NMR Restraints Grid |
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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