C med intra
assign (resid 25 and name cg ) (resid 25 and name cb ) 2.125 1.125 1.125 !L51CG-CB strong intra
OR (resid 36 and name cg ) (resid 36 and name cb )
assign (resid 25 and name cd* ) (resid 25 and name cg ) 2.75 1.75 1.75 !L51CD-CG med intra
OR (resid 36 and name cd* ) (resid 36 and name cg )
assign (resid 25 and name cg ) (resid 25 and name cd* ) 2.75 1.75 1.75 !L51CG-CD med intra
OR (resid 36 and name cg ) (resid 36 and name cd* )
assign (resid 29 and name ca) (resid 30 and name ca) 3.3 2.3 2.3 !G55CA-K56CA weak sqntl
assign (resid 30 and name ca) (resid 29 and name ca) 3.3 2.3 2.3 !K56CA-G55CA weak sqntl
assign (resid 30 and name cb) (resid 30 and name ca) 3.3 2.3 2.3 !K56CB-CA weak intra
assign (resid 30 and name cg) (resid 30 and name ca) 3.3 2.3 2.3 !K56CG-CA weak intra
assign (resid 31 and name ca ) (resid 31 and name cd* ) 3.3 2.3 2.3 !W57CA-CDx weak intra
assign (resid 31 and name ca ) (resid 31 and name cg ) 3.3 2.3 2.3 !W57CA-CG weak intra
assign (resid 31 and name cd* ) (resid 31 and name ca ) 3.3 2.3 2.3 !W57CDx-CA weak intra
assign (resid 31 and name cg ) (resid 31 and name ca ) 3.3 2.3 2.3 !W57CG-CA weak intra
assign (resid 32 and name ca) (resid 32 and name cb) 2.125 1.125 1.125 !V58CA-CB strong intra
assign (resid 32 and name ca) (resid 33 and name ca) 3.3 2.3 2.3 !V58CA-G59CA weak sqntl
assign (resid 32 and name cb) (resid 32 and name c) 3.3 2.3 2.3 !V58CB-C weak intra
assign (resid 32 and name cb) (resid 32 and name ca) 2.125 1.125 1.125 !V58CB-CA strong intra
assign (resid 32 and name cg2) (resid 32 and name cb) 3.3 2.3 2.3 !V58CG2-CB weak intra
assign (resid 34 and name cb) (resid 34 and name cg2) 3.3 2.3 2.3 !V58CB-CG2 weak intra
assign (resid 34 and name cg2) (resid 34 and name cb) 3.3 2.3 2.3 !V58CG2-CB weak intra
assign (resid 34 and name ca) (resid 34 and name cb) 2.125 1.125 1.125 !V60CA-CB strong intra
assign (resid 34 and name cb) (resid 34 and name ca) 2.125 1.125 1.125 !V60CB-CA strong intra
assign (resid 34 and name cb) (resid 34 and name cg1) 3.3 2.3 2.3 !V60CB-CG1 weak intra
assign (resid 34 and name cg1) (resid 34 and name cb) 3.3 2.3 2.3 !V60CG1-CB weak intra
assign (resid 35 and name ca) (resid 35 and name cb) 2.125 1.125 1.125 !I61CA-CB strong intra
assign (resid 35 and name cb) (resid 35 and name ca) 2.125 1.125 1.125 !I61CB-CA strong intra
assign (resid 35 and name cb) (resid 35 and name cd1) 2.75 1.75 1.75 !I61CB-CD1 med intra
assign (resid 35 and name cb) (resid 35 and name cg1) 2.75 1.75 1.75 !I61CB-CG1 med intra
assign (resid 35 and name cd1) (resid 35 and name ca) 3.3 2.3 2.3 !I61CD1-CA weak intra
assign (resid 35 and name cd1) (resid 35 and name cb) 3.3 2.3 2.3 !I61CD1-CB weak intra
assign (resid 35 and name cg1) (resid 35 and name cb) 2.75 1.75 1.75 !I61CG1-CB med intra
assign (resid 36 and name cd*) (resid 36 and name cg) 2.75 1.75 1.75 !L62CDx-CG med intra
OR (resid 25 and name cd*) (resid 25 and name cg)
assign (resid 36 and name cg) (resid 36 and name cd* ) 2.75 1.75 1.75 !L62CG-CDx med intra
OR (resid 25 and name cg) (resid 25 and name cd*)
assign (resid 46 and name cg2) (resid 46 and name ca ) 3.3 2.3 2.3 !T72CG2-CA weak intra
assign (resid 47 and name ca ) (resid 47 and name c ) 3.3 2.3 2.3 !V73CA-C weak intra
assign (resid 52 and name ca ) (resid 52 and name cg ) 3.3 2.3 2.3 !Y78CA-CG weak intra
assign (resid 52 and name cg ) (resid 52 and name ca ) 3.3 2.3 2.3 !Y78CG-CA weak intra
assign (resid 53 and name ca ) (resid 53 and name c ) 3.3 2.3 2.3 !F79CA-C weak intra
assign (resid 53 and name ca ) (resid 53 and name cd* ) 3.3 2.3 2.3 !F79CA-CDx weak intra
assign (resid 53 and name ca ) (resid 53 and name cg ) 2.125 1.125 1.125 !F79CA-CG strong intra
assign (resid 53 and name cd* ) (resid 53 and name ca ) 3.3 2.3 2.3 !F79CDx-CA weak intra
assign (resid 53 and name cg ) (resid 53 and name ca ) 2.125 1.125 1.125 !F79CG-CA strong intra
assign (resid 53 and name ca ) (resid 54 and name c ) 3.3 2.3 2.3 !F79CA-T80C weak sqntl
assign (resid 54 and name cb ) (resid 55 and name ca ) 3.3 2.3 2.3 !T80CB-C81CA weak sqntl
assign (resid 54 and name cg2 ) (resid 55 and name cb ) 3.3 2.3 2.3 !T80CG2-C81CB weak sqntl
assign (resid 61 and name ca ) (resid 61 and name cb ) 3.3 2.3 2.3 !I87CA-CB weak intra
assign (resid 61 and name cb ) (resid 61 and name ca ) 3.3 2.3 2.3 !I87CB-CA weak intra
assign (resid 61 and name cd1 ) (resid 61 and name cb ) 3.3 2.3 2.3 !I87CD1-CB weak intra
assign (resid 62 and name cg ) (resid 62 and name ca ) 3.3 2.3 2.3 !F88CG-CA weak intra
assign (resid 63 and name ca ) (resid 63 and name cb ) 2.125 1.125 1.125 !V89CA-CB strong intra
assign (resid 63 and name cb ) (resid 63 and name c ) 3.3 2.3 2.3 !V89CB-C weak intra
assign (resid 63 and name cb ) (resid 63 and name ca ) 2.125 1.125 1.125 !V89CB-CA strong intra
assign (resid 66 and name cb ) (resid 66 and name c ) 2.75 1.75 1.75 !S92CB-C med intra
assign (resid 68 and name cb ) (resid 68 and name ca ) 3.3 2.3 2.3 !I94CB-CA weak intra
! File:2CAP_200ms.list
assign (resid 3 and name ca ) (resid 3 and name cb) 2.9 1.9 1.9 !V29CA-CB strong intra
assign (resid 3 and name ca ) (resid 4 and name ca) 4 3 3 !V29CA-G30CA weak sqntl
assign (resid 3 and name cb) (resid 3 and name ca ) 2.9 1.9 1.9 !V29CB-CA strong intra
assign (resid 3 and name cb) (resid 3 and name cg1) 3.35 2.35 2.35 !V29CB-CG1 med intra
assign (resid 3 and name cg1) (resid 3 and name cb) 3.35 2.35 2.35 !V29CG1-CB med intra
assign (resid 7 and name ca ) (resid 7 and name cb) 2.9 1.9 1.9 !V33CA-CB strong intra
assign (resid 7 and name cb) (resid 7 and name ca ) 2.9 1.9 1.9 !V33CB-CA strong intra
assign (resid 9 and name ca ) (resid 9 and name cb ) 2.9 1.9 1.9 !V35CA-CB strong intra
assign (resid 9 and name ca ) (resid 67 and name ca) 4 3 3 !V35CA-Q93CA weak long
OR (resid 9 and name ca ) (resid 26 and name ca)
OR (resid 9 and name ca ) (resid 42 and name ca)
OR (resid 9 and name ca ) (resid 48 and name ca)
OR (resid 9 and name ca ) (resid 55 and name ca)
OR (resid 9 and name ca ) (resid 59 and name ca)
OR (resid 9 and name ca ) (resid 71 and name ca)
assign (resid 9 and name cb ) (resid 9 and name ca ) 2.9 1.9 1.9 !V35CB-CA strong intra
assign (resid 10 and name ca ) (resid 10 and name cb ) 3.35 2.35 2.35 !I36CA-CB med intra
assign (resid 10 and name cb ) (resid 10 and name ca ) 3.35 2.35 2.35 !I36CB-CA med intra
assign (resid 16 and name ca ) (resid 37 and name c ) 4 3 3 !G42CA-D63C weak long correct
OR (resid 16 and name ca ) (resid 25 and name c)
OR (resid 16 and name ca ) (resid 35 and name c)
OR (resid 16 and name ca ) (resid 36 and name c)
OR (resid 16 and name ca ) (resid 57 and name c)
assign (resid 17 and name ca ) (resid 18 and name ca ) 4 3 3 !T43CA-V44CA weak sqntl
!assign (resid 17 and name cb ) (resid 15 and name ca ) 4 3 3 !T43CB-R41CA weak med
assign (resid 17 and name cg2 ) (resid 17 and name ca ) 3.35 2.35 2.35 !T43CG2-CA med intra
assign (resid 18 and name ca ) (resid 17 and name c ) 3.35 2.35 2.35 !V44CA-T43C med sqntl
assign (resid 18 and name ca ) (resid 17 and name ca ) 4 3 3 !V44CA-T43CA weak sqntl
assign (resid 18 and name ca ) (resid 18 and name cb) 2.9 1.9 1.9 !V44CA-CB strong intra
assign (resid 18 and name ca ) (resid 19 and name ca) 4 3 3 !V44CA-A45CA weak sqntl
assign (resid 18 and name cb) (resid 18 and name ca ) 2.9 1.9 1.9 !V44CB-CA strong intra
assign (resid 18 and name cb) (resid 19 and name ca ) 3.35 2.35 2.35 !V44CB-A45CA med sqntl
assign (resid 18 and name cg1) (resid 19 and name cb ) 4 3 3 !V44CG1-CB weak intra
assign (resid 18 and name cg2) (resid 17 and name ca ) 3.35 2.35 2.35 !V44CG2-T43CA med sqntl
assign (resid 19 and name ca) (resid 18 and name ca ) 3.35 2.35 2.35 !A45CA-V44CA med sqntl
assign (resid 19 and name ca) (resid 18 and name cb ) 3.35 2.35 2.35 !A45CA-V44CB med sqntl
assign (resid 19 and name ca) (resid 19 and name c) 3.35 2.35 2.35 !A45CA-C med intra
assign (resid 20 and name ca) (resid 20 and name cg) 3.35 2.35 2.35 !Y46CA-CG med intra
assign (resid 20 and name cg) (resid 20 and name ca) 3.35 2.35 2.35 !Y46CG-CA med intra
assign (resid 21 and name ca) (resid 20 and name ca) 4 3 3 !V47CA-Y46CA weak sqntl
assign (resid 21 and name ca) (resid 21 and name cb) 2.9 1.9 1.9 !V47CA-CB strong intra
assign (resid 21 and name ca) (resid 22 and name ca) 3.35 2.35 2.35 !V47CA-G48CA med sqntl
assign (resid 21 and name cb) (resid 21 and name ca) 2.9 1.9 1.9 !V47CB-CA strong intra
assign (resid 22 and name ca) (resid 21 and name ca) 3.35 2.35 2.35 !G48CA-V47CA med sqntl
assign (resid 22 and name ca) (resid 23 and name ca) 3.35 2.35 2.35 !G48CA-A49CA med sqntl
assign (resid 23 and name ca) (resid 22 and name ca) 3.35 2.35 2.35 !A49CA-G48CA med sqntl
assign (resid 23 and name ca) (resid 24 and name ca) 3.35 2.35 2.35 !A49CA-T50CA med sqntl
assign (resid 24 and name ca) (resid 23 and name ca) 3.35 2.35 2.35 !T50CA-A49CA med sqntl
assign (resid 24 and name ca) (resid 24 and name cg2) 3.35 2.35 2.35 !T50CA-CG2 med intra
assign (resid 24 and name cg2) (resid 27 and name ca) 4 3 3 !T50/54CG2-A53CA weak med
OR (resid 28 and name cg2) (resid 27 and name ca)
assign (resid 28 and name cg2) (resid 28 and name ca) 3.35 2.35 2.35 !T54CG2-CA med intra
assign (resid 28 and name cg2) (resid 29 and name ca) 4 3 3 !T54CG2-G55CA weak sqntl
assign (resid 30 and name c) (resid 30 and name ca) 3.35 2.35 2.35 !K56C-CA med intra
assign (resid 30 and name ca) (resid 30 and name c) 3.35 2.35 2.35 !K56CA-C med intra
assign (resid 30 and name ca) (resid 30 and name cg) 3.35 2.35 2.35 !K56CA-CG med intra
assign (resid 30 and name cg) (resid 30 and name ca) 3.35 2.35 2.35 !K56CG-CA! med intra
assign (resid 31 and name ca) (resid 31 and name cd*) 2.9 1.9 1.9 !W57CA-CDx strong intra
assign (resid 31 and name ca) (resid 31 and name cg) 3.35 2.35 2.35 !W57CA-CG med intra
assign (resid 31 and name cd*) (resid 31 and name ca) 2.9 1.9 1.9 !W57CDx-CA strong intra
assign (resid 31 and name cg) (resid 31 and name ca) 3.35 2.35 2.35 !W57CG-CA med intra
assign (resid 31 and name ca) (resid 32 and name ca) 4 3 3 !W57CA-V58CA weak sqntl
OR (resid 30 and name ca) (resid 32 and name ca)
OR (resid 42 and name ca) (resid 61 and name ca)
OR (resid 59 and name ca) (resid 61 and name ca)
assign (resid 32 and name c) (resid 32 and name cb) 3.35 2.35 2.35 !V58C-CB med intra
assign (resid 32 and name ca) (resid 32 and name cb) 2.9 1.9 1.9 !V58CA-CB strong intra
assign (resid 32 and name cb) (resid 31 and name ca) 4 3 3 !V58CB-W57CA weak med
assign (resid 32 and name cb) (resid 32 and name c) 3.35 2.35 2.35 !V58CB-C med intra
assign (resid 32 and name cb) (resid 32 and name ca) 2.9 1.9 1.9 !V58CB-CA strong intra
assign (resid 32 and name cb) (resid 33 and name ca) 4 3 3 !V58CB-G59CA med sqntl
assign (resid 33 and name ca) (resid 34 and name ca) 2.9 1.9 1.9 !G59CA-V60CA strong sqntl
assign (resid 33 and name ca) (resid 34 and name cb) 3.35 2.35 2.35 !G59CA-V60CB med sqntl
assign (resid 34 and name ca) (resid 33 and name ca) 2.9 1.9 1.9 !V60CA-G59CA strong sqntl
assign (resid 34 and name ca) (resid 34 and name cb) 2.9 1.9 1.9 !V60CA-CB strong intra
assign (resid 34 and name cb) (resid 33 and name ca) 3.35 2.35 2.35 !V60CB-G59CA med sqntl
assign (resid 34 and name cb) (resid 34 and name ca) 2.9 1.9 1.9 !V60CB-CA strong intra
assign (resid 34 and name cg1) (resid 18 and name ca) 4 3 3 !V60CG1-V44CA weak intra
assign (resid 34 and name cg2) (resid 34 and name ca) 3.35 2.35 2.35 !V60CG2-CA med intra
assign (resid 35 and name ca) (resid 35 and name cb) 2.9 1.9 1.9 !I61CA-CB strong intra
assign (resid 35 and name cb) (resid 35 and name ca) 2.9 1.9 1.9 !I61CB-CA strong intra
assign (resid 35 and name cb) (resid 35 and name cd1) 3.35 2.35 2.35 !I61CB-CD1 med intra
assign (resid 35 and name cb) (resid 35 and name cg1) 2.9 1.9 1.9 !I61CB-CG1 strong intra
assign (resid 35 and name cb) (resid 35 and name c) 3.35 2.35 2.35 !I61CB-D63C med intra
assign (resid 35 and name cd1) (resid 35 and name ca) 3.35 2.35 2.35 !I61CD1-CA med intra
assign (resid 35 and name cd1) (resid 35 and name cb) 3.35 2.35 2.35 ! I61CD1-CB med intra
assign (resid 35 and name cg1) (resid 35 and name cb) 2.9 1.9 1.9 !I61CG1-CB strong intra
assign (resid 36 and name ca) (resid 36 and name cg) 3.35 2.35 2.35 !L62CA-CG med intra
assign (resid 36 and name cb) (resid 36 and name cg) 2.9 1.9 1.9 !L62CA-CG strong intra
assign (resid 36 and name cb) (resid 59 and name ca) 3.35 2.35 2.35 !L62CB-H85CA med long
OR (resid 36 and name cb) (resid 48 and name ca)
OR (resid 36 and name cb) (resid 42 and name ca)
assign (resid 36 and name cd*) (resid 36 and name cg) 3.35 2.35 2.35 !L62CDx-CG med intra
assign (resid 36 and name cg) (resid 36 and name ca) 3.35 2.35 2.35 !L62CG-CA med intra
assign (resid 36 and name cg) (resid 36 and name cb) 2.9 1.9 1.9 !L62CG-CB strong intra
assign (resid 36 and name cg) (resid 59 and name ca) 3.35 2.35 2.35 !L62Cg-H85CA med long
OR (resid 36 and name cg) (resid 48 and name ca)
OR (resid 36 and name cg) (resid 42 and name ca)
assign (resid 38 and name ca) (resid 39 and name ca) 4 3 3 !E64CA-A65CA weak sqntl
assign (resid 38 and name cb) (resid 39 and name ca) 4 3 3 !E64CB-A65CA weak sqntl
assign (resid 39 and name cb) (resid 41 and name ca) 4 3 3 !A65CB-G67CA weak med corrected
assign (resid 41 and name ca) (resid 39 and name ca) 4 3 3 !G67CA-A65CB weak med corrected
assign (resid 42 and name ce) (resid 43 and name ca) 4 3 3 !K68ce-N69ca weak sqnt
assign (resid 43 and name ca) (resid 42 and name ce) 4 3 3 !N69ca-K68ce weak sqntl
assign (resid 43 and name ca) (resid 41 and name ca) 4 3 3 !N69CA-G67CA weak med corrected
assign (resid 44 and name ca) (resid 44 and name cb) 4 3 3 !D70CA-CB weak intra
assign (resid 44 and name cb) (resid 44 and name ca) 4 3 3 !D70CB-CA weak intra
assign (resid 45 and name ca) (resid 51 and name ca) 4 3 3 !G71ca-K77ca weak long
OR (resid 45 and name ca) (resid 36 and name ca)
assign (resid 47 and name ca) (resid 47 and name cb) 2.9 1.9 1.9 !V73CA-CB strong intra
assign (resid 52 and name ca) (resid 52 and name cg) 3.35 2.35 2.35 !Y78CA-CG med intra
assign (resid 52 and name cg) (resid 52 and name ca) 3.35 2.35 2.35 !Y78CG-CA med intra
assign (resid 53 and name c) (resid 53 and name ca) 2.9 1.9 1.9 !F79C-CA strong intra
assign (resid 53 and name ca) (resid 53 and name c) 2.9 1.9 1.9 !F79CA-C strong intra
assign (resid 53 and name ca) (resid 53 and name cd1) 3.35 2.35 2.35 !F79CA-CD1 med intra
assign (resid 53 and name ca) (resid 53 and name ce*) 3.35 2.35 2.35 !F79CA-CE med intra
assign (resid 53 and name ca) (resid 53 and name cg) 2.9 1.9 1.9 !F79CA-CG strong intra
assign (resid 53 and name ca) (resid 53 and name cz) 3.35 2.35 2.35 !F79CA-CZ med intra
assign (resid 53 and name cd*) (resid 53 and name ca) 3.35 2.35 2.35 !F79CDs-CA med intra
assign (resid 53 and name ce*) (resid 53 and name ca) 3.35 2.35 2.35 !F79CE-CA med intra
assign (resid 53 and name cg) (resid 53 and name ca) 2.9 1.9 1.9 !F79CG-CA strong intra
assign (resid 57 and name ca) (resid 41 and name ca) 4 3 3 !E83CA-G67CA weak long
assign (resid 58 and name ca) (resid 59 and name ca) 3.35 2.35 2.35 !G84CA-H85CA med sqntl
OR (resid 60 and name ca) (resid 59 and name ca)
assign (resid 59 and name ca) (resid 58 and name ca) 3.35 2.35 2.35 !H85CA-G84CA med sqntl
OR (resid 59 and name ca) (resid 60 and name ca)
assign (resid 61 and name ca) (resid 61 and name cb) 3.35 2.35 2.35 !I87CA-CB med intra
assign (resid 61 and name cb) (resid 42 and name ca) 4 3 3 !I87CB-K68CA weak sqntl
assign (resid 61 and name cb) (resid 61 and name ca) 3.35 2.35 2.35 !I87CB-CA med intra
assign (resid 61 and name cb) (resid 61 and name cd1) 4 3 3 !I87CB-CD1 weak intra
assign (resid 61 and name cd1) (resid 61 and name cb) 4 3 3 !I87CD1-CB weak intra
assign (resid 62 and name ca) (resid 62 and name cg) 3.35 2.35 2.35 !F88CA-CG med intra
assign (resid 62 and name cg) (resid 62 and name ca) 3.35 2.35 2.35 !F88CG-CA med intra
assign (resid 63 and name ca) (resid 63 and name cb) 2.9 1.9 1.9 !V89CA-CB strong intra
assign (resid 63 and name cb) (resid 63 and name ca) 2.9 1.9 1.9 !V89CB-CA strong intra
assign (resid 70 and name ca) (resid 70 and name cb) 2.9 1.9 1.9 !V96CA-CB strong intra
assign (resid 70 and name cb) (resid 70 and name ca) 2.9 1.9 1.9 !V96CB-CA strong intra
assign (resid 70 and name cg1) (resid 70 and name ca) 3.35 2.35 2.35 !V96CG1-CA med intra
! File:2CAP_500ms.list
assign (resid 1 and name ca ) (resid 1 and name cd1) 4.6 3.6 3.6 !L27CA-CD1 weak intra
assign (resid 1 and name cb ) (resid 1 and name cd1) 3.825 2.825 2.825 !L27CB-CD1 med intra
assign (resid 1 and name cb ) (resid 18 and name cb ) 4.6 3.6 3.6 !L27cb-V44cb/V35cb weak long
OR (resid 1 and name cb ) (resid 9 and name cb )
assign (resid 1 and name cb ) (resid 70 and name ca ) 4.6 3.6 3.6 !L27CB-V96CA weak long 95%
assign (resid 3 and name ca ) (resid 3 and name cb ) 3.4 2.4 2.4 !V29CA-CB strong intra
assign (resid 3 and name ca ) (resid 4 and name ca ) 3.825 2.825 2.825 !V29CA-G30CA med sqntl
assign (resid 3 and name cb ) (resid 1 and name cd1 ) 4.6 3.6 3.6 !V29CB-L27CD1 weak med
assign (resid 3 and name cb ) (resid 3 and name ca ) 3.4 2.4 2.4 !V29CB-CA strong intra
assign (resid 4 and name ca ) (resid 3 and name ca ) 3.825 2.825 2.825 !G30CA-V29CA med sqntl
assign (resid 4 and name ca ) (resid 18 and name ca ) 4.6 3.6 3.6 !G30CA-V44CA weak long
assign (resid 4 and name ca ) (resid 18 and name cb ) 3.825 2.825 2.825 ! G30CA-V44CB med long vio, but it should be in this range
OR (resid 22 and name ca ) (resid 18 and name cb )
OR (resid 49 and name ca ) (resid 18 and name cb )
OR (resid 60 and name ca ) (resid 18 and name cb )
OR (resid 4 and name ca ) (resid 9 and name cb )
OR (resid 22 and name ca ) (resid 9 and name cb )
OR (resid 49 and name ca ) (resid 9 and name cb )
OR (resid 60 and name ca ) (resid 9 and name cb )
assign (resid 7 and name ca ) (resid 7 and name cb ) 3.4 2.4 2.4 !V33CA-CB strong intra
assign (resid 7 and name ca ) (resid 18 and name ca ) 4.6 3.6 3.6 !V33CA-V44CA weak long
OR (resid 62 and name ca ) (resid 18 and name cb )
OR (resid 71 and name ca ) (resid 18 and name cb )
assign (resid 7 and name cb ) (resid 16 and name ca ) 4.6 3.6 3.6 !V33CB-G42CA weak long
OR (resid 10 and name cb ) (resid 16 and name ca )
assign (resid 8 and name ca ) (resid 10 and name cb ) 4.6 3.6 3.6 !E34CA-I36CB weak med
OR (resid 8 and name ca ) (resid 7 and name cb )
assign (resid 8 and name cb ) (resid 10 and name cb ) 4.6 3.6 3.6 !E34CB-I36CB weak med
OR (resid 8 and name cb ) (resid 12 and name cb )
assign (resid 9 and name ca ) (resid 67 and name ca ) 3.825 2.825 2.825 !V35ca-Q93ca med long
OR (resid 9 and name ca ) (resid 26 and name ca )
OR (resid 9 and name ca ) (resid 55 and name ca )
OR (resid 70 and name ca ) (resid 67 and name ca )
OR (resid 70 and name ca ) (resid 26 and name ca )
OR (resid 70 and name ca ) (resid 55 and name ca )
assign (resid 9 and name ca ) (resid 9 and name cb ) 3.4 2.4 2.4 !V35CA-CB strong intra
OR (resid 70 and name ca ) (resid 70 and name cb )
assign (resid 9 and name cb ) (resid 9 and name ca ) 3.4 2.4 2.4 ! V35CB-CA strong intra
OR (resid 70 and name cb ) (resid 64 and name ca )
assign (resid 10 and name ca ) (resid 10 and name cb ) 3.825 2.825 2.825 ! I36CA-CB med intra
assign (resid 10 and name ca ) (resid 10 and name cd1 ) 4.6 3.6 3.6 !I36CA-CD1 weak intra
assign (resid 10 and name cb ) (resid 8 and name cb ) 4.6 3.6 3.6 !I36CB-E34CB/K38CB weak med
OR (resid 10 and name cb ) (resid 12 and name cb )
assign (resid 10 and name cb ) (resid 9 and name ca ) 4.6 3.6 3.6 !I36CB-V35CA weak sqntl
assign (resid 10 and name cb ) (resid 10 and name ca ) 3.825 2.825 2.825 !I36CB-CA med intra
assign (resid 10 and name cd1 ) (resid 10 and name ca ) 4.6 3.6 3.6 ! I36CD1-CA weak intra
assign (resid 13 and name ca ) (resid 10 and name cb ) 4.6 3.6 3.6 !G39CA-I36CB med long vio, but should be
OR (resid 33 and name ca ) (resid 10 and name cb )
OR (resid 58 and name ca ) (resid 10 and name cb )
OR (resid 60 and name ca ) (resid 10 and name cb )
OR (resid 29 and name ca ) (resid 10 and name cb )
assign (resid 14 and name ca ) (resid 16 and name ca ) 4.6 3.6 3.6 ! H40CA-G42CA weak med
assign (resid 14 and name cb ) (resid 8 and name ca ) 4.6 3.6 3.6 ! H40cb-E34ca weak long
OR (resid 51 and name cb ) (resid 43 and name ca )
OR (resid 51 and name cb ) (resid 8 and name ca )
OR (resid 14 and name cb ) (resid 43 and name ca )
assign (resid 14 and name cb ) (resid 36 and name ca ) 3.825 2.825 2.825 !H40CB-L62ca med sqntl
OR (resid 14 and name cb ) (resid 51 and name ca )
OR (resid 14 and name cb ) (resid 55 and name ca )
assign (resid 14 and name cb ) (resid 16 and name ca ) 4.6 3.6 3.6 !H40CB-G42CA weak med corrected
assign (resid 15 and name ca ) (resid 14 and name cb ) 3.825 2.825 2.825 !R41CA-H40CB med sqntl
assign (resid 55 and name ca ) (resid 54 and name cb ) 4.6 3.6 3.6 !C81ca-T80cb med sqntl corrected
OR (resid 53 and name ca ) (resid 54 and name cb )
assign (resid 15 and name cb ) (resid 36 and name cg ) 4.6 3.6 3.6 !R41CB-L62CG weak long, sure
OR (resid 38 and name cb ) (resid 36 and name cg )
OR (resid 8 and name cb ) (resid 36 and name cg )
OR (resid 12 and name cb ) (resid 36 and name cg )
assign (resid 16 and name ca ) (resid 14 and name ca ) 4.6 3.6 3.6 !G42CA-H40CA/L62ca weak med
OR (resid 16 and name ca ) (resid 36 and name ca )
assign (resid 16 and name ca ) (resid 35 and name cb ) 4.6 3.6 3.6 !G42CA-I61CB weak long
assign (resid 16 and name ca ) (resid 36 and name cb ) 4.6 3.6 3.6 !G42CA-L62CB weak long
assign (resid 16 and name ca ) (resid 36 and name cg ) 4.6 3.6 3.6 !G42CA-L62CG weak long
assign (resid 17 and name ca ) (resid 15 and name ca ) 4.6 3.6 3.6 !T43CA-R41CA med med corrected
assign (resid 17 and name ca ) (resid 16 and name ca ) 3.825 2.825 2.825 !T43CA-G42CA med sqntl
assign (resid 17 and name ca ) (resid 18 and name ca ) 3.825 2.825 2.825 !T43CA-V44CA med sqntl
assign (resid 17 and name ca ) (resid 18 and name cg2 ) 3.825 2.825 2.825 ! T43CA-V44CG2 med sqntl
OR (resid 17 and name ca ) (resid 34 and name cg1 )
OR (resid 17 and name ca ) (resid 3 and name cg1 )
OR (resid 17 and name ca ) (resid 18 and name cg2 )
OR (resid 17 and name ca ) (resid 7 and name cg1 )
OR (resid 32 and name ca ) (resid 7 and name cg1 )
OR (resid 32 and name ca ) (resid 18 and name cg2 )
OR (resid 32 and name ca ) (resid 3 and name cg1 )
OR (resid 32 and name ca ) (resid 34 and name cg1 )
assign (resid 17 and name ca ) (resid 19 and name ca ) 4.6 3.6 3.6 !T43CA-A45CA weak med
OR (resid 34 and name ca ) (resid 19 and name ca )
OR (resid 32 and name ca ) (resid 19 and name ca )
assign (resid 17 and name cb ) (resid 18 and name ca ) 4.6 3.6 3.6 !T43CB-V44CA weak sqntl
assign (resid 17 and name cb ) (resid 18 and name cb ) 4.6 3.6 3.6 !T43CB-V44CB/K77cb-T880cb med sqntl/long
OR (resid 51 and name cb ) (resid 54 and name cb )
assign (resid 18 and name ca ) (resid 7 and name ca ) 4.6 3.6 3.6 !V44CA-V33CA weak long
assign (resid 18 and name ca ) (resid 17 and name ca ) 3.825 2.825 2.825 !V44CA-T43CA med sqntl;V44CA-V60CA med long
OR (resid 18 and name ca ) (resid 34 and name ca )
assign (resid 18 and name ca ) (resid 17 and name cb ) 4.6 3.6 3.6 !V44CA-T43CB weak sqntl
assign (resid 18 and name ca ) (resid 18 and name cb ) 3.4 2.4 2.4 !V44CA-CB strong intra
assign (resid 18 and name ca ) (resid 19 and name ca ) 3.825 2.825 2.825 !V44CA-A45CA med sqntl
assign (resid 18 and name ca ) (resid 33 and name ca ) 4.6 3.6 3.6 !V44CA-G59CA weak long
assign (resid 18 and name ca ) (resid 34 and name cb ) 4.6 3.6 3.6 !V44CA-V60CB weak long
assign (resid 18 and name ca ) (resid 17 and name ca ) 3.825 2.825 2.825 !V44CA-T43CA med sqntl ;V44CA-V60 med long
OR (resid 18 and name ca ) (resid 34 and name ca )
OR (resid 18 and name ca ) (resid 32 and name ca )
assign (resid 18 and name cb ) (resid 3 and name cg1 ) 4.6 3.6 3.6 !V44CB-V29cg1 weak long
OR (resid 18 and name cb ) (resid 34 and name cg1 )
OR (resid 18 and name cb ) (resid 17 and name cg2 )
assign (resid 18 and name cb ) (resid 18 and name ca ) 4.6 3.6 3.6 !V44CB-CA weak intra
assign (resid 18 and name cb ) (resid 19 and name ca ) 3.825 2.825 2.825 !V44CB-A45CA med sqntl
assign (resid 18 and name cg2 ) (resid 34 and name cb ) 4.6 3.6 3.6 !V44CG2-V60CB weak long
assign (resid 19 and name ca ) (resid 3 and name ca ) 4.6 3.6 3.6 !A45CA-V29CA weak long
assign (resid 19 and name ca ) (resid 18 and name ca ) 3.825 2.825 2.825 !A45CA-V44CA med sqntl
assign (resid 19 and name ca ) (resid 18 and name cb ) 3.825 2.825 2.825 !A45CA-V44CB med sqntl
assign (resid 19 and name ca ) (resid 20 and name ca ) 3.825 2.825 2.825 !A45CA-Y46CA med sqntl
assign (resid 19 and name ca ) (resid 21 and name ca ) 4.6 3.6 3.6 !A45CA-V47CA weak med
assign (resid 19 and name ca ) (resid 21 and name cb ) 4.6 3.6 3.6 !A45CA-V47CB med med
assign (resid 19 and name ca ) (resid 34 and name ca ) 3.825 2.825 2.825 !A45CA-V60CA med long
OR (resid 19 and name ca ) (resid 17 and name ca )
OR (resid 19 and name ca ) (resid 61 and name ca )
OR (resid 19 and name ca ) (resid 35 and name ca )
OR (resid 19 and name ca ) (resid 52 and name ca )
assign (resid 20 and name ca ) (resid 18 and name ca ) 4.6 3.6 3.6 !Y46CA-V44CA weak med
OR (resid 68 and name ca ) (resid 18 and name ca )
OR (resid 57 and name ca ) (resid 18 and name ca )
assign (resid 20 and name ca ) (resid 18 and name cb ) 4.6 3.6 3.6 !Y46CA-V44CB weak med
OR (resid 7 and name ca ) (resid 18 and name cb )
OR (resid 68 and name ca ) (resid 18 and name cb )
OR (resid 57 and name ca ) (resid 18 and name cb )
assign (resid 20 and name ca ) (resid 19 and name ca ) 3.825 2.825 2.825 !Y46CA-A45CA med sqntl
assign (resid 20 and name ca ) (resid 21 and name cb ) 4.6 3.6 3.6 !Y46CA-V47CB weak sqntl
OR (resid 7 and name ca ) (resid 21 and name cb )
OR (resid 68 and name ca ) (resid 21 and name cb )
OR (resid 57 and name ca ) (resid 21 and name cb )
assign (resid 21 and name ca ) (resid 20 and name ca ) 3.825 2.825 2.825 !V47CA-Y46CA med sqntl
assign (resid 21 and name ca ) (resid 21 and name cb ) 3.4 2.4 2.4 !V47CA-CB strong intra
assign (resid 21 and name cb ) (resid 23 and name ca ) 4.6 3.6 3.6 !V47CB-A49ca med med
assign (resid 21 and name cb ) (resid 21 and name ca ) 3.4 2.4 2.4 !V47CB-CA strong intra
assign (resid 21 and name cb ) (resid 19 and name cb ) 4.6 3.6 3.6 !V47CB-V45cb weak sqntl
assign (resid 21 and name cg1 ) (resid 20 and name ca ) 4.6 3.6 3.6 !V47CG1-Y46CA weak sqntl
OR (resid 3 and name cg2 ) (resid 20 and name ca )
assign (resid 21 and name cg1 ) (resid 21 and name cb ) 4.6 3.6 3.6 !V47CG1-CB weak intra
assign (resid 22 and name ca ) (resid 23 and name ca ) 3.825 2.825 2.825 !G48CA-A49CA med sqntl
assign (resid 23 and name ca ) (resid 22 and name ca ) 3.825 2.825 2.825 !A49CA-G48CA med sqntl
assign (resid 23 and name ca ) (resid 24 and name ca ) 3.825 2.825 2.825 !A49CA-T50CA med sqntl
assign (resid 23 and name ca ) (resid 24 and name cg2 ) 3.825 2.825 2.825 !A49CA-T50CG2 med sqntl
assign (resid 24 and name ca ) (resid 24 and name cg2 ) 4.6 3.6 3.6 !T50CA-CG2 weak intra
assign (resid 24 and name cb ) (resid 27 and name ca ) 4.6 3.6 3.6 !T50CB-A53CA weak med
OR (resid 17 and name cb ) (resid 27 and name ca )
assign (resid 24 and name cg2 ) (resid 23 and name ca ) 3.825 2.825 2.825 !T50CG2-A49CA med long
OR (resid 24 and name cg2 ) (resid 27 and name ca )
OR (resid 28 and name cg2 ) (resid 23 and name ca )
OR (resid 28 and name cg2 ) (resid 27 and name ca )
assign (resid 24 and name cg2 ) (resid 24 and name ca ) 3.825 2.825 2.825 !T50CG-CA med intra
assign (resid 24 and name cg2 ) (resid 28 and name ca ) 4.6 3.6 3.6 !T50CG2-T54CA med med
OR (resid 47 and name cg2 ) (resid 28 and name ca )
OR (resid 28 and name cg2 ) (resid 28 and name ca )
assign (resid 25 and name cd1 ) (resid 25 and name cg ) 4.6 3.6 3.6 ! L51CD-CG weak intra
assign (resid 27 and name ca ) (resid 28 and name ca ) 3.825 2.825 2.825 !A53CA-T54CA med sqntl
assign (resid 29 and name ca ) (resid 28 and name cg2 ) 4.6 3.6 3.6 !G55CA-T54CG2 weak sqntl
assign (resid 29 and name ca ) (resid 30 and name cb ) 3.825 2.825 2.825 !G55CA-K56CB med sqntl
assign (resid 30 and name ca ) (resid 23 and name ca ) 4.6 3.6 3.6 !K56CA-A49CA weak long
OR (resid 42 and name ca ) (resid 23 and name ca )
OR (resid 48 and name ca ) (resid 23 and name ca )
OR (resid 59 and name ca ) (resid 23 and name ca )
assign (resid 30 and name ca ) (resid 30 and name cg ) 3.825 2.825 2.825 !K56CA-CG med intra
assign (resid 30 and name cb ) (resid 29 and name ca ) 3.825 2.825 2.825 !K56CB-G55CA med sqntl
assign (resid 30 and name ce ) (resid 30 and name cg ) 3.825 2.825 2.825 ! K56CE-CG med intra
assign (resid 30 and name cg ) (resid 30 and name ce ) 3.825 2.825 2.825 !K56CG-CE med intra
assign (resid 31 and name ca ) (resid 32 and name ca ) 3.825 2.825 2.825 !W57CA-V58CA med sqntl
assign (resid 31 and name ca ) (resid 32 and name cb ) 4.6 3.6 3.6 !W57CA-V58CB med med
assign (resid 32 and name ca ) (resid 18 and name cb ) 3.825 2.825 2.825 !V58CA-V44CB med long
assign (resid 32 and name ca ) (resid 31 and name ca ) 3.825 2.825 2.825 !V58CA-W57CA med sqntl
OR (resid 32 and name ca ) (resid 30 and name ca )
assign (resid 32 and name ca ) (resid 32 and name cb ) 3.4 2.4 2.4 !V58CA-CB strong intra
assign (resid 32 and name cb ) (resid 32 and name ca ) 3.4 2.4 2.4 !V58CB-CA strong intra
assign (resid 33 and name ca ) (resid 34 and name cb ) 3.825 2.825 2.825 !G59CA-V60CB med sqntl
assign (resid 34 and name ca ) (resid 18 and name ca ) 3.825 2.825 2.825 !V60CA-V44CA med long
assign (resid 34 and name ca ) (resid 34 and name cb ) 3.4 2.4 2.4 !V60CA-CB strong intra
assign (resid 34 and name ca ) (resid 36 and name cg ) 3.825 2.825 2.825 !V60CA-L62CG med med
OR (resid 35 and name ca ) (resid 36 and name cg )
OR (resid 52 and name ca ) (resid 36 and name cg )
OR (resid 61 and name ca ) (resid 36 and name cg )
OR (resid 17 and name ca ) (resid 36 and name cg )
assign (resid 34 and name ca ) (resid 55 and name ca ) 3.825 2.825 2.825 !V60ca-C81ca med long
OR (resid 34 and name ca ) (resid 26 and name ca )
OR (resid 34 and name ca ) (resid 53 and name ca )
OR (resid 35 and name ca ) (resid 53 and name ca )
OR (resid 35 and name ca ) (resid 26 and name ca )
OR (resid 35 and name ca ) (resid 55 and name ca )
OR (resid 52 and name ca ) (resid 53 and name ca )
OR (resid 52 and name ca ) (resid 26 and name ca )
OR (resid 52 and name ca ) (resid 55 and name ca )
OR (resid 61 and name ca ) (resid 53 and name ca )
OR (resid 61 and name ca ) (resid 26 and name ca )
OR (resid 61 and name ca ) (resid 55 and name ca )
assign (resid 34 and name cb ) (resid 33 and name ca ) 3.4 2.4 2.4 !V60CB-G59CA strong sqntl
assign (resid 34 and name cb ) (resid 34 and name ca ) 3.4 2.4 2.4 !V60CB-CA strong intra
assign (resid 34 and name cb ) (resid 35 and name cb ) 4.6 3.6 3.6 !V60CB-I61CB weak sqntl
assign (resid 34 and name cb ) (resid 61 and name cg1 ) 4.6 3.6 3.6 !V60CB-I87cg1 weak med
assign (resid 34 and name cg1 ) (resid 18 and name ca ) 4.6 3.6 3.6 !V60cg1-V44ca weak long
assign (resid 34 and name cg1 ) (resid 59 and name ca ) 4.6 3.6 3.6 !V60CG1-H85CA weak long
OR (resid 3 and name cg1 ) (resid 59 and name ca )
OR (resid 18 and name cg2 ) (resid 59 and name ca )
OR (resid 18 and name cg2 ) (resid 30 and name ca )
OR (resid 3 and name cg1 ) (resid 30 and name ca )
OR (resid 34 and name cg1 ) (resid 30 and name ca )
OR (resid 34 and name cg1 ) (resid 31 and name ca )
OR (resid 3 and name cg1 ) (resid 31 and name ca )
OR (resid 18 and name cg2 ) (resid 31 and name ca )
assign (resid 34 and name cg1 ) (resid 34 and name ca ) 3.825 2.825 2.825 !V60CG1-V60CA med intra;V60CG1-I61CA med sqntl; V60CG1-I87CA med long
OR (resid 34 and name cg1 ) (resid 35 and name ca )
OR (resid 34 and name cg1 ) (resid 61 and name ca )
assign (resid 34 and name cg1 ) (resid 60 and name ca ) 4.6 3.6 3.6 !V60CG1-G86CA weak long corrected
assign (resid 35 and name ca ) (resid 35 and name cb ) 3.4 2.4 2.4 !I61CA-CB strong intra
assign (resid 35 and name ca ) (resid 36 and name cb ) 3.825 2.825 2.825 !I61CA-L62CB med sqntl
OR (resid 35 and name ca ) (resid 56 and name cb )
OR (resid 35 and name ca ) (resid 25 and name cb )
OR (resid 52 and name ca ) (resid 25 and name cb )
OR (resid 52 and name ca ) (resid 56 and name cb )
OR (resid 52 and name ca ) (resid 36 and name cb )
OR (resid 61 and name ca ) (resid 25 and name cb )
OR (resid 61 and name ca ) (resid 56 and name cb )
OR (resid 61 and name ca ) (resid 36 and name cb )
OR (resid 34 and name ca ) (resid 25 and name cb )
OR (resid 34 and name ca ) (resid 56 and name cb )
OR (resid 34 and name ca ) (resid 36 and name cb )
assign (resid 35 and name cb ) (resid 33 and name ca ) 4.6 3.6 3.6 !I61CB-G59CA weak med
assign (resid 35 and name cb ) (resid 34 and name cb ) 3.825 2.825 2.825 !I61CB-V60CB med sqntl
assign (resid 35 and name cb ) (resid 35 and name ca ) 3.4 2.4 2.4 !I61CB-CA strong intra
assign (resid 35 and name cb ) (resid 35 and name cd1 ) 3.4 2.4 2.4 !I61CB-CD1 strong intra
assign (resid 35 and name cb ) (resid 35 and name cg1 ) 3.825 2.825 2.825 !I61CB-CG1 med intra
assign (resid 35 and name cb ) (resid 36 and name cg ) 3.825 2.825 2.825 !I61CB-L62CG med sqntl
assign (resid 35 and name cb ) (resid 55 and name ca ) 3.825 2.825 2.825 !I61CB-C81ca med long
OR (resid 35 and name cb ) (resid 53 and name ca )
OR (resid 35 and name cb ) (resid 42 and name ca )
assign (resid 35 and name cb ) (resid 59 and name cb ) 4.6 3.6 3.6 !I61CB-H85cb weak long
assign (resid 35 and name cd1 ) (resid 18 and name ca ) 4.6 3.6 3.6 !I61CD1-V44CA med long corrected
assign (resid 35 and name cd1 ) (resid 33 and name ca ) 4.6 3.6 3.6 !I61CD1-G59CA med med
OR (resid 35 and name cd1 ) (resid 13 and name ca )
OR (resid 35 and name cd1 ) (resid 29 and name ca )
OR (resid 61 and name cd1 ) (resid 33 and name ca )
OR (resid 61 and name cd1 ) (resid 13 and name ca )
OR (resid 61 and name cd1 ) (resid 29 and name ca )
assign (resid 35 and name cd1 ) (resid 34 and name cb ) 3.825 2.825 2.825 !I61CD1-V60CB med long
assign (resid 35 and name cd1 ) (resid 35 and name cb ) 3.4 2.4 2.4 !I61CD1-CB strong intra
assign (resid 35 and name cd1 ) (resid 36 and name cg ) 3.825 2.825 2.825 !I61CD1-L62CG med sqntl
OR (resid 61 and name cd1 ) (resid 36 and name cg )
assign (resid 35 and name cd1 ) (resid 55 and name cb ) 3.4 2.4 2.4 !I61cd1-C81cb weak long
OR (resid 35 and name cd1 ) (resid 15 and name cb )
OR (resid 35 and name cd1 ) (resid 40 and name cb )
OR (resid 35 and name cd1 ) (resid 51 and name cb )
OR (resid 61 and name cd1 ) (resid 55 and name cb )
OR (resid 61 and name cd1 ) (resid 15 and name cb )
OR (resid 61 and name cd1 ) (resid 40 and name cb )
OR (resid 61 and name cd1 ) (resid 51 and name cb )
assign (resid 35 and name cg1 ) (resid 19 and name ca ) 4.6 3.6 3.6 !I61CG1-A45CA weak long
assign (resid 35 and name cg1 ) (resid 35 and name cb ) 4.6 3.6 3.6 !I61CG1-CB weak intra
assign (resid 35 and name cd1 ) (resid 35 and name ca ) 3.825 2.825 2.825 !I61CD1-CA med intra
assign (resid 36 and name cb ) (resid 16 and name ca ) 4.6 3.6 3.6 !L62CB-G42CA weak long
assign (resid 36 and name cb ) (resid 34 and name ca ) 4.6 3.6 3.6 !L62CB-V60CA weak med
OR (resid 36 and name cb ) (resid 35 and name ca )
OR (resid 36 and name cb ) (resid 52 and name ca )
OR (resid 36 and name cb ) (resid 61 and name ca )
OR (resid 36 and name cb ) (resid 17 and name ca )
assign (resid 36 and name cb ) (resid 36 and name cg ) 3.4 2.4 2.4 !L62CB-CG strong intra
assign (resid 36 and name cd* ) (resid 36 and name ca ) 4.6 3.6 3.6 !L62CD-CA weak intra
assign (resid 36 and name cd* ) (resid 62 and name ca ) 4.6 3.6 3.6 !L62CD-D63CA weak sqntl
OR (resid 36 and name cd* ) (resid 7 and name ca )
OR (resid 17 and name cg2 ) (resid 62 and name ca )
OR (resid 17 and name cg2 ) (resid 7 and name ca )
assign (resid 36 and name cd* ) (resid 36 and name cg ) 4.6 3.6 3.6 !L62CD-CG weak intra
assign (resid 36 and name cg ) (resid 15 and name ca ) 3.825 2.825 2.825 !L62CG-R41ca med long
OR (resid 36 and name cg ) (resid 14 and name ca )
assign (resid 36 and name cg ) (resid 34 and name cb ) 3.825 2.825 2.825 !L62CG-V60CB med med
assign (resid 36 and name cg ) (resid 36 and name cb ) 4.6 3.6 3.6 !L62CG-CB weak intra
assign (resid 36 and name cg ) (resid 39 and name ca ) 4.6 3.6 3.6 !L62CG-A65CA weak med
OR (resid 25 and name cg ) (resid 39 and name ca )
assign (resid 36 and name cg ) (resid 41 and name ca ) 4.6 3.6 3.6 !L62CG-G67ca weak med
OR (resid 25 and name cg ) (resid 41 and name ca )
assign (resid 36 and name cg ) (resid 60 and name ca ) 4.6 3.6 3.6 ! L62CG-G86CA weak long
OR (resid 36 and name cg ) (resid 22 and name ca )
OR (resid 36 and name cg ) (resid 49 and name ca )
OR (resid 36 and name cg ) (resid 58 and name ca )
assign (resid 37 and name ca ) (resid 16 and name ca ) 4.6 3.6 3.6 !D63CA-G42CA weak long
assign (resid 38 and name ca ) (resid 39 and name ca ) 4.6 3.6 3.6 !E64CA-A65CA weak sqntl
OR (resid 56 and name ca ) (resid 39 and name ca )
assign (resid 38 and name cb ) (resid 39 and name ca ) 3.825 2.825 2.825 !E64CB-A65CA med sqntl
OR (resid 15 and name cb ) (resid 39 and name ca )
OR (resid 12 and name cb ) (resid 39 and name ca )
assign (resid 39 and name ca ) (resid 36 and name ca ) 4.6 3.6 3.6 !A65CA-L62CA weak med
assign (resid 39 and name ca ) (resid 36 and name cb ) 4.6 3.6 3.6 !A65CA-L62CB weak med
OR (resid 39 and name ca ) (resid 25 and name cb )
assign (resid 39 and name ca ) (resid 37 and name ca ) 4.6 3.6 3.6 !A65CA-D63CA weak med
assign (resid 39 and name ca ) (resid 40 and name cd ) 4.6 3.6 3.6 !A65CA-K66CD weak sqntl
assign (resid 39 and name ca ) (resid 59 and name cb ) 4.6 3.6 3.6 !A65CA-H85CB weak long
assign (resid 39 and name cb ) (resid 41 and name ca ) 3.825 2.825 2.825 !A65CB-G67CA med med
assign (resid 39 and name cb ) (resid 59 and name ca ) 4.6 3.6 3.6 !A65CB-H85CA weak long
OR (resid 39 and name cb ) (resid 42 and name ca )
OR (resid 39 and name cb ) (resid 48 and name ca )
OR (resid 39 and name cb ) (resid 59 and name ca )
OR (resid 39 and name cb ) (resid 67 and name ca )
OR (resid 39 and name cb ) (resid 30 and name ca )
OR (resid 68 and name cb ) (resid 59 and name ca )
OR (resid 68 and name cb ) (resid 42 and name ca )
OR (resid 68 and name cb ) (resid 48 and name ca )
OR (resid 68 and name cb ) (resid 59 and name ca )
OR (resid 68 and name cb ) (resid 67 and name ca )
OR (resid 68 and name cb ) (resid 30 and name ca )
assign (resid 40 and name cd ) (resid 39 and name ca ) 4.6 3.6 3.6 !K66CD-A65CA weak sqntl
OR (resid 59 and name cb ) (resid 39 and name ca )
assign (resid 41 and name ca ) (resid 35 and name cd1 ) 3.825 2.825 2.825 !G67CA-I61CD1 med long
OR (resid 41 and name ca ) (resid 61 and name cd1 )
assign (resid 41 and name ca ) (resid 39 and name cb ) 3.825 2.825 2.825 !G67CA-A65CB med med
assign (resid 42 and name ca ) (resid 61 and name cb ) 3.825 2.825 2.825 !K68CA-I87CB med long
OR (resid 42 and name ca ) (resid 45 and name ca )
OR (resid 55 and name ca ) (resid 45 and name ca )
OR (resid 55 and name ca ) (resid 61 and name cb )
OR (resid 67 and name ca ) (resid 68 and name cb )
OR (resid 53 and name ca ) (resid 61 and name cb )
OR (resid 53 and name ca ) (resid 45 and name ca )
assign (resid 43 and name ca ) (resid 42 and name ce ) 4.6 3.6 3.6 !N69ca-K68ce weak sqntl
OR (resid 64 and name ca ) (resid 1 and name cb)
OR (resid 8 and name ca ) (resid 1 and name cb)
assign (resid 44 and name ca ) (resid 43 and name cb ) 4.6 3.6 3.6 !D70CA-N69CB weak long
assign (resid 44 and name ca ) (resid 56 and name cb ) 4.6 3.6 3.6 !D70CA-D82CB weak long
OR (resid 50 and name ca ) (resid 56 and name cb )
OR (resid 64 and name ca ) (resid 56 and name cb )
assign (resid 44 and name cb ) (resid 44 and name ca ) 3.825 2.825 2.825 !D70CB-CA med intra
assign (resid 46 and name cg2 ) (reside 51 and name cb ) 4.6 3.6 3.6 !T72cg2-K77cb weak long
OR (resid 46 and name cg2 ) (reside 14 and name cb )
OR (resid 54 and name cg2 ) (reside 14 and name cb )
OR (resid 54 and name cg2 ) (reside 51 and name cb )
assign (resid 51 and name ce ) (resid 46 and name ca ) 4.6 3.6 3.6 !K77ce-T72ca weak long
OR (resid 51 and name ce ) (resid 5 and name ca )
OR (resid 51 and name ce ) (resid 21 and name ca )
assign (resid 53 and name cb ) (resid 33 and name ca ) 4.6 3.6 3.6 !F79cb-G59ca weak long
OR (resid 35 and name cb ) (resid 33 and name ca )
OR (resid 53 and name cb ) (resid 13 and name ca )
OR (resid 35 and name cb ) (resid 13 and name ca )
OR (resid 53 and name cb ) (resid 29 and name ca )
assign (resid 54 and name cb ) (resid 55 and name ca ) 3.825 2.825 2.825 !T80cb-C81ca med sqntl
assign (resid 54 and name cg2 ) (resid 55 and name ca ) 3.825 2.825 2.825 !T80CG2-C81CA med sqntl
OR (resid 54 and name cg2 ) (resid 53 and name ca )
OR (resid 46 and name cg2 ) (resid 67 and name ca )
OR (resid 46 and name cg2 ) (resid 42 and name ca )
assign (resid 56 and name cb ) (resid 54 and name ca ) 4.6 3.6 3.6 !D82CB-T80CA weak med
assign (resid 58 and name ca ) (resid 59 and name ca ) 3.825 2.825 2.825 !G84CA-H85CA med sqntl
OR (resid 60 and name ca ) (resid 59 and name ca )
assign (resid 59 and name ca ) (resid 35 and name cb ) 3.825 2.825 2.825 !H85CA-I61CB med long
OR (resid 59 and name ca ) (resid 37 and name cb )
OR (resid 42 and name ca ) (resid 35 and name cb )
OR (resid 42 and name ca ) (resid 37 and name cb )
OR (resid 48 and name ca ) (resid 35 and name cb )
OR (resid 48 and name ca ) (resid 37 and name cb )
OR (resid 67 and name ca ) (resid 35 and name cb )
OR (resid 67 and name ca ) (resid 37 and name cb )
assign (resid 59 and name ca ) (resid 36 and name cg ) 3.825 2.825 2.825 !H85CA-L62CG med long
OR (resid 59 and name ca ) (resid 25 and name cg )
OR (resid 48 and name ca ) (resid 36 and name cg )
OR (resid 48 and name ca ) (resid 25 and name cg )
OR (resid 67 and name ca ) (resid 36 and name cg )
OR (resid 67 and name ca ) (resid 25 and name cg )
OR (resid 30 and name ca ) (resid 25 and name cg )
OR (resid 31 and name ca ) (resid 25 and name cg )
assign (resid 59 and name ca ) (resid 39 and name ca ) 4.6 3.6 3.6 !H85CA-A65CA weak long corrected
OR (resid 39 and name ca ) (resid 48 and name ca )
OR (resid 39 and name ca ) (resid 67 and name ca )
OR (resid 39 and name ca ) (resid 30 and name ca )
OR (resid 39 and name ca ) (resid 31 and name ca )
assign (resid 59 and name cb ) (resid 35 and name cb ) 4.6 3.6 3.6 !H85CB-I61Cb weak long
assign (resid 59 and name cb ) (resid 39 and name ca ) 4.6 3.6 3.6 !H85CB-A65CA weak long
assign (resid 60 and name ca ) (resid 36 and name cg ) 4.6 3.6 3.6 !G86CA-L62CG weak long
OR (resid 58 and name ca ) (resid 36 and name cg )
assign (resid 60 and name ca ) (resid 59 and name ca ) 3.825 2.825 2.825 !G86CA-H85CA med sqntl
assign (resid 61 and name cb ) (resid 36 and name cg ) 3.825 2.825 2.825 !I87CB-L62CG med long
assign (resid 61 and name cb ) (resid 63 and name cb ) 4.6 3.6 3.6 !I87CB-V89CB weak med
assign (resid 61 and name cd1 ) (resid 42 and name ca ) 3.825 2.825 2.825 !I87CD1-K68CA med long
OR (resid 61 and name cd1 ) (resid 55 and name ca )
OR (resid 35 and name cd1 ) (resid 55 and name ca )
OR (resid 35 and name cd1 ) (resid 67 and name ca )
OR (resid 35 and name cd1 ) (resid 53 and name ca )
OR (resid 35 and name cd1 ) (resid 42 and name ca )
assign (resid 63 and name ca ) (resid 64 and name ca ) 4.6 3.6 3.6 !V89CA-R90CA weak sqntl
assign (resid 63 and name cb ) (resid 61 and name cb ) 4.6 3.6 3.6 !V89CB-I87CB weak med
assign (resid 63 and name cb ) (resid 63 and name ca ) 3.4 2.4 2.4 !V89CB-CA strong intra
assign (resid 63 and name cg1 ) (resid 64 and name cb ) 4.6 3.6 3.6 !V89CG1-R90CB weak sqntl
OR (resid 7 and name cg1 ) (resid 9 and name cb )
OR (resid 7 and name cg1 ) (resid 18 and name cb )
assign (resid 63 and name cg2 ) (resid 61 and name ca ) 4.6 3.6 3.6 !V89CG2-I87CA weak med
OR (resid 63 and name cg2 ) (resid 35 and name ca )
OR (resid 63 and name cg2 ) (resid 52 and name ca )
OR (resid 63 and name cg2 ) (resid 34 and name ca )
OR (resid 63 and name cg2 ) (resid 17 and name ca )
OR (resid 63 and name cg2 ) (resid 32 and name ca )
assign (resid 64 and name ca ) (resid 63 and name cb ) 4.6 3.6 3.6 !R90CA-V89CB weak sqntl
assign (resid 64 and name cb ) (resid 62 and name cb ) 4.6 3.6 3.6 !R90cb-F88cb weak long
OR (resid 9 and name cb ) (resid 62 and name cb )
OR (resid 18 and name cb ) (resid 62 and name cb )
assign (resid 64 and name cd ) (resid 63 and name ca ) 4.6 3.6 3.6 !R90CD-V89CA weak sqntl
assign (resid 65 and name cb ) (resid 63 and name ca ) 4.6 3.6 3.6 !Q91CB-V89CA weak med
OR (resid 61 and name cg1 ) (resid 63 and name ca )
OR (resid 18 and name cg1 ) (resid 63 and name ca )
assign (resid 66 and name ca ) (resid 65 and name cb ) 4.6 3.6 3.6 !S92CA-Q91CB weak sqntl
assign (resid 67 and name ca ) (resid 9 and name ca ) 3.825 2.825 2.825 !Q93CA-V35CA med long
OR (resid 67 and name ca ) (resid 70 and name ca )
OR (resid 42 and name ca ) (resid 70 and name ca )
OR (resid 42 and name ca ) (resid 9 and name ca )
OR (resid 48 and name ca ) (resid 70 and name ca )
OR (resid 48 and name ca ) (resid 9 and name ca )
OR (resid 59 and name ca ) (resid 70 and name ca )
OR (resid 59 and name ca ) (resid 9 and name ca )
assign (resid 68 and name ca ) (resid 70 and name cb ) 4.6 3.6 3.6 !I94CA-V96CB weak med
OR (resid 57 and name ca ) (resid 70 and name cb )
assign (resid 68 and name cd1 ) (resid 18 and name cb ) 4.6 3.6 3.6 !I94cd1-V44cb weak long
assign (resid 68 and name cd1 ) (resid 68 and name ca ) 3.825 2.825 2.825 !I94CD1-CA med intra
assign (resid 68 and name cd1 ) (resid 70 and name ca ) 4.6 3.6 3.6 !I94CD1-V96CA weak med
assign (resid 68 and name cg2 ) (resid 7 and name cb ) 4.6 3.6 3.6 !I94CG2-V33CB weak long
assign (resid 70 and name ca ) (resid 70 and name cb ) 3.4 2.4 2.4 !V96CA-CB strong intra
assign (resid 70 and name ca ) (resid 1 and name cb ) 4.6 3.6 3.6 !V96CA-L27CB weak long
assign (resid 70 and name ca ) (resid 7 and name cb ) 4.6 3.6 3.6 !V96CA-V33CB weak long
OR (resid 9 and name ca ) (resid 7 and name cb )
assign (resid 70 and name ca ) (resid 71 and name ca ) 4.6 3.6 3.6 !V96CA-F97CA weak sqntl
assign (resid 70 and name cb ) (resid 70 and name ca ) 3.4 2.4 2.4 !V96CB-CA strong intra
assign (resid 70 and name cb ) (resid 70 and name ca ) 3.825 2.825 2.825 !V96CB-I94CA med med
assign (resid 70 and name cg1 ) (resid 70 and name ca ) 3.825 2.825 2.825 !V96CG1-CA med intra
assign (resid 70 and name cg1 ) (resid 68 and name cb ) 4.6 3.6 3.6 !V96cg1-I94cb weak med
OR (resid 70 and name cg1 ) (resid 61 and name cb )
OR (resid 70 and name cg1 ) (resid 45 and name ca )
OR (resid 24 and name cg2 ) (resid 68 and name cb )
OR (resid 24 and name cg2 ) (resid 61 and name cb )
OR (resid 24 and name cg2 ) (resid 45 and name ca )
OR (resid 28 and name cg2 ) (resid 68 and name cb )
OR (resid 28 and name cg2 ) (resid 61 and name cb )
OR (resid 28 and name cg2 ) (resid 45 and name ca )
! 13cap_50ms
assign (resid 1 and name ca ) (resid 1 and name cg ) 3.300 2.300 2.300 ! L27CA-CG weak intra
assign (resid 1 and name cg ) (resid 1 and name ca ) 3.300 2.300 2.300 ! L27CG-CA weak intra
assign (resid 3 and name cb ) (resid 3 and name cg1 ) 3.300 2.300 2.300 ! V29CB-CG1 weak intra
assign (resid 3 and name cg1 ) (resid 3 and name cb ) 3.300 2.300 2.300 ! V29CG1-CB weak intra
assign (resid 5 and name cb ) (resid 5 and name c ) 2.750 1.750 1.750 ! S31CB-C med intra
assign (resid 7 and name cb ) (resid 7 and name cg2 ) 3.30 2.30 2.30 ! V33CB-CG2 weak intra
assign (resid 7 and name cg1 ) (resid 7 and name cg2 ) 2.750 1.750 1.750 ! V33CG1-CG2 med intra
assign (resid 7 and name cg2 ) (resid 7 and name c ) 2.750 1.750 1.750 ! V33CG2-C med intra
assign (resid 7 and name cg2 ) (resid 7 and name cb ) 2.750 1.750 1.750 ! V33CG2-CB med intra
assign (resid 7 and name cg2 ) (resid 7 and name cg1 ) 2.750 1.750 1.750 ! V33CG2-CG1 med intra
assign (resid 8 and name cb ) (resid 8 and name ca ) 2.750 1.750 1.750 ! E34CB-CA med intra
assign (resid 10 and name ca ) (resid 10 and name cg2 ) 3.30 2.30 2.30 ! I36CA-CG2 weak intra
assign (resid 10 and name cd1 ) (resid 10 and name ca ) 3.30 2.30 2.30 ! I36CD1-CA weak intra
assign (resid 10 and name cd1 ) (resid 10 and name cg1 ) 2.750 1.750 1.750 ! I36CD1-CG1 med intra
assign (resid 10 and name cd1 ) (resid 10 and name cg2 ) 2.750 1.750 1.750 ! I36CD1-CG2 med intra
assign (resid 10 and name cg1 ) (resid 10 and name cd1 ) 3.30 2.30 2.30 ! I36CG1-CD1 weak intra
assign (resid 10 and name cg2 ) (resid 10 and name ca ) 2.750 1.750 1.750 ! I36CG2-CA med intra
assign (resid 10 and name cg2 ) (resid 10 and name cd1 ) 3.30 2.30 2.30 ! I36CG2-CD1 weak intra
assign (resid 10 and name cg2 ) (resid 10 and name cg1 ) 2.750 1.750 1.750 ! I36CG2-CG1 med intra
assign (resid 14 and name ca ) (resid 14 and name c ) 2.750 1.750 1.750 ! H40CA-C med intra
assign (resid 15 and name ca ) (resid 15 and name cb ) 3.30 2.30 2.30 ! R41CA-CB weak intra
assign (resid 17 and name ca ) (resid 16 and name c ) 2.750 1.750 1.750 ! T43CA-G42C med sqntl
assign (resid 17 and name ca ) (resid 17 and name cb ) 2.750 1.750 1.750 ! T43CA-CB weak intra
assign (resid 17 and name cb ) (resid 17 and name c ) 2.750 1.750 1.750 ! T43CB-C med intra
assign (resid 17 and name cb ) (resid 17 and name ca ) 2.750 1.750 1.750 ! T43CB-CA weak intra
assign (resid 17 and name cb ) (resid 17 and name cg2 ) 2.750 1.750 1.750 ! T43CB-CG med intra
assign (resid 17 and name cg2 ) (resid 17 and name c ) 2.750 1.750 1.750 ! T43CG-C med intra
assign (resid 17 and name cg2 ) (resid 17 and name cb ) 2.750 1.750 1.750 ! T43CG-CB med intra
assign (resid 18 and name ca ) (resid 18 and name cg1 ) 3.30 2.30 2.30 ! V44CA-CG1 weak intra
assign (resid 18 and name ca ) (resid 18 and name cg2 ) 3.30 2.30 2.30 ! V44CA-CG2 weak intra
assign (resid 18 and name cb ) (resid 18 and name cg1 ) 2.750 1.750 1.750 ! V44CB-CG1 med intra
assign (resid 18 and name cb ) (resid 18 and name cg2 ) 2.750 1.750 1.750 ! V44CB-CG2 med intra
assign (resid 18 and name cg1 ) (resid 18 and name ca ) 3.30 2.30 2.30 ! V44CG1-CA weak intra
assign (resid 18 and name cg1 ) (resid 18 and name cb ) 2.750 1.750 1.750 ! V44CG1-CB med intra
assign (resid 18 and name cg2 ) (resid 18 and name ca ) 3.30 2.30 2.30 ! V44CG2-CA weak intra
assign (resid 20 and name cb ) (resid 20 and name c ) 2.125 1.125 1.125 ! Y46CB-C stron intra
assign (resid 21 and name ca ) (resid 21 and name cg1 ) 2.750 1.750 1.750 ! V47CA-CG1 med intra
assign (resid 21 and name cb ) (resid 21 and name cg1 ) 2.125 1.125 1.125 ! V47CB-CG1 stron intra
assign (resid 21 and name cg1 ) (resid 21 and name c ) 2.750 1.750 1.750 ! V47CG1-C med intra
assign (resid 21 and name cg1 ) (resid 21 and name ca ) 2.750 1.750 1.750 ! V47CG1-CA med intra
assign (resid 21 and name cg1 ) (resid 21 and name cb ) 2.750 1.750 1.750 ! V47CG1-CB med intra
assign (resid 23 and name cb ) (resid 23 and name c ) 2.750 1.750 1.750 ! A49CB-C med intra
assign (resid 23 and name cb ) (resid 23 and name ca ) 2.125 1.125 1.125 ! A49CB-CA stron intra
assign (resid 24 and name ca ) (resid 24 and name cb ) 2.750 1.750 1.750 ! T50CA-CB med intra
assign (resid 24 and name ca ) (resid 24 and name cg2 ) 2.750 1.750 1.750 ! T50CA-CG med intra
assign (resid 24 and name cb ) (resid 24 and name ca ) 2.750 1.750 1.750 ! T50CB-CA med intra
assign (resid 24 and name cb ) (resid 24 and name cg2 ) 2.750 1.750 1.750 ! T50CB-CG med intra
assign (resid 24 and name cg2 ) (resid 24 and name ca ) 2.750 1.750 1.750 ! T50CG-CA med intra
assign (resid 24 and name cg2 ) (resid 24 and name cb ) 2.125 1.125 1.125 ! T50CG-CB stron intra
assign (resid 25 and name ca ) (resid 25 and name c ) 2.750 1.750 1.750 ! L51CA-C med intra
assign (resid 25 and name ca ) (resid 25 and name cb ) 3.30 2.30 2.30 ! L51/D82CA-CB weak intra
OR (resid 56 and name ca ) (resid 56 and name cb )
assign (resid 25 and name cb ) (resid 25 and name ca ) 3.30 2.30 2.30 ! L51/D82CB-CA weak intra
OR (resid 56 and name cb ) (resid 56 and name ca )
assign (resid 28 and name ca ) (resid 28 and name c ) 2.125 1.125 1.125 ! T54CA-C stron intra
assign (resid 28 and name ca ) (resid 28 and name cb ) 2.750 1.750 1.750 ! T54CA-CB med intra
assign (resid 28 and name cb ) (resid 28 and name ca ) 2.750 1.750 1.750 ! T54CB-CA med intra
assign (resid 28 and name cb ) (resid 28 and name cg2 ) 2.750 1.750 1.750 ! T54CB-CG2 med intra
assign (resid 28 and name cg2 ) (resid 28 and name c ) 2.750 1.750 1.750 ! T54CG2-C stron intra
assign (resid 28 and name cg2 ) (resid 28 and name ca ) 2.750 1.750 1.750 ! T54CG2-CA med intra
assign (resid 28 and name cg2 ) (resid 28 and name cb ) 3.30 2.30 2.30 ! T54CG2-CB weak intra
assign (resid 30 and name ca ) (resid 30 and name c ) 2.125 1.125 1.125 ! K56CA-C stron intra
assign (resid 30 and name ca ) (resid 30 and name cb ) 2.750 1.750 1.750 ! K56CA-CB med intra
assign (resid 30 and name cb ) (resid 30 and name ca ) 2.125 1.125 1.125 ! K56CB-CA stron intra
assign (resid 30 and name cb ) (resid 30 and name cg ) 2.125 1.125 1.125 ! K56CB-CG stron intra
assign (resid 30 and name cd ) (resid 30 and name cg ) 2.125 1.125 1.125 ! K56CD-CG stron intra
assign (resid 30 and name ce ) (resid 30 and name cd ) 2.750 1.750 1.750 ! K56CE-CD med intra
assign (resid 30 and name cg ) (resid 30 and name cb ) 2.125 1.125 1.125 ! K56CG-CB stron intra
assign (resid 30 and name cg ) (resid 30 and name ce ) 3.30 2.30 2.30 ! K56CG-CE weak intra
assign (resid 32 and name ca ) (resid 32 and name c ) 2.750 1.750 1.750 ! V58CA-C med intra
assign (resid 32 and name ca ) (resid 32 and name cg2 ) 3.30 2.30 2.30 ! V58CA-CG2 weak intra
assign (resid 32 and name cb ) (resid 32 and name cg2 ) 2.750 1.750 1.750 ! V58CB-CG2 med intra
assign (resid 32 and name cg1 ) (resid 32 and name c ) 2.750 1.750 1.750 ! V58CG1-C med intra
assign (resid 32 and name cg1 ) (resid 32 and name ca ) 3.30 2.30 2.30 ! V58CG1-CA weak intra
assign (resid 32 and name cg1 ) (resid 32 and name cg2 ) 2.125 1.125 1.125 ! V58CG1-CG2 stron intra
assign (resid 32 and name cg2 ) (resid 32 and name ca ) 3.30 2.30 2.30 ! V58CG2-CA weak intra
assign (resid 32 and name cg2 ) (resid 32 and name cb ) 2.750 1.750 1.750 ! V58CG2-CB med intra
assign (resid 32 and name cg2 ) (resid 32 and name cg1 ) 2.125 1.125 1.125 ! V58CG2-CG1 stron intra
assign (resid 34 and name ca ) (resid 34 and name c ) 2.750 1.750 1.750 ! V60CA-C med intra
assign (resid 34 and name ca ) (resid 34 and name cg1 ) 2.750 1.750 1.750 ! V60CA-CG1 med intra
assign (resid 34 and name ca ) (resid 34 and name cg2 ) 2.750 1.750 1.750 ! V60CA-CG2 med intra
assign (resid 34 and name cb ) (resid 34 and name cg1 ) 2.750 1.750 1.750 ! V60CB-CG1 med intra
assign (resid 34 and name cg1 ) (resid 34 and name c ) 2.750 1.750 1.750 ! V60CG1-C med intra
assign (resid 34 and name cg1 ) (resid 34 and name ca ) 2.750 1.750 1.750 ! V60CG1-CA med intra
assign (resid 34 and name cg1 ) (resid 34 and name cb ) 2.750 1.750 1.750 ! V60CG1-CB med intra
assign (resid 34 and name cg2 ) (resid 34 and name c ) 2.750 1.750 1.750 ! V60CG2-C med intra
assign (resid 34 and name cg2 ) (resid 34 and name ca ) 2.750 1.750 1.750 ! V60CG2-CA med intra
assign (resid 35 and name ca ) (resid 35 and name cg2 ) 2.125 1.125 1.125 ! I61CA-CG2 stron intra
assign (resid 35 and name cd1 ) (resid 35 and name ca ) 3.30 2.30 2.30 ! I61CD1-CA weak intra
assign (resid 35 and name cd1 ) (resid 35 and name cg1 ) 2.750 1.750 1.750 ! I61CD1-CG1 med intra
assign (resid 35 and name cd1 ) (resid 35 and name cg2 ) 3.30 2.30 2.30 ! I61CD1-CG2 weak intra
assign (resid 35 and name cg1 ) (resid 35 and name cd1 ) 3.30 2.30 2.30 ! I61CG1-CD1 weak intra
assign (resid 35 and name cg1 ) (resid 35 and name cg2 ) 2.750 1.750 1.750 ! I61CG1-CG2 med intra
assign (resid 35 and name cg2 ) (resid 35 and name ca ) 2.750 1.750 1.750 ! I61CG2-CA med intra
assign (resid 35 and name cg2 ) (resid 35 and name cd1 ) 3.30 2.30 2.30 ! I61CG2-CD1 weak intra
assign (resid 35 and name cg2 ) (resid 35 and name cg1 ) 2.750 1.750 1.750 ! I61CG2-CG1 med intra
assign (resid 36 and name ca ) (resid 36 and name c ) 2.750 1.750 1.750 ! L62CA-C med intra
assign (resid 36 and name ca ) (resid 36 and name cd* ) 2.750 1.750 1.750 ! L62CA-CDx med intra
assign (resid 36 and name ca ) (resid 36 and name cg ) 2.750 1.750 1.750 ! L62CA-CG med intra
assign (resid 36 and name cb ) (resid 36 and name ca ) 3.30 2.30 2.30 ! L62CB-CA weak intra
assign (resid 36 and name cd* ) (resid 36 and name ca ) 2.750 1.750 1.750 ! L62CDx-CA med intra
assign (resid 36 and name cd* ) (resid 36 and name cg ) 2.125 1.125 1.125 ! L62CDx-CG stron intra
assign (resid 36 and name cg ) (resid 36 and name ca ) 2.750 1.750 1.750 ! L62CG-CA med intra
assign (resid 36 and name cg ) (resid 36 and name cb ) 3.30 2.30 2.30 ! L62CG-CB weak intra
OR (resid 25 and name cg ) (resid 25 and name cb )
assign (resid 36 and name cg ) (resid 36 and name cd* ) 2.125 1.125 1.125 ! L62CG-CDx stron intra
assign (resid 37 and name ca ) (resid 37 and name c ) 2.750 1.750 1.750 ! D63CA-C med intra
assign (resid 37 and name ca ) (resid 37 and name cb ) 2.750 1.750 1.750 ! D63CA-CB med intra
assign (resid 37 and name cb ) (resid 37 and name c ) 2.750 1.750 1.750 ! D63CB-C med intra
assign (resid 37 and name cb ) (resid 37 and name ca ) 2.750 1.750 1.750 ! D63CB-CA med intra
assign (resid 38 and name ca ) (resid 38 and name cb ) 2.750 1.750 1.750 ! E64CA-CB med intra
assign (resid 38 and name cb ) (resid 38 and name cg ) 2.750 1.750 1.750 ! E64CB-CG med intra
assign (resid 38 and name cb ) (resid 38 and name ca ) 2.750 1.750 1.750 ! E64CB-CA med intra
assign (resid 38 and name cg ) (resid 38 and name cb ) 2.750 1.750 1.750 ! E64CG-CB med intra
assign (resid 39 and name cb ) (resid 39 and name c ) 2.750 1.750 1.750 ! A65CB-C med intra
assign (resid 39 and name cb ) (resid 39 and name ca ) 3.30 2.30 2.30 ! A65CB-CA weak intra
assign (resid 40 and name ca ) (resid 41 and name c ) 2.750 1.750 1.750 ! K66CA-G67C med sqntl
assign (resid 42 and name ca ) (resid 42 and name c ) 2.750 1.750 1.750 ! K68CA-C med intra
assign (resid 42 and name cd ) (resid 42 and name cb ) 2.750 1.750 1.750 ! K68CD-CB med intra
assign (resid 42 and name cd ) (resid 42 and name ce ) 2.125 1.125 1.125 ! K68CD-CE stron intra
assign (resid 42 and name ce ) (resid 42 and name cd ) 2.750 1.750 1.750 ! K68CE-CD med intra
assign (resid 42 and name cg ) (resid 42 and name cb ) 2.750 1.750 1.750 ! K68CG-CB med intra
assign (resid 42 and name cg ) (resid 42 and name cd ) 2.750 1.750 1.750 ! K68CG-CD med intra
assign (resid 44 and name ca ) (resid 44 and name cb ) 2.125 1.125 1.125 ! D70CA-CB stron intra
assign (resid 44 and name ca ) (resid 44 and name cg ) 2.750 1.750 1.750 ! D70CA-CG med intra
assign (resid 44 and name cb ) (resid 44 and name ca ) 2.125 1.125 1.125 ! D70CB-CA stron intra
assign (resid 46 and name cb ) (resid 46 and name c ) 2.750 1.750 1.750 ! T72CB-C med intra
assign (resid 47 and name ca ) (resid 46 and name c ) 2.750 1.750 1.750 ! V73CA-T72C med sqntl
assign (resid 47 and name cb ) (resid 47 and name c ) 2.750 1.750 1.750 ! V73CB-C med intra
assign (resid 50 and name ca ) (resid 50 and name c ) 2.750 1.750 1.750 ! R76CA-C med intra
assign (resid 51 and name cd ) (resid 51 and name cg ) 2.750 1.750 1.750 ! K77CD-CG med intra
assign (resid 51 and name cg ) (resid 51 and name cd ) 2.750 1.750 1.750 ! K77CG-CD med intra
assign (resid 51 and name cb ) (resid 51 and name cd ) 2.750 1.750 1.750 ! K77CB-CD med intra
OR (resid 40 and name cb ) (resid 40 and name cd )
assign (resid 54 and name ca ) (resid 54 and name c ) 2.750 1.750 1.750 ! T80CA-C med intra
assign (resid 54 and name ca ) (resid 54 and name cg2 ) 3.30 2.30 2.30 ! T80CA-CG2 weak intra
assign (resid 54 and name cb ) (resid 54 and name c ) 2.750 1.750 1.750 ! T80CB-C med intra
assign (resid 54 and name cb ) (resid 54 and name ca ) 2.750 1.750 1.750 ! T80CB-CA med intra
assign (resid 54 and name cg2 ) (resid 54 and name ca ) 2.750 1.750 1.750 ! T80CG2-CA med intra
assign (resid 54 and name ca ) (resid 54 and name cb ) 2.750 1.750 1.750 ! T80CA-CB med intra
assign (resid 55 and name ca ) (resid 55 and name c ) 2.750 1.750 1.750 ! C81CA-C med intra
assign (resid 55 and name cb ) (resid 55 and name c ) 2.750 1.750 1.750 ! C81CB-C med intra
assign (resid 56 and name ca ) (resid 56 and name c ) 2.750 1.750 1.750 ! D82CA-C med intra
assign (resid 57 and name ca ) (resid 57 and name cb ) 3.30 2.30 2.30 ! E83CA-CB weak intra
assign (resid 57 and name cb ) (resid 57 and name ca ) 2.750 1.750 1.750 ! E83CB-CA med intra
assign (resid 58 and name ca ) (resid 58 and name c ) 2.125 1.125 1.125 ! G84CA-C stron intra
assign (resid 63 and name ca ) (resid 63 and name c ) 2.750 1.750 1.750 ! V89CA-C med intra
assign (resid 63 and name ca ) (resid 63 and name cg1 ) 3.30 2.30 2.30 ! V89CA-CG1 weak intra
assign (resid 63 and name cb ) (resid 63 and name c ) 2.125 1.125 1.125 ! V89CB-C stron intra
assign (resid 63 and name cb ) (resid 63 and name cg2 ) 3.30 2.30 2.30 ! V89CB-CG2 weak intra
assign (resid 63 and name cg1 ) (resid 63 and name c ) 2.750 1.750 1.750 ! V89CG1-C med intra
assign (resid 63 and name cg1 ) (resid 63 and name ca ) 2.750 1.750 1.750 ! V89CG1-CA med intra
assign (resid 63 and name cg1 ) (resid 63 and name cg2 ) 2.125 1.125 1.125 ! V89CG1-CG2 stron intra
assign (resid 63 and name cg2 ) (resid 63 and name c ) 2.750 1.750 1.750 ! V89CG2-C med intra
assign (resid 63 and name cg2 ) (resid 63 and name ca ) 3.30 2.30 2.30 ! V89CG2-CA weak intra
assign (resid 63 and name cg2 ) (resid 63 and name cb ) 2.750 1.750 1.750 ! V89CG2-CB med intra
assign (resid 63 and name cg2 ) (resid 63 and name cg1 ) 2.125 1.125 1.125 ! V89CG2-CG1 stron intra
assign (resid 65 and name cg ) (resid 65 and name ca ) 2.750 1.750 1.750 ! Q91CG-CA med intra
assign (resid 68 and name ca ) (resid 68 and name cg2 ) 2.750 1.750 1.750 ! I94CA-CG2 med intra
assign (resid 68 and name cd1 ) (resid 68 and name cg1 ) 2.750 1.750 1.750 ! I94CD1-CG1 med intra
assign (resid 68 and name cg1 ) (resid 68 and name cd1 ) 2.750 1.750 1.750 ! I94CG1-CD1 med intra
assign (resid 68 and name cg1 ) (resid 68 and name cg2 ) 2.750 1.750 1.750 ! I94CG1-CG2 med
assign (resid 68 and name cg2 ) (resid 68 and name ca ) 2.750 1.750 1.750 ! I94CG2-CA med intra
assign (resid 68 and name cg2 ) (resid 68 and name cg1 ) 2.750 1.750 1.750 ! I94CG2-CG1 med intra
assign (resid 70 and name cb ) (resid 70 and name cg2 ) 2.750 1.750 1.750 ! V96CB-CG2 med intra
assign (resid 70 and name cg1 ) (resid 70 and name ca ) 2.750 1.750 1.750 ! V96CG1-CA med intra
assign (resid 70 and name cg2 ) (resid 70 and name cb ) 3.30 2.30 2.30 ! V96CG2-CB weak intra
! 13cap_200ms Assignment
assign (resid 1 and name ca ) (resid 1 and name c ) 4.000 3.000 3.000 ! L27CA-C weak intra
assign (resid 1 and name cd* ) (resid 1 and name ca ) 3.350 2.350 2.350 ! L27CDx-CA med intra
assign (resid 3 and name cb ) (resid 20 and name ca ) 4.000 3.000 3.000 ! V29cb-Y46ca weak long
assign (resid 3 and name cg2 ) (resid 3 and name ca ) 4.000 3.000 3.000 ! V29CG2-CA weak intra
assign (resid 3 and name cg1 ) (resid 1 and name cd* ) 4.000 3.000 3.000 ! V29CG1-L27CDx weak intra
assign (resid 5 and name cb ) (resid 1 and name c ) 4.000 3.000 3.000 ! S31CB-L27C weak med; or I36CA-L27C
OR (resid 10 and name ca ) (resid 1 and name c )
assign (resid 5 and name cb ) (resid 5 and name c ) 2.900 1.900 1.900 ! S31CB-C stron intra
assign (resid 5 and name cb ) (resid 18 and name cg1 ) 4.000 3.000 3.000 ! S31CB-Q91CB weak long
assign (resid 7 and name cb ) (resid 7 and name cg2 ) 3.350 2.350 2.350 ! V33CB-CG2 med intra
!! assign (resid 7 and name cb ) (resid 8 and name cb ) 4.000 3.000 3.000 ! V33CB-E34CB weak sqntl
assign (resid 7 and name cg1 ) (resid 1 and name ca ) 4.000 3.000 3.000 ! V33CG1-L27CA weak long corrected
assign (resid 7 and name cg1 ) (resid 7 and name ca ) 3.350 2.350 2.350 ! V33CG1-CA med intra
assign (resid 7 and name cg1 ) (resid 7 and name cg2 ) 3.350 2.350 2.350 ! V33CG1-CG2 med intra
assign (resid 7 and name cg2 ) (resid 7 and name c ) 3.350 2.350 2.350 ! V33CG2-C med intra
assign (resid 7 and name cg2 ) (resid 7 and name cb ) 4.000 3.000 3.000 ! V33CG2-CB weak intra
assign (resid 7 and name cg2 ) (resid 7 and name cg1 ) 3.350 2.350 2.350 ! V33CG2-CG1 med intra
assign (resid 8 and name ca ) (resid 8 and name cg ) 3.350 2.350 2.350 ! E34CA-CG med intra
assign (resid 8 and name ca ) (resid 10 and name cg1 ) 4.000 3.000 3.000 ! E34CA-I36CG1 med med
! assign (resid 8 and name ca ) (resid 68 and name cg1 ) 4.000 3.000 3.000 ! E34CA-I94CG1 weak long
assign (resid 8 and name cb ) (resid 8 and name ca ) 4.000 3.000 3.000 ! E34CB-CA weak intra
assign (resid 8 and name cg ) (resid 8 and name ca ) 3.350 2.350 2.350 ! E34CG-CA med intra
assign (resid 9 and name cb ) (resid 9 and name c ) 4.000 3.000 3.000 ! V35CB-C weak intra
assign (resid 10 and name ca ) (resid 10 and name cd1 ) 4.000 3.000 3.000 ! I36CA-CD1 weak intra
assign (resid 10 and name ca ) (resid 10 and name cg2 ) 3.350 2.350 2.350 ! I36CA-CG2 med intra
! assign (resid 10 and name cb ) (resid 67 and name ca ) 4.000 3.000 3.000 ! I36CB-Q93CA weak long
assign (resid 10 and name cd1 ) (resid 10 and name cb ) 4.000 3.000 3.000 ! I36CD-CB weak intra
assign (resid 10 and name cd1 ) (resid 10 and name ca ) 4.000 3.000 3.000 ! I36CD1-CA weak intra
assign (resid 10 and name cd1 ) (resid 10 and name cg1 ) 3.350 2.350 2.350 ! I36CD1-CG1 med intra
assign (resid 10 and name cd1 ) (resid 10 and name cg2 ) 3.350 2.350 2.350 ! I36CD1-CG2 med intra
assign (resid 10 and name cg1 ) (resid 8 and name ca ) 4.000 3.000 3.000 ! I36CG1-E34CA med med
OR (resid 35 and name cg1 ) (resid 8 and name ca )
assign (resid 10 and name cg1 ) (resid 10 and name cd1 ) 4.000 3.000 3.000 ! I36CG1-CD1 weak intra
assign (resid 10 and name cg1 ) (resid 10 and name cg2 ) 4.000 3.000 3.000 ! I36CG1-CG2 weak intra
assign (resid 10 and name cg2 ) (resid 10 and name ca ) 3.350 2.350 2.350 ! I36CG2-CA med intra
assign (resid 10 and name cg2 ) (resid 10 and name cd1 ) 3.350 2.350 2.350 ! I36CG2-CD1 med intra
assign (resid 10 and name cg2 ) (resid 10 and name cg1 ) 3.350 2.350 2.350 ! I36CG2-CG1 med intra
assign (resid 14 and name ca ) (resid 14 and name c ) 4.000 3.000 3.000 ! H40CA-C weak intra
assign (resid 15 and name ca ) (resid 15 and name cb ) 2.900 1.900 1.900 ! R41CA-CB stron intra
assign (resid 15 and name cb ) (resid 15 and name ca ) 4.000 3.000 3.000 ! R41CB-CA weak intra
assign (resid 15 and name cb ) (resid 36 and name c ) 4.000 3.000 3.000 ! R41CB-L62C weak long; anti-para b-strands
!assign (resid 15 and name cb ) (resid 37 and name c ) 4.000 3.000 3.000 ! R41CB-D63 weak long
assign (resid 17 and name ca ) (resid 16 and name c ) 3.350 2.350 2.350 ! T43CA-G42C med sqntl
assign (resid 17 and name ca ) (resid 17 and name cb ) 3.350 2.350 2.350 ! T43CA-CB med intra
assign (resid 17 and name cb ) (resid 16 and name c ) 4.000 3.000 3.000 ! T43CB-G42C weak sqntl
assign (resid 17 and name cb ) (resid 17 and name c ) 4.000 3.000 3.000 ! T43CB-C weak intra
assign (resid 17 and name cb ) (resid 17 and name ca ) 3.350 2.350 2.350 ! T43CB-CA med intra
assign (resid 17 and name cb ) (resid 17 and name cg2 ) 3.350 2.350 2.350 ! T43CB-CG med intra
assign (resid 17 and name cg2 ) (resid 17 and name c ) 4.000 3.000 3.000 ! T43CG-C weak intra
assign (resid 17 and name cg2 ) (resid 17 and name cb ) 2.900 1.900 1.900 ! T43CG-CB stron intra
assign (resid 18 and name ca ) (resid 18 and name cg1 ) 4.000 3.000 3.000 ! V44CA-CG1 weak intra
assign (resid 18 and name ca ) (resid 18 and name cg2 ) 3.350 2.350 2.350 ! V44CA-CG2 med intra
assign (resid 18 and name cb ) (resid 18 and name cg1 ) 4.000 3.000 3.000 ! V44CB-CG1 weak intra
assign (resid 18 and name cg1 ) (resid 18 and name ca ) 4.000 3.000 3.000 ! V44CG1-CA weak intra
assign (resid 18 and name cg1 ) (resid 18 and name cb ) 3.350 2.350 2.350 ! V44CG1-CB med intra
assign (resid 18 and name cg1 ) (resid 18 and name cg2 ) 4.000 3.000 3.000 ! V44CG1-CG2 weak intra
assign (resid 18 and name cg2 ) (resid 16 and name c ) 4.000 3.000 3.000 ! V44CG2-G42C weak med corrected
assign (resid 18 and name cg2 ) (resid 18 and name ca ) 4.000 3.000 3.000 ! V44CG2-CA weak intra
assign (resid 18 and name cg2 ) (resid 18 and name cb ) 3.350 2.350 2.350 ! V44CG2-CB med intra
assign (resid 20 and name cb ) (resid 24 and name cg2 ) 4.000 3.000 3.000 ! Y46cb-T50cg2 weak long, new added
assign (resid 21 and name ca ) (resid 21 and name cg1 ) 4.000 3.000 3.000 ! V47CA-CG1 weak intra
assign (resid 21 and name cg1 ) (resid 21 and name c ) 4.000 3.000 3.000 ! V47CG1-C weak intra
assign (resid 21 and name cg1 ) (resid 21 and name ca ) 2.900 1.900 1.900 ! V47CG1-CA stron intra
assign (resid 21 and name cg2 ) (resid 22 and name c ) 4.000 3.000 3.000 ! V47CG2-G48C weak sqntl
assign (resid 21 and name cg2 ) (resid 31 and name ca ) 4.000 3.000 3.000 ! V47CG2-W57CA weak long
OR (resid 21 and name cg2 ) (resid 56 and name ca )
OR (resid 3 and name cg2 ) (resid 31 and name ca )
OR (resid 3 and name cg2 ) (resid 56 and name ca )
assign (resid 23 and name cb ) (resid 23 and name c ) 3.350 2.350 2.350 ! A49CB-C med intra
assign (resid 23 and name cb ) (resid 23 and name ca ) 4.000 3.000 3.000 ! A49CB-CA weak intra
assign (resid 23 and name cb ) (resid 24 and name ca ) 4.000 3.000 3.000 ! A49CB-T50CA weak sqntl
assign (resid 24 and name ca ) (resid 23 and name cb ) 3.350 2.350 2.350 ! T50CA-A49CB med sqntl
assign (resid 24 and name ca ) (resid 24 and name cb ) 3.350 2.350 2.350 ! T50CA-CB med intra
assign (resid 24 and name ca ) (resid 24 and name cg2 ) 4.000 3.000 3.000 ! T50CA-CG2 weak intra
assign (resid 24 and name cb ) (resid 24 and name c ) 3.350 2.350 2.350 ! T50CB-C med intra
assign (resid 24 and name cb ) (resid 24 and name ca ) 4.000 3.000 3.000 ! T50CB-CA weak intra
assign (resid 24 and name cb ) (resid 24 and name cg2 ) 3.350 2.350 2.350 ! T50CB-CG2 med intra
assign (resid 24 and name cg2 ) (resid 24 and name ca ) 4.000 3.000 3.000 ! T50CG2-CA weak intra
assign (resid 24 and name cg2 ) (resid 24 and name cb ) 3.350 2.350 2.350 ! T50CG2-CB med intra
assign (resid 25 and name ca ) (resid 27 and name cb ) 4.000 3.000 3.000 ! L51CA-A53CB weak med, new added;R41ca-V60cg1...
OR (resid 15 and name ca ) (resid 34 and name cg1 )
OR (resid 25 and name ca ) (resid 34 and name cg1 )
OR (resid 15 and name ca ) (resid 27 and name cb )
assign (resid 25 and name cb ) (resid 25 and name c ) 3.350 2.350 2.350 ! L51CB-C med intra
assign (resid 25 and name cg ) (resid 30 and name cb ) 3.350 2.350 2.350 ! L51cg-K56cb/W57cb med long
OR (resid 25 and name cb ) (resid 31 and name cb )
assign (resid 24 and name cg2 ) (resid 26 and name cb ) 3.350 2.350 2.350 ! F52CB-T50CG2med med
OR (resid 24 and name cg2 ) (resid 53 and name cb )
OR (resid 19 and name cb ) (resid 26 and name cb )
OR (resid 19 and name cb ) (resid 53 and name cb )
assign (resid 28 and name ca ) (resid 28 and name c ) 4.000 3.000 3.000 ! T54CA-C weak intra
assign (resid 28 and name ca ) (resid 28 and name cb ) 3.350 2.350 2.350 ! T54CA-CB med intra
assign (resid 28 and name cb ) (resid 27 and name c ) 3.350 2.350 2.350 ! T54CB-A53C med sqntl
assign (resid 28 and name cb ) (resid 28 and name c ) 3.350 2.350 2.350 ! T54CB-C med intra
assign (resid 28 and name cb ) (resid 28 and name ca ) 4.000 3.000 3.000 ! T54CB-CA weak intra
assign (resid 28 and name cb ) (resid 28 and name cg2 ) 3.350 2.350 2.350 ! T54CB-CG2 med intra
assign (resid 28 and name cg2 ) (resid 28 and name c ) 4.000 3.000 3.000 ! T54CG2-C weak intra
assign (resid 28 and name cg2 ) (resid 28 and name ca ) 2.900 1.900 1.900 ! T54CG2-CA stron intra
assign (resid 28 and name cg2 ) (resid 28 and name cb ) 2.900 1.900 1.900 ! T54CG2-CB stron intra
assign (resid 30 and name ca ) (resid 30 and name cb ) 3.350 2.350 2.350 ! K56CA-CB med intra
assign (resid 30 and name ca ) (resid 30 and name cg ) 4.000 3.000 3.000 ! K56CA-CG weak intra
assign (resid 30 and name cb ) (resid 29 and name c ) 3.350 2.350 2.350 ! K56CB-G55C med sqntl
assign (resid 30 and name cb ) (resid 30 and name ca ) 3.350 2.350 2.350 ! K56CB-CA med intra
assign (resid 30 and name cb ) (resid 30 and name cd ) 4.000 3.000 3.000 ! K56CB-CD weak intra
assign (resid 30 and name cb ) (resid 30 and name cg ) 4.000 3.000 3.000 ! K56CB-CG weak intra
assign (resid 30 and name cd ) (resid 30 and name cg ) 4.000 3.000 3.000 ! K56CD-CG weak intra
assign (resid 30 and name ce ) (resid 30 and name cd ) 4.000 3.000 3.000 ! K56CE-CD weak intra
assign (resid 30 and name ce ) (resid 30 and name cg ) 3.350 2.350 2.350 ! K56CE-CG med intra
!! assign (resid 30 and name cg ) (resid 29 and name c )
assign (resid 30 and name cg ) (resid 29 and name c ) 4.000 3.000 3.000 ! K56CG-G55C weak sqntl
assign (resid 30 and name cg ) (resid 30 and name ca ) 4.000 3.000 3.000 ! K56CG-CA weak intra
assign (resid 30 and name cg ) (resid 30 and name cb ) 4.000 3.000 3.000 ! K56CG-CB weak intra
assign (resid 30 and name cg ) (resid 30 and name cd ) 4.000 3.000 3.000 ! K56CG-CD weak intra
assign (resid 30 and name cg ) (resid 30 and name ce ) 3.350 2.350 2.350 ! K56CG-CE med intra
assign (resid 30 and name cg ) (resid 31 and name c ) 3.350 2.350 2.350 ! K56CG-W57C med sqntl
assign (resid 32 and name ca ) (resid 32 and name cg1 ) 3.350 2.350 2.350 ! V58CA-CG1 med intra
assign (resid 32 and name ca ) (resid 32 and name cg2 ) 4.000 3.000 3.000 ! V58CA-CG2 weak intra
assign (resid 32 and name cb ) (resid 32 and name cg2 ) 3.350 2.350 2.350 ! V58CB-CG2 med intra
assign (resid 32 and name cb ) (resid 62 and name cb ) 4.000 3.000 3.000 ! V58CB-F88CB weak long
OR (resid 32 and name cb ) (resid 30 and name ce )
assign (resid 32 and name cg1 ) (resid 32 and name c ) 4.000 3.000 3.000 ! V58CG1-C weak intra
assign (resid 32 and name cg1 ) (resid 32 and name ca ) 4.000 3.000 3.000 ! V58CG1-CA weak intra
assign (resid 32 and name cg1 ) (resid 32 and name cg2 ) 2.900 1.900 1.900 ! V58CG1-CG2 stron intra
assign (resid 32 and name cg2 ) (resid 32 and name ca ) 4.000 3.000 3.000 ! V58CG2-CA weak intra
assign (resid 32 and name cg2 ) (resid 32 and name cb ) 3.350 2.350 2.350 ! V58CG2-CB med intra
assign (resid 32 and name cg2 ) (resid 32 and name cg1 ) 2.900 1.900 1.900 ! V58CG2-CG1 stron intra
assign (resid 34 and name ca ) (resid 34 and name c ) 3.350 2.350 2.350 ! V60CA-C med intra
assign (resid 34 and name ca ) (resid 34 and name cg1 ) 4.000 3.000 3.000 ! V60CA-CG1 weak intra
assign (resid 34 and name cb ) (resid 34 and name cg1 ) 3.350 2.350 2.350 ! V60CB-CG1 med intra
assign (resid 34 and name cb ) (resid 34 and name cg2 ) 3.350 2.350 2.350 ! V60CB-CG2 med intra
assign (resid 34 and name cg1 ) (resid 34 and name ca ) 3.350 2.350 2.350 ! V60CG1-CA med intra
assign (resid 34 and name cg1 ) (resid 34 and name cb ) 4.000 3.000 3.000 ! V60CG1-CB weak intra
assign (resid 34 and name cg2 ) (resid 34 and name c ) 4.000 3.000 3.000 ! V60CG2-C weak intra
assign (resid 34 and name cg2 ) (resid 34 and name c ) 4.000 3.000 3.000 ! V60CG2-C weak intra
assign (resid 34 and name cg2 ) (resid 45 and name ca ) 4.000 3.000 3.000 ! V60CG2-G71ca/Y46cb med long;...multiple
OR (resid 34 and name cg2 ) (resid 20 and name cb )
OR (resid 21 and name cg2 ) (resid 20 and name cb )
OR (resid 21 and name cg2 ) (resid 45 and name ca )
OR (resid 34 and name cg2 ) (resid 61 and name cb )
assign (resid 35 and name ca ) (resid 35 and name cd1 ) 4.000 3.000 3.000 ! I61CA-CD1 weak intra
assign (resid 35 and name ca ) (resid 35 and name cg2 ) 3.350 2.350 2.350 ! I61CA-CG2 med intra
assign (resid 35 and name cd1 ) (resid 35 and name ca ) 3.350 2.350 2.350 ! I61CD1-CA med intra
assign (resid 35 and name cd1 ) (resid 35 and name cb ) 4.000 3.000 3.000 ! I61CD1-CB weak intra
assign (resid 35 and name cd1 ) (resid 35 and name cg1 ) 3.350 2.350 2.350 ! I61CD1-CG1 med intra
assign (resid 35 and name cd1 ) (resid 35 and name cg2 ) 3.350 2.350 2.350 ! I61CD1-CG2 med intra
assign (resid 35 and name cg1 ) (resid 35 and name cd1 ) 4.000 3.000 3.000 ! I61CG1-CD1 weak intra
assign (resid 35 and name cg1 ) (resid 35 and name cg2 ) 3.350 2.350 2.350 ! I61CG1-CG2 med intra
assign (resid 35 and name cg2 ) (resid 34 and name c ) 4.000 3.000 3.000 ! I61CG2-V60C weak sqntl
assign (resid 35 and name cg2 ) (resid 35 and name ca ) 4.000 3.000 3.000 ! I61CG2-CA weak intra
assign (resid 35 and name cg2 ) (resid 35 and name cd1 ) 3.350 2.350 2.350 ! I61CG2-CD1 med intra
assign (resid 35 and name cg2 ) (resid 35 and name cg1 ) 3.350 2.350 2.350 ! I61CG2-CG1 med intra
assign (resid 35 and name cg2 ) (resid 36 and name ca ) 4.000 3.000 3.000 ! I61CG2-L62CA weak sqntl
assign (resid 36 and name ca ) (resid 35 and name cg1 ) 3.350 2.350 2.350 ! L62CA-I61cg1 med long
OR (resid 14 and name ca ) (resid 35 and name cg1 )
OR (resid 36 and name ca ) (resid 40 and name cd )
assign (resid 36 and name ca ) (resid 35 and name cg2 ) 4.000 3.000 3.000 ! L62CA-I61CG2 weak sqntl
assign (resid 36 and name ca ) (resid 36 and name c ) 4.000 3.000 3.000 ! L62CA-C weak intra
assign (resid 36 and name ca ) (resid 36 and name cd* ) 3.350 2.350 2.350 ! L62CA-CDx med intra
assign (resid 36 and name ca ) (resid 36 and name cg ) 3.350 2.350 2.350 ! L62CA-CG med intra
assign (resid 36 and name cd* ) (resid 36 and name c ) 4.000 3.000 3.000 ! L62CD-C weak intra
assign (resid 36 and name cd* ) (resid 36 and name ca ) 3.350 2.350 2.350 ! L62CDx-CA med intra
assign (resid 36 and name cd* ) (resid 36 and name cg ) 2.900 1.900 1.900 ! L62CDx-CG stron intra
assign (resid 36 and name cg ) (resid 36 and name ca ) 3.350 2.350 2.350 ! L62CG-CA med intra
assign (resid 36 and name cg ) (resid 36 and name cb ) 4.000 3.000 3.000 ! L62CG-CB weak intra
assign (resid 36 and name cg ) (resid 36 and name cd* ) 2.900 1.900 1.900 ! L62CG-CDx stron intra
assign (resid 36 and name cg ) (resid 61 and name cd1 ) 4.000 3.000 3.000 ! L62CG-I87cd1 weak long (it was a typo in the old table)
assign (resid 37 and name ca ) (resid 37 and name c ) 3.350 2.350 2.350 ! D63CA-C med intra
assign (resid 37 and name ca ) (resid 37 and name cb ) 3.350 2.350 2.350 ! D63CA-CB med intra
assign (resid 37 and name cb ) (resid 37 and name c ) 3.350 2.350 2.350 ! D63CB-C med intra
assign (resid 37 and name cb ) (resid 37 and name ca ) 3.350 2.350 2.350 ! D63CB-CA med intra
assign (resid 38 and name ca ) (resid 38 and name cg ) 4.000 3.000 3.000 ! E64CA-CG weak intra
assign (resid 38 and name ca ) (resid 39 and name c ) 4.000 3.000 3.000 ! E64CA-A65C weak sqntl
assign (resid 39 and name ca ) (resid 39 and name cb ) 4.000 3.000 3.000 ! A65CA-CB weak intra
assign (resid 40 and name ca ) (resid 41 and name c ) 4.000 3.000 3.000 ! K66CA-G67C weak sqntl
assign (resid 40 and name cb ) (resid 40 and name cd ) 4.000 3.000 3.000 ! K66CB-CD weak intra
assign (resid 40 and name cd ) (resid 36 and name ca ) 3.350 2.350 2.350 ! K66cd-L62ca med long; L62CA-I61cg1 med long
OR (resid 36 and name ca ) (resid 35 and name cg1 )
OR (resid 14 and name ca ) (resid 35 and name cg1 )
OR (resid 36 and name ca ) (resid 40 and name cd )
assign (resid 40 and name cd ) (resid 38 and name cg ) 4.000 3.000 3.000 ! K66CD-E64CG weak med
assign (resid 40 and name cg ) (resid 36 and name cb ) 4.000 3.000 3.000 ! K66CG-L62CB weak med
assign (resid 42 and name ca ) (resid 42 and name cg ) 3.350 2.350 2.350 ! K68CA-CG med intra
assign (resid 42 and name cb ) (resid 42 and name cd ) 4.000 3.000 3.000 ! K68CB-CD weak intra
assign (resid 42 and name cd ) (resid 42 and name c ) 4.000 3.000 3.000 ! K68CD-C weak intra
assign (resid 42 and name cd ) (resid 42 and name cb ) 3.350 2.350 2.350 ! K68CD-CB med intra
assign (resid 42 and name cd ) (resid 43 and name ca ) 4.000 3.000 3.000 ! K68CD-N69CA med sqntl corrected
assign (resid 42 and name cg ) (resid 42 and name ca ) 3.350 2.350 2.350 ! K68CG-CA med intra
assign (resid 44 and name ca ) (resid 44 and name cg ) 3.350 2.350 2.350 ! D70CA-CG med intra
assign (resid 44 and name ca ) (resid 44 and name cb ) 3.350 2.350 2.350 ! D70CA-CB med intra
assign (resid 44 and name cb ) (resid 44 and name c ) 3.350 2.350 2.350 ! D70CB-C med intra
assign (resid 44 and name cb ) (resid 44 and name ca ) 3.350 2.350 2.350 ! D70CB-CA med intra
assign (resid 44 and name cb ) (resid 44 and name cg ) 4.000 3.000 3.000 ! D70CB-CG weak intra
assign (resid 45 and name ca ) (resid 44 and name cb ) 4.000 3.000 3.000 ! G71CA-D70CB weak sqntl
assign (resid 46 and name ca ) (resid 46 and name cb ) 3.350 2.350 2.350 ! T72CA-CB med intra
assign (resid 46 and name cb ) (resid 46 and name c ) 3.350 2.350 2.350 ! T72CB-C med intra
assign (resid 46 and name cb ) (resid 46 and name ca ) 4.000 3.000 3.000 ! T72CB-CA weak intra
assign (resid 47 and name cb ) (resid 48 and name ca ) 3.350 2.350 2.350 ! V73CB-Q74CA med sqntl
assign (resid 48 and name ca ) (resid 47 and name cb ) 3.350 2.350 2.350 ! Q74CA-V73CB med sqntl
assign (resid 48 and name cg ) (resid 48 and name ca ) 4.000 3.000 3.000 ! Q74CG-CA weak intra
assign (resid 50 and name ca ) (resid 50 and name c ) 4.000 3.000 3.000 ! R76CA-C weak intra
assign (resid 50 and name ca ) (resid 51 and name cb ) 3.350 2.350 2.350 ! R76CA-K77CB med sqntl
assign (resid 51 and name ca ) (resid 51 and name cb ) 4.000 3.000 3.000 ! K77CA-CB weak intra
assign (resid 51 and name cd ) (resid 51 and name cg ) 2.900 1.900 1.900 ! K77CD-CG stron intra
assign (resid 51 and name cg ) (resid 51 and name cd ) 4.000 3.000 3.000 ! K77CG-CD weak intra
assign (resid 51 and name cg ) (resid 52 and name c ) 4.000 3.000 3.000 ! K77CG-Y78C weak sqntl
assign (resid 51 and name cb ) (resid 51 and name cd ) 4.000 3.000 3.000 ! K77CB-CD weak intra
assign (resid 51 and name cd ) (resid 51 and name cb ) 4.000 3.000 3.000 ! K77CD-CB weak intra
assign (resid 54 and name ca ) (resid 54 and name c ) 4.000 3.000 3.000 ! T80CA-C weak intra
assign (resid 54 and name ca ) (resid 54 and name cg2 ) 4.000 3.000 3.000 ! T80CA-CG2 weak intra
assign (resid 54 and name cb ) (resid 54 and name c ) 3.350 2.350 2.350 ! T80CB-C med intra
assign (resid 54 and name cb ) (resid 54 and name ca ) 3.350 2.350 2.350 ! T80CB-CA med intra
assign (resid 54 and name cg2 ) (resid 54 and name ca ) 3.350 2.350 2.350 ! T80CG2-CA med intra
assign (resid 54 and name ca ) (resid 54 and name cb ) 3.350 2.350 2.350 ! T80CA-CB med intra
assign (resid 55 and name cb ) (resid 55 and name c ) 3.350 2.350 2.350 ! C81CB-C med intra
assign (resid 55 and name ca ) (resid 55 and name c ) 4.000 3.000 3.000 ! C81CA-C weak intra
assign (resid 55 and name cb ) (resid 55 and name ca ) 4.000 3.000 3.000 ! C81CB-CA weak intra
assign (resid 55 and name cb ) (resid 56 and name ca ) 3.350 2.350 2.350 ! C81CB-D82ca med sqntl
assign (resid 55 and name cb ) (resid 57 and name ca ) 4.000 3.000 3.000 ! C81CB-E83CA weak med
assign (resid 56 and name ca ) (resid 56 and name c ) 4.000 3.000 3.000 ! D82CA-C weak intra
assign (resid 56 and name ca ) (resid 56 and name cb ) 3.350 2.350 2.350 ! D82CA-CB med intra
assign (resid 56 and name cb ) (resid 55 and name cb ) 3.350 2.350 2.350 ! D82CB-C81CB med sqntl
assign (resid 56 and name cb ) (resid 56 and name ca ) 3.350 2.350 2.350 ! D82CB-CA med intra
assign (resid 57 and name ca ) (resid 57 and name cb ) 4.000 3.000 3.000 ! E83CA-CB weak intra
assign (resid 57 and name cb ) (resid 57 and name ca ) 4.000 3.000 3.000 ! E83CB-CA weak intra
assign (resid 57 and name cb ) (resid 57 and name cg ) 3.350 2.350 2.350 ! E83CB-CG med intra
assign (resid 57 and name cg ) (resid 57 and name cb ) 3.350 2.350 2.350 ! E83CG-CB med intra
assign (resid 59 and name ca ) (resid 59 and name cb ) 3.350 2.350 2.350 ! H85CA-CB med intra
assign (resid 59 and name cb ) (resid 59 and name c ) 4.000 3.000 3.000 ! H85CB-C weak intra
assign (resid 59 and name cb ) (resid 59 and name ca ) 3.350 2.350 2.350 ! H85CB-CA med intra
assign (resid 61 and name cb ) (resid 34 and name cg2 ) 4.000 3.000 3.000 ! I87CB-V60cg2 weak long
assign (resid 61 and name cd1 ) (resid 36 and name cg ) 4.000 3.000 3.000 ! I87cd1-L62cg weak long
assign (resid 63 and name ca ) (resid 63 and name c ) 4.000 3.000 3.000 ! V89CA-C weak intra
assign (resid 63 and name ca ) (resid 63 and name cg1 ) 3.350 2.350 2.350 ! V89CA-CG1 med intra
assign (resid 63 and name cb ) (resid 63 and name c ) 4.000 3.000 3.000 ! V89CB-C weak intra
assign (resid 63 and name cb ) (resid 63 and name cg2 ) 4.000 3.000 3.000 ! V89CB-CG2 weak intra
assign (resid 63 and name cb ) (resid 64 and name cb ) 3.350 2.350 2.350 ! V89CB-R90CB med sqntl
assign (resid 63 and name cg1 ) (resid 63 and name c ) 4.000 3.000 3.000 ! V89CG1-C weak intra
assign (resid 63 and name cg1 ) (resid 63 and name ca ) 3.350 2.350 2.350 ! V89CG1-CA med intra
assign (resid 63 and name cg1 ) (resid 63 and name cg2 ) 3.350 2.350 2.350 ! V89CG1-CG2 med intra
assign (resid 63 and name cg2 ) (resid 63 and name c ) 4.000 3.000 3.000 ! V89CG2-C weak intra
assign (resid 63 and name cg2 ) (resid 63 and name ca ) 3.350 2.350 2.350 ! V89CG2-CA med intra
assign (resid 63 and name cg2 ) (resid 63 and name cg1 ) 2.900 1.900 1.900 ! V89CG2-CG1 stron intra
assign (resid 65 and name ca ) (resid 64 and name c ) 3.350 2.350 2.350 ! Q91CA-R90C med sqntl
assign (resid 65 and name ca ) (resid 64 and name cb ) 4.000 3.000 3.000 ! Q91CA-R90CB weak sqntl
assign (resid 65 and name ca ) (resid 65 and name cg ) 4.000 3.000 3.000 ! Q91CA-CG weak intra
assign (resid 65 and name cg ) (resid 65 and name ca ) 3.350 2.350 2.350 ! Q91CG-CA med intra
assign (resid 68 and name ca ) (resid 68 and name cd1 ) 4.000 3.000 3.000 ! I94CA-CD1 weak intra
assign (resid 68 and name ca ) (resid 67 and name cg ) 3.350 2.350 2.350 ! I94CA-Q93cg/V89cb
OR (resid 68 and name ca ) (resid 63 and name cb )
assign (resid 68 and name ca ) (resid 68 and name cg2 ) 3.350 2.350 2.350 ! I94CA-CG2 med intra
assign (resid 68 and name cb ) (resid 68 and name ca ) 3.350 2.350 2.350 ! I94CB-CA med intra
assign (resid 68 and name cd1 ) (resid 68 and name ca ) 4.000 3.000 3.000 ! I94CD1-CA weak intra
assign (resid 68 and name cd1 ) (resid 68 and name cg1 ) 3.350 2.350 2.350 ! I94CD1-CG1 med intra
assign (resid 68 and name cd1 ) (resid 68 and name cg2 ) 3.350 2.350 2.350 ! I94CD1-CG2 med intra
assign (resid 68 and name cg1 ) (resid 68 and name cd1 ) 3.350 2.350 2.350 ! I94CG1-CD1 med intra
assign (resid 68 and name cg1 ) (resid 68 and name cg2 ) 3.350 2.350 2.350 ! I94CG1-CG2 med intra
assign (resid 68 and name cg2 ) (resid 68 and name ca ) 3.350 2.350 2.350 ! I94CG2-CA med intra
assign (resid 68 and name cg2 ) (resid 68 and name cd1 ) 3.350 2.350 2.350 ! I94CG2-CD1 med intra
assign (resid 68 and name cg2 ) (resid 68 and name cg1 ) 3.350 2.350 2.350 ! I94CG2-CG1 med intra
assign (resid 70 and name cb ) (resid 70 and name cg2 ) 3.350 2.350 2.350 ! V96CB-CG2 med intra
assign (resid 70 and name cg2 ) (resid 70 and name cb ) 4.000 3.000 3.000 ! V96CG2-CB weak intra
! 13cap_500ms
assign (resid 1 and name ca ) (resid 5 and name cb ) 3.825 2.825 2.825 ! L27CA-S31CB med long
assign (resid 1 and name cd1 ) (resid 68 and name cd1 ) 4.600 3.600 3.600 ! L27CD1-I94CD1 weak long
OR (resid 1 and name cd1 ) (resid 39 and name cb )
assign (resid 3 and name ca ) (resid 3 and name cg2 ) 4.600 3.600 3.600 ! V29CA-CG2 weak intra
assign (resid 5 and name cb ) (resid 1 and name ca ) 3.825 2.825 2.825 ! S31CB-L27CA med med
assign (resid 5 and name cb ) (resid 3 and name c ) 3.825 2.825 2.825 ! S31CB-V29C med med
assign (resid 5 and name cb ) (resid 7 and name cg2 ) 3.825 2.825 2.825 ! S31CB-V33CG2 med med
assign (resid 5 and name cb ) (resid 67 and name cg ) 4.600 3.600 3.600 ! S31CB-Q93CG
OR (resid 5 and name cb ) (resid 8 and name cg )
assign (resid 5 and name cb ) (resid 16 and name c ) 4.600 3.600 3.600 ! S31CB-G42C weak long
assign (resid 7 and name cg1 ) (resid 7 and name ca ) 3.825 2.825 2.825 ! V33CG1-CA med intra
assign (resid 7 and name cg1 ) (resid 7 and name cg2 ) 3.825 2.825 2.825 ! V33CG1-CG2 med intra
assign (resid 7 and name cg2 ) (resid 7 and name c ) 3.825 2.825 2.825 ! V33CG2-C med intra
assign (resid 7 and name cg2 ) (resid 7 and name cb ) 4.600 3.600 3.600 ! V33CG2-CB weak intra
assign (resid 7 and name cg2 ) (resid 7 and name cg1 ) 4.600 3.600 3.600 ! V33CG2-CG1 weak intra
assign (resid 7 and name cg2 ) (resid 8 and name c ) 3.825 2.825 2.825 ! V33CG2-E34C med sqntl
assign (resid 7 and name cg2 ) (resid 8 and name ca ) 4.600 3.600 3.600 ! V33CG2-E34CA weak sqntl
assign (resid 7 and name cg2 ) (resid 14 and name cb ) 3.825 2.825 2.825 ! V33CG2-H40CB med long, multiple possibility
OR (resid 35 and name cg2 ) (resid 14 and name cb )
OR (resid 7 and name cg2 ) (resid 55 and name cb )
OR (resid 7 and name cg2 ) (resid 51 and name cb )
OR (resid 35 and name cg2 ) (resid 55 and name cb )
OR (resid 35 and name cg2 ) (resid 51 and name cb )
assign (resid 7 and name cg2 ) (resid 17 and name cg2 ) 4.600 3.600 3.600 ! V33CG2-T43CG2 med long
assign (resid 8 and name ca ) (resid 7 and name cg2 ) 4.600 3.600 3.600 ! E34CA-V33CG2 weak sqntl
assign (resid 8 and name ca ) (resid 8 and name cb ) 3.825 2.825 2.825 ! E34CA-CB med intra
assign (resid 8 and name ca ) (resid 8 and name cg ) 3.825 2.825 2.825 ! E34CA-CG med intra
assign (resid 8 and name ca ) (resid 68 and name ca ) 4.600 3.600 3.600 ! E34CA-I94CA weak long
OR (resid 8 and name ca ) (resid 57 and name ca )
assign (resid 8 and name ca ) (resid 70 and name ca ) 4.600 3.600 3.600 ! E34CA-V96CA/V35ca weak long
OR (resid 54 and name ca ) (resid 43 and name ca )
OR (resid 43 and name ca ) (resid 70 and name ca )
OR (resid 1 and name ca ) (resid 70 and name ca )
OR (resid 54 and name ca ) (resid 1 and name ca )
OR (resid 54 and name ca ) (resid 8 and name ca )
assign (resid 8 and name cb ) (resid 8 and name ca ) 3.825 2.825 2.825 ! E34CB-CA med intra
assign (resid 8 and name cg ) (resid 10 and name c ) 3.825 2.825 2.825 ! E34CG-I36C med med
assign (resid 8 and name cg ) (resid 15 and name cb ) 3.825 2.825 2.825 ! E34CG-R41CB med long
assign (resid 8 and name cg ) (resid 71 and name cb ) 4.600 3.600 3.600 ! E34CG-F97CB weak long
assign (resid 8 and name cg ) (resid 8 and name ca ) 3.825 2.825 2.825 ! E34CG-CA med intra
assign (resid 9 and name ca ) (resid 8 and name ca ) 4.600 3.600 3.600 ! V35CA-E34CA weak long
OR (resid 54 and name ca ) (resid 43 and name ca )
OR (resid 66 and name cb ) (resid 43 and name ca )
assign (resid 9 and name cb ) (resid 7 and name cg2 ) 4.600 3.600 3.600 ! V35CB-V33CG2 weak med;H40cb-V33cg2
OR (resid 51 and name cb ) (resid 35 and name cg2 )
OR (resid 9 and name cb ) (resid 35 and name cg2 )
OR (resid 51 and name cb ) (resid 7 and name cg2 )
OR (resid 14 and name cb ) (resid 7 and name cg2 )
OR (resid 14 and name cb ) (resid 35 and name cg2 )
assign (resid 9 and name ca ) (resid 9 and name cb ) 3.825 2.825 2.825 ! V35CA-CB med intra
assign (resid 9 and name cb ) (resid 9 and name ca ) 3.825 2.825 2.825 ! V35CB-CA med intra
assign (resid 10 and name ca ) (resid 7 and name cg2 ) 4.600 3.600 3.600 ! I36CA-V33CG2 weak long
assign (resid 10 and name ca ) (resid 10 and name cd1 ) 3.825 2.825 2.825 ! I36CA-CD1 med intra
assign (resid 10 and name ca ) (resid 10 and name cg2 ) 4.600 3.600 3.600 ! I36CA-CG2 weak intra
assign (resid 10 and name ca ) (resid 30 and name ca ) 4.600 3.600 3.600 ! I36CA-Q93CA weak
OR (resid 10 and name ca ) (resid 67at and name ca )
assign (resid 10 and name ca ) (resid 68 and name ca ) 4.600 3.600 3.600 ! I36CA-I94ca/Y46ca weak long
OR (resid 10 and name ca ) (resid 68 and name ca )
assign (resid 10 and name ca ) (resid 68 and name cb ) 4.600 3.600 3.600 ! I36CA-I94CB weak long
assign (resid 10 and name ca ) (resid 68 and name cg1 ) 4.600 3.600 3.600 ! I36CA-I94Cg1 weak long, new added
assign (resid 10 and name cb ) (resid 10 and name cd1 ) 4.600 3.600 3.600 ! I36CB-CD1 weak intra
assign (resid 10 and name cd1 ) (resid 10 and name ca ) 3.825 2.825 2.825 ! I36CD1-CA med intra
assign (resid 10 and name cd1 ) (resid 10 and name cg1 ) 4.600 3.600 3.600 ! I36CD1-CG1 weak intra
assign (resid 10 and name cd1 ) (resid 10 and name cg2 ) 3.825 2.825 2.825 ! I36CD1-CG2 med intra
assign (resid 10 and name cg1 ) (resid 10 and name cd1 ) 4.600 3.600 3.600 ! I36CG1-CD1 weak intra
assign (resid 10 and name cg1 ) (resid 10 and name cg2 ) 4.600 3.600 3.600 ! I36CG1-CG2 weak intra
assign (resid 10 and name cg2 ) (resid 10 and name cg1 ) 3.825 2.825 2.825 ! I36CG2-CG1 med intra
assign (resid 11 and name ca ) (resid 12 and name cd ) 4.600 3.600 3.600 ! G37CA-K38CD weak sqntl
assign (resid 11 and name ca ) (resid 52 and name ca ) 4.600 3.600 3.600 ! G37CA-Y78CA weak long
OR (resid 11 and name ca ) (resid 35 and name ca )
OR (resid 11 and name ca ) (resid 34 and name ca )
OR (resid 11 and name ca ) (resid 61 and name ca )
OR (resid 11 and name ca ) (resid 17 and name ca )
OR (resid 41 and name ca ) (resid 52 and name ca )
OR (resid 41 and name ca ) (resid 35 and name ca )
OR (resid 41 and name ca ) (resid 34 and name ca )
OR (resid 41 and name ca ) (resid 61 and name ca )
OR (resid 41 and name ca ) (resid 17 and name ca )
assign (resid 12 and name cd ) (resid 13 and name ca ) 3.825 2.825 2.825 ! K38CD-G39CA med sqntl
assign (resid 14 and name cb ) (resid 8 and name cg ) 3.825 2.825 2.825 ! H40CB-E34CG med long; R41CB-E34CG med long
OR (resid 15 and name cb ) (resid 8 and name cg )
assign (resid 25 and name ca ) (resid 27 and name cb ) 3.825 2.825 2.825 ! L51CA-A53CB weak med, new added
OR (resid 15 and name ca ) (resid 34 and name cg1 )
OR (resid 25 and name ca ) (resid 34 and name cg1 )
OR (resid 15 and name ca ) (resid 27 and name cb )
assign (resid 15 and name ca ) (resid 37 and name ca ) 4.600 3.600 3.600 ! R41CA-D63CA weak long
assign (resid 15 and name cb ) (resid 36 and name c ) 3.825 2.825 2.825 ! R41CB-L62C med long
assign (resid 15 and name cb ) (resid 36 and name cb ) 3.825 2.825 2.825 ! R41CB-L62CB med long
assign (resid 15 and name cb ) (resid 37 and name c ) 4.600 3.600 3.600 ! R41CB-D63C med long
assign (resid 17 and name ca ) (resid 16 and name c ) 3.825 2.825 2.825 ! T43CA-G42C med sqntl
assign (resid 17 and name ca ) (resid 17 and name cb ) 4.600 3.600 3.600 ! T43CA-CB weak intra
assign (resid 17 and name cb ) (resid 7 and name cg2 ) 4.600 3.600 3.600 ! T43CB-V33CG2 weak long
OR (resid 17 and name cb ) (resid 35 and name cg2 )
assign (resid 17 and name cb ) (resid 16 and name c ) 3.825 2.825 2.825 ! T43CB-G42C med sqntl
assign (resid 17 and name cb ) (resid 17 and name c ) 3.825 2.825 2.825 ! T43CB-C med intra
assign (resid 17 and name cb ) (resid 17 and name ca ) 3.825 2.825 2.825 ! T43CB-CA med intra
assign (resid 17 and name cb ) (resid 34 and name cg1 ) 3.825 2.825 2.825 ! T43CB-V60CG1 med long
assign (resid 17 and name cb ) (resid 36 and name ca ) 4.600 3.600 3.600 ! T43CB-L62CA med long corrected
assign (resid 17 and name cg2 ) (resid 5 and name cb ) 3.825 2.825 2.825 ! T43CG2-S31CB med long
assign (resid 18 and name ca ) (resid 7 and name cg2 ) 4.600 3.600 3.600 ! V44CA-V33CG2 weak long
assign (resid 18 and name ca ) (resid 18 and name cg2 ) 3.825 2.825 2.825 ! V44CA-CG2 med intra
assign (resid 18 and name ca ) (resid 68 and name ca ) 4.600 3.600 3.600 ! V44CA-I94CA weak med, changed
assign (resid 18 and name ca ) (resid 33 and name ca ) 4.600 3.600 3.600 ! V44CA-G59CA weak long
assign (resid 18 and name ca ) (resid 34 and name ca ) 4.600 3.600 3.600 ! V44CA-V60CA weak long
OR (resid 18 and name ca ) (resid 52 and name ca )
OR (resid 18 and name ca ) (resid 17 and name ca )
assign (resid 18 and name cg1 ) (resid 18 and name cb ) 3.825 2.825 2.825 ! V44CG1-CB med intra
assign (resid 18 and name cg2 ) (resid 16 and name c ) 3.825 2.825 2.825 ! V44CG2-G42C med med
assign (resid 18 and name cg2 ) (resid 18 and name ca ) 3.825 2.825 2.825 ! V44CG2-CA med intra
assign (resid 19 and name cb ) (resid 3 and name ca ) 4.600 3.600 3.600 ! A45CB-V29CA med long corrected
OR (resid 28 and name cg2 ) (resid 3 and name ca )
OR (resid 24 and name cg2 ) (resid 3 and name ca )
OR (resid 70 and name cg1 ) (resid 3 and name ca )
OR (resid 36 and name cd* ) (resid 3 and name ca )
assign (resid 19 and name cb ) (resid 20 and name cg ) 3.825 2.825 2.825 ! A45CB-Y46CG med sqntl
assign (resid 19 and name cb ) (resid 35 and name cd1 ) 4.600 3.600 3.600 ! A45CB-I61CD1 weak long
OR (resid 36 and name cd* ) (resid 35 and name cd1 )
OR (resid 17 and name cg2 ) (resid 35 and name cd1 )
OR (resid 28 and name cg2 ) (resid 35 and name cd1 )
assign (resid 20 and name ca ) (resid 33 and name c ) 4.600 3.600 3.600 ! Y46CA-G59C weak long
assign (resid 20 and name cb ) (resid 18 and name cg2 ) 4.600 3.600 3.600 ! Y46CB-V44CG2 med med corrected
OR (resid 20 and name cb ) (resid 34 and name cg1 )
OR (resid 20 and name cb ) (resid 27 and name cb )
OR (resid 20 and name cb ) (resid 3 and name cg1 )
assign (resid 20 and name cb ) (resid 52 and name cb ) 4.600 3.600 3.600 ! Y46CB-Y78CB weak long;! Y46CB-F79CB weak long
OR (resid 20 and name cb ) (resid 53 and name cb )
assign (resid 21 and name ca ) (resid 20 and name cb ) 3.825 2.825 2.825 ! V47CA-Y46CB med sqntl
assign (resid 21 and name ca ) (resid 21 and name cg1 ) 3.825 2.825 2.825 ! V47CA-CG1 med intra
assign (resid 21 and name cg1 ) (resid 20 and name cz ) 4.600 3.600 3.600 ! V47CG1-Y46CZ med sqntl corrected
assign (resid 21 and name cg2 ) (resid 21 and name ca ) 3.825 2.825 2.825 ! V47CG2-CA med intra
assign (resid 22 and name ca ) (resid 21 and name cg1 ) 3.825 2.825 2.825 ! G48CA-V47CG1 med sqntl
assign (resid 22 and name ca ) (resid 30 and name ca ) 3.825 2.825 2.825 ! G48CA-K56CA med long
OR (resid 4 and name ca ) (resid 30 and name ca )
OR (resid 60 and name ca ) (resid 30 and name ca )
assign (resid 23 and name cb ) (resid 23 and name c ) 3.825 2.825 2.825 ! A49CB-C med intra
assign (resid 23 and name cb ) (resid 24 and name ca ) 3.825 2.825 2.825 ! A49CB-T50CA med sqntl
assign (resid 23 and name cb ) (resid 24 and name cb ) 3.825 2.825 2.825 ! A49CB-T50CB med sqntl
assign (resid 24 and name ca ) (resid 23 and name cb ) 3.825 2.825 2.825 ! T50CA-A49CB med sqntl
assign (resid 24 and name ca ) (resid 24 and name cb ) 4.600 3.600 3.600 ! T50CA-CB weak intra
assign (resid 24 and name cb ) (resid 23 and name c ) 4.600 3.600 3.600 ! T50CB-A49C weak sqntl
assign (resid 24 and name cb ) (resid 24 and name c ) 3.825 2.825 2.825 ! T50CB-C med intra
assign (resid 24 and name cb ) (resid 24 and name ca ) 4.600 3.600 3.600 ! T50CB-CA weak intra
assign (resid 24 and name cb ) (resid 25 and name ca ) 3.825 2.825 2.825 ! T50CB-L51CA med sqntl
assign (resid 24 and name cb ) (resid 26 and name cb ) 3.825 2.825 2.825 ! T50CB-F52CB med med
OR (resid 24 and name cb ) (resid 35 and name cb )
OR (resid 17 and name cb ) (resid 26 and name cb )
OR (resid 17 and name cb ) (resid 35 and name cb )
assign (resid 24 and name cb ) (resid 30 and name ca ) 4.600 3.600 3.600 ! T50CB-K56CA weak long
assign (resid 25 and name ca ) (resid 24 and name cb ) 3.825 2.825 2.825 ! L51CA-T50CB med sqntl
assign (resid 26 and name cb ) (resid 24 and name cb ) 4.600 3.600 3.600 ! F52CB-T50CB weak med
assign (resid 28 and name ca ) (resid 28 and name cg2 ) 3.400 2.400 2.400 ! T54CA-CG2 stron intra
assign (resid 28 and name ca ) (resid 30 and name ca ) 3.825 2.825 2.825 ! T54CA-K56CA med med
assign (resid 28 and name cb ) (resid 28 and name c ) 3.400 2.400 2.400 ! T54CB-C stron intra
assign (resid 28 and name cb ) (resid 28 and name ca ) 3.825 2.825 2.825 ! T54CB-CA med intra
assign (resid 28 and name cb ) (resid 28 and name cg2 ) 3.825 2.825 2.825 ! T54CB-CG2 med intra
assign (resid 28 and name cg2 ) (resid 28 and name c ) 3.400 2.400 2.400 ! T54CG2-C stron intra
assign (resid 28 and name cg2 ) (resid 28 and name ca ) 3.400 2.400 2.400 ! T54CG2-CA stron intra
assign (resid 30 and name ca ) (resid 28 and name ca ) 3.825 2.825 2.825 ! K56CA-T54CA med med
assign (resid 30 and name ca ) (resid 29 and name ca ) 4.600 3.600 3.600 ! K56CA-G55CA weak sqntl
OR (resid 42 and name ca ) (resid 29 and name ca )
OR (resid 48 and name ca ) (resid 29 and name ca )
OR (resid 67 and name ca ) (resid 29 and name ca )
assign (resid 30 and name ca ) (resid 30 and name cb ) 3.825 2.825 2.825 ! K56CA-CB med intra
assign (resid 38 and name cg ) (resid 29 and name ca ) 3.825 2.825 2.825 ! E64cg-G55CA/G84ca med long
OR (resid 38 and name cg ) (resid 58 and name ca )
assign (resid 30 and name cb ) (resid 30 and name ca ) 3.825 2.825 2.825 ! K56CB-CA med intra
assign (resid 30 and name cb ) (resid 30 and name cg ) 3.825 2.825 2.825 ! K56CB-CG med intra
assign (resid 30 and name cb ) (resid 32 and name cg2 ) 3.825 2.825 2.825 ! K56CB-V58CG2 med med
assign (resid 30 and name cb ) (resid 65 and name ca ) 4.600 3.600 3.600 ! K56CB-Q91CA med long corrected
assign (resid 30 and name cd ) (resid 21 and name cg1 ) 4.600 3.600 3.600 ! K56CD-V47CG1 weak long
OR (resid 30 and name cd ) (resid 28 and name cg2 )
OR (resid 30 and name cd ) (resid 24 and name cg2 )
OR (resid 30 and name cd ) (resid 70 and name cg1 )
OR (resid 30 and name cd ) (resid 19 and name cb )
assign (resid 30 and name cd ) (resid 30 and name cg ) 3.825 2.825 2.825 ! K56CD-CG med intra
assign (resid 30 and name cd ) (resid 31 and name ca ) 3.825 2.825 2.825 ! K56CD-W57CA med sqntl
assign (resid 30 and name ce ) (resid 30 and name cg ) 3.825 2.825 2.825 ! K56CE-CG med intra
assign (resid 30 and name ce ) (resid 31 and name ca ) 4.600 3.600 3.600 ! K56CE-W57CA weak sqntl
assign (resid 30 and name cg ) (resid 30 and name cb ) 3.825 2.825 2.825 ! K56CG-CB med intra
assign (resid 30 and name cg ) (resid 30 and name ce ) 3.825 2.825 2.825 ! K56CG-CE med intra
assign (resid 30 and name cg ) (resid 65 and name ca ) 3.825 2.825 2.825 ! K56CG-Q91CA med long
OR (resid 30 and name cg ) (resid 50 and name ca )
assign (resid 32 and name ca ) (resid 18 and name cg1 ) 3.825 2.825 2.825 ! V58CA-V44CG1 med long
assign (resid 32 and name ca ) (resid 61 and name cg2 ) 4.600 3.600 3.600 ! V58CA-I87CG2 med long, corrected
assign (resid 32 and name cb ) (resid 32 and name cg2 ) 3.825 2.825 2.825 ! V58CB-CG2 med intra
assign (resid 32 and name cb ) (resid 62 and name cb ) 3.825 2.825 2.825 ! V58CB-F88CB med long
OR (resid 8 and name cb ) (resid 62 and name cb )
OR (resid 69 and name cb ) (resid 62 and name cb )
OR (resid 30 and name cb ) (resid 62 and name cb )
assign (resid 32 and name cg1 ) (resid 32 and name cg2 ) 3.400 2.400 2.400 ! V58CG1-CG2 stron intra
assign (resid 32 and name cg2 ) (resid 32 and name cg1 ) 3.400 2.400 2.400 ! V58CG2-CG1 stron intra
assign (resid 35 and name ca ) (resid 59 and name cb ) 4.600 3.600 3.600 ! new assignments
OR (resid 61 and name ca ) (resid 59 and name cb )
OR (resid 34 and name ca ) (resid 59 and name cb )
OR (resid 52 and name ca ) (resid 59 and name cb )
assign (resid 34 and name ca ) (resid 34 and name cg1 ) 3.825 2.825 2.825 ! V60CA-CG1 med intra
assign (resid 34 and name ca ) (resid 36 and name c ) 4.600 3.600 3.600 ! V60CA-L62C med med corrected
assign (resid 17 and name ca ) (resid 35 and name cg2 ) 3.825 2.825 2.825 ! T43ca-I61cg2/V33cg2 med long
OR (resid 17 and name ca ) (resid 7 and name cg2 )
assign (resid 34 and name cb ) (resid 34 and name cg2 ) 3.825 2.825 2.825 ! V60CB-CG2 med intra
assign (resid 34 and name cg1 ) (resid 15 and name ca ) 3.825 2.825 2.825 ! V60CG1-R41CA med long
OR (resid 27 and name cb ) (resid 15 and name ca )
assign (resid 34 and name cg1 ) (resid 34 and name ca ) 3.400 2.400 2.400 ! V60CG1-CA stron intra
assign (resid 34 and name cg1 ) (resid 62 and name cb ) 4.600 3.600 3.600 ! V60CG1/A53cb-F88CB
OR (resid 27 and name cb ) (resid 62 and name cb )
assign (resid 34 and name cg2 ) (resid 34 and name c ) 3.400 2.400 2.400 ! V60CG2-C stron intra
assign (resid 34 and name cg2 ) (resid 34 and name cb ) 3.825 2.825 2.825 ! V60CG2-CB med intra
assign (resid 34 and name cg2 ) (resid 36 and name cb ) 4.600 3.600 3.600 ! V60CG2-L62CB med med corrected
OR (resid 24 and name cg2 ) (resid 25 and name cb )
assign (resid 34 and name cg2 ) (resid 61 and name cb ) 3.825 2.825 2.825 ! V60CG2-I87CB stron long
OR (resid 20 and name cb ) (resid 21 and name cg1 )
OR (resid 34 and name cg2 ) (resid 68 and name cb )
assign (resid 35 and name ca ) (resid 34 and name cb ) 4.600 3.600 3.600 ! I61CA-V60CB weak long
assign (resid 35 and name ca ) (resid 35 and name cb ) 3.825 2.825 2.825 ! I61CA-CB med intra
assign (resid 35 and name ca ) (resid 35 and name cd1 ) 3.825 2.825 2.825 ! I61CA-CD1 med intra
assign (resid 35 and name ca ) (resid 35 and name cg1 ) 3.825 2.825 2.825 ! I61CA-CG1 med intra
assign (resid 35 and name ca ) (resid 35 and name cg2 ) 4.600 3.600 3.600 ! I61CA-CG2 weak intra
assign (resid 35 and name ca ) (resid 36 and name ca ) 4.600 3.600 3.600 ! I61CA-L62CA weak sqntl
assign (resid 35 and name ca ) (resid 59 and name cb ) 4.600 3.600 3.600 !
OR (resid 61 and name ca ) (resid 59 and name cb )
OR (resid 34 and name ca ) (resid 59 and name cb )
assign (resid 35 and name cb ) (resid 34 and name cg2 ) 4.600 3.600 3.600 ! I61CB-V60CG2 med sqntl, corrected
OR (resid 53 and name cb ) (resid 54 and name cg2 )
OR (resid 52 and name cb ) (resid 21 and name cg1 )
OR (resid 52 and name cb ) (resid 47 and name cg2 )
assign (resid 35 and name cb ) (resid 35 and name ca ) 4.600 3.600 3.600 ! I61CB-CA weak intra
assign (resid 35 and name cb ) (resid 36 and name cd* ) 4.600 3.600 3.600 ! I61CB-L62CDx weak sqntl
OR (resid 35 and name cb ) (resid 34 and name cg1 )
OR (resid 52 and name cb ) (resid 27 and name cb )
OR (resid 52 and name cb ) (resid 17 and name cg2 )
assign (resid 35 and name cd1 ) (resid 63 and name cg1 ) 3.825 2.825 2.825 ! I61cd1-V89cg1 med long
OR (resid 35 and name cd1 ) (resid 32 and name cg1 )
OR (resid 61 and name cd1 ) (resid 32 and name cg1 )
OR (resid 61 and name cd1 ) (resid 63 and name cg1 )
assign (resid 35 and name cd1 ) (resid 19 and name cb ) 3.825 2.825 2.825 ! I61CD1-A45CB med long
OR (resid 35 and name cd1 ) (resid 47 and name cg2 )
OR (resid 35 and name cd1 ) (resid 70 and name cg1 )
assign (resid 35 and name cd1 ) (resid 34 and name c ) 3.825 2.825 2.825 ! I61CD1-V60C med sqntl
assign (resid 35 and name cd1 ) (resid 35 and name ca ) 3.825 2.825 2.825 ! I61CD1-CA med intra
assign (resid 35 and name cd1 ) (resid 35 and name cb ) 3.825 2.825 2.825 ! I61CD1-CB med intra
assign (resid 35 and name cd1 ) (resid 35 and name cg1 ) 4.600 3.600 3.600 ! I61CD1-CG1 weak intra
assign (resid 35 and name cd1 ) (resid 35 and name cg2 ) 3.825 2.825 2.825 ! I61CD1-CG2 med intra
assign (resid 35 and name cd1 ) (resid 36 and name ca ) 3.825 2.825 2.825 ! I61CD1-L62CA med sqntl
OR (resid 35 and name cd1 ) (resid 14 and name ca )
OR (resid 35 and name cd1 ) (resid 51 and name ca )
assign (resid 35 and name cd1 ) (resid 36 and name cb ) 4.600 3.600 3.600 ! I61CD1-L62CB weak sqntl
assign (resid 35 and name cd1 ) (resid 36 and name cg ) 3.825 2.825 2.825 ! I61CD1-L62CG med sqntl
assign (resid 35 and name cd1 ) (resid 44 and name ca ) 4.600 3.600 3.600 ! I61CD1-D70CA weak long
assign (resid 35 and name cg1 ) (resid 35 and name cg2 ) 3.825 2.825 2.825 ! I61CG1-CG2 med intra
assign (resid 35 and name cg2 ) (resid 16 and name c ) 4.600 3.600 3.600 ! I61CG2-G42C weak long
assign (resid 35 and name cg2 ) (resid 34 and name c ) 3.825 2.825 2.825 ! I61CG2-V60C med long
assign (resid 35 and name cg2 ) (resid 35 and name cb ) 3.825 2.825 2.825 ! I61CG2-CB med intra
assign (resid 35 and name cg2 ) (resid 35 and name cg1 ) 3.825 2.825 2.825 ! I61CG2-CG1 med intra
assign (resid 35 and name cg2 ) (resid 36 and name ca ) 3.825 2.825 2.825 ! I61CG2-L62CA med sqntl
assign (resid 35 and name cg2 ) (resid 36 and name cb ) 4.600 3.600 3.600 ! I61CG2-L62CB weak sqntl
assign (resid 35 and name cg2 ) (resid 37 and name c ) 4.600 3.600 3.600 ! I61CG2-D63C weak med
assign (resid 35 and name cg2 ) (resid 55 and name c ) 4.600 3.600 3.600 ! I61CG2-C81C weak long
assign (resid 35 and name cg2 ) (resid 59 and name cb ) 4.600 3.600 3.600 ! I61CG2-H85CB weak long
assign (resid 36 and name ca ) (resid 17 and name cb ) 4.600 3.600 3.600 ! L62CA-T43CB weak long
assign (resid 36 and name ca ) (resid 35 and name ca ) 3.825 2.825 2.825 ! L62CA-I61CA med sqntl
assign (resid 36 and name ca ) (resid 35 and name cg2 ) 4.600 3.600 3.600 ! L62CA-I61CG2 weak sqntl
assign (resid 36 and name ca ) (resid 36 and name cd* ) 3.400 2.400 2.400 ! L62CA-CDx stron intra
assign (resid 36 and name ca ) (resid 36 and name cg ) 3.825 2.825 2.825 ! L62CA-CG med intra
assign (resid 36 and name cb ) (resid 15 and name cb ) 3.825 2.825 2.825 ! L62CB-R41CB med long
assign (resid 36 and name cb ) (resid 35 and name ca ) 4.600 3.600 3.600 ! L62CB-I61CA weak med
assign (resid 36 and name cb ) (resid 40 and name cg ) 4.600 3.600 3.600 ! L62CB-K66CG weak long
OR (resid 25 and name cb ) (resid 40 and name cg )
assign (resid 36 and name cb ) (resid 59 and name cb ) 3.825 2.825 2.825 ! L62CB-H85CB med long
OR (resid 36 and name cb ) (resid 57 and name cb )
OR (resid 25 and name cb ) (resid 57 and name cb )
OR (resid 25 and name cb ) (resid 59 and name cb )
assign (resid 36 and name cd* ) (resid 36 and name c ) 3.400 2.400 2.400 ! L62CDx-C stron intra
assign (resid 36 and name cd* ) (resid 37 and name cb ) 4.600 3.600 3.600 ! L62CDx-D63CB med sqntl degenerate, corrected
assign (resid 36 and name cd2 ) (resid 35 and name cg1 ) 3.825 2.825 2.825 ! L62CDx-I61CG1 med sqntl
assign (resid 36 and name cd* ) (resid 36 and name ca ) 3.400 2.400 2.400 ! L62CDx-CA stron intra
assign (resid 36 and name cd* ) (resid 36 and name cg ) 3.400 2.400 2.400 ! L62CDx-CG stron intra
assign (resid 36 and name cg ) (resid 36 and name ca ) 3.825 2.825 2.825 ! L62CG-CA med intra
assign (resid 36 and name cg ) (resid 36 and name cd* ) 3.400 2.400 2.400 ! L62CG-CDx stron intra
assign (resid 36 and name cg ) (resid 38 and name cg ) 4.600 3.600 3.600 ! L62CG-E64CG med med corrected
assign (resid 36 and name cd* ) (resid 34 and name ca ) 3.825 2.825 2.825 ! L62CDx-V60CA med med
assign (resid 37 and name ca ) (resid 37 and name cb ) 3.825 2.825 2.825 ! D63CA-CB med intra
assign (resid 37 and name cb ) (resid 17 and name cb ) 4.600 3.600 3.600 ! D63cb-T43cb weak long
assign (resid 37 and name cb ) (resid 37 and name ca ) 4.600 3.600 3.600 ! D63CB-CA weak intra
assign (resid 37 and name cb ) (resid 38 and name ca ) 3.825 2.825 2.825 ! D63CB-E64CA med sqntl
assign (resid 38 and name ca ) (resid 37 and name cb ) 4.600 3.600 3.600 ! E64CA-D63CB weak sqntl
assign (resid 38 and name ca ) (resid 39 and name cb ) 3.825 2.825 2.825 ! E64CA-A65CB med sqntl
assign (resid 39 and name cb ) (resid 36 and name cb ) 4.600 3.600 3.600 ! A65CB-L62CB weak med
assign (resid 39 and name cb ) (resid 38 and name ca ) 3.825 2.825 2.825 ! A65CB-E64CA med sqntl
assign (resid 39 and name cb ) (resid 38 and name cg ) 3.825 2.825 2.825 ! A65CB-E64CG med sqntl
assign (resid 39 and name cb ) (resid 39 and name c ) 3.400 2.400 2.400 ! A65CB-C stron intra
assign (resid 39 and name cb ) (resid 39 and name ca ) 4.600 3.600 3.600 ! A65CB-CA weak intra
assign (resid 39 and name cb ) (resid 40 and name cd ) 4.600 3.600 3.600 ! A65CB-K66CD weak sqntl
assign (resid 40 and name cd ) (resid 38 and name cg ) 3.825 2.825 2.825 ! K66CD-E64CG med med
assign (resid 40 and name cd ) (resid 39 and name c ) 3.400 2.400 2.400 ! K66CD-A65C stron sqntl
assign (resid 40 and name cd ) (resid 39 and name cb ) 3.825 2.825 2.825 ! K66CD-A65CB med sqntl
assign (resid 41 and name ca ) (resid 36 and name cg ) 4.600 3.600 3.600 ! G67CA-L62cg weak long
assign (resid 42 and name cb ) (resid 42 and name cd ) 3.825 2.825 2.825 ! K68CB-CD med intra
assign (resid 42 and name cb ) (resid 43 and name ca ) 3.825 2.825 2.825 ! K68CB-N69CA med sqntl
assign (resid 42 and name cd ) (resid 42 and name c ) 3.400 2.400 2.400 ! K68CD-C stron intra
assign (resid 42 and name cd ) (resid 42 and name cb ) 3.825 2.825 2.825 ! K68CD-CB med intra
assign (resid 42 and name cd ) (resid 42 and name ce ) 3.825 2.825 2.825 ! K68CD-CE med intra
assign (resid 42 and name cd ) (resid 43 and name ca ) 3.825 2.825 2.825 ! K68CD-N69CA med sqntl
assign (resid 42 and name ce ) (resid 42 and name cd ) 3.825 2.825 2.825 ! K68CE-CD med intra
assign (resid 42 and name ce ) (resid 43 and name ca ) 3.825 2.825 2.825 ! K68CE-N69CA med sqntl
assign (resid 43 and name ca ) (resid 42 and name ce ) 3.825 2.825 2.825 ! N69CA-K68CE med sqntl
assign (resid 43 and name ca ) (resid 47 and name cg2 ) 4.600 3.600 3.600 ! N69CA-V73CG2 med med, degenerate, corrected
assign (resid 43 and name ca ) (resid 43 and name cb ) 3.825 2.825 2.825 ! N69CA-CB med intra
assign (resid 43 and name cb ) (resid 43 and name ca ) 3.825 2.825 2.825 ! N69CB-CA med intra
assign (resid 44 and name ca ) (resid 44 and name cb ) 3.825 2.825 2.825 ! D70CA-CB med intra
assign (resid 44 and name ca ) (resid 44 and name cg ) 3.825 2.825 2.825 ! D70CA-CG med intra
assign (resid 44 and name ca ) (resid 46 and name cg2 ) 4.600 3.600 3.600 ! D70CA-T72CG2 weak med
OR (resid 44 and name ca ) (resid 23 and name cb )
OR (resid 44 and name ca ) (resid 32 and name cg2 )
assign (resid 44 and name cb ) (resid 44 and name cg ) 3.825 2.825 2.825 ! D70CB-CG med intra
assign (resid 44 and name cb ) (resid 54 and name cb ) 4.600 3.600 3.600 ! D70CB-T80CB weak long
OR (resid 37 and name cb ) (resid 17 and name cb )
OR (resid 37 and name cb ) (resid 54 and name cb )
assign (resid 44 and name cb ) (resid 54 and name cg2 ) 4.600 3.600 3.600 ! D70CB-T80CG2 med long corrected
OR (resid 44 and name cb ) (resid 47 and name cg2 )
OR (resid 44 and name cb ) (resid 19 and name cb )
OR (resid 44 and name cb ) (resid 24 and name cg2 )
OR (resid 44 and name cb ) (resid 70 and name cg1 )
OR (resid 44 and name cb ) (resid 28 and name cg2 )
OR (resid 43 and name cb ) (resid 54 and name cg2 )
OR (resid 43 and name cb ) (resid 47 and name cg2 )
OR (resid 43 and name cb ) (resid 19 and name cb )
OR (resid 43 and name cb ) (resid 24 and name cg2 )
OR (resid 43 and name cb ) (resid 70 and name cg1 )
OR (resid 43 and name cb ) (resid 28 and name cg2 )
assign (resid 46 and name ca ) (resid 46 and name cb ) 3.825 2.825 2.825 ! T72CA-CB med intra
assign (resid 46 and name cb ) (resid 46 and name c ) 3.825 2.825 2.825 ! T72CB-C med intra
assign (resid 46 and name cb ) (resid 46 and name ca ) 3.825 2.825 2.825 ! T72CB-CA med intra
assign (resid 47 and name cb ) (resid 48 and name cg ) 3.825 2.825 2.825 ! V73CB-Q74CG med sqntl
assign (resid 47 and name cg2 ) (resid 46 and name cb ) 4.600 3.600 3.600 ! V73cg2-T72cb weak intra
assign (resid 8 and name ca ) (resid 47 and name cg2 ) 4.600 3.600 3.600 ! E34ca-V73cg2 med long
OR (resid 8 and name ca ) (resid 19 and name cb )
OR (resid 8 and name ca ) (resid 24 and name cg2 )
OR (resid 8 and name ca ) (resid 70 and name cg1 )
OR (resid 8 and name ca ) (resid 28 and name cg2 )
OR (resid 8 and name ca ) (resid 36 and name cd* )
OR (resid 43 and name ca ) (resid 47 and name cg2 )
OR (resid 43 and name ca ) (resid 19 and name cb )
OR (resid 43 and name ca ) (resid 24 and name cg2 )
OR (resid 43 and name ca ) (resid 70 and name cg1 )
OR (resid 43 and name ca ) (resid 28 and name cg2 )
OR (resid 43 and name ca ) (resid 36 and name cd* )
assign (resid 47 and name cg2 ) (resid 53 and name cd2 ) 4.600 3.600 3.600 ! V73CG2-F79CD2 med long, corrected
assign (resid 48 and name ca ) (resid 47 and name cb ) 3.825 2.825 2.825 ! Q74CA-V73CB med sqntl
assign (resid 48 and name ca ) (resid 26 and name cb ) 4.600 3.600 3.600 ! Q74CA-F52CB med long
assign (resid 48 and name cg ) (resid 47 and name cb ) 3.825 2.825 2.825 ! Q74CG-V73CB med sqntl
assign (resid 50 and name ca ) (resid 47 and name ca ) 3.825 2.825 2.825 ! R76CA-V73CA med med
OR (resid 44 and name ca ) (resid 47 and name ca )
assign (resid 51 and name cb ) (resid 53 and name cb ) 4.600 3.600 3.600 ! K77CB-F79CB weak med, corrected
OR (resid 51 and name cb ) (resid 52 and name cb )
OR (resid 51 and name cb ) (resid 35 and name cb )
OR (resid 40 and name cb ) (resid 53 and name cb )
OR (resid 40 and name cb ) (resid 52 and name cb )
OR (resid 40 and name cb ) (resid 35 and name cb )
OR (resid 15 and name cb ) (resid 53 and name cb )
OR (resid 15 and name cb ) (resid 52 and name cb )
OR (resid 15 and name cb ) (resid 35 and name cb )
assign (resid 51 and name cb ) (resid 54 and name cb ) 4.600 3.600 3.600 ! K77CB-T80CB weak med
assign (resid 51 and name cd ) (resid 53 and name c ) 3.825 2.825 2.825 ! K77CD-F79C med med
assign (resid 51 and name cd ) (resid 54 and name cg2 ) 4.600 3.600 3.600 ! K77CD-T80CG weak med
assign (resid 51 and name ce ) (resid 54 and name ca ) 4.600 3.600 3.600 ! K77CE-T80CA weak med
assign (resid 51 and name cb ) (resid 51 and name cd ) 3.825 2.825 2.825 ! K77CB-CD med intra
assign (resid 51 and name cd ) (resid 51 and name cb ) 3.825 2.825 2.825 ! K77CD-CB med intra
assign (resid 54 and name ca ) (resid 52 and name cb ) 4.600 3.600 3.600 ! T80CA-Y78CB med med, corrected;T80CA-F79CB med sqnt
OR (resid 54 and name ca ) (resid 53 and name cb )
assign (resid 54 and name cb ) (resid 44 and name ca ) 4.600 3.600 3.600 ! T80CB-D70CA weak long
assign (resid 54 and name cb ) (resid 54 and name c ) 3.400 2.400 2.400 ! T80CB-C stron intra
assign (resid 54 and name cb ) (resid 54 and name ca ) 3.825 2.825 2.825 ! T80CB-CA med intra
assign (resid 54 and name cb ) (resid 54 and name cg2 ) 3.825 2.825 2.825 ! T80CB-CG med intra
assign (resid 54 and name cb ) (resid 57 and name cb ) 4.600 3.600 3.600 ! T80CB-E83CB weak med, wrong assignment
assign (resid 54 and name cg2 ) (resid 54 and name ca ) 3.825 2.825 2.825 ! T80CG-CA med intra
assign (resid 55 and name ca ) (resid 35 and name cd1 ) 4.600 3.600 3.600 ! C81ca-I61cd1 weak long; F79ca-I61cd1
OR (resid 53 and name ca ) (resid 35 and name cd1 )
assign (resid 55 and name ca ) (resid 55 and name cb ) 3.400 2.400 2.400 ! C81CA-CB stron intra
assign (resid 55 and name ca ) (resid 59 and name cb ) 4.600 3.600 3.600 ! C81CA-H85CB med med, corrected
OR (resid 51 and name ca ) (resid 59 and name cb )
OR (resid 30 and name ca ) (resid 59 and name cb )
assign (resid 55 and name cb ) (resid 55 and name ca ) 4.600 3.600 3.600 ! C81CB-CA weak intra
assign (resid 56 and name ca ) (resid 56 and name cg ) 3.825 2.825 2.825 ! D82CA-CG med intra
assign (resid 56 and name cb ) (resid 55 and name ca ) 4.600 3.600 3.600 ! D82CB-C81CA weak sqntl
assign (resid 56 and name cb ) (resid 57 and name ca ) 3.825 2.825 2.825 ! D82CB-E83CA med sqntl
assign (resid 56 and name cb ) (resid 58 and name ca ) 4.600 3.600 3.600 ! D82CB-G84CA weak med
OR (resid 56 and name cb ) (resid 29 and name ca )
OR (resid 56 and name cb ) (resid 33 and name ca )
assign (resid 57 and name ca ) (resid 56 and name cb ) 4.600 3.600 3.600 ! E83CA-D82CB weak sqntl
assign (resid 59 and name ca ) (resid 35 and name cb ) 3.825 2.825 2.825 ! H85CA-I61CB med med
OR (resid 59 and name ca ) (resid 53 and name cb )
OR (resid 42 and name ca ) (resid 35 and name cb )
OR (resid 42 and name ca ) (resid 53 and name cb )
OR (resid 48 and name ca ) (resid 35 and name cb )
OR (resid 48 and name ca ) (resid 53 and name cb )
OR (resid 30 and name ca ) (resid 35 and name cb )
OR (resid 30 and name ca ) (resid 53 and name cb )
assign (resid 59 and name ca ) (resid 43 and name ca ) 4.600 3.600 3.600 ! H85CA-N69CA weak long
assign (resid 59 and name ca ) (resid 43 and name cb ) 4.600 3.600 3.600 ! H85CA-N69CB weak long
OR (resid 59 and name ca ) (resid 44 and name cb )
OR (resid 55 and name ca ) (resid 43 and name cb )
OR (resid 55 and name ca ) (resid 44 and name cb )
OR (resid 42 and name ca ) (resid 43 and name cb )
OR (resid 42 and name ca ) (resid 44 and name cb )
assign (resid 59 and name cb ) (resid 55 and name c ) 3.825 2.825 2.825 ! H85CB-C81C med med, corrected
assign (resid 59 and name cb ) (resid 59 and name c ) 3.400 2.400 2.400 ! H85CB-C stron intra
assign (resid 60 and name ca ) (resid 36 and name cd* ) 4.600 3.600 3.600 ! G86CA-L62CD med long
OR (resid 60 and name ca ) (resid 17 and name cg2 )
OR (resid 60 and name ca ) (resid 34 and name cg1 )
OR (resid 60 and name ca ) (resid 27 and name cb )
OR (resid 22 and name ca ) (resid 17 and name cg2 )
OR (resid 22 and name ca ) (resid 36 and name cd* )
OR (resid 22 and name ca ) (resid 34 and name cg1 )
OR (resid 22 and name ca ) (resid 27 and name cb )
assign (resid 61 and name cb ) (resid 61 and name cd1 ) 4.600 3.600 3.600 ! I87CB-CD1 weak intra
assign (resid 61 and name cd1 ) (resid 32 and name cg1 ) 4.600 3.600 3.600 ! I87cd1/I61cd1-V58cg1
OR (resid 35 and name cd1 ) (resid 32 and name cg1 )
assign (resid 61 and name cd1 ) (resid 63 and name cg2 ) 4.600 3.600 3.600 ! I87CD1-V89CG2 weak med
assign (resid 61 and name cg2 ) (resid 61 and name ca ) 3.825 2.825 2.825 ! I87CG2-I87CA med intra
assign (resid 62 and name cb ) (resid 34 and name cg2 ) 4.600 3.600 3.600 ! F88CB-V60CG2 weak long
assign (resid 62 and name cb ) (resid 42 and name cb ) 4.600 3.600 3.600 ! F88CB-K68CB weak long, vio, but should be
assign (resid 63 and name ca ) (resid 63 and name cg1 ) 3.825 2.825 2.825 ! V89CA-CG1 med intra
assign (resid 63 and name cb ) (resid 68 and name cg1 ) 4.600 3.600 3.600 ! V89CB-I94CG1 weak long
assign (resid 63 and name cg1 ) (resid 63 and name ca ) 3.825 2.825 2.825 ! V89CG-CA med intra
assign (resid 63 and name cg1 ) (resid 63 and name cb ) 3.825 2.825 2.825 ! V89CG1-CB med intra
assign (resid 63 and name cg1 ) (resid 63 and name cg2 ) 3.825 2.825 2.825 ! V89CG1-CG2 med intra
assign (resid 63 and name cg2 ) (resid 63 and name c ) 3.825 2.825 2.825 ! V89CG2-C med intra
assign (resid 63 and name cg2 ) (resid 63 and name ca ) 3.825 2.825 2.825 ! V89CG2-CA med intra
assign (resid 63 and name cg2 ) (resid 63 and name cb ) 3.825 2.825 2.825 ! V89CG2-CB med intra
assign (resid 63 and name cg2 ) (resid 63 and name cg1 ) 3.825 2.825 2.825 ! V89CG2-CG1 med intra
assign (resid 63 and name cg2 ) (resid 64 and name ca ) 3.825 2.825 2.825 ! V89CG2-R90CA med sqntl
assign (resid 64 and name ca ) (resid 30 and name ca ) 4.600 3.600 3.600 ! R90CA-K56CA weak long
assign (resid 64 and name ca ) (resid 63 and name cg2 ) 3.825 2.825 2.825 ! R90CA-V89CG2 med sqntl
assign (resid 64 and name ca ) (resid 65 and name cg ) 4.600 3.600 3.600 ! R90CA-Q91CG weak sqntl
assign (resid 65 and name ca ) (resid 30 and name cb ) 4.600 3.600 3.600 ! Q91CA-K56CB med long, corrected
assign (resid 65 and name ca ) (resid 68 and name cg1 ) 4.600 3.600 3.600 ! Q91CA-I94CG1 weak med
assign (resid 65 and name cb ) (resid 66 and name cb ) 3.825 2.825 2.825 ! Q91CB-S92CB med sqntl
assign (resid 66 and name ca ) (resid 65 and name cb ) 3.825 2.825 2.825 ! S92CA-Q91CB med sqntl
OR (resid 63 and name ca ) (resid 65 and name cb )
assign (resid 66 and name cb ) (resid 65 and name cb ) 3.825 2.825 2.825 ! S92CB-Q91CB med sqntl
assign (resid 66 and name cb ) (resid 65 and name cg ) 4.600 3.600 3.600 ! S92CB-Q91CG weak sqntl
assign (resid 68 and name ca ) (resid 67 and name cg ) 3.350 2.350 2.350 ! I94CA-Q93cg/V89cb
OR (resid 68 and name ca ) (resid 63 and name cb )
assign (resid 68 and name ca ) (resid 68 and name cd1 ) 3.825 2.825 2.825 ! I94CA-CD1 med intra
assign (resid 68 and name ca ) (resid 68 and name cg2 ) 3.825 2.825 2.825 ! I94CA-CG2 med intra
assign (resid 68 and name cb ) (resid 68 and name ca ) 4.600 3.600 3.600 ! I94CB-CA weak intra
assign (resid 68 and name cd1 ) (resid 7 and name c ) 3.825 2.825 2.825 ! I94CD1-V33C med long
assign (resid 68 and name cd1 ) (resid 7 and name cb ) 3.825 2.825 2.825 ! I94CD1-V33CB med long
assign (resid 68 and name cd1 ) (resid 9 and name cb ) 4.600 3.600 3.600 ! I94CD1-V35CB weak long
assign (resid 68 and name cd1 ) (resid 63 and name cb ) 4.600 3.600 3.600 ! I94CD1-V89cb weak long
assign (resid 68 and name cd1 ) (resid 68 and name c ) 4.600 3.600 3.600 ! I94CD1-C weak intra
assign (resid 68 and name cd1 ) (resid 68 and name ca ) 3.825 2.825 2.825 ! I94CD1-CA med intra
assign (resid 68 and name cd1 ) (resid 68 and name cg2 ) 3.825 2.825 2.825 ! I94CD1-CG2 med intra
assign (resid 30 and name cg) (resid 27 and name cb ) 4.600 3.600 3.600 ! K56cg-A53cb/T43cg2/V29cg1; V29cg1-L27CDx
OR (resid 30 and name cg) (resid 17 and name cb )
OR (resid 30 and name cg) (resid 3 and name cg1 )
OR (resid 1 and name cd*) (resid 3 and name cg1 )
assign (resid 68 and name cg1 ) (resid 68 and name cg2 ) 3.825 2.825 2.825 ! I94CG1-CG2 med intra
assign (resid 68 and name cg2 ) (resid 68 and name ca ) 3.825 2.825 2.825 ! I94CG2-CA med intra
assign (resid 68 and name cg2 ) (resid 68 and name cd1 ) 3.825 2.825 2.825 ! I94CG2-CD1 med intra
assign (resid 68 and name cg2 ) (resid 68 and name cg1 ) 3.825 2.825 2.825 ! I94CG2-CG1 med intra
assign (resid 69 and name cb ) (resid 71 and name cb ) 4.600 3.600 3.600 ! Q95CB-F97CB weak med
assign (resid 70 and name ca ) (resid 70 and name cb ) 3.825 2.825 2.825 ! V96CA-CB med intra
assign (resid 70 and name cb ) (resid 70 and name ca ) 3.825 2.825 2.825 ! V96CB-CA med intra
! Additional assignments after two passes
!! New assigned peaks in 1,3 capgly 500ms spectra, sine-bell 30,45 degree processed
assign (resid 56 and name ca ) (resid 57 and name ca ) 4.6 3.6 3.6 ! D82ca-D83ca weak sqntl
assign (resid 57 and name cb ) (resid 44 and name cb ) 4.6 3.6 3.6 ! E83cb-D701cb weak long
OR (resid 57 and name cb ) (resid 43 and name cb )
assign (resid 2 and name ca ) (resid 18 and name cg2 ) 4.6 3.6 3.6 ! R28ca-V44cg2 weak long
OR (resid 2 and name ca ) (resid 3 and name cg1 )
assign (resid 28 and name ca ) (resid 23 and name cb ) 4.6 3.6 3.6 ! T54ca-A49cb weak long
!! New assigned peaks in 1,3 capgly 500ms spectra, sine-bell 60 degree processed
assign (resid 1 and name cd* ) (resid 5 and name cb ) 4.6 3.6 3.6 ! L27cdx-S31cb weak long
assign (resid 5 and name cb ) (resid 6 and name cb ) 4.6 3.6 3.6 ! S31cb-R32cb weak sqntl
OR (resid 5 and name cb ) (resid 1 and name cg )
assign (resid 5 and name cb ) (resid 18 and name cg1 ) 4.6 3.6 3.6 ! S31cb-V44cg1 weak long
assign (resid 7 and name cb ) (resid 5 and name cb ) 4.6 3.6 3.6 ! V33cb-S31cb weak med
assign (resid 7 and name cb ) (resid 68 and name cg1 ) 4.6 3.6 3.6 ! V33cb-I94cg1 weak long
assign (resid 8 and name ca ) (resid 68 and name cb ) 4.6 3.6 3.6 ! E34ca-I94cb weak long
OR (resid 43 and name ca ) (resid 61 and name cb )
assign (resid 8 and name cb ) (resid 68 and name ca ) 4.6 3.6 3.6 ! E34cb-I94ca weak long
assign (resid 8 and name cg ) (resid 9 and name ca ) 4.6 3.6 3.6 ! E34cg-V35ca weak intra
OR (resid 8 and name cg ) (resid 70 and name ca )
assign (resid 9 and name ca ) (resid 15 and name cb ) 4.6 3.6 3.6 ! V35ca-R41cb weak long
assign (resid 10 and name ca ) (resid 8 and name cb ) 4.6 3.6 3.6 ! I36ca-E34cb weak med
assign (resid 10 and name cb ) (resid 9 and name ca ) 4.6 3.6 3.6 ! I36cb-V35ca weak sqntl
assign (resid 15 and name ca ) (resid 13 and name ca ) 4.6 3.6 3.6 ! R41ca-G39ca weak med
assign (resid 21 and name ca ) (resid 33 and name ca ) 4.6 3.6 3.6 ! V47ca-G59ca weak long
OR (resid 28 and name ca ) (resid 29 and name ca )
assign (resid 28 and name ca ) (resid 23 and name cb ) 4.6 3.6 3.6 ! T54ca-A49cb weak long
assign (resid 32 and name ca ) (resid 64 and name ca ) 4.6 3.6 3.6 ! V58ca-R90ca weak long
assign (resid 32 and name cb ) (resid 34 and name ca ) 4.6 3.6 3.6 ! V58cb-V60ca weak med
assign (resid 32 and name cb ) (resid 62 and name ca ) 4.6 3.6 3.6 ! V58cb-F88ca weak long
assign (resid 34 and name ca ) (resid 32 and name cb ) 4.6 3.6 3.6 ! V60ca_V58cb weak med
assign (resid 34 and name cb ) (resid 61 and name ca ) 4.6 3.6 3.6 ! V60cb_I87ca weak long
OR (resid 34 and name cb ) (resid 35 and name ca )
assign (resid 35 and name ca ) (resid 59 and name cb ) 4.6 3.6 3.6 ! I61ca_H85cb weak long
OR (resid 61 and name ca ) (resid 59 and name cb )
assign (resid 36 and name cb ) (resid 61 and name cb ) 4.6 3.6 3.6 ! L62cb-I87cb weak long
assign (resid 36 and name cg ) (resid 37 and name ca ) 4.6 3.6 3.6 ! L62cg-D63ca weak sqntl
assign (resid 41 and name ca ) (resid 42 and name cg ) 4.6 3.6 3.6 ! G67ca-K68cg weak sqntl
assign (resid 41 and name ca ) (resid 57 and name ca ) 4.6 3.6 3.6 ! G67ca-E83ca weak long
OR (resid 45 and name ca ) (resid 57 and name ca )
assign (resid 43 and name ca ) (resid 61 and name ca ) 4.6 3.6 3.6 ! N69ca-I87ca weak long
assign (resid 43 and name cb ) (resid 47 and name ca ) 4.6 3.6 3.6 ! N69cb-V73ca weak long
assign (resid 52 and name cb ) (resid 54 and name ca ) 4.6 3.6 3.6 ! Y78cb-T80ca weak med
assign (resid 54 and name ca ) (resid 56 and name ca ) 4.6 3.6 3.6 ! T80ca-D82ca weak med
assign (resid 54 and name cb ) (resid 55 and name ca ) 4.6 3.6 3.6 ! T80cb-C81ca weak sqntl
assign (resid 57 and name ca ) (resid 55 and name cb ) 4.6 3.6 3.6 ! E83ca-C81cb weak med
OR (resid 68 and name ca ) (resid 9 and name cb )
OR (resid 7 and name ca ) (resid 9 and name cb )
OR (resid 7 and name ca ) (resid 70 and name cb )
assign (resid 58 and name ca ) (resid 43 and name ca ) 4.6 3.6 3.6 ! G84ca-N69ca weak long
OR (resid 13 and name ca ) (resid 8 and name ca )
assign (resid 60 and name ca ) (resid 55 and name ca ) 4.6 3.6 3.6 ! G86ca-C81ca weak long
assign (resid 61 and name ca ) (resid 63 and name cg2 ) 4.6 3.6 3.6 ! I87ca-V89cg2 weak med
assign (resid 62 and name ca ) (resid 63 and name cb ) 4.6 3.6 3.6 ! F88ca-V89cb weak sqntl
assign (resid 62 and name cb ) (resid 32 and name ca ) 4.6 3.6 3.6 ! F88cb-V58ca weak long
assign (resid 62 and name cb ) (resid 32 and name cg1 ) 4.6 3.6 3.6 ! F88cb-V58cg1 weak long
assign (resid 62 and name cb ) (resid 32 and name cg2 ) 4.6 3.6 3.6 ! F88cb-V58cg2 weak long
assign (resid 62 and name cb ) (resid 42 and name cb ) 4.6 3.6 3.6 ! F88cb-K68cb weak long
assign (resid 63 and name ca ) (resid 31 and name ca ) 4.6 3.6 3.6 ! V89ca-W57ca weak long
assign (resid 63 and name cb ) (resid 62 and name cb ) 4.6 3.6 3.6 ! V89cb-F88cb weak sqntl
assign (resid 65 and name ca ) (resid 64 and name ca ) 4.6 3.6 3.6 ! Q91ca-R90ca weak sqntl
assign (resid 67 and name ca ) (resid 9 and name cb ) 4.6 3.6 3.6 ! Q93ca-V35cb weak long
assign (resid 67 and name cb ) (resid 68 and name ca ) 4.6 3.6 3.6 ! Q93cb-I94ca weak sqntl
OR (resid 64 and name cb ) (resid 68 and name ca )
assign (resid 68 and name ca ) (resid 67 and name cb ) 4.6 3.6 3.6 ! Q93cb-I94ca weak sqntl
assign (resid 70 and name ca ) (resid 68 and name ca ) 4.6 3.6 3.6 ! V96ca-I94ca weak sqntl
OR (resid 9 and name ca ) (resid 68 and name ca )
!! New assigned peaks in 2 capgly 500ms spectra sine-bell 30,45 degree processed
assign (resid 19 and name ca ) (resid 32 and name cb ) 4.6 3.6 3.6 ! A45ca-V58cb weak long
!! New assigned peaks in 2capgly 500ms spectra, sine-bell 60 degree processed
assign (resid 1 and name cd* ) (resid 69 and name ca ) 4.6 3.6 3.6 ! L27cdx-Q95ca weak long
assign (resid 7 and name ca ) (resid 68 and name cb ) 4.6 3.6 3.6 ! V33ca-I94cb weak long
assign (resid 8 and name ca ) (resid 9 and name ca ) 4.6 3.6 3.6 ! E34ca-V35ca weak sqntl
assign (resid 8 and name ca ) (resid 14 and name cb ) 4.6 3.6 3.6 ! E34ca-H40cb weak long
assign (resid 8 and name ca ) (resid 68 and name cg1 ) 4.6 3.6 3.6 ! E34ca-I94cg1 weak long
assign (resid 8 and name cg ) (resid 69 and name cb ) 4.6 3.6 3.6 ! E34cg-Q95cb weak long
assign (resid 9 and name ca ) (resid 8 and name ca ) 4.6 3.6 3.6 ! V35ca-E34ca weak sqntl
assign (resid 15 and name cb ) (resid 8 and name cg ) 4.6 3.6 3.6 ! R41cb-E34cg weak long
assign (resid 16 and name ca ) (resid 36 and name cb ) 4.6 3.6 3.6 ! G42ca-L62cb weak long
assign (resid 17 and name ca ) (resid 36 and name cb ) 4.6 3.6 3.6 ! T43ca-L62cb weak long
assign (resid 18 and name cb ) (resid 34 and name cb ) 4.6 3.6 3.6 ! V44cb-V60cb weak long
assign (resid 18 and name cg2 ) (resid 34 and name cb ) 4.6 3.6 3.6 ! V44cg2-V60cb weak long
assign (resid 19 and name ca ) (resid 34 and name cb ) 4.6 3.6 3.6 ! A45ca-V60cb weak long
assign (resid 21 and name ca ) (resid 20 and name ca ) 4.6 3.6 3.6 ! V47ca-Y46ca weak sqntl
assign (resid 23 and name cb ) (resid 28 and name ca ) 4.6 3.6 3.6 ! A49cb-T54ca weak long
assign (resid 25 and name cb ) (resid 27 and name ca ) 4.6 3.6 3.6 ! L51cb-A53ca weak med
assign (resid 27 and name ca ) (resid 25 and name cb ) 4.6 3.6 3.6 ! A53ca-L51cb weak med
assign (resid 32 and name cb ) (resid 64 and name ca ) 4.6 3.6 3.6 ! V58cb-R90ca weak long
assign (resid 34 and name cb ) (resid 18 and name cb ) 4.6 3.6 3.6 ! V60cb-V44cb weak long
assign (resid 34 and name cb ) (resid 19 and name ca ) 4.6 3.6 3.6 ! V60cb-A45ca weak long
assign (resid 34 and name cb ) (resid 61 and name cg1 ) 4.6 3.6 3.6 ! V60cb-I87cg1 weak long
assign (resid 34 and name cb ) (resid 62 and name cb ) 4.6 3.6 3.6 ! V60cb-F88cb weak long
assign (resid 34 and name cg1 ) (resid 37 and name ca ) 4.6 3.6 3.6 ! V60cg1-D63ca weak med
assign (resid 34 and name cg1 ) (resid 63 and name ca ) 4.6 3.6 3.6 ! V60cg1-V89ca weak long
assign (resid 36 and name cb ) (resid 16 and name ca ) 4.6 3.6 3.6 ! L62cb-G42ca weak long
assign (resid 36 and name cg ) (resid 58 and name ca ) 4.6 3.6 3.6 ! L62cg-G84ca weak long
assign (resid 37 and name ca ) (resid 59 and name cb ) 4.6 3.6 3.6 ! D63ca-H85cb weak long
assign (resid 38 and name ca ) (resid 39 and name ca ) 4.6 3.6 3.6 ! E64ca-A65ca weak sqntl
assign (resid 39 and name ca ) (resid 38 and name ca ) 4.6 3.6 3.6 ! A65ca-E64ca weak sqntl
assign (resid 40 and name cg ) (resid 37 and name ca ) 4.6 3.6 3.6 ! K66cg-D63ca weak med
assign (resid 51 and name cg ) (resid 46 and name ca ) 4.6 3.6 3.6 ! K77cg-T72ca weak long
assign (resid 54 and name ca ) (resid 45 and name ca ) 4.6 3.6 3.6 ! T80ca-G71ca weak long
assign (resid 57 and name ca ) (resid 44 and name ca ) 4.6 3.6 3.6 ! E83ca-D70ca weak long
assign (resid 58 and name ca ) (resid 56 and name cb ) 4.6 3.6 3.6 ! G84ca-D82cb weak med
assign (resid 61 and name cb ) (resid 36 and name cb ) 4.6 3.6 3.6 ! I87cb-L62cb weak long
assign (resid 62 and name cb ) (resid 34 and name cb ) 4.6 3.6 3.6 ! F88cb-V60cb weak long
assign (resid 64 and name ca ) (resid 62 and name ca ) 4.6 3.6 3.6 ! R90ca-F88ca weak med
assign (resid 64 and name ca ) (resid 67 and name ca ) 4.6 3.6 3.6 ! R90ca-Q93ca weak med
assign (resid 67 and name ca ) (resid 64 and name ca ) 4.6 3.6 3.6 ! Q93ca-R90ca weak med
assign (resid 69 and name ca ) (resid 70 and name cb ) 4.6 3.6 3.6 ! Q95ca-V96cb weak sqntl
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