NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype |
|
|
572856 |
2mfg   |
19548 | cing | 2-parsed | STAR | entry | full |
data_2mfg_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mfg
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project" NMR . parsed_2mfg 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mfg
_Entry.Title "Original constraint list(s)"
_Entry.Version_type original
_Entry.Submission_date .
_Entry.Accession_date .
_Entry.Last_release_date .
_Entry.Original_release_date .
_Entry.Origination .
_Entry.NMR_STAR_version 3.1
_Entry.Original_NMR_STAR_version .
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype .
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 2mfg "Master copy" parsed_2mfg
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mfg
_Constraint_stat_list.ID 1
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 2mfg.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mfg 1
1 2mfg.mr . . AMBER 2 distance NOE simple 0 parsed_2mfg 1
1 2mfg.mr . . AMBER 3 distance "hydrogen bond" simple 0 parsed_2mfg 1
1 2mfg.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2mfg 1
1 2mfg.mr . . AMBER 5 stereochemistry chirality "Not applicable" 0 parsed_2mfg 1
1 2mfg.mr . . AMBER 6 unknown "Not applicable" "Not applicable" 0 parsed_2mfg 1
1 2mfg.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mfg 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2mfg
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
*HEADER TRANSLATION/RNA 11-OCT-13 2MFG
*TITLE CSR/RSM PROTEIN-RNA RECOGNITION - A MOLECULAR AFFINITY RULER:
*TITLE 2 RSMZ(SL4)/RSME(DIMER) 2:1 COMPLEX
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: CARBON STORAGE REGULATOR HOMOLOG;
*COMPND 3 CHAIN: A, C;
*COMPND 4 ENGINEERED: YES;
*COMPND 5 MOL_ID: 2;
*COMPND 6 MOLECULE: SL4(RSMZ) RNA;
*COMPND 7 CHAIN: B, D;
*COMPND 8 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS FLUORESCENS;
*SOURCE 3 ORGANISM_TAXID: 294;
*SOURCE 4 GENE: RSME, CSRA;
*SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 7 EXPRESSION_SYSTEM_VECTOR: PET28A;
*SOURCE 8 MOL_ID: 2;
*SOURCE 9 SYNTHETIC: YES
*KEYWDS CSRA, RSMA, RSME, RSMZ, CSRB, TRANSLATION REPRESSOR PROTEIN,
*KEYWDS 2 TRANSLATION ACTIVATION, PROTEIN SEQUESTRATION, BACTERIAL PROTEIN,
*KEYWDS 3 NON-CODING RNA, SRNA, PSEUDOMONAS AERUGINOSA, RNA-BINDING PROTEINS,
*KEYWDS 4 MESSENGER RNA, MODULATION OF BINDING AFFINITY, MOLECULAR MIMICRY,
*KEYWDS 5 TRANSLATION-RNA COMPLEX
*EXPDTA SOLUTION NMR
*NUMMDL 20
*AUTHOR O.DUSS, N.DIARRA DIT KONTE, E.MICHEL, M.SCHUBERT, F.H.-T.ALLAIN
*REVDAT 1 26-FEB-14 2MFG 0
;
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2mfg
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_TA_constraint_parse_err.ID
_TA_constraint_parse_err.Content
_TA_constraint_parse_err.Begin_line
_TA_constraint_parse_err.Begin_column
_TA_constraint_parse_err.End_line
_TA_constraint_parse_err.End_column
_TA_constraint_parse_err.Entry_ID
_TA_constraint_parse_err.Torsion_angle_constraint_list_ID
1
;
# 3410 atoms read from pdb file amber_cycle001.pdb.
# 2 LEU PHI: (1 MET C)-(2 LEU N)-(2 LEU CA)-(2 LEU C) -135.0 -63.0
&rst iat = 18, 20, 22, 37,
r1 = -136.0, r2 = -135.0, r3 = -63.0, r4 = -62.0,
rk2 = 250, rk3 = 250, &end
# 2 LEU PSI: (2 LEU N)-(2 LEU CA)-(2 LEU C)-(3 ILE N) 91.0 139.0
&rst iat = 20, 22, 37, 39,
r1 = 90.0, r2 = 91.0, r3 = 139.0, r4 = 140.0,
&end
# 3 ILE PHI: (2 LEU C)-(3 ILE N)-(3 ILE CA)-(3 ILE C) -131.0 -75.0
&rst iat = 37, 39, 41, 56,
r1 = -132.0, r2 = -131.0, r3 = -75.0, r4 = -74.0,
&end
# 3 ILE PSI: (3 ILE N)-(3 ILE CA)-(3 ILE C)-(4 LEU N) 111.0 151.0
&rst iat = 39, 41, 56, 58,
r1 = 110.0, r2 = 111.0, r3 = 151.0, r4 = 152.0,
&end
# 4 LEU PHI: (3 ILE C)-(4 LEU N)-(4 LEU CA)-(4 LEU C) -160.0 -103.0
&rst iat = 56, 58, 60, 75,
r1 = -161.0, r2 = -160.0, r3 = -103.0, r4 = -102.0,
&end
# 4 LEU PSI: (4 LEU N)-(4 LEU CA)-(4 LEU C)-(5 THR N) 118.0 182.0
&rst iat = 58, 60, 75, 77,
r1 = 117.0, r2 = 118.0, r3 = 182.0, r4 = 183.0,
&end
# 5 THR PHI: (4 LEU C)-(5 THR N)-(5 THR CA)-(5 THR C) -156.0 -76.0
&rst iat = 75, 77, 79, 89,
r1 = -157.0, r2 = -156.0, r3 = -76.0, r4 = -75.0,
&end
# 5 THR PSI: (5 THR N)-(5 THR CA)-(5 THR C)-(6 ARG N) 113.0 157.0
&rst iat = 77, 79, 89, 91,
r1 = 112.0, r2 = 113.0, r3 = 157.0, r4 = 158.0,
&end
# 6 ARG PHI: (5 THR C)-(6 ARG N)-(6 ARG CA)-(6 ARG C) -148.0 -104.0
&rst iat = 89, 91, 93, 113,
r1 = -149.0, r2 = -148.0, r3 = -104.0, r4 = -103.0,
&end
# 6 ARG PSI: (6 ARG N)-(6 ARG CA)-(6 ARG C)-(7 LYS N) 124.0 164.0
&rst iat = 91, 93, 113, 115,
r1 = 123.0, r2 = 124.0, r3 = 164.0, r4 = 165.0,
&end
# 7 LYS PHI: (6 ARG C)-(7 LYS N)-(7 LYS CA)-(7 LYS C) -190.0 -50.0
&rst iat = 113, 115, 117, 135,
r1 = -191.0, r2 = -190.0, r3 = -50.0, r4 = -49.0,
&end
# 7 LYS PSI: (7 LYS N)-(7 LYS CA)-(7 LYS C)-(8 VAL N) 138.0 198.0
&rst iat = 115, 117, 135, 137,
r1 = 137.0, r2 = 138.0, r3 = 198.0, r4 = 199.0,
&end
# 8 VAL PHI: (7 LYS C)-(8 VAL N)-(8 VAL CA)-(8 VAL C) -77.0 -37.0
&rst iat = 135, 137, 139, 151,
r1 = -78.0, r2 = -77.0, r3 = -37.0, r4 = -36.0,
&end
# 8 VAL PSI: (8 VAL N)-(8 VAL CA)-(8 VAL C)-(9 GLY N) 115.0 155.0
&rst iat = 137, 139, 151, 153,
r1 = 114.0, r2 = 115.0, r3 = 155.0, r4 = 156.0,
&end
# 10 GLU PHI: (9 GLY C)-(10 GLU N)-(10 GLU CA)-(10 GLU C) -177.0 -61.0
&rst iat = 158, 160, 162, 173,
r1 = -178.0, r2 = -177.0, r3 = -61.0, r4 = -60.0,
&end
# 10 GLU PSI: (10 GLU N)-(10 GLU CA)-(10 GLU C)-(11 SER N) 124.0 184.0
&rst iat = 160, 162, 173, 175,
r1 = 123.0, r2 = 124.0, r3 = 184.0, r4 = 185.0,
&end
# 11 SER PHI: (10 GLU C)-(11 SER N)-(11 SER CA)-(11 SER C) -173.0 -105.0
&rst iat = 173, 175, 177, 184,
r1 = -174.0, r2 = -173.0, r3 = -105.0, r4 = -104.0,
&end
# 11 SER PSI: (11 SER N)-(11 SER CA)-(11 SER C)-(12 ILE N) 123.0 171.0
&rst iat = 175, 177, 184, 186,
r1 = 122.0, r2 = 123.0, r3 = 171.0, r4 = 172.0,
&end
# 12 ILE PHI: (11 SER C)-(12 ILE N)-(12 ILE CA)-(12 ILE C) -165.0 -101.0
&rst iat = 184, 186, 188, 203,
r1 = -166.0, r2 = -165.0, r3 = -101.0, r4 = -100.0,
&end
# 12 ILE PSI: (12 ILE N)-(12 ILE CA)-(12 ILE C)-(13 ASN N) 91.0 170.0
&rst iat = 186, 188, 203, 205,
r1 = 90.0, r2 = 91.0, r3 = 170.0, r4 = 171.0,
&end
# 13 ASN PHI: (12 ILE C)-(13 ASN N)-(13 ASN CA)-(13 ASN C) -154.0 -70.0
&rst iat = 203, 205, 207, 217,
r1 = -155.0, r2 = -154.0, r3 = -70.0, r4 = -69.0,
&end
# 13 ASN PSI: (13 ASN N)-(13 ASN CA)-(13 ASN C)-(14 ILE N) 114.0 154.0
&rst iat = 205, 207, 217, 219,
r1 = 113.0, r2 = 114.0, r3 = 154.0, r4 = 155.0,
&end
# 14 ILE PHI: (13 ASN C)-(14 ILE N)-(14 ILE CA)-(14 ILE C) -150.0 -86.0
&rst iat = 217, 219, 221, 236,
r1 = -151.0, r2 = -150.0, r3 = -86.0, r4 = -85.0,
&end
# 14 ILE PSI: (14 ILE N)-(14 ILE CA)-(14 ILE C)-(15 GLY N) 82.0 174.0
&rst iat = 219, 221, 236, 238,
r1 = 81.0, r2 = 82.0, r3 = 174.0, r4 = 175.0,
&end
# 18 ILE PHI: (17 ASP C)-(18 ILE N)-(18 ILE CA)-(18 ILE C) -174.0 -70.0
&rst iat = 267, 269, 271, 286,
r1 = -175.0, r2 = -174.0, r3 = -70.0, r4 = -69.0,
&end
# 18 ILE PSI: (18 ILE N)-(18 ILE CA)-(18 ILE C)-(19 THR N) 111.0 151.0
&rst iat = 269, 271, 286, 288,
r1 = 110.0, r2 = 111.0, r3 = 151.0, r4 = 152.0,
&end
# 19 THR PHI: (18 ILE C)-(19 THR N)-(19 THR CA)-(19 THR C) -141.0 -101.0
&rst iat = 286, 288, 290, 300,
r1 = -142.0, r2 = -141.0, r3 = -101.0, r4 = -100.0,
&end
# 19 THR PSI: (19 THR N)-(19 THR CA)-(19 THR C)-(20 ILE N) 108.0 160.0
&rst iat = 288, 290, 300, 302,
r1 = 107.0, r2 = 108.0, r3 = 160.0, r4 = 161.0,
&end
# 20 ILE PHI: (19 THR C)-(20 ILE N)-(20 ILE CA)-(20 ILE C) -145.0 -81.0
&rst iat = 300, 302, 304, 319,
r1 = -146.0, r2 = -145.0, r3 = -81.0, r4 = -80.0,
&end
# 20 ILE PSI: (20 ILE N)-(20 ILE CA)-(20 ILE C)-(21 THR N) 105.0 149.0
&rst iat = 302, 304, 319, 321,
r1 = 104.0, r2 = 105.0, r3 = 149.0, r4 = 150.0,
&end
# 21 THR PHI: (20 ILE C)-(21 THR N)-(21 THR CA)-(21 THR C) -150.0 -78.0
&rst iat = 319, 321, 323, 333,
r1 = -151.0, r2 = -150.0, r3 = -78.0, r4 = -77.0,
&end
# 21 THR PSI: (21 THR N)-(21 THR CA)-(21 THR C)-(22 ILE N) 92.0 176.0
&rst iat = 321, 323, 333, 335,
r1 = 91.0, r2 = 92.0, r3 = 176.0, r4 = 177.0,
&end
# 22 ILE PHI: (21 THR C)-(22 ILE N)-(22 ILE CA)-(22 ILE C) -111.0 -63.0
&rst iat = 333, 335, 337, 352,
r1 = -112.0, r2 = -111.0, r3 = -63.0, r4 = -62.0,
&end
# 22 ILE PSI: (22 ILE N)-(22 ILE CA)-(22 ILE C)-(23 LEU N) 85.0 141.0
&rst iat = 335, 337, 352, 354,
r1 = 84.0, r2 = 85.0, r3 = 141.0, r4 = 142.0,
&end
# 23 LEU PHI: (22 ILE C)-(23 LEU N)-(23 LEU CA)-(23 LEU C) -111.0 -63.0
&rst iat = 352, 354, 356, 371,
r1 = -112.0, r2 = -111.0, r3 = -63.0, r4 = -62.0,
&end
# 23 LEU PSI: (23 LEU N)-(23 LEU CA)-(23 LEU C)-(24 GLY N) -63.0 17.0
&rst iat = 354, 356, 371, 373,
r1 = -64.0, r2 = -63.0, r3 = 17.0, r4 = 18.0,
&end
# 24 GLY PHI: (23 LEU C)-(24 GLY N)-(24 GLY CA)-(24 GLY C) 102.0 242.0
&rst iat = 371, 373, 375, 378,
r1 = 101.0, r2 = 102.0, r3 = 242.0, r4 = 243.0,
&end
# 24 GLY PSI: (24 GLY N)-(24 GLY CA)-(24 GLY C)-(25 VAL N) 142.0 194.0
&rst iat = 373, 375, 378, 380,
r1 = 141.0, r2 = 142.0, r3 = 194.0, r4 = 195.0,
&end
# 25 VAL PHI: (24 GLY C)-(25 VAL N)-(25 VAL CA)-(25 VAL C) -185.0 -85.0
&rst iat = 378, 380, 382, 394,
r1 = -186.0, r2 = -185.0, r3 = -85.0, r4 = -84.0,
&end
# 25 VAL PSI: (25 VAL N)-(25 VAL CA)-(25 VAL C)-(26 SER N) 122.0 170.0
&rst iat = 380, 382, 394, 396,
r1 = 121.0, r2 = 122.0, r3 = 170.0, r4 = 171.0,
&end
# 26 SER PHI: (25 VAL C)-(26 SER N)-(26 SER CA)-(26 SER C) -151.0 -75.0
&rst iat = 394, 396, 398, 405,
r1 = -152.0, r2 = -151.0, r3 = -75.0, r4 = -74.0,
&end
# 26 SER PSI: (26 SER N)-(26 SER CA)-(26 SER C)-(27 GLY N) 60.0 172.0
&rst iat = 396, 398, 405, 407,
r1 = 59.0, r2 = 60.0, r3 = 172.0, r4 = 173.0,
&end
# 27 GLY PHI: (26 SER C)-(27 GLY N)-(27 GLY CA)-(27 GLY C) 44.0 92.0
&rst iat = 405, 407, 409, 412,
r1 = 43.0, r2 = 44.0, r3 = 92.0, r4 = 93.0,
&end
# 27 GLY PSI: (27 GLY N)-(27 GLY CA)-(27 GLY C)-(28 GLN N) -142.0 -102.0
&rst iat = 407, 409, 412, 414,
r1 = -143.0, r2 = -142.0, r3 = -102.0, r4 = -101.0,
&end
# 28 GLN PHI: (27 GLY C)-(28 GLN N)-(28 GLN CA)-(28 GLN C) -126.0 -66.0
&rst iat = 412, 414, 416, 429,
r1 = -127.0, r2 = -126.0, r3 = -66.0, r4 = -65.0,
&end
# 28 GLN PSI: (28 GLN N)-(28 GLN CA)-(28 GLN C)-(29 GLN N) -39.0 33.0
&rst iat = 414, 416, 429, 431,
r1 = -40.0, r2 = -39.0, r3 = 33.0, r4 = 34.0,
&end
# 29 GLN PHI: (28 GLN C)-(29 GLN N)-(29 GLN CA)-(29 GLN C) -203.0 -75.0
&rst iat = 429, 431, 433, 446,
r1 = -204.0, r2 = -203.0, r3 = -75.0, r4 = -74.0,
&end
# 29 GLN PSI: (29 GLN N)-(29 GLN CA)-(29 GLN C)-(30 VAL N) 124.0 164.0
&rst iat = 431, 433, 446, 448,
r1 = 123.0, r2 = 124.0, r3 = 164.0, r4 = 165.0,
&end
# 30 VAL PHI: (29 GLN C)-(30 VAL N)-(30 VAL CA)-(30 VAL C) -155.0 -87.0
&rst iat = 446, 448, 450, 462,
r1 = -156.0, r2 = -155.0, r3 = -87.0, r4 = -86.0,
&end
# 30 VAL PSI: (30 VAL N)-(30 VAL CA)-(30 VAL C)-(31 ARG N) 99.0 147.0
&rst iat = 448, 450, 462, 464,
r1 = 98.0, r2 = 99.0, r3 = 147.0, r4 = 148.0,
&end
# 31 ARG PHI: (30 VAL C)-(31 ARG N)-(31 ARG CA)-(31 ARG C) -135.0 -63.0
&rst iat = 462, 464, 466, 486,
r1 = -136.0, r2 = -135.0, r3 = -63.0, r4 = -62.0,
&end
# 31 ARG PSI: (31 ARG N)-(31 ARG CA)-(31 ARG C)-(32 ILE N) 102.0 146.0
&rst iat = 464, 466, 486, 488,
r1 = 101.0, r2 = 102.0, r3 = 146.0, r4 = 147.0,
&end
# 32 ILE PHI: (31 ARG C)-(32 ILE N)-(32 ILE CA)-(32 ILE C) -138.0 -98.0
&rst iat = 486, 488, 490, 505,
r1 = -139.0, r2 = -138.0, r3 = -98.0, r4 = -97.0,
&end
# 32 ILE PSI: (32 ILE N)-(32 ILE CA)-(32 ILE C)-(33 GLY N) 115.0 155.0
&rst iat = 488, 490, 505, 507,
r1 = 114.0, r2 = 115.0, r3 = 155.0, r4 = 156.0,
&end
# 33 GLY PHI: (32 ILE C)-(33 GLY N)-(33 GLY CA)-(33 GLY C) -203.0 -63.0
&rst iat = 505, 507, 509, 512,
r1 = -204.0, r2 = -203.0, r3 = -63.0, r4 = -62.0,
&end
# 33 GLY PSI: (33 GLY N)-(33 GLY CA)-(33 GLY C)-(34 ILE N) 81.0 221.0
&rst iat = 507, 509, 512, 514,
r1 = 80.0, r2 = 81.0, r3 = 221.0, r4 = 222.0,
&end
# 34 ILE PHI: (33 GLY C)-(34 ILE N)-(34 ILE CA)-(34 ILE C) -141.0 -101.0
&rst iat = 512, 514, 516, 531,
r1 = -142.0, r2 = -141.0, r3 = -101.0, r4 = -100.0,
&end
# 34 ILE PSI: (34 ILE N)-(34 ILE CA)-(34 ILE C)-(35 ASN N) 104.0 144.0
&rst iat = 514, 516, 531, 533,
r1 = 103.0, r2 = 104.0, r3 = 144.0, r4 = 145.0,
&end
# 35 ASN PHI: (34 ILE C)-(35 ASN N)-(35 ASN CA)-(35 ASN C) -144.0 -80.0
&rst iat = 531, 533, 535, 545,
r1 = -145.0, r2 = -144.0, r3 = -80.0, r4 = -79.0,
&end
# 35 ASN PSI: (35 ASN N)-(35 ASN CA)-(35 ASN C)-(36 ALA N) 97.0 142.0
&rst iat = 533, 535, 545, 547,
r1 = 96.0, r2 = 97.0, r3 = 142.0, r4 = 143.0,
&end
# 36 ALA PHI: (35 ASN C)-(36 ALA N)-(36 ALA CA)-(36 ALA C) -154.0 -38.0
&rst iat = 545, 547, 549, 555,
r1 = -155.0, r2 = -154.0, r3 = -38.0, r4 = -37.0,
&end
# 36 ALA PSI: (36 ALA N)-(36 ALA CA)-(36 ALA C)-(37 PRO N) 60.0 184.0
&rst iat = 547, 549, 555, 557,
r1 = 59.0, r2 = 60.0, r3 = 184.0, r4 = 185.0,
&end
# 38 LYS PHI: (37 PRO C)-(38 LYS N)-(38 LYS CA)-(38 LYS C) -80.0 -40.0
&rst iat = 569, 571, 573, 591,
r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
&end
# 38 LYS PSI: (38 LYS N)-(38 LYS CA)-(38 LYS C)-(39 ASP N) -49.0 -1.0
&rst iat = 571, 573, 591, 593,
r1 = -50.0, r2 = -49.0, r3 = -1.0, r4 = 0.0,
&end
# 39 ASP PHI: (38 LYS C)-(39 ASP N)-(39 ASP CA)-(39 ASP C) -111.0 -67.0
&rst iat = 591, 593, 595, 603,
r1 = -112.0, r2 = -111.0, r3 = -67.0, r4 = -66.0,
&end
# 39 ASP PSI: (39 ASP N)-(39 ASP CA)-(39 ASP C)-(40 VAL N) -31.0 37.0
&rst iat = 593, 595, 603, 605,
r1 = -32.0, r2 = -31.0, r3 = 37.0, r4 = 38.0,
&end
# 40 VAL PHI: (39 ASP C)-(40 VAL N)-(40 VAL CA)-(40 VAL C) -139.0 -47.0
&rst iat = 603, 605, 607, 619,
r1 = -140.0, r2 = -139.0, r3 = -47.0, r4 = -46.0,
&end
# 40 VAL PSI: (40 VAL N)-(40 VAL CA)-(40 VAL C)-(41 ALA N) 79.0 169.0
&rst iat = 605, 607, 619, 621,
r1 = 78.0, r2 = 79.0, r3 = 169.0, r4 = 170.0,
&end
# 41 ALA PHI: (40 VAL C)-(41 ALA N)-(41 ALA CA)-(41 ALA C) -129.0 -61.0
&rst iat = 619, 621, 623, 629,
r1 = -130.0, r2 = -129.0, r3 = -61.0, r4 = -60.0,
&end
# 41 ALA PSI: (41 ALA N)-(41 ALA CA)-(41 ALA C)-(42 VAL N) 84.0 160.0
&rst iat = 621, 623, 629, 631,
r1 = 83.0, r2 = 84.0, r3 = 160.0, r4 = 161.0,
&end
# 42 VAL PHI: (41 ALA C)-(42 VAL N)-(42 VAL CA)-(42 VAL C) -153.0 -89.0
&rst iat = 629, 631, 633, 645,
r1 = -154.0, r2 = -153.0, r3 = -89.0, r4 = -88.0,
&end
# 42 VAL PSI: (42 VAL N)-(42 VAL CA)-(42 VAL C)-(43 HIE N) 94.0 194.0
&rst iat = 631, 633, 645, 647,
r1 = 93.0, r2 = 94.0, r3 = 194.0, r4 = 195.0,
&end
# 43 HIS PHI: (42 VAL C)-(43 HIE N)-(43 HIE CA)-(43 HIE C) -180.0 -80.0
&rst iat = 645, 647, 649, 662,
r1 = -181.0, r2 = -180.0, r3 = -80.0, r4 = -79.0,
&end
# 43 HIS PSI: (43 HIE N)-(43 HIE CA)-(43 HIE C)-(44 ARG N) 130.0 186.0
&rst iat = 647, 649, 662, 664,
r1 = 129.0, r2 = 130.0, r3 = 186.0, r4 = 187.0,
&end
# 45 GLU PHI: (44 ARG C)-(45 GLU N)-(45 GLU CA)-(45 GLU C) -85.0 -45.0
&rst iat = 686, 688, 690, 701,
r1 = -86.0, r2 = -85.0, r3 = -45.0, r4 = -44.0,
&end
# 45 GLU PSI: (45 GLU N)-(45 GLU CA)-(45 GLU C)-(46 GLU N) -64.0 -24.0
&rst iat = 688, 690, 701, 703,
r1 = -65.0, r2 = -64.0, r3 = -24.0, r4 = -23.0,
&end
# 46 GLU PHI: (45 GLU C)-(46 GLU N)-(46 GLU CA)-(46 GLU C) -88.0 -48.0
&rst iat = 701, 703, 705, 716,
r1 = -89.0, r2 = -88.0, r3 = -48.0, r4 = -47.0,
&end
# 46 GLU PSI: (46 GLU N)-(46 GLU CA)-(46 GLU C)-(47 ILE N) -58.0 10.0
&rst iat = 703, 705, 716, 718,
r1 = -59.0, r2 = -58.0, r3 = 10.0, r4 = 11.0,
&end
# 47 ILE PHI: (46 GLU C)-(47 ILE N)-(47 ILE CA)-(47 ILE C) -90.0 -50.0
&rst iat = 716, 718, 720, 735,
r1 = -91.0, r2 = -90.0, r3 = -50.0, r4 = -49.0,
&end
# 47 ILE PSI: (47 ILE N)-(47 ILE CA)-(47 ILE C)-(48 TYR N) -58.0 -18.0
&rst iat = 718, 720, 735, 737,
r1 = -59.0, r2 = -58.0, r3 = -18.0, r4 = -17.0,
&end
# 48 TYR PHI: (47 ILE C)-(48 TYR N)-(48 TYR CA)-(48 TYR C) -79.0 -39.0
&rst iat = 735, 737, 739, 756,
r1 = -80.0, r2 = -79.0, r3 = -39.0, r4 = -38.0,
&end
# 48 TYR PSI: (48 TYR N)-(48 TYR CA)-(48 TYR C)-(49 GLN N) -64.0 -24.0
&rst iat = 737, 739, 756, 758,
r1 = -65.0, r2 = -64.0, r3 = -24.0, r4 = -23.0,
&end
# 49 GLN PHI: (48 TYR C)-(49 GLN N)-(49 GLN CA)-(49 GLN C) -79.0 -39.0
&rst iat = 756, 758, 760, 773,
r1 = -80.0, r2 = -79.0, r3 = -39.0, r4 = -38.0,
&end
# 49 GLN PSI: (49 GLN N)-(49 GLN CA)-(49 GLN C)-(50 ARG N) -59.0 -15.0
&rst iat = 758, 760, 773, 775,
r1 = -60.0, r2 = -59.0, r3 = -15.0, r4 = -14.0,
&end
# 50 ARG PHI: (49 GLN C)-(50 ARG N)-(50 ARG CA)-(50 ARG C) -86.0 -46.0
&rst iat = 773, 775, 777, 797,
r1 = -87.0, r2 = -86.0, r3 = -46.0, r4 = -45.0,
&end
# 50 ARG PSI: (50 ARG N)-(50 ARG CA)-(50 ARG C)-(51 ILE N) -63.0 -15.0
&rst iat = 775, 777, 797, 799,
r1 = -64.0, r2 = -63.0, r3 = -15.0, r4 = -14.0,
&end
# 51 ILE PHI: (50 ARG C)-(51 ILE N)-(51 ILE CA)-(51 ILE C) -110.0 -45.0
&rst iat = 797, 799, 801, 816,
r1 = -111.0, r2 = -110.0, r3 = -45.0, r4 = -44.0,
&end
# 51 ILE PSI: (51 ILE N)-(51 ILE CA)-(51 ILE C)-(52 GLN N) -63.0 -23.0
&rst iat = 799, 801, 816, 818,
r1 = -64.0, r2 = -63.0, r3 = -23.0, r4 = -22.0,
&end
# 52 GLN PHI: (51 ILE C)-(52 GLN N)-(52 GLN CA)-(52 GLN C) -82.0 -42.0
&rst iat = 816, 818, 820, 833,
r1 = -83.0, r2 = -82.0, r3 = -42.0, r4 = -41.0,
&end
# 52 GLN PSI: (52 GLN N)-(52 GLN CA)-(52 GLN C)-(53 ALA N) -73.0 3.0
&rst iat = 818, 820, 833, 835,
r1 = -74.0, r2 = -73.0, r3 = 3.0, r4 = 4.0,
&end
# 53 ALA PHI: (52 GLN C)-(53 ALA N)-(53 ALA CA)-(53 ALA C) -101.0 -37.0
&rst iat = 833, 835, 837, 843,
r1 = -102.0, r2 = -101.0, r3 = -37.0, r4 = -36.0,
&end
# 53 ALA PSI: (53 ALA N)-(53 ALA CA)-(53 ALA C)-(54 GLY N) -59.0 -3.0
&rst iat = 835, 837, 843, 845,
r1 = -60.0, r2 = -59.0, r3 = -3.0, r4 = -2.0,
&end
# 88 LEU PHI: (87 MET C)-(88 LEU N)-(88 LEU CA)-(88 LEU C) -135.0 -63.0
&rst iat = 1723, 1725, 1727, 1742,
r1 = -136.0, r2 = -135.0, r3 = -63.0, r4 = -62.0,
&end
# 88 LEU PSI: (88 LEU N)-(88 LEU CA)-(88 LEU C)-(89 ILE N) 91.0 139.0
&rst iat = 1725, 1727, 1742, 1744,
r1 = 90.0, r2 = 91.0, r3 = 139.0, r4 = 140.0,
&end
# 89 ILE PHI: (88 LEU C)-(89 ILE N)-(89 ILE CA)-(89 ILE C) -131.0 -75.0
&rst iat = 1742, 1744, 1746, 1761,
r1 = -132.0, r2 = -131.0, r3 = -75.0, r4 = -74.0,
&end
# 89 ILE PSI: (89 ILE N)-(89 ILE CA)-(89 ILE C)-(90 LEU N) 111.0 151.0
&rst iat = 1744, 1746, 1761, 1763,
r1 = 110.0, r2 = 111.0, r3 = 151.0, r4 = 152.0,
&end
# 90 LEU PHI: (89 ILE C)-(90 LEU N)-(90 LEU CA)-(90 LEU C) -160.0 -103.0
&rst iat = 1761, 1763, 1765, 1780,
r1 = -161.0, r2 = -160.0, r3 = -103.0, r4 = -102.0,
&end
# 90 LEU PSI: (90 LEU N)-(90 LEU CA)-(90 LEU C)-(91 THR N) 118.0 182.0
&rst iat = 1763, 1765, 1780, 1782,
r1 = 117.0, r2 = 118.0, r3 = 182.0, r4 = 183.0,
&end
# 91 THR PHI: (90 LEU C)-(91 THR N)-(91 THR CA)-(91 THR C) -156.0 -76.0
&rst iat = 1780, 1782, 1784, 1794,
r1 = -157.0, r2 = -156.0, r3 = -76.0, r4 = -75.0,
&end
# 91 THR PSI: (91 THR N)-(91 THR CA)-(91 THR C)-(92 ARG N) 113.0 157.0
&rst iat = 1782, 1784, 1794, 1796,
r1 = 112.0, r2 = 113.0, r3 = 157.0, r4 = 158.0,
&end
# 92 ARG PHI: (91 THR C)-(92 ARG N)-(92 ARG CA)-(92 ARG C) -148.0 -104.0
&rst iat = 1794, 1796, 1798, 1818,
r1 = -149.0, r2 = -148.0, r3 = -104.0, r4 = -103.0,
&end
# 92 ARG PSI: (92 ARG N)-(92 ARG CA)-(92 ARG C)-(93 LYS N) 124.0 164.0
&rst iat = 1796, 1798, 1818, 1820,
r1 = 123.0, r2 = 124.0, r3 = 164.0, r4 = 165.0,
&end
# 93 LYS PHI: (92 ARG C)-(93 LYS N)-(93 LYS CA)-(93 LYS C) -190.0 -50.0
&rst iat = 1818, 1820, 1822, 1840,
r1 = -191.0, r2 = -190.0, r3 = -50.0, r4 = -49.0,
&end
# 93 LYS PSI: (93 LYS N)-(93 LYS CA)-(93 LYS C)-(94 VAL N) 138.0 198.0
&rst iat = 1820, 1822, 1840, 1842,
r1 = 137.0, r2 = 138.0, r3 = 198.0, r4 = 199.0,
&end
# 94 VAL PHI: (93 LYS C)-(94 VAL N)-(94 VAL CA)-(94 VAL C) -77.0 -37.0
&rst iat = 1840, 1842, 1844, 1856,
r1 = -78.0, r2 = -77.0, r3 = -37.0, r4 = -36.0,
&end
# 94 VAL PSI: (94 VAL N)-(94 VAL CA)-(94 VAL C)-(95 GLY N) 115.0 155.0
&rst iat = 1842, 1844, 1856, 1858,
r1 = 114.0, r2 = 115.0, r3 = 155.0, r4 = 156.0,
&end
# 96 GLU PHI: (95 GLY C)-(96 GLU N)-(96 GLU CA)-(96 GLU C) -177.0 -61.0
&rst iat = 1863, 1865, 1867, 1878,
r1 = -178.0, r2 = -177.0, r3 = -61.0, r4 = -60.0,
&end
# 96 GLU PSI: (96 GLU N)-(96 GLU CA)-(96 GLU C)-(97 SER N) 124.0 184.0
&rst iat = 1865, 1867, 1878, 1880,
r1 = 123.0, r2 = 124.0, r3 = 184.0, r4 = 185.0,
&end
# 97 SER PHI: (96 GLU C)-(97 SER N)-(97 SER CA)-(97 SER C) -173.0 -105.0
&rst iat = 1878, 1880, 1882, 1889,
r1 = -174.0, r2 = -173.0, r3 = -105.0, r4 = -104.0,
&end
# 97 SER PSI: (97 SER N)-(97 SER CA)-(97 SER C)-(98 ILE N) 123.0 171.0
&rst iat = 1880, 1882, 1889, 1891,
r1 = 122.0, r2 = 123.0, r3 = 171.0, r4 = 172.0,
&end
# 98 ILE PHI: (97 SER C)-(98 ILE N)-(98 ILE CA)-(98 ILE C) -165.0 -101.0
&rst iat = 1889, 1891, 1893, 1908,
r1 = -166.0, r2 = -165.0, r3 = -101.0, r4 = -100.0,
&end
# 98 ILE PSI: (98 ILE N)-(98 ILE CA)-(98 ILE C)-(99 ASN N) 91.0 170.0
&rst iat = 1891, 1893, 1908, 1910,
r1 = 90.0, r2 = 91.0, r3 = 170.0, r4 = 171.0,
&end
# 99 ASN PHI: (98 ILE C)-(99 ASN N)-(99 ASN CA)-(99 ASN C) -154.0 -70.0
&rst iat = 1908, 1910, 1912, 1922,
r1 = -155.0, r2 = -154.0, r3 = -70.0, r4 = -69.0,
&end
# 99 ASN PSI: (99 ASN N)-(99 ASN CA)-(99 ASN C)-(100 ILE N) 114.0 154.0
&rst iat = 1910, 1912, 1922, 1924,
r1 = 113.0, r2 = 114.0, r3 = 154.0, r4 = 155.0,
&end
# 100 ILE PHI: (99 ASN C)-(100 ILE N)-(100 ILE CA)-(100 ILE C) -150.0 -86.0
&rst iat = 1922, 1924, 1926, 1941,
r1 = -151.0, r2 = -150.0, r3 = -86.0, r4 = -85.0,
&end
# 100 ILE PSI: (100 ILE N)-(100 ILE CA)-(100 ILE C)-(101 GLY N) 82.0 174.0
&rst iat = 1924, 1926, 1941, 1943,
r1 = 81.0, r2 = 82.0, r3 = 174.0, r4 = 175.0,
&end
# 104 ILE PHI: (103 ASP C)-(104 ILE N)-(104 ILE CA)-(104 ILE C) -174.0 -70.0
&rst iat = 1972, 1974, 1976, 1991,
r1 = -175.0, r2 = -174.0, r3 = -70.0, r4 = -69.0,
&end
# 104 ILE PSI: (104 ILE N)-(104 ILE CA)-(104 ILE C)-(105 THR N) 111.0 151.0
&rst iat = 1974, 1976, 1991, 1993,
r1 = 110.0, r2 = 111.0, r3 = 151.0, r4 = 152.0,
&end
# 105 THR PHI: (104 ILE C)-(105 THR N)-(105 THR CA)-(105 THR C) -141.0 -101.0
&rst iat = 1991, 1993, 1995, 2005,
r1 = -142.0, r2 = -141.0, r3 = -101.0, r4 = -100.0,
&end
# 105 THR PSI: (105 THR N)-(105 THR CA)-(105 THR C)-(106 ILE N) 108.0 160.0
&rst iat = 1993, 1995, 2005, 2007,
r1 = 107.0, r2 = 108.0, r3 = 160.0, r4 = 161.0,
&end
# 106 ILE PHI: (105 THR C)-(106 ILE N)-(106 ILE CA)-(106 ILE C) -145.0 -81.0
&rst iat = 2005, 2007, 2009, 2024,
r1 = -146.0, r2 = -145.0, r3 = -81.0, r4 = -80.0,
&end
# 106 ILE PSI: (106 ILE N)-(106 ILE CA)-(106 ILE C)-(107 THR N) 105.0 149.0
&rst iat = 2007, 2009, 2024, 2026,
r1 = 104.0, r2 = 105.0, r3 = 149.0, r4 = 150.0,
&end
# 107 THR PHI: (106 ILE C)-(107 THR N)-(107 THR CA)-(107 THR C) -150.0 -78.0
&rst iat = 2024, 2026, 2028, 2038,
r1 = -151.0, r2 = -150.0, r3 = -78.0, r4 = -77.0,
&end
# 107 THR PSI: (107 THR N)-(107 THR CA)-(107 THR C)-(108 ILE N) 92.0 176.0
&rst iat = 2026, 2028, 2038, 2040,
r1 = 91.0, r2 = 92.0, r3 = 176.0, r4 = 177.0,
&end
# 108 ILE PHI: (107 THR C)-(108 ILE N)-(108 ILE CA)-(108 ILE C) -111.0 -63.0
&rst iat = 2038, 2040, 2042, 2057,
r1 = -112.0, r2 = -111.0, r3 = -63.0, r4 = -62.0,
&end
# 108 ILE PSI: (108 ILE N)-(108 ILE CA)-(108 ILE C)-(109 LEU N) 85.0 141.0
&rst iat = 2040, 2042, 2057, 2059,
r1 = 84.0, r2 = 85.0, r3 = 141.0, r4 = 142.0,
&end
# 109 LEU PHI: (108 ILE C)-(109 LEU N)-(109 LEU CA)-(109 LEU C) -111.0 -63.0
&rst iat = 2057, 2059, 2061, 2076,
r1 = -112.0, r2 = -111.0, r3 = -63.0, r4 = -62.0,
&end
# 109 LEU PSI: (109 LEU N)-(109 LEU CA)-(109 LEU C)-(110 GLY N) -63.0 17.0
&rst iat = 2059, 2061, 2076, 2078,
r1 = -64.0, r2 = -63.0, r3 = 17.0, r4 = 18.0,
&end
# 110 GLY PHI: (109 LEU C)-(110 GLY N)-(110 GLY CA)-(110 GLY C) 102.0 242.0
&rst iat = 2076, 2078, 2080, 2083,
r1 = 101.0, r2 = 102.0, r3 = 242.0, r4 = 243.0,
&end
# 110 GLY PSI: (110 GLY N)-(110 GLY CA)-(110 GLY C)-(111 VAL N) 142.0 194.0
&rst iat = 2078, 2080, 2083, 2085,
r1 = 141.0, r2 = 142.0, r3 = 194.0, r4 = 195.0,
&end
# 111 VAL PHI: (110 GLY C)-(111 VAL N)-(111 VAL CA)-(111 VAL C) -185.0 -85.0
&rst iat = 2083, 2085, 2087, 2099,
r1 = -186.0, r2 = -185.0, r3 = -85.0, r4 = -84.0,
&end
# 111 VAL PSI: (111 VAL N)-(111 VAL CA)-(111 VAL C)-(112 SER N) 122.0 170.0
&rst iat = 2085, 2087, 2099, 2101,
r1 = 121.0, r2 = 122.0, r3 = 170.0, r4 = 171.0,
&end
# 112 SER PHI: (111 VAL C)-(112 SER N)-(112 SER CA)-(112 SER C) -151.0 -75.0
&rst iat = 2099, 2101, 2103, 2110,
r1 = -152.0, r2 = -151.0, r3 = -75.0, r4 = -74.0,
&end
# 112 SER PSI: (112 SER N)-(112 SER CA)-(112 SER C)-(113 GLY N) 60.0 172.0
&rst iat = 2101, 2103, 2110, 2112,
r1 = 59.0, r2 = 60.0, r3 = 172.0, r4 = 173.0,
&end
# 113 GLY PHI: (112 SER C)-(113 GLY N)-(113 GLY CA)-(113 GLY C) 44.0 92.0
&rst iat = 2110, 2112, 2114, 2117,
r1 = 43.0, r2 = 44.0, r3 = 92.0, r4 = 93.0,
&end
# 113 GLY PSI: (113 GLY N)-(113 GLY CA)-(113 GLY C)-(114 GLN N) -142.0 -102.0
&rst iat = 2112, 2114, 2117, 2119,
r1 = -143.0, r2 = -142.0, r3 = -102.0, r4 = -101.0,
&end
# 114 GLN PHI: (113 GLY C)-(114 GLN N)-(114 GLN CA)-(114 GLN C) -126.0 -66.0
&rst iat = 2117, 2119, 2121, 2134,
r1 = -127.0, r2 = -126.0, r3 = -66.0, r4 = -65.0,
&end
# 114 GLN PSI: (114 GLN N)-(114 GLN CA)-(114 GLN C)-(115 GLN N) -39.0 33.0
&rst iat = 2119, 2121, 2134, 2136,
r1 = -40.0, r2 = -39.0, r3 = 33.0, r4 = 34.0,
&end
# 115 GLN PHI: (114 GLN C)-(115 GLN N)-(115 GLN CA)-(115 GLN C) -203.0 -75.0
&rst iat = 2134, 2136, 2138, 2151,
r1 = -204.0, r2 = -203.0, r3 = -75.0, r4 = -74.0,
&end
# 115 GLN PSI: (115 GLN N)-(115 GLN CA)-(115 GLN C)-(116 VAL N) 124.0 164.0
&rst iat = 2136, 2138, 2151, 2153,
r1 = 123.0, r2 = 124.0, r3 = 164.0, r4 = 165.0,
&end
# 116 VAL PHI: (115 GLN C)-(116 VAL N)-(116 VAL CA)-(116 VAL C) -155.0 -87.0
&rst iat = 2151, 2153, 2155, 2167,
r1 = -156.0, r2 = -155.0, r3 = -87.0, r4 = -86.0,
&end
# 116 VAL PSI: (116 VAL N)-(116 VAL CA)-(116 VAL C)-(117 ARG N) 99.0 147.0
&rst iat = 2153, 2155, 2167, 2169,
r1 = 98.0, r2 = 99.0, r3 = 147.0, r4 = 148.0,
&end
# 117 ARG PHI: (116 VAL C)-(117 ARG N)-(117 ARG CA)-(117 ARG C) -135.0 -63.0
&rst iat = 2167, 2169, 2171, 2191,
r1 = -136.0, r2 = -135.0, r3 = -63.0, r4 = -62.0,
&end
# 117 ARG PSI: (117 ARG N)-(117 ARG CA)-(117 ARG C)-(118 ILE N) 102.0 146.0
&rst iat = 2169, 2171, 2191, 2193,
r1 = 101.0, r2 = 102.0, r3 = 146.0, r4 = 147.0,
&end
# 118 ILE PHI: (117 ARG C)-(118 ILE N)-(118 ILE CA)-(118 ILE C) -138.0 -98.0
&rst iat = 2191, 2193, 2195, 2210,
r1 = -139.0, r2 = -138.0, r3 = -98.0, r4 = -97.0,
&end
# 118 ILE PSI: (118 ILE N)-(118 ILE CA)-(118 ILE C)-(119 GLY N) 115.0 155.0
&rst iat = 2193, 2195, 2210, 2212,
r1 = 114.0, r2 = 115.0, r3 = 155.0, r4 = 156.0,
&end
# 119 GLY PHI: (118 ILE C)-(119 GLY N)-(119 GLY CA)-(119 GLY C) -203.0 -63.0
&rst iat = 2210, 2212, 2214, 2217,
r1 = -204.0, r2 = -203.0, r3 = -63.0, r4 = -62.0,
&end
# 119 GLY PSI: (119 GLY N)-(119 GLY CA)-(119 GLY C)-(120 ILE N) 81.0 221.0
&rst iat = 2212, 2214, 2217, 2219,
r1 = 80.0, r2 = 81.0, r3 = 221.0, r4 = 222.0,
&end
# 120 ILE PHI: (119 GLY C)-(120 ILE N)-(120 ILE CA)-(120 ILE C) -141.0 -101.0
&rst iat = 2217, 2219, 2221, 2236,
r1 = -142.0, r2 = -141.0, r3 = -101.0, r4 = -100.0,
&end
# 120 ILE PSI: (120 ILE N)-(120 ILE CA)-(120 ILE C)-(121 ASN N) 104.0 144.0
&rst iat = 2219, 2221, 2236, 2238,
r1 = 103.0, r2 = 104.0, r3 = 144.0, r4 = 145.0,
&end
# 121 ASN PHI: (120 ILE C)-(121 ASN N)-(121 ASN CA)-(121 ASN C) -144.0 -80.0
&rst iat = 2236, 2238, 2240, 2250,
r1 = -145.0, r2 = -144.0, r3 = -80.0, r4 = -79.0,
&end
# 121 ASN PSI: (121 ASN N)-(121 ASN CA)-(121 ASN C)-(122 ALA N) 97.0 142.0
&rst iat = 2238, 2240, 2250, 2252,
r1 = 96.0, r2 = 97.0, r3 = 142.0, r4 = 143.0,
&end
# 122 ALA PHI: (121 ASN C)-(122 ALA N)-(122 ALA CA)-(122 ALA C) -154.0 -38.0
&rst iat = 2250, 2252, 2254, 2260,
r1 = -155.0, r2 = -154.0, r3 = -38.0, r4 = -37.0,
&end
# 122 ALA PSI: (122 ALA N)-(122 ALA CA)-(122 ALA C)-(123 PRO N) 60.0 184.0
&rst iat = 2252, 2254, 2260, 2262,
r1 = 59.0, r2 = 60.0, r3 = 184.0, r4 = 185.0,
&end
# 124 LYS PHI: (123 PRO C)-(124 LYS N)-(124 LYS CA)-(124 LYS C) -80.0 -40.0
&rst iat = 2274, 2276, 2278, 2296,
r1 = -81.0, r2 = -80.0, r3 = -40.0, r4 = -39.0,
&end
# 124 LYS PSI: (124 LYS N)-(124 LYS CA)-(124 LYS C)-(125 ASP N) -49.0 -1.0
&rst iat = 2276, 2278, 2296, 2298,
r1 = -50.0, r2 = -49.0, r3 = -1.0, r4 = 0.0,
&end
# 125 ASP PHI: (124 LYS C)-(125 ASP N)-(125 ASP CA)-(125 ASP C) -111.0 -67.0
&rst iat = 2296, 2298, 2300, 2308,
r1 = -112.0, r2 = -111.0, r3 = -67.0, r4 = -66.0,
&end
# 125 ASP PSI: (125 ASP N)-(125 ASP CA)-(125 ASP C)-(126 VAL N) -31.0 37.0
&rst iat = 2298, 2300, 2308, 2310,
r1 = -32.0, r2 = -31.0, r3 = 37.0, r4 = 38.0,
&end
# 126 VAL PHI: (125 ASP C)-(126 VAL N)-(126 VAL CA)-(126 VAL C) -139.0 -47.0
&rst iat = 2308, 2310, 2312, 2324,
r1 = -140.0, r2 = -139.0, r3 = -47.0, r4 = -46.0,
&end
# 126 VAL PSI: (126 VAL N)-(126 VAL CA)-(126 VAL C)-(127 ALA N) 79.0 169.0
&rst iat = 2310, 2312, 2324, 2326,
r1 = 78.0, r2 = 79.0, r3 = 169.0, r4 = 170.0,
&end
# 127 ALA PHI: (126 VAL C)-(127 ALA N)-(127 ALA CA)-(127 ALA C) -129.0 -61.0
&rst iat = 2324, 2326, 2328, 2334,
r1 = -130.0, r2 = -129.0, r3 = -61.0, r4 = -60.0,
&end
# 127 ALA PSI: (127 ALA N)-(127 ALA CA)-(127 ALA C)-(128 VAL N) 84.0 160.0
&rst iat = 2326, 2328, 2334, 2336,
r1 = 83.0, r2 = 84.0, r3 = 160.0, r4 = 161.0,
&end
# 128 VAL PHI: (127 ALA C)-(128 VAL N)-(128 VAL CA)-(128 VAL C) -153.0 -89.0
&rst iat = 2334, 2336, 2338, 2350,
r1 = -154.0, r2 = -153.0, r3 = -89.0, r4 = -88.0,
&end
# 128 VAL PSI: (128 VAL N)-(128 VAL CA)-(128 VAL C)-(129 HIE N) 94.0 194.0
&rst iat = 2336, 2338, 2350, 2352,
r1 = 93.0, r2 = 94.0, r3 = 194.0, r4 = 195.0,
&end
# 129 HIS PHI: (128 VAL C)-(129 HIE N)-(129 HIE CA)-(129 HIE C) -180.0 -80.0
&rst iat = 2350, 2352, 2354, 2367,
r1 = -181.0, r2 = -180.0, r3 = -80.0, r4 = -79.0,
&end
# 129 HIS PSI: (129 HIE N)-(129 HIE CA)-(129 HIE C)-(130 ARG N) 130.0 186.0
&rst iat = 2352, 2354, 2367, 2369,
r1 = 129.0, r2 = 130.0, r3 = 186.0, r4 = 187.0,
&end
# 131 GLU PHI: (130 ARG C)-(131 GLU N)-(131 GLU CA)-(131 GLU C) -85.0 -45.0
&rst iat = 2391, 2393, 2395, 2406,
r1 = -86.0, r2 = -85.0, r3 = -45.0, r4 = -44.0,
&end
# 131 GLU PSI: (131 GLU N)-(131 GLU CA)-(131 GLU C)-(132 GLU N) -64.0 -24.0
&rst iat = 2393, 2395, 2406, 2408,
r1 = -65.0, r2 = -64.0, r3 = -24.0, r4 = -23.0,
&end
# 132 GLU PHI: (131 GLU C)-(132 GLU N)-(132 GLU CA)-(132 GLU C) -88.0 -48.0
&rst iat = 2406, 2408, 2410, 2421,
r1 = -89.0, r2 = -88.0, r3 = -48.0, r4 = -47.0,
&end
# 132 GLU PSI: (132 GLU N)-(132 GLU CA)-(132 GLU C)-(133 ILE N) -58.0 10.0
&rst iat = 2408, 2410, 2421, 2423,
r1 = -59.0, r2 = -58.0, r3 = 10.0, r4 = 11.0,
&end
# 133 ILE PHI: (132 GLU C)-(133 ILE N)-(133 ILE CA)-(133 ILE C) -90.0 -50.0
&rst iat = 2421, 2423, 2425, 2440,
r1 = -91.0, r2 = -90.0, r3 = -50.0, r4 = -49.0,
&end
# 133 ILE PSI: (133 ILE N)-(133 ILE CA)-(133 ILE C)-(134 TYR N) -58.0 -18.0
&rst iat = 2423, 2425, 2440, 2442,
r1 = -59.0, r2 = -58.0, r3 = -18.0, r4 = -17.0,
&end
# 134 TYR PHI: (133 ILE C)-(134 TYR N)-(134 TYR CA)-(134 TYR C) -79.0 -39.0
&rst iat = 2440, 2442, 2444, 2461,
r1 = -80.0, r2 = -79.0, r3 = -39.0, r4 = -38.0,
&end
# 134 TYR PSI: (134 TYR N)-(134 TYR CA)-(134 TYR C)-(135 GLN N) -64.0 -24.0
&rst iat = 2442, 2444, 2461, 2463,
r1 = -65.0, r2 = -64.0, r3 = -24.0, r4 = -23.0,
&end
# 135 GLN PHI: (134 TYR C)-(135 GLN N)-(135 GLN CA)-(135 GLN C) -79.0 -39.0
&rst iat = 2461, 2463, 2465, 2478,
r1 = -80.0, r2 = -79.0, r3 = -39.0, r4 = -38.0,
&end
# 135 GLN PSI: (135 GLN N)-(135 GLN CA)-(135 GLN C)-(136 ARG N) -59.0 -15.0
&rst iat = 2463, 2465, 2478, 2480,
r1 = -60.0, r2 = -59.0, r3 = -15.0, r4 = -14.0,
&end
# 136 ARG PHI: (135 GLN C)-(136 ARG N)-(136 ARG CA)-(136 ARG C) -86.0 -46.0
&rst iat = 2478, 2480, 2482, 2502,
r1 = -87.0, r2 = -86.0, r3 = -46.0, r4 = -45.0,
&end
# 136 ARG PSI: (136 ARG N)-(136 ARG CA)-(136 ARG C)-(137 ILE N) -63.0 -15.0
&rst iat = 2480, 2482, 2502, 2504,
r1 = -64.0, r2 = -63.0, r3 = -15.0, r4 = -14.0,
&end
# 137 ILE PHI: (136 ARG C)-(137 ILE N)-(137 ILE CA)-(137 ILE C) -110.0 -45.0
&rst iat = 2502, 2504, 2506, 2521,
r1 = -111.0, r2 = -110.0, r3 = -45.0, r4 = -44.0,
&end
# 137 ILE PSI: (137 ILE N)-(137 ILE CA)-(137 ILE C)-(138 GLN N) -63.0 -23.0
&rst iat = 2504, 2506, 2521, 2523,
r1 = -64.0, r2 = -63.0, r3 = -23.0, r4 = -22.0,
&end
# 138 GLN PHI: (137 ILE C)-(138 GLN N)-(138 GLN CA)-(138 GLN C) -82.0 -42.0
&rst iat = 2521, 2523, 2525, 2538,
r1 = -83.0, r2 = -82.0, r3 = -42.0, r4 = -41.0,
&end
# 138 GLN PSI: (138 GLN N)-(138 GLN CA)-(138 GLN C)-(139 ALA N) -73.0 3.0
&rst iat = 2523, 2525, 2538, 2540,
r1 = -74.0, r2 = -73.0, r3 = 3.0, r4 = 4.0,
&end
# 139 ALA PHI: (138 GLN C)-(139 ALA N)-(139 ALA CA)-(139 ALA C) -101.0 -37.0
&rst iat = 2538, 2540, 2542, 2548,
r1 = -102.0, r2 = -101.0, r3 = -37.0, r4 = -36.0,
&end
# 139 ALA PSI: (139 ALA N)-(139 ALA CA)-(139 ALA C)-(140 GLY N) -59.0 -3.0
&rst iat = 2540, 2542, 2548, 2550,
r1 = -60.0, r2 = -59.0, r3 = -3.0, r4 = -2.0,
&end
# 66 GUA DELTA: (66 RG5 C5')-(66 RG5 C4')-(66 RG5 C3')-(66 RG5 O3') 50.0 110.0
&rst iat = 1030, 1033, 1053, 1059,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 66 GUA EPSI: (66 RG5 C4')-(66 RG5 C3')-(66 RG5 O3')-(67 RG P) -180.0 -120.0
&rst iat = 1033, 1053, 1059, 1060,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 66 GUA ZETA: (66 RG5 C3')-(66 RG5 O3')-(67 RG P)-(67 RG O5') -100.0 -40.0
&rst iat = 1053, 1059, 1060, 1063,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 67 GUA ALPHA: (66 RG5 O3')-(67 RG P)-(67 RG O5')-(67 RG C5') -90.0 -30.0
&rst iat = 1059, 1060, 1063, 1064,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 67 GUA BETA: (67 RG P)-(67 RG O5')-(67 RG C5')-(67 RG C4') -210.0 -150.0
&rst iat = 1060, 1063, 1064, 1067,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 67 GUA GAMMA: (67 RG O5')-(67 RG C5')-(67 RG C4')-(67 RG C3') 30.0 90.0
&rst iat = 1063, 1064, 1067, 1087,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 67 GUA DELTA: (67 RG C5')-(67 RG C4')-(67 RG C3')-(67 RG O3') 50.0 110.0
&rst iat = 1064, 1067, 1087, 1093,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 67 GUA EPSI: (67 RG C4')-(67 RG C3')-(67 RG O3')-(68 RG P) -180.0 -120.0
&rst iat = 1067, 1087, 1093, 1094,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 67 GUA ZETA: (67 RG C3')-(67 RG O3')-(68 RG P)-(68 RG O5') -100.0 -40.0
&rst iat = 1087, 1093, 1094, 1097,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 68 GUA ALPHA: (67 RG O3')-(68 RG P)-(68 RG O5')-(68 RG C5') -90.0 -30.0
&rst iat = 1093, 1094, 1097, 1098,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 68 GUA BETA: (68 RG P)-(68 RG O5')-(68 RG C5')-(68 RG C4') -210.0 -150.0
&rst iat = 1094, 1097, 1098, 1101,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 68 GUA GAMMA: (68 RG O5')-(68 RG C5')-(68 RG C4')-(68 RG C3') 30.0 90.0
&rst iat = 1097, 1098, 1101, 1121,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 68 GUA DELTA: (68 RG C5')-(68 RG C4')-(68 RG C3')-(68 RG O3') 50.0 110.0
&rst iat = 1098, 1101, 1121, 1127,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 68 GUA EPSI: (68 RG C4')-(68 RG C3')-(68 RG O3')-(69 RU P) -180.0 -120.0
&rst iat = 1101, 1121, 1127, 1128,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 68 GUA ZETA: (68 RG C3')-(68 RG O3')-(69 RU P)-(69 RU O5') -100.0 -40.0
&rst iat = 1121, 1127, 1128, 1131,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 69 URA ALPHA: (68 RG O3')-(69 RU P)-(69 RU O5')-(69 RU C5') -90.0 -30.0
&rst iat = 1127, 1128, 1131, 1132,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 69 URA BETA: (69 RU P)-(69 RU O5')-(69 RU C5')-(69 RU C4') -210.0 -150.0
&rst iat = 1128, 1131, 1132, 1135,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 69 URA GAMMA: (69 RU O5')-(69 RU C5')-(69 RU C4')-(69 RU C3') 30.0 90.0
&rst iat = 1131, 1132, 1135, 1151,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 69 URA DELTA: (69 RU C5')-(69 RU C4')-(69 RU C3')-(69 RU O3') 50.0 110.0
&rst iat = 1132, 1135, 1151, 1157,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 69 URA EPSI: (69 RU C4')-(69 RU C3')-(69 RU O3')-(70 RC P) -180.0 -120.0
&rst iat = 1135, 1151, 1157, 1158,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 69 URA ZETA: (69 RU C3')-(69 RU O3')-(70 RC P)-(70 RC O5') -100.0 -40.0
&rst iat = 1151, 1157, 1158, 1161,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 70 CYT ALPHA: (69 RU O3')-(70 RC P)-(70 RC O5')-(70 RC C5') -90.0 -30.0
&rst iat = 1157, 1158, 1161, 1162,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 70 CYT BETA: (70 RC P)-(70 RC O5')-(70 RC C5')-(70 RC C4') -210.0 -150.0
&rst iat = 1158, 1161, 1162, 1165,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 70 CYT GAMMA: (70 RC O5')-(70 RC C5')-(70 RC C4')-(70 RC C3') 30.0 90.0
&rst iat = 1161, 1162, 1165, 1182,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 70 CYT DELTA: (70 RC C5')-(70 RC C4')-(70 RC C3')-(70 RC O3') 50.0 110.0
&rst iat = 1162, 1165, 1182, 1188,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 70 CYT EPSI: (70 RC C4')-(70 RC C3')-(70 RC O3')-(71 RA P) -180.0 -120.0
&rst iat = 1165, 1182, 1188, 1189,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 70 CYT ZETA: (70 RC C3')-(70 RC O3')-(71 RA P)-(71 RA O5') -100.0 -40.0
&rst iat = 1182, 1188, 1189, 1192,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 71 ADE ALPHA: (70 RC O3')-(71 RA P)-(71 RA O5')-(71 RA C5') -90.0 -30.0
&rst iat = 1188, 1189, 1192, 1193,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 71 ADE BETA: (71 RA P)-(71 RA O5')-(71 RA C5')-(71 RA C4') -210.0 -150.0
&rst iat = 1189, 1192, 1193, 1196,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 71 ADE GAMMA: (71 RA O5')-(71 RA C5')-(71 RA C4')-(71 RA C3') 30.0 90.0
&rst iat = 1192, 1193, 1196, 1215,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 71 ADE DELTA: (71 RA C5')-(71 RA C4')-(71 RA C3')-(71 RA O3') 50.0 110.0
&rst iat = 1193, 1196, 1215, 1221,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 71 ADE EPSI: (71 RA C4')-(71 RA C3')-(71 RA O3')-(72 RU P) -180.0 -120.0
&rst iat = 1196, 1215, 1221, 1222,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 71 ADE ZETA: (71 RA C3')-(71 RA O3')-(72 RU P)-(72 RU O5') -100.0 -40.0
&rst iat = 1215, 1221, 1222, 1225,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 72 URA ALPHA: (71 RA O3')-(72 RU P)-(72 RU O5')-(72 RU C5') -90.0 -30.0
&rst iat = 1221, 1222, 1225, 1226,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 72 URA BETA: (72 RU P)-(72 RU O5')-(72 RU C5')-(72 RU C4') -210.0 -150.0
&rst iat = 1222, 1225, 1226, 1229,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 72 URA GAMMA: (72 RU O5')-(72 RU C5')-(72 RU C4')-(72 RU C3') 30.0 90.0
&rst iat = 1225, 1226, 1229, 1245,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 72 URA DELTA: (72 RU C5')-(72 RU C4')-(72 RU C3')-(72 RU O3') 50.0 110.0
&rst iat = 1226, 1229, 1245, 1251,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 72 URA EPSI: (72 RU C4')-(72 RU C3')-(72 RU O3')-(73 RC P) -180.0 -120.0
&rst iat = 1229, 1245, 1251, 1252,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 72 URA ZETA: (72 RU C3')-(72 RU O3')-(73 RC P)-(73 RC O5') -100.0 -40.0
&rst iat = 1245, 1251, 1252, 1255,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 73 CYT ALPHA: (72 RU O3')-(73 RC P)-(73 RC O5')-(73 RC C5') -90.0 -30.0
&rst iat = 1251, 1252, 1255, 1256,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 73 CYT BETA: (73 RC P)-(73 RC O5')-(73 RC C5')-(73 RC C4') -210.0 -150.0
&rst iat = 1252, 1255, 1256, 1259,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 73 CYT GAMMA: (73 RC O5')-(73 RC C5')-(73 RC C4')-(73 RC C3') 30.0 90.0
&rst iat = 1255, 1256, 1259, 1276,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 73 CYT DELTA: (73 RC C5')-(73 RC C4')-(73 RC C3')-(73 RC O3') 50.0 110.0
&rst iat = 1256, 1259, 1276, 1282,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 74 ADE DELTA: (74 RA C5')-(74 RA C4')-(74 RA C3')-(74 RA O3') 55.0 115.0
&rst iat = 1287, 1290, 1309, 1315,
r1 = 54.0, r2 = 55.0, r3 = 115.0, r4 = 116.0,
&end
# 75 GUA DELTA: (75 RG C5')-(75 RG C4')-(75 RG C3')-(75 RG O3') 130.0 190.0
&rst iat = 1320, 1323, 1343, 1349,
r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
&end
# 76 GUA DELTA: (76 RG C5')-(76 RG C4')-(76 RG C3')-(76 RG O3') 130.0 190.0
&rst iat = 1354, 1357, 1377, 1383,
r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
&end
# 77 ADE DELTA: (77 RA C5')-(77 RA C4')-(77 RA C3')-(77 RA O3') 55.0 115.0
&rst iat = 1388, 1391, 1410, 1416,
r1 = 54.0, r2 = 55.0, r3 = 115.0, r4 = 116.0,
&end
# 78 CYT DELTA: (78 RC C5')-(78 RC C4')-(78 RC C3')-(78 RC O3') 130.0 190.0
&rst iat = 1421, 1424, 1441, 1447,
r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
&end
# 79 GUA DELTA: (79 RG C5')-(79 RG C4')-(79 RG C3')-(79 RG O3') 50.0 110.0
&rst iat = 1452, 1455, 1475, 1481,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 79 GUA EPSI: (79 RG C4')-(79 RG C3')-(79 RG O3')-(80 RA P) -180.0 -120.0
&rst iat = 1455, 1475, 1481, 1482,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 79 GUA ZETA: (79 RG C3')-(79 RG O3')-(80 RA P)-(80 RA O5') -100.0 -40.0
&rst iat = 1475, 1481, 1482, 1485,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 80 ADE ALPHA: (79 RG O3')-(80 RA P)-(80 RA O5')-(80 RA C5') -90.0 -30.0
&rst iat = 1481, 1482, 1485, 1486,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 80 ADE BETA: (80 RA P)-(80 RA O5')-(80 RA C5')-(80 RA C4') -210.0 -150.0
&rst iat = 1482, 1485, 1486, 1489,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 80 ADE GAMMA: (80 RA O5')-(80 RA C5')-(80 RA C4')-(80 RA C3') 30.0 90.0
&rst iat = 1485, 1486, 1489, 1508,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 80 ADE DELTA: (80 RA C5')-(80 RA C4')-(80 RA C3')-(80 RA O3') 50.0 110.0
&rst iat = 1486, 1489, 1508, 1514,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 80 ADE EPSI: (80 RA C4')-(80 RA C3')-(80 RA O3')-(81 RU P) -180.0 -120.0
&rst iat = 1489, 1508, 1514, 1515,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 80 ADE ZETA: (80 RA C3')-(80 RA O3')-(81 RU P)-(81 RU O5') -100.0 -40.0
&rst iat = 1508, 1514, 1515, 1518,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 81 URA ALPHA: (80 RA O3')-(81 RU P)-(81 RU O5')-(81 RU C5') -90.0 -30.0
&rst iat = 1514, 1515, 1518, 1519,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 81 URA BETA: (81 RU P)-(81 RU O5')-(81 RU C5')-(81 RU C4') -210.0 -150.0
&rst iat = 1515, 1518, 1519, 1522,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 81 URA GAMMA: (81 RU O5')-(81 RU C5')-(81 RU C4')-(81 RU C3') 30.0 90.0
&rst iat = 1518, 1519, 1522, 1538,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 81 URA DELTA: (81 RU C5')-(81 RU C4')-(81 RU C3')-(81 RU O3') 50.0 110.0
&rst iat = 1519, 1522, 1538, 1544,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 81 URA EPSI: (81 RU C4')-(81 RU C3')-(81 RU O3')-(82 RG P) -180.0 -120.0
&rst iat = 1522, 1538, 1544, 1545,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 81 URA ZETA: (81 RU C3')-(81 RU O3')-(82 RG P)-(82 RG O5') -100.0 -40.0
&rst iat = 1538, 1544, 1545, 1548,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 82 GUA ALPHA: (81 RU O3')-(82 RG P)-(82 RG O5')-(82 RG C5') -90.0 -30.0
&rst iat = 1544, 1545, 1548, 1549,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 82 GUA BETA: (82 RG P)-(82 RG O5')-(82 RG C5')-(82 RG C4') -210.0 -150.0
&rst iat = 1545, 1548, 1549, 1552,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 82 GUA GAMMA: (82 RG O5')-(82 RG C5')-(82 RG C4')-(82 RG C3') 30.0 90.0
&rst iat = 1548, 1549, 1552, 1572,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 82 GUA DELTA: (82 RG C5')-(82 RG C4')-(82 RG C3')-(82 RG O3') 50.0 110.0
&rst iat = 1549, 1552, 1572, 1578,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 82 GUA EPSI: (82 RG C4')-(82 RG C3')-(82 RG O3')-(83 RA P) -180.0 -120.0
&rst iat = 1552, 1572, 1578, 1579,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 82 GUA ZETA: (82 RG C3')-(82 RG O3')-(83 RA P)-(83 RA O5') -100.0 -40.0
&rst iat = 1572, 1578, 1579, 1582,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 83 ADE ALPHA: (82 RG O3')-(83 RA P)-(83 RA O5')-(83 RA C5') -90.0 -30.0
&rst iat = 1578, 1579, 1582, 1583,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 83 ADE BETA: (83 RA P)-(83 RA O5')-(83 RA C5')-(83 RA C4') -210.0 -150.0
&rst iat = 1579, 1582, 1583, 1586,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 83 ADE GAMMA: (83 RA O5')-(83 RA C5')-(83 RA C4')-(83 RA C3') 30.0 90.0
&rst iat = 1582, 1583, 1586, 1605,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 83 ADE DELTA: (83 RA C5')-(83 RA C4')-(83 RA C3')-(83 RA O3') 50.0 110.0
&rst iat = 1583, 1586, 1605, 1611,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 83 ADE EPSI: (83 RA C4')-(83 RA C3')-(83 RA O3')-(84 RC P) -180.0 -120.0
&rst iat = 1586, 1605, 1611, 1612,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 83 ADE ZETA: (83 RA C3')-(83 RA O3')-(84 RC P)-(84 RC O5') -100.0 -40.0
&rst iat = 1605, 1611, 1612, 1615,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 84 CYT ALPHA: (83 RA O3')-(84 RC P)-(84 RC O5')-(84 RC C5') -90.0 -30.0
&rst iat = 1611, 1612, 1615, 1616,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 84 CYT BETA: (84 RC P)-(84 RC O5')-(84 RC C5')-(84 RC C4') -210.0 -150.0
&rst iat = 1612, 1615, 1616, 1619,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 84 CYT GAMMA: (84 RC O5')-(84 RC C5')-(84 RC C4')-(84 RC C3') 30.0 90.0
&rst iat = 1615, 1616, 1619, 1636,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 84 CYT DELTA: (84 RC C5')-(84 RC C4')-(84 RC C3')-(84 RC O3') 50.0 110.0
&rst iat = 1616, 1619, 1636, 1642,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 84 CYT EPSI: (84 RC C4')-(84 RC C3')-(84 RC O3')-(85 RC P) -180.0 -120.0
&rst iat = 1619, 1636, 1642, 1643,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 84 CYT ZETA: (84 RC C3')-(84 RC O3')-(85 RC P)-(85 RC O5') -100.0 -40.0
&rst iat = 1636, 1642, 1643, 1646,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 85 CYT ALPHA: (84 RC O3')-(85 RC P)-(85 RC O5')-(85 RC C5') -90.0 -30.0
&rst iat = 1642, 1643, 1646, 1647,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 85 CYT BETA: (85 RC P)-(85 RC O5')-(85 RC C5')-(85 RC C4') -210.0 -150.0
&rst iat = 1643, 1646, 1647, 1650,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 85 CYT GAMMA: (85 RC O5')-(85 RC C5')-(85 RC C4')-(85 RC C3') 30.0 90.0
&rst iat = 1646, 1647, 1650, 1667,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 85 CYT DELTA: (85 RC C5')-(85 RC C4')-(85 RC C3')-(85 RC O3') 50.0 110.0
&rst iat = 1647, 1650, 1667, 1673,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 85 CYT EPSI: (85 RC C4')-(85 RC C3')-(85 RC O3')-(86 RC3 P) -180.0 -120.0
&rst iat = 1650, 1667, 1673, 1674,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 85 CYT ZETA: (85 RC C3')-(85 RC O3')-(86 RC3 P)-(86 RC3 O5') -100.0 -40.0
&rst iat = 1667, 1673, 1674, 1677,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 86 CYT ALPHA: (85 RC O3')-(86 RC3 P)-(86 RC3 O5')-(86 RC3 C5') -90.0 -30.0
&rst iat = 1673, 1674, 1677, 1678,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 86 CYT BETA: (86 RC3 P)-(86 RC3 O5')-(86 RC3 C5')-(86 RC3 C4') -210.0 -150.0
&rst iat = 1674, 1677, 1678, 1681,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 86 CYT GAMMA: (86 RC3 O5')-(86 RC3 C5')-(86 RC3 C4')-(86 RC3 C3') 30.0 90.0
&rst iat = 1677, 1678, 1681, 1698,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 86 CYT DELTA: (86 RC3 C5')-(86 RC3 C4')-(86 RC3 C3')-(86 RC3 O3') 50.0 110.0
&rst iat = 1678, 1681, 1698, 1704,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 152 GUA DELTA: (152 RG5 C5')-(152 RG5 C4')-(152 RG5 C3')-(152 RG5 O3') 50.0 110.0
&rst iat = 2735, 2738, 2758, 2764,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 152 GUA EPSI: (152 RG5 C4')-(152 RG5 C3')-(152 RG5 O3')-(153 RG P) -180.0 -120.0
&rst iat = 2738, 2758, 2764, 2765,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 152 GUA ZETA: (152 RG5 C3')-(152 RG5 O3')-(153 RG P)-(153 RG O5') -100.0 -40.0
&rst iat = 2758, 2764, 2765, 2768,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 153 GUA ALPHA: (152 RG5 O3')-(153 RG P)-(153 RG O5')-(153 RG C5') -90.0 -30.0
&rst iat = 2764, 2765, 2768, 2769,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 153 GUA BETA: (153 RG P)-(153 RG O5')-(153 RG C5')-(153 RG C4') -210.0 -150.0
&rst iat = 2765, 2768, 2769, 2772,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 153 GUA GAMMA: (153 RG O5')-(153 RG C5')-(153 RG C4')-(153 RG C3') 30.0 90.0
&rst iat = 2768, 2769, 2772, 2792,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 153 GUA DELTA: (153 RG C5')-(153 RG C4')-(153 RG C3')-(153 RG O3') 50.0 110.0
&rst iat = 2769, 2772, 2792, 2798,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 153 GUA EPSI: (153 RG C4')-(153 RG C3')-(153 RG O3')-(154 RG P) -180.0 -120.0
&rst iat = 2772, 2792, 2798, 2799,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 153 GUA ZETA: (153 RG C3')-(153 RG O3')-(154 RG P)-(154 RG O5') -100.0 -40.0
&rst iat = 2792, 2798, 2799, 2802,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 154 GUA ALPHA: (153 RG O3')-(154 RG P)-(154 RG O5')-(154 RG C5') -90.0 -30.0
&rst iat = 2798, 2799, 2802, 2803,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 154 GUA BETA: (154 RG P)-(154 RG O5')-(154 RG C5')-(154 RG C4') -210.0 -150.0
&rst iat = 2799, 2802, 2803, 2806,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 154 GUA GAMMA: (154 RG O5')-(154 RG C5')-(154 RG C4')-(154 RG C3') 30.0 90.0
&rst iat = 2802, 2803, 2806, 2826,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 154 GUA DELTA: (154 RG C5')-(154 RG C4')-(154 RG C3')-(154 RG O3') 50.0 110.0
&rst iat = 2803, 2806, 2826, 2832,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 154 GUA EPSI: (154 RG C4')-(154 RG C3')-(154 RG O3')-(155 RU P) -180.0 -120.0
&rst iat = 2806, 2826, 2832, 2833,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 154 GUA ZETA: (154 RG C3')-(154 RG O3')-(155 RU P)-(155 RU O5') -100.0 -40.0
&rst iat = 2826, 2832, 2833, 2836,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 155 URA ALPHA: (154 RG O3')-(155 RU P)-(155 RU O5')-(155 RU C5') -90.0 -30.0
&rst iat = 2832, 2833, 2836, 2837,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 155 URA BETA: (155 RU P)-(155 RU O5')-(155 RU C5')-(155 RU C4') -210.0 -150.0
&rst iat = 2833, 2836, 2837, 2840,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 155 URA GAMMA: (155 RU O5')-(155 RU C5')-(155 RU C4')-(155 RU C3') 30.0 90.0
&rst iat = 2836, 2837, 2840, 2856,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 155 URA DELTA: (155 RU C5')-(155 RU C4')-(155 RU C3')-(155 RU O3') 50.0 110.0
&rst iat = 2837, 2840, 2856, 2862,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 155 URA EPSI: (155 RU C4')-(155 RU C3')-(155 RU O3')-(156 RC P) -180.0 -120.0
&rst iat = 2840, 2856, 2862, 2863,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 155 URA ZETA: (155 RU C3')-(155 RU O3')-(156 RC P)-(156 RC O5') -100.0 -40.0
&rst iat = 2856, 2862, 2863, 2866,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 156 CYT ALPHA: (155 RU O3')-(156 RC P)-(156 RC O5')-(156 RC C5') -90.0 -30.0
&rst iat = 2862, 2863, 2866, 2867,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 156 CYT BETA: (156 RC P)-(156 RC O5')-(156 RC C5')-(156 RC C4') -210.0 -150.0
&rst iat = 2863, 2866, 2867, 2870,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 156 CYT GAMMA: (156 RC O5')-(156 RC C5')-(156 RC C4')-(156 RC C3') 30.0 90.0
&rst iat = 2866, 2867, 2870, 2887,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 156 CYT DELTA: (156 RC C5')-(156 RC C4')-(156 RC C3')-(156 RC O3') 50.0 110.0
&rst iat = 2867, 2870, 2887, 2893,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 156 CYT EPSI: (156 RC C4')-(156 RC C3')-(156 RC O3')-(157 RA P) -180.0 -120.0
&rst iat = 2870, 2887, 2893, 2894,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 156 CYT ZETA: (156 RC C3')-(156 RC O3')-(157 RA P)-(157 RA O5') -100.0 -40.0
&rst iat = 2887, 2893, 2894, 2897,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 157 ADE ALPHA: (156 RC O3')-(157 RA P)-(157 RA O5')-(157 RA C5') -90.0 -30.0
&rst iat = 2893, 2894, 2897, 2898,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 157 ADE BETA: (157 RA P)-(157 RA O5')-(157 RA C5')-(157 RA C4') -210.0 -150.0
&rst iat = 2894, 2897, 2898, 2901,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 157 ADE GAMMA: (157 RA O5')-(157 RA C5')-(157 RA C4')-(157 RA C3') 30.0 90.0
&rst iat = 2897, 2898, 2901, 2920,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 157 ADE DELTA: (157 RA C5')-(157 RA C4')-(157 RA C3')-(157 RA O3') 50.0 110.0
&rst iat = 2898, 2901, 2920, 2926,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 157 ADE EPSI: (157 RA C4')-(157 RA C3')-(157 RA O3')-(158 RU P) -180.0 -120.0
&rst iat = 2901, 2920, 2926, 2927,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 157 ADE ZETA: (157 RA C3')-(157 RA O3')-(158 RU P)-(158 RU O5') -100.0 -40.0
&rst iat = 2920, 2926, 2927, 2930,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 158 URA ALPHA: (157 RA O3')-(158 RU P)-(158 RU O5')-(158 RU C5') -90.0 -30.0
&rst iat = 2926, 2927, 2930, 2931,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 158 URA BETA: (158 RU P)-(158 RU O5')-(158 RU C5')-(158 RU C4') -210.0 -150.0
&rst iat = 2927, 2930, 2931, 2934,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 158 URA GAMMA: (158 RU O5')-(158 RU C5')-(158 RU C4')-(158 RU C3') 30.0 90.0
&rst iat = 2930, 2931, 2934, 2950,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 158 URA DELTA: (158 RU C5')-(158 RU C4')-(158 RU C3')-(158 RU O3') 50.0 110.0
&rst iat = 2931, 2934, 2950, 2956,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 158 URA EPSI: (158 RU C4')-(158 RU C3')-(158 RU O3')-(159 RC P) -180.0 -120.0
&rst iat = 2934, 2950, 2956, 2957,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 158 URA ZETA: (158 RU C3')-(158 RU O3')-(159 RC P)-(159 RC O5') -100.0 -40.0
&rst iat = 2950, 2956, 2957, 2960,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 159 CYT ALPHA: (158 RU O3')-(159 RC P)-(159 RC O5')-(159 RC C5') -90.0 -30.0
&rst iat = 2956, 2957, 2960, 2961,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 159 CYT BETA: (159 RC P)-(159 RC O5')-(159 RC C5')-(159 RC C4') -210.0 -150.0
&rst iat = 2957, 2960, 2961, 2964,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 159 CYT GAMMA: (159 RC O5')-(159 RC C5')-(159 RC C4')-(159 RC C3') 30.0 90.0
&rst iat = 2960, 2961, 2964, 2981,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 159 CYT DELTA: (159 RC C5')-(159 RC C4')-(159 RC C3')-(159 RC O3') 50.0 110.0
&rst iat = 2961, 2964, 2981, 2987,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 160 ADE DELTA: (160 RA C5')-(160 RA C4')-(160 RA C3')-(160 RA O3') 55.0 115.0
&rst iat = 2992, 2995, 3014, 3020,
r1 = 54.0, r2 = 55.0, r3 = 115.0, r4 = 116.0,
&end
# 161 GUA DELTA: (161 RG C5')-(161 RG C4')-(161 RG C3')-(161 RG O3') 130.0 190.0
&rst iat = 3025, 3028, 3048, 3054,
r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
&end
# 162 GUA DELTA: (162 RG C5')-(162 RG C4')-(162 RG C3')-(162 RG O3') 130.0 190.0
&rst iat = 3059, 3062, 3082, 3088,
r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
&end
# 163 ADE DELTA: (163 RA C5')-(163 RA C4')-(163 RA C3')-(163 RA O3') 55.0 115.0
&rst iat = 3093, 3096, 3115, 3121,
r1 = 54.0, r2 = 55.0, r3 = 115.0, r4 = 116.0,
&end
# 164 CYT DELTA: (164 RC C5')-(164 RC C4')-(164 RC C3')-(164 RC O3') 130.0 190.0
&rst iat = 3126, 3129, 3146, 3152,
r1 = 129.0, r2 = 130.0, r3 = 190.0, r4 = 191.0,
&end
# 165 GUA DELTA: (165 RG C5')-(165 RG C4')-(165 RG C3')-(165 RG O3') 50.0 110.0
&rst iat = 3157, 3160, 3180, 3186,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 165 GUA EPSI: (165 RG C4')-(165 RG C3')-(165 RG O3')-(166 RA P) -180.0 -120.0
&rst iat = 3160, 3180, 3186, 3187,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 165 GUA ZETA: (165 RG C3')-(165 RG O3')-(166 RA P)-(166 RA O5') -100.0 -40.0
&rst iat = 3180, 3186, 3187, 3190,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 166 ADE ALPHA: (165 RG O3')-(166 RA P)-(166 RA O5')-(166 RA C5') -90.0 -30.0
&rst iat = 3186, 3187, 3190, 3191,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 166 ADE BETA: (166 RA P)-(166 RA O5')-(166 RA C5')-(166 RA C4') -210.0 -150.0
&rst iat = 3187, 3190, 3191, 3194,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 166 ADE GAMMA: (166 RA O5')-(166 RA C5')-(166 RA C4')-(166 RA C3') 30.0 90.0
&rst iat = 3190, 3191, 3194, 3213,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 166 ADE DELTA: (166 RA C5')-(166 RA C4')-(166 RA C3')-(166 RA O3') 50.0 110.0
&rst iat = 3191, 3194, 3213, 3219,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 166 ADE EPSI: (166 RA C4')-(166 RA C3')-(166 RA O3')-(167 RU P) -180.0 -120.0
&rst iat = 3194, 3213, 3219, 3220,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 166 ADE ZETA: (166 RA C3')-(166 RA O3')-(167 RU P)-(167 RU O5') -100.0 -40.0
&rst iat = 3213, 3219, 3220, 3223,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 167 URA ALPHA: (166 RA O3')-(167 RU P)-(167 RU O5')-(167 RU C5') -90.0 -30.0
&rst iat = 3219, 3220, 3223, 3224,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 167 URA BETA: (167 RU P)-(167 RU O5')-(167 RU C5')-(167 RU C4') -210.0 -150.0
&rst iat = 3220, 3223, 3224, 3227,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 167 URA GAMMA: (167 RU O5')-(167 RU C5')-(167 RU C4')-(167 RU C3') 30.0 90.0
&rst iat = 3223, 3224, 3227, 3243,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 167 URA DELTA: (167 RU C5')-(167 RU C4')-(167 RU C3')-(167 RU O3') 50.0 110.0
&rst iat = 3224, 3227, 3243, 3249,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 167 URA EPSI: (167 RU C4')-(167 RU C3')-(167 RU O3')-(168 RG P) -180.0 -120.0
&rst iat = 3227, 3243, 3249, 3250,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 167 URA ZETA: (167 RU C3')-(167 RU O3')-(168 RG P)-(168 RG O5') -100.0 -40.0
&rst iat = 3243, 3249, 3250, 3253,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 168 GUA ALPHA: (167 RU O3')-(168 RG P)-(168 RG O5')-(168 RG C5') -90.0 -30.0
&rst iat = 3249, 3250, 3253, 3254,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 168 GUA BETA: (168 RG P)-(168 RG O5')-(168 RG C5')-(168 RG C4') -210.0 -150.0
&rst iat = 3250, 3253, 3254, 3257,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 168 GUA GAMMA: (168 RG O5')-(168 RG C5')-(168 RG C4')-(168 RG C3') 30.0 90.0
&rst iat = 3253, 3254, 3257, 3277,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 168 GUA DELTA: (168 RG C5')-(168 RG C4')-(168 RG C3')-(168 RG O3') 50.0 110.0
&rst iat = 3254, 3257, 3277, 3283,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 168 GUA EPSI: (168 RG C4')-(168 RG C3')-(168 RG O3')-(169 RA P) -180.0 -120.0
&rst iat = 3257, 3277, 3283, 3284,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 168 GUA ZETA: (168 RG C3')-(168 RG O3')-(169 RA P)-(169 RA O5') -100.0 -40.0
&rst iat = 3277, 3283, 3284, 3287,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 169 ADE ALPHA: (168 RG O3')-(169 RA P)-(169 RA O5')-(169 RA C5') -90.0 -30.0
&rst iat = 3283, 3284, 3287, 3288,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 169 ADE BETA: (169 RA P)-(169 RA O5')-(169 RA C5')-(169 RA C4') -210.0 -150.0
&rst iat = 3284, 3287, 3288, 3291,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 169 ADE GAMMA: (169 RA O5')-(169 RA C5')-(169 RA C4')-(169 RA C3') 30.0 90.0
&rst iat = 3287, 3288, 3291, 3310,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 169 ADE DELTA: (169 RA C5')-(169 RA C4')-(169 RA C3')-(169 RA O3') 50.0 110.0
&rst iat = 3288, 3291, 3310, 3316,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 169 ADE EPSI: (169 RA C4')-(169 RA C3')-(169 RA O3')-(170 RC P) -180.0 -120.0
&rst iat = 3291, 3310, 3316, 3317,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 169 ADE ZETA: (169 RA C3')-(169 RA O3')-(170 RC P)-(170 RC O5') -100.0 -40.0
&rst iat = 3310, 3316, 3317, 3320,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 170 CYT ALPHA: (169 RA O3')-(170 RC P)-(170 RC O5')-(170 RC C5') -90.0 -30.0
&rst iat = 3316, 3317, 3320, 3321,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 170 CYT BETA: (170 RC P)-(170 RC O5')-(170 RC C5')-(170 RC C4') -210.0 -150.0
&rst iat = 3317, 3320, 3321, 3324,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 170 CYT GAMMA: (170 RC O5')-(170 RC C5')-(170 RC C4')-(170 RC C3') 30.0 90.0
&rst iat = 3320, 3321, 3324, 3341,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 170 CYT DELTA: (170 RC C5')-(170 RC C4')-(170 RC C3')-(170 RC O3') 50.0 110.0
&rst iat = 3321, 3324, 3341, 3347,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 170 CYT EPSI: (170 RC C4')-(170 RC C3')-(170 RC O3')-(171 RC P) -180.0 -120.0
&rst iat = 3324, 3341, 3347, 3348,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 170 CYT ZETA: (170 RC C3')-(170 RC O3')-(171 RC P)-(171 RC O5') -100.0 -40.0
&rst iat = 3341, 3347, 3348, 3351,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 171 CYT ALPHA: (170 RC O3')-(171 RC P)-(171 RC O5')-(171 RC C5') -90.0 -30.0
&rst iat = 3347, 3348, 3351, 3352,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 171 CYT BETA: (171 RC P)-(171 RC O5')-(171 RC C5')-(171 RC C4') -210.0 -150.0
&rst iat = 3348, 3351, 3352, 3355,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 171 CYT GAMMA: (171 RC O5')-(171 RC C5')-(171 RC C4')-(171 RC C3') 30.0 90.0
&rst iat = 3351, 3352, 3355, 3372,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 171 CYT DELTA: (171 RC C5')-(171 RC C4')-(171 RC C3')-(171 RC O3') 50.0 110.0
&rst iat = 3352, 3355, 3372, 3378,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
# 171 CYT EPSI: (171 RC C4')-(171 RC C3')-(171 RC O3')-(172 RC3 P) -180.0 -120.0
&rst iat = 3355, 3372, 3378, 3379,
r1 = -181.0, r2 = -180.0, r3 = -120.0, r4 = -119.0,
&end
# 171 CYT ZETA: (171 RC C3')-(171 RC O3')-(172 RC3 P)-(172 RC3 O5') -100.0 -40.0
&rst iat = 3372, 3378, 3379, 3382,
r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0,
&end
# 172 CYT ALPHA: (171 RC O3')-(172 RC3 P)-(172 RC3 O5')-(172 RC3 C5') -90.0 -30.0
&rst iat = 3378, 3379, 3382, 3383,
r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
&end
# 172 CYT BETA: (172 RC3 P)-(172 RC3 O5')-(172 RC3 C5')-(172 RC3 C4') -210.0 -150.0
&rst iat = 3379, 3382, 3383, 3386,
r1 = -211.0, r2 = -210.0, r3 = -150.0, r4 = -149.0,
&end
# 172 CYT GAMMA: (172 RC3 O5')-(172 RC3 C5')-(172 RC3 C4')-(172 RC3 C3') 30.0 90.0
&rst iat = 3382, 3383, 3386, 3403,
r1 = 29.0, r2 = 30.0, r3 = 90.0, r4 = 91.0,
&end
# 172 CYT DELTA: (172 RC3 C5')-(172 RC3 C4')-(172 RC3 C3')-(172 RC3 O3') 50.0 110.0
&rst iat = 3383, 3386, 3403, 3409,
r1 = 49.0, r2 = 50.0, r3 = 110.0, r4 = 111.0,
&end
;
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