NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
378520 |
1heh   |
4900 | cing | 4-filtered-FRED | STAR | entry | full | 930 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1heh
# This FRED archive file contains, for PDB entry <1heh>:
#
# - Coordinates and sequence information from the PDB mmCIF file
# - NMR restraints from the PDB MR file
#
# In this file, the coordinates and NMR restraints share the same atom names,
# and in this way can differ from the data deposited at the wwPDB. To achieve
# this aim, the NMR restraints were parsed from their original format files, and
# the coordinates and NMR restraints information were subsequently harmonized.
#
# Due to the complexity of this harmonization process and the filtering process
# used in creating these files, the NMR restraints information in these files
# may differ significantly from that in the originally deposited file. Other
# modifications could have occurred to the NMR restraints information, or data
# could have been lost because of parsing or conversion errors. The PDB file
# remains the authoritative reference for the atomic coordinates and the
# originally deposited restraints files remain the primary reference for these
# data.
#
# This file is generated at the BioMagResBank (BMRB) in collaboration with the
# PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and
# the CMBI/IMM group at the Radboud University of Nijmegen.
#
# Several software packages were used to produce this file:
#
# - Wattos (BMRB and CMBI/IMM).
# - FormatConverter and NMRStarExport (PDBe).
# - CCPN framework (http://www.ccpn.ac.uk/).
#
# More information about this process can be found in the references below.
# Please cite the original reference for this PDB entry.
#
# JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL
# Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED
# containing converted and filtered sets of experimental NMR restraints and
# coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12.
#
# WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL
# Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy:
# development of a software pipeline. Proteins 59, 687-696.
#
# JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend,
# JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with
# curated sets of experimental NMR restraints for over 4,000 protein and nucleic
# acid PDB entries. (in preparation)
save_Conversion_project_for_entry_Name_1
_Study_list.Sf_category study_list
_Study_list.Entry_ID 1
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project for entry 1" NMR . 1 1
stop_
save_
save_originalConstraints_1
_Entry.Sf_category entry_information
_Entry.ID 1
_Entry.Title "Data for entry 1"
_Entry.NMR_STAR_version 3.1.0.8
_Entry.Experimental_method NMR
_Entry.Details .
save_
save_assembly_1heh
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 1heh
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "all disulfide bound"
_Assembly.Molecular_mass 8745.29
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 . 1 $ENDO_1_4_BETA_XYLANASE_D A . 1 1
stop_
save_
save_ENDO_1_4_BETA_XYLANASE_D
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "ENDO 1 4 BETA XYLANASE D"
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_seq_one_letter_code TGSCSVSAVRGEEWADRFNVTYSVSGSSSWVVTLGLNGGQSVQSSWNAALTGSSGTVTARPNGSGNSFGVTFYKNGSSATPGATCATG
_Entity.Number_of_monomers 88
loop_
_Entity_comp_index.ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 THR . 1 1
2 GLY . 1 1
3 SER . 1 1
4 CYS . 1 1
5 SER . 1 1
6 VAL . 1 1
7 SER . 1 1
8 ALA . 1 1
9 VAL . 1 1
10 ARG . 1 1
11 GLY . 1 1
12 GLU . 1 1
13 GLU . 1 1
14 TRP . 1 1
15 ALA . 1 1
16 ASP . 1 1
17 ARG . 1 1
18 PHE . 1 1
19 ASN . 1 1
20 VAL . 1 1
21 THR . 1 1
22 TYR . 1 1
23 SER . 1 1
24 VAL . 1 1
25 SER . 1 1
26 GLY . 1 1
27 SER . 1 1
28 SER . 1 1
29 SER . 1 1
30 TRP . 1 1
31 VAL . 1 1
32 VAL . 1 1
33 THR . 1 1
34 LEU . 1 1
35 GLY . 1 1
36 LEU . 1 1
37 ASN . 1 1
38 GLY . 1 1
39 GLY . 1 1
40 GLN . 1 1
41 SER . 1 1
42 VAL . 1 1
43 GLN . 1 1
44 SER . 1 1
45 SER . 1 1
46 TRP . 1 1
47 ASN . 1 1
48 ALA . 1 1
49 ALA . 1 1
50 LEU . 1 1
51 THR . 1 1
52 GLY . 1 1
53 SER . 1 1
54 SER . 1 1
55 GLY . 1 1
56 THR . 1 1
57 VAL . 1 1
58 THR . 1 1
59 ALA . 1 1
60 ARG . 1 1
61 PRO . 1 1
62 ASN . 1 1
63 GLY . 1 1
64 SER . 1 1
65 GLY . 1 1
66 ASN . 1 1
67 SER . 1 1
68 PHE . 1 1
69 GLY . 1 1
70 VAL . 1 1
71 THR . 1 1
72 PHE . 1 1
73 TYR . 1 1
74 LYS . 1 1
75 ASN . 1 1
76 GLY . 1 1
77 SER . 1 1
78 SER . 1 1
79 ALA . 1 1
80 THR . 1 1
81 PRO . 1 1
82 GLY . 1 1
83 ALA . 1 1
84 THR . 1 1
85 CYS . 1 1
86 ALA . 1 1
87 THR . 1 1
88 GLY . 1 1
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
THR 1 1 1 1
GLY 2 2 1 1
SER 3 3 1 1
CYS 4 4 1 1
SER 5 5 1 1
VAL 6 6 1 1
SER 7 7 1 1
ALA 8 8 1 1
VAL 9 9 1 1
ARG 10 10 1 1
GLY 11 11 1 1
GLU 12 12 1 1
GLU 13 13 1 1
TRP 14 14 1 1
ALA 15 15 1 1
ASP 16 16 1 1
ARG 17 17 1 1
PHE 18 18 1 1
ASN 19 19 1 1
VAL 20 20 1 1
THR 21 21 1 1
TYR 22 22 1 1
SER 23 23 1 1
VAL 24 24 1 1
SER 25 25 1 1
GLY 26 26 1 1
SER 27 27 1 1
SER 28 28 1 1
SER 29 29 1 1
TRP 30 30 1 1
VAL 31 31 1 1
VAL 32 32 1 1
THR 33 33 1 1
LEU 34 34 1 1
GLY 35 35 1 1
LEU 36 36 1 1
ASN 37 37 1 1
GLY 38 38 1 1
GLY 39 39 1 1
GLN 40 40 1 1
SER 41 41 1 1
VAL 42 42 1 1
GLN 43 43 1 1
SER 44 44 1 1
SER 45 45 1 1
TRP 46 46 1 1
ASN 47 47 1 1
ALA 48 48 1 1
ALA 49 49 1 1
LEU 50 50 1 1
THR 51 51 1 1
GLY 52 52 1 1
SER 53 53 1 1
SER 54 54 1 1
GLY 55 55 1 1
THR 56 56 1 1
VAL 57 57 1 1
THR 58 58 1 1
ALA 59 59 1 1
ARG 60 60 1 1
PRO 61 61 1 1
ASN 62 62 1 1
GLY 63 63 1 1
SER 64 64 1 1
GLY 65 65 1 1
ASN 66 66 1 1
SER 67 67 1 1
PHE 68 68 1 1
GLY 69 69 1 1
VAL 70 70 1 1
THR 71 71 1 1
PHE 72 72 1 1
TYR 73 73 1 1
LYS 74 74 1 1
ASN 75 75 1 1
GLY 76 76 1 1
SER 77 77 1 1
SER 78 78 1 1
ALA 79 79 1 1
THR 80 80 1 1
PRO 81 81 1 1
GLY 82 82 1 1
ALA 83 83 1 1
THR 84 84 1 1
CYS 85 85 1 1
ALA 86 86 1 1
THR 87 87 1 1
GLY 88 88 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 1
2 1 . . . 1 1
3 1 . . . 1 1
4 1 . . . 1 1
5 1 . . . 1 1
6 1 . . . 1 1
7 1 . . . 1 1
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9 1 . . . 1 1
10 1 . . . 1 1
11 1 . . . 1 1
12 1 . . . 1 1
13 1 . . . 1 1
14 1 . . . 1 1
15 1 . . . 1 1
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20 1 . . . 1 1
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268 1 . . . 1 1
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275 1 . . . 1 1
276 1 . . . 1 1
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280 1 . . . 1 1
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530 1 . . . 1 1
531 1 . . . 1 1
532 1 . . . 1 1
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534 1 . . . 1 1
535 1 . . . 1 1
536 1 . . . 1 1
537 1 . . . 1 1
538 1 . . . 1 1
539 1 . . . 1 1
540 1 . . . 1 1
541 1 . . . 1 1
542 1 . . . 1 1
543 1 . . . 1 1
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547 1 . . . 1 1
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558 1 . . . 1 1
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560 1 . . . 1 1
561 1 . . . 1 1
562 1 . . . 1 1
563 1 . . . 1 1
564 1 . . . 1 1
565 1 . . . 1 1
566 1 . . . 1 1
567 1 . . . 1 1
568 1 . . . 1 1
569 1 . . . 1 1
570 1 . . . 1 1
571 1 . . . 1 1
572 1 . . . 1 1
573 1 . . . 1 1
574 1 . . . 1 1
575 1 . . . 1 1
576 1 . . . 1 1
577 1 . . . 1 1
578 1 . . . 1 1
579 1 . . . 1 1
580 1 . . . 1 1
581 1 . . . 1 1
582 1 . . . 1 1
583 1 . . . 1 1
584 1 . . . 1 1
585 1 . . . 1 1
586 1 . . . 1 1
587 1 . . . 1 1
588 1 . . . 1 1
589 1 . . . 1 1
590 1 . . . 1 1
591 1 . . . 1 1
592 1 . . . 1 1
593 1 . . . 1 1
594 1 . . . 1 1
595 1 . . . 1 1
596 1 . . . 1 1
597 1 . . . 1 1
598 1 . . . 1 1
599 1 . . . 1 1
600 1 . . . 1 1
601 1 . . . 1 1
602 1 . . . 1 1
603 1 . . . 1 1
604 1 . . . 1 1
605 1 . . . 1 1
606 1 . . . 1 1
607 1 . . . 1 1
608 1 . . . 1 1
609 1 . . . 1 1
610 1 . . . 1 1
611 1 . . . 1 1
612 1 . . . 1 1
613 1 . . . 1 1
614 1 . . . 1 1
615 1 . . . 1 1
616 1 . . . 1 1
617 1 . . . 1 1
618 1 . . . 1 1
619 1 . . . 1 1
620 1 . . . 1 1
621 1 . . . 1 1
622 1 . . . 1 1
623 1 . . . 1 1
624 1 . . . 1 1
625 1 . . . 1 1
626 1 . . . 1 1
627 1 . . . 1 1
628 1 . . . 1 1
629 1 . . . 1 1
630 1 . . . 1 1
631 1 . . . 1 1
632 1 . . . 1 1
633 1 . . . 1 1
634 1 . . . 1 1
635 1 . . . 1 1
636 1 . . . 1 1
637 1 . . . 1 1
638 1 . . . 1 1
639 1 . . . 1 1
640 1 . . . 1 1
641 1 . . . 1 1
642 1 . . . 1 1
643 1 . . . 1 1
644 1 . . . 1 1
645 1 . . . 1 1
646 1 . . . 1 1
647 1 . . . 1 1
648 1 . . . 1 1
649 1 . . . 1 1
650 1 . . . 1 1
651 1 . . . 1 1
652 1 . . . 1 1
653 1 . . . 1 1
654 1 . . . 1 1
655 1 . . . 1 1
656 1 . . . 1 1
657 1 . . . 1 1
658 1 . . . 1 1
659 1 . . . 1 1
660 1 . . . 1 1
661 1 . . . 1 1
662 1 . . . 1 1
663 1 . . . 1 1
664 1 . . . 1 1
665 1 . . . 1 1
666 1 . . . 1 1
667 1 . . . 1 1
668 1 . . . 1 1
669 1 . . . 1 1
670 1 . . . 1 1
671 1 . . . 1 1
672 1 . . . 1 1
673 1 . . . 1 1
674 1 . . . 1 1
675 1 . . . 1 1
676 1 . . . 1 1
677 1 . . . 1 1
678 1 . . . 1 1
679 1 . . . 1 1
680 1 . . . 1 1
681 1 . . . 1 1
682 1 . . . 1 1
683 1 . . . 1 1
684 1 . . . 1 1
685 1 . . . 1 1
686 1 . . . 1 1
687 1 . . . 1 1
688 1 . . . 1 1
689 1 . . . 1 1
690 1 . . . 1 1
691 1 . . . 1 1
692 1 . . . 1 1
693 1 . . . 1 1
694 1 . . . 1 1
695 1 . . . 1 1
696 1 . . . 1 1
697 1 . . . 1 1
698 1 . . . 1 1
699 1 . . . 1 1
700 1 . . . 1 1
701 1 . . . 1 1
702 1 . . . 1 1
703 1 . . . 1 1
704 1 . . . 1 1
705 1 . . . 1 1
706 1 . . . 1 1
707 1 . . . 1 1
708 1 . . . 1 1
709 1 . . . 1 1
710 1 . . . 1 1
711 1 . . . 1 1
712 1 . . . 1 1
713 1 . . . 1 1
714 1 . . . 1 1
715 1 . . . 1 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 1 THR HA . 557 . HA 1 1
1 1 2 1 1 1 THR MG . 557 . HG2+ 1 1
2 1 1 1 1 1 THR HA . 557 . HA 1 1
2 1 2 1 1 2 GLY H . 558 . HN 1 1
3 1 1 1 1 3 SER H . 559 . HN 1 1
3 1 2 1 1 3 SER QB . 559 . HB+ 1 1
4 1 1 1 1 4 CYS HA . 560 . HA 1 1
4 1 2 1 1 4 CYS QB . 560 . HB+ 1 1
5 1 1 1 1 3 SER HA . 559 . HA 1 1
5 1 2 1 1 4 CYS H . 560 . HN 1 1
6 1 1 1 1 4 CYS H . 560 . HN 1 1
6 1 2 1 1 4 CYS QB . 560 . HB+ 1 1
7 1 1 1 1 4 CYS H . 560 . HN 1 1
7 1 2 1 1 85 CYS HB2 . 641 . HB2 1 1
8 1 1 1 1 3 SER QB . 559 . HB+ 1 1
8 1 2 1 1 4 CYS H . 560 . HN 1 1
9 1 1 1 1 4 CYS HA . 560 . HA 1 1
9 1 2 1 1 5 SER H . 561 . HN 1 1
10 1 1 1 1 4 CYS QB . 560 . HB+ 1 1
10 1 2 1 1 5 SER H . 561 . HN 1 1
11 1 1 1 1 6 VAL HA . 562 . HA 1 1
11 1 2 1 1 24 VAL HA . 580 . HA 1 1
12 1 1 1 1 6 VAL HA . 562 . HA 1 1
12 1 2 1 1 6 VAL QG . 562 . HG++ 1 1
13 1 1 1 1 5 SER HA . 561 . HA 1 1
13 1 2 1 1 6 VAL H . 562 . HN 1 1
14 1 1 1 1 6 VAL H . 562 . HN 1 1
14 1 2 1 1 6 VAL QG . 562 . HG++ 1 1
15 1 1 1 1 6 VAL QG . 562 . HG++ 1 1
15 1 2 1 1 85 CYS HB3 . 641 . HB1 1 1
16 1 1 1 1 7 SER H . 563 . HN 1 1
16 1 2 1 1 23 SER H . 579 . HN 1 1
17 1 1 1 1 7 SER H . 563 . HN 1 1
17 1 2 1 1 7 SER QB . 563 . HB+ 1 1
18 1 1 1 1 7 SER HA . 563 . HA 1 1
18 1 2 1 1 8 ALA H . 564 . HN 1 1
19 1 1 1 1 9 VAL H . 565 . HN 1 1
19 1 2 1 1 21 THR H . 577 . HN 1 1
20 1 1 1 1 9 VAL H . 565 . HN 1 1
20 1 2 1 1 20 VAL QG . 576 . HG++ 1 1
21 1 1 1 1 9 VAL HA . 565 . HA 1 1
21 1 2 1 1 9 VAL MG2 . 565 . HG2+ 1 1
22 1 1 1 1 9 VAL HA . 565 . HA 1 1
22 1 2 1 1 9 VAL MG1 . 565 . HG1+ 1 1
23 1 1 1 1 10 ARG QB . 566 . HB+ 1 1
23 1 2 1 1 10 ARG HE . 566 . HE 1 1
24 1 1 1 1 10 ARG QD . 566 . HD+ 1 1
24 1 2 1 1 10 ARG HE . 566 . HE 1 1
25 1 1 1 1 10 ARG HE . 566 . HE 1 1
25 1 2 1 1 10 ARG QG . 566 . HG+ 1 1
26 1 1 1 1 9 VAL HA . 565 . HA 1 1
26 1 2 1 1 10 ARG H . 566 . HN 1 1
27 1 1 1 1 10 ARG H . 566 . HN 1 1
27 1 2 1 1 10 ARG QB . 566 . HB+ 1 1
28 1 1 1 1 10 ARG HA . 566 . HA 1 1
28 1 2 1 1 10 ARG QB . 566 . HB+ 1 1
29 1 1 1 1 10 ARG QB . 566 . HB+ 1 1
29 1 2 1 1 10 ARG QD . 566 . HD+ 1 1
30 1 1 1 1 10 ARG HA . 566 . HA 1 1
30 1 2 1 1 10 ARG QG . 566 . HG+ 1 1
31 1 1 1 1 10 ARG HA . 566 . HA 1 1
31 1 2 1 1 11 GLY H . 567 . HN 1 1
32 1 1 1 1 12 GLU HA . 568 . HA 1 1
32 1 2 1 1 12 GLU HB3 . 568 . HB1 1 1
33 1 1 1 1 12 GLU HA . 568 . HA 1 1
33 1 2 1 1 12 GLU QG . 568 . HG+ 1 1
34 1 1 1 1 12 GLU H . 568 . HN 1 1
34 1 2 1 1 12 GLU HB2 . 568 . HB2 1 1
35 1 1 1 1 12 GLU H . 568 . HN 1 1
35 1 2 1 1 12 GLU QG . 568 . HG+ 1 1
36 1 1 1 1 11 GLY QA . 567 . HA+ 1 1
36 1 2 1 1 12 GLU H . 568 . HN 1 1
37 1 1 1 1 12 GLU H . 568 . HN 1 1
37 1 2 1 1 19 ASN HB3 . 575 . HB1 1 1
38 1 1 1 1 12 GLU HA . 568 . HA 1 1
38 1 2 1 1 13 GLU H . 569 . HN 1 1
39 1 1 1 1 13 GLU HA . 569 . HA 1 1
39 1 2 1 1 13 GLU QB . 569 . HB+ 1 1
40 1 1 1 1 14 TRP HA . 570 . HA 1 1
40 1 2 1 1 14 TRP HD1 . 570 . HD1 1 1
41 1 1 1 1 14 TRP HB3 . 570 . HB1 1 1
41 1 2 1 1 14 TRP HD1 . 570 . HD1 1 1
42 1 1 1 1 14 TRP HH2 . 570 . HH2 1 1
42 1 2 1 1 19 ASN QD . 575 . HD2+ 1 1
43 1 1 1 1 14 TRP H . 570 . HN 1 1
43 1 2 1 1 14 TRP HE3 . 570 . HE3 1 1
44 1 1 1 1 13 GLU HA . 569 . HA 1 1
44 1 2 1 1 14 TRP HE3 . 570 . HE3 1 1
45 1 1 1 1 14 TRP HE3 . 570 . HE3 1 1
45 1 2 1 1 18 PHE HA . 574 . HA 1 1
46 1 1 1 1 14 TRP HZ3 . 570 . HZ3 1 1
46 1 2 1 1 18 PHE HA . 574 . HA 1 1
47 1 1 1 1 14 TRP HZ3 . 570 . HZ3 1 1
47 1 2 1 1 71 THR MG . 627 . HG2+ 1 1
48 1 1 1 1 15 ALA H . 571 . HN 1 1
48 1 2 1 1 16 ASP H . 572 . HN 1 1
49 1 1 1 1 15 ALA H . 571 . HN 1 1
49 1 2 1 1 15 ALA MB . 571 . HB+ 1 1
50 1 1 1 1 14 TRP HB3 . 570 . HB1 1 1
50 1 2 1 1 15 ALA H . 571 . HN 1 1
51 1 1 1 1 16 ASP HA . 572 . HA 1 1
51 1 2 1 1 16 ASP QB . 572 . HB+ 1 1
52 1 1 1 1 16 ASP H . 572 . HN 1 1
52 1 2 1 1 17 ARG H . 573 . HN 1 1
53 1 1 1 1 15 ALA MB . 571 . HB+ 1 1
53 1 2 1 1 16 ASP H . 572 . HN 1 1
54 1 1 1 1 16 ASP H . 572 . HN 1 1
54 1 2 1 1 16 ASP QB . 572 . HB+ 1 1
55 1 1 1 1 17 ARG HA . 573 . HA 1 1
55 1 2 1 1 73 TYR HA . 629 . HA 1 1
56 1 1 1 1 17 ARG HA . 573 . HA 1 1
56 1 2 1 1 71 THR MG . 627 . HG2+ 1 1
57 1 1 1 1 16 ASP HA . 572 . HA 1 1
57 1 2 1 1 17 ARG H . 573 . HN 1 1
58 1 1 1 1 13 GLU HA . 569 . HA 1 1
58 1 2 1 1 18 PHE HA . 574 . HA 1 1
59 1 1 1 1 13 GLU QB . 569 . HB+ 1 1
59 1 2 1 1 18 PHE HA . 574 . HA 1 1
60 1 1 1 1 18 PHE HA . 574 . HA 1 1
60 1 2 1 1 18 PHE QB . 574 . HB+ 1 1
61 1 1 1 1 17 ARG HA . 573 . HA 1 1
61 1 2 1 1 18 PHE H . 574 . HN 1 1
62 1 1 1 1 18 PHE H . 574 . HN 1 1
62 1 2 1 1 73 TYR HA . 629 . HA 1 1
63 1 1 1 1 18 PHE H . 574 . HN 1 1
63 1 2 1 1 18 PHE QB . 574 . HB+ 1 1
64 1 1 1 1 18 PHE H . 574 . HN 1 1
64 1 2 1 1 18 PHE QD . 574 . HD+ 1 1
65 1 1 1 1 18 PHE HA . 574 . HA 1 1
65 1 2 1 1 18 PHE QD . 574 . HD+ 1 1
66 1 1 1 1 17 ARG HA . 573 . HA 1 1
66 1 2 1 1 18 PHE QD . 574 . HD+ 1 1
67 1 1 1 1 18 PHE QD . 574 . HD+ 1 1
67 1 2 1 1 20 VAL MG2 . 576 . HG2+ 1 1
68 1 1 1 1 18 PHE QE . 574 . HE+ 1 1
68 1 2 1 1 81 PRO QD . 637 . HD+ 1 1
69 1 1 1 1 18 PHE QE . 574 . HE+ 1 1
69 1 2 1 1 20 VAL MG1 . 576 . HG1+ 1 1
70 1 1 1 1 18 PHE QE . 574 . HE+ 1 1
70 1 2 1 1 20 VAL MG2 . 576 . HG2+ 1 1
71 1 1 1 1 18 PHE HZ . 574 . HZ 1 1
71 1 2 1 1 81 PRO QD . 637 . HD+ 1 1
72 1 1 1 1 19 ASN HA . 575 . HA 1 1
72 1 2 1 1 71 THR HA . 627 . HA 1 1
73 1 1 1 1 19 ASN HA . 575 . HA 1 1
73 1 2 1 1 71 THR MG . 627 . HG2+ 1 1
74 1 1 1 1 18 PHE HA . 574 . HA 1 1
74 1 2 1 1 19 ASN H . 575 . HN 1 1
75 1 1 1 1 18 PHE QB . 574 . HB+ 1 1
75 1 2 1 1 19 ASN H . 575 . HN 1 1
76 1 1 1 1 19 ASN H . 575 . HN 1 1
76 1 2 1 1 19 ASN HB3 . 575 . HB1 1 1
77 1 1 1 1 19 ASN HB3 . 575 . HB1 1 1
77 1 2 1 1 19 ASN QD . 575 . HD2+ 1 1
78 1 1 1 1 19 ASN HA . 575 . HA 1 1
78 1 2 1 1 20 VAL H . 576 . HN 1 1
79 1 1 1 1 20 VAL H . 576 . HN 1 1
79 1 2 1 1 20 VAL HB . 576 . HB 1 1
80 1 1 1 1 20 VAL H . 576 . HN 1 1
80 1 2 1 1 70 VAL H . 626 . HN 1 1
81 1 1 1 1 20 VAL H . 576 . HN 1 1
81 1 2 1 1 20 VAL MG1 . 576 . HG1+ 1 1
82 1 1 1 1 20 VAL H . 576 . HN 1 1
82 1 2 1 1 20 VAL QG . 576 . HG++ 1 1
83 1 1 1 1 10 ARG HA . 566 . HA 1 1
83 1 2 1 1 20 VAL MG1 . 576 . HG1+ 1 1
84 1 1 1 1 10 ARG HA . 566 . HA 1 1
84 1 2 1 1 20 VAL MG2 . 576 . HG2+ 1 1
85 1 1 1 1 20 VAL HA . 576 . HA 1 1
85 1 2 1 1 20 VAL MG1 . 576 . HG1+ 1 1
86 1 1 1 1 20 VAL HA . 576 . HA 1 1
86 1 2 1 1 20 VAL MG2 . 576 . HG2+ 1 1
87 1 1 1 1 21 THR H . 577 . HN 1 1
87 1 2 1 1 21 THR HB . 577 . HB 1 1
88 1 1 1 1 20 VAL HA . 576 . HA 1 1
88 1 2 1 1 21 THR H . 577 . HN 1 1
89 1 1 1 1 21 THR H . 577 . HN 1 1
89 1 2 1 1 21 THR MG . 577 . HG2+ 1 1
90 1 1 1 1 20 VAL MG1 . 576 . HG1+ 1 1
90 1 2 1 1 21 THR H . 577 . HN 1 1
91 1 1 1 1 20 VAL MG2 . 576 . HG2+ 1 1
91 1 2 1 1 21 THR H . 577 . HN 1 1
92 1 1 1 1 22 TYR HH . 578 . HH 1 1
92 1 2 1 1 72 PHE HZ . 628 . HZ 1 1
93 1 1 1 1 22 TYR HH . 578 . HH 1 1
93 1 2 1 1 81 PRO HA . 637 . HA 1 1
94 1 1 1 1 8 ALA MB . 564 . HB+ 1 1
94 1 2 1 1 22 TYR HH . 578 . HH 1 1
95 1 1 1 1 22 TYR HH . 578 . HH 1 1
95 1 2 1 1 72 PHE QE . 628 . HE+ 1 1
96 1 1 1 1 22 TYR HH . 578 . HH 1 1
96 1 2 1 1 34 LEU QD . 590 . HD++ 1 1
97 1 1 1 1 22 TYR HH . 578 . HH 1 1
97 1 2 1 1 81 PRO QD . 637 . HD+ 1 1
98 1 1 1 1 22 TYR HH . 578 . HH 1 1
98 1 2 1 1 81 PRO QG . 637 . HG+ 1 1
99 1 1 1 1 22 TYR H . 578 . HN 1 1
99 1 2 1 1 22 TYR HB2 . 578 . HB2 1 1
100 1 1 1 1 22 TYR H . 578 . HN 1 1
100 1 2 1 1 22 TYR QD . 578 . HD+ 1 1
101 1 1 1 1 21 THR MG . 577 . HG2+ 1 1
101 1 2 1 1 22 TYR H . 578 . HN 1 1
102 1 1 1 1 8 ALA HA . 564 . HA 1 1
102 1 2 1 1 22 TYR QD . 578 . HD+ 1 1
103 1 1 1 1 8 ALA MB . 564 . HB+ 1 1
103 1 2 1 1 22 TYR QD . 578 . HD+ 1 1
104 1 1 1 1 8 ALA MB . 564 . HB+ 1 1
104 1 2 1 1 22 TYR QE . 578 . HE+ 1 1
105 1 1 1 1 23 SER HA . 579 . HA 1 1
105 1 2 1 1 23 SER QB . 579 . HB+ 1 1
106 1 1 1 1 22 TYR HA . 578 . HA 1 1
106 1 2 1 1 23 SER H . 579 . HN 1 1
107 1 1 1 1 23 SER H . 579 . HN 1 1
107 1 2 1 1 23 SER QB . 579 . HB+ 1 1
108 1 1 1 1 22 TYR HB3 . 578 . HB1 1 1
108 1 2 1 1 23 SER H . 579 . HN 1 1
109 1 1 1 1 6 VAL QG . 562 . HG++ 1 1
109 1 2 1 1 23 SER H . 579 . HN 1 1
110 1 1 1 1 24 VAL H . 580 . HN 1 1
110 1 2 1 1 67 SER HA . 623 . HA 1 1
111 1 1 1 1 24 VAL H . 580 . HN 1 1
111 1 2 1 1 24 VAL HB . 580 . HB 1 1
112 1 1 1 1 24 VAL H . 580 . HN 1 1
112 1 2 1 1 24 VAL MG2 . 580 . HG2+ 1 1
113 1 1 1 1 24 VAL H . 580 . HN 1 1
113 1 2 1 1 24 VAL MG1 . 580 . HG1+ 1 1
114 1 1 1 1 23 SER HA . 579 . HA 1 1
114 1 2 1 1 24 VAL MG2 . 580 . HG2+ 1 1
115 1 1 1 1 23 SER HA . 579 . HA 1 1
115 1 2 1 1 24 VAL MG1 . 580 . HG1+ 1 1
116 1 1 1 1 6 VAL HA . 562 . HA 1 1
116 1 2 1 1 24 VAL MG1 . 580 . HG1+ 1 1
117 1 1 1 1 6 VAL HA . 562 . HA 1 1
117 1 2 1 1 24 VAL MG2 . 580 . HG2+ 1 1
118 1 1 1 1 6 VAL HB . 562 . HB 1 1
118 1 2 1 1 24 VAL MG2 . 580 . HG2+ 1 1
119 1 1 1 1 6 VAL HB . 562 . HB 1 1
119 1 2 1 1 24 VAL MG1 . 580 . HG1+ 1 1
120 1 1 1 1 24 VAL HA . 580 . HA 1 1
120 1 2 1 1 24 VAL MG1 . 580 . HG1+ 1 1
121 1 1 1 1 24 VAL HA . 580 . HA 1 1
121 1 2 1 1 24 VAL MG2 . 580 . HG2+ 1 1
122 1 1 1 1 6 VAL QG . 562 . HG++ 1 1
122 1 2 1 1 24 VAL MG2 . 580 . HG2+ 1 1
123 1 1 1 1 6 VAL QG . 562 . HG++ 1 1
123 1 2 1 1 24 VAL MG1 . 580 . HG1+ 1 1
124 1 1 1 1 5 SER H . 561 . HN 1 1
124 1 2 1 1 25 SER H . 581 . HN 1 1
125 1 1 1 1 6 VAL HA . 562 . HA 1 1
125 1 2 1 1 25 SER H . 581 . HN 1 1
126 1 1 1 1 24 VAL HA . 580 . HA 1 1
126 1 2 1 1 25 SER H . 581 . HN 1 1
127 1 1 1 1 25 SER H . 581 . HN 1 1
127 1 2 1 1 25 SER QB . 581 . HB+ 1 1
128 1 1 1 1 6 VAL QG . 562 . HG++ 1 1
128 1 2 1 1 25 SER H . 581 . HN 1 1
129 1 1 1 1 24 VAL MG2 . 580 . HG2+ 1 1
129 1 2 1 1 25 SER H . 581 . HN 1 1
130 1 1 1 1 24 VAL MG1 . 580 . HG1+ 1 1
130 1 2 1 1 25 SER H . 581 . HN 1 1
131 1 1 1 1 25 SER HA . 581 . HA 1 1
131 1 2 1 1 26 GLY H . 582 . HN 1 1
132 1 1 1 1 27 SER HA . 583 . HA 1 1
132 1 2 1 1 27 SER QB . 583 . HB+ 1 1
133 1 1 1 1 26 GLY QA . 582 . HA+ 1 1
133 1 2 1 1 27 SER H . 583 . HN 1 1
134 1 1 1 1 27 SER H . 583 . HN 1 1
134 1 2 1 1 27 SER QB . 583 . HB+ 1 1
135 1 1 1 1 24 VAL MG2 . 580 . HG2+ 1 1
135 1 2 1 1 27 SER H . 583 . HN 1 1
136 1 1 1 1 28 SER HA . 584 . HA 1 1
136 1 2 1 1 28 SER QB . 584 . HB+ 1 1
137 1 1 1 1 26 GLY H . 582 . HN 1 1
137 1 2 1 1 28 SER H . 584 . HN 1 1
138 1 1 1 1 28 SER H . 584 . HN 1 1
138 1 2 1 1 29 SER H . 585 . HN 1 1
139 1 1 1 1 29 SER HA . 585 . HA 1 1
139 1 2 1 1 30 TRP H . 586 . HN 1 1
140 1 1 1 1 29 SER QB . 585 . HB+ 1 1
140 1 2 1 1 30 TRP H . 586 . HN 1 1
141 1 1 1 1 30 TRP H . 586 . HN 1 1
141 1 2 1 1 30 TRP QB . 586 . HB+ 1 1
142 1 1 1 1 30 TRP HE1 . 586 . HE1 1 1
142 1 2 1 1 66 ASN HA . 622 . HA 1 1
143 1 1 1 1 24 VAL HB . 580 . HB 1 1
143 1 2 1 1 30 TRP HE1 . 586 . HE1 1 1
144 1 1 1 1 30 TRP HE1 . 586 . HE1 1 1
144 1 2 1 1 59 ALA MB . 615 . HB+ 1 1
145 1 1 1 1 30 TRP HE1 . 586 . HE1 1 1
145 1 2 1 1 66 ASN HB3 . 622 . HB1 1 1
146 1 1 1 1 30 TRP QB . 586 . HB+ 1 1
146 1 2 1 1 30 TRP HE3 . 586 . HE3 1 1
147 1 1 1 1 24 VAL MG1 . 580 . HG1+ 1 1
147 1 2 1 1 30 TRP HE1 . 586 . HE1 1 1
148 1 1 1 1 30 TRP HH2 . 586 . HH2 1 1
148 1 2 1 1 59 ALA MB . 615 . HB+ 1 1
149 1 1 1 1 30 TRP HZ3 . 586 . HZ3 1 1
149 1 2 1 1 59 ALA MB . 615 . HB+ 1 1
150 1 1 1 1 30 TRP HA . 586 . HA 1 1
150 1 2 1 1 31 VAL H . 587 . HN 1 1
151 1 1 1 1 31 VAL H . 587 . HN 1 1
151 1 2 1 1 31 VAL QG . 587 . HG++ 1 1
152 1 1 1 1 32 VAL HA . 588 . HA 1 1
152 1 2 1 1 32 VAL QG . 588 . HG++ 1 1
153 1 1 1 1 30 TRP HZ3 . 586 . HZ3 1 1
153 1 2 1 1 32 VAL HB . 588 . HB 1 1
154 1 1 1 1 32 VAL H . 588 . HN 1 1
154 1 2 1 1 59 ALA H . 615 . HN 1 1
155 1 1 1 1 32 VAL H . 588 . HN 1 1
155 1 2 1 1 58 THR HA . 614 . HA 1 1
156 1 1 1 1 31 VAL HA . 587 . HA 1 1
156 1 2 1 1 32 VAL H . 588 . HN 1 1
157 1 1 1 1 32 VAL H . 588 . HN 1 1
157 1 2 1 1 59 ALA MB . 615 . HB+ 1 1
158 1 1 1 1 30 TRP HE3 . 586 . HE3 1 1
158 1 2 1 1 32 VAL H . 588 . HN 1 1
159 1 1 1 1 30 TRP HZ3 . 586 . HZ3 1 1
159 1 2 1 1 32 VAL H . 588 . HN 1 1
160 1 1 1 1 30 TRP HZ3 . 586 . HZ3 1 1
160 1 2 1 1 32 VAL QG . 588 . HG++ 1 1
161 1 1 1 1 33 THR H . 589 . HN 1 1
161 1 2 1 1 33 THR HB . 589 . HB 1 1
162 1 1 1 1 33 THR H . 589 . HN 1 1
162 1 2 1 1 84 THR H . 640 . HN 1 1
163 1 1 1 1 34 LEU HA . 590 . HA 1 1
163 1 2 1 1 34 LEU QD . 590 . HD++ 1 1
164 1 1 1 1 34 LEU H . 590 . HN 1 1
164 1 2 1 1 34 LEU HG . 590 . HG 1 1
165 1 1 1 1 33 THR HA . 589 . HA 1 1
165 1 2 1 1 34 LEU H . 590 . HN 1 1
166 1 1 1 1 34 LEU H . 590 . HN 1 1
166 1 2 1 1 58 THR HA . 614 . HA 1 1
167 1 1 1 1 34 LEU H . 590 . HN 1 1
167 1 2 1 1 57 VAL H . 613 . HN 1 1
168 1 1 1 1 34 LEU H . 590 . HN 1 1
168 1 2 1 1 34 LEU QB . 590 . HB+ 1 1
169 1 1 1 1 34 LEU H . 590 . HN 1 1
169 1 2 1 1 34 LEU QD . 590 . HD++ 1 1
170 1 1 1 1 33 THR MG . 589 . HG2+ 1 1
170 1 2 1 1 34 LEU H . 590 . HN 1 1
171 1 1 1 1 35 GLY H . 591 . HN 1 1
171 1 2 1 1 83 ALA HA . 639 . HA 1 1
172 1 1 1 1 36 LEU HA . 592 . HA 1 1
172 1 2 1 1 36 LEU QD . 592 . HD++ 1 1
173 1 1 1 1 36 LEU H . 592 . HN 1 1
173 1 2 1 1 56 THR HA . 612 . HA 1 1
174 1 1 1 1 35 GLY QA . 591 . HA+ 1 1
174 1 2 1 1 36 LEU H . 592 . HN 1 1
175 1 1 1 1 36 LEU H . 592 . HN 1 1
175 1 2 1 1 36 LEU QD . 592 . HD++ 1 1
176 1 1 1 1 37 ASN H . 593 . HN 1 1
176 1 2 1 1 37 ASN HB2 . 593 . HB2 1 1
177 1 1 1 1 37 ASN H . 593 . HN 1 1
177 1 2 1 1 37 ASN QD . 593 . HD2+ 1 1
178 1 1 1 1 37 ASN QD . 593 . HD2+ 1 1
178 1 2 1 1 79 ALA MB . 635 . HB+ 1 1
179 1 1 1 1 37 ASN HB2 . 593 . HB2 1 1
179 1 2 1 1 37 ASN QD . 593 . HD2+ 1 1
180 1 1 1 1 36 LEU HA . 592 . HA 1 1
180 1 2 1 1 37 ASN QD . 593 . HD2+ 1 1
181 1 1 1 1 37 ASN HA . 593 . HA 1 1
181 1 2 1 1 38 GLY H . 594 . HN 1 1
182 1 1 1 1 39 GLY H . 595 . HN 1 1
182 1 2 1 1 40 GLN H . 596 . HN 1 1
183 1 1 1 1 39 GLY QA . 595 . HA+ 1 1
183 1 2 1 1 40 GLN H . 596 . HN 1 1
184 1 1 1 1 40 GLN H . 596 . HN 1 1
184 1 2 1 1 40 GLN HB2 . 596 . HB2 1 1
185 1 1 1 1 40 GLN H . 596 . HN 1 1
185 1 2 1 1 40 GLN QG . 596 . HG+ 1 1
186 1 1 1 1 40 GLN HA . 596 . HA 1 1
186 1 2 1 1 40 GLN QE . 596 . HE2+ 1 1
187 1 1 1 1 40 GLN QE . 596 . HE2+ 1 1
187 1 2 1 1 40 GLN QG . 596 . HG+ 1 1
188 1 1 1 1 41 SER HA . 597 . HA 1 1
188 1 2 1 1 54 SER HA . 610 . HA 1 1
189 1 1 1 1 41 SER HA . 597 . HA 1 1
189 1 2 1 1 41 SER QB . 597 . HB+ 1 1
190 1 1 1 1 41 SER H . 597 . HN 1 1
190 1 2 1 1 41 SER QB . 597 . HB+ 1 1
191 1 1 1 1 41 SER H . 597 . HN 1 1
191 1 2 1 1 73 TYR HB2 . 629 . HB2 1 1
192 1 1 1 1 40 GLN HA . 596 . HA 1 1
192 1 2 1 1 41 SER H . 597 . HN 1 1
193 1 1 1 1 41 SER HA . 597 . HA 1 1
193 1 2 1 1 42 VAL H . 598 . HN 1 1
194 1 1 1 1 42 VAL H . 598 . HN 1 1
194 1 2 1 1 42 VAL HB . 598 . HB 1 1
195 1 1 1 1 41 SER QB . 597 . HB+ 1 1
195 1 2 1 1 42 VAL H . 598 . HN 1 1
196 1 1 1 1 42 VAL H . 598 . HN 1 1
196 1 2 1 1 42 VAL MG1 . 598 . HG1+ 1 1
197 1 1 1 1 42 VAL H . 598 . HN 1 1
197 1 2 1 1 42 VAL MG2 . 598 . HG2+ 1 1
198 1 1 1 1 42 VAL HA . 598 . HA 1 1
198 1 2 1 1 42 VAL MG1 . 598 . HG1+ 1 1
199 1 1 1 1 42 VAL HA . 598 . HA 1 1
199 1 2 1 1 42 VAL MG2 . 598 . HG2+ 1 1
200 1 1 1 1 43 GLN HA . 599 . HA 1 1
200 1 2 1 1 43 GLN QG . 599 . HG+ 1 1
201 1 1 1 1 43 GLN H . 599 . HN 1 1
201 1 2 1 1 72 PHE HA . 628 . HA 1 1
202 1 1 1 1 43 GLN H . 599 . HN 1 1
202 1 2 1 1 44 SER H . 600 . HN 1 1
203 1 1 1 1 42 VAL HA . 598 . HA 1 1
203 1 2 1 1 43 GLN H . 599 . HN 1 1
204 1 1 1 1 43 GLN H . 599 . HN 1 1
204 1 2 1 1 43 GLN HB3 . 599 . HB1 1 1
205 1 1 1 1 42 VAL MG1 . 598 . HG1+ 1 1
205 1 2 1 1 43 GLN H . 599 . HN 1 1
206 1 1 1 1 43 GLN H . 599 . HN 1 1
206 1 2 1 1 70 VAL QG . 626 . HG++ 1 1
207 1 1 1 1 43 GLN QE . 599 . HE2+ 1 1
207 1 2 1 1 43 GLN QG . 599 . HG+ 1 1
208 1 1 1 1 43 GLN HA . 599 . HA 1 1
208 1 2 1 1 44 SER H . 600 . HN 1 1
209 1 1 1 1 43 GLN HB3 . 599 . HB1 1 1
209 1 2 1 1 44 SER H . 600 . HN 1 1
210 1 1 1 1 44 SER H . 600 . HN 1 1
210 1 2 1 1 44 SER QB . 600 . HB+ 1 1
211 1 1 1 1 44 SER HA . 600 . HA 1 1
211 1 2 1 1 45 SER H . 601 . HN 1 1
212 1 1 1 1 44 SER QB . 600 . HB+ 1 1
212 1 2 1 1 45 SER H . 601 . HN 1 1
213 1 1 1 1 46 TRP HB2 . 602 . HB2 1 1
213 1 2 1 1 46 TRP HD1 . 602 . HD1 1 1
214 1 1 1 1 46 TRP HD1 . 602 . HD1 1 1
214 1 2 1 1 47 ASN QB . 603 . HB+ 1 1
215 1 1 1 1 46 TRP H . 602 . HN 1 1
215 1 2 1 1 69 GLY H . 625 . HN 1 1
216 1 1 1 1 45 SER HA . 601 . HA 1 1
216 1 2 1 1 46 TRP H . 602 . HN 1 1
217 1 1 1 1 45 SER QB . 601 . HB+ 1 1
217 1 2 1 1 46 TRP H . 602 . HN 1 1
218 1 1 1 1 46 TRP H . 602 . HN 1 1
218 1 2 1 1 46 TRP HE3 . 602 . HE3 1 1
219 1 1 1 1 46 TRP HE1 . 602 . HE1 1 1
219 1 2 1 1 69 GLY QA . 625 . HA+ 1 1
220 1 1 1 1 46 TRP HZ2 . 602 . HZ2 1 1
220 1 2 1 1 69 GLY QA . 625 . HA+ 1 1
221 1 1 1 1 47 ASN H . 603 . HN 1 1
221 1 2 1 1 48 ALA H . 604 . HN 1 1
222 1 1 1 1 47 ASN H . 603 . HN 1 1
222 1 2 1 1 47 ASN HA . 603 . HA 1 1
223 1 1 1 1 47 ASN HA . 603 . HA 1 1
223 1 2 1 1 48 ALA H . 604 . HN 1 1
224 1 1 1 1 48 ALA H . 604 . HN 1 1
224 1 2 1 1 48 ALA MB . 604 . HB+ 1 1
225 1 1 1 1 48 ALA HA . 604 . HA 1 1
225 1 2 1 1 49 ALA H . 605 . HN 1 1
226 1 1 1 1 49 ALA H . 605 . HN 1 1
226 1 2 1 1 60 ARG H . 616 . HN 1 1
227 1 1 1 1 48 ALA MB . 604 . HB+ 1 1
227 1 2 1 1 49 ALA H . 605 . HN 1 1
228 1 1 1 1 49 ALA H . 605 . HN 1 1
228 1 2 1 1 49 ALA MB . 605 . HB+ 1 1
229 1 1 1 1 50 LEU HA . 606 . HA 1 1
229 1 2 1 1 59 ALA HA . 615 . HA 1 1
230 1 1 1 1 50 LEU HA . 606 . HA 1 1
230 1 2 1 1 50 LEU QD . 606 . HD++ 1 1
231 1 1 1 1 50 LEU H . 606 . HN 1 1
231 1 2 1 1 50 LEU QD . 606 . HD++ 1 1
232 1 1 1 1 51 THR H . 607 . HN 1 1
232 1 2 1 1 59 ALA HA . 615 . HA 1 1
233 1 1 1 1 50 LEU HA . 606 . HA 1 1
233 1 2 1 1 51 THR H . 607 . HN 1 1
234 1 1 1 1 51 THR H . 607 . HN 1 1
234 1 2 1 1 58 THR H . 614 . HN 1 1
235 1 1 1 1 51 THR H . 607 . HN 1 1
235 1 2 1 1 51 THR HB . 607 . HB 1 1
236 1 1 1 1 51 THR H . 607 . HN 1 1
236 1 2 1 1 51 THR MG . 607 . HG2+ 1 1
237 1 1 1 1 51 THR H . 607 . HN 1 1
237 1 2 1 1 57 VAL MG1 . 613 . HG1+ 1 1
238 1 1 1 1 51 THR HA . 607 . HA 1 1
238 1 2 1 1 51 THR MG . 607 . HG2+ 1 1
239 1 1 1 1 51 THR HA . 607 . HA 1 1
239 1 2 1 1 52 GLY H . 608 . HN 1 1
240 1 1 1 1 51 THR MG . 607 . HG2+ 1 1
240 1 2 1 1 52 GLY H . 608 . HN 1 1
241 1 1 1 1 53 SER H . 609 . HN 1 1
241 1 2 1 1 54 SER H . 610 . HN 1 1
242 1 1 1 1 53 SER QB . 609 . HB+ 1 1
242 1 2 1 1 54 SER H . 610 . HN 1 1
243 1 1 1 1 54 SER H . 610 . HN 1 1
243 1 2 1 1 54 SER QB . 610 . HB+ 1 1
244 1 1 1 1 54 SER HA . 610 . HA 1 1
244 1 2 1 1 55 GLY H . 611 . HN 1 1
245 1 1 1 1 55 GLY H . 611 . HN 1 1
245 1 2 1 1 55 GLY QA . 611 . HA+ 1 1
246 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
246 1 2 1 1 55 GLY H . 611 . HN 1 1
247 1 1 1 1 56 THR H . 612 . HN 1 1
247 1 2 1 1 56 THR HB . 612 . HB 1 1
248 1 1 1 1 55 GLY QA . 611 . HA+ 1 1
248 1 2 1 1 56 THR H . 612 . HN 1 1
249 1 1 1 1 56 THR H . 612 . HN 1 1
249 1 2 1 1 56 THR MG . 612 . HG2+ 1 1
250 1 1 1 1 56 THR HA . 612 . HA 1 1
250 1 2 1 1 56 THR MG . 612 . HG2+ 1 1
251 1 1 1 1 56 THR HA . 612 . HA 1 1
251 1 2 1 1 57 VAL H . 613 . HN 1 1
252 1 1 1 1 57 VAL H . 613 . HN 1 1
252 1 2 1 1 57 VAL HB . 613 . HB 1 1
253 1 1 1 1 57 VAL HA . 613 . HA 1 1
253 1 2 1 1 57 VAL MG1 . 613 . HG1+ 1 1
254 1 1 1 1 33 THR HA . 589 . HA 1 1
254 1 2 1 1 58 THR HA . 614 . HA 1 1
255 1 1 1 1 58 THR HA . 614 . HA 1 1
255 1 2 1 1 58 THR MG . 614 . HG2+ 1 1
256 1 1 1 1 57 VAL MG1 . 613 . HG1+ 1 1
256 1 2 1 1 58 THR HA . 614 . HA 1 1
257 1 1 1 1 57 VAL HA . 613 . HA 1 1
257 1 2 1 1 58 THR H . 614 . HN 1 1
258 1 1 1 1 58 THR H . 614 . HN 1 1
258 1 2 1 1 58 THR MG . 614 . HG2+ 1 1
259 1 1 1 1 57 VAL MG2 . 613 . HG2+ 1 1
259 1 2 1 1 58 THR H . 614 . HN 1 1
260 1 1 1 1 57 VAL MG1 . 613 . HG1+ 1 1
260 1 2 1 1 58 THR H . 614 . HN 1 1
261 1 1 1 1 58 THR HA . 614 . HA 1 1
261 1 2 1 1 59 ALA H . 615 . HN 1 1
262 1 1 1 1 58 THR HB . 614 . HB 1 1
262 1 2 1 1 59 ALA H . 615 . HN 1 1
263 1 1 1 1 59 ALA H . 615 . HN 1 1
263 1 2 1 1 59 ALA MB . 615 . HB+ 1 1
264 1 1 1 1 58 THR MG . 614 . HG2+ 1 1
264 1 2 1 1 59 ALA H . 615 . HN 1 1
265 1 1 1 1 59 ALA HA . 615 . HA 1 1
265 1 2 1 1 60 ARG H . 616 . HN 1 1
266 1 1 1 1 50 LEU HA . 606 . HA 1 1
266 1 2 1 1 60 ARG H . 616 . HN 1 1
267 1 1 1 1 59 ALA MB . 615 . HB+ 1 1
267 1 2 1 1 60 ARG H . 616 . HN 1 1
268 1 1 1 1 60 ARG H . 616 . HN 1 1
268 1 2 1 1 60 ARG QB . 616 . HB+ 1 1
269 1 1 1 1 60 ARG H . 616 . HN 1 1
269 1 2 1 1 60 ARG QG . 616 . HG+ 1 1
270 1 1 1 1 60 ARG HA . 616 . HA 1 1
270 1 2 1 1 60 ARG QG . 616 . HG+ 1 1
271 1 1 1 1 60 ARG HA . 616 . HA 1 1
271 1 2 1 1 61 PRO QD . 617 . HD+ 1 1
272 1 1 1 1 62 ASN H . 618 . HN 1 1
272 1 2 1 1 63 GLY H . 619 . HN 1 1
273 1 1 1 1 61 PRO HA . 617 . HA 1 1
273 1 2 1 1 62 ASN H . 618 . HN 1 1
274 1 1 1 1 62 ASN H . 618 . HN 1 1
274 1 2 1 1 64 SER H . 620 . HN 1 1
275 1 1 1 1 62 ASN H . 618 . HN 1 1
275 1 2 1 1 62 ASN QB . 618 . HB+ 1 1
276 1 1 1 1 62 ASN HA . 618 . HA 1 1
276 1 2 1 1 62 ASN QB . 618 . HB+ 1 1
277 1 1 1 1 62 ASN QB . 618 . HB+ 1 1
277 1 2 1 1 62 ASN QD . 618 . HD2+ 1 1
278 1 1 1 1 62 ASN HA . 618 . HA 1 1
278 1 2 1 1 63 GLY H . 619 . HN 1 1
279 1 1 1 1 63 GLY H . 619 . HN 1 1
279 1 2 1 1 64 SER H . 620 . HN 1 1
280 1 1 1 1 64 SER H . 620 . HN 1 1
280 1 2 1 1 65 GLY H . 621 . HN 1 1
281 1 1 1 1 66 ASN H . 622 . HN 1 1
281 1 2 1 1 67 SER H . 623 . HN 1 1
282 1 1 1 1 66 ASN H . 622 . HN 1 1
282 1 2 1 1 66 ASN QB . 622 . HB+ 1 1
283 1 1 1 1 66 ASN HA . 622 . HA 1 1
283 1 2 1 1 66 ASN QB . 622 . HB+ 1 1
284 1 1 1 1 66 ASN QB . 622 . HB+ 1 1
284 1 2 1 1 66 ASN QD . 622 . HD2+ 1 1
285 1 1 1 1 24 VAL MG2 . 580 . HG2+ 1 1
285 1 2 1 1 66 ASN QD . 622 . HD2+ 1 1
286 1 1 1 1 24 VAL MG1 . 580 . HG1+ 1 1
286 1 2 1 1 66 ASN QD . 622 . HD2+ 1 1
287 1 1 1 1 23 SER HA . 579 . HA 1 1
287 1 2 1 1 67 SER HA . 623 . HA 1 1
288 1 1 1 1 67 SER HA . 623 . HA 1 1
288 1 2 1 1 67 SER QB . 623 . HB+ 1 1
289 1 1 1 1 66 ASN HA . 622 . HA 1 1
289 1 2 1 1 67 SER H . 623 . HN 1 1
290 1 1 1 1 67 SER H . 623 . HN 1 1
290 1 2 1 1 68 PHE QD . 624 . HD+ 1 1
291 1 1 1 1 67 SER H . 623 . HN 1 1
291 1 2 1 1 67 SER QB . 623 . HB+ 1 1
292 1 1 1 1 68 PHE HA . 624 . HA 1 1
292 1 2 1 1 68 PHE QB . 624 . HB+ 1 1
293 1 1 1 1 23 SER HA . 579 . HA 1 1
293 1 2 1 1 68 PHE H . 624 . HN 1 1
294 1 1 1 1 67 SER HA . 623 . HA 1 1
294 1 2 1 1 68 PHE H . 624 . HN 1 1
295 1 1 1 1 68 PHE H . 624 . HN 1 1
295 1 2 1 1 68 PHE QB . 624 . HB+ 1 1
296 1 1 1 1 68 PHE H . 624 . HN 1 1
296 1 2 1 1 68 PHE QD . 624 . HD+ 1 1
297 1 1 1 1 68 PHE HA . 624 . HA 1 1
297 1 2 1 1 68 PHE QD . 624 . HD+ 1 1
298 1 1 1 1 24 VAL MG2 . 580 . HG2+ 1 1
298 1 2 1 1 68 PHE QD . 624 . HD+ 1 1
299 1 1 1 1 30 TRP HH2 . 586 . HH2 1 1
299 1 2 1 1 68 PHE QD . 624 . HD+ 1 1
300 1 1 1 1 68 PHE HA . 624 . HA 1 1
300 1 2 1 1 69 GLY H . 625 . HN 1 1
301 1 1 1 1 68 PHE QB . 624 . HB+ 1 1
301 1 2 1 1 69 GLY H . 625 . HN 1 1
302 1 1 1 1 70 VAL HA . 626 . HA 1 1
302 1 2 1 1 70 VAL QG . 626 . HG++ 1 1
303 1 1 1 1 21 THR HA . 577 . HA 1 1
303 1 2 1 1 70 VAL H . 626 . HN 1 1
304 1 1 1 1 70 VAL H . 626 . HN 1 1
304 1 2 1 1 70 VAL HB . 626 . HB 1 1
305 1 1 1 1 69 GLY QA . 625 . HA+ 1 1
305 1 2 1 1 70 VAL H . 626 . HN 1 1
306 1 1 1 1 70 VAL H . 626 . HN 1 1
306 1 2 1 1 70 VAL QG . 626 . HG++ 1 1
307 1 1 1 1 42 VAL HA . 598 . HA 1 1
307 1 2 1 1 70 VAL QG . 626 . HG++ 1 1
308 1 1 1 1 42 VAL MG2 . 598 . HG2+ 1 1
308 1 2 1 1 70 VAL QG . 626 . HG++ 1 1
309 1 1 1 1 42 VAL MG1 . 598 . HG1+ 1 1
309 1 2 1 1 70 VAL QG . 626 . HG++ 1 1
310 1 1 1 1 44 SER H . 600 . HN 1 1
310 1 2 1 1 71 THR H . 627 . HN 1 1
311 1 1 1 1 70 VAL HA . 626 . HA 1 1
311 1 2 1 1 71 THR H . 627 . HN 1 1
312 1 1 1 1 71 THR H . 627 . HN 1 1
312 1 2 1 1 71 THR MG . 627 . HG2+ 1 1
313 1 1 1 1 70 VAL QG . 626 . HG++ 1 1
313 1 2 1 1 71 THR H . 627 . HN 1 1
314 1 1 1 1 71 THR HG1 . 627 . HG1 1 1
314 1 2 1 1 71 THR MG . 627 . HG2+ 1 1
315 1 1 1 1 71 THR HA . 627 . HA 1 1
315 1 2 1 1 71 THR MG . 627 . HG2+ 1 1
316 1 1 1 1 17 ARG QD . 573 . HD+ 1 1
316 1 2 1 1 71 THR MG . 627 . HG2+ 1 1
317 1 1 1 1 18 PHE H . 574 . HN 1 1
317 1 2 1 1 72 PHE H . 628 . HN 1 1
318 1 1 1 1 19 ASN HA . 575 . HA 1 1
318 1 2 1 1 72 PHE H . 628 . HN 1 1
319 1 1 1 1 71 THR HA . 627 . HA 1 1
319 1 2 1 1 72 PHE H . 628 . HN 1 1
320 1 1 1 1 72 PHE H . 628 . HN 1 1
320 1 2 1 1 72 PHE HB2 . 628 . HB2 1 1
321 1 1 1 1 72 PHE H . 628 . HN 1 1
321 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
322 1 1 1 1 22 TYR QE . 578 . HE+ 1 1
322 1 2 1 1 72 PHE HZ . 628 . HZ 1 1
323 1 1 1 1 34 LEU QD . 590 . HD++ 1 1
323 1 2 1 1 72 PHE HZ . 628 . HZ 1 1
324 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
324 1 2 1 1 72 PHE HZ . 628 . HZ 1 1
325 1 1 1 1 20 VAL MG2 . 576 . HG2+ 1 1
325 1 2 1 1 72 PHE HZ . 628 . HZ 1 1
326 1 1 1 1 42 VAL MG2 . 598 . HG2+ 1 1
326 1 2 1 1 72 PHE HZ . 628 . HZ 1 1
327 1 1 1 1 72 PHE HA . 628 . HA 1 1
327 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
328 1 1 1 1 72 PHE HB3 . 628 . HB1 1 1
328 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
329 1 1 1 1 72 PHE HB2 . 628 . HB2 1 1
329 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
330 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
330 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
331 1 1 1 1 20 VAL MG2 . 576 . HG2+ 1 1
331 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
332 1 1 1 1 42 VAL MG2 . 598 . HG2+ 1 1
332 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
333 1 1 1 1 22 TYR QE . 578 . HE+ 1 1
333 1 2 1 1 72 PHE QE . 628 . HE+ 1 1
334 1 1 1 1 34 LEU QD . 590 . HD++ 1 1
334 1 2 1 1 72 PHE QE . 628 . HE+ 1 1
335 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
335 1 2 1 1 72 PHE QE . 628 . HE+ 1 1
336 1 1 1 1 20 VAL MG2 . 576 . HG2+ 1 1
336 1 2 1 1 72 PHE QE . 628 . HE+ 1 1
337 1 1 1 1 42 VAL MG2 . 598 . HG2+ 1 1
337 1 2 1 1 72 PHE QE . 628 . HE+ 1 1
338 1 1 1 1 72 PHE HA . 628 . HA 1 1
338 1 2 1 1 73 TYR H . 629 . HN 1 1
339 1 1 1 1 41 SER H . 597 . HN 1 1
339 1 2 1 1 73 TYR H . 629 . HN 1 1
340 1 1 1 1 42 VAL HA . 598 . HA 1 1
340 1 2 1 1 73 TYR H . 629 . HN 1 1
341 1 1 1 1 72 PHE HB3 . 628 . HB1 1 1
341 1 2 1 1 73 TYR H . 629 . HN 1 1
342 1 1 1 1 72 PHE QD . 628 . HD+ 1 1
342 1 2 1 1 73 TYR H . 629 . HN 1 1
343 1 1 1 1 73 TYR H . 629 . HN 1 1
343 1 2 1 1 73 TYR HB2 . 629 . HB2 1 1
344 1 1 1 1 73 TYR H . 629 . HN 1 1
344 1 2 1 1 73 TYR QD . 629 . HD+ 1 1
345 1 1 1 1 43 GLN HA . 599 . HA 1 1
345 1 2 1 1 73 TYR QD . 629 . HD+ 1 1
346 1 1 1 1 43 GLN HB2 . 599 . HB2 1 1
346 1 2 1 1 73 TYR QD . 629 . HD+ 1 1
347 1 1 1 1 43 GLN QG . 599 . HG+ 1 1
347 1 2 1 1 73 TYR QD . 629 . HD+ 1 1
348 1 1 1 1 73 TYR HB2 . 629 . HB2 1 1
348 1 2 1 1 73 TYR QD . 629 . HD+ 1 1
349 1 1 1 1 43 GLN HA . 599 . HA 1 1
349 1 2 1 1 73 TYR QE . 629 . HE+ 1 1
350 1 1 1 1 43 GLN QG . 599 . HG+ 1 1
350 1 2 1 1 73 TYR QE . 629 . HE+ 1 1
351 1 1 1 1 17 ARG HA . 573 . HA 1 1
351 1 2 1 1 74 LYS H . 630 . HN 1 1
352 1 1 1 1 73 TYR HA . 629 . HA 1 1
352 1 2 1 1 74 LYS H . 630 . HN 1 1
353 1 1 1 1 73 TYR HB3 . 629 . HB1 1 1
353 1 2 1 1 74 LYS H . 630 . HN 1 1
354 1 1 1 1 75 ASN HA . 631 . HA 1 1
354 1 2 1 1 75 ASN QB . 631 . HB+ 1 1
355 1 1 1 1 75 ASN H . 631 . HN 1 1
355 1 2 1 1 76 GLY H . 632 . HN 1 1
356 1 1 1 1 74 LYS HA . 630 . HA 1 1
356 1 2 1 1 75 ASN H . 631 . HN 1 1
357 1 1 1 1 74 LYS H . 630 . HN 1 1
357 1 2 1 1 75 ASN H . 631 . HN 1 1
358 1 1 1 1 75 ASN H . 631 . HN 1 1
358 1 2 1 1 75 ASN HA . 631 . HA 1 1
359 1 1 1 1 75 ASN H . 631 . HN 1 1
359 1 2 1 1 75 ASN QB . 631 . HB+ 1 1
360 1 1 1 1 75 ASN HA . 631 . HA 1 1
360 1 2 1 1 76 GLY H . 632 . HN 1 1
361 1 1 1 1 76 GLY H . 632 . HN 1 1
361 1 2 1 1 77 SER H . 633 . HN 1 1
362 1 1 1 1 76 GLY H . 632 . HN 1 1
362 1 2 1 1 76 GLY QA . 632 . HA+ 1 1
363 1 1 1 1 77 SER H . 633 . HN 1 1
363 1 2 1 1 77 SER QB . 633 . HB+ 1 1
364 1 1 1 1 78 SER H . 634 . HN 1 1
364 1 2 1 1 79 ALA H . 635 . HN 1 1
365 1 1 1 1 77 SER HA . 633 . HA 1 1
365 1 2 1 1 78 SER H . 634 . HN 1 1
366 1 1 1 1 78 SER HA . 634 . HA 1 1
366 1 2 1 1 78 SER QB . 634 . HB+ 1 1
367 1 1 1 1 78 SER HA . 634 . HA 1 1
367 1 2 1 1 79 ALA H . 635 . HN 1 1
368 1 1 1 1 79 ALA H . 635 . HN 1 1
368 1 2 1 1 79 ALA MB . 635 . HB+ 1 1
369 1 1 1 1 79 ALA HA . 635 . HA 1 1
369 1 2 1 1 80 THR H . 636 . HN 1 1
370 1 1 1 1 79 ALA MB . 635 . HB+ 1 1
370 1 2 1 1 80 THR H . 636 . HN 1 1
371 1 1 1 1 80 THR H . 636 . HN 1 1
371 1 2 1 1 80 THR MG . 636 . HG2+ 1 1
372 1 1 1 1 80 THR HA . 636 . HA 1 1
372 1 2 1 1 81 PRO QD . 637 . HD+ 1 1
373 1 1 1 1 81 PRO QD . 637 . HD+ 1 1
373 1 2 1 1 81 PRO QG . 637 . HG+ 1 1
374 1 1 1 1 81 PRO HA . 637 . HA 1 1
374 1 2 1 1 82 GLY H . 638 . HN 1 1
375 1 1 1 1 82 GLY H . 638 . HN 1 1
375 1 2 1 1 82 GLY QA . 638 . HA+ 1 1
376 1 1 1 1 34 LEU HA . 590 . HA 1 1
376 1 2 1 1 83 ALA HA . 639 . HA 1 1
377 1 1 1 1 34 LEU QD . 590 . HD++ 1 1
377 1 2 1 1 83 ALA HA . 639 . HA 1 1
378 1 1 1 1 83 ALA H . 639 . HN 1 1
378 1 2 1 1 83 ALA MB . 639 . HB+ 1 1
379 1 1 1 1 82 GLY QA . 638 . HA+ 1 1
379 1 2 1 1 83 ALA H . 639 . HN 1 1
380 1 1 1 1 84 THR HA . 640 . HA 1 1
380 1 2 1 1 84 THR HB . 640 . HB 1 1
381 1 1 1 1 83 ALA HA . 639 . HA 1 1
381 1 2 1 1 84 THR H . 640 . HN 1 1
382 1 1 1 1 84 THR H . 640 . HN 1 1
382 1 2 1 1 84 THR MG . 640 . HG2+ 1 1
383 1 1 1 1 84 THR HA . 640 . HA 1 1
383 1 2 1 1 84 THR MG . 640 . HG2+ 1 1
384 1 1 1 1 84 THR HA . 640 . HA 1 1
384 1 2 1 1 85 CYS H . 641 . HN 1 1
385 1 1 1 1 84 THR HB . 640 . HB 1 1
385 1 2 1 1 85 CYS H . 641 . HN 1 1
386 1 1 1 1 85 CYS H . 641 . HN 1 1
386 1 2 1 1 85 CYS HB2 . 641 . HB2 1 1
387 1 1 1 1 85 CYS HA . 641 . HA 1 1
387 1 2 1 1 86 ALA H . 642 . HN 1 1
388 1 1 1 1 86 ALA H . 642 . HN 1 1
388 1 2 1 1 86 ALA MB . 642 . HB+ 1 1
389 1 1 1 1 86 ALA HA . 642 . HA 1 1
389 1 2 1 1 87 THR H . 643 . HN 1 1
390 1 1 1 1 87 THR H . 643 . HN 1 1
390 1 2 1 1 88 GLY H . 644 . HN 1 1
391 1 1 1 1 86 ALA MB . 642 . HB+ 1 1
391 1 2 1 1 87 THR H . 643 . HN 1 1
392 1 1 1 1 87 THR H . 643 . HN 1 1
392 1 2 1 1 87 THR MG . 643 . HG2+ 1 1
393 1 1 1 1 87 THR HA . 643 . HA 1 1
393 1 2 1 1 87 THR MG . 643 . HG2+ 1 1
394 1 1 1 1 87 THR HA . 643 . HA 1 1
394 1 2 1 1 88 GLY H . 644 . HN 1 1
395 1 1 1 1 88 GLY H . 644 . HN 1 1
395 1 2 1 1 88 GLY QA . 644 . HA+ 1 1
396 1 1 1 1 5 SER H . 561 . HN 1 1
396 1 2 1 1 5 SER QB . 561 . HB+ 1 1
397 1 1 1 1 5 SER QB . 561 . HB+ 1 1
397 1 2 1 1 6 VAL H . 562 . HN 1 1
398 1 1 1 1 8 ALA H . 564 . HN 1 1
398 1 2 1 1 8 ALA MB . 564 . HB+ 1 1
399 1 1 1 1 8 ALA HA . 564 . HA 1 1
399 1 2 1 1 9 VAL H . 565 . HN 1 1
400 1 1 1 1 8 ALA MB . 564 . HB+ 1 1
400 1 2 1 1 9 VAL H . 565 . HN 1 1
401 1 1 1 1 33 THR H . 589 . HN 1 1
401 1 2 1 1 33 THR MG . 589 . HG2+ 1 1
402 1 1 1 1 33 THR HA . 589 . HA 1 1
402 1 2 1 1 59 ALA H . 615 . HN 1 1
403 1 1 1 1 49 ALA HA . 605 . HA 1 1
403 1 2 1 1 50 LEU H . 606 . HN 1 1
404 1 1 1 1 65 GLY QA . 621 . HA+ 1 1
404 1 2 1 1 66 ASN H . 622 . HN 1 1
405 1 1 1 1 86 ALA H . 642 . HN 1 1
405 1 2 1 1 87 THR H . 643 . HN 1 1
406 1 1 1 1 85 CYS H . 641 . HN 1 1
406 1 2 1 1 86 ALA H . 642 . HN 1 1
407 1 1 1 1 85 CYS HB3 . 641 . HB1 1 1
407 1 2 1 1 86 ALA H . 642 . HN 1 1
408 1 1 1 1 85 CYS HB2 . 641 . HB2 1 1
408 1 2 1 1 86 ALA H . 642 . HN 1 1
409 1 1 1 1 32 VAL H . 588 . HN 1 1
409 1 2 1 1 32 VAL HB . 588 . HB 1 1
410 1 1 1 1 32 VAL H . 588 . HN 1 1
410 1 2 1 1 32 VAL QG . 588 . HG++ 1 1
411 1 1 1 1 42 VAL HB . 598 . HB 1 1
411 1 2 1 1 43 GLN H . 599 . HN 1 1
412 1 1 1 1 43 GLN H . 599 . HN 1 1
412 1 2 1 1 43 GLN QG . 599 . HG+ 1 1
413 1 1 1 1 10 ARG H . 566 . HN 1 1
413 1 2 1 1 10 ARG QD . 566 . HD+ 1 1
414 1 1 1 1 9 VAL MG1 . 565 . HG1+ 1 1
414 1 2 1 1 10 ARG H . 566 . HN 1 1
415 1 1 1 1 10 ARG H . 566 . HN 1 1
415 1 2 1 1 20 VAL MG1 . 576 . HG1+ 1 1
416 1 1 1 1 30 TRP HE1 . 586 . HE1 1 1
416 1 2 1 1 61 PRO QB . 617 . HB+ 1 1
417 1 1 1 1 50 LEU H . 606 . HN 1 1
417 1 2 1 1 51 THR H . 607 . HN 1 1
418 1 1 1 1 49 ALA MB . 605 . HB+ 1 1
418 1 2 1 1 50 LEU H . 606 . HN 1 1
419 1 1 1 1 23 SER H . 579 . HN 1 1
419 1 2 1 1 24 VAL H . 580 . HN 1 1
420 1 1 1 1 23 SER HA . 579 . HA 1 1
420 1 2 1 1 24 VAL H . 580 . HN 1 1
421 1 1 1 1 23 SER HB2 . 579 . HB2 1 1
421 1 2 1 1 24 VAL H . 580 . HN 1 1
422 1 1 1 1 46 TRP HE1 . 602 . HE1 1 1
422 1 2 1 1 69 GLY H . 625 . HN 1 1
423 1 1 1 1 46 TRP HE1 . 602 . HE1 1 1
423 1 2 1 1 47 ASN QB . 603 . HB+ 1 1
424 1 1 1 1 57 VAL H . 613 . HN 1 1
424 1 2 1 1 58 THR H . 614 . HN 1 1
425 1 1 1 1 56 THR HB . 612 . HB 1 1
425 1 2 1 1 57 VAL H . 613 . HN 1 1
426 1 1 1 1 34 LEU HG . 590 . HG 1 1
426 1 2 1 1 57 VAL H . 613 . HN 1 1
427 1 1 1 1 34 LEU HB3 . 590 . HB1 1 1
427 1 2 1 1 57 VAL H . 613 . HN 1 1
428 1 1 1 1 22 TYR H . 578 . HN 1 1
428 1 2 1 1 22 TYR QE . 578 . HE+ 1 1
429 1 1 1 1 21 THR HA . 577 . HA 1 1
429 1 2 1 1 22 TYR H . 578 . HN 1 1
430 1 1 1 1 34 LEU H . 590 . HN 1 1
430 1 2 1 1 58 THR H . 614 . HN 1 1
431 1 1 1 1 34 LEU H . 590 . HN 1 1
431 1 2 1 1 56 THR HA . 612 . HA 1 1
432 1 1 1 1 34 LEU H . 590 . HN 1 1
432 1 2 1 1 35 GLY QA . 591 . HA+ 1 1
433 1 1 1 1 58 THR H . 614 . HN 1 1
433 1 2 1 1 59 ALA H . 615 . HN 1 1
434 1 1 1 1 36 LEU H . 592 . HN 1 1
434 1 2 1 1 37 ASN H . 593 . HN 1 1
435 1 1 1 1 36 LEU H . 592 . HN 1 1
435 1 2 1 1 36 LEU HB3 . 592 . HB1 1 1
436 1 1 1 1 36 LEU H . 592 . HN 1 1
436 1 2 1 1 57 VAL MG2 . 613 . HG2+ 1 1
437 1 1 1 1 7 SER QB . 563 . HB+ 1 1
437 1 2 1 1 8 ALA H . 564 . HN 1 1
438 1 1 1 1 8 ALA H . 564 . HN 1 1
438 1 2 1 1 9 VAL MG2 . 565 . HG2+ 1 1
439 1 1 1 1 14 TRP H . 570 . HN 1 1
439 1 2 1 1 17 ARG H . 573 . HN 1 1
440 1 1 1 1 14 TRP H . 570 . HN 1 1
440 1 2 1 1 18 PHE HA . 574 . HA 1 1
441 1 1 1 1 14 TRP H . 570 . HN 1 1
441 1 2 1 1 18 PHE QB . 574 . HB+ 1 1
442 1 1 1 1 13 GLU QB . 569 . HB+ 1 1
442 1 2 1 1 14 TRP H . 570 . HN 1 1
443 1 1 1 1 18 PHE QE . 574 . HE+ 1 1
443 1 2 1 1 72 PHE H . 628 . HN 1 1
444 1 1 1 1 71 THR HB . 627 . HB 1 1
444 1 2 1 1 72 PHE H . 628 . HN 1 1
445 1 1 1 1 37 ASN QD . 593 . HD2+ 1 1
445 1 2 1 1 79 ALA H . 635 . HN 1 1
446 1 1 1 1 33 THR H . 589 . HN 1 1
446 1 2 1 1 83 ALA HA . 639 . HA 1 1
447 1 1 1 1 32 VAL HA . 588 . HA 1 1
447 1 2 1 1 33 THR H . 589 . HN 1 1
448 1 1 1 1 33 THR H . 589 . HN 1 1
448 1 2 1 1 85 CYS HA . 641 . HA 1 1
449 1 1 1 1 33 THR H . 589 . HN 1 1
449 1 2 1 1 84 THR HB . 640 . HB 1 1
450 1 1 1 1 33 THR H . 589 . HN 1 1
450 1 2 1 1 84 THR MG . 640 . HG2+ 1 1
451 1 1 1 1 55 GLY H . 611 . HN 1 1
451 1 2 1 1 56 THR H . 612 . HN 1 1
452 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
452 1 2 1 1 56 THR H . 612 . HN 1 1
453 1 1 1 1 7 SER H . 563 . HN 1 1
453 1 2 1 1 22 TYR HA . 578 . HA 1 1
454 1 1 1 1 7 SER H . 563 . HN 1 1
454 1 2 1 1 24 VAL HA . 580 . HA 1 1
455 1 1 1 1 7 SER H . 563 . HN 1 1
455 1 2 1 1 23 SER HB2 . 579 . HB2 1 1
456 1 1 1 1 6 VAL HB . 562 . HB 1 1
456 1 2 1 1 7 SER H . 563 . HN 1 1
457 1 1 1 1 6 VAL QG . 562 . HG++ 1 1
457 1 2 1 1 7 SER H . 563 . HN 1 1
458 1 1 1 1 7 SER H . 563 . HN 1 1
458 1 2 1 1 24 VAL MG2 . 580 . HG2+ 1 1
459 1 1 1 1 48 ALA H . 604 . HN 1 1
459 1 2 1 1 49 ALA H . 605 . HN 1 1
460 1 1 1 1 49 ALA H . 605 . HN 1 1
460 1 2 1 1 59 ALA HA . 615 . HA 1 1
461 1 1 1 1 49 ALA H . 605 . HN 1 1
461 1 2 1 1 62 ASN QB . 618 . HB+ 1 1
462 1 1 1 1 9 VAL H . 565 . HN 1 1
462 1 2 1 1 10 ARG H . 566 . HN 1 1
463 1 1 1 1 9 VAL H . 565 . HN 1 1
463 1 2 1 1 22 TYR HA . 578 . HA 1 1
464 1 1 1 1 9 VAL H . 565 . HN 1 1
464 1 2 1 1 20 VAL HA . 576 . HA 1 1
465 1 1 1 1 9 VAL H . 565 . HN 1 1
465 1 2 1 1 21 THR HB . 577 . HB 1 1
466 1 1 1 1 67 SER H . 623 . HN 1 1
466 1 2 1 1 68 PHE H . 624 . HN 1 1
467 1 1 1 1 68 PHE H . 624 . HN 1 1
467 1 2 1 1 68 PHE QE . 624 . HE+ 1 1
468 1 1 1 1 22 TYR HB2 . 578 . HB2 1 1
468 1 2 1 1 68 PHE H . 624 . HN 1 1
469 1 1 1 1 14 TRP HD1 . 570 . HD1 1 1
469 1 2 1 1 15 ALA H . 571 . HN 1 1
470 1 1 1 1 71 THR H . 627 . HN 1 1
470 1 2 1 1 72 PHE H . 628 . HN 1 1
471 1 1 1 1 45 SER HA . 601 . HA 1 1
471 1 2 1 1 71 THR H . 627 . HN 1 1
472 1 1 1 1 70 VAL HB . 626 . HB 1 1
472 1 2 1 1 71 THR H . 627 . HN 1 1
473 1 1 1 1 42 VAL MG1 . 598 . HG1+ 1 1
473 1 2 1 1 71 THR H . 627 . HN 1 1
474 1 1 1 1 82 GLY H . 638 . HN 1 1
474 1 2 1 1 83 ALA H . 639 . HN 1 1
475 1 1 1 1 22 TYR QE . 578 . HE+ 1 1
475 1 2 1 1 83 ALA H . 639 . HN 1 1
476 1 1 1 1 42 VAL H . 598 . HN 1 1
476 1 2 1 1 43 GLN H . 599 . HN 1 1
477 1 1 1 1 48 ALA HA . 604 . HA 1 1
477 1 2 1 1 60 ARG H . 616 . HN 1 1
478 1 1 1 1 60 ARG H . 616 . HN 1 1
478 1 2 1 1 60 ARG QD . 616 . HD+ 1 1
479 1 1 1 1 36 LEU HB2 . 592 . HB2 1 1
479 1 2 1 1 40 GLN H . 596 . HN 1 1
480 1 1 1 1 20 VAL HB . 576 . HB 1 1
480 1 2 1 1 21 THR H . 577 . HN 1 1
481 1 1 1 1 11 GLY QA . 567 . HA+ 1 1
481 1 2 1 1 21 THR H . 577 . HN 1 1
482 1 1 1 1 11 GLY H . 567 . HN 1 1
482 1 2 1 1 21 THR H . 577 . HN 1 1
483 1 1 1 1 43 GLN HB2 . 599 . HB2 1 1
483 1 2 1 1 73 TYR H . 629 . HN 1 1
484 1 1 1 1 20 VAL H . 576 . HN 1 1
484 1 2 1 1 72 PHE QE . 628 . HE+ 1 1
485 1 1 1 1 20 VAL H . 576 . HN 1 1
485 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
486 1 1 1 1 20 VAL H . 576 . HN 1 1
486 1 2 1 1 71 THR HA . 627 . HA 1 1
487 1 1 1 1 19 ASN HB2 . 575 . HB2 1 1
487 1 2 1 1 20 VAL H . 576 . HN 1 1
488 1 1 1 1 29 SER H . 585 . HN 1 1
488 1 2 1 1 30 TRP H . 586 . HN 1 1
489 1 1 1 1 28 SER HA . 584 . HA 1 1
489 1 2 1 1 29 SER H . 585 . HN 1 1
490 1 1 1 1 29 SER H . 585 . HN 1 1
490 1 2 1 1 29 SER QB . 585 . HB+ 1 1
491 1 1 1 1 14 TRP H . 570 . HN 1 1
491 1 2 1 1 19 ASN H . 575 . HN 1 1
492 1 1 1 1 14 TRP HE3 . 570 . HE3 1 1
492 1 2 1 1 19 ASN H . 575 . HN 1 1
493 1 1 1 1 14 TRP HZ3 . 570 . HZ3 1 1
493 1 2 1 1 19 ASN H . 575 . HN 1 1
494 1 1 1 1 12 GLU H . 568 . HN 1 1
494 1 2 1 1 13 GLU H . 569 . HN 1 1
495 1 1 1 1 13 GLU H . 569 . HN 1 1
495 1 2 1 1 13 GLU QB . 569 . HB+ 1 1
496 1 1 1 1 13 GLU H . 569 . HN 1 1
496 1 2 1 1 13 GLU QG . 569 . HG+ 1 1
497 1 1 1 1 12 GLU HB3 . 568 . HB1 1 1
497 1 2 1 1 13 GLU H . 569 . HN 1 1
498 1 1 1 1 14 TRP HE3 . 570 . HE3 1 1
498 1 2 1 1 17 ARG H . 573 . HN 1 1
499 1 1 1 1 17 ARG H . 573 . HN 1 1
499 1 2 1 1 17 ARG QB . 573 . HB+ 1 1
500 1 1 1 1 51 THR H . 607 . HN 1 1
500 1 2 1 1 60 ARG H . 616 . HN 1 1
501 1 1 1 1 49 ALA H . 605 . HN 1 1
501 1 2 1 1 62 ASN H . 618 . HN 1 1
502 1 1 1 1 61 PRO QB . 617 . HB+ 1 1
502 1 2 1 1 62 ASN H . 618 . HN 1 1
503 1 1 1 1 27 SER H . 583 . HN 1 1
503 1 2 1 1 28 SER H . 584 . HN 1 1
504 1 1 1 1 37 ASN H . 593 . HN 1 1
504 1 2 1 1 40 GLN H . 596 . HN 1 1
505 1 1 1 1 37 ASN H . 593 . HN 1 1
505 1 2 1 1 81 PRO HA . 637 . HA 1 1
506 1 1 1 1 36 LEU HA . 592 . HA 1 1
506 1 2 1 1 37 ASN H . 593 . HN 1 1
507 1 1 1 1 37 ASN H . 593 . HN 1 1
507 1 2 1 1 40 GLN QG . 596 . HG+ 1 1
508 1 1 1 1 37 ASN H . 593 . HN 1 1
508 1 2 1 1 40 GLN HB2 . 596 . HB2 1 1
509 1 1 1 1 36 LEU HB2 . 592 . HB2 1 1
509 1 2 1 1 37 ASN H . 593 . HN 1 1
510 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
510 1 2 1 1 37 ASN H . 593 . HN 1 1
511 1 1 1 1 28 SER HA . 584 . HA 1 1
511 1 2 1 1 30 TRP H . 586 . HN 1 1
512 1 1 1 1 30 TRP H . 586 . HN 1 1
512 1 2 1 1 61 PRO QD . 617 . HD+ 1 1
513 1 1 1 1 30 TRP H . 586 . HN 1 1
513 1 2 1 1 61 PRO QG . 617 . HG+ 1 1
514 1 1 1 1 30 TRP H . 586 . HN 1 1
514 1 2 1 1 31 VAL QG . 587 . HG++ 1 1
515 1 1 1 1 30 TRP H . 586 . HN 1 1
515 1 2 1 1 31 VAL H . 587 . HN 1 1
516 1 1 1 1 31 VAL H . 587 . HN 1 1
516 1 2 1 1 32 VAL HA . 588 . HA 1 1
517 1 1 1 1 30 TRP QB . 586 . HB+ 1 1
517 1 2 1 1 31 VAL H . 587 . HN 1 1
518 1 1 1 1 51 THR HB . 607 . HB 1 1
518 1 2 1 1 58 THR H . 614 . HN 1 1
519 1 1 1 1 57 VAL HB . 613 . HB 1 1
519 1 2 1 1 58 THR H . 614 . HN 1 1
520 1 1 1 1 10 ARG HA . 566 . HA 1 1
520 1 2 1 1 10 ARG HE . 566 . HE 1 1
521 1 1 1 1 22 TYR QE . 578 . HE+ 1 1
521 1 2 1 1 70 VAL H . 626 . HN 1 1
522 1 1 1 1 22 TYR QD . 578 . HD+ 1 1
522 1 2 1 1 70 VAL H . 626 . HN 1 1
523 1 1 1 1 19 ASN HA . 575 . HA 1 1
523 1 2 1 1 70 VAL H . 626 . HN 1 1
524 1 1 1 1 20 VAL HB . 576 . HB 1 1
524 1 2 1 1 70 VAL H . 626 . HN 1 1
525 1 1 1 1 46 TRP H . 602 . HN 1 1
525 1 2 1 1 47 ASN H . 603 . HN 1 1
526 1 1 1 1 46 TRP H . 602 . HN 1 1
526 1 2 1 1 68 PHE QD . 624 . HD+ 1 1
527 1 1 1 1 46 TRP H . 602 . HN 1 1
527 1 2 1 1 46 TRP HB3 . 602 . HB1 1 1
528 1 1 1 1 46 TRP H . 602 . HN 1 1
528 1 2 1 1 68 PHE QB . 624 . HB+ 1 1
529 1 1 1 1 46 TRP H . 602 . HN 1 1
529 1 2 1 1 69 GLY QA . 625 . HA+ 1 1
530 1 1 1 1 87 THR HB . 643 . HB 1 1
530 1 2 1 1 88 GLY H . 644 . HN 1 1
531 1 1 1 1 87 THR MG . 643 . HG2+ 1 1
531 1 2 1 1 88 GLY H . 644 . HN 1 1
532 1 1 1 1 66 ASN H . 622 . HN 1 1
532 1 2 1 1 67 SER QB . 623 . HB+ 1 1
533 1 1 1 1 6 VAL HA . 562 . HA 1 1
533 1 2 1 1 23 SER H . 579 . HN 1 1
534 1 1 1 1 51 THR H . 607 . HN 1 1
534 1 2 1 1 52 GLY H . 608 . HN 1 1
535 1 1 1 1 52 GLY H . 608 . HN 1 1
535 1 2 1 1 53 SER H . 609 . HN 1 1
536 1 1 1 1 52 GLY H . 608 . HN 1 1
536 1 2 1 1 57 VAL MG1 . 613 . HG1+ 1 1
537 1 1 1 1 75 ASN H . 631 . HN 1 1
537 1 2 1 1 77 SER H . 633 . HN 1 1
538 1 1 1 1 77 SER H . 633 . HN 1 1
538 1 2 1 1 78 SER H . 634 . HN 1 1
539 1 1 1 1 76 GLY QA . 632 . HA+ 1 1
539 1 2 1 1 77 SER H . 633 . HN 1 1
540 1 1 1 1 74 LYS QG . 630 . HG+ 1 1
540 1 2 1 1 77 SER H . 633 . HN 1 1
541 1 1 1 1 64 SER H . 620 . HN 1 1
541 1 2 1 1 64 SER QB . 620 . HB+ 1 1
542 1 1 1 1 64 SER H . 620 . HN 1 1
542 1 2 1 1 65 GLY QA . 621 . HA+ 1 1
543 1 1 1 1 14 TRP HE3 . 570 . HE3 1 1
543 1 2 1 1 18 PHE H . 574 . HN 1 1
544 1 1 1 1 14 TRP HZ3 . 570 . HZ3 1 1
544 1 2 1 1 18 PHE H . 574 . HN 1 1
545 1 1 1 1 18 PHE H . 574 . HN 1 1
545 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
546 1 1 1 1 18 PHE H . 574 . HN 1 1
546 1 2 1 1 71 THR HA . 627 . HA 1 1
547 1 1 1 1 17 ARG QB . 573 . HB+ 1 1
547 1 2 1 1 18 PHE H . 574 . HN 1 1
548 1 1 1 1 18 PHE H . 574 . HN 1 1
548 1 2 1 1 71 THR MG . 627 . HG2+ 1 1
549 1 1 1 1 54 SER H . 610 . HN 1 1
549 1 2 1 1 55 GLY H . 611 . HN 1 1
550 1 1 1 1 42 VAL H . 598 . HN 1 1
550 1 2 1 1 54 SER H . 610 . HN 1 1
551 1 1 1 1 37 ASN QD . 593 . HD2+ 1 1
551 1 2 1 1 40 GLN QE . 596 . HE2+ 1 1
552 1 1 1 1 5 SER H . 561 . HN 1 1
552 1 2 1 1 6 VAL QG . 562 . HG++ 1 1
553 1 1 1 1 11 GLY H . 567 . HN 1 1
553 1 2 1 1 20 VAL MG1 . 576 . HG1+ 1 1
554 1 1 1 1 9 VAL H . 565 . HN 1 1
554 1 2 1 1 11 GLY H . 567 . HN 1 1
555 1 1 1 1 11 GLY H . 567 . HN 1 1
555 1 2 1 1 19 ASN HB3 . 575 . HB1 1 1
556 1 1 1 1 38 GLY H . 594 . HN 1 1
556 1 2 1 1 39 GLY H . 595 . HN 1 1
557 1 1 1 1 73 TYR HA . 629 . HA 1 1
557 1 2 1 1 75 ASN H . 631 . HN 1 1
558 1 1 1 1 75 ASN H . 631 . HN 1 1
558 1 2 1 1 77 SER QB . 633 . HB+ 1 1
559 1 1 1 1 73 TYR HB3 . 629 . HB1 1 1
559 1 2 1 1 75 ASN H . 631 . HN 1 1
560 1 1 1 1 74 LYS QG . 630 . HG+ 1 1
560 1 2 1 1 75 ASN H . 631 . HN 1 1
561 1 1 1 1 46 TRP H . 602 . HN 1 1
561 1 2 1 1 48 ALA H . 604 . HN 1 1
562 1 1 1 1 46 TRP HA . 602 . HA 1 1
562 1 2 1 1 48 ALA H . 604 . HN 1 1
563 1 1 1 1 46 TRP HB2 . 602 . HB2 1 1
563 1 2 1 1 48 ALA H . 604 . HN 1 1
564 1 1 1 1 48 ALA H . 604 . HN 1 1
564 1 2 1 1 68 PHE QB . 624 . HB+ 1 1
565 1 1 1 1 48 ALA H . 604 . HN 1 1
565 1 2 1 1 68 PHE HA . 624 . HA 1 1
566 1 1 1 1 66 ASN H . 622 . HN 1 1
566 1 2 1 1 66 ASN QD . 622 . HD2+ 1 1
567 1 1 1 1 65 GLY QA . 621 . HA+ 1 1
567 1 2 1 1 67 SER H . 623 . HN 1 1
568 1 1 1 1 46 TRP HA . 602 . HA 1 1
568 1 2 1 1 47 ASN H . 603 . HN 1 1
569 1 1 1 1 47 ASN H . 603 . HN 1 1
569 1 2 1 1 48 ALA HA . 604 . HA 1 1
570 1 1 1 1 84 THR H . 640 . HN 1 1
570 1 2 1 1 85 CYS H . 641 . HN 1 1
571 1 1 1 1 83 ALA H . 639 . HN 1 1
571 1 2 1 1 84 THR H . 640 . HN 1 1
572 1 1 1 1 34 LEU HA . 590 . HA 1 1
572 1 2 1 1 84 THR H . 640 . HN 1 1
573 1 1 1 1 33 THR HB . 589 . HB 1 1
573 1 2 1 1 84 THR H . 640 . HN 1 1
574 1 1 1 1 83 ALA MB . 639 . HB+ 1 1
574 1 2 1 1 84 THR H . 640 . HN 1 1
575 1 1 1 1 45 SER H . 601 . HN 1 1
575 1 2 1 1 46 TRP H . 602 . HN 1 1
576 1 1 1 1 44 SER H . 600 . HN 1 1
576 1 2 1 1 45 SER H . 601 . HN 1 1
577 1 1 1 1 45 SER H . 601 . HN 1 1
577 1 2 1 1 46 TRP HE3 . 602 . HE3 1 1
578 1 1 1 1 45 SER H . 601 . HN 1 1
578 1 2 1 1 45 SER QB . 601 . HB+ 1 1
579 1 1 1 1 45 SER H . 601 . HN 1 1
579 1 2 1 1 70 VAL QG . 626 . HG++ 1 1
580 1 1 1 1 75 ASN HA . 631 . HA 1 1
580 1 2 1 1 75 ASN QD . 631 . HD2+ 1 1
581 1 1 1 1 75 ASN HB2 . 631 . HB2 1 1
581 1 2 1 1 75 ASN QD . 631 . HD2+ 1 1
582 1 1 1 1 41 SER HA . 597 . HA 1 1
582 1 2 1 1 55 GLY H . 611 . HN 1 1
583 1 1 1 1 36 LEU HB3 . 592 . HB1 1 1
583 1 2 1 1 55 GLY H . 611 . HN 1 1
584 1 1 1 1 26 GLY H . 582 . HN 1 1
584 1 2 1 1 27 SER H . 583 . HN 1 1
585 1 1 1 1 63 GLY H . 619 . HN 1 1
585 1 2 1 1 65 GLY H . 621 . HN 1 1
586 1 1 1 1 64 SER QB . 620 . HB+ 1 1
586 1 2 1 1 65 GLY H . 621 . HN 1 1
587 1 1 1 1 53 SER H . 609 . HN 1 1
587 1 2 1 1 57 VAL MG1 . 613 . HG1+ 1 1
588 1 1 1 1 34 LEU H . 590 . HN 1 1
588 1 2 1 1 35 GLY H . 591 . HN 1 1
589 1 1 1 1 35 GLY H . 591 . HN 1 1
589 1 2 1 1 81 PRO HA . 637 . HA 1 1
590 1 1 1 1 35 GLY H . 591 . HN 1 1
590 1 2 1 1 35 GLY QA . 591 . HA+ 1 1
591 1 1 1 1 34 LEU QB . 590 . HB+ 1 1
591 1 2 1 1 35 GLY H . 591 . HN 1 1
592 1 1 1 1 35 GLY H . 591 . HN 1 1
592 1 2 1 1 36 LEU QD . 592 . HD++ 1 1
593 1 1 1 1 34 LEU HG . 590 . HG 1 1
593 1 2 1 1 35 GLY H . 591 . HN 1 1
594 1 1 1 1 34 LEU QD . 590 . HD++ 1 1
594 1 2 1 1 35 GLY H . 591 . HN 1 1
595 1 1 1 1 40 GLN H . 596 . HN 1 1
595 1 2 1 1 41 SER H . 597 . HN 1 1
596 1 1 1 1 41 SER H . 597 . HN 1 1
596 1 2 1 1 73 TYR QD . 629 . HD+ 1 1
597 1 1 1 1 41 SER H . 597 . HN 1 1
597 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
598 1 1 1 1 41 SER H . 597 . HN 1 1
598 1 2 1 1 72 PHE HA . 628 . HA 1 1
599 1 1 1 1 40 GLN QG . 596 . HG+ 1 1
599 1 2 1 1 41 SER H . 597 . HN 1 1
600 1 1 1 1 40 GLN HB3 . 596 . HB1 1 1
600 1 2 1 1 41 SER H . 597 . HN 1 1
601 1 1 1 1 5 SER H . 561 . HN 1 1
601 1 2 1 1 27 SER H . 583 . HN 1 1
602 1 1 1 1 4 CYS QB . 560 . HB+ 1 1
602 1 2 1 1 27 SER H . 583 . HN 1 1
603 1 1 1 1 43 GLN QG . 599 . HG+ 1 1
603 1 2 1 1 44 SER H . 600 . HN 1 1
604 1 1 1 1 44 SER H . 600 . HN 1 1
604 1 2 1 1 70 VAL QG . 626 . HG++ 1 1
605 1 1 1 1 14 TRP HZ3 . 570 . HZ3 1 1
605 1 2 1 1 19 ASN QD . 575 . HD2+ 1 1
606 1 1 1 1 37 ASN HB2 . 593 . HB2 1 1
606 1 2 1 1 40 GLN QE . 596 . HE2+ 1 1
607 1 1 1 1 40 GLN QE . 596 . HE2+ 1 1
607 1 2 1 1 81 PRO QD . 637 . HD+ 1 1
608 1 1 1 1 40 GLN QE . 596 . HE2+ 1 1
608 1 2 1 1 81 PRO QB . 637 . HB+ 1 1
609 1 1 1 1 40 GLN QE . 596 . HE2+ 1 1
609 1 2 1 1 79 ALA MB . 635 . HB+ 1 1
610 1 1 1 1 47 ASN QD . 603 . HD++ 1 1
610 1 2 1 1 68 PHE HA . 624 . HA 1 1
611 1 1 1 1 16 ASP H . 572 . HN 1 1
611 1 2 1 1 17 ARG HA . 573 . HA 1 1
612 1 1 1 1 15 ALA HA . 571 . HA 1 1
612 1 2 1 1 16 ASP H . 572 . HN 1 1
613 1 1 1 1 14 TRP HB2 . 570 . HB2 1 1
613 1 2 1 1 16 ASP H . 572 . HN 1 1
614 1 1 1 1 62 ASN HA . 618 . HA 1 1
614 1 2 1 1 62 ASN QD . 618 . HD++ 1 1
615 1 1 1 1 46 TRP HD1 . 602 . HD1 1 1
615 1 2 1 1 69 GLY H . 625 . HN 1 1
616 1 1 1 1 68 PHE QD . 624 . HD+ 1 1
616 1 2 1 1 69 GLY H . 625 . HN 1 1
617 1 1 1 1 61 PRO HA . 617 . HA 1 1
617 1 2 1 1 63 GLY H . 619 . HN 1 1
618 1 1 1 1 61 PRO QB . 617 . HB+ 1 1
618 1 2 1 1 63 GLY H . 619 . HN 1 1
619 1 1 1 1 75 ASN HB2 . 631 . HB2 1 1
619 1 2 1 1 76 GLY H . 632 . HN 1 1
620 1 1 1 1 17 ARG HE . 573 . HE 1 1
620 1 2 1 1 73 TYR QE . 629 . HE+ 1 1
621 1 1 1 1 17 ARG QB . 573 . HB+ 1 1
621 1 2 1 1 17 ARG HE . 573 . HE 1 1
622 1 1 1 1 60 ARG HE . 616 . HE 1 1
622 1 2 1 1 60 ARG QG . 616 . HG+ 1 1
623 1 1 1 1 57 VAL H . 613 . HN 1 1
623 1 2 1 1 57 VAL MG1 . 613 . HG1+ 1 1
624 1 1 1 1 46 TRP HB2 . 602 . HB2 1 1
624 1 2 1 1 47 ASN H . 603 . HN 1 1
625 1 1 1 1 37 ASN HB2 . 593 . HB2 1 1
625 1 2 1 1 38 GLY H . 594 . HN 1 1
626 1 1 1 1 9 VAL H . 565 . HN 1 1
626 1 2 1 1 9 VAL MG2 . 565 . HG2+ 1 1
627 1 1 1 1 11 GLY H . 567 . HN 1 1
627 1 2 1 1 20 VAL MG2 . 576 . HG2+ 1 1
628 1 1 1 1 57 VAL H . 613 . HN 1 1
628 1 2 1 1 57 VAL MG2 . 613 . HG2+ 1 1
629 1 1 1 1 86 ALA MB . 642 . HB+ 1 1
629 1 2 1 1 88 GLY H . 644 . HN 1 1
630 1 1 1 1 14 TRP HB2 . 570 . HB2 1 1
630 1 2 1 1 17 ARG H . 573 . HN 1 1
631 1 1 1 1 74 LYS QG . 630 . HG+ 1 1
631 1 2 1 1 76 GLY H . 632 . HN 1 1
632 1 1 1 1 67 SER HA . 623 . HA 1 1
632 1 2 1 1 68 PHE QD . 624 . HD+ 1 1
633 1 1 1 1 17 ARG QD . 573 . HD+ 1 1
633 1 2 1 1 73 TYR QE . 629 . HE+ 1 1
634 1 1 1 1 14 TRP HE3 . 570 . HE3 1 1
634 1 2 1 1 17 ARG QG . 573 . HG+ 1 1
635 1 1 1 1 20 VAL HB . 576 . HB 1 1
635 1 2 1 1 72 PHE QE . 628 . HE+ 1 1
636 1 1 1 1 5 SER H . 561 . HN 1 1
636 1 2 1 1 24 VAL MG1 . 580 . HG1+ 1 1
637 1 1 1 1 18 PHE HZ . 574 . HZ 1 1
637 1 2 1 1 80 THR HA . 636 . HA 1 1
638 1 1 1 1 42 VAL HA . 598 . HA 1 1
638 1 2 1 1 72 PHE QD . 628 . HD+ 1 1
639 1 1 1 1 39 GLY H . 595 . HN 1 1
639 1 2 1 1 39 GLY QA . 595 . HA+ 1 1
640 1 1 1 1 41 SER HA . 597 . HA 1 1
640 1 2 1 1 42 VAL MG2 . 598 . HG2+ 1 1
641 1 1 1 1 45 SER HA . 601 . HA 1 1
641 1 2 1 1 46 TRP HE3 . 602 . HE3 1 1
642 1 1 1 1 18 PHE QD . 574 . HD+ 1 1
642 1 2 1 1 81 PRO QD . 637 . HD+ 1 1
643 1 1 1 1 45 SER QB . 601 . HB+ 1 1
643 1 2 1 1 68 PHE QD . 624 . HD+ 1 1
644 1 1 1 1 24 VAL MG2 . 580 . HG2+ 1 1
644 1 2 1 1 30 TRP HZ2 . 586 . HZ2 1 1
645 1 1 1 1 43 GLN HB2 . 599 . HB2 1 1
645 1 2 1 1 73 TYR QE . 629 . HE+ 1 1
646 1 1 1 1 42 VAL MG1 . 598 . HG1+ 1 1
646 1 2 1 1 44 SER H . 600 . HN 1 1
647 1 1 1 1 30 TRP HE3 . 586 . HE3 1 1
647 1 2 1 1 59 ALA MB . 615 . HB+ 1 1
648 1 1 1 1 70 VAL HB . 626 . HB 1 1
648 1 2 1 1 72 PHE QE . 628 . HE+ 1 1
649 1 1 1 1 30 TRP HE3 . 586 . HE3 1 1
649 1 2 1 1 31 VAL QG . 587 . HG++ 1 1
650 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
650 1 2 1 1 54 SER H . 610 . HN 1 1
651 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
651 1 2 1 1 41 SER H . 597 . HN 1 1
652 1 1 1 1 18 PHE QD . 574 . HD+ 1 1
652 1 2 1 1 80 THR MG . 636 . HG2+ 1 1
653 1 1 1 1 18 PHE QE . 574 . HE+ 1 1
653 1 2 1 1 80 THR MG . 636 . HG2+ 1 1
654 1 1 1 1 14 TRP HZ3 . 570 . HZ3 1 1
654 1 2 1 1 19 ASN HB2 . 575 . HB2 1 1
655 1 1 1 1 17 ARG QG . 573 . HG+ 1 1
655 1 2 1 1 73 TYR QD . 629 . HD+ 1 1
656 1 1 1 1 30 TRP HE3 . 586 . HE3 1 1
656 1 2 1 1 32 VAL HB . 588 . HB 1 1
657 1 1 1 1 74 LYS H . 630 . HN 1 1
657 1 2 1 1 74 LYS QG . 630 . HG+ 1 1
658 1 1 1 1 36 LEU H . 592 . HN 1 1
658 1 2 1 1 36 LEU HG . 592 . HG 1 1
659 1 1 1 1 34 LEU QD . 590 . HD++ 1 1
659 1 2 1 1 50 LEU QD . 606 . HD++ 1 1
660 1 1 1 1 50 LEU QD . 606 . HD++ 1 1
660 1 2 1 1 70 VAL QG . 626 . HG++ 1 1
661 1 1 1 1 34 LEU QD . 590 . HD++ 1 1
661 1 2 1 1 36 LEU HG . 592 . HG 1 1
662 1 1 1 1 24 VAL MG2 . 580 . HG2+ 1 1
662 1 2 1 1 30 TRP QB . 586 . HB+ 1 1
663 1 1 1 1 61 PRO QB . 617 . HB+ 1 1
663 1 2 1 1 61 PRO QG . 617 . HG+ 1 1
664 1 1 1 1 43 GLN HB2 . 599 . HB2 1 1
664 1 2 1 1 43 GLN QG . 599 . HG+ 1 1
665 1 1 1 1 9 VAL MG1 . 565 . HG1+ 1 1
665 1 2 1 1 21 THR HB . 577 . HB 1 1
666 1 1 1 1 21 THR MG . 577 . HG2+ 1 1
666 1 2 1 1 22 TYR HA . 578 . HA 1 1
667 1 1 1 1 21 THR MG . 577 . HG2+ 1 1
667 1 2 1 1 69 GLY QA . 625 . HA+ 1 1
668 1 1 1 1 21 THR HA . 577 . HA 1 1
668 1 2 1 1 21 THR MG . 577 . HG2+ 1 1
669 1 1 1 1 20 VAL MG1 . 576 . HG1+ 1 1
669 1 2 1 1 22 TYR HA . 578 . HA 1 1
670 1 1 1 1 20 VAL MG1 . 576 . HG1+ 1 1
670 1 2 1 1 21 THR HA . 577 . HA 1 1
671 1 1 1 1 61 PRO QD . 617 . HD+ 1 1
671 1 2 1 1 61 PRO QG . 617 . HG+ 1 1
672 1 1 1 1 31 VAL QG . 587 . HG++ 1 1
672 1 2 1 1 58 THR MG . 614 . HG2+ 1 1
673 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
673 1 2 1 1 36 LEU HG . 592 . HG 1 1
674 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
674 1 2 1 1 40 GLN HB2 . 596 . HB2 1 1
675 1 1 1 1 17 ARG QB . 573 . HB+ 1 1
675 1 2 1 1 71 THR MG . 627 . HG2+ 1 1
676 1 1 1 1 34 LEU HB3 . 590 . HB1 1 1
676 1 2 1 1 36 LEU HG . 592 . HG 1 1
677 1 1 1 1 42 VAL HB . 598 . HB 1 1
677 1 2 1 1 42 VAL MG2 . 598 . HG2+ 1 1
678 1 1 1 1 8 ALA MB . 564 . HB+ 1 1
678 1 2 1 1 20 VAL MG2 . 576 . HG2+ 1 1
679 1 1 1 1 34 LEU HG . 590 . HG 1 1
679 1 2 1 1 83 ALA MB . 639 . HB+ 1 1
680 1 1 1 1 32 VAL HB . 588 . HB 1 1
680 1 2 1 1 32 VAL QG . 588 . HG++ 1 1
681 1 1 1 1 33 THR MG . 589 . HG2+ 1 1
681 1 2 1 1 58 THR HA . 614 . HA 1 1
682 1 1 1 1 32 VAL QG . 588 . HG++ 1 1
682 1 2 1 1 84 THR HB . 640 . HB 1 1
683 1 1 1 1 32 VAL QG . 588 . HG++ 1 1
683 1 2 1 1 33 THR HA . 589 . HA 1 1
684 1 1 1 1 7 SER QB . 563 . HB+ 1 1
684 1 2 1 1 9 VAL MG2 . 565 . HG2+ 1 1
685 1 1 1 1 29 SER HA . 585 . HA 1 1
685 1 2 1 1 31 VAL QG . 587 . HG++ 1 1
686 1 1 1 1 9 VAL MG2 . 565 . HG2+ 1 1
686 1 2 1 1 11 GLY QA . 567 . HA+ 1 1
687 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
687 1 2 1 1 54 SER HA . 610 . HA 1 1
688 1 1 1 1 42 VAL MG2 . 598 . HG2+ 1 1
688 1 2 1 1 53 SER HA . 609 . HA 1 1
689 1 1 1 1 21 THR HB . 577 . HB 1 1
689 1 2 1 1 21 THR MG . 577 . HG2+ 1 1
690 1 1 1 1 22 TYR HB2 . 578 . HB2 1 1
690 1 2 1 1 68 PHE QE . 624 . HE+ 1 1
691 1 1 1 1 32 VAL HB . 588 . HB 1 1
691 1 2 1 1 68 PHE QE . 624 . HE+ 1 1
692 1 1 1 1 17 ARG HA . 573 . HA 1 1
692 1 2 1 1 17 ARG QB . 573 . HB+ 1 1
693 1 1 1 1 17 ARG HA . 573 . HA 1 1
693 1 2 1 1 17 ARG QG . 573 . HG+ 1 1
694 1 1 1 1 24 VAL MG2 . 580 . HG2+ 1 1
694 1 2 1 1 66 ASN HA . 622 . HA 1 1
695 1 1 1 1 36 LEU QD . 592 . HD++ 1 1
695 1 2 1 1 41 SER HA . 597 . HA 1 1
696 1 1 1 1 41 SER HA . 597 . HA 1 1
696 1 2 1 1 42 VAL HB . 598 . HB 1 1
697 1 1 1 1 24 VAL HB . 580 . HB 1 1
697 1 2 1 1 66 ASN HA . 622 . HA 1 1
698 1 1 1 1 86 ALA HA . 642 . HA 1 1
698 1 2 1 1 86 ALA MB . 642 . HB+ 1 1
699 1 1 1 1 41 SER HA . 597 . HA 1 1
699 1 2 1 1 54 SER QB . 610 . HB+ 1 1
700 1 1 1 1 47 ASN QB . 603 . HB+ 1 1
700 1 2 1 1 68 PHE HA . 624 . HA 1 1
701 1 1 1 1 45 SER HA . 601 . HA 1 1
701 1 2 1 1 45 SER QB . 601 . HB+ 1 1
702 1 1 1 1 30 TRP HA . 586 . HA 1 1
702 1 2 1 1 30 TRP QB . 586 . HB+ 1 1
703 1 1 1 1 29 SER HA . 585 . HA 1 1
703 1 2 1 1 29 SER QB . 585 . HB+ 1 1
704 1 1 1 1 10 ARG HA . 566 . HA 1 1
704 1 2 1 1 10 ARG QD . 566 . HD+ 1 1
705 1 1 1 1 87 THR HB . 643 . HB 1 1
705 1 2 1 1 87 THR MG . 643 . HG2+ 1 1
706 1 1 1 1 1 THR HB . 557 . HB 1 1
706 1 2 1 1 1 THR MG . 557 . HG2+ 1 1
707 1 1 1 1 20 VAL MG1 . 576 . HG1+ 1 1
707 1 2 1 1 21 THR HB . 577 . HB 1 1
708 1 1 1 1 10 ARG QD . 566 . HD+ 1 1
708 1 2 1 1 20 VAL MG1 . 576 . HG1+ 1 1
709 1 1 1 1 43 GLN HB2 . 599 . HB2 1 1
709 1 2 1 1 71 THR HB . 627 . HB 1 1
710 1 1 1 1 9 VAL MG1 . 565 . HG1+ 1 1
710 1 2 1 1 11 GLY QA . 567 . HA+ 1 1
711 1 1 1 1 78 SER QB . 634 . HB+ 1 1
711 1 2 1 1 79 ALA MB . 635 . HB+ 1 1
712 1 1 1 1 14 TRP HB3 . 570 . HB1 1 1
712 1 2 1 1 15 ALA MB . 571 . HB+ 1 1
713 1 1 1 1 9 VAL HB . 565 . HB 1 1
713 1 2 1 1 21 THR HB . 577 . HB 1 1
714 1 1 1 1 13 GLU QB . 569 . HB+ 1 1
714 1 2 1 1 18 PHE QB . 574 . HB+ 1 1
715 1 1 1 1 47 ASN QB . 603 . HB+ 1 1
715 1 2 1 1 68 PHE QB . 624 . HB+ 1 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 4.51 1.9 4.51 1 1
2 1 . . . . . 4.08 1.9 4.08 1 1
3 1 . . . . . 3.7 1.9 3.7 1 1
4 1 . . . . . 2.5 1.9 2.5 1 1
5 1 . . . . . 2.5 1.9 2.5 1 1
6 1 . . . . . 4.97 1.9 4.97 1 1
7 1 . . . . . 5.5 1.9 5.5 1 1
8 1 . . . . . 2.75 1.9 2.75 1 1
9 1 . . . . . 2.5 1.9 2.5 1 1
10 1 . . . . . 3.04 1.9 3.04 1 1
11 1 . . . . . 3.04 1.9 3.04 1 1
12 1 . . . . . 3.7 1.9 3.7 1 1
13 1 . . . . . 2.5 1.9 2.5 1 1
14 1 . . . . . 3.35 1.9 3.35 1 1
15 1 . . . . . 2.5 1.9 2.5 1 1
16 1 . . . . . 4.08 1.9 4.08 1 1
17 1 . . . . . 3.7 1.9 3.7 1 1
18 1 . . . . . 2.5 1.9 2.5 1 1
19 1 . . . . . 4.08 1.9 4.08 1 1
20 1 . . . . . 3.7 1.9 3.7 1 1
21 1 . . . . . 2.5 1.9 2.5 1 1
22 1 . . . . . 3.04 1.9 3.04 1 1
23 1 . . . . . 4.51 1.9 4.51 1 1
24 1 . . . . . 2.75 1.9 2.75 1 1
25 1 . . . . . 5.5 1.9 5.5 1 1
26 1 . . . . . 2.5 1.9 2.5 1 1
27 1 . . . . . 3.7 1.9 3.7 1 1
28 1 . . . . . 4.08 1.9 4.08 1 1
29 1 . . . . . 4.51 1.9 4.51 1 1
30 1 . . . . . 4.51 1.9 4.51 1 1
31 1 . . . . . 2.5 1.9 2.5 1 1
32 1 . . . . . 2.75 1.9 2.75 1 1
33 1 . . . . . 3.7 1.9 3.7 1 1
34 1 . . . . . 3.04 1.9 3.04 1 1
35 1 . . . . . 4.97 1.9 4.97 1 1
36 1 . . . . . 2.5 1.9 2.5 1 1
37 1 . . . . . 4.08 1.9 4.08 1 1
38 1 . . . . . 2.5 1.9 2.5 1 1
39 1 . . . . . 5.5 1.9 5.5 1 1
40 1 . . . . . 4.08 1.9 4.08 1 1
41 1 . . . . . 3.04 1.9 3.04 1 1
42 1 . . . . . 3.7 1.9 3.7 1 1
43 1 . . . . . 3.7 1.9 3.7 1 1
44 1 . . . . . 4.08 1.9 4.08 1 1
45 1 . . . . . 3.04 1.9 3.04 1 1
46 1 . . . . . 4.51 1.9 4.51 1 1
47 1 . . . . . 4.51 1.9 4.51 1 1
48 1 . . . . . 4.51 1.9 4.51 1 1
49 1 . . . . . 2.5 1.9 2.5 1 1
50 1 . . . . . 4.97 1.9 4.97 1 1
51 1 . . . . . 3.04 1.9 3.04 1 1
52 1 . . . . . 3.04 1.9 3.04 1 1
53 1 . . . . . 3.35 1.9 3.35 1 1
54 1 . . . . . 4.08 1.9 4.08 1 1
55 1 . . . . . 3.35 1.9 3.35 1 1
56 1 . . . . . 5.5 1.9 5.5 1 1
57 1 . . . . . 4.51 1.9 4.51 1 1
58 1 . . . . . 3.04 1.9 3.04 1 1
59 1 . . . . . 5.5 1.9 5.5 1 1
60 1 . . . . . 2.5 1.9 2.5 1 1
61 1 . . . . . 2.5 1.9 2.5 1 1
62 1 . . . . . 5.5 1.9 5.5 1 1
63 1 . . . . . 5.5 1.9 5.5 1 1
64 1 . . . . . 3.7 1.9 3.7 1 1
65 1 . . . . . 4.97 1.9 4.97 1 1
66 1 . . . . . 4.51 1.9 4.51 1 1
67 1 . . . . . 2.75 1.9 2.75 1 1
68 1 . . . . . 3.04 1.9 3.04 1 1
69 1 . . . . . 5.5 1.9 5.5 1 1
70 1 . . . . . 2.5 1.9 2.5 1 1
71 1 . . . . . 2.75 1.9 2.75 1 1
72 1 . . . . . 3.04 1.9 3.04 1 1
73 1 . . . . . 5.5 1.9 5.5 1 1
74 1 . . . . . 2.5 1.9 2.5 1 1
75 1 . . . . . 2.75 1.9 2.75 1 1
76 1 . . . . . 3.7 1.9 3.7 1 1
77 1 . . . . . 3.35 1.9 3.35 1 1
78 1 . . . . . 2.5 1.9 2.5 1 1
79 1 . . . . . 4.08 1.9 4.08 1 1
80 1 . . . . . 4.08 1.9 4.08 1 1
81 1 . . . . . 5.5 1.9 5.5 1 1
82 1 . . . . . 4.08 1.9 4.08 1 1
83 1 . . . . . 3.7 1.9 3.7 1 1
84 1 . . . . . 3.7 1.9 3.7 1 1
85 1 . . . . . 2.75 1.9 2.75 1 1
86 1 . . . . . 3.35 1.9 3.35 1 1
87 1 . . . . . 3.35 1.9 3.35 1 1
88 1 . . . . . 2.5 1.9 2.5 1 1
89 1 . . . . . 5.5 1.9 5.5 1 1
90 1 . . . . . 3.04 1.9 3.04 1 1
91 1 . . . . . 4.97 1.9 4.97 1 1
92 1 . . . . . 4.51 1.9 4.51 1 1
93 1 . . . . . 5.5 1.9 5.5 1 1
94 1 . . . . . 3.7 1.9 3.7 1 1
95 1 . . . . . 4.08 1.9 4.08 1 1
96 1 . . . . . 5.5 1.9 5.5 1 1
97 1 . . . . . 3.35 1.9 3.35 1 1
98 1 . . . . . 2.5 1.9 2.5 1 1
99 1 . . . . . 3.7 1.9 3.7 1 1
100 1 . . . . . 4.08 1.9 4.08 1 1
101 1 . . . . . 3.35 1.9 3.35 1 1
102 1 . . . . . 4.51 1.9 4.51 1 1
103 1 . . . . . 2.5 1.9 2.5 1 1
104 1 . . . . . 2.75 1.9 2.75 1 1
105 1 . . . . . 3.7 1.9 3.7 1 1
106 1 . . . . . 2.5 1.9 2.5 1 1
107 1 . . . . . 3.7 1.9 3.7 1 1
108 1 . . . . . 4.97 1.9 4.97 1 1
109 1 . . . . . 4.97 1.9 4.97 1 1
110 1 . . . . . 4.97 1.9 4.97 1 1
111 1 . . . . . 3.04 1.9 3.04 1 1
112 1 . . . . . 3.04 1.9 3.04 1 1
113 1 . . . . . 5.5 1.9 5.5 1 1
114 1 . . . . . 4.51 1.9 4.51 1 1
115 1 . . . . . 5.5 1.9 5.5 1 1
116 1 . . . . . 4.51 1.9 4.51 1 1
117 1 . . . . . 4.51 1.9 4.51 1 1
118 1 . . . . . 3.7 1.9 3.7 1 1
119 1 . . . . . 5.5 1.9 5.5 1 1
120 1 . . . . . 3.04 1.9 3.04 1 1
121 1 . . . . . 3.04 1.9 3.04 1 1
122 1 . . . . . 2.5 1.9 2.5 1 1
123 1 . . . . . 3.35 1.9 3.35 1 1
124 1 . . . . . 3.7 1.9 3.7 1 1
125 1 . . . . . 4.51 1.9 4.51 1 1
126 1 . . . . . 2.5 1.9 2.5 1 1
127 1 . . . . . 4.08 1.9 4.08 1 1
128 1 . . . . . 4.51 1.9 4.51 1 1
129 1 . . . . . 5.5 1.9 5.5 1 1
130 1 . . . . . 3.35 1.9 3.35 1 1
131 1 . . . . . 4.08 1.9 4.08 1 1
132 1 . . . . . 4.97 1.9 4.97 1 1
133 1 . . . . . 4.51 1.9 4.51 1 1
134 1 . . . . . 3.35 1.9 3.35 1 1
135 1 . . . . . 4.08 1.9 4.08 1 1
136 1 . . . . . 2.75 1.9 2.75 1 1
137 1 . . . . . 5.5 1.9 5.5 1 1
138 1 . . . . . 5.5 1.9 5.5 1 1
139 1 . . . . . 2.5 1.9 2.5 1 1
140 1 . . . . . 4.51 1.9 4.51 1 1
141 1 . . . . . 4.51 1.9 4.51 1 1
142 1 . . . . . 2.75 1.9 2.75 1 1
143 1 . . . . . 4.97 1.9 4.97 1 1
144 1 . . . . . 4.51 1.9 4.51 1 1
145 1 . . . . . 4.97 1.9 4.97 1 1
146 1 . . . . . 3.35 1.9 3.35 1 1
147 1 . . . . . 3.7 1.9 3.7 1 1
148 1 . . . . . 4.97 1.9 4.97 1 1
149 1 . . . . . 2.75 1.9 2.75 1 1
150 1 . . . . . 2.5 1.9 2.5 1 1
151 1 . . . . . 4.51 1.9 4.51 1 1
152 1 . . . . . 3.7 1.9 3.7 1 1
153 1 . . . . . 5.5 1.9 5.5 1 1
154 1 . . . . . 4.08 1.9 4.08 1 1
155 1 . . . . . 5.5 1.9 5.5 1 1
156 1 . . . . . 3.35 1.9 3.35 1 1
157 1 . . . . . 4.97 1.9 4.97 1 1
158 1 . . . . . 3.7 1.9 3.7 1 1
159 1 . . . . . 5.5 1.9 5.5 1 1
160 1 . . . . . 3.35 1.9 3.35 1 1
161 1 . . . . . 4.08 1.9 4.08 1 1
162 1 . . . . . 3.7 1.9 3.7 1 1
163 1 . . . . . 4.08 1.9 4.08 1 1
164 1 . . . . . 4.08 1.9 4.08 1 1
165 1 . . . . . 3.04 1.9 3.04 1 1
166 1 . . . . . 4.97 1.9 4.97 1 1
167 1 . . . . . 4.08 1.9 4.08 1 1
168 1 . . . . . 3.35 1.9 3.35 1 1
169 1 . . . . . 4.51 1.9 4.51 1 1
170 1 . . . . . 3.7 1.9 3.7 1 1
171 1 . . . . . 4.51 1.9 4.51 1 1
172 1 . . . . . 3.04 1.9 3.04 1 1
173 1 . . . . . 4.51 1.9 4.51 1 1
174 1 . . . . . 2.5 1.9 2.5 1 1
175 1 . . . . . 3.04 1.9 3.04 1 1
176 1 . . . . . 4.08 1.9 4.08 1 1
177 1 . . . . . 4.08 1.9 4.08 1 1
178 1 . . . . . 3.04 1.9 3.04 1 1
179 1 . . . . . 3.04 1.9 3.04 1 1
180 1 . . . . . 5.5 1.9 5.5 1 1
181 1 . . . . . 3.04 1.9 3.04 1 1
182 1 . . . . . 4.08 1.9 4.08 1 1
183 1 . . . . . 4.51 1.9 4.51 1 1
184 1 . . . . . 3.04 1.9 3.04 1 1
185 1 . . . . . 2.75 1.9 2.75 1 1
186 1 . . . . . 4.97 1.9 4.97 1 1
187 1 . . . . . 3.35 1.9 3.35 1 1
188 1 . . . . . 3.35 1.9 3.35 1 1
189 1 . . . . . 2.5 1.9 2.5 1 1
190 1 . . . . . 5.5 1.9 5.5 1 1
191 1 . . . . . 4.51 1.9 4.51 1 1
192 1 . . . . . 2.5 1.9 2.5 1 1
193 1 . . . . . 2.5 1.9 2.5 1 1
194 1 . . . . . 2.75 1.9 2.75 1 1
195 1 . . . . . 3.04 1.9 3.04 1 1
196 1 . . . . . 4.08 1.9 4.08 1 1
197 1 . . . . . 2.5 1.9 2.5 1 1
198 1 . . . . . 2.5 1.9 2.5 1 1
199 1 . . . . . 2.5 1.9 2.5 1 1
200 1 . . . . . 4.08 1.9 4.08 1 1
201 1 . . . . . 4.08 1.9 4.08 1 1
202 1 . . . . . 3.04 1.9 3.04 1 1
203 1 . . . . . 2.5 1.9 2.5 1 1
204 1 . . . . . 3.7 1.9 3.7 1 1
205 1 . . . . . 3.7 1.9 3.7 1 1
206 1 . . . . . 5.5 1.9 5.5 1 1
207 1 . . . . . 3.7 1.9 3.7 1 1
208 1 . . . . . 4.97 1.9 4.97 1 1
209 1 . . . . . 3.35 1.9 3.35 1 1
210 1 . . . . . 3.7 1.9 3.7 1 1
211 1 . . . . . 2.5 1.9 2.5 1 1
212 1 . . . . . 2.75 1.9 2.75 1 1
213 1 . . . . . 3.35 1.9 3.35 1 1
214 1 . . . . . 3.7 1.9 3.7 1 1
215 1 . . . . . 4.51 1.9 4.51 1 1
216 1 . . . . . 2.5 1.9 2.5 1 1
217 1 . . . . . 3.04 1.9 3.04 1 1
218 1 . . . . . 4.08 1.9 4.08 1 1
219 1 . . . . . 4.97 1.9 4.97 1 1
220 1 . . . . . 4.08 1.9 4.08 1 1
221 1 . . . . . 3.7 1.9 3.7 1 1
222 1 . . . . . 2.5 1.9 2.5 1 1
223 1 . . . . . 4.51 1.9 4.51 1 1
224 1 . . . . . 3.35 1.9 3.35 1 1
225 1 . . . . . 2.75 1.9 2.75 1 1
226 1 . . . . . 3.7 1.9 3.7 1 1
227 1 . . . . . 3.04 1.9 3.04 1 1
228 1 . . . . . 3.35 1.9 3.35 1 1
229 1 . . . . . 3.04 1.9 3.04 1 1
230 1 . . . . . 4.51 1.9 4.51 1 1
231 1 . . . . . 4.51 1.9 4.51 1 1
232 1 . . . . . 5.5 1.9 5.5 1 1
233 1 . . . . . 2.5 1.9 2.5 1 1
234 1 . . . . . 4.51 1.9 4.51 1 1
235 1 . . . . . 3.7 1.9 3.7 1 1
236 1 . . . . . 5.5 1.9 5.5 1 1
237 1 . . . . . 4.51 1.9 4.51 1 1
238 1 . . . . . 2.75 1.9 2.75 1 1
239 1 . . . . . 2.5 1.9 2.5 1 1
240 1 . . . . . 3.7 1.9 3.7 1 1
241 1 . . . . . 3.35 1.9 3.35 1 1
242 1 . . . . . 5.5 1.9 5.5 1 1
243 1 . . . . . 4.51 1.9 4.51 1 1
244 1 . . . . . 2.75 1.9 2.75 1 1
245 1 . . . . . 2.5 1.9 2.5 1 1
246 1 . . . . . 4.08 1.9 4.08 1 1
247 1 . . . . . 2.75 1.9 2.75 1 1
248 1 . . . . . 2.5 1.9 2.5 1 1
249 1 . . . . . 4.97 1.9 4.97 1 1
250 1 . . . . . 2.5 1.9 2.5 1 1
251 1 . . . . . 2.5 1.9 2.5 1 1
252 1 . . . . . 3.35 1.9 3.35 1 1
253 1 . . . . . 3.04 1.9 3.04 1 1
254 1 . . . . . 3.7 1.9 3.7 1 1
255 1 . . . . . 3.04 1.9 3.04 1 1
256 1 . . . . . 4.51 1.9 4.51 1 1
257 1 . . . . . 2.5 1.9 2.5 1 1
258 1 . . . . . 4.51 1.9 4.51 1 1
259 1 . . . . . 4.97 1.9 4.97 1 1
260 1 . . . . . 3.35 1.9 3.35 1 1
261 1 . . . . . 2.5 1.9 2.5 1 1
262 1 . . . . . 4.51 1.9 4.51 1 1
263 1 . . . . . 3.04 1.9 3.04 1 1
264 1 . . . . . 4.08 1.9 4.08 1 1
265 1 . . . . . 2.5 1.9 2.5 1 1
266 1 . . . . . 4.51 1.9 4.51 1 1
267 1 . . . . . 4.08 1.9 4.08 1 1
268 1 . . . . . 3.7 1.9 3.7 1 1
269 1 . . . . . 4.97 1.9 4.97 1 1
270 1 . . . . . 4.51 1.9 4.51 1 1
271 1 . . . . . 3.35 1.9 3.35 1 1
272 1 . . . . . 4.08 1.9 4.08 1 1
273 1 . . . . . 2.75 1.9 2.75 1 1
274 1 . . . . . 5.5 1.9 5.5 1 1
275 1 . . . . . 5.5 1.9 5.5 1 1
276 1 . . . . . 2.5 1.9 2.5 1 1
277 1 . . . . . 2.5 1.9 2.5 1 1
278 1 . . . . . 4.51 1.9 4.51 1 1
279 1 . . . . . 3.7 1.9 3.7 1 1
280 1 . . . . . 4.08 1.9 4.08 1 1
281 1 . . . . . 3.35 1.9 3.35 1 1
282 1 . . . . . 3.04 1.9 3.04 1 1
283 1 . . . . . 3.35 1.9 3.35 1 1
284 1 . . . . . 2.75 1.9 2.75 1 1
285 1 . . . . . 4.97 1.9 4.97 1 1
286 1 . . . . . 2.5 1.9 2.5 1 1
287 1 . . . . . 3.35 1.9 3.35 1 1
288 1 . . . . . 3.35 1.9 3.35 1 1
289 1 . . . . . 4.51 1.9 4.51 1 1
290 1 . . . . . 4.97 1.9 4.97 1 1
291 1 . . . . . 3.7 1.9 3.7 1 1
292 1 . . . . . 4.51 1.9 4.51 1 1
293 1 . . . . . 5.5 1.9 5.5 1 1
294 1 . . . . . 2.5 1.9 2.5 1 1
295 1 . . . . . 4.51 1.9 4.51 1 1
296 1 . . . . . 3.35 1.9 3.35 1 1
297 1 . . . . . 4.51 1.9 4.51 1 1
298 1 . . . . . 4.08 1.9 4.08 1 1
299 1 . . . . . 4.08 1.9 4.08 1 1
300 1 . . . . . 3.04 1.9 3.04 1 1
301 1 . . . . . 3.04 1.9 3.04 1 1
302 1 . . . . . 3.7 1.9 3.7 1 1
303 1 . . . . . 4.97 1.9 4.97 1 1
304 1 . . . . . 4.08 1.9 4.08 1 1
305 1 . . . . . 3.04 1.9 3.04 1 1
306 1 . . . . . 3.7 1.9 3.7 1 1
307 1 . . . . . 3.35 1.9 3.35 1 1
308 1 . . . . . 2.75 1.9 2.75 1 1
309 1 . . . . . 2.5 1.9 2.5 1 1
310 1 . . . . . 4.51 1.9 4.51 1 1
311 1 . . . . . 2.5 1.9 2.5 1 1
312 1 . . . . . 4.97 1.9 4.97 1 1
313 1 . . . . . 3.04 1.9 3.04 1 1
314 1 . . . . . 4.08 1.9 4.08 1 1
315 1 . . . . . 2.75 1.9 2.75 1 1
316 1 . . . . . 3.04 1.9 3.04 1 1
317 1 . . . . . 4.08 1.9 4.08 1 1
318 1 . . . . . 4.97 1.9 4.97 1 1
319 1 . . . . . 2.75 1.9 2.75 1 1
320 1 . . . . . 3.7 1.9 3.7 1 1
321 1 . . . . . 3.7 1.9 3.7 1 1
322 1 . . . . . 3.04 1.9 3.04 1 1
323 1 . . . . . 3.04 1.9 3.04 1 1
324 1 . . . . . 3.7 1.9 3.7 1 1
325 1 . . . . . 4.97 1.9 4.97 1 1
326 1 . . . . . 4.51 1.9 4.51 1 1
327 1 . . . . . 3.04 1.9 3.04 1 1
328 1 . . . . . 2.5 1.9 2.5 1 1
329 1 . . . . . 2.5 1.9 2.5 1 1
330 1 . . . . . 2.75 1.9 2.75 1 1
331 1 . . . . . 3.04 1.9 3.04 1 1
332 1 . . . . . 3.35 1.9 3.35 1 1
333 1 . . . . . 2.75 1.9 2.75 1 1
334 1 . . . . . 3.7 1.9 3.7 1 1
335 1 . . . . . 2.5 1.9 2.5 1 1
336 1 . . . . . 3.04 1.9 3.04 1 1
337 1 . . . . . 3.35 1.9 3.35 1 1
338 1 . . . . . 2.5 1.9 2.5 1 1
339 1 . . . . . 4.08 1.9 4.08 1 1
340 1 . . . . . 5.5 1.9 5.5 1 1
341 1 . . . . . 4.51 1.9 4.51 1 1
342 1 . . . . . 5.5 1.9 5.5 1 1
343 1 . . . . . 3.35 1.9 3.35 1 1
344 1 . . . . . 4.51 1.9 4.51 1 1
345 1 . . . . . 4.97 1.9 4.97 1 1
346 1 . . . . . 4.97 1.9 4.97 1 1
347 1 . . . . . 5.5 1.9 5.5 1 1
348 1 . . . . . 3.04 1.9 3.04 1 1
349 1 . . . . . 3.04 1.9 3.04 1 1
350 1 . . . . . 3.35 1.9 3.35 1 1
351 1 . . . . . 3.35 1.9 3.35 1 1
352 1 . . . . . 2.5 1.9 2.5 1 1
353 1 . . . . . 4.51 1.9 4.51 1 1
354 1 . . . . . 2.75 1.9 2.75 1 1
355 1 . . . . . 4.97 1.9 4.97 1 1
356 1 . . . . . 4.97 1.9 4.97 1 1
357 1 . . . . . 3.7 1.9 3.7 1 1
358 1 . . . . . 2.5 1.9 2.5 1 1
359 1 . . . . . 4.08 1.9 4.08 1 1
360 1 . . . . . 3.35 1.9 3.35 1 1
361 1 . . . . . 4.08 1.9 4.08 1 1
362 1 . . . . . 2.5 1.9 2.5 1 1
363 1 . . . . . 4.51 1.9 4.51 1 1
364 1 . . . . . 4.51 1.9 4.51 1 1
365 1 . . . . . 3.7 1.9 3.7 1 1
366 1 . . . . . 2.75 1.9 2.75 1 1
367 1 . . . . . 3.35 1.9 3.35 1 1
368 1 . . . . . 2.5 1.9 2.5 1 1
369 1 . . . . . 2.5 1.9 2.5 1 1
370 1 . . . . . 3.04 1.9 3.04 1 1
371 1 . . . . . 4.51 1.9 4.51 1 1
372 1 . . . . . 4.08 1.9 4.08 1 1
373 1 . . . . . 2.5 1.9 2.5 1 1
374 1 . . . . . 2.5 1.9 2.5 1 1
375 1 . . . . . 2.5 1.9 2.5 1 1
376 1 . . . . . 3.35 1.9 3.35 1 1
377 1 . . . . . 3.7 1.9 3.7 1 1
378 1 . . . . . 3.04 1.9 3.04 1 1
379 1 . . . . . 2.5 1.9 2.5 1 1
380 1 . . . . . 3.04 1.9 3.04 1 1
381 1 . . . . . 2.5 1.9 2.5 1 1
382 1 . . . . . 4.51 1.9 4.51 1 1
383 1 . . . . . 2.75 1.9 2.75 1 1
384 1 . . . . . 2.5 1.9 2.5 1 1
385 1 . . . . . 3.35 1.9 3.35 1 1
386 1 . . . . . 3.35 1.9 3.35 1 1
387 1 . . . . . 2.5 1.9 2.5 1 1
388 1 . . . . . 3.04 1.9 3.04 1 1
389 1 . . . . . 2.5 1.9 2.5 1 1
390 1 . . . . . 4.97 1.9 4.97 1 1
391 1 . . . . . 2.75 1.9 2.75 1 1
392 1 . . . . . 2.5 1.9 2.5 1 1
393 1 . . . . . 2.75 1.9 2.75 1 1
394 1 . . . . . 2.5 1.9 2.5 1 1
395 1 . . . . . 2.5 1.9 2.5 1 1
396 1 . . . . . 4.51 1.9 4.51 1 1
397 1 . . . . . 3.35 1.9 3.35 1 1
398 1 . . . . . 3.04 1.9 3.04 1 1
399 1 . . . . . 2.5 1.9 2.5 1 1
400 1 . . . . . 4.51 1.9 4.51 1 1
401 1 . . . . . 4.51 1.9 4.51 1 1
402 1 . . . . . 5.5 1.9 5.5 1 1
403 1 . . . . . 2.75 1.9 2.75 1 1
404 1 . . . . . 4.08 1.9 4.08 1 1
405 1 . . . . . 5.5 1.9 5.5 1 1
406 1 . . . . . 6.0 2.4 6.0 1 1
407 1 . . . . . 5.5 1.9 5.5 1 1
408 1 . . . . . 5.5 1.9 5.5 1 1
409 1 . . . . . 3.35 1.9 3.35 1 1
410 1 . . . . . 3.35 1.9 3.35 1 1
411 1 . . . . . 6.0 2.4 6.0 1 1
412 1 . . . . . 6.0 2.4 6.0 1 1
413 1 . . . . . 6.0 2.4 6.0 1 1
414 1 . . . . . 3.04 1.9 3.04 1 1
415 1 . . . . . 6.0 2.4 6.0 1 1
416 1 . . . . . 6.0 2.4 6.0 1 1
417 1 . . . . . 6.0 2.4 6.0 1 1
418 1 . . . . . 3.04 1.9 3.04 1 1
419 1 . . . . . 6.0 2.4 6.0 1 1
420 1 . . . . . 2.5 1.9 2.5 1 1
421 1 . . . . . 6.0 2.4 6.0 1 1
422 1 . . . . . 6.0 2.4 6.0 1 1
423 1 . . . . . 6.0 2.4 6.0 1 1
424 1 . . . . . 6.0 2.4 6.0 1 1
425 1 . . . . . 5.5 1.9 5.5 1 1
426 1 . . . . . 6.0 2.4 6.0 1 1
427 1 . . . . . 4.51 1.9 4.51 1 1
428 1 . . . . . 6.0 2.4 6.0 1 1
429 1 . . . . . 3.04 1.9 3.04 1 1
430 1 . . . . . 6.0 2.4 6.0 1 1
431 1 . . . . . 6.0 2.4 6.0 1 1
432 1 . . . . . 6.0 2.4 6.0 1 1
433 1 . . . . . 6.0 2.4 6.0 1 1
434 1 . . . . . 6.0 2.4 6.0 1 1
435 1 . . . . . 3.35 1.9 3.35 1 1
436 1 . . . . . 6.0 2.4 6.0 1 1
437 1 . . . . . 3.04 1.9 3.04 1 1
438 1 . . . . . 5.5 1.9 5.5 1 1
439 1 . . . . . 6.0 2.4 6.0 1 1
440 1 . . . . . 5.5 1.9 5.5 1 1
441 1 . . . . . 6.0 2.4 6.0 1 1
442 1 . . . . . 3.7 1.9 3.7 1 1
443 1 . . . . . 6.0 2.4 6.0 1 1
444 1 . . . . . 6.0 2.4 6.0 1 1
445 1 . . . . . 6.0 2.4 6.0 1 1
446 1 . . . . . 5.5 1.9 5.5 1 1
447 1 . . . . . 2.5 1.9 2.5 1 1
448 1 . . . . . 4.51 1.9 4.51 1 1
449 1 . . . . . 6.0 2.4 6.0 1 1
450 1 . . . . . 6.0 2.4 6.0 1 1
451 1 . . . . . 5.5 1.9 5.5 1 1
452 1 . . . . . 5.5 1.9 5.5 1 1
453 1 . . . . . 6.0 2.4 6.0 1 1
454 1 . . . . . 4.51 1.9 4.51 1 1
455 1 . . . . . 6.0 2.4 6.0 1 1
456 1 . . . . . 4.51 1.9 4.51 1 1
457 1 . . . . . 2.75 1.9 2.75 1 1
458 1 . . . . . 6.0 2.4 6.0 1 1
459 1 . . . . . 6.0 2.4 6.0 1 1
460 1 . . . . . 6.0 2.4 6.0 1 1
461 1 . . . . . 6.0 2.4 6.0 1 1
462 1 . . . . . 6.0 2.4 6.0 1 1
463 1 . . . . . 6.0 2.4 6.0 1 1
464 1 . . . . . 6.0 2.4 6.0 1 1
465 1 . . . . . 5.5 1.9 5.5 1 1
466 1 . . . . . 6.0 2.4 6.0 1 1
467 1 . . . . . 6.0 2.4 6.0 1 1
468 1 . . . . . 6.0 2.4 6.0 1 1
469 1 . . . . . 6.0 2.4 6.0 1 1
470 1 . . . . . 6.0 2.4 6.0 1 1
471 1 . . . . . 4.51 1.9 4.51 1 1
472 1 . . . . . 6.0 2.4 6.0 1 1
473 1 . . . . . 5.5 1.9 5.5 1 1
474 1 . . . . . 5.5 1.9 5.5 1 1
475 1 . . . . . 6.0 2.4 6.0 1 1
476 1 . . . . . 6.0 2.4 6.0 1 1
477 1 . . . . . 6.0 2.4 6.0 1 1
478 1 . . . . . 6.0 2.4 6.0 1 1
479 1 . . . . . 6.0 2.4 6.0 1 1
480 1 . . . . . 3.35 1.9 3.35 1 1
481 1 . . . . . 2.5 1.9 2.5 1 1
482 1 . . . . . 6.0 2.4 6.0 1 1
483 1 . . . . . 6.0 2.4 6.0 1 1
484 1 . . . . . 6.0 2.4 6.0 1 1
485 1 . . . . . 6.0 2.4 6.0 1 1
486 1 . . . . . 5.5 1.9 5.5 1 1
487 1 . . . . . 4.51 1.9 4.51 1 1
488 1 . . . . . 6.0 2.4 6.0 1 1
489 1 . . . . . 4.51 1.9 4.51 1 1
490 1 . . . . . 3.04 1.9 3.04 1 1
491 1 . . . . . 6.0 2.4 6.0 1 1
492 1 . . . . . 6.0 2.4 6.0 1 1
493 1 . . . . . 6.0 2.4 6.0 1 1
494 1 . . . . . 6.0 2.4 6.0 1 1
495 1 . . . . . 6.0 2.4 6.0 1 1
496 1 . . . . . 4.51 1.9 4.51 1 1
497 1 . . . . . 3.7 1.9 3.7 1 1
498 1 . . . . . 6.0 2.4 6.0 1 1
499 1 . . . . . 3.35 1.9 3.35 1 1
500 1 . . . . . 6.0 2.4 6.0 1 1
501 1 . . . . . 6.0 2.4 6.0 1 1
502 1 . . . . . 3.7 1.9 3.7 1 1
503 1 . . . . . 6.0 2.4 6.0 1 1
504 1 . . . . . 6.0 2.4 6.0 1 1
505 1 . . . . . 6.0 2.4 6.0 1 1
506 1 . . . . . 2.75 1.9 2.75 1 1
507 1 . . . . . 6.0 2.4 6.0 1 1
508 1 . . . . . 4.51 1.9 4.51 1 1
509 1 . . . . . 4.51 1.9 4.51 1 1
510 1 . . . . . 4.51 1.9 4.51 1 1
511 1 . . . . . 6.0 2.4 6.0 1 1
512 1 . . . . . 5.5 1.9 5.5 1 1
513 1 . . . . . 3.35 1.9 3.35 1 1
514 1 . . . . . 6.0 2.4 6.0 1 1
515 1 . . . . . 6.0 2.4 6.0 1 1
516 1 . . . . . 6.0 2.4 6.0 1 1
517 1 . . . . . 3.35 1.9 3.35 1 1
518 1 . . . . . 5.5 1.9 5.5 1 1
519 1 . . . . . 5.5 1.9 5.5 1 1
520 1 . . . . . 6.0 2.4 6.0 1 1
521 1 . . . . . 6.0 2.4 6.0 1 1
522 1 . . . . . 6.0 2.4 6.0 1 1
523 1 . . . . . 6.0 2.4 6.0 1 1
524 1 . . . . . 6.0 2.4 6.0 1 1
525 1 . . . . . 6.0 2.4 6.0 1 1
526 1 . . . . . 6.0 2.4 6.0 1 1
527 1 . . . . . 6.0 2.4 6.0 1 1
528 1 . . . . . 6.0 2.4 6.0 1 1
529 1 . . . . . 6.0 2.4 6.0 1 1
530 1 . . . . . 3.7 1.9 3.7 1 1
531 1 . . . . . 5.5 1.9 5.5 1 1
532 1 . . . . . 4.51 1.9 4.51 1 1
533 1 . . . . . 6.0 2.4 6.0 1 1
534 1 . . . . . 6.0 2.4 6.0 1 1
535 1 . . . . . 6.0 2.4 6.0 1 1
536 1 . . . . . 6.0 2.4 6.0 1 1
537 1 . . . . . 6.0 2.4 6.0 1 1
538 1 . . . . . 6.0 2.4 6.0 1 1
539 1 . . . . . 3.7 1.9 3.7 1 1
540 1 . . . . . 4.51 1.9 4.51 1 1
541 1 . . . . . 3.7 1.9 3.7 1 1
542 1 . . . . . 6.0 2.4 6.0 1 1
543 1 . . . . . 6.0 2.4 6.0 1 1
544 1 . . . . . 6.0 2.4 6.0 1 1
545 1 . . . . . 6.0 2.4 6.0 1 1
546 1 . . . . . 6.0 2.4 6.0 1 1
547 1 . . . . . 3.7 1.9 3.7 1 1
548 1 . . . . . 4.51 1.9 4.51 1 1
549 1 . . . . . 6.0 2.4 6.0 1 1
550 1 . . . . . 6.0 2.4 6.0 1 1
551 1 . . . . . 5.5 1.9 5.5 1 1
552 1 . . . . . 6.0 2.4 6.0 1 1
553 1 . . . . . 5.5 1.9 5.5 1 1
554 1 . . . . . 6.0 2.4 6.0 1 1
555 1 . . . . . 5.5 1.9 5.5 1 1
556 1 . . . . . 3.7 1.9 3.7 1 1
557 1 . . . . . 6.0 2.4 6.0 1 1
558 1 . . . . . 6.0 2.4 6.0 1 1
559 1 . . . . . 5.5 1.9 5.5 1 1
560 1 . . . . . 3.7 1.9 3.7 1 1
561 1 . . . . . 6.0 2.4 6.0 1 1
562 1 . . . . . 3.7 1.9 3.7 1 1
563 1 . . . . . 6.0 2.4 6.0 1 1
564 1 . . . . . 5.5 1.9 5.5 1 1
565 1 . . . . . 6.0 2.4 6.0 1 1
566 1 . . . . . 5.5 1.9 5.5 1 1
567 1 . . . . . 6.0 2.4 6.0 1 1
568 1 . . . . . 2.5 1.9 2.5 1 1
569 1 . . . . . 6.0 2.4 6.0 1 1
570 1 . . . . . 6.0 2.4 6.0 1 1
571 1 . . . . . 4.51 1.9 4.51 1 1
572 1 . . . . . 4.51 1.9 4.51 1 1
573 1 . . . . . 5.5 1.9 5.5 1 1
574 1 . . . . . 3.04 1.9 3.04 1 1
575 1 . . . . . 6.0 2.4 6.0 1 1
576 1 . . . . . 6.0 2.4 6.0 1 1
577 1 . . . . . 6.0 2.4 6.0 1 1
578 1 . . . . . 4.51 1.9 4.51 1 1
579 1 . . . . . 6.0 2.4 6.0 1 1
580 1 . . . . . 6.0 2.4 6.0 1 1
581 1 . . . . . 2.75 1.9 2.75 1 1
582 1 . . . . . 6.0 2.4 6.0 1 1
583 1 . . . . . 5.5 1.9 5.5 1 1
584 1 . . . . . 5.5 1.9 5.5 1 1
585 1 . . . . . 6.0 2.4 6.0 1 1
586 1 . . . . . 6.0 2.4 6.0 1 1
587 1 . . . . . 6.0 2.4 6.0 1 1
588 1 . . . . . 6.0 2.4 6.0 1 1
589 1 . . . . . 6.0 2.4 6.0 1 1
590 1 . . . . . 2.5 1.9 2.5 1 1
591 1 . . . . . 3.35 1.9 3.35 1 1
592 1 . . . . . 4.51 1.9 4.51 1 1
593 1 . . . . . 6.0 2.4 6.0 1 1
594 1 . . . . . 4.51 1.9 4.51 1 1
595 1 . . . . . 6.0 2.4 6.0 1 1
596 1 . . . . . 6.0 2.4 6.0 1 1
597 1 . . . . . 6.0 2.4 6.0 1 1
598 1 . . . . . 4.51 1.9 4.51 1 1
599 1 . . . . . 6.0 2.4 6.0 1 1
600 1 . . . . . 3.7 1.9 3.7 1 1
601 1 . . . . . 6.0 2.4 6.0 1 1
602 1 . . . . . 6.0 2.4 6.0 1 1
603 1 . . . . . 6.0 2.4 6.0 1 1
604 1 . . . . . 4.51 1.9 4.51 1 1
605 1 . . . . . 4.51 1.9 4.51 1 1
606 1 . . . . . 6.0 2.4 6.0 1 1
607 1 . . . . . 6.0 2.4 6.0 1 1
608 1 . . . . . 6.0 2.4 6.0 1 1
609 1 . . . . . 6.0 2.4 6.0 1 1
610 1 . . . . . 5.5 1.9 5.5 1 1
611 1 . . . . . 6.0 2.4 6.0 1 1
612 1 . . . . . 6.0 2.4 6.0 1 1
613 1 . . . . . 5.5 1.9 5.5 1 1
614 1 . . . . . 5.5 1.9 5.5 1 1
615 1 . . . . . 6.0 2.4 6.0 1 1
616 1 . . . . . 4.51 1.9 4.51 1 1
617 1 . . . . . 5.5 1.9 5.5 1 1
618 1 . . . . . 3.7 1.9 3.7 1 1
619 1 . . . . . 6.0 2.4 6.0 1 1
620 1 . . . . . 6.0 2.4 6.0 1 1
621 1 . . . . . 6.0 2.4 6.0 1 1
622 1 . . . . . 4.51 1.9 4.51 1 1
623 1 . . . . . 3.35 1.9 3.35 1 1
624 1 . . . . . 3.7 1.9 3.7 1 1
625 1 . . . . . 6.0 2.4 6.0 1 1
626 1 . . . . . 3.7 1.9 3.7 1 1
627 1 . . . . . 6.0 2.4 6.0 1 1
628 1 . . . . . 3.7 1.9 3.7 1 1
629 1 . . . . . 4.08 1.9 4.08 1 1
630 1 . . . . . 4.51 1.9 4.51 1 1
631 1 . . . . . 5.5 1.9 5.5 1 1
632 1 . . . . . 5.5 1.9 5.5 1 1
633 1 . . . . . 4.51 1.9 4.51 1 1
634 1 . . . . . 3.7 1.9 3.7 1 1
635 1 . . . . . 3.04 1.9 3.04 1 1
636 1 . . . . . 4.51 1.9 4.51 1 1
637 1 . . . . . 4.51 1.9 4.51 1 1
638 1 . . . . . 3.7 1.9 3.7 1 1
639 1 . . . . . 2.75 1.9 2.75 1 1
640 1 . . . . . 4.51 1.9 4.51 1 1
641 1 . . . . . 3.35 1.9 3.35 1 1
642 1 . . . . . 4.97 1.9 4.97 1 1
643 1 . . . . . 4.97 1.9 4.97 1 1
644 1 . . . . . 5.5 1.9 5.5 1 1
645 1 . . . . . 4.97 1.9 4.97 1 1
646 1 . . . . . 3.35 1.9 3.35 1 1
647 1 . . . . . 5.5 1.9 5.5 1 1
648 1 . . . . . 4.08 1.9 4.08 1 1
649 1 . . . . . 5.5 1.9 5.5 1 1
650 1 . . . . . 5.5 1.9 5.5 1 1
651 1 . . . . . 5.5 1.9 5.5 1 1
652 1 . . . . . 5.5 1.9 5.5 1 1
653 1 . . . . . 4.97 1.9 4.97 1 1
654 1 . . . . . 5.5 1.9 5.5 1 1
655 1 . . . . . 4.08 1.9 4.08 1 1
656 1 . . . . . 4.51 1.9 4.51 1 1
657 1 . . . . . 3.35 1.9 3.35 1 1
658 1 . . . . . 5.5 1.9 5.5 1 1
659 1 . . . . . 4.97 1.9 4.97 1 1
660 1 . . . . . 4.97 1.9 4.97 1 1
661 1 . . . . . 5.5 1.9 5.5 1 1
662 1 . . . . . 5.5 1.9 5.5 1 1
663 1 . . . . . 4.97 1.9 4.97 1 1
664 1 . . . . . 3.35 1.9 3.35 1 1
665 1 . . . . . 5.5 1.9 5.5 1 1
666 1 . . . . . 5.5 1.9 5.5 1 1
667 1 . . . . . 4.97 1.9 4.97 1 1
668 1 . . . . . 2.75 1.9 2.75 1 1
669 1 . . . . . 5.5 1.9 5.5 1 1
670 1 . . . . . 4.97 1.9 4.97 1 1
671 1 . . . . . 4.97 1.9 4.97 1 1
672 1 . . . . . 2.5 1.9 2.5 1 1
673 1 . . . . . 2.5 1.9 2.5 1 1
674 1 . . . . . 4.08 1.9 4.08 1 1
675 1 . . . . . 3.7 1.9 3.7 1 1
676 1 . . . . . 5.5 1.9 5.5 1 1
677 1 . . . . . 2.5 1.9 2.5 1 1
678 1 . . . . . 4.51 1.9 4.51 1 1
679 1 . . . . . 4.97 1.9 4.97 1 1
680 1 . . . . . 2.5 1.9 2.5 1 1
681 1 . . . . . 5.5 1.9 5.5 1 1
682 1 . . . . . 2.5 1.9 2.5 1 1
683 1 . . . . . 3.04 1.9 3.04 1 1
684 1 . . . . . 4.97 1.9 4.97 1 1
685 1 . . . . . 4.97 1.9 4.97 1 1
686 1 . . . . . 4.97 1.9 4.97 1 1
687 1 . . . . . 2.5 1.9 2.5 1 1
688 1 . . . . . 2.75 1.9 2.75 1 1
689 1 . . . . . 2.75 1.9 2.75 1 1
690 1 . . . . . 5.5 1.9 5.5 1 1
691 1 . . . . . 5.5 1.9 5.5 1 1
692 1 . . . . . 3.35 1.9 3.35 1 1
693 1 . . . . . 3.04 1.9 3.04 1 1
694 1 . . . . . 5.5 1.9 5.5 1 1
695 1 . . . . . 2.75 1.9 2.75 1 1
696 1 . . . . . 5.5 1.9 5.5 1 1
697 1 . . . . . 5.5 1.9 5.5 1 1
698 1 . . . . . 2.5 1.9 2.5 1 1
699 1 . . . . . 5.5 1.9 5.5 1 1
700 1 . . . . . 2.5 1.9 2.5 1 1
701 1 . . . . . 3.7 1.9 3.7 1 1
702 1 . . . . . 3.35 1.9 3.35 1 1
703 1 . . . . . 3.04 1.9 3.04 1 1
704 1 . . . . . 4.51 1.9 4.51 1 1
705 1 . . . . . 2.5 1.9 2.5 1 1
706 1 . . . . . 2.5 1.9 2.5 1 1
707 1 . . . . . 5.5 1.9 5.5 1 1
708 1 . . . . . 5.5 1.9 5.5 1 1
709 1 . . . . . 5.5 1.9 5.5 1 1
710 1 . . . . . 5.5 1.9 5.5 1 1
711 1 . . . . . 4.08 1.9 4.08 1 1
712 1 . . . . . 5.5 1.9 5.5 1 1
713 1 . . . . . 4.08 1.9 4.08 1 1
714 1 . . . . . 3.35 1.9 3.35 1 1
715 1 . . . . . 4.51 1.9 4.51 1 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 2
2 1 . . . 1 2
3 1 . . . 1 2
4 1 . . . 1 2
5 1 . . . 1 2
6 1 . . . 1 2
7 1 . . . 1 2
8 1 . . . 1 2
9 1 . . . 1 2
10 1 . . . 1 2
11 1 . . . 1 2
12 1 . . . 1 2
13 1 . . . 1 2
14 1 . . . 1 2
15 1 . . . 1 2
16 1 . . . 1 2
17 1 . . . 1 2
18 1 . . . 1 2
19 1 . . . 1 2
20 1 . . . 1 2
21 1 . . . 1 2
22 1 . . . 1 2
23 1 . . . 1 2
24 1 . . . 1 2
25 1 . . . 1 2
26 1 . . . 1 2
27 1 . . . 1 2
28 1 . . . 1 2
29 1 . . . 1 2
30 1 . . . 1 2
31 1 . . . 1 2
32 1 . . . 1 2
33 1 . . . 1 2
34 1 . . . 1 2
35 1 . . . 1 2
36 1 . . . 1 2
37 1 . . . 1 2
38 1 . . . 1 2
39 1 . . . 1 2
40 1 . . . 1 2
41 1 . . . 1 2
42 1 . . . 1 2
43 1 . . . 1 2
44 1 . . . 1 2
45 1 . . . 1 2
46 1 . . . 1 2
47 1 . . . 1 2
48 1 . . . 1 2
49 1 . . . 1 2
50 1 . . . 1 2
51 1 . . . 1 2
52 1 . . . 1 2
53 1 . . . 1 2
54 1 . . . 1 2
55 1 . . . 1 2
56 1 . . . 1 2
57 1 . . . 1 2
58 1 . . . 1 2
59 1 . . . 1 2
60 1 . . . 1 2
61 1 . . . 1 2
62 1 . . . 1 2
63 1 . . . 1 2
64 1 . . . 1 2
65 1 . . . 1 2
66 1 . . . 1 2
67 1 . . . 1 2
68 1 . . . 1 2
69 1 . . . 1 2
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 30 TRP HD1 . 586 . HD1 1 2
1 1 1 1 1 66 ASN QD . 622 . HD2+ 1 2
1 1 2 1 1 30 TRP HE1 . 586 . HE1 1 2
2 1 1 1 1 50 LEU H . 606 . HN 1 2
2 1 2 1 1 50 LEU QB . 606 . HB+ 1 2
2 1 2 1 1 50 LEU HG . 606 . HG 1 2
3 1 1 1 1 32 VAL QG . 588 . HG++ 1 2
3 1 1 1 1 57 VAL MG1 . 613 . HG1+ 1 2
3 1 2 1 1 34 LEU H . 590 . HN 1 2
4 1 1 1 1 35 GLY H . 591 . HN 1 2
4 1 1 1 1 57 VAL H . 613 . HN 1 2
4 1 2 1 1 36 LEU H . 592 . HN 1 2
5 1 1 1 1 42 VAL MG1 . 598 . HG1+ 1 2
5 1 1 1 1 57 VAL MG2 . 613 . HG2+ 1 2
5 1 2 1 1 56 THR H . 612 . HN 1 2
6 1 1 1 1 4 CYS QB . 560 . HB+ 1 2
6 1 2 1 1 25 SER H . 581 . HN 1 2
6 1 2 1 1 85 CYS H . 641 . HN 1 2
7 1 1 1 1 24 VAL HB . 580 . HB 1 2
7 1 1 1 1 84 THR MG . 640 . HG2+ 1 2
7 1 2 1 1 25 SER H . 581 . HN 1 2
7 1 2 1 1 85 CYS H . 641 . HN 1 2
8 1 1 1 1 42 VAL H . 598 . HN 1 2
8 1 2 1 1 53 SER HA . 609 . HA 1 2
8 1 2 1 1 54 SER HA . 610 . HA 1 2
9 1 1 1 1 49 ALA HA . 605 . HA 1 2
9 1 1 1 1 60 ARG HA . 616 . HA 1 2
9 1 2 1 1 60 ARG H . 616 . HN 1 2
10 1 1 1 1 40 GLN HA . 596 . HA 1 2
10 1 1 1 1 74 LYS HA . 630 . HA 1 2
10 1 2 1 1 73 TYR H . 629 . HN 1 2
11 1 1 1 1 18 PHE QR . 574 . HD+ 1 2
11 1 2 1 1 20 VAL H . 576 . HN 1 2
12 1 1 1 1 74 LYS H . 630 . HN 1 2
12 1 2 1 1 74 LYS QB . 630 . HB+ 1 2
12 1 2 1 1 74 LYS QD . 630 . HD+ 1 2
13 1 1 1 1 13 GLU H . 569 . HN 1 2
13 1 1 1 1 19 ASN QD . 575 . HD2+ 1 2
13 1 2 1 1 19 ASN H . 575 . HN 1 2
14 1 1 1 1 12 GLU QG . 568 . HG+ 1 2
14 1 1 1 1 13 GLU QB . 569 . HB+ 1 2
14 1 2 1 1 13 GLU H . 569 . HN 1 2
15 1 1 1 1 51 THR H . 607 . HN 1 2
15 1 2 1 1 52 GLY QA . 608 . HA+ 1 2
15 1 2 1 1 58 THR HB . 614 . HB 1 2
16 1 1 1 1 50 LEU QB . 606 . HB+ 1 2
16 1 1 1 1 50 LEU HG . 606 . HG 1 2
16 1 2 1 1 51 THR H . 607 . HN 1 2
17 1 1 1 1 26 GLY QA . 582 . HA+ 1 2
17 1 1 1 1 27 SER HA . 583 . HA 1 2
17 1 2 1 1 28 SER H . 584 . HN 1 2
18 1 1 1 1 27 SER QB . 583 . HB+ 1 2
18 1 1 1 1 28 SER QB . 584 . HB+ 1 2
18 1 2 1 1 28 SER H . 584 . HN 1 2
19 1 1 1 1 36 LEU HB3 . 592 . HB1 1 2
19 1 1 1 1 81 PRO QB . 637 . HB+ 1 2
19 1 2 1 1 37 ASN H . 593 . HN 1 2
20 1 1 1 1 31 VAL H . 587 . HN 1 2
20 1 2 1 1 31 VAL HB . 587 . HB 1 2
20 1 2 1 1 32 VAL HB . 588 . HB 1 2
21 1 1 1 1 50 LEU QB . 606 . HB+ 1 2
21 1 1 1 1 50 LEU HG . 606 . HG 1 2
21 1 2 1 1 58 THR H . 614 . HN 1 2
22 1 1 1 1 4 CYS H . 560 . HN 1 2
22 1 2 1 1 5 SER HA . 561 . HA 1 2
22 1 2 1 1 86 ALA HA . 642 . HA 1 2
23 1 1 1 1 74 LYS QB . 630 . HB+ 1 2
23 1 1 1 1 74 LYS QD . 630 . HD+ 1 2
23 1 2 1 1 77 SER H . 633 . HN 1 2
24 1 1 1 1 17 ARG QD . 573 . HD+ 1 2
24 1 1 1 1 72 PHE HB3 . 628 . HB1 1 2
24 1 2 1 1 18 PHE H . 574 . HN 1 2
25 1 1 1 1 17 ARG QG . 573 . HG+ 1 2
25 1 1 1 1 72 PHE HB2 . 628 . HB2 1 2
25 1 2 1 1 18 PHE H . 574 . HN 1 2
26 1 1 1 1 42 VAL MG1 . 598 . HG1+ 1 2
26 1 1 1 1 57 VAL MG2 . 613 . HG2+ 1 2
26 1 2 1 1 54 SER H . 610 . HN 1 2
27 1 1 1 1 4 CYS H . 560 . HN 1 2
27 1 1 1 1 26 GLY H . 582 . HN 1 2
27 1 2 1 1 5 SER H . 561 . HN 1 2
28 1 1 1 1 9 VAL HB . 565 . HB 1 2
28 1 1 1 1 10 ARG QG . 566 . HG+ 1 2
28 1 2 1 1 11 GLY H . 567 . HN 1 2
29 1 1 1 1 74 LYS QB . 630 . HB+ 1 2
29 1 1 1 1 74 LYS QD . 630 . HD+ 1 2
29 1 2 1 1 75 ASN H . 631 . HN 1 2
30 1 1 1 1 45 SER QB . 601 . HB+ 1 2
30 1 1 1 1 47 ASN QB . 603 . HB+ 1 2
30 1 2 1 1 48 ALA H . 604 . HN 1 2
31 1 1 1 1 6 VAL QG . 562 . HG++ 1 2
31 1 1 1 1 32 VAL QG . 588 . HG++ 1 2
31 1 2 1 1 84 THR H . 640 . HN 1 2
32 1 1 1 1 25 SER QB . 581 . HB+ 1 2
32 1 1 1 1 26 GLY QA . 582 . HA+ 1 2
32 1 2 1 1 26 GLY H . 582 . HN 1 2
33 1 1 1 1 33 THR HB . 589 . HB 1 2
33 1 1 1 1 36 LEU HA . 592 . HA 1 2
33 1 2 1 1 35 GLY H . 591 . HN 1 2
34 1 1 1 1 42 VAL HA . 598 . HA 1 2
34 1 1 1 1 45 SER QB . 601 . HB+ 1 2
34 1 2 1 1 44 SER H . 600 . HN 1 2
35 1 1 1 1 42 VAL MG2 . 598 . HG2+ 1 2
35 1 1 1 1 71 THR MG . 627 . HG2+ 1 2
35 1 2 1 1 44 SER H . 600 . HN 1 2
36 1 1 1 1 36 LEU HA . 592 . HA 1 2
36 1 1 1 1 77 SER QB . 633 . HB+ 1 2
36 1 2 1 1 40 GLN QE . 596 . HE2+ 1 2
37 1 1 1 1 45 SER QB . 601 . HB+ 1 2
37 1 1 1 1 47 ASN QB . 603 . HB+ 1 2
37 1 2 1 1 69 GLY H . 625 . HN 1 2
38 1 1 1 1 48 ALA MB . 604 . HB+ 1 2
38 1 1 1 1 70 VAL QG . 626 . HG++ 1 2
38 1 2 1 1 69 GLY H . 625 . HN 1 2
39 1 1 1 1 17 ARG QD . 573 . HD+ 1 2
39 1 1 1 1 72 PHE HB3 . 628 . HB1 1 2
39 1 2 1 1 72 PHE H . 628 . HN 1 2
40 1 1 1 1 9 VAL MG2 . 565 . HG2+ 1 2
40 1 1 1 1 22 TYR HB2 . 578 . HB2 1 2
40 1 2 1 1 23 SER H . 579 . HN 1 2
41 1 1 1 1 80 THR H . 636 . HN 1 2
41 1 2 1 1 80 THR HA . 636 . HA 1 2
41 1 2 1 1 80 THR HB . 636 . HB 1 2
42 1 1 1 1 18 PHE QR . 574 . HD+ 1 2
42 1 2 1 1 74 LYS H . 630 . HN 1 2
43 1 1 1 1 74 LYS QB . 630 . HB+ 1 2
43 1 1 1 1 74 LYS QD . 630 . HD+ 1 2
43 1 2 1 1 76 GLY H . 632 . HN 1 2
44 1 1 1 1 5 SER H . 561 . HN 1 2
44 1 1 1 1 6 VAL H . 562 . HN 1 2
44 1 2 1 1 85 CYS HB2 . 641 . HB2 1 2
45 1 1 1 1 76 GLY QA . 632 . HA+ 1 2
45 1 1 1 1 77 SER QB . 633 . HB+ 1 2
45 1 2 1 1 77 SER H . 633 . HN 1 2
46 1 1 1 1 70 VAL QG . 626 . HG++ 1 2
46 1 1 1 1 81 PRO QG . 637 . HG++ 1 2
46 1 2 1 1 72 PHE HZ . 628 . HZ 1 2
47 1 1 1 1 70 VAL QG . 626 . HG++ 1 2
47 1 1 1 1 81 PRO QG . 637 . HG++ 1 2
47 1 2 1 1 72 PHE QE . 628 . HE+ 1 2
48 1 1 1 1 70 VAL QG . 626 . HG++ 1 2
48 1 1 1 1 81 PRO QG . 637 . HG++ 1 2
48 1 2 1 1 72 PHE QD . 628 . HD+ 1 2
49 1 1 1 1 53 SER HA . 609 . HA 1 2
49 1 1 1 1 54 SER HA . 610 . HA 1 2
49 1 2 1 1 54 SER H . 610 . HN 1 2
50 1 1 1 1 31 VAL HB . 587 . HB 1 2
50 1 1 1 1 32 VAL HB . 588 . HB 1 2
50 1 2 1 1 32 VAL H . 588 . HN 1 2
51 1 1 1 1 26 GLY QA . 582 . HA+ 1 2
51 1 1 1 1 27 SER HA . 583 . HA 1 2
51 1 2 1 1 27 SER H . 583 . HN 1 2
52 1 1 1 1 42 VAL MG1 . 598 . HG1+ 1 2
52 1 1 1 1 57 VAL MG2 . 613 . HG2+ 1 2
52 1 2 1 1 72 PHE QE . 628 . HE+ 1 2
53 1 1 1 1 57 VAL MG1 . 613 . HG1+ 1 2
53 1 1 1 1 70 VAL QG . 626 . HG++ 1 2
53 1 2 1 1 72 PHE QE . 628 . HE+ 1 2
54 1 1 1 1 50 LEU QB . 606 . HB+ 1 2
54 1 1 1 1 50 LEU HG . 606 . HG 1 2
54 1 2 1 1 50 LEU QD . 606 . HD++ 1 2
55 1 1 1 1 21 THR MG . 577 . HG2+ 1 2
55 1 2 1 1 23 SER HB3 . 579 . HB1 1 2
55 1 2 1 1 67 SER QB . 623 . HB+ 1 2
56 1 1 1 1 6 VAL QG . 562 . HG++ 1 2
56 1 1 1 1 32 VAL QG . 588 . HG++ 1 2
56 1 2 1 1 83 ALA MB . 639 . HB+ 1 2
57 1 1 1 1 6 VAL QG . 562 . HG++ 1 2
57 1 1 1 1 32 VAL QG . 588 . HG++ 1 2
57 1 2 1 1 85 CYS HA . 641 . HA 1 2
58 1 1 1 1 6 VAL QG . 562 . HG++ 1 2
58 1 1 1 1 32 VAL QG . 588 . HG++ 1 2
58 1 2 1 1 84 THR HA . 640 . HA 1 2
59 1 1 1 1 8 ALA HA . 564 . HA 1 2
59 1 2 1 1 9 VAL MG2 . 565 . HG2+ 1 2
59 1 2 1 1 22 TYR HB2 . 578 . HB2 1 2
60 1 1 1 1 22 TYR HB2 . 578 . HB2 1 2
60 1 2 1 1 22 TYR QD . 578 . HD+ 1 2
60 1 2 1 1 68 PHE HZ . 624 . HZ 1 2
61 1 1 1 1 74 LYS HA . 630 . HA 1 2
61 1 2 1 1 74 LYS QB . 630 . HB+ 1 2
61 1 2 1 1 74 LYS QD . 630 . HD+ 1 2
62 1 1 1 1 45 SER QB . 601 . HB+ 1 2
62 1 1 1 1 52 GLY QA . 608 . HA+ 1 2
62 1 2 1 1 50 LEU QD . 606 . HD++ 1 2
63 1 1 1 1 12 GLU HB2 . 568 . HB2 1 2
63 1 1 1 1 81 PRO QG . 637 . HG+ 1 2
63 1 2 1 1 14 TRP HH2 . 570 . HH2 1 2
63 1 2 1 1 18 PHE QE . 574 . HE+ 1 2
64 1 1 1 1 4 CYS QB . 560 . HB+ 1 2
64 1 1 1 1 40 GLN HG2 . 596 . HG2 1 2
64 1 2 1 1 31 VAL QG . 587 . HG++ 1 2
64 1 2 1 1 36 LEU QD . 592 . HD++ 1 2
65 1 1 1 1 9 VAL MG1 . 565 . HG1+ 1 2
65 1 1 1 1 31 VAL QG . 587 . HG++ 1 2
65 1 2 1 1 22 TYR HA . 578 . HA 1 2
65 1 2 1 1 30 TRP HA . 586 . HA 1 2
66 1 1 1 1 19 ASN HB2 . 575 . HB2 1 2
66 1 1 1 1 85 CYS HB2 . 641 . HB2 1 2
66 1 2 1 1 71 THR HA . 627 . HA 1 2
66 1 2 1 1 85 CYS HA . 641 . HA 1 2
67 1 1 1 1 30 TRP HA . 586 . HA 1 2
67 1 1 1 1 45 SER HA . 601 . HA 1 2
67 1 2 1 1 30 TRP QB . 586 . HB+ 1 2
67 1 2 1 1 46 TRP HB3 . 602 . HB1 1 2
68 1 1 1 1 51 THR HB . 607 . HB 1 2
68 1 1 1 1 79 ALA HA . 635 . HA 1 2
68 1 2 1 1 51 THR MG . 607 . HG2+ 1 2
68 1 2 1 1 79 ALA MB . 635 . HB+ 1 2
69 1 1 1 1 2 GLY HA3 . 558 . HA1 1 2
69 1 1 1 1 82 GLY QA . 638 . HA+ 1 2
69 1 2 1 1 83 ALA MB . 639 . HB+ 1 2
69 1 2 1 1 87 THR MG . 643 . HG2+ 1 2
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.5 1.9 2.5 1 2
2 1 . . . . . 2.5 1.9 2.5 1 2
3 1 . . . . . 5.5 1.9 5.5 1 2
4 1 . . . . . 5.5 1.9 5.5 1 2
5 1 . . . . . 6.0 2.4 6.0 1 2
6 1 . . . . . 6.0 2.4 6.0 1 2
7 1 . . . . . 3.35 1.9 3.35 1 2
8 1 . . . . . 3.7 1.9 3.7 1 2
9 1 . . . . . 3.7 1.9 3.7 1 2
10 1 . . . . . 6.0 2.4 6.0 1 2
11 1 . . . . . 6.0 2.4 6.0 1 2
12 1 . . . . . 3.7 1.9 3.7 1 2
13 1 . . . . . 6.0 2.4 6.0 1 2
14 1 . . . . . 3.04 1.9 3.04 1 2
15 1 . . . . . 6.0 2.4 6.0 1 2
16 1 . . . . . 2.75 1.9 2.75 1 2
17 1 . . . . . 3.7 1.9 3.7 1 2
18 1 . . . . . 4.51 1.9 4.51 1 2
19 1 . . . . . 3.35 1.9 3.35 1 2
20 1 . . . . . 3.04 1.9 3.04 1 2
21 1 . . . . . 6.0 2.4 6.0 1 2
22 1 . . . . . 6.0 2.4 6.0 1 2
23 1 . . . . . 5.5 1.9 5.5 1 2
24 1 . . . . . 6.0 2.4 6.0 1 2
25 1 . . . . . 3.35 1.9 3.35 1 2
26 1 . . . . . 3.35 1.9 3.35 1 2
27 1 . . . . . 5.5 1.9 5.5 1 2
28 1 . . . . . 3.04 1.9 3.04 1 2
29 1 . . . . . 3.35 1.9 3.35 1 2
30 1 . . . . . 6.0 2.4 6.0 1 2
31 1 . . . . . 3.35 1.9 3.35 1 2
32 1 . . . . . 3.04 1.9 3.04 1 2
33 1 . . . . . 6.0 2.4 6.0 1 2
34 1 . . . . . 4.51 1.9 4.51 1 2
35 1 . . . . . 4.51 1.9 4.51 1 2
36 1 . . . . . 6.0 2.4 6.0 1 2
37 1 . . . . . 4.51 1.9 4.51 1 2
38 1 . . . . . 5.5 1.9 5.5 1 2
39 1 . . . . . 5.5 1.9 5.5 1 2
40 1 . . . . . 5.5 1.9 5.5 1 2
41 1 . . . . . 2.5 1.9 2.5 1 2
42 1 . . . . . 6.0 2.4 6.0 1 2
43 1 . . . . . 5.5 1.9 5.5 1 2
44 1 . . . . . 4.97 1.9 4.97 1 2
45 1 . . . . . 3.7 1.9 3.7 1 2
46 1 . . . . . 3.35 1.9 3.35 1 2
47 1 . . . . . 3.04 1.9 3.04 1 2
48 1 . . . . . 3.7 1.9 3.7 1 2
49 1 . . . . . 3.04 1.9 3.04 1 2
50 1 . . . . . 3.04 1.9 3.04 1 2
51 1 . . . . . 3.7 1.9 3.7 1 2
52 1 . . . . . 5.5 1.9 5.5 1 2
53 1 . . . . . 4.97 1.9 4.97 1 2
54 1 . . . . . 2.5 1.9 2.5 1 2
55 1 . . . . . 4.08 1.9 4.08 1 2
56 1 . . . . . 2.5 1.9 2.5 1 2
57 1 . . . . . 3.35 1.9 3.35 1 2
58 1 . . . . . 3.35 1.9 3.35 1 2
59 1 . . . . . 4.97 1.9 4.97 1 2
60 1 . . . . . 2.75 1.9 2.75 1 2
61 1 . . . . . 3.7 1.9 3.7 1 2
62 1 . . . . . 4.51 1.9 4.51 1 2
63 1 . . . . . 4.08 1.9 4.08 1 2
64 1 . . . . . 5.5 1.9 5.5 1 2
65 1 . . . . . 3.7 1.9 3.7 1 2
66 1 . . . . . 5.5 1.9 5.5 1 2
67 1 . . . . . 3.04 1.9 3.04 1 2
68 1 . . . . . 2.5 1.9 2.5 1 2
69 1 . . . . . 3.7 1.9 3.7 1 2
stop_
save_
save_CNS/XPLOR_distance_constraints_6_1
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID 1
_Distance_constraint_list.ID 3
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID .
_Distance_constraint_list.Block_ID .
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . 1 3
2 1 . . . 1 3
3 1 . . . 1 3
4 1 . . . 1 3
5 1 . . . 1 3
6 1 . . . 1 3
7 1 . . . 1 3
8 1 . . . 1 3
9 1 . . . 1 3
10 1 . . . 1 3
11 1 . . . 1 3
12 1 . . . 1 3
13 1 . . . 1 3
14 1 . . . 1 3
15 1 . . . 1 3
16 1 . . . 1 3
17 1 . . . 1 3
18 1 . . . 1 3
19 1 . . . 1 3
20 1 . . . 1 3
21 1 . . . 1 3
22 1 . . . 1 3
23 1 . . . 1 3
24 1 . . . 1 3
25 1 . . . 1 3
26 1 . . . 1 3
27 1 . . . 1 3
28 1 . . . 1 3
29 1 . . . 1 3
30 1 . . . 1 3
31 1 . . . 1 3
32 1 . . . 1 3
33 1 . . . 1 3
34 1 . . . 1 3
35 1 . . . 1 3
36 1 . . . 1 3
37 1 . . . 1 3
38 1 . . . 1 3
39 1 . . . 1 3
40 1 . . . 1 3
41 1 . . . 1 3
42 1 . . . 1 3
43 1 . . . 1 3
44 1 . . . 1 3
45 1 . . . 1 3
46 1 . . . 1 3
47 1 . . . 1 3
48 1 . . . 1 3
49 1 . . . 1 3
50 1 . . . 1 3
51 1 . . . 1 3
52 1 . . . 1 3
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 1 1 7 SER H . 563 . HN 1 3
1 1 2 1 1 23 SER O . 579 . O 1 3
2 1 1 1 1 7 SER N . 563 . N 1 3
2 1 2 1 1 23 SER O . 579 . O 1 3
3 1 1 1 1 18 PHE H . 574 . HN 1 3
3 1 2 1 1 72 PHE O . 628 . O 1 3
4 1 1 1 1 18 PHE N . 574 . N 1 3
4 1 2 1 1 72 PHE O . 628 . O 1 3
5 1 1 1 1 20 VAL H . 576 . HN 1 3
5 1 2 1 1 70 VAL O . 626 . O 1 3
6 1 1 1 1 20 VAL N . 576 . N 1 3
6 1 2 1 1 70 VAL O . 626 . O 1 3
7 1 1 1 1 7 SER O . 563 . O 1 3
7 1 2 1 1 23 SER H . 579 . HN 1 3
8 1 1 1 1 7 SER O . 563 . O 1 3
8 1 2 1 1 23 SER N . 579 . N 1 3
9 1 1 1 1 33 THR H . 589 . HN 1 3
9 1 2 1 1 84 THR O . 640 . O 1 3
10 1 1 1 1 33 THR N . 589 . N 1 3
10 1 2 1 1 84 THR O . 640 . O 1 3
11 1 1 1 1 51 THR O . 607 . O 1 3
11 1 2 1 1 58 THR H . 614 . HN 1 3
12 1 1 1 1 51 THR O . 607 . O 1 3
12 1 2 1 1 58 THR N . 614 . N 1 3
13 1 1 1 1 32 VAL O . 588 . O 1 3
13 1 2 1 1 59 ALA H . 615 . HN 1 3
14 1 1 1 1 32 VAL O . 588 . O 1 3
14 1 2 1 1 59 ALA N . 615 . N 1 3
15 1 1 1 1 22 TYR O . 578 . O 1 3
15 1 2 1 1 68 PHE H . 624 . HN 1 3
16 1 1 1 1 22 TYR O . 578 . O 1 3
16 1 2 1 1 68 PHE N . 624 . N 1 3
17 1 1 1 1 20 VAL O . 576 . O 1 3
17 1 2 1 1 70 VAL H . 626 . HN 1 3
18 1 1 1 1 20 VAL O . 576 . O 1 3
18 1 2 1 1 70 VAL N . 626 . N 1 3
19 1 1 1 1 18 PHE O . 574 . O 1 3
19 1 2 1 1 72 PHE H . 628 . HN 1 3
20 1 1 1 1 18 PHE O . 574 . O 1 3
20 1 2 1 1 72 PHE N . 628 . N 1 3
21 1 1 1 1 33 THR O . 589 . O 1 3
21 1 2 1 1 84 THR H . 640 . HN 1 3
22 1 1 1 1 33 THR O . 589 . O 1 3
22 1 2 1 1 84 THR N . 640 . N 1 3
23 1 1 1 1 14 TRP H . 570 . HN 1 3
23 1 2 1 1 17 ARG O . 573 . O 1 3
24 1 1 1 1 14 TRP N . 570 . N 1 3
24 1 2 1 1 17 ARG O . 573 . O 1 3
25 1 1 1 1 12 GLU O . 568 . O 1 3
25 1 2 1 1 19 ASN H . 575 . HN 1 3
26 1 1 1 1 12 GLU O . 568 . O 1 3
26 1 2 1 1 19 ASN N . 575 . N 1 3
27 1 1 1 1 9 VAL O . 565 . O 1 3
27 1 2 1 1 21 THR H . 577 . HN 1 3
28 1 1 1 1 9 VAL O . 565 . O 1 3
28 1 2 1 1 21 THR N . 577 . N 1 3
29 1 1 1 1 24 VAL H . 580 . HN 1 3
29 1 2 1 1 66 ASN O . 622 . O 1 3
30 1 1 1 1 24 VAL N . 580 . N 1 3
30 1 2 1 1 66 ASN O . 622 . O 1 3
31 1 1 1 1 34 LEU H . 590 . HN 1 3
31 1 2 1 1 57 VAL O . 613 . O 1 3
32 1 1 1 1 34 LEU N . 590 . N 1 3
32 1 2 1 1 57 VAL O . 613 . O 1 3
33 1 1 1 1 22 TYR H . 578 . HN 1 3
33 1 2 1 1 68 PHE O . 624 . O 1 3
34 1 1 1 1 22 TYR N . 578 . N 1 3
34 1 2 1 1 68 PHE O . 624 . O 1 3
35 1 1 1 1 35 GLY H . 591 . HN 1 3
35 1 2 1 1 82 GLY O . 638 . O 1 3
36 1 1 1 1 35 GLY N . 591 . N 1 3
36 1 2 1 1 82 GLY O . 638 . O 1 3
37 1 1 1 1 46 TRP H . 602 . HN 1 3
37 1 2 1 1 69 GLY O . 625 . O 1 3
38 1 1 1 1 46 TRP N . 602 . N 1 3
38 1 2 1 1 69 GLY O . 625 . O 1 3
39 1 1 1 1 49 ALA H . 605 . HN 1 3
39 1 2 1 1 60 ARG O . 616 . O 1 3
40 1 1 1 1 49 ALA N . 605 . N 1 3
40 1 2 1 1 60 ARG O . 616 . O 1 3
41 1 1 1 1 51 THR H . 607 . HN 1 3
41 1 2 1 1 58 THR O . 614 . O 1 3
42 1 1 1 1 51 THR N . 607 . N 1 3
42 1 2 1 1 58 THR O . 614 . O 1 3
43 1 1 1 1 34 LEU O . 590 . O 1 3
43 1 2 1 1 57 VAL H . 613 . HN 1 3
44 1 1 1 1 34 LEU O . 590 . O 1 3
44 1 2 1 1 57 VAL N . 613 . N 1 3
45 1 1 1 1 46 TRP O . 602 . O 1 3
45 1 2 1 1 69 GLY H . 625 . HN 1 3
46 1 1 1 1 46 TRP O . 602 . O 1 3
46 1 2 1 1 69 GLY N . 625 . N 1 3
47 1 1 1 1 44 SER O . 600 . O 1 3
47 1 2 1 1 71 THR H . 627 . HN 1 3
48 1 1 1 1 44 SER O . 600 . O 1 3
48 1 2 1 1 71 THR N . 627 . N 1 3
49 1 1 1 1 41 SER O . 597 . O 1 3
49 1 2 1 1 73 TYR H . 629 . HN 1 3
50 1 1 1 1 41 SER O . 597 . O 1 3
50 1 2 1 1 73 TYR N . 629 . N 1 3
51 1 1 1 1 16 ASP O . 572 . O 1 3
51 1 2 1 1 74 LYS H . 630 . HN 1 3
52 1 1 1 1 16 ASP O . 572 . O 1 3
52 1 2 1 1 74 LYS N . 630 . N 1 3
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.3 1.8 2.5 1 3
2 1 . . . . . 3.3 2.5 3.5 1 3
3 1 . . . . . 2.3 1.8 2.5 1 3
4 1 . . . . . 3.3 2.5 3.5 1 3
5 1 . . . . . 2.3 1.8 2.5 1 3
6 1 . . . . . 3.3 2.5 3.5 1 3
7 1 . . . . . 2.3 1.8 2.5 1 3
8 1 . . . . . 3.3 2.5 3.5 1 3
9 1 . . . . . 2.3 1.8 2.5 1 3
10 1 . . . . . 3.3 2.5 3.5 1 3
11 1 . . . . . 2.3 1.8 2.5 1 3
12 1 . . . . . 3.3 2.5 3.5 1 3
13 1 . . . . . 2.3 1.8 2.5 1 3
14 1 . . . . . 3.3 2.5 3.5 1 3
15 1 . . . . . 2.3 1.8 2.5 1 3
16 1 . . . . . 3.3 2.5 3.5 1 3
17 1 . . . . . 2.3 1.8 2.5 1 3
18 1 . . . . . 3.3 2.5 3.5 1 3
19 1 . . . . . 2.3 1.8 2.5 1 3
20 1 . . . . . 3.3 2.5 3.5 1 3
21 1 . . . . . 2.3 1.8 2.5 1 3
22 1 . . . . . 3.3 2.5 3.5 1 3
23 1 . . . . . 2.3 1.8 2.5 1 3
24 1 . . . . . 3.3 2.5 3.5 1 3
25 1 . . . . . 2.3 1.8 2.5 1 3
26 1 . . . . . 3.3 2.5 3.5 1 3
27 1 . . . . . 2.3 1.8 2.5 1 3
28 1 . . . . . 3.3 2.5 3.5 1 3
29 1 . . . . . 2.3 1.8 2.5 1 3
30 1 . . . . . 3.3 2.5 3.5 1 3
31 1 . . . . . 2.3 1.8 2.5 1 3
32 1 . . . . . 3.3 2.5 3.5 1 3
33 1 . . . . . 2.3 1.8 2.5 1 3
34 1 . . . . . 3.3 2.5 3.5 1 3
35 1 . . . . . 2.3 1.8 2.5 1 3
36 1 . . . . . 3.3 2.5 3.5 1 3
37 1 . . . . . 2.3 1.8 2.5 1 3
38 1 . . . . . 3.3 2.5 3.5 1 3
39 1 . . . . . 2.3 1.8 2.5 1 3
40 1 . . . . . 3.3 2.5 3.5 1 3
41 1 . . . . . 2.3 1.8 2.5 1 3
42 1 . . . . . 3.3 2.5 3.5 1 3
43 1 . . . . . 2.3 1.8 2.5 1 3
44 1 . . . . . 3.3 2.5 3.5 1 3
45 1 . . . . . 2.3 1.8 2.5 1 3
46 1 . . . . . 3.3 2.5 3.5 1 3
47 1 . . . . . 2.3 1.8 2.5 1 3
48 1 . . . . . 3.3 2.5 3.5 1 3
49 1 . . . . . 2.3 1.8 2.5 1 3
50 1 . . . . . 3.3 2.5 3.5 1 3
51 1 . . . . . 2.3 1.8 2.5 1 3
52 1 . . . . . 3.3 2.5 3.5 1 3
stop_
save_
save_CNS/XPLOR_dihedral_8
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 3 SER C 1 1 4 CYS N 1 1 4 CYS CA 1 1 4 CYS C -179.99998 -60.0 . 559 . C . 560 . N . 560 . CA . 560 . C 1 1
2 . 1 1 5 SER C 1 1 6 VAL N 1 1 6 VAL CA 1 1 6 VAL C -160.0 -80.0 . 561 . C . 562 . N . 562 . CA . 562 . C 1 1
3 . 1 1 6 VAL C 1 1 7 SER N 1 1 7 SER CA 1 1 7 SER C -160.0 -80.0 . 562 . C . 563 . N . 563 . CA . 563 . C 1 1
4 . 1 1 7 SER C 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C -160.0 -80.0 . 563 . C . 564 . N . 564 . CA . 564 . C 1 1
5 . 1 1 8 ALA C 1 1 9 VAL N 1 1 9 VAL CA 1 1 9 VAL C -160.0 -80.0 . 564 . C . 565 . N . 565 . CA . 565 . C 1 1
6 . 1 1 9 VAL C 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG C -89.99999 -20.0 . 565 . C . 566 . N . 566 . CA . 566 . C 1 1
7 . 1 1 11 GLY C 1 1 12 GLU N 1 1 12 GLU CA 1 1 12 GLU C -89.99999 -20.0 . 567 . C . 568 . N . 568 . CA . 568 . C 1 1
8 . 1 1 12 GLU C 1 1 13 GLU N 1 1 13 GLU CA 1 1 13 GLU C -160.0 -80.0 . 568 . C . 569 . N . 569 . CA . 569 . C 1 1
9 . 1 1 15 ALA C 1 1 16 ASP N 1 1 16 ASP CA 1 1 16 ASP C -160.0 -80.0 . 571 . C . 572 . N . 572 . CA . 572 . C 1 1
10 . 1 1 16 ASP C 1 1 17 ARG N 1 1 17 ARG CA 1 1 17 ARG C -170.0 -70.0 . 572 . C . 573 . N . 573 . CA . 573 . C 1 1
11 . 1 1 17 ARG C 1 1 18 PHE N 1 1 18 PHE CA 1 1 18 PHE C -179.99998 -60.0 . 573 . C . 574 . N . 574 . CA . 574 . C 1 1
12 . 1 1 18 PHE C 1 1 19 ASN N 1 1 19 ASN CA 1 1 19 ASN C -170.0 -70.0 . 574 . C . 575 . N . 575 . CA . 575 . C 1 1
13 . 1 1 19 ASN C 1 1 20 VAL N 1 1 20 VAL CA 1 1 20 VAL C -160.0 -80.0 . 575 . C . 576 . N . 576 . CA . 576 . C 1 1
14 . 1 1 20 VAL C 1 1 21 THR N 1 1 21 THR CA 1 1 21 THR C -160.0 -80.0 . 576 . C . 577 . N . 577 . CA . 577 . C 1 1
15 . 1 1 21 THR C 1 1 22 TYR N 1 1 22 TYR CA 1 1 22 TYR C -160.0 -80.0 . 577 . C . 578 . N . 578 . CA . 578 . C 1 1
16 . 1 1 22 TYR C 1 1 23 SER N 1 1 23 SER CA 1 1 23 SER C -160.0 -80.0 . 578 . C . 579 . N . 579 . CA . 579 . C 1 1
17 . 1 1 23 SER C 1 1 24 VAL N 1 1 24 VAL CA 1 1 24 VAL C -170.0 -70.0 . 579 . C . 580 . N . 580 . CA . 580 . C 1 1
18 . 1 1 25 SER C 1 1 26 GLY N 1 1 26 GLY CA 1 1 26 GLY C -300.0 -60.0 . 581 . C . 582 . N . 582 . CA . 582 . C 1 1
19 . 1 1 28 SER C 1 1 29 SER N 1 1 29 SER CA 1 1 29 SER C -160.0 -80.0 . 584 . C . 585 . N . 585 . CA . 585 . C 1 1
20 . 1 1 29 SER C 1 1 30 TRP N 1 1 30 TRP CA 1 1 30 TRP C -170.0 -70.0 . 585 . C . 586 . N . 586 . CA . 586 . C 1 1
21 . 1 1 30 TRP C 1 1 31 VAL N 1 1 31 VAL CA 1 1 31 VAL C -160.0 -80.0 . 586 . C . 587 . N . 587 . CA . 587 . C 1 1
22 . 1 1 31 VAL C 1 1 32 VAL N 1 1 32 VAL CA 1 1 32 VAL C -160.0 -80.0 . 587 . C . 588 . N . 588 . CA . 588 . C 1 1
23 . 1 1 32 VAL C 1 1 33 THR N 1 1 33 THR CA 1 1 33 THR C -160.0 -80.0 . 588 . C . 589 . N . 589 . CA . 589 . C 1 1
24 . 1 1 33 THR C 1 1 34 LEU N 1 1 34 LEU CA 1 1 34 LEU C -160.0 -80.0 . 589 . C . 590 . N . 590 . CA . 590 . C 1 1
25 . 1 1 36 LEU C 1 1 37 ASN N 1 1 37 ASN CA 1 1 37 ASN C -170.0 -70.0 . 592 . C . 593 . N . 593 . CA . 593 . C 1 1
26 . 1 1 39 GLY C 1 1 40 GLN N 1 1 40 GLN CA 1 1 40 GLN C -89.99999 -20.0 . 595 . C . 596 . N . 596 . CA . 596 . C 1 1
27 . 1 1 40 GLN C 1 1 41 SER N 1 1 41 SER CA 1 1 41 SER C -170.0 -70.0 . 596 . C . 597 . N . 597 . CA . 597 . C 1 1
28 . 1 1 42 VAL C 1 1 43 GLN N 1 1 43 GLN CA 1 1 43 GLN C -160.0 -80.0 . 598 . C . 599 . N . 599 . CA . 599 . C 1 1
29 . 1 1 43 GLN C 1 1 44 SER N 1 1 44 SER CA 1 1 44 SER C -179.99998 -60.0 . 599 . C . 600 . N . 600 . CA . 600 . C 1 1
30 . 1 1 45 SER C 1 1 46 TRP N 1 1 46 TRP CA 1 1 46 TRP C -170.0 -70.0 . 601 . C . 602 . N . 602 . CA . 602 . C 1 1
31 . 1 1 46 TRP C 1 1 47 ASN N 1 1 47 ASN CA 1 1 47 ASN C 0.0 120.0 . 602 . C . 603 . N . 603 . CA . 603 . C 1 1
32 . 1 1 48 ALA C 1 1 49 ALA N 1 1 49 ALA CA 1 1 49 ALA C -160.0 -80.0 . 604 . C . 605 . N . 605 . CA . 605 . C 1 1
33 . 1 1 49 ALA C 1 1 50 LEU N 1 1 50 LEU CA 1 1 50 LEU C -160.0 -80.0 . 605 . C . 606 . N . 606 . CA . 606 . C 1 1
34 . 1 1 50 LEU C 1 1 51 THR N 1 1 51 THR CA 1 1 51 THR C -160.0 -80.0 . 606 . C . 607 . N . 607 . CA . 607 . C 1 1
35 . 1 1 55 GLY C 1 1 56 THR N 1 1 56 THR CA 1 1 56 THR C -160.0 -80.0 . 611 . C . 612 . N . 612 . CA . 612 . C 1 1
36 . 1 1 56 THR C 1 1 57 VAL N 1 1 57 VAL CA 1 1 57 VAL C -160.0 -80.0 . 612 . C . 613 . N . 613 . CA . 613 . C 1 1
37 . 1 1 57 VAL C 1 1 58 THR N 1 1 58 THR CA 1 1 58 THR C -160.0 -80.0 . 613 . C . 614 . N . 614 . CA . 614 . C 1 1
38 . 1 1 58 THR C 1 1 59 ALA N 1 1 59 ALA CA 1 1 59 ALA C -160.0 -80.0 . 614 . C . 615 . N . 615 . CA . 615 . C 1 1
39 . 1 1 59 ALA C 1 1 60 ARG N 1 1 60 ARG CA 1 1 60 ARG C -160.0 -80.0 . 615 . C . 616 . N . 616 . CA . 616 . C 1 1
40 . 1 1 61 PRO C 1 1 62 ASN N 1 1 62 ASN CA 1 1 62 ASN C -160.0 -80.0 . 617 . C . 618 . N . 618 . CA . 618 . C 1 1
41 . 1 1 65 GLY C 1 1 66 ASN N 1 1 66 ASN CA 1 1 66 ASN C -170.0 -70.0 . 621 . C . 622 . N . 622 . CA . 622 . C 1 1
42 . 1 1 66 ASN C 1 1 67 SER N 1 1 67 SER CA 1 1 67 SER C -160.0 -80.0 . 622 . C . 623 . N . 623 . CA . 623 . C 1 1
43 . 1 1 68 PHE C 1 1 69 GLY N 1 1 69 GLY CA 1 1 69 GLY C -300.0 -60.0 . 624 . C . 625 . N . 625 . CA . 625 . C 1 1
44 . 1 1 69 GLY C 1 1 70 VAL N 1 1 70 VAL CA 1 1 70 VAL C -160.0 -80.0 . 625 . C . 626 . N . 626 . CA . 626 . C 1 1
45 . 1 1 70 VAL C 1 1 71 THR N 1 1 71 THR CA 1 1 71 THR C -160.0 -80.0 . 626 . C . 627 . N . 627 . CA . 627 . C 1 1
46 . 1 1 72 PHE C 1 1 73 TYR N 1 1 73 TYR CA 1 1 73 TYR C -170.0 -70.0 . 628 . C . 629 . N . 629 . CA . 629 . C 1 1
47 . 1 1 76 GLY C 1 1 77 SER N 1 1 77 SER CA 1 1 77 SER C -160.0 -80.0 . 632 . C . 633 . N . 633 . CA . 633 . C 1 1
48 . 1 1 78 SER C 1 1 79 ALA N 1 1 79 ALA CA 1 1 79 ALA C -89.99999 -20.0 . 634 . C . 635 . N . 635 . CA . 635 . C 1 1
49 . 1 1 79 ALA C 1 1 80 THR N 1 1 80 THR CA 1 1 80 THR C -89.99999 -20.0 . 635 . C . 636 . N . 636 . CA . 636 . C 1 1
50 . 1 1 82 GLY C 1 1 83 ALA N 1 1 83 ALA CA 1 1 83 ALA C -160.0 -80.0 . 638 . C . 639 . N . 639 . CA . 639 . C 1 1
51 . 1 1 83 ALA C 1 1 84 THR N 1 1 84 THR CA 1 1 84 THR C -160.0 -80.0 . 639 . C . 640 . N . 640 . CA . 640 . C 1 1
52 . 1 1 84 THR C 1 1 85 CYS N 1 1 85 CYS CA 1 1 85 CYS C -160.0 -80.0 . 640 . C . 641 . N . 641 . CA . 641 . C 1 1
53 . 1 1 85 CYS C 1 1 86 ALA N 1 1 86 ALA CA 1 1 86 ALA C -160.0 -80.0 . 641 . C . 642 . N . 642 . CA . 642 . C 1 1
54 . 1 1 86 ALA C 1 1 87 THR N 1 1 87 THR CA 1 1 87 THR C -170.0 -70.0 . 642 . C . 643 . N . 643 . CA . 643 . C 1 1
stop_
save_
save_CNS/XPLOR_dihedral_10
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID 1
_Torsion_angle_constraint_list.ID 2
_Torsion_angle_constraint_list.Constraint_file_ID .
_Torsion_angle_constraint_list.Block_ID .
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . 1 1 9 VAL N 1 1 9 VAL CA 1 1 9 VAL CB 1 1 9 VAL CG1 150.0 210.0 . 565 . N . 565 . CA . 565 . CB . 565 . CG1 1 2
2 . 1 1 10 ARG N 1 1 10 ARG CA 1 1 10 ARG CB 1 1 10 ARG CG -89.99999 89.99999 . 566 . N . 566 . CA . 566 . CB . 566 . CG 1 2
3 . 1 1 12 GLU N 1 1 12 GLU CA 1 1 12 GLU CB 1 1 12 GLU CG -89.99999 -30.0 . 568 . N . 568 . CA . 568 . CB . 568 . CG 1 2
4 . 1 1 13 GLU N 1 1 13 GLU CA 1 1 13 GLU CB 1 1 13 GLU CG -89.99999 89.99999 . 569 . N . 569 . CA . 569 . CB . 569 . CG 1 2
5 . 1 1 14 TRP N 1 1 14 TRP CA 1 1 14 TRP CB 1 1 14 TRP CG -89.99999 -30.0 . 570 . N . 570 . CA . 570 . CB . 570 . CG 1 2
6 . 1 1 16 ASP N 1 1 16 ASP CA 1 1 16 ASP CB 1 1 16 ASP CG -89.99999 89.99999 . 572 . N . 572 . CA . 572 . CB . 572 . CG 1 2
7 . 1 1 17 ARG N 1 1 17 ARG CA 1 1 17 ARG CB 1 1 17 ARG CG -89.99999 89.99999 . 573 . N . 573 . CA . 573 . CB . 573 . CG 1 2
8 . 1 1 19 ASN N 1 1 19 ASN CA 1 1 19 ASN CB 1 1 19 ASN CG 150.0 210.0 . 575 . N . 575 . CA . 575 . CB . 575 . CG 1 2
9 . 1 1 20 VAL N 1 1 20 VAL CA 1 1 20 VAL CB 1 1 20 VAL CG1 150.0 210.0 . 576 . N . 576 . CA . 576 . CB . 576 . CG1 1 2
10 . 1 1 21 THR N 1 1 21 THR CA 1 1 21 THR CB 1 1 21 THR OG1 -89.99999 -30.0 . 577 . N . 577 . CA . 577 . CB . 577 . OG1 1 2
11 . 1 1 22 TYR N 1 1 22 TYR CA 1 1 22 TYR CB 1 1 22 TYR CG -89.99999 -30.0 . 578 . N . 578 . CA . 578 . CB . 578 . CG 1 2
12 . 1 1 23 SER N 1 1 23 SER CA 1 1 23 SER CB 1 1 23 SER OG -89.99999 -30.0 . 579 . N . 579 . CA . 579 . CB . 579 . OG 1 2
13 . 1 1 24 VAL N 1 1 24 VAL CA 1 1 24 VAL CB 1 1 24 VAL CG1 150.0 210.0 . 580 . N . 580 . CA . 580 . CB . 580 . CG1 1 2
14 . 1 1 30 TRP N 1 1 30 TRP CA 1 1 30 TRP CB 1 1 30 TRP CG -89.99999 89.99999 . 586 . N . 586 . CA . 586 . CB . 586 . CG 1 2
15 . 1 1 34 LEU N 1 1 34 LEU CA 1 1 34 LEU CB 1 1 34 LEU CG -89.99999 -30.0 . 590 . N . 590 . CA . 590 . CB . 590 . CG 1 2
16 . 1 1 36 LEU N 1 1 36 LEU CA 1 1 36 LEU CB 1 1 36 LEU CG -89.99999 -30.0 . 592 . N . 592 . CA . 592 . CB . 592 . CG 1 2
17 . 1 1 37 ASN N 1 1 37 ASN CA 1 1 37 ASN CB 1 1 37 ASN CG -89.99999 -30.0 . 593 . N . 593 . CA . 593 . CB . 593 . CG 1 2
18 . 1 1 40 GLN N 1 1 40 GLN CA 1 1 40 GLN CB 1 1 40 GLN CG -89.99999 -30.0 . 596 . N . 596 . CA . 596 . CB . 596 . CG 1 2
19 . 1 1 41 SER N 1 1 41 SER CA 1 1 41 SER CB 1 1 41 SER OG -89.99999 89.99999 . 597 . N . 597 . CA . 597 . CB . 597 . OG 1 2
20 . 1 1 42 VAL N 1 1 42 VAL CA 1 1 42 VAL CB 1 1 42 VAL CG1 150.0 210.0 . 598 . N . 598 . CA . 598 . CB . 598 . CG1 1 2
21 . 1 1 43 GLN N 1 1 43 GLN CA 1 1 43 GLN CB 1 1 43 GLN CG 150.0 210.0 . 599 . N . 599 . CA . 599 . CB . 599 . CG 1 2
22 . 1 1 46 TRP N 1 1 46 TRP CA 1 1 46 TRP CB 1 1 46 TRP CG 30.0 89.99999 . 602 . N . 602 . CA . 602 . CB . 602 . CG 1 2
23 . 1 1 51 THR N 1 1 51 THR CA 1 1 51 THR CB 1 1 51 THR OG1 -89.99999 -30.0 . 607 . N . 607 . CA . 607 . CB . 607 . OG1 1 2
24 . 1 1 53 SER N 1 1 53 SER CA 1 1 53 SER CB 1 1 53 SER OG -89.99999 89.99999 . 609 . N . 609 . CA . 609 . CB . 609 . OG 1 2
25 . 1 1 56 THR N 1 1 56 THR CA 1 1 56 THR CB 1 1 56 THR OG1 -89.99999 -30.0 . 612 . N . 612 . CA . 612 . CB . 612 . OG1 1 2
26 . 1 1 57 VAL N 1 1 57 VAL CA 1 1 57 VAL CB 1 1 57 VAL CG1 150.0 210.0 . 613 . N . 613 . CA . 613 . CB . 613 . CG1 1 2
27 . 1 1 58 THR N 1 1 58 THR CA 1 1 58 THR CB 1 1 58 THR OG1 -89.99999 -30.0 . 614 . N . 614 . CA . 614 . CB . 614 . OG1 1 2
28 . 1 1 62 ASN N 1 1 62 ASN CA 1 1 62 ASN CB 1 1 62 ASN CG -89.99999 89.99999 . 618 . N . 618 . CA . 618 . CB . 618 . CG 1 2
29 . 1 1 66 ASN N 1 1 66 ASN CA 1 1 66 ASN CB 1 1 66 ASN CG -89.99999 -30.0 . 622 . N . 622 . CA . 622 . CB . 622 . CG 1 2
30 . 1 1 67 SER N 1 1 67 SER CA 1 1 67 SER CB 1 1 67 SER OG -89.99999 89.99999 . 623 . N . 623 . CA . 623 . CB . 623 . OG 1 2
31 . 1 1 68 PHE N 1 1 68 PHE CA 1 1 68 PHE CB 1 1 68 PHE CG -89.99999 89.99999 . 624 . N . 624 . CA . 624 . CB . 624 . CG 1 2
32 . 1 1 70 VAL N 1 1 70 VAL CA 1 1 70 VAL CB 1 1 70 VAL CG1 30.0 210.0 . 626 . N . 626 . CA . 626 . CB . 626 . CG1 1 2
33 . 1 1 71 THR N 1 1 71 THR CA 1 1 71 THR CB 1 1 71 THR OG1 -89.99999 -30.0 . 627 . N . 627 . CA . 627 . CB . 627 . OG1 1 2
34 . 1 1 72 PHE N 1 1 72 PHE CA 1 1 72 PHE CB 1 1 72 PHE CG -89.99999 -30.0 . 628 . N . 628 . CA . 628 . CB . 628 . CG 1 2
35 . 1 1 73 TYR N 1 1 73 TYR CA 1 1 73 TYR CB 1 1 73 TYR CG -89.99999 -30.0 . 629 . N . 629 . CA . 629 . CB . 629 . CG 1 2
36 . 1 1 75 ASN N 1 1 75 ASN CA 1 1 75 ASN CB 1 1 75 ASN CG -89.99999 -30.0 . 631 . N . 631 . CA . 631 . CB . 631 . CG 1 2
37 . 1 1 77 SER N 1 1 77 SER CA 1 1 77 SER CB 1 1 77 SER OG -89.99999 89.99999 . 633 . N . 633 . CA . 633 . CB . 633 . OG 1 2
38 . 1 1 84 THR N 1 1 84 THR CA 1 1 84 THR CB 1 1 84 THR OG1 -89.99999 -30.0 . 640 . N . 640 . CA . 640 . CB . 640 . OG1 1 2
39 . 1 1 85 CYS N 1 1 85 CYS CA 1 1 85 CYS CB 1 1 85 CYS SG -89.99999 -30.0 . 641 . N . 641 . CA . 641 . CB . 641 . SG 1 2
40 . 1 1 87 THR N 1 1 87 THR CA 1 1 87 THR CB 1 1 87 THR OG1 30.0 89.99999 . 643 . N . 643 . CA . 643 . CB . 643 . OG1 1 2
stop_
save_
save_conformer_family_coord_set_1
_Conformer_family_coord_set.Sf_category conformer_family_coord_set
_Conformer_family_coord_set.Entry_ID 1
_Conformer_family_coord_set.ID 1
loop_
_Atom_site.Model_ID
_Atom_site.ID
_Atom_site.Label_entity_assembly_ID
_Atom_site.Label_entity_ID
_Atom_site.Label_comp_index_ID
_Atom_site.Label_comp_ID
_Atom_site.Label_atom_ID
_Atom_site.Type_symbol
_Atom_site.Cartn_x
_Atom_site.Cartn_y
_Atom_site.Cartn_z
_Atom_site.Occupancy
_Atom_site.Uncertainty
_Atom_site.PDBX_label_asym_ID
_Atom_site.PDB_strand_ID
_Atom_site.PDB_ins_code
_Atom_site.PDB_residue_no
_Atom_site.PDB_residue_name
_Atom_site.PDB_atom_name
_Atom_site.Entry_ID
_Atom_site.Conformer_family_coord_set_ID
1 1 1 1 1 THR C C 12.544 18.169 2.411 1.00 . A C . 557 THR C 1 1
1 2 1 1 1 THR CA C 13.988 18.042 2.897 1.00 . A C . 557 THR CA 1 1
1 3 1 1 1 THR CB C 14.486 19.406 3.379 1.00 . A C . 557 THR CB 1 1
1 4 1 1 1 THR CG2 C 15.805 19.233 4.133 1.00 . A C . 557 THR CG2 1 1
1 5 1 1 1 THR H1 H 14.265 17.061 1.082 1.00 . A C . 557 THR H1 1 1
1 6 1 1 1 THR H2 H 15.307 18.382 1.322 1.00 . A C . 557 THR H2 1 1
1 7 1 1 1 THR H3 H 15.577 16.923 2.149 1.00 . A C . 557 THR H3 1 1
1 8 1 1 1 THR HA H 14.033 17.334 3.712 1.00 . A C . 557 THR HA 1 1
1 9 1 1 1 THR HB H 13.753 19.844 4.040 1.00 . A C . 557 THR HB 1 1
1 10 1 1 1 THR HG1 H 13.824 20.553 1.955 1.00 . A C . 557 THR HG1 1 1
1 11 1 1 1 THR HG21 H 15.732 18.382 4.794 1.00 . A C . 557 THR HG21 1 1
1 12 1 1 1 THR HG22 H 16.605 19.073 3.426 1.00 . A C . 557 THR HG22 1 1
1 13 1 1 1 THR HG23 H 16.008 20.121 4.712 1.00 . A C . 557 THR HG23 1 1
1 14 1 1 1 THR N N 14.849 17.566 1.778 1.00 . A C . 557 THR N 1 1
1 15 1 1 1 THR O O 12.179 19.131 1.764 1.00 . A C . 557 THR O 1 1
1 16 1 1 1 THR OG1 O 14.685 20.258 2.260 1.00 . A C . 557 THR OG1 1 1
1 17 1 1 2 GLY C C 9.749 15.859 2.084 1.00 . A C . 558 GLY C 1 1
1 18 1 1 2 GLY CA C 10.298 17.274 2.272 1.00 . A C . 558 GLY CA 1 1
1 19 1 1 2 GLY H H 12.032 16.440 3.240 1.00 . A C . 558 GLY H 1 1
1 20 1 1 2 GLY HA2 H 10.239 17.806 1.335 1.00 . A C . 558 GLY HA2 1 1
1 21 1 1 2 GLY HA3 H 9.712 17.793 3.018 1.00 . A C . 558 GLY HA3 1 1
1 22 1 1 2 GLY N N 11.718 17.207 2.717 1.00 . A C . 558 GLY N 1 1
1 23 1 1 2 GLY O O 8.969 15.599 1.190 1.00 . A C . 558 GLY O 1 1
1 24 1 1 3 SER C C 8.120 13.545 2.903 1.00 . A C . 559 SER C 1 1
1 25 1 1 3 SER CA C 9.645 13.544 2.788 1.00 . A C . 559 SER CA 1 1
1 26 1 1 3 SER CB C 10.239 12.680 3.900 1.00 . A C . 559 SER CB 1 1
1 27 1 1 3 SER H H 10.776 15.168 3.638 1.00 . A C . 559 SER H 1 1
1 28 1 1 3 SER HA H 9.934 13.146 1.827 1.00 . A C . 559 SER HA 1 1
1 29 1 1 3 SER HB2 H 9.517 12.558 4.690 1.00 . A C . 559 SER HB2 1 1
1 30 1 1 3 SER HB3 H 10.498 11.708 3.500 1.00 . A C . 559 SER HB3 1 1
1 31 1 1 3 SER HG H 11.288 13.403 5.371 1.00 . A C . 559 SER HG 1 1
1 32 1 1 3 SER N N 10.148 14.940 2.921 1.00 . A C . 559 SER N 1 1
1 33 1 1 3 SER O O 7.530 14.462 3.439 1.00 . A C . 559 SER O 1 1
1 34 1 1 3 SER OG O 11.399 13.316 4.421 1.00 . A C . 559 SER OG 1 1
1 35 1 1 4 CYS C C 5.579 11.889 3.842 1.00 . A C . 560 CYS C 1 1
1 36 1 1 4 CYS CA C 5.988 12.480 2.491 1.00 . A C . 560 CYS CA 1 1
1 37 1 1 4 CYS CB C 5.436 11.630 1.333 1.00 . A C . 560 CYS CB 1 1
1 38 1 1 4 CYS H H 7.965 11.796 1.974 1.00 . A C . 560 CYS H 1 1
1 39 1 1 4 CYS HA H 5.598 13.485 2.412 1.00 . A C . 560 CYS HA 1 1
1 40 1 1 4 CYS HB2 H 4.773 12.238 0.737 1.00 . A C . 560 CYS HB2 1 1
1 41 1 1 4 CYS HB3 H 6.256 11.290 0.718 1.00 . A C . 560 CYS HB3 1 1
1 42 1 1 4 CYS N N 7.474 12.527 2.404 1.00 . A C . 560 CYS N 1 1
1 43 1 1 4 CYS O O 6.340 11.191 4.482 1.00 . A C . 560 CYS O 1 1
1 44 1 1 4 CYS SG S 4.518 10.198 1.961 1.00 . A C . 560 CYS SG 1 1
1 45 1 1 5 SER C C 3.077 10.375 5.348 1.00 . A C . 561 SER C 1 1
1 46 1 1 5 SER CA C 3.925 11.623 5.591 1.00 . A C . 561 SER CA 1 1
1 47 1 1 5 SER CB C 3.088 12.677 6.317 1.00 . A C . 561 SER CB 1 1
1 48 1 1 5 SER H H 3.785 12.732 3.748 1.00 . A C . 561 SER H 1 1
1 49 1 1 5 SER HA H 4.783 11.365 6.195 1.00 . A C . 561 SER HA 1 1
1 50 1 1 5 SER HB2 H 2.165 12.837 5.785 1.00 . A C . 561 SER HB2 1 1
1 51 1 1 5 SER HB3 H 2.867 12.332 7.319 1.00 . A C . 561 SER HB3 1 1
1 52 1 1 5 SER HG H 4.416 13.852 7.118 1.00 . A C . 561 SER HG 1 1
1 53 1 1 5 SER N N 4.383 12.167 4.281 1.00 . A C . 561 SER N 1 1
1 54 1 1 5 SER O O 2.197 10.367 4.511 1.00 . A C . 561 SER O 1 1
1 55 1 1 5 SER OG O 3.814 13.898 6.371 1.00 . A C . 561 SER OG 1 1
1 56 1 1 6 VAL C C 2.371 7.332 7.184 1.00 . A C . 562 VAL C 1 1
1 57 1 1 6 VAL CA C 2.545 8.074 5.858 1.00 . A C . 562 VAL CA 1 1
1 58 1 1 6 VAL CB C 3.277 7.170 4.865 1.00 . A C . 562 VAL CB 1 1
1 59 1 1 6 VAL CG1 C 3.806 8.012 3.705 1.00 . A C . 562 VAL CG1 1 1
1 60 1 1 6 VAL CG2 C 4.448 6.480 5.568 1.00 . A C . 562 VAL CG2 1 1
1 61 1 1 6 VAL H H 4.055 9.339 6.733 1.00 . A C . 562 VAL H 1 1
1 62 1 1 6 VAL HA H 1.575 8.330 5.460 1.00 . A C . 562 VAL HA 1 1
1 63 1 1 6 VAL HB H 2.593 6.425 4.486 1.00 . A C . 562 VAL HB 1 1
1 64 1 1 6 VAL HG11 H 3.114 8.816 3.499 1.00 . A C . 562 VAL HG11 1 1
1 65 1 1 6 VAL HG12 H 4.773 8.426 3.966 1.00 . A C . 562 VAL HG12 1 1
1 66 1 1 6 VAL HG13 H 3.907 7.391 2.827 1.00 . A C . 562 VAL HG13 1 1
1 67 1 1 6 VAL HG21 H 5.101 7.227 5.997 1.00 . A C . 562 VAL HG21 1 1
1 68 1 1 6 VAL HG22 H 4.070 5.839 6.351 1.00 . A C . 562 VAL HG22 1 1
1 69 1 1 6 VAL HG23 H 5.000 5.888 4.853 1.00 . A C . 562 VAL HG23 1 1
1 70 1 1 6 VAL N N 3.338 9.317 6.066 1.00 . A C . 562 VAL N 1 1
1 71 1 1 6 VAL O O 2.949 7.685 8.193 1.00 . A C . 562 VAL O 1 1
1 72 1 1 7 SER C C 0.816 4.128 8.036 1.00 . A C . 563 SER C 1 1
1 73 1 1 7 SER CA C 1.352 5.508 8.421 1.00 . A C . 563 SER CA 1 1
1 74 1 1 7 SER CB C 0.332 6.226 9.305 1.00 . A C . 563 SER CB 1 1
1 75 1 1 7 SER H H 1.129 6.035 6.347 1.00 . A C . 563 SER H 1 1
1 76 1 1 7 SER HA H 2.284 5.399 8.955 1.00 . A C . 563 SER HA 1 1
1 77 1 1 7 SER HB2 H -0.622 6.258 8.805 1.00 . A C . 563 SER HB2 1 1
1 78 1 1 7 SER HB3 H 0.229 5.691 10.240 1.00 . A C . 563 SER HB3 1 1
1 79 1 1 7 SER HG H 0.223 7.930 10.238 1.00 . A C . 563 SER HG 1 1
1 80 1 1 7 SER N N 1.577 6.297 7.178 1.00 . A C . 563 SER N 1 1
1 81 1 1 7 SER O O -0.014 4.002 7.159 1.00 . A C . 563 SER O 1 1
1 82 1 1 7 SER OG O 0.776 7.554 9.550 1.00 . A C . 563 SER OG 1 1
1 83 1 1 8 ALA C C 0.005 1.138 9.492 1.00 . A C . 564 ALA C 1 1
1 84 1 1 8 ALA CA C 0.791 1.728 8.320 1.00 . A C . 564 ALA CA 1 1
1 85 1 1 8 ALA CB C 1.980 0.821 7.993 1.00 . A C . 564 ALA CB 1 1
1 86 1 1 8 ALA H H 1.957 3.205 9.374 1.00 . A C . 564 ALA H 1 1
1 87 1 1 8 ALA HA H 0.146 1.795 7.456 1.00 . A C . 564 ALA HA 1 1
1 88 1 1 8 ALA HB1 H 2.603 1.299 7.252 1.00 . A C . 564 ALA HB1 1 1
1 89 1 1 8 ALA HB2 H 1.618 -0.121 7.605 1.00 . A C . 564 ALA HB2 1 1
1 90 1 1 8 ALA HB3 H 2.556 0.645 8.889 1.00 . A C . 564 ALA HB3 1 1
1 91 1 1 8 ALA N N 1.283 3.090 8.672 1.00 . A C . 564 ALA N 1 1
1 92 1 1 8 ALA O O 0.463 1.122 10.618 1.00 . A C . 564 ALA O 1 1
1 93 1 1 9 VAL C C -2.458 -1.341 9.891 1.00 . A C . 565 VAL C 1 1
1 94 1 1 9 VAL CA C -2.000 0.050 10.320 1.00 . A C . 565 VAL CA 1 1
1 95 1 1 9 VAL CB C -3.231 0.919 10.565 1.00 . A C . 565 VAL CB 1 1
1 96 1 1 9 VAL CG1 C -3.731 0.708 11.995 1.00 . A C . 565 VAL CG1 1 1
1 97 1 1 9 VAL CG2 C -2.860 2.388 10.365 1.00 . A C . 565 VAL CG2 1 1
1 98 1 1 9 VAL H H -1.521 0.669 8.314 1.00 . A C . 565 VAL H 1 1
1 99 1 1 9 VAL HA H -1.416 -0.018 11.225 1.00 . A C . 565 VAL HA 1 1
1 100 1 1 9 VAL HB H -4.008 0.639 9.866 1.00 . A C . 565 VAL HB 1 1
1 101 1 1 9 VAL HG11 H -2.945 0.266 12.590 1.00 . A C . 565 VAL HG11 1 1
1 102 1 1 9 VAL HG12 H -4.012 1.660 12.422 1.00 . A C . 565 VAL HG12 1 1
1 103 1 1 9 VAL HG13 H -4.587 0.051 11.984 1.00 . A C . 565 VAL HG13 1 1
1 104 1 1 9 VAL HG21 H -1.819 2.531 10.615 1.00 . A C . 565 VAL HG21 1 1
1 105 1 1 9 VAL HG22 H -3.024 2.664 9.334 1.00 . A C . 565 VAL HG22 1 1
1 106 1 1 9 VAL HG23 H -3.473 3.004 11.006 1.00 . A C . 565 VAL HG23 1 1
1 107 1 1 9 VAL N N -1.176 0.648 9.231 1.00 . A C . 565 VAL N 1 1
1 108 1 1 9 VAL O O -2.516 -1.643 8.717 1.00 . A C . 565 VAL O 1 1
1 109 1 1 10 ARG C C -4.698 -3.458 9.939 1.00 . A C . 566 ARG C 1 1
1 110 1 1 10 ARG CA C -3.265 -3.551 10.458 1.00 . A C . 566 ARG CA 1 1
1 111 1 1 10 ARG CB C -3.217 -4.463 11.686 1.00 . A C . 566 ARG CB 1 1
1 112 1 1 10 ARG CD C -1.255 -5.379 12.933 1.00 . A C . 566 ARG CD 1 1
1 113 1 1 10 ARG CG C -2.001 -4.102 12.541 1.00 . A C . 566 ARG CG 1 1
1 114 1 1 10 ARG CZ C -0.783 -5.927 15.245 1.00 . A C . 566 ARG CZ 1 1
1 115 1 1 10 ARG H H -2.753 -1.919 11.769 1.00 . A C . 566 ARG H 1 1
1 116 1 1 10 ARG HA H -2.629 -3.951 9.680 1.00 . A C . 566 ARG HA 1 1
1 117 1 1 10 ARG HB2 H -4.118 -4.332 12.266 1.00 . A C . 566 ARG HB2 1 1
1 118 1 1 10 ARG HB3 H -3.138 -5.491 11.368 1.00 . A C . 566 ARG HB3 1 1
1 119 1 1 10 ARG HD2 H -1.489 -6.163 12.228 1.00 . A C . 566 ARG HD2 1 1
1 120 1 1 10 ARG HD3 H -0.191 -5.192 12.924 1.00 . A C . 566 ARG HD3 1 1
1 121 1 1 10 ARG HE H -2.618 -5.977 14.490 1.00 . A C . 566 ARG HE 1 1
1 122 1 1 10 ARG HG2 H -1.342 -3.459 11.975 1.00 . A C . 566 ARG HG2 1 1
1 123 1 1 10 ARG HG3 H -2.327 -3.589 13.433 1.00 . A C . 566 ARG HG3 1 1
1 124 1 1 10 ARG HH11 H 0.163 -4.220 14.796 1.00 . A C . 566 ARG HH11 1 1
1 125 1 1 10 ARG HH12 H 0.822 -5.115 16.125 1.00 . A C . 566 ARG HH12 1 1
1 126 1 1 10 ARG HH21 H -1.519 -7.664 15.915 1.00 . A C . 566 ARG HH21 1 1
1 127 1 1 10 ARG HH22 H -0.130 -7.064 16.758 1.00 . A C . 566 ARG HH22 1 1
1 128 1 1 10 ARG N N -2.797 -2.186 10.827 1.00 . A C . 566 ARG N 1 1
1 129 1 1 10 ARG NE N -1.674 -5.798 14.300 1.00 . A C . 566 ARG NE 1 1
1 130 1 1 10 ARG NH1 N 0.139 -5.017 15.401 1.00 . A C . 566 ARG NH1 1 1
1 131 1 1 10 ARG NH2 N -0.813 -6.966 16.034 1.00 . A C . 566 ARG NH2 1 1
1 132 1 1 10 ARG O O -5.613 -4.044 10.482 1.00 . A C . 566 ARG O 1 1
1 133 1 1 11 GLY C C -6.926 -3.919 8.193 1.00 . A C . 567 GLY C 1 1
1 134 1 1 11 GLY CA C -6.245 -2.553 8.302 1.00 . A C . 567 GLY CA 1 1
1 135 1 1 11 GLY H H -4.129 -2.259 8.482 1.00 . A C . 567 GLY H 1 1
1 136 1 1 11 GLY HA2 H -6.155 -2.116 7.317 1.00 . A C . 567 GLY HA2 1 1
1 137 1 1 11 GLY HA3 H -6.833 -1.903 8.934 1.00 . A C . 567 GLY HA3 1 1
1 138 1 1 11 GLY N N -4.887 -2.715 8.888 1.00 . A C . 567 GLY N 1 1
1 139 1 1 11 GLY O O -6.341 -4.941 8.492 1.00 . A C . 567 GLY O 1 1
1 140 1 1 12 GLU C C -7.946 -6.309 7.084 1.00 . A C . 568 GLU C 1 1
1 141 1 1 12 GLU CA C -8.887 -5.241 7.647 1.00 . A C . 568 GLU CA 1 1
1 142 1 1 12 GLU CB C -10.082 -5.069 6.706 1.00 . A C . 568 GLU CB 1 1
1 143 1 1 12 GLU CD C -12.576 -4.930 6.756 1.00 . A C . 568 GLU CD 1 1
1 144 1 1 12 GLU CG C -11.290 -4.568 7.501 1.00 . A C . 568 GLU CG 1 1
1 145 1 1 12 GLU H H -8.616 -3.107 7.540 1.00 . A C . 568 GLU H 1 1
1 146 1 1 12 GLU HA H -9.239 -5.551 8.620 1.00 . A C . 568 GLU HA 1 1
1 147 1 1 12 GLU HB2 H -9.833 -4.352 5.937 1.00 . A C . 568 GLU HB2 1 1
1 148 1 1 12 GLU HB3 H -10.321 -6.018 6.251 1.00 . A C . 568 GLU HB3 1 1
1 149 1 1 12 GLU HG2 H -11.295 -5.031 8.477 1.00 . A C . 568 GLU HG2 1 1
1 150 1 1 12 GLU HG3 H -11.229 -3.496 7.610 1.00 . A C . 568 GLU HG3 1 1
1 151 1 1 12 GLU N N -8.162 -3.944 7.772 1.00 . A C . 568 GLU N 1 1
1 152 1 1 12 GLU O O -6.922 -6.005 6.506 1.00 . A C . 568 GLU O 1 1
1 153 1 1 12 GLU OE1 O -12.490 -5.235 5.578 1.00 . A C . 568 GLU OE1 1 1
1 154 1 1 12 GLU OE2 O -13.626 -4.897 7.377 1.00 . A C . 568 GLU OE2 1 1
1 155 1 1 13 GLU C C -8.220 -9.936 6.597 1.00 . A C . 569 GLU C 1 1
1 156 1 1 13 GLU CA C -7.410 -8.644 6.725 1.00 . A C . 569 GLU CA 1 1
1 157 1 1 13 GLU CB C -6.242 -8.868 7.687 1.00 . A C . 569 GLU CB 1 1
1 158 1 1 13 GLU CD C -5.596 -9.115 10.089 1.00 . A C . 569 GLU CD 1 1
1 159 1 1 13 GLU CG C -6.764 -8.900 9.125 1.00 . A C . 569 GLU CG 1 1
1 160 1 1 13 GLU H H -9.115 -7.782 7.720 1.00 . A C . 569 GLU H 1 1
1 161 1 1 13 GLU HA H -7.028 -8.362 5.755 1.00 . A C . 569 GLU HA 1 1
1 162 1 1 13 GLU HB2 H -5.761 -9.808 7.457 1.00 . A C . 569 GLU HB2 1 1
1 163 1 1 13 GLU HB3 H -5.530 -8.064 7.583 1.00 . A C . 569 GLU HB3 1 1
1 164 1 1 13 GLU HG2 H -7.251 -7.962 9.351 1.00 . A C . 569 GLU HG2 1 1
1 165 1 1 13 GLU HG3 H -7.472 -9.708 9.233 1.00 . A C . 569 GLU HG3 1 1
1 166 1 1 13 GLU N N -8.285 -7.558 7.250 1.00 . A C . 569 GLU N 1 1
1 167 1 1 13 GLU O O -9.421 -9.948 6.781 1.00 . A C . 569 GLU O 1 1
1 168 1 1 13 GLU OE1 O -5.188 -10.253 10.249 1.00 . A C . 569 GLU OE1 1 1
1 169 1 1 13 GLU OE2 O -5.130 -8.138 10.651 1.00 . A C . 569 GLU OE2 1 1
1 170 1 1 14 TRP C C -7.364 -13.473 6.502 1.00 . A C . 570 TRP C 1 1
1 171 1 1 14 TRP CA C -8.304 -12.317 6.151 1.00 . A C . 570 TRP CA 1 1
1 172 1 1 14 TRP CB C -8.797 -12.479 4.712 1.00 . A C . 570 TRP CB 1 1
1 173 1 1 14 TRP CD1 C -10.936 -11.140 4.577 1.00 . A C . 570 TRP CD1 1 1
1 174 1 1 14 TRP CD2 C -9.191 -10.080 3.632 1.00 . A C . 570 TRP CD2 1 1
1 175 1 1 14 TRP CE2 C -10.311 -9.227 3.487 1.00 . A C . 570 TRP CE2 1 1
1 176 1 1 14 TRP CE3 C -7.956 -9.646 3.118 1.00 . A C . 570 TRP CE3 1 1
1 177 1 1 14 TRP CG C -9.615 -11.288 4.327 1.00 . A C . 570 TRP CG 1 1
1 178 1 1 14 TRP CH2 C -8.974 -7.571 2.350 1.00 . A C . 570 TRP CH2 1 1
1 179 1 1 14 TRP CZ2 C -10.209 -7.987 2.855 1.00 . A C . 570 TRP CZ2 1 1
1 180 1 1 14 TRP CZ3 C -7.850 -8.398 2.481 1.00 . A C . 570 TRP CZ3 1 1
1 181 1 1 14 TRP H H -6.603 -10.995 6.145 1.00 . A C . 570 TRP H 1 1
1 182 1 1 14 TRP HA H -9.149 -12.324 6.824 1.00 . A C . 570 TRP HA 1 1
1 183 1 1 14 TRP HB2 H -7.950 -12.564 4.048 1.00 . A C . 570 TRP HB2 1 1
1 184 1 1 14 TRP HB3 H -9.403 -13.370 4.637 1.00 . A C . 570 TRP HB3 1 1
1 185 1 1 14 TRP HD1 H -11.565 -11.858 5.082 1.00 . A C . 570 TRP HD1 1 1
1 186 1 1 14 TRP HE1 H -12.264 -9.567 4.130 1.00 . A C . 570 TRP HE1 1 1
1 187 1 1 14 TRP HE3 H -7.084 -10.275 3.213 1.00 . A C . 570 TRP HE3 1 1
1 188 1 1 14 TRP HH2 H -8.886 -6.613 1.859 1.00 . A C . 570 TRP HH2 1 1
1 189 1 1 14 TRP HZ2 H -11.078 -7.354 2.757 1.00 . A C . 570 TRP HZ2 1 1
1 190 1 1 14 TRP HZ3 H -6.897 -8.074 2.090 1.00 . A C . 570 TRP HZ3 1 1
1 191 1 1 14 TRP N N -7.572 -11.026 6.287 1.00 . A C . 570 TRP N 1 1
1 192 1 1 14 TRP NE1 N -11.350 -9.917 4.079 1.00 . A C . 570 TRP NE1 1 1
1 193 1 1 14 TRP O O -6.293 -13.273 7.039 1.00 . A C . 570 TRP O 1 1
1 194 1 1 15 ALA C C -5.972 -16.143 5.333 1.00 . A C . 571 ALA C 1 1
1 195 1 1 15 ALA CA C -6.884 -15.847 6.524 1.00 . A C . 571 ALA CA 1 1
1 196 1 1 15 ALA CB C -7.755 -17.070 6.817 1.00 . A C . 571 ALA CB 1 1
1 197 1 1 15 ALA H H -8.625 -14.823 5.773 1.00 . A C . 571 ALA H 1 1
1 198 1 1 15 ALA HA H -6.282 -15.618 7.391 1.00 . A C . 571 ALA HA 1 1
1 199 1 1 15 ALA HB1 H -8.660 -16.757 7.315 1.00 . A C . 571 ALA HB1 1 1
1 200 1 1 15 ALA HB2 H -7.212 -17.754 7.452 1.00 . A C . 571 ALA HB2 1 1
1 201 1 1 15 ALA HB3 H -8.006 -17.563 5.890 1.00 . A C . 571 ALA HB3 1 1
1 202 1 1 15 ALA N N -7.757 -14.682 6.205 1.00 . A C . 571 ALA N 1 1
1 203 1 1 15 ALA O O -4.786 -16.359 5.486 1.00 . A C . 571 ALA O 1 1
1 204 1 1 16 ASP C C -4.968 -15.159 2.505 1.00 . A C . 572 ASP C 1 1
1 205 1 1 16 ASP CA C -5.677 -16.441 2.947 1.00 . A C . 572 ASP CA 1 1
1 206 1 1 16 ASP CB C -6.567 -16.950 1.811 1.00 . A C . 572 ASP CB 1 1
1 207 1 1 16 ASP CG C -7.194 -18.286 2.214 1.00 . A C . 572 ASP CG 1 1
1 208 1 1 16 ASP H H -7.473 -15.981 4.044 1.00 . A C . 572 ASP H 1 1
1 209 1 1 16 ASP HA H -4.941 -17.192 3.193 1.00 . A C . 572 ASP HA 1 1
1 210 1 1 16 ASP HB2 H -7.347 -16.229 1.615 1.00 . A C . 572 ASP HB2 1 1
1 211 1 1 16 ASP HB3 H -5.971 -17.088 0.922 1.00 . A C . 572 ASP HB3 1 1
1 212 1 1 16 ASP N N -6.515 -16.157 4.146 1.00 . A C . 572 ASP N 1 1
1 213 1 1 16 ASP O O -3.925 -15.199 1.882 1.00 . A C . 572 ASP O 1 1
1 214 1 1 16 ASP OD1 O -7.849 -18.324 3.242 1.00 . A C . 572 ASP OD1 1 1
1 215 1 1 16 ASP OD2 O -7.009 -19.248 1.487 1.00 . A C . 572 ASP OD2 1 1
1 216 1 1 17 ARG C C -5.103 -11.692 3.512 1.00 . A C . 573 ARG C 1 1
1 217 1 1 17 ARG CA C -4.880 -12.739 2.419 1.00 . A C . 573 ARG CA 1 1
1 218 1 1 17 ARG CB C -5.489 -12.240 1.104 1.00 . A C . 573 ARG CB 1 1
1 219 1 1 17 ARG CD C -7.417 -12.542 -0.458 1.00 . A C . 573 ARG CD 1 1
1 220 1 1 17 ARG CG C -6.577 -13.209 0.633 1.00 . A C . 573 ARG CG 1 1
1 221 1 1 17 ARG CZ C -9.788 -12.300 -0.893 1.00 . A C . 573 ARG CZ 1 1
1 222 1 1 17 ARG H H -6.365 -14.011 3.326 1.00 . A C . 573 ARG H 1 1
1 223 1 1 17 ARG HA H -3.820 -12.897 2.286 1.00 . A C . 573 ARG HA 1 1
1 224 1 1 17 ARG HB2 H -5.922 -11.262 1.258 1.00 . A C . 573 ARG HB2 1 1
1 225 1 1 17 ARG HB3 H -4.717 -12.177 0.352 1.00 . A C . 573 ARG HB3 1 1
1 226 1 1 17 ARG HD2 H -7.045 -11.545 -0.640 1.00 . A C . 573 ARG HD2 1 1
1 227 1 1 17 ARG HD3 H -7.354 -13.122 -1.367 1.00 . A C . 573 ARG HD3 1 1
1 228 1 1 17 ARG HE H -9.059 -12.547 0.938 1.00 . A C . 573 ARG HE 1 1
1 229 1 1 17 ARG HG2 H -6.115 -14.103 0.237 1.00 . A C . 573 ARG HG2 1 1
1 230 1 1 17 ARG HG3 H -7.212 -13.471 1.465 1.00 . A C . 573 ARG HG3 1 1
1 231 1 1 17 ARG HH11 H -8.617 -11.340 -2.202 1.00 . A C . 573 ARG HH11 1 1
1 232 1 1 17 ARG HH12 H -10.266 -11.554 -2.688 1.00 . A C . 573 ARG HH12 1 1
1 233 1 1 17 ARG HH21 H -11.181 -13.222 0.211 1.00 . A C . 573 ARG HH21 1 1
1 234 1 1 17 ARG HH22 H -11.717 -12.620 -1.322 1.00 . A C . 573 ARG HH22 1 1
1 235 1 1 17 ARG N N -5.524 -14.022 2.822 1.00 . A C . 573 ARG N 1 1
1 236 1 1 17 ARG NE N -8.838 -12.469 -0.014 1.00 . A C . 573 ARG NE 1 1
1 237 1 1 17 ARG NH1 N -9.537 -11.683 -2.015 1.00 . A C . 573 ARG NH1 1 1
1 238 1 1 17 ARG NH2 N -10.989 -12.749 -0.649 1.00 . A C . 573 ARG NH2 1 1
1 239 1 1 17 ARG O O -6.042 -11.773 4.279 1.00 . A C . 573 ARG O 1 1
1 240 1 1 18 PHE C C -4.475 -8.284 3.963 1.00 . A C . 574 PHE C 1 1
1 241 1 1 18 PHE CA C -4.415 -9.658 4.632 1.00 . A C . 574 PHE CA 1 1
1 242 1 1 18 PHE CB C -3.230 -9.706 5.599 1.00 . A C . 574 PHE CB 1 1
1 243 1 1 18 PHE CD1 C -1.579 -7.986 4.781 1.00 . A C . 574 PHE CD1 1 1
1 244 1 1 18 PHE CD2 C -1.179 -10.323 4.271 1.00 . A C . 574 PHE CD2 1 1
1 245 1 1 18 PHE CE1 C -0.406 -7.637 4.102 1.00 . A C . 574 PHE CE1 1 1
1 246 1 1 18 PHE CE2 C -0.005 -9.973 3.591 1.00 . A C . 574 PHE CE2 1 1
1 247 1 1 18 PHE CG C -1.965 -9.329 4.866 1.00 . A C . 574 PHE CG 1 1
1 248 1 1 18 PHE CZ C 0.381 -8.631 3.507 1.00 . A C . 574 PHE CZ 1 1
1 249 1 1 18 PHE H H -3.499 -10.662 2.961 1.00 . A C . 574 PHE H 1 1
1 250 1 1 18 PHE HA H -5.331 -9.834 5.177 1.00 . A C . 574 PHE HA 1 1
1 251 1 1 18 PHE HB2 H -3.398 -9.011 6.409 1.00 . A C . 574 PHE HB2 1 1
1 252 1 1 18 PHE HB3 H -3.130 -10.705 5.997 1.00 . A C . 574 PHE HB3 1 1
1 253 1 1 18 PHE HD1 H -2.186 -7.220 5.240 1.00 . A C . 574 PHE HD1 1 1
1 254 1 1 18 PHE HD2 H -1.477 -11.359 4.336 1.00 . A C . 574 PHE HD2 1 1
1 255 1 1 18 PHE HE1 H -0.108 -6.601 4.037 1.00 . A C . 574 PHE HE1 1 1
1 256 1 1 18 PHE HE2 H 0.601 -10.740 3.132 1.00 . A C . 574 PHE HE2 1 1
1 257 1 1 18 PHE HZ H 1.286 -8.361 2.983 1.00 . A C . 574 PHE HZ 1 1
1 258 1 1 18 PHE N N -4.249 -10.709 3.589 1.00 . A C . 574 PHE N 1 1
1 259 1 1 18 PHE O O -4.024 -8.105 2.849 1.00 . A C . 574 PHE O 1 1
1 260 1 1 19 ASN C C -4.498 -4.930 4.983 1.00 . A C . 575 ASN C 1 1
1 261 1 1 19 ASN CA C -5.118 -5.950 4.030 1.00 . A C . 575 ASN CA 1 1
1 262 1 1 19 ASN CB C -6.585 -5.588 3.795 1.00 . A C . 575 ASN CB 1 1
1 263 1 1 19 ASN CG C -6.696 -4.661 2.582 1.00 . A C . 575 ASN CG 1 1
1 264 1 1 19 ASN H H -5.389 -7.474 5.529 1.00 . A C . 575 ASN H 1 1
1 265 1 1 19 ASN HA H -4.587 -5.934 3.090 1.00 . A C . 575 ASN HA 1 1
1 266 1 1 19 ASN HB2 H -7.155 -6.488 3.615 1.00 . A C . 575 ASN HB2 1 1
1 267 1 1 19 ASN HB3 H -6.974 -5.082 4.666 1.00 . A C . 575 ASN HB3 1 1
1 268 1 1 19 ASN HD21 H -7.057 -6.139 1.306 1.00 . A C . 575 ASN HD21 1 1
1 269 1 1 19 ASN HD22 H -7.016 -4.586 0.624 1.00 . A C . 575 ASN HD22 1 1
1 270 1 1 19 ASN N N -5.030 -7.310 4.632 1.00 . A C . 575 ASN N 1 1
1 271 1 1 19 ASN ND2 N -6.944 -5.171 1.406 1.00 . A C . 575 ASN ND2 1 1
1 272 1 1 19 ASN O O -4.139 -5.244 6.101 1.00 . A C . 575 ASN O 1 1
1 273 1 1 19 ASN OD1 O -6.555 -3.461 2.706 1.00 . A C . 575 ASN OD1 1 1
1 274 1 1 20 VAL C C -4.397 -1.306 5.084 1.00 . A C . 576 VAL C 1 1
1 275 1 1 20 VAL CA C -3.782 -2.661 5.427 1.00 . A C . 576 VAL CA 1 1
1 276 1 1 20 VAL CB C -2.271 -2.596 5.207 1.00 . A C . 576 VAL CB 1 1
1 277 1 1 20 VAL CG1 C -1.595 -1.975 6.429 1.00 . A C . 576 VAL CG1 1 1
1 278 1 1 20 VAL CG2 C -1.725 -4.008 4.993 1.00 . A C . 576 VAL CG2 1 1
1 279 1 1 20 VAL H H -4.672 -3.477 3.645 1.00 . A C . 576 VAL H 1 1
1 280 1 1 20 VAL HA H -3.987 -2.899 6.461 1.00 . A C . 576 VAL HA 1 1
1 281 1 1 20 VAL HB H -2.066 -1.989 4.341 1.00 . A C . 576 VAL HB 1 1
1 282 1 1 20 VAL HG11 H -2.148 -1.103 6.743 1.00 . A C . 576 VAL HG11 1 1
1 283 1 1 20 VAL HG12 H -1.571 -2.697 7.232 1.00 . A C . 576 VAL HG12 1 1
1 284 1 1 20 VAL HG13 H -0.585 -1.688 6.174 1.00 . A C . 576 VAL HG13 1 1
1 285 1 1 20 VAL HG21 H -2.292 -4.500 4.217 1.00 . A C . 576 VAL HG21 1 1
1 286 1 1 20 VAL HG22 H -0.687 -3.951 4.699 1.00 . A C . 576 VAL HG22 1 1
1 287 1 1 20 VAL HG23 H -1.809 -4.568 5.913 1.00 . A C . 576 VAL HG23 1 1
1 288 1 1 20 VAL N N -4.373 -3.708 4.549 1.00 . A C . 576 VAL N 1 1
1 289 1 1 20 VAL O O -4.877 -1.086 3.989 1.00 . A C . 576 VAL O 1 1
1 290 1 1 21 THR C C -3.876 2.010 6.013 1.00 . A C . 577 THR C 1 1
1 291 1 1 21 THR CA C -4.952 0.953 5.757 1.00 . A C . 577 THR CA 1 1
1 292 1 1 21 THR CB C -6.137 1.192 6.696 1.00 . A C . 577 THR CB 1 1
1 293 1 1 21 THR CG2 C -6.626 2.633 6.549 1.00 . A C . 577 THR CG2 1 1
1 294 1 1 21 THR H H -3.981 -0.605 6.882 1.00 . A C . 577 THR H 1 1
1 295 1 1 21 THR HA H -5.284 1.016 4.731 1.00 . A C . 577 THR HA 1 1
1 296 1 1 21 THR HB H -5.828 1.024 7.716 1.00 . A C . 577 THR HB 1 1
1 297 1 1 21 THR HG1 H -7.619 0.030 7.182 1.00 . A C . 577 THR HG1 1 1
1 298 1 1 21 THR HG21 H -5.906 3.201 5.977 1.00 . A C . 577 THR HG21 1 1
1 299 1 1 21 THR HG22 H -7.577 2.641 6.038 1.00 . A C . 577 THR HG22 1 1
1 300 1 1 21 THR HG23 H -6.738 3.077 7.527 1.00 . A C . 577 THR HG23 1 1
1 301 1 1 21 THR N N -4.378 -0.398 6.013 1.00 . A C . 577 THR N 1 1
1 302 1 1 21 THR O O -3.675 2.448 7.128 1.00 . A C . 577 THR O 1 1
1 303 1 1 21 THR OG1 O -7.189 0.296 6.366 1.00 . A C . 577 THR OG1 1 1
1 304 1 1 22 TYR C C -2.739 4.835 5.259 1.00 . A C . 578 TYR C 1 1
1 305 1 1 22 TYR CA C -2.110 3.443 5.179 1.00 . A C . 578 TYR CA 1 1
1 306 1 1 22 TYR CB C -1.135 3.390 4.001 1.00 . A C . 578 TYR CB 1 1
1 307 1 1 22 TYR CD1 C 0.443 1.632 4.883 1.00 . A C . 578 TYR CD1 1 1
1 308 1 1 22 TYR CD2 C -0.869 1.137 2.904 1.00 . A C . 578 TYR CD2 1 1
1 309 1 1 22 TYR CE1 C 1.026 0.361 4.813 1.00 . A C . 578 TYR CE1 1 1
1 310 1 1 22 TYR CE2 C -0.285 -0.133 2.834 1.00 . A C . 578 TYR CE2 1 1
1 311 1 1 22 TYR CG C -0.505 2.020 3.928 1.00 . A C . 578 TYR CG 1 1
1 312 1 1 22 TYR CZ C 0.663 -0.521 3.789 1.00 . A C . 578 TYR CZ 1 1
1 313 1 1 22 TYR H H -3.350 2.051 4.098 1.00 . A C . 578 TYR H 1 1
1 314 1 1 22 TYR HA H -1.578 3.237 6.095 1.00 . A C . 578 TYR HA 1 1
1 315 1 1 22 TYR HB2 H -1.669 3.591 3.083 1.00 . A C . 578 TYR HB2 1 1
1 316 1 1 22 TYR HB3 H -0.364 4.133 4.139 1.00 . A C . 578 TYR HB3 1 1
1 317 1 1 22 TYR HD1 H 0.723 2.312 5.673 1.00 . A C . 578 TYR HD1 1 1
1 318 1 1 22 TYR HD2 H -1.600 1.436 2.167 1.00 . A C . 578 TYR HD2 1 1
1 319 1 1 22 TYR HE1 H 1.757 0.062 5.550 1.00 . A C . 578 TYR HE1 1 1
1 320 1 1 22 TYR HE2 H -0.566 -0.814 2.044 1.00 . A C . 578 TYR HE2 1 1
1 321 1 1 22 TYR HH H 0.882 -2.303 4.437 1.00 . A C . 578 TYR HH 1 1
1 322 1 1 22 TYR N N -3.177 2.420 4.989 1.00 . A C . 578 TYR N 1 1
1 323 1 1 22 TYR O O -3.732 5.118 4.618 1.00 . A C . 578 TYR O 1 1
1 324 1 1 22 TYR OH O 1.238 -1.773 3.720 1.00 . A C . 578 TYR OH 1 1
1 325 1 1 23 SER C C -1.653 8.111 5.812 1.00 . A C . 579 SER C 1 1
1 326 1 1 23 SER CA C -2.729 7.083 6.168 1.00 . A C . 579 SER CA 1 1
1 327 1 1 23 SER CB C -3.199 7.314 7.604 1.00 . A C . 579 SER CB 1 1
1 328 1 1 23 SER H H -1.368 5.460 6.552 1.00 . A C . 579 SER H 1 1
1 329 1 1 23 SER HA H -3.567 7.191 5.494 1.00 . A C . 579 SER HA 1 1
1 330 1 1 23 SER HB2 H -2.380 7.145 8.284 1.00 . A C . 579 SER HB2 1 1
1 331 1 1 23 SER HB3 H -3.546 8.334 7.709 1.00 . A C . 579 SER HB3 1 1
1 332 1 1 23 SER HG H -4.123 6.092 8.803 1.00 . A C . 579 SER HG 1 1
1 333 1 1 23 SER N N -2.167 5.709 6.044 1.00 . A C . 579 SER N 1 1
1 334 1 1 23 SER O O -0.493 7.951 6.141 1.00 . A C . 579 SER O 1 1
1 335 1 1 23 SER OG O -4.252 6.408 7.906 1.00 . A C . 579 SER OG 1 1
1 336 1 1 24 VAL C C -1.416 11.534 5.408 1.00 . A C . 580 VAL C 1 1
1 337 1 1 24 VAL CA C -1.036 10.205 4.754 1.00 . A C . 580 VAL CA 1 1
1 338 1 1 24 VAL CB C -1.037 10.352 3.231 1.00 . A C . 580 VAL CB 1 1
1 339 1 1 24 VAL CG1 C -0.372 11.666 2.821 1.00 . A C . 580 VAL CG1 1 1
1 340 1 1 24 VAL CG2 C -0.263 9.188 2.621 1.00 . A C . 580 VAL CG2 1 1
1 341 1 1 24 VAL H H -2.968 9.267 4.880 1.00 . A C . 580 VAL H 1 1
1 342 1 1 24 VAL HA H -0.053 9.907 5.087 1.00 . A C . 580 VAL HA 1 1
1 343 1 1 24 VAL HB H -2.054 10.336 2.868 1.00 . A C . 580 VAL HB 1 1
1 344 1 1 24 VAL HG11 H -0.760 12.472 3.424 1.00 . A C . 580 VAL HG11 1 1
1 345 1 1 24 VAL HG12 H 0.696 11.587 2.964 1.00 . A C . 580 VAL HG12 1 1
1 346 1 1 24 VAL HG13 H -0.583 11.862 1.777 1.00 . A C . 580 VAL HG13 1 1
1 347 1 1 24 VAL HG21 H 0.420 8.787 3.355 1.00 . A C . 580 VAL HG21 1 1
1 348 1 1 24 VAL HG22 H -0.954 8.419 2.312 1.00 . A C . 580 VAL HG22 1 1
1 349 1 1 24 VAL HG23 H 0.294 9.539 1.764 1.00 . A C . 580 VAL HG23 1 1
1 350 1 1 24 VAL N N -2.029 9.163 5.138 1.00 . A C . 580 VAL N 1 1
1 351 1 1 24 VAL O O -2.564 11.775 5.725 1.00 . A C . 580 VAL O 1 1
1 352 1 1 25 SER C C -0.835 14.798 5.186 1.00 . A C . 581 SER C 1 1
1 353 1 1 25 SER CA C -0.775 13.709 6.257 1.00 . A C . 581 SER CA 1 1
1 354 1 1 25 SER CB C 0.314 14.053 7.274 1.00 . A C . 581 SER CB 1 1
1 355 1 1 25 SER H H 0.461 12.188 5.358 1.00 . A C . 581 SER H 1 1
1 356 1 1 25 SER HA H -1.729 13.645 6.759 1.00 . A C . 581 SER HA 1 1
1 357 1 1 25 SER HB2 H 1.046 13.263 7.302 1.00 . A C . 581 SER HB2 1 1
1 358 1 1 25 SER HB3 H 0.796 14.977 6.984 1.00 . A C . 581 SER HB3 1 1
1 359 1 1 25 SER HG H -0.203 13.348 9.012 1.00 . A C . 581 SER HG 1 1
1 360 1 1 25 SER N N -0.462 12.400 5.618 1.00 . A C . 581 SER N 1 1
1 361 1 1 25 SER O O -1.890 15.310 4.865 1.00 . A C . 581 SER O 1 1
1 362 1 1 25 SER OG O -0.274 14.192 8.560 1.00 . A C . 581 SER OG 1 1
1 363 1 1 26 GLY C C 1.161 15.758 2.404 1.00 . A C . 582 GLY C 1 1
1 364 1 1 26 GLY CA C 0.293 16.213 3.578 1.00 . A C . 582 GLY CA 1 1
1 365 1 1 26 GLY H H 1.128 14.731 4.900 1.00 . A C . 582 GLY H 1 1
1 366 1 1 26 GLY HA2 H 0.697 17.126 3.987 1.00 . A C . 582 GLY HA2 1 1
1 367 1 1 26 GLY HA3 H -0.718 16.385 3.236 1.00 . A C . 582 GLY HA3 1 1
1 368 1 1 26 GLY N N 0.288 15.157 4.628 1.00 . A C . 582 GLY N 1 1
1 369 1 1 26 GLY O O 1.961 16.510 1.884 1.00 . A C . 582 GLY O 1 1
1 370 1 1 27 SER C C 1.151 14.410 -0.478 1.00 . A C . 583 SER C 1 1
1 371 1 1 27 SER CA C 1.829 14.036 0.840 1.00 . A C . 583 SER CA 1 1
1 372 1 1 27 SER CB C 1.964 12.516 0.930 1.00 . A C . 583 SER CB 1 1
1 373 1 1 27 SER H H 0.360 13.939 2.412 1.00 . A C . 583 SER H 1 1
1 374 1 1 27 SER HA H 2.810 14.486 0.880 1.00 . A C . 583 SER HA 1 1
1 375 1 1 27 SER HB2 H 0.992 12.061 0.845 1.00 . A C . 583 SER HB2 1 1
1 376 1 1 27 SER HB3 H 2.595 12.163 0.126 1.00 . A C . 583 SER HB3 1 1
1 377 1 1 27 SER HG H 2.156 12.746 2.852 1.00 . A C . 583 SER HG 1 1
1 378 1 1 27 SER N N 1.010 14.532 1.980 1.00 . A C . 583 SER N 1 1
1 379 1 1 27 SER O O 1.018 13.595 -1.369 1.00 . A C . 583 SER O 1 1
1 380 1 1 27 SER OG O 2.535 12.169 2.185 1.00 . A C . 583 SER OG 1 1
1 381 1 1 28 SER C C 0.797 15.439 -3.061 1.00 . A C . 584 SER C 1 1
1 382 1 1 28 SER CA C 0.057 16.060 -1.876 1.00 . A C . 584 SER CA 1 1
1 383 1 1 28 SER CB C 0.096 17.584 -1.991 1.00 . A C . 584 SER CB 1 1
1 384 1 1 28 SER H H 0.841 16.280 0.119 1.00 . A C . 584 SER H 1 1
1 385 1 1 28 SER HA H -0.970 15.724 -1.875 1.00 . A C . 584 SER HA 1 1
1 386 1 1 28 SER HB2 H 0.822 17.981 -1.302 1.00 . A C . 584 SER HB2 1 1
1 387 1 1 28 SER HB3 H 0.372 17.861 -3.000 1.00 . A C . 584 SER HB3 1 1
1 388 1 1 28 SER HG H -1.059 18.918 -1.171 1.00 . A C . 584 SER HG 1 1
1 389 1 1 28 SER N N 0.722 15.638 -0.611 1.00 . A C . 584 SER N 1 1
1 390 1 1 28 SER O O 0.200 15.047 -4.044 1.00 . A C . 584 SER O 1 1
1 391 1 1 28 SER OG O -1.186 18.111 -1.675 1.00 . A C . 584 SER OG 1 1
1 392 1 1 29 SER C C 3.133 13.259 -3.761 1.00 . A C . 585 SER C 1 1
1 393 1 1 29 SER CA C 2.878 14.733 -4.078 1.00 . A C . 585 SER CA 1 1
1 394 1 1 29 SER CB C 4.214 15.464 -4.219 1.00 . A C . 585 SER CB 1 1
1 395 1 1 29 SER H H 2.552 15.655 -2.161 1.00 . A C . 585 SER H 1 1
1 396 1 1 29 SER HA H 2.322 14.814 -5.000 1.00 . A C . 585 SER HA 1 1
1 397 1 1 29 SER HB2 H 4.256 16.280 -3.517 1.00 . A C . 585 SER HB2 1 1
1 398 1 1 29 SER HB3 H 5.023 14.775 -4.016 1.00 . A C . 585 SER HB3 1 1
1 399 1 1 29 SER HG H 4.770 16.829 -5.489 1.00 . A C . 585 SER HG 1 1
1 400 1 1 29 SER N N 2.094 15.338 -2.968 1.00 . A C . 585 SER N 1 1
1 401 1 1 29 SER O O 4.084 12.914 -3.088 1.00 . A C . 585 SER O 1 1
1 402 1 1 29 SER OG O 4.332 15.977 -5.540 1.00 . A C . 585 SER OG 1 1
1 403 1 1 30 TRP C C 3.696 10.400 -4.697 1.00 . A C . 586 TRP C 1 1
1 404 1 1 30 TRP CA C 2.475 10.936 -3.951 1.00 . A C . 586 TRP CA 1 1
1 405 1 1 30 TRP CB C 1.234 10.159 -4.389 1.00 . A C . 586 TRP CB 1 1
1 406 1 1 30 TRP CD1 C -0.868 10.695 -3.083 1.00 . A C . 586 TRP CD1 1 1
1 407 1 1 30 TRP CD2 C 0.422 9.158 -2.071 1.00 . A C . 586 TRP CD2 1 1
1 408 1 1 30 TRP CE2 C -0.705 9.350 -1.244 1.00 . A C . 586 TRP CE2 1 1
1 409 1 1 30 TRP CE3 C 1.396 8.236 -1.658 1.00 . A C . 586 TRP CE3 1 1
1 410 1 1 30 TRP CG C 0.296 10.022 -3.235 1.00 . A C . 586 TRP CG 1 1
1 411 1 1 30 TRP CH2 C 0.110 7.737 0.346 1.00 . A C . 586 TRP CH2 1 1
1 412 1 1 30 TRP CZ2 C -0.866 8.653 -0.053 1.00 . A C . 586 TRP CZ2 1 1
1 413 1 1 30 TRP CZ3 C 1.240 7.529 -0.454 1.00 . A C . 586 TRP CZ3 1 1
1 414 1 1 30 TRP H H 1.522 12.686 -4.769 1.00 . A C . 586 TRP H 1 1
1 415 1 1 30 TRP HA H 2.621 10.799 -2.890 1.00 . A C . 586 TRP HA 1 1
1 416 1 1 30 TRP HB2 H 0.742 10.689 -5.190 1.00 . A C . 586 TRP HB2 1 1
1 417 1 1 30 TRP HB3 H 1.526 9.178 -4.732 1.00 . A C . 586 TRP HB3 1 1
1 418 1 1 30 TRP HD1 H -1.269 11.424 -3.770 1.00 . A C . 586 TRP HD1 1 1
1 419 1 1 30 TRP HE1 H -2.306 10.622 -1.547 1.00 . A C . 586 TRP HE1 1 1
1 420 1 1 30 TRP HE3 H 2.271 8.075 -2.268 1.00 . A C . 586 TRP HE3 1 1
1 421 1 1 30 TRP HH2 H -0.006 7.192 1.271 1.00 . A C . 586 TRP HH2 1 1
1 422 1 1 30 TRP HZ2 H -1.742 8.820 0.556 1.00 . A C . 586 TRP HZ2 1 1
1 423 1 1 30 TRP HZ3 H 1.993 6.822 -0.143 1.00 . A C . 586 TRP HZ3 1 1
1 424 1 1 30 TRP N N 2.286 12.386 -4.233 1.00 . A C . 586 TRP N 1 1
1 425 1 1 30 TRP NE1 N -1.459 10.293 -1.898 1.00 . A C . 586 TRP NE1 1 1
1 426 1 1 30 TRP O O 3.803 10.510 -5.903 1.00 . A C . 586 TRP O 1 1
1 427 1 1 31 VAL C C 6.444 8.211 -3.675 1.00 . A C . 587 VAL C 1 1
1 428 1 1 31 VAL CA C 5.827 9.242 -4.621 1.00 . A C . 587 VAL CA 1 1
1 429 1 1 31 VAL CB C 6.839 10.356 -4.890 1.00 . A C . 587 VAL CB 1 1
1 430 1 1 31 VAL CG1 C 8.005 9.795 -5.706 1.00 . A C . 587 VAL CG1 1 1
1 431 1 1 31 VAL CG2 C 6.164 11.482 -5.678 1.00 . A C . 587 VAL CG2 1 1
1 432 1 1 31 VAL H H 4.488 9.727 -3.011 1.00 . A C . 587 VAL H 1 1
1 433 1 1 31 VAL HA H 5.557 8.763 -5.551 1.00 . A C . 587 VAL HA 1 1
1 434 1 1 31 VAL HB H 7.209 10.742 -3.951 1.00 . A C . 587 VAL HB 1 1
1 435 1 1 31 VAL HG11 H 7.756 8.802 -6.053 1.00 . A C . 587 VAL HG11 1 1
1 436 1 1 31 VAL HG12 H 8.194 10.437 -6.554 1.00 . A C . 587 VAL HG12 1 1
1 437 1 1 31 VAL HG13 H 8.889 9.748 -5.086 1.00 . A C . 587 VAL HG13 1 1
1 438 1 1 31 VAL HG21 H 5.709 11.075 -6.569 1.00 . A C . 587 VAL HG21 1 1
1 439 1 1 31 VAL HG22 H 5.405 11.945 -5.065 1.00 . A C . 587 VAL HG22 1 1
1 440 1 1 31 VAL HG23 H 6.902 12.219 -5.955 1.00 . A C . 587 VAL HG23 1 1
1 441 1 1 31 VAL N N 4.609 9.808 -3.980 1.00 . A C . 587 VAL N 1 1
1 442 1 1 31 VAL O O 7.645 8.037 -3.626 1.00 . A C . 587 VAL O 1 1
1 443 1 1 32 VAL C C 6.488 5.231 -2.713 1.00 . A C . 588 VAL C 1 1
1 444 1 1 32 VAL CA C 6.164 6.514 -1.968 1.00 . A C . 588 VAL CA 1 1
1 445 1 1 32 VAL CB C 5.117 6.176 -0.909 1.00 . A C . 588 VAL CB 1 1
1 446 1 1 32 VAL CG1 C 3.777 5.926 -1.596 1.00 . A C . 588 VAL CG1 1 1
1 447 1 1 32 VAL CG2 C 5.542 4.901 -0.172 1.00 . A C . 588 VAL CG2 1 1
1 448 1 1 32 VAL H H 4.662 7.689 -2.969 1.00 . A C . 588 VAL H 1 1
1 449 1 1 32 VAL HA H 7.053 6.894 -1.489 1.00 . A C . 588 VAL HA 1 1
1 450 1 1 32 VAL HB H 5.022 6.993 -0.209 1.00 . A C . 588 VAL HB 1 1
1 451 1 1 32 VAL HG11 H 3.945 5.420 -2.536 1.00 . A C . 588 VAL HG11 1 1
1 452 1 1 32 VAL HG12 H 3.157 5.310 -0.963 1.00 . A C . 588 VAL HG12 1 1
1 453 1 1 32 VAL HG13 H 3.286 6.867 -1.778 1.00 . A C . 588 VAL HG13 1 1
1 454 1 1 32 VAL HG21 H 6.622 4.870 -0.091 1.00 . A C . 588 VAL HG21 1 1
1 455 1 1 32 VAL HG22 H 5.106 4.894 0.815 1.00 . A C . 588 VAL HG22 1 1
1 456 1 1 32 VAL HG23 H 5.201 4.037 -0.725 1.00 . A C . 588 VAL HG23 1 1
1 457 1 1 32 VAL N N 5.627 7.529 -2.917 1.00 . A C . 588 VAL N 1 1
1 458 1 1 32 VAL O O 6.007 4.989 -3.804 1.00 . A C . 588 VAL O 1 1
1 459 1 1 33 THR C C 7.319 1.967 -1.754 1.00 . A C . 589 THR C 1 1
1 460 1 1 33 THR CA C 7.624 3.097 -2.739 1.00 . A C . 589 THR CA 1 1
1 461 1 1 33 THR CB C 9.112 3.080 -3.101 1.00 . A C . 589 THR CB 1 1
1 462 1 1 33 THR CG2 C 9.271 3.111 -4.622 1.00 . A C . 589 THR CG2 1 1
1 463 1 1 33 THR H H 7.625 4.616 -1.213 1.00 . A C . 589 THR H 1 1
1 464 1 1 33 THR HA H 7.031 2.967 -3.630 1.00 . A C . 589 THR HA 1 1
1 465 1 1 33 THR HB H 9.566 2.181 -2.714 1.00 . A C . 589 THR HB 1 1
1 466 1 1 33 THR HG1 H 10.698 4.087 -2.596 1.00 . A C . 589 THR HG1 1 1
1 467 1 1 33 THR HG21 H 8.423 2.626 -5.082 1.00 . A C . 589 THR HG21 1 1
1 468 1 1 33 THR HG22 H 9.324 4.137 -4.957 1.00 . A C . 589 THR HG22 1 1
1 469 1 1 33 THR HG23 H 10.177 2.594 -4.900 1.00 . A C . 589 THR HG23 1 1
1 470 1 1 33 THR N N 7.277 4.394 -2.105 1.00 . A C . 589 THR N 1 1
1 471 1 1 33 THR O O 8.012 1.782 -0.773 1.00 . A C . 589 THR O 1 1
1 472 1 1 33 THR OG1 O 9.748 4.216 -2.532 1.00 . A C . 589 THR OG1 1 1
1 473 1 1 34 LEU C C 6.831 -1.099 -1.348 1.00 . A C . 590 LEU C 1 1
1 474 1 1 34 LEU CA C 5.929 0.104 -1.072 1.00 . A C . 590 LEU CA 1 1
1 475 1 1 34 LEU CB C 4.468 -0.296 -1.288 1.00 . A C . 590 LEU CB 1 1
1 476 1 1 34 LEU CD1 C 2.580 1.295 -1.669 1.00 . A C . 590 LEU CD1 1 1
1 477 1 1 34 LEU CD2 C 2.761 0.067 0.498 1.00 . A C . 590 LEU CD2 1 1
1 478 1 1 34 LEU CG C 3.552 0.736 -0.629 1.00 . A C . 590 LEU CG 1 1
1 479 1 1 34 LEU H H 5.730 1.383 -2.791 1.00 . A C . 590 LEU H 1 1
1 480 1 1 34 LEU HA H 6.065 0.430 -0.051 1.00 . A C . 590 LEU HA 1 1
1 481 1 1 34 LEU HB2 H 4.260 -0.339 -2.348 1.00 . A C . 590 LEU HB2 1 1
1 482 1 1 34 LEU HB3 H 4.290 -1.266 -0.847 1.00 . A C . 590 LEU HB3 1 1
1 483 1 1 34 LEU HD11 H 3.136 1.686 -2.508 1.00 . A C . 590 LEU HD11 1 1
1 484 1 1 34 LEU HD12 H 1.923 0.508 -2.008 1.00 . A C . 590 LEU HD12 1 1
1 485 1 1 34 LEU HD13 H 1.994 2.087 -1.225 1.00 . A C . 590 LEU HD13 1 1
1 486 1 1 34 LEU HD21 H 3.424 -0.552 1.085 1.00 . A C . 590 LEU HD21 1 1
1 487 1 1 34 LEU HD22 H 2.324 0.826 1.130 1.00 . A C . 590 LEU HD22 1 1
1 488 1 1 34 LEU HD23 H 1.978 -0.544 0.075 1.00 . A C . 590 LEU HD23 1 1
1 489 1 1 34 LEU HG H 4.149 1.541 -0.225 1.00 . A C . 590 LEU HG 1 1
1 490 1 1 34 LEU N N 6.281 1.214 -2.000 1.00 . A C . 590 LEU N 1 1
1 491 1 1 34 LEU O O 7.125 -1.420 -2.483 1.00 . A C . 590 LEU O 1 1
1 492 1 1 35 GLY C C 7.478 -4.203 0.020 1.00 . A C . 591 GLY C 1 1
1 493 1 1 35 GLY CA C 8.162 -2.947 -0.521 1.00 . A C . 591 GLY CA 1 1
1 494 1 1 35 GLY H H 7.028 -1.488 0.590 1.00 . A C . 591 GLY H 1 1
1 495 1 1 35 GLY HA2 H 9.093 -2.793 0.004 1.00 . A C . 591 GLY HA2 1 1
1 496 1 1 35 GLY HA3 H 8.360 -3.069 -1.577 1.00 . A C . 591 GLY HA3 1 1
1 497 1 1 35 GLY N N 7.276 -1.766 -0.318 1.00 . A C . 591 GLY N 1 1
1 498 1 1 35 GLY O O 7.378 -4.402 1.214 1.00 . A C . 591 GLY O 1 1
1 499 1 1 36 LEU C C 7.337 -7.188 0.332 1.00 . A C . 592 LEU C 1 1
1 500 1 1 36 LEU CA C 6.333 -6.292 -0.396 1.00 . A C . 592 LEU CA 1 1
1 501 1 1 36 LEU CB C 5.790 -7.020 -1.621 1.00 . A C . 592 LEU CB 1 1
1 502 1 1 36 LEU CD1 C 4.389 -6.792 -3.678 1.00 . A C . 592 LEU CD1 1 1
1 503 1 1 36 LEU CD2 C 3.703 -5.648 -1.566 1.00 . A C . 592 LEU CD2 1 1
1 504 1 1 36 LEU CG C 4.896 -6.074 -2.425 1.00 . A C . 592 LEU CG 1 1
1 505 1 1 36 LEU H H 7.094 -4.881 -1.807 1.00 . A C . 592 LEU H 1 1
1 506 1 1 36 LEU HA H 5.519 -6.042 0.267 1.00 . A C . 592 LEU HA 1 1
1 507 1 1 36 LEU HB2 H 6.612 -7.351 -2.238 1.00 . A C . 592 LEU HB2 1 1
1 508 1 1 36 LEU HB3 H 5.217 -7.866 -1.304 1.00 . A C . 592 LEU HB3 1 1
1 509 1 1 36 LEU HD11 H 5.032 -7.631 -3.897 1.00 . A C . 592 LEU HD11 1 1
1 510 1 1 36 LEU HD12 H 3.382 -7.144 -3.509 1.00 . A C . 592 LEU HD12 1 1
1 511 1 1 36 LEU HD13 H 4.395 -6.106 -4.513 1.00 . A C . 592 LEU HD13 1 1
1 512 1 1 36 LEU HD21 H 3.579 -6.346 -0.751 1.00 . A C . 592 LEU HD21 1 1
1 513 1 1 36 LEU HD22 H 3.878 -4.659 -1.170 1.00 . A C . 592 LEU HD22 1 1
1 514 1 1 36 LEU HD23 H 2.808 -5.640 -2.172 1.00 . A C . 592 LEU HD23 1 1
1 515 1 1 36 LEU HG H 5.464 -5.202 -2.715 1.00 . A C . 592 LEU HG 1 1
1 516 1 1 36 LEU N N 7.006 -5.054 -0.850 1.00 . A C . 592 LEU N 1 1
1 517 1 1 36 LEU O O 8.431 -6.772 0.660 1.00 . A C . 592 LEU O 1 1
1 518 1 1 37 ASN C C 8.173 -10.564 0.413 1.00 . A C . 593 ASN C 1 1
1 519 1 1 37 ASN CA C 7.910 -9.338 1.289 1.00 . A C . 593 ASN CA 1 1
1 520 1 1 37 ASN CB C 7.288 -9.782 2.615 1.00 . A C . 593 ASN CB 1 1
1 521 1 1 37 ASN CG C 7.687 -8.802 3.719 1.00 . A C . 593 ASN CG 1 1
1 522 1 1 37 ASN H H 6.090 -8.732 0.310 1.00 . A C . 593 ASN H 1 1
1 523 1 1 37 ASN HA H 8.842 -8.828 1.483 1.00 . A C . 593 ASN HA 1 1
1 524 1 1 37 ASN HB2 H 6.212 -9.799 2.519 1.00 . A C . 593 ASN HB2 1 1
1 525 1 1 37 ASN HB3 H 7.643 -10.770 2.867 1.00 . A C . 593 ASN HB3 1 1
1 526 1 1 37 ASN HD21 H 5.904 -7.932 3.786 1.00 . A C . 593 ASN HD21 1 1
1 527 1 1 37 ASN HD22 H 7.056 -7.312 4.869 1.00 . A C . 593 ASN HD22 1 1
1 528 1 1 37 ASN N N 6.976 -8.416 0.585 1.00 . A C . 593 ASN N 1 1
1 529 1 1 37 ASN ND2 N 6.809 -7.944 4.162 1.00 . A C . 593 ASN ND2 1 1
1 530 1 1 37 ASN O O 7.897 -11.683 0.796 1.00 . A C . 593 ASN O 1 1
1 531 1 1 37 ASN OD1 O 8.810 -8.817 4.184 1.00 . A C . 593 ASN OD1 1 1
1 532 1 1 38 GLY C C 7.768 -12.442 -1.703 1.00 . A C . 594 GLY C 1 1
1 533 1 1 38 GLY CA C 8.985 -11.516 -1.663 1.00 . A C . 594 GLY CA 1 1
1 534 1 1 38 GLY H H 8.920 -9.450 -1.052 1.00 . A C . 594 GLY H 1 1
1 535 1 1 38 GLY HA2 H 9.838 -12.064 -1.292 1.00 . A C . 594 GLY HA2 1 1
1 536 1 1 38 GLY HA3 H 9.195 -11.151 -2.659 1.00 . A C . 594 GLY HA3 1 1
1 537 1 1 38 GLY N N 8.705 -10.362 -0.762 1.00 . A C . 594 GLY N 1 1
1 538 1 1 38 GLY O O 7.596 -13.294 -0.855 1.00 . A C . 594 GLY O 1 1
1 539 1 1 39 GLY C C 4.455 -12.305 -2.613 1.00 . A C . 595 GLY C 1 1
1 540 1 1 39 GLY CA C 5.717 -13.155 -2.777 1.00 . A C . 595 GLY CA 1 1
1 541 1 1 39 GLY H H 7.078 -11.589 -3.359 1.00 . A C . 595 GLY H 1 1
1 542 1 1 39 GLY HA2 H 5.749 -13.899 -1.996 1.00 . A C . 595 GLY HA2 1 1
1 543 1 1 39 GLY HA3 H 5.701 -13.644 -3.741 1.00 . A C . 595 GLY HA3 1 1
1 544 1 1 39 GLY N N 6.921 -12.282 -2.684 1.00 . A C . 595 GLY N 1 1
1 545 1 1 39 GLY O O 3.645 -12.200 -3.512 1.00 . A C . 595 GLY O 1 1
1 546 1 1 40 GLN C C 2.825 -9.987 -2.487 1.00 . A C . 596 GLN C 1 1
1 547 1 1 40 GLN CA C 3.073 -10.855 -1.251 1.00 . A C . 596 GLN CA 1 1
1 548 1 1 40 GLN CB C 3.293 -9.957 -0.032 1.00 . A C . 596 GLN CB 1 1
1 549 1 1 40 GLN CD C 3.586 -9.961 2.449 1.00 . A C . 596 GLN CD 1 1
1 550 1 1 40 GLN CG C 3.626 -10.822 1.185 1.00 . A C . 596 GLN CG 1 1
1 551 1 1 40 GLN H H 4.948 -11.795 -0.759 1.00 . A C . 596 GLN H 1 1
1 552 1 1 40 GLN HA H 2.217 -11.491 -1.081 1.00 . A C . 596 GLN HA 1 1
1 553 1 1 40 GLN HB2 H 4.110 -9.278 -0.228 1.00 . A C . 596 GLN HB2 1 1
1 554 1 1 40 GLN HB3 H 2.394 -9.392 0.166 1.00 . A C . 596 GLN HB3 1 1
1 555 1 1 40 GLN HE21 H 4.316 -8.351 1.546 1.00 . A C . 596 GLN HE21 1 1
1 556 1 1 40 GLN HE22 H 3.969 -8.163 3.197 1.00 . A C . 596 GLN HE22 1 1
1 557 1 1 40 GLN HG2 H 2.903 -11.620 1.269 1.00 . A C . 596 GLN HG2 1 1
1 558 1 1 40 GLN HG3 H 4.614 -11.241 1.069 1.00 . A C . 596 GLN HG3 1 1
1 559 1 1 40 GLN N N 4.282 -11.697 -1.472 1.00 . A C . 596 GLN N 1 1
1 560 1 1 40 GLN NE2 N 3.991 -8.722 2.393 1.00 . A C . 596 GLN NE2 1 1
1 561 1 1 40 GLN O O 3.609 -9.118 -2.814 1.00 . A C . 596 GLN O 1 1
1 562 1 1 40 GLN OE1 O 3.182 -10.421 3.499 1.00 . A C . 596 GLN OE1 1 1
1 563 1 1 41 SER C C 0.205 -8.538 -4.136 1.00 . A C . 597 SER C 1 1
1 564 1 1 41 SER CA C 1.444 -9.401 -4.388 1.00 . A C . 597 SER CA 1 1
1 565 1 1 41 SER CB C 1.185 -10.330 -5.575 1.00 . A C . 597 SER CB 1 1
1 566 1 1 41 SER H H 1.120 -10.919 -2.895 1.00 . A C . 597 SER H 1 1
1 567 1 1 41 SER HA H 2.287 -8.763 -4.608 1.00 . A C . 597 SER HA 1 1
1 568 1 1 41 SER HB2 H 0.152 -10.259 -5.872 1.00 . A C . 597 SER HB2 1 1
1 569 1 1 41 SER HB3 H 1.817 -10.038 -6.403 1.00 . A C . 597 SER HB3 1 1
1 570 1 1 41 SER HG H 1.615 -12.181 -5.992 1.00 . A C . 597 SER HG 1 1
1 571 1 1 41 SER N N 1.740 -10.214 -3.175 1.00 . A C . 597 SER N 1 1
1 572 1 1 41 SER O O -0.580 -8.807 -3.248 1.00 . A C . 597 SER O 1 1
1 573 1 1 41 SER OG O 1.471 -11.669 -5.193 1.00 . A C . 597 SER OG 1 1
1 574 1 1 42 VAL C C -2.365 -7.213 -5.447 1.00 . A C . 598 VAL C 1 1
1 575 1 1 42 VAL CA C -1.161 -6.622 -4.712 1.00 . A C . 598 VAL CA 1 1
1 576 1 1 42 VAL CB C -0.859 -5.229 -5.268 1.00 . A C . 598 VAL CB 1 1
1 577 1 1 42 VAL CG1 C -2.103 -4.348 -5.146 1.00 . A C . 598 VAL CG1 1 1
1 578 1 1 42 VAL CG2 C 0.288 -4.601 -4.473 1.00 . A C . 598 VAL CG2 1 1
1 579 1 1 42 VAL H H 0.671 -7.302 -5.618 1.00 . A C . 598 VAL H 1 1
1 580 1 1 42 VAL HA H -1.384 -6.548 -3.657 1.00 . A C . 598 VAL HA 1 1
1 581 1 1 42 VAL HB H -0.577 -5.311 -6.307 1.00 . A C . 598 VAL HB 1 1
1 582 1 1 42 VAL HG11 H -2.836 -4.844 -4.527 1.00 . A C . 598 VAL HG11 1 1
1 583 1 1 42 VAL HG12 H -1.833 -3.403 -4.698 1.00 . A C . 598 VAL HG12 1 1
1 584 1 1 42 VAL HG13 H -2.519 -4.175 -6.128 1.00 . A C . 598 VAL HG13 1 1
1 585 1 1 42 VAL HG21 H 0.308 -5.019 -3.477 1.00 . A C . 598 VAL HG21 1 1
1 586 1 1 42 VAL HG22 H 1.225 -4.807 -4.969 1.00 . A C . 598 VAL HG22 1 1
1 587 1 1 42 VAL HG23 H 0.141 -3.533 -4.412 1.00 . A C . 598 VAL HG23 1 1
1 588 1 1 42 VAL N N 0.025 -7.502 -4.909 1.00 . A C . 598 VAL N 1 1
1 589 1 1 42 VAL O O -2.258 -7.669 -6.568 1.00 . A C . 598 VAL O 1 1
1 590 1 1 43 GLN C C -5.655 -6.628 -5.900 1.00 . A C . 599 GLN C 1 1
1 591 1 1 43 GLN CA C -4.723 -7.770 -5.490 1.00 . A C . 599 GLN CA 1 1
1 592 1 1 43 GLN CB C -5.453 -8.701 -4.519 1.00 . A C . 599 GLN CB 1 1
1 593 1 1 43 GLN CD C -7.919 -9.089 -4.401 1.00 . A C . 599 GLN CD 1 1
1 594 1 1 43 GLN CG C -6.654 -9.336 -5.224 1.00 . A C . 599 GLN CG 1 1
1 595 1 1 43 GLN H H -3.579 -6.835 -3.922 1.00 . A C . 599 GLN H 1 1
1 596 1 1 43 GLN HA H -4.427 -8.325 -6.367 1.00 . A C . 599 GLN HA 1 1
1 597 1 1 43 GLN HB2 H -4.778 -9.476 -4.187 1.00 . A C . 599 GLN HB2 1 1
1 598 1 1 43 GLN HB3 H -5.797 -8.134 -3.667 1.00 . A C . 599 GLN HB3 1 1
1 599 1 1 43 GLN HE21 H -9.148 -9.491 -5.907 1.00 . A C . 599 GLN HE21 1 1
1 600 1 1 43 GLN HE22 H -9.904 -9.074 -4.446 1.00 . A C . 599 GLN HE22 1 1
1 601 1 1 43 GLN HG2 H -6.769 -8.895 -6.204 1.00 . A C . 599 GLN HG2 1 1
1 602 1 1 43 GLN HG3 H -6.493 -10.398 -5.323 1.00 . A C . 599 GLN HG3 1 1
1 603 1 1 43 GLN N N -3.513 -7.208 -4.825 1.00 . A C . 599 GLN N 1 1
1 604 1 1 43 GLN NE2 N -9.087 -9.229 -4.965 1.00 . A C . 599 GLN NE2 1 1
1 605 1 1 43 GLN O O -6.201 -6.619 -6.985 1.00 . A C . 599 GLN O 1 1
1 606 1 1 43 GLN OE1 O -7.844 -8.765 -3.232 1.00 . A C . 599 GLN OE1 1 1
1 607 1 1 44 SER C C -6.498 -3.371 -4.407 1.00 . A C . 600 SER C 1 1
1 608 1 1 44 SER CA C -6.741 -4.525 -5.382 1.00 . A C . 600 SER CA 1 1
1 609 1 1 44 SER CB C -8.198 -4.978 -5.283 1.00 . A C . 600 SER CB 1 1
1 610 1 1 44 SER H H -5.395 -5.690 -4.169 1.00 . A C . 600 SER H 1 1
1 611 1 1 44 SER HA H -6.535 -4.195 -6.390 1.00 . A C . 600 SER HA 1 1
1 612 1 1 44 SER HB2 H -8.809 -4.162 -4.936 1.00 . A C . 600 SER HB2 1 1
1 613 1 1 44 SER HB3 H -8.543 -5.293 -6.260 1.00 . A C . 600 SER HB3 1 1
1 614 1 1 44 SER HG H -9.185 -6.408 -4.407 1.00 . A C . 600 SER HG 1 1
1 615 1 1 44 SER N N -5.843 -5.664 -5.040 1.00 . A C . 600 SER N 1 1
1 616 1 1 44 SER O O -5.973 -3.558 -3.328 1.00 . A C . 600 SER O 1 1
1 617 1 1 44 SER OG O -8.293 -6.058 -4.363 1.00 . A C . 600 SER OG 1 1
1 618 1 1 45 SER C C -7.792 0.003 -4.083 1.00 . A C . 601 SER C 1 1
1 619 1 1 45 SER CA C -6.667 -1.013 -3.875 1.00 . A C . 601 SER CA 1 1
1 620 1 1 45 SER CB C -5.323 -0.358 -4.192 1.00 . A C . 601 SER CB 1 1
1 621 1 1 45 SER H H -7.298 -2.050 -5.655 1.00 . A C . 601 SER H 1 1
1 622 1 1 45 SER HA H -6.671 -1.348 -2.848 1.00 . A C . 601 SER HA 1 1
1 623 1 1 45 SER HB2 H -5.353 0.683 -3.914 1.00 . A C . 601 SER HB2 1 1
1 624 1 1 45 SER HB3 H -4.541 -0.855 -3.634 1.00 . A C . 601 SER HB3 1 1
1 625 1 1 45 SER HG H -5.679 0.121 -6.044 1.00 . A C . 601 SER HG 1 1
1 626 1 1 45 SER N N -6.877 -2.179 -4.780 1.00 . A C . 601 SER N 1 1
1 627 1 1 45 SER O O -8.584 -0.113 -4.998 1.00 . A C . 601 SER O 1 1
1 628 1 1 45 SER OG O -5.068 -0.461 -5.587 1.00 . A C . 601 SER OG 1 1
1 629 1 1 46 TRP C C -8.543 3.301 -2.663 1.00 . A C . 602 TRP C 1 1
1 630 1 1 46 TRP CA C -8.944 2.019 -3.396 1.00 . A C . 602 TRP CA 1 1
1 631 1 1 46 TRP CB C -10.248 1.480 -2.805 1.00 . A C . 602 TRP CB 1 1
1 632 1 1 46 TRP CD1 C -10.173 2.124 -0.362 1.00 . A C . 602 TRP CD1 1 1
1 633 1 1 46 TRP CD2 C -9.729 -0.056 -0.695 1.00 . A C . 602 TRP CD2 1 1
1 634 1 1 46 TRP CE2 C -9.655 0.167 0.700 1.00 . A C . 602 TRP CE2 1 1
1 635 1 1 46 TRP CE3 C -9.488 -1.356 -1.173 1.00 . A C . 602 TRP CE3 1 1
1 636 1 1 46 TRP CG C -10.060 1.204 -1.348 1.00 . A C . 602 TRP CG 1 1
1 637 1 1 46 TRP CH2 C -9.116 -2.151 1.099 1.00 . A C . 602 TRP CH2 1 1
1 638 1 1 46 TRP CZ2 C -9.353 -0.865 1.590 1.00 . A C . 602 TRP CZ2 1 1
1 639 1 1 46 TRP CZ3 C -9.184 -2.397 -0.280 1.00 . A C . 602 TRP CZ3 1 1
1 640 1 1 46 TRP H H -7.221 1.074 -2.512 1.00 . A C . 602 TRP H 1 1
1 641 1 1 46 TRP HA H -9.087 2.235 -4.445 1.00 . A C . 602 TRP HA 1 1
1 642 1 1 46 TRP HB2 H -11.031 2.212 -2.935 1.00 . A C . 602 TRP HB2 1 1
1 643 1 1 46 TRP HB3 H -10.522 0.566 -3.312 1.00 . A C . 602 TRP HB3 1 1
1 644 1 1 46 TRP HD1 H -10.412 3.166 -0.498 1.00 . A C . 602 TRP HD1 1 1
1 645 1 1 46 TRP HE1 H -9.955 1.958 1.721 1.00 . A C . 602 TRP HE1 1 1
1 646 1 1 46 TRP HE3 H -9.538 -1.556 -2.233 1.00 . A C . 602 TRP HE3 1 1
1 647 1 1 46 TRP HH2 H -8.882 -2.956 1.780 1.00 . A C . 602 TRP HH2 1 1
1 648 1 1 46 TRP HZ2 H -9.302 -0.670 2.651 1.00 . A C . 602 TRP HZ2 1 1
1 649 1 1 46 TRP HZ3 H -9.001 -3.392 -0.657 1.00 . A C . 602 TRP HZ3 1 1
1 650 1 1 46 TRP N N -7.869 0.998 -3.243 1.00 . A C . 602 TRP N 1 1
1 651 1 1 46 TRP NE1 N -9.934 1.511 0.851 1.00 . A C . 602 TRP NE1 1 1
1 652 1 1 46 TRP O O -7.782 3.275 -1.715 1.00 . A C . 602 TRP O 1 1
1 653 1 1 47 ASN C C -7.309 6.155 -2.861 1.00 . A C . 603 ASN C 1 1
1 654 1 1 47 ASN CA C -8.706 5.709 -2.425 1.00 . A C . 603 ASN CA 1 1
1 655 1 1 47 ASN CB C -8.730 5.519 -0.907 1.00 . A C . 603 ASN CB 1 1
1 656 1 1 47 ASN CG C -9.657 6.561 -0.277 1.00 . A C . 603 ASN CG 1 1
1 657 1 1 47 ASN H H -9.665 4.420 -3.859 1.00 . A C . 603 ASN H 1 1
1 658 1 1 47 ASN HA H -9.427 6.464 -2.704 1.00 . A C . 603 ASN HA 1 1
1 659 1 1 47 ASN HB2 H -9.090 4.528 -0.674 1.00 . A C . 603 ASN HB2 1 1
1 660 1 1 47 ASN HB3 H -7.733 5.643 -0.513 1.00 . A C . 603 ASN HB3 1 1
1 661 1 1 47 ASN HD21 H -9.206 7.969 -1.601 1.00 . A C . 603 ASN HD21 1 1
1 662 1 1 47 ASN HD22 H -10.328 8.424 -0.411 1.00 . A C . 603 ASN HD22 1 1
1 663 1 1 47 ASN N N -9.053 4.423 -3.094 1.00 . A C . 603 ASN N 1 1
1 664 1 1 47 ASN ND2 N -9.737 7.750 -0.807 1.00 . A C . 603 ASN ND2 1 1
1 665 1 1 47 ASN O O -6.626 6.867 -2.153 1.00 . A C . 603 ASN O 1 1
1 666 1 1 47 ASN OD1 O -10.315 6.289 0.708 1.00 . A C . 603 ASN OD1 1 1
1 667 1 1 48 ALA C C -5.094 5.221 -5.642 1.00 . A C . 604 ALA C 1 1
1 668 1 1 48 ALA CA C -5.526 6.144 -4.502 1.00 . A C . 604 ALA CA 1 1
1 669 1 1 48 ALA CB C -4.523 6.037 -3.353 1.00 . A C . 604 ALA CB 1 1
1 670 1 1 48 ALA H H -7.446 5.169 -4.579 1.00 . A C . 604 ALA H 1 1
1 671 1 1 48 ALA HA H -5.559 7.164 -4.858 1.00 . A C . 604 ALA HA 1 1
1 672 1 1 48 ALA HB1 H -4.731 5.148 -2.775 1.00 . A C . 604 ALA HB1 1 1
1 673 1 1 48 ALA HB2 H -3.521 5.979 -3.753 1.00 . A C . 604 ALA HB2 1 1
1 674 1 1 48 ALA HB3 H -4.607 6.906 -2.718 1.00 . A C . 604 ALA HB3 1 1
1 675 1 1 48 ALA N N -6.879 5.742 -4.022 1.00 . A C . 604 ALA N 1 1
1 676 1 1 48 ALA O O -5.703 4.199 -5.892 1.00 . A C . 604 ALA O 1 1
1 677 1 1 49 ALA C C -2.202 4.129 -7.115 1.00 . A C . 605 ALA C 1 1
1 678 1 1 49 ALA CA C -3.575 4.710 -7.459 1.00 . A C . 605 ALA CA 1 1
1 679 1 1 49 ALA CB C -3.470 5.549 -8.734 1.00 . A C . 605 ALA CB 1 1
1 680 1 1 49 ALA H H -3.567 6.398 -6.119 1.00 . A C . 605 ALA H 1 1
1 681 1 1 49 ALA HA H -4.278 3.905 -7.614 1.00 . A C . 605 ALA HA 1 1
1 682 1 1 49 ALA HB1 H -4.257 6.287 -8.745 1.00 . A C . 605 ALA HB1 1 1
1 683 1 1 49 ALA HB2 H -2.511 6.044 -8.760 1.00 . A C . 605 ALA HB2 1 1
1 684 1 1 49 ALA HB3 H -3.566 4.906 -9.596 1.00 . A C . 605 ALA HB3 1 1
1 685 1 1 49 ALA N N -4.045 5.570 -6.336 1.00 . A C . 605 ALA N 1 1
1 686 1 1 49 ALA O O -1.439 4.712 -6.371 1.00 . A C . 605 ALA O 1 1
1 687 1 1 50 LEU C C 0.114 1.941 -8.659 1.00 . A C . 606 LEU C 1 1
1 688 1 1 50 LEU CA C -0.556 2.369 -7.352 1.00 . A C . 606 LEU CA 1 1
1 689 1 1 50 LEU CB C -0.746 1.144 -6.453 1.00 . A C . 606 LEU CB 1 1
1 690 1 1 50 LEU CD1 C -2.126 -0.938 -6.272 1.00 . A C . 606 LEU CD1 1 1
1 691 1 1 50 LEU CD2 C -3.182 1.297 -5.899 1.00 . A C . 606 LEU CD2 1 1
1 692 1 1 50 LEU CG C -2.127 0.531 -6.706 1.00 . A C . 606 LEU CG 1 1
1 693 1 1 50 LEU H H -2.509 2.528 -8.248 1.00 . A C . 606 LEU H 1 1
1 694 1 1 50 LEU HA H 0.070 3.091 -6.847 1.00 . A C . 606 LEU HA 1 1
1 695 1 1 50 LEU HB2 H 0.020 0.415 -6.677 1.00 . A C . 606 LEU HB2 1 1
1 696 1 1 50 LEU HB3 H -0.668 1.441 -5.418 1.00 . A C . 606 LEU HB3 1 1
1 697 1 1 50 LEU HD11 H -1.669 -1.026 -5.297 1.00 . A C . 606 LEU HD11 1 1
1 698 1 1 50 LEU HD12 H -3.143 -1.301 -6.225 1.00 . A C . 606 LEU HD12 1 1
1 699 1 1 50 LEU HD13 H -1.567 -1.526 -6.985 1.00 . A C . 606 LEU HD13 1 1
1 700 1 1 50 LEU HD21 H -2.884 2.330 -5.802 1.00 . A C . 606 LEU HD21 1 1
1 701 1 1 50 LEU HD22 H -4.134 1.243 -6.406 1.00 . A C . 606 LEU HD22 1 1
1 702 1 1 50 LEU HD23 H -3.274 0.855 -4.917 1.00 . A C . 606 LEU HD23 1 1
1 703 1 1 50 LEU HG H -2.360 0.596 -7.760 1.00 . A C . 606 LEU HG 1 1
1 704 1 1 50 LEU N N -1.880 2.984 -7.650 1.00 . A C . 606 LEU N 1 1
1 705 1 1 50 LEU O O -0.544 1.630 -9.632 1.00 . A C . 606 LEU O 1 1
1 706 1 1 51 THR C C 2.893 0.213 -9.674 1.00 . A C . 607 THR C 1 1
1 707 1 1 51 THR CA C 2.128 1.513 -9.932 1.00 . A C . 607 THR CA 1 1
1 708 1 1 51 THR CB C 3.110 2.612 -10.344 1.00 . A C . 607 THR CB 1 1
1 709 1 1 51 THR CG2 C 3.589 2.361 -11.774 1.00 . A C . 607 THR CG2 1 1
1 710 1 1 51 THR H H 1.930 2.176 -7.893 1.00 . A C . 607 THR H 1 1
1 711 1 1 51 THR HA H 1.409 1.357 -10.723 1.00 . A C . 607 THR HA 1 1
1 712 1 1 51 THR HB H 3.959 2.605 -9.678 1.00 . A C . 607 THR HB 1 1
1 713 1 1 51 THR HG1 H 3.014 4.518 -10.721 1.00 . A C . 607 THR HG1 1 1
1 714 1 1 51 THR HG21 H 2.995 1.577 -12.221 1.00 . A C . 607 THR HG21 1 1
1 715 1 1 51 THR HG22 H 3.483 3.267 -12.353 1.00 . A C . 607 THR HG22 1 1
1 716 1 1 51 THR HG23 H 4.627 2.063 -11.760 1.00 . A C . 607 THR HG23 1 1
1 717 1 1 51 THR N N 1.418 1.922 -8.689 1.00 . A C . 607 THR N 1 1
1 718 1 1 51 THR O O 3.718 0.133 -8.787 1.00 . A C . 607 THR O 1 1
1 719 1 1 51 THR OG1 O 2.461 3.874 -10.273 1.00 . A C . 607 THR OG1 1 1
1 720 1 1 52 GLY C C 2.414 -3.077 -9.499 1.00 . A C . 608 GLY C 1 1
1 721 1 1 52 GLY CA C 3.333 -2.103 -10.237 1.00 . A C . 608 GLY CA 1 1
1 722 1 1 52 GLY H H 1.952 -0.724 -11.151 1.00 . A C . 608 GLY H 1 1
1 723 1 1 52 GLY HA2 H 4.223 -1.937 -9.649 1.00 . A C . 608 GLY HA2 1 1
1 724 1 1 52 GLY HA3 H 3.607 -2.518 -11.197 1.00 . A C . 608 GLY HA3 1 1
1 725 1 1 52 GLY N N 2.623 -0.808 -10.442 1.00 . A C . 608 GLY N 1 1
1 726 1 1 52 GLY O O 1.316 -2.733 -9.108 1.00 . A C . 608 GLY O 1 1
1 727 1 1 53 SER C C 2.879 -6.383 -7.994 1.00 . A C . 609 SER C 1 1
1 728 1 1 53 SER CA C 1.998 -5.284 -8.594 1.00 . A C . 609 SER CA 1 1
1 729 1 1 53 SER CB C 1.009 -5.906 -9.580 1.00 . A C . 609 SER CB 1 1
1 730 1 1 53 SER H H 3.739 -4.551 -9.630 1.00 . A C . 609 SER H 1 1
1 731 1 1 53 SER HA H 1.453 -4.789 -7.803 1.00 . A C . 609 SER HA 1 1
1 732 1 1 53 SER HB2 H 1.420 -6.818 -9.980 1.00 . A C . 609 SER HB2 1 1
1 733 1 1 53 SER HB3 H 0.081 -6.127 -9.068 1.00 . A C . 609 SER HB3 1 1
1 734 1 1 53 SER HG H -0.099 -5.178 -11.005 1.00 . A C . 609 SER HG 1 1
1 735 1 1 53 SER N N 2.851 -4.292 -9.306 1.00 . A C . 609 SER N 1 1
1 736 1 1 53 SER O O 2.427 -7.480 -7.734 1.00 . A C . 609 SER O 1 1
1 737 1 1 53 SER OG O 0.771 -4.994 -10.645 1.00 . A C . 609 SER OG 1 1
1 738 1 1 54 SER C C 6.486 -6.636 -7.260 1.00 . A C . 610 SER C 1 1
1 739 1 1 54 SER CA C 5.038 -7.127 -7.187 1.00 . A C . 610 SER CA 1 1
1 740 1 1 54 SER CB C 4.902 -8.431 -7.973 1.00 . A C . 610 SER CB 1 1
1 741 1 1 54 SER H H 4.478 -5.206 -7.986 1.00 . A C . 610 SER H 1 1
1 742 1 1 54 SER HA H 4.769 -7.299 -6.155 1.00 . A C . 610 SER HA 1 1
1 743 1 1 54 SER HB2 H 5.850 -8.943 -7.991 1.00 . A C . 610 SER HB2 1 1
1 744 1 1 54 SER HB3 H 4.164 -9.062 -7.495 1.00 . A C . 610 SER HB3 1 1
1 745 1 1 54 SER HG H 4.103 -8.928 -9.676 1.00 . A C . 610 SER HG 1 1
1 746 1 1 54 SER N N 4.133 -6.097 -7.771 1.00 . A C . 610 SER N 1 1
1 747 1 1 54 SER O O 7.077 -6.573 -8.320 1.00 . A C . 610 SER O 1 1
1 748 1 1 54 SER OG O 4.503 -8.137 -9.305 1.00 . A C . 610 SER OG 1 1
1 749 1 1 55 GLY C C 8.524 -4.386 -5.570 1.00 . A C . 611 GLY C 1 1
1 750 1 1 55 GLY CA C 8.470 -5.802 -6.147 1.00 . A C . 611 GLY CA 1 1
1 751 1 1 55 GLY H H 6.566 -6.347 -5.298 1.00 . A C . 611 GLY H 1 1
1 752 1 1 55 GLY HA2 H 8.843 -5.789 -7.159 1.00 . A C . 611 GLY HA2 1 1
1 753 1 1 55 GLY HA3 H 9.080 -6.461 -5.545 1.00 . A C . 611 GLY HA3 1 1
1 754 1 1 55 GLY N N 7.061 -6.288 -6.142 1.00 . A C . 611 GLY N 1 1
1 755 1 1 55 GLY O O 8.665 -4.195 -4.379 1.00 . A C . 611 GLY O 1 1
1 756 1 1 56 THR C C 7.324 -1.183 -6.550 1.00 . A C . 612 THR C 1 1
1 757 1 1 56 THR CA C 8.454 -1.988 -5.905 1.00 . A C . 612 THR CA 1 1
1 758 1 1 56 THR CB C 9.802 -1.359 -6.265 1.00 . A C . 612 THR CB 1 1
1 759 1 1 56 THR CG2 C 9.828 0.098 -5.800 1.00 . A C . 612 THR CG2 1 1
1 760 1 1 56 THR H H 8.296 -3.565 -7.364 1.00 . A C . 612 THR H 1 1
1 761 1 1 56 THR HA H 8.330 -1.986 -4.832 1.00 . A C . 612 THR HA 1 1
1 762 1 1 56 THR HB H 9.943 -1.394 -7.334 1.00 . A C . 612 THR HB 1 1
1 763 1 1 56 THR HG1 H 10.941 -1.736 -4.733 1.00 . A C . 612 THR HG1 1 1
1 764 1 1 56 THR HG21 H 8.816 0.447 -5.653 1.00 . A C . 612 THR HG21 1 1
1 765 1 1 56 THR HG22 H 10.372 0.170 -4.870 1.00 . A C . 612 THR HG22 1 1
1 766 1 1 56 THR HG23 H 10.313 0.706 -6.549 1.00 . A C . 612 THR HG23 1 1
1 767 1 1 56 THR N N 8.411 -3.390 -6.406 1.00 . A C . 612 THR N 1 1
1 768 1 1 56 THR O O 7.350 -0.894 -7.730 1.00 . A C . 612 THR O 1 1
1 769 1 1 56 THR OG1 O 10.845 -2.081 -5.624 1.00 . A C . 612 THR OG1 1 1
1 770 1 1 57 VAL C C 5.245 1.386 -5.795 1.00 . A C . 613 VAL C 1 1
1 771 1 1 57 VAL CA C 5.199 -0.042 -6.347 1.00 . A C . 613 VAL CA 1 1
1 772 1 1 57 VAL CB C 3.890 -0.724 -5.941 1.00 . A C . 613 VAL CB 1 1
1 773 1 1 57 VAL CG1 C 2.790 0.320 -5.782 1.00 . A C . 613 VAL CG1 1 1
1 774 1 1 57 VAL CG2 C 3.483 -1.729 -7.022 1.00 . A C . 613 VAL CG2 1 1
1 775 1 1 57 VAL H H 6.323 -1.065 -4.838 1.00 . A C . 613 VAL H 1 1
1 776 1 1 57 VAL HA H 5.276 -0.017 -7.424 1.00 . A C . 613 VAL HA 1 1
1 777 1 1 57 VAL HB H 4.031 -1.242 -5.003 1.00 . A C . 613 VAL HB 1 1
1 778 1 1 57 VAL HG11 H 3.089 1.035 -5.030 1.00 . A C . 613 VAL HG11 1 1
1 779 1 1 57 VAL HG12 H 2.636 0.827 -6.722 1.00 . A C . 613 VAL HG12 1 1
1 780 1 1 57 VAL HG13 H 1.875 -0.164 -5.477 1.00 . A C . 613 VAL HG13 1 1
1 781 1 1 57 VAL HG21 H 4.266 -1.796 -7.763 1.00 . A C . 613 VAL HG21 1 1
1 782 1 1 57 VAL HG22 H 3.329 -2.698 -6.572 1.00 . A C . 613 VAL HG22 1 1
1 783 1 1 57 VAL HG23 H 2.568 -1.400 -7.492 1.00 . A C . 613 VAL HG23 1 1
1 784 1 1 57 VAL N N 6.330 -0.822 -5.786 1.00 . A C . 613 VAL N 1 1
1 785 1 1 57 VAL O O 5.892 1.656 -4.803 1.00 . A C . 613 VAL O 1 1
1 786 1 1 58 THR C C 3.148 4.266 -5.948 1.00 . A C . 614 THR C 1 1
1 787 1 1 58 THR CA C 4.573 3.709 -5.931 1.00 . A C . 614 THR CA 1 1
1 788 1 1 58 THR CB C 5.469 4.566 -6.830 1.00 . A C . 614 THR CB 1 1
1 789 1 1 58 THR CG2 C 5.416 6.024 -6.368 1.00 . A C . 614 THR CG2 1 1
1 790 1 1 58 THR H H 4.048 2.068 -7.227 1.00 . A C . 614 THR H 1 1
1 791 1 1 58 THR HA H 4.952 3.728 -4.921 1.00 . A C . 614 THR HA 1 1
1 792 1 1 58 THR HB H 5.121 4.503 -7.850 1.00 . A C . 614 THR HB 1 1
1 793 1 1 58 THR HG1 H 6.913 3.401 -7.414 1.00 . A C . 614 THR HG1 1 1
1 794 1 1 58 THR HG21 H 5.065 6.065 -5.348 1.00 . A C . 614 THR HG21 1 1
1 795 1 1 58 THR HG22 H 6.404 6.457 -6.426 1.00 . A C . 614 THR HG22 1 1
1 796 1 1 58 THR HG23 H 4.742 6.579 -7.004 1.00 . A C . 614 THR HG23 1 1
1 797 1 1 58 THR N N 4.564 2.303 -6.427 1.00 . A C . 614 THR N 1 1
1 798 1 1 58 THR O O 2.346 3.918 -6.792 1.00 . A C . 614 THR O 1 1
1 799 1 1 58 THR OG1 O 6.805 4.090 -6.754 1.00 . A C . 614 THR OG1 1 1
1 800 1 1 59 ALA C C 1.352 6.861 -5.992 1.00 . A C . 615 ALA C 1 1
1 801 1 1 59 ALA CA C 1.445 5.704 -4.996 1.00 . A C . 615 ALA CA 1 1
1 802 1 1 59 ALA CB C 1.117 6.216 -3.590 1.00 . A C . 615 ALA CB 1 1
1 803 1 1 59 ALA H H 3.489 5.400 -4.349 1.00 . A C . 615 ALA H 1 1
1 804 1 1 59 ALA HA H 0.734 4.938 -5.272 1.00 . A C . 615 ALA HA 1 1
1 805 1 1 59 ALA HB1 H 2.021 6.262 -3.006 1.00 . A C . 615 ALA HB1 1 1
1 806 1 1 59 ALA HB2 H 0.679 7.204 -3.657 1.00 . A C . 615 ALA HB2 1 1
1 807 1 1 59 ALA HB3 H 0.416 5.545 -3.117 1.00 . A C . 615 ALA HB3 1 1
1 808 1 1 59 ALA N N 2.825 5.130 -5.023 1.00 . A C . 615 ALA N 1 1
1 809 1 1 59 ALA O O 2.334 7.504 -6.305 1.00 . A C . 615 ALA O 1 1
1 810 1 1 60 ARG C C -1.271 9.013 -7.148 1.00 . A C . 616 ARG C 1 1
1 811 1 1 60 ARG CA C 0.016 8.247 -7.464 1.00 . A C . 616 ARG CA 1 1
1 812 1 1 60 ARG CB C -0.063 7.678 -8.882 1.00 . A C . 616 ARG CB 1 1
1 813 1 1 60 ARG CD C 1.179 7.362 -11.027 1.00 . A C . 616 ARG CD 1 1
1 814 1 1 60 ARG CG C 1.246 7.962 -9.621 1.00 . A C . 616 ARG CG 1 1
1 815 1 1 60 ARG CZ C 1.580 8.316 -13.217 1.00 . A C . 616 ARG CZ 1 1
1 816 1 1 60 ARG H H -0.602 6.601 -6.221 1.00 . A C . 616 ARG H 1 1
1 817 1 1 60 ARG HA H 0.862 8.915 -7.389 1.00 . A C . 616 ARG HA 1 1
1 818 1 1 60 ARG HB2 H -0.225 6.612 -8.833 1.00 . A C . 616 ARG HB2 1 1
1 819 1 1 60 ARG HB3 H -0.881 8.143 -9.411 1.00 . A C . 616 ARG HB3 1 1
1 820 1 1 60 ARG HD2 H 1.599 6.367 -11.014 1.00 . A C . 616 ARG HD2 1 1
1 821 1 1 60 ARG HD3 H 0.149 7.313 -11.348 1.00 . A C . 616 ARG HD3 1 1
1 822 1 1 60 ARG HE H 2.743 8.703 -11.655 1.00 . A C . 616 ARG HE 1 1
1 823 1 1 60 ARG HG2 H 1.396 9.030 -9.692 1.00 . A C . 616 ARG HG2 1 1
1 824 1 1 60 ARG HG3 H 2.069 7.518 -9.081 1.00 . A C . 616 ARG HG3 1 1
1 825 1 1 60 ARG HH11 H 2.891 6.956 -13.878 1.00 . A C . 616 ARG HH11 1 1
1 826 1 1 60 ARG HH12 H 1.874 7.666 -15.087 1.00 . A C . 616 ARG HH12 1 1
1 827 1 1 60 ARG HH21 H 0.181 9.700 -12.847 1.00 . A C . 616 ARG HH21 1 1
1 828 1 1 60 ARG HH22 H 0.340 9.219 -14.503 1.00 . A C . 616 ARG HH22 1 1
1 829 1 1 60 ARG N N 0.177 7.132 -6.490 1.00 . A C . 616 ARG N 1 1
1 830 1 1 60 ARG NE N 1.953 8.216 -11.970 1.00 . A C . 616 ARG NE 1 1
1 831 1 1 60 ARG NH1 N 2.160 7.589 -14.132 1.00 . A C . 616 ARG NH1 1 1
1 832 1 1 60 ARG NH2 N 0.626 9.143 -13.548 1.00 . A C . 616 ARG NH2 1 1
1 833 1 1 60 ARG O O -2.210 8.452 -6.617 1.00 . A C . 616 ARG O 1 1
1 834 1 1 61 PRO C C -3.515 10.903 -8.306 1.00 . A C . 617 PRO C 1 1
1 835 1 1 61 PRO CA C -2.430 11.158 -7.257 1.00 . A C . 617 PRO CA 1 1
1 836 1 1 61 PRO CB C -1.842 12.564 -7.408 1.00 . A C . 617 PRO CB 1 1
1 837 1 1 61 PRO CD C -0.123 10.938 -8.135 1.00 . A C . 617 PRO CD 1 1
1 838 1 1 61 PRO CG C -0.558 12.410 -8.257 1.00 . A C . 617 PRO CG 1 1
1 839 1 1 61 PRO HA H -2.820 11.025 -6.261 1.00 . A C . 617 PRO HA 1 1
1 840 1 1 61 PRO HB2 H -2.551 13.208 -7.911 1.00 . A C . 617 PRO HB2 1 1
1 841 1 1 61 PRO HB3 H -1.592 12.968 -6.440 1.00 . A C . 617 PRO HB3 1 1
1 842 1 1 61 PRO HD2 H 0.060 10.516 -9.114 1.00 . A C . 617 PRO HD2 1 1
1 843 1 1 61 PRO HD3 H 0.754 10.853 -7.513 1.00 . A C . 617 PRO HD3 1 1
1 844 1 1 61 PRO HG2 H -0.767 12.654 -9.290 1.00 . A C . 617 PRO HG2 1 1
1 845 1 1 61 PRO HG3 H 0.219 13.053 -7.874 1.00 . A C . 617 PRO HG3 1 1
1 846 1 1 61 PRO N N -1.274 10.275 -7.488 1.00 . A C . 617 PRO N 1 1
1 847 1 1 61 PRO O O -3.239 10.475 -9.409 1.00 . A C . 617 PRO O 1 1
1 848 1 1 62 ASN C C -7.004 11.896 -8.645 1.00 . A C . 618 ASN C 1 1
1 849 1 1 62 ASN CA C -5.851 10.938 -8.948 1.00 . A C . 618 ASN CA 1 1
1 850 1 1 62 ASN CB C -6.345 9.494 -8.836 1.00 . A C . 618 ASN CB 1 1
1 851 1 1 62 ASN CG C -7.072 9.304 -7.503 1.00 . A C . 618 ASN CG 1 1
1 852 1 1 62 ASN H H -4.951 11.509 -7.076 1.00 . A C . 618 ASN H 1 1
1 853 1 1 62 ASN HA H -5.488 11.117 -9.949 1.00 . A C . 618 ASN HA 1 1
1 854 1 1 62 ASN HB2 H -7.023 9.281 -9.650 1.00 . A C . 618 ASN HB2 1 1
1 855 1 1 62 ASN HB3 H -5.503 8.820 -8.883 1.00 . A C . 618 ASN HB3 1 1
1 856 1 1 62 ASN HD21 H -7.585 7.426 -7.889 1.00 . A C . 618 ASN HD21 1 1
1 857 1 1 62 ASN HD22 H -8.100 8.024 -6.387 1.00 . A C . 618 ASN HD22 1 1
1 858 1 1 62 ASN N N -4.749 11.164 -7.971 1.00 . A C . 618 ASN N 1 1
1 859 1 1 62 ASN ND2 N -7.632 8.156 -7.238 1.00 . A C . 618 ASN ND2 1 1
1 860 1 1 62 ASN O O -8.132 11.669 -9.034 1.00 . A C . 618 ASN O 1 1
1 861 1 1 62 ASN OD1 O -7.130 10.210 -6.695 1.00 . A C . 618 ASN OD1 1 1
1 862 1 1 63 GLY C C -7.621 14.449 -6.193 1.00 . A C . 619 GLY C 1 1
1 863 1 1 63 GLY CA C -7.809 13.940 -7.623 1.00 . A C . 619 GLY CA 1 1
1 864 1 1 63 GLY H H -5.813 13.132 -7.647 1.00 . A C . 619 GLY H 1 1
1 865 1 1 63 GLY HA2 H -8.770 13.454 -7.705 1.00 . A C . 619 GLY HA2 1 1
1 866 1 1 63 GLY HA3 H -7.766 14.772 -8.312 1.00 . A C . 619 GLY HA3 1 1
1 867 1 1 63 GLY N N -6.729 12.968 -7.952 1.00 . A C . 619 GLY N 1 1
1 868 1 1 63 GLY O O -7.614 15.638 -5.942 1.00 . A C . 619 GLY O 1 1
1 869 1 1 64 SER C C -7.521 12.802 -2.907 1.00 . A C . 620 SER C 1 1
1 870 1 1 64 SER CA C -7.281 13.991 -3.839 1.00 . A C . 620 SER CA 1 1
1 871 1 1 64 SER CB C -8.275 15.105 -3.510 1.00 . A C . 620 SER CB 1 1
1 872 1 1 64 SER H H -7.478 12.604 -5.475 1.00 . A C . 620 SER H 1 1
1 873 1 1 64 SER HA H -6.273 14.356 -3.705 1.00 . A C . 620 SER HA 1 1
1 874 1 1 64 SER HB2 H -9.054 15.127 -4.254 1.00 . A C . 620 SER HB2 1 1
1 875 1 1 64 SER HB3 H -8.714 14.919 -2.538 1.00 . A C . 620 SER HB3 1 1
1 876 1 1 64 SER HG H -7.508 16.642 -2.595 1.00 . A C . 620 SER HG 1 1
1 877 1 1 64 SER N N -7.469 13.558 -5.252 1.00 . A C . 620 SER N 1 1
1 878 1 1 64 SER O O -8.621 12.297 -2.799 1.00 . A C . 620 SER O 1 1
1 879 1 1 64 SER OG O -7.596 16.354 -3.507 1.00 . A C . 620 SER OG 1 1
1 880 1 1 65 GLY C C -5.384 10.985 -0.507 1.00 . A C . 621 GLY C 1 1
1 881 1 1 65 GLY CA C -6.671 11.194 -1.307 1.00 . A C . 621 GLY CA 1 1
1 882 1 1 65 GLY H H -5.621 12.771 -2.332 1.00 . A C . 621 GLY H 1 1
1 883 1 1 65 GLY HA2 H -6.883 10.303 -1.879 1.00 . A C . 621 GLY HA2 1 1
1 884 1 1 65 GLY HA3 H -7.490 11.392 -0.631 1.00 . A C . 621 GLY HA3 1 1
1 885 1 1 65 GLY N N -6.500 12.350 -2.231 1.00 . A C . 621 GLY N 1 1
1 886 1 1 65 GLY O O -4.299 10.965 -1.052 1.00 . A C . 621 GLY O 1 1
1 887 1 1 66 ASN C C -4.365 9.265 2.317 1.00 . A C . 622 ASN C 1 1
1 888 1 1 66 ASN CA C -4.279 10.624 1.618 1.00 . A C . 622 ASN CA 1 1
1 889 1 1 66 ASN CB C -4.187 11.735 2.666 1.00 . A C . 622 ASN CB 1 1
1 890 1 1 66 ASN CG C -4.501 13.081 2.012 1.00 . A C . 622 ASN CG 1 1
1 891 1 1 66 ASN H H -6.381 10.851 1.205 1.00 . A C . 622 ASN H 1 1
1 892 1 1 66 ASN HA H -3.402 10.650 0.987 1.00 . A C . 622 ASN HA 1 1
1 893 1 1 66 ASN HB2 H -4.897 11.543 3.457 1.00 . A C . 622 ASN HB2 1 1
1 894 1 1 66 ASN HB3 H -3.189 11.761 3.078 1.00 . A C . 622 ASN HB3 1 1
1 895 1 1 66 ASN HD21 H -2.789 13.156 1.010 1.00 . A C . 622 ASN HD21 1 1
1 896 1 1 66 ASN HD22 H -3.826 14.479 0.774 1.00 . A C . 622 ASN HD22 1 1
1 897 1 1 66 ASN N N -5.496 10.831 0.784 1.00 . A C . 622 ASN N 1 1
1 898 1 1 66 ASN ND2 N -3.633 13.617 1.198 1.00 . A C . 622 ASN ND2 1 1
1 899 1 1 66 ASN O O -3.387 8.755 2.828 1.00 . A C . 622 ASN O 1 1
1 900 1 1 66 ASN OD1 O -5.548 13.653 2.245 1.00 . A C . 622 ASN OD1 1 1
1 901 1 1 67 SER C C -6.076 6.306 1.957 1.00 . A C . 623 SER C 1 1
1 902 1 1 67 SER CA C -5.676 7.347 3.003 1.00 . A C . 623 SER CA 1 1
1 903 1 1 67 SER CB C -6.760 7.432 4.079 1.00 . A C . 623 SER CB 1 1
1 904 1 1 67 SER H H -6.301 9.099 1.920 1.00 . A C . 623 SER H 1 1
1 905 1 1 67 SER HA H -4.738 7.062 3.457 1.00 . A C . 623 SER HA 1 1
1 906 1 1 67 SER HB2 H -7.665 6.973 3.718 1.00 . A C . 623 SER HB2 1 1
1 907 1 1 67 SER HB3 H -6.425 6.912 4.967 1.00 . A C . 623 SER HB3 1 1
1 908 1 1 67 SER HG H -7.956 8.895 4.542 1.00 . A C . 623 SER HG 1 1
1 909 1 1 67 SER N N -5.527 8.673 2.341 1.00 . A C . 623 SER N 1 1
1 910 1 1 67 SER O O -7.133 6.384 1.364 1.00 . A C . 623 SER O 1 1
1 911 1 1 67 SER OG O -7.015 8.798 4.381 1.00 . A C . 623 SER OG 1 1
1 912 1 1 68 PHE C C -5.322 2.905 1.289 1.00 . A C . 624 PHE C 1 1
1 913 1 1 68 PHE CA C -5.575 4.296 0.707 1.00 . A C . 624 PHE CA 1 1
1 914 1 1 68 PHE CB C -4.703 4.497 -0.534 1.00 . A C . 624 PHE CB 1 1
1 915 1 1 68 PHE CD1 C -2.900 2.757 -0.273 1.00 . A C . 624 PHE CD1 1 1
1 916 1 1 68 PHE CD2 C -2.339 5.083 0.119 1.00 . A C . 624 PHE CD2 1 1
1 917 1 1 68 PHE CE1 C -1.580 2.390 0.015 1.00 . A C . 624 PHE CE1 1 1
1 918 1 1 68 PHE CE2 C -1.018 4.716 0.407 1.00 . A C . 624 PHE CE2 1 1
1 919 1 1 68 PHE CG C -3.280 4.103 -0.221 1.00 . A C . 624 PHE CG 1 1
1 920 1 1 68 PHE CZ C -0.640 3.369 0.355 1.00 . A C . 624 PHE CZ 1 1
1 921 1 1 68 PHE H H -4.388 5.289 2.207 1.00 . A C . 624 PHE H 1 1
1 922 1 1 68 PHE HA H -6.615 4.386 0.433 1.00 . A C . 624 PHE HA 1 1
1 923 1 1 68 PHE HB2 H -5.078 3.884 -1.340 1.00 . A C . 624 PHE HB2 1 1
1 924 1 1 68 PHE HB3 H -4.731 5.536 -0.829 1.00 . A C . 624 PHE HB3 1 1
1 925 1 1 68 PHE HD1 H -3.625 2.001 -0.536 1.00 . A C . 624 PHE HD1 1 1
1 926 1 1 68 PHE HD2 H -2.633 6.122 0.160 1.00 . A C . 624 PHE HD2 1 1
1 927 1 1 68 PHE HE1 H -1.287 1.351 -0.025 1.00 . A C . 624 PHE HE1 1 1
1 928 1 1 68 PHE HE2 H -0.292 5.471 0.669 1.00 . A C . 624 PHE HE2 1 1
1 929 1 1 68 PHE HZ H 0.379 3.086 0.577 1.00 . A C . 624 PHE HZ 1 1
1 930 1 1 68 PHE N N -5.238 5.334 1.721 1.00 . A C . 624 PHE N 1 1
1 931 1 1 68 PHE O O -4.384 2.691 2.031 1.00 . A C . 624 PHE O 1 1
1 932 1 1 69 GLY C C -5.589 -0.360 0.330 1.00 . A C . 625 GLY C 1 1
1 933 1 1 69 GLY CA C -5.961 0.575 1.481 1.00 . A C . 625 GLY CA 1 1
1 934 1 1 69 GLY H H -6.900 2.150 0.350 1.00 . A C . 625 GLY H 1 1
1 935 1 1 69 GLY HA2 H -6.877 0.233 1.937 1.00 . A C . 625 GLY HA2 1 1
1 936 1 1 69 GLY HA3 H -5.169 0.577 2.217 1.00 . A C . 625 GLY HA3 1 1
1 937 1 1 69 GLY N N -6.152 1.955 0.953 1.00 . A C . 625 GLY N 1 1
1 938 1 1 69 GLY O O -5.929 -0.119 -0.811 1.00 . A C . 625 GLY O 1 1
1 939 1 1 70 VAL C C -4.506 -3.800 0.070 1.00 . A C . 626 VAL C 1 1
1 940 1 1 70 VAL CA C -4.501 -2.368 -0.468 1.00 . A C . 626 VAL CA 1 1
1 941 1 1 70 VAL CB C -3.098 -2.017 -0.968 1.00 . A C . 626 VAL CB 1 1
1 942 1 1 70 VAL CG1 C -2.714 -2.959 -2.111 1.00 . A C . 626 VAL CG1 1 1
1 943 1 1 70 VAL CG2 C -3.084 -0.572 -1.472 1.00 . A C . 626 VAL CG2 1 1
1 944 1 1 70 VAL H H -4.625 -1.602 1.543 1.00 . A C . 626 VAL H 1 1
1 945 1 1 70 VAL HA H -5.203 -2.288 -1.284 1.00 . A C . 626 VAL HA 1 1
1 946 1 1 70 VAL HB H -2.390 -2.126 -0.159 1.00 . A C . 626 VAL HB 1 1
1 947 1 1 70 VAL HG11 H -3.587 -3.175 -2.708 1.00 . A C . 626 VAL HG11 1 1
1 948 1 1 70 VAL HG12 H -1.963 -2.488 -2.728 1.00 . A C . 626 VAL HG12 1 1
1 949 1 1 70 VAL HG13 H -2.320 -3.878 -1.703 1.00 . A C . 626 VAL HG13 1 1
1 950 1 1 70 VAL HG21 H -4.057 -0.318 -1.866 1.00 . A C . 626 VAL HG21 1 1
1 951 1 1 70 VAL HG22 H -2.842 0.091 -0.655 1.00 . A C . 626 VAL HG22 1 1
1 952 1 1 70 VAL HG23 H -2.343 -0.470 -2.251 1.00 . A C . 626 VAL HG23 1 1
1 953 1 1 70 VAL N N -4.892 -1.425 0.617 1.00 . A C . 626 VAL N 1 1
1 954 1 1 70 VAL O O -4.288 -4.035 1.242 1.00 . A C . 626 VAL O 1 1
1 955 1 1 71 THR C C -3.363 -6.764 -0.437 1.00 . A C . 627 THR C 1 1
1 956 1 1 71 THR CA C -4.770 -6.176 -0.320 1.00 . A C . 627 THR CA 1 1
1 957 1 1 71 THR CB C -5.734 -6.984 -1.192 1.00 . A C . 627 THR CB 1 1
1 958 1 1 71 THR CG2 C -6.045 -8.318 -0.511 1.00 . A C . 627 THR CG2 1 1
1 959 1 1 71 THR H H -4.924 -4.548 -1.721 1.00 . A C . 627 THR H 1 1
1 960 1 1 71 THR HA H -5.094 -6.217 0.709 1.00 . A C . 627 THR HA 1 1
1 961 1 1 71 THR HB H -5.280 -7.172 -2.152 1.00 . A C . 627 THR HB 1 1
1 962 1 1 71 THR HG1 H -7.180 -6.299 -2.299 1.00 . A C . 627 THR HG1 1 1
1 963 1 1 71 THR HG21 H -5.752 -8.269 0.527 1.00 . A C . 627 THR HG21 1 1
1 964 1 1 71 THR HG22 H -7.104 -8.517 -0.578 1.00 . A C . 627 THR HG22 1 1
1 965 1 1 71 THR HG23 H -5.498 -9.109 -1.003 1.00 . A C . 627 THR HG23 1 1
1 966 1 1 71 THR N N -4.752 -4.759 -0.780 1.00 . A C . 627 THR N 1 1
1 967 1 1 71 THR O O -2.471 -6.158 -0.997 1.00 . A C . 627 THR O 1 1
1 968 1 1 71 THR OG1 O -6.937 -6.249 -1.371 1.00 . A C . 627 THR OG1 1 1
1 969 1 1 72 PHE C C -1.928 -10.075 0.204 1.00 . A C . 628 PHE C 1 1
1 970 1 1 72 PHE CA C -1.805 -8.563 0.006 1.00 . A C . 628 PHE CA 1 1
1 971 1 1 72 PHE CB C -0.907 -7.981 1.098 1.00 . A C . 628 PHE CB 1 1
1 972 1 1 72 PHE CD1 C 0.349 -6.212 -0.183 1.00 . A C . 628 PHE CD1 1 1
1 973 1 1 72 PHE CD2 C -1.275 -5.517 1.478 1.00 . A C . 628 PHE CD2 1 1
1 974 1 1 72 PHE CE1 C 0.632 -4.870 -0.467 1.00 . A C . 628 PHE CE1 1 1
1 975 1 1 72 PHE CE2 C -0.993 -4.176 1.194 1.00 . A C . 628 PHE CE2 1 1
1 976 1 1 72 PHE CG C -0.604 -6.535 0.790 1.00 . A C . 628 PHE CG 1 1
1 977 1 1 72 PHE CZ C -0.039 -3.853 0.221 1.00 . A C . 628 PHE CZ 1 1
1 978 1 1 72 PHE H H -3.887 -8.413 0.536 1.00 . A C . 628 PHE H 1 1
1 979 1 1 72 PHE HA H -1.372 -8.360 -0.963 1.00 . A C . 628 PHE HA 1 1
1 980 1 1 72 PHE HB2 H -1.411 -8.048 2.051 1.00 . A C . 628 PHE HB2 1 1
1 981 1 1 72 PHE HB3 H 0.017 -8.540 1.140 1.00 . A C . 628 PHE HB3 1 1
1 982 1 1 72 PHE HD1 H 0.867 -6.997 -0.714 1.00 . A C . 628 PHE HD1 1 1
1 983 1 1 72 PHE HD2 H -2.011 -5.767 2.228 1.00 . A C . 628 PHE HD2 1 1
1 984 1 1 72 PHE HE1 H 1.367 -4.621 -1.217 1.00 . A C . 628 PHE HE1 1 1
1 985 1 1 72 PHE HE2 H -1.511 -3.391 1.724 1.00 . A C . 628 PHE HE2 1 1
1 986 1 1 72 PHE HZ H 0.179 -2.818 0.003 1.00 . A C . 628 PHE HZ 1 1
1 987 1 1 72 PHE N N -3.155 -7.940 0.088 1.00 . A C . 628 PHE N 1 1
1 988 1 1 72 PHE O O -2.248 -10.546 1.277 1.00 . A C . 628 PHE O 1 1
1 989 1 1 73 TYR C C -0.631 -12.824 0.201 1.00 . A C . 629 TYR C 1 1
1 990 1 1 73 TYR CA C -1.771 -12.320 -0.686 1.00 . A C . 629 TYR CA 1 1
1 991 1 1 73 TYR CB C -1.668 -12.967 -2.069 1.00 . A C . 629 TYR CB 1 1
1 992 1 1 73 TYR CD1 C -4.098 -13.574 -2.348 1.00 . A C . 629 TYR CD1 1 1
1 993 1 1 73 TYR CD2 C -3.109 -11.983 -3.888 1.00 . A C . 629 TYR CD2 1 1
1 994 1 1 73 TYR CE1 C -5.325 -13.454 -3.013 1.00 . A C . 629 TYR CE1 1 1
1 995 1 1 73 TYR CE2 C -4.335 -11.863 -4.553 1.00 . A C . 629 TYR CE2 1 1
1 996 1 1 73 TYR CG C -2.990 -12.838 -2.786 1.00 . A C . 629 TYR CG 1 1
1 997 1 1 73 TYR CZ C -5.443 -12.599 -4.115 1.00 . A C . 629 TYR CZ 1 1
1 998 1 1 73 TYR H H -1.412 -10.442 -1.678 1.00 . A C . 629 TYR H 1 1
1 999 1 1 73 TYR HA H -2.719 -12.578 -0.237 1.00 . A C . 629 TYR HA 1 1
1 1000 1 1 73 TYR HB2 H -0.898 -12.472 -2.641 1.00 . A C . 629 TYR HB2 1 1
1 1001 1 1 73 TYR HB3 H -1.419 -14.012 -1.960 1.00 . A C . 629 TYR HB3 1 1
1 1002 1 1 73 TYR HD1 H -4.007 -14.234 -1.498 1.00 . A C . 629 TYR HD1 1 1
1 1003 1 1 73 TYR HD2 H -2.254 -11.416 -4.225 1.00 . A C . 629 TYR HD2 1 1
1 1004 1 1 73 TYR HE1 H -6.179 -14.022 -2.676 1.00 . A C . 629 TYR HE1 1 1
1 1005 1 1 73 TYR HE2 H -4.426 -11.204 -5.403 1.00 . A C . 629 TYR HE2 1 1
1 1006 1 1 73 TYR HH H -7.019 -13.361 -4.877 1.00 . A C . 629 TYR HH 1 1
1 1007 1 1 73 TYR N N -1.672 -10.840 -0.821 1.00 . A C . 629 TYR N 1 1
1 1008 1 1 73 TYR O O 0.483 -12.345 0.125 1.00 . A C . 629 TYR O 1 1
1 1009 1 1 73 TYR OH O -6.652 -12.481 -4.770 1.00 . A C . 629 TYR OH 1 1
1 1010 1 1 74 LYS C C 0.448 -15.780 1.580 1.00 . A C . 630 LYS C 1 1
1 1011 1 1 74 LYS CA C 0.175 -14.316 1.929 1.00 . A C . 630 LYS CA 1 1
1 1012 1 1 74 LYS CB C -0.262 -14.212 3.395 1.00 . A C . 630 LYS CB 1 1
1 1013 1 1 74 LYS CD C -2.196 -13.809 4.927 1.00 . A C . 630 LYS CD 1 1
1 1014 1 1 74 LYS CE C -2.069 -15.097 5.742 1.00 . A C . 630 LYS CE 1 1
1 1015 1 1 74 LYS CG C -1.785 -14.076 3.477 1.00 . A C . 630 LYS CG 1 1
1 1016 1 1 74 LYS H H -1.803 -14.160 1.086 1.00 . A C . 630 LYS H 1 1
1 1017 1 1 74 LYS HA H 1.077 -13.740 1.783 1.00 . A C . 630 LYS HA 1 1
1 1018 1 1 74 LYS HB2 H 0.048 -15.101 3.925 1.00 . A C . 630 LYS HB2 1 1
1 1019 1 1 74 LYS HB3 H 0.198 -13.346 3.846 1.00 . A C . 630 LYS HB3 1 1
1 1020 1 1 74 LYS HD2 H -1.553 -13.049 5.349 1.00 . A C . 630 LYS HD2 1 1
1 1021 1 1 74 LYS HD3 H -3.221 -13.468 4.953 1.00 . A C . 630 LYS HD3 1 1
1 1022 1 1 74 LYS HE2 H -2.917 -15.190 6.403 1.00 . A C . 630 LYS HE2 1 1
1 1023 1 1 74 LYS HE3 H -2.038 -15.944 5.074 1.00 . A C . 630 LYS HE3 1 1
1 1024 1 1 74 LYS HG2 H -2.106 -13.255 2.854 1.00 . A C . 630 LYS HG2 1 1
1 1025 1 1 74 LYS HG3 H -2.247 -14.991 3.137 1.00 . A C . 630 LYS HG3 1 1
1 1026 1 1 74 LYS HZ1 H -0.335 -14.143 6.390 1.00 . A C . 630 LYS HZ1 1 1
1 1027 1 1 74 LYS HZ2 H -1.046 -15.156 7.555 1.00 . A C . 630 LYS HZ2 1 1
1 1028 1 1 74 LYS HZ3 H -0.189 -15.831 6.256 1.00 . A C . 630 LYS HZ3 1 1
1 1029 1 1 74 LYS N N -0.898 -13.786 1.041 1.00 . A C . 630 LYS N 1 1
1 1030 1 1 74 LYS NZ N -0.815 -15.054 6.547 1.00 . A C . 630 LYS NZ 1 1
1 1031 1 1 74 LYS O O 1.540 -16.141 1.189 1.00 . A C . 630 LYS O 1 1
1 1032 1 1 75 ASN C C 1.018 -18.528 1.950 1.00 . A C . 631 ASN C 1 1
1 1033 1 1 75 ASN CA C -0.330 -18.065 1.392 1.00 . A C . 631 ASN CA 1 1
1 1034 1 1 75 ASN CB C -0.344 -18.252 -0.127 1.00 . A C . 631 ASN CB 1 1
1 1035 1 1 75 ASN CG C -1.486 -17.433 -0.732 1.00 . A C . 631 ASN CG 1 1
1 1036 1 1 75 ASN H H -1.409 -16.315 2.033 1.00 . A C . 631 ASN H 1 1
1 1037 1 1 75 ASN HA H -1.123 -18.651 1.833 1.00 . A C . 631 ASN HA 1 1
1 1038 1 1 75 ASN HB2 H 0.598 -17.918 -0.539 1.00 . A C . 631 ASN HB2 1 1
1 1039 1 1 75 ASN HB3 H -0.489 -19.296 -0.360 1.00 . A C . 631 ASN HB3 1 1
1 1040 1 1 75 ASN HD21 H -0.379 -16.726 -2.221 1.00 . A C . 631 ASN HD21 1 1
1 1041 1 1 75 ASN HD22 H -1.993 -16.200 -2.202 1.00 . A C . 631 ASN HD22 1 1
1 1042 1 1 75 ASN N N -0.536 -16.626 1.717 1.00 . A C . 631 ASN N 1 1
1 1043 1 1 75 ASN ND2 N -1.268 -16.728 -1.808 1.00 . A C . 631 ASN ND2 1 1
1 1044 1 1 75 ASN O O 1.650 -19.417 1.416 1.00 . A C . 631 ASN O 1 1
1 1045 1 1 75 ASN OD1 O -2.588 -17.436 -0.220 1.00 . A C . 631 ASN OD1 1 1
1 1046 1 1 76 GLY C C 3.696 -17.129 3.710 1.00 . A C . 632 GLY C 1 1
1 1047 1 1 76 GLY CA C 2.767 -18.341 3.616 1.00 . A C . 632 GLY CA 1 1
1 1048 1 1 76 GLY H H 0.935 -17.219 3.441 1.00 . A C . 632 GLY H 1 1
1 1049 1 1 76 GLY HA2 H 3.225 -19.093 2.991 1.00 . A C . 632 GLY HA2 1 1
1 1050 1 1 76 GLY HA3 H 2.601 -18.747 4.604 1.00 . A C . 632 GLY HA3 1 1
1 1051 1 1 76 GLY N N 1.461 -17.933 3.024 1.00 . A C . 632 GLY N 1 1
1 1052 1 1 76 GLY O O 4.903 -17.257 3.656 1.00 . A C . 632 GLY O 1 1
1 1053 1 1 77 SER C C 4.379 -14.502 5.419 1.00 . A C . 633 SER C 1 1
1 1054 1 1 77 SER CA C 4.006 -14.739 3.954 1.00 . A C . 633 SER CA 1 1
1 1055 1 1 77 SER CB C 3.243 -13.527 3.419 1.00 . A C . 633 SER CB 1 1
1 1056 1 1 77 SER H H 2.173 -15.869 3.898 1.00 . A C . 633 SER H 1 1
1 1057 1 1 77 SER HA H 4.905 -14.884 3.373 1.00 . A C . 633 SER HA 1 1
1 1058 1 1 77 SER HB2 H 3.919 -12.697 3.299 1.00 . A C . 633 SER HB2 1 1
1 1059 1 1 77 SER HB3 H 2.806 -13.773 2.460 1.00 . A C . 633 SER HB3 1 1
1 1060 1 1 77 SER HG H 1.950 -13.965 4.805 1.00 . A C . 633 SER HG 1 1
1 1061 1 1 77 SER N N 3.148 -15.953 3.854 1.00 . A C . 633 SER N 1 1
1 1062 1 1 77 SER O O 4.508 -15.430 6.193 1.00 . A C . 633 SER O 1 1
1 1063 1 1 77 SER OG O 2.223 -13.169 4.342 1.00 . A C . 633 SER OG 1 1
1 1064 1 1 78 SER C C 4.855 -11.471 7.477 1.00 . A C . 634 SER C 1 1
1 1065 1 1 78 SER CA C 4.917 -12.981 7.225 1.00 . A C . 634 SER CA 1 1
1 1066 1 1 78 SER CB C 6.331 -13.495 7.500 1.00 . A C . 634 SER CB 1 1
1 1067 1 1 78 SER H H 4.444 -12.532 5.171 1.00 . A C . 634 SER H 1 1
1 1068 1 1 78 SER HA H 4.220 -13.481 7.881 1.00 . A C . 634 SER HA 1 1
1 1069 1 1 78 SER HB2 H 6.988 -13.191 6.703 1.00 . A C . 634 SER HB2 1 1
1 1070 1 1 78 SER HB3 H 6.687 -13.082 8.435 1.00 . A C . 634 SER HB3 1 1
1 1071 1 1 78 SER HG H 6.973 -15.253 6.967 1.00 . A C . 634 SER HG 1 1
1 1072 1 1 78 SER N N 4.553 -13.268 5.809 1.00 . A C . 634 SER N 1 1
1 1073 1 1 78 SER O O 3.799 -10.872 7.452 1.00 . A C . 634 SER O 1 1
1 1074 1 1 78 SER OG O 6.309 -14.915 7.573 1.00 . A C . 634 SER OG 1 1
1 1075 1 1 79 ALA C C 5.061 -8.679 6.980 1.00 . A C . 635 ALA C 1 1
1 1076 1 1 79 ALA CA C 5.980 -9.382 7.982 1.00 . A C . 635 ALA CA 1 1
1 1077 1 1 79 ALA CB C 7.403 -8.841 7.834 1.00 . A C . 635 ALA CB 1 1
1 1078 1 1 79 ALA H H 6.820 -11.349 7.744 1.00 . A C . 635 ALA H 1 1
1 1079 1 1 79 ALA HA H 5.628 -9.193 8.986 1.00 . A C . 635 ALA HA 1 1
1 1080 1 1 79 ALA HB1 H 8.025 -9.243 8.620 1.00 . A C . 635 ALA HB1 1 1
1 1081 1 1 79 ALA HB2 H 7.388 -7.764 7.902 1.00 . A C . 635 ALA HB2 1 1
1 1082 1 1 79 ALA HB3 H 7.802 -9.136 6.874 1.00 . A C . 635 ALA HB3 1 1
1 1083 1 1 79 ALA N N 5.978 -10.850 7.724 1.00 . A C . 635 ALA N 1 1
1 1084 1 1 79 ALA O O 5.094 -8.949 5.796 1.00 . A C . 635 ALA O 1 1
1 1085 1 1 80 THR C C 4.120 -6.046 5.703 1.00 . A C . 636 THR C 1 1
1 1086 1 1 80 THR CA C 3.322 -7.056 6.533 1.00 . A C . 636 THR CA 1 1
1 1087 1 1 80 THR CB C 2.264 -6.322 7.361 1.00 . A C . 636 THR CB 1 1
1 1088 1 1 80 THR CG2 C 0.868 -6.762 6.918 1.00 . A C . 636 THR CG2 1 1
1 1089 1 1 80 THR H H 4.229 -7.576 8.401 1.00 . A C . 636 THR H 1 1
1 1090 1 1 80 THR HA H 2.841 -7.764 5.881 1.00 . A C . 636 THR HA 1 1
1 1091 1 1 80 THR HB H 2.367 -5.260 7.214 1.00 . A C . 636 THR HB 1 1
1 1092 1 1 80 THR HG1 H 1.875 -6.046 9.246 1.00 . A C . 636 THR HG1 1 1
1 1093 1 1 80 THR HG21 H 0.937 -7.286 5.977 1.00 . A C . 636 THR HG21 1 1
1 1094 1 1 80 THR HG22 H 0.444 -7.417 7.665 1.00 . A C . 636 THR HG22 1 1
1 1095 1 1 80 THR HG23 H 0.237 -5.893 6.802 1.00 . A C . 636 THR HG23 1 1
1 1096 1 1 80 THR N N 4.240 -7.778 7.448 1.00 . A C . 636 THR N 1 1
1 1097 1 1 80 THR O O 5.255 -5.748 6.017 1.00 . A C . 636 THR O 1 1
1 1098 1 1 80 THR OG1 O 2.443 -6.628 8.736 1.00 . A C . 636 THR OG1 1 1
1 1099 1 1 81 PRO C C 4.083 -3.171 4.382 1.00 . A C . 637 PRO C 1 1
1 1100 1 1 81 PRO CA C 4.119 -4.570 3.759 1.00 . A C . 637 PRO CA 1 1
1 1101 1 1 81 PRO CB C 3.241 -4.633 2.507 1.00 . A C . 637 PRO CB 1 1
1 1102 1 1 81 PRO CD C 2.119 -5.927 4.297 1.00 . A C . 637 PRO CD 1 1
1 1103 1 1 81 PRO CG C 1.874 -5.200 2.961 1.00 . A C . 637 PRO CG 1 1
1 1104 1 1 81 PRO HA H 5.129 -4.856 3.517 1.00 . A C . 637 PRO HA 1 1
1 1105 1 1 81 PRO HB2 H 3.116 -3.641 2.093 1.00 . A C . 637 PRO HB2 1 1
1 1106 1 1 81 PRO HB3 H 3.682 -5.290 1.775 1.00 . A C . 637 PRO HB3 1 1
1 1107 1 1 81 PRO HD2 H 1.419 -5.582 5.045 1.00 . A C . 637 PRO HD2 1 1
1 1108 1 1 81 PRO HD3 H 2.044 -6.995 4.168 1.00 . A C . 637 PRO HD3 1 1
1 1109 1 1 81 PRO HG2 H 1.167 -4.393 3.099 1.00 . A C . 637 PRO HG2 1 1
1 1110 1 1 81 PRO HG3 H 1.501 -5.899 2.229 1.00 . A C . 637 PRO HG3 1 1
1 1111 1 1 81 PRO N N 3.499 -5.552 4.665 1.00 . A C . 637 PRO N 1 1
1 1112 1 1 81 PRO O O 3.468 -2.953 5.406 1.00 . A C . 637 PRO O 1 1
1 1113 1 1 82 GLY C C 5.017 0.168 3.213 1.00 . A C . 638 GLY C 1 1
1 1114 1 1 82 GLY CA C 4.740 -0.840 4.330 1.00 . A C . 638 GLY CA 1 1
1 1115 1 1 82 GLY H H 5.229 -2.417 2.946 1.00 . A C . 638 GLY H 1 1
1 1116 1 1 82 GLY HA2 H 5.510 -0.757 5.082 1.00 . A C . 638 GLY HA2 1 1
1 1117 1 1 82 GLY HA3 H 3.778 -0.632 4.775 1.00 . A C . 638 GLY HA3 1 1
1 1118 1 1 82 GLY N N 4.739 -2.221 3.771 1.00 . A C . 638 GLY N 1 1
1 1119 1 1 82 GLY O O 5.602 -0.158 2.198 1.00 . A C . 638 GLY O 1 1
1 1120 1 1 83 ALA C C 6.034 3.292 2.747 1.00 . A C . 639 ALA C 1 1
1 1121 1 1 83 ALA CA C 4.840 2.425 2.344 1.00 . A C . 639 ALA CA 1 1
1 1122 1 1 83 ALA CB C 3.598 3.304 2.197 1.00 . A C . 639 ALA CB 1 1
1 1123 1 1 83 ALA H H 4.133 1.636 4.218 1.00 . A C . 639 ALA H 1 1
1 1124 1 1 83 ALA HA H 5.051 1.939 1.403 1.00 . A C . 639 ALA HA 1 1
1 1125 1 1 83 ALA HB1 H 3.363 3.420 1.150 1.00 . A C . 639 ALA HB1 1 1
1 1126 1 1 83 ALA HB2 H 2.766 2.839 2.704 1.00 . A C . 639 ALA HB2 1 1
1 1127 1 1 83 ALA HB3 H 3.790 4.273 2.633 1.00 . A C . 639 ALA HB3 1 1
1 1128 1 1 83 ALA N N 4.601 1.394 3.392 1.00 . A C . 639 ALA N 1 1
1 1129 1 1 83 ALA O O 6.158 3.709 3.882 1.00 . A C . 639 ALA O 1 1
1 1130 1 1 84 THR C C 7.866 5.856 1.818 1.00 . A C . 640 THR C 1 1
1 1131 1 1 84 THR CA C 8.115 4.384 2.156 1.00 . A C . 640 THR CA 1 1
1 1132 1 1 84 THR CB C 9.299 3.906 1.334 1.00 . A C . 640 THR CB 1 1
1 1133 1 1 84 THR CG2 C 10.597 4.164 2.101 1.00 . A C . 640 THR CG2 1 1
1 1134 1 1 84 THR H H 6.803 3.197 0.924 1.00 . A C . 640 THR H 1 1
1 1135 1 1 84 THR HA H 8.345 4.288 3.205 1.00 . A C . 640 THR HA 1 1
1 1136 1 1 84 THR HB H 9.317 4.456 0.409 1.00 . A C . 640 THR HB 1 1
1 1137 1 1 84 THR HG1 H 9.530 2.037 1.815 1.00 . A C . 640 THR HG1 1 1
1 1138 1 1 84 THR HG21 H 10.369 4.367 3.136 1.00 . A C . 640 THR HG21 1 1
1 1139 1 1 84 THR HG22 H 11.232 3.292 2.037 1.00 . A C . 640 THR HG22 1 1
1 1140 1 1 84 THR HG23 H 11.107 5.013 1.671 1.00 . A C . 640 THR HG23 1 1
1 1141 1 1 84 THR N N 6.919 3.556 1.828 1.00 . A C . 640 THR N 1 1
1 1142 1 1 84 THR O O 7.169 6.191 0.884 1.00 . A C . 640 THR O 1 1
1 1143 1 1 84 THR OG1 O 9.166 2.517 1.068 1.00 . A C . 640 THR OG1 1 1
1 1144 1 1 85 CYS C C 9.457 8.958 2.965 1.00 . A C . 641 CYS C 1 1
1 1145 1 1 85 CYS CA C 8.309 8.193 2.302 1.00 . A C . 641 CYS CA 1 1
1 1146 1 1 85 CYS CB C 6.969 8.679 2.864 1.00 . A C . 641 CYS CB 1 1
1 1147 1 1 85 CYS H H 9.048 6.428 3.288 1.00 . A C . 641 CYS H 1 1
1 1148 1 1 85 CYS HA H 8.333 8.366 1.236 1.00 . A C . 641 CYS HA 1 1
1 1149 1 1 85 CYS HB2 H 6.673 8.043 3.685 1.00 . A C . 641 CYS HB2 1 1
1 1150 1 1 85 CYS HB3 H 7.067 9.693 3.217 1.00 . A C . 641 CYS HB3 1 1
1 1151 1 1 85 CYS N N 8.468 6.733 2.563 1.00 . A C . 641 CYS N 1 1
1 1152 1 1 85 CYS O O 9.265 9.673 3.929 1.00 . A C . 641 CYS O 1 1
1 1153 1 1 85 CYS SG S 5.709 8.610 1.568 1.00 . A C . 641 CYS SG 1 1
1 1154 1 1 86 ALA C C 12.497 10.377 1.981 1.00 . A C . 642 ALA C 1 1
1 1155 1 1 86 ALA CA C 11.811 9.531 3.053 1.00 . A C . 642 ALA CA 1 1
1 1156 1 1 86 ALA CB C 12.814 8.515 3.601 1.00 . A C . 642 ALA CB 1 1
1 1157 1 1 86 ALA H H 10.782 8.232 1.677 1.00 . A C . 642 ALA H 1 1
1 1158 1 1 86 ALA HA H 11.469 10.169 3.854 1.00 . A C . 642 ALA HA 1 1
1 1159 1 1 86 ALA HB1 H 13.744 8.601 3.056 1.00 . A C . 642 ALA HB1 1 1
1 1160 1 1 86 ALA HB2 H 12.417 7.518 3.482 1.00 . A C . 642 ALA HB2 1 1
1 1161 1 1 86 ALA HB3 H 12.989 8.711 4.649 1.00 . A C . 642 ALA HB3 1 1
1 1162 1 1 86 ALA N N 10.650 8.813 2.455 1.00 . A C . 642 ALA N 1 1
1 1163 1 1 86 ALA O O 12.218 10.253 0.805 1.00 . A C . 642 ALA O 1 1
1 1164 1 1 87 THR C C 15.600 11.734 1.392 1.00 . A C . 643 THR C 1 1
1 1165 1 1 87 THR CA C 14.111 12.074 1.378 1.00 . A C . 643 THR CA 1 1
1 1166 1 1 87 THR CB C 13.929 13.550 1.721 1.00 . A C . 643 THR CB 1 1
1 1167 1 1 87 THR CG2 C 12.441 13.861 1.880 1.00 . A C . 643 THR CG2 1 1
1 1168 1 1 87 THR H H 13.616 11.311 3.329 1.00 . A C . 643 THR H 1 1
1 1169 1 1 87 THR HA H 13.708 11.882 0.395 1.00 . A C . 643 THR HA 1 1
1 1170 1 1 87 THR HB H 14.336 14.151 0.923 1.00 . A C . 643 THR HB 1 1
1 1171 1 1 87 THR HG1 H 14.596 13.052 3.479 1.00 . A C . 643 THR HG1 1 1
1 1172 1 1 87 THR HG21 H 11.944 13.014 2.331 1.00 . A C . 643 THR HG21 1 1
1 1173 1 1 87 THR HG22 H 12.319 14.728 2.513 1.00 . A C . 643 THR HG22 1 1
1 1174 1 1 87 THR HG23 H 12.008 14.058 0.911 1.00 . A C . 643 THR HG23 1 1
1 1175 1 1 87 THR N N 13.401 11.231 2.377 1.00 . A C . 643 THR N 1 1
1 1176 1 1 87 THR O O 16.326 12.105 2.292 1.00 . A C . 643 THR O 1 1
1 1177 1 1 87 THR OG1 O 14.611 13.842 2.933 1.00 . A C . 643 THR OG1 1 1
1 1178 1 1 88 GLY C C 17.634 9.140 0.257 1.00 . A C . 644 GLY C 1 1
1 1179 1 1 88 GLY CA C 17.499 10.661 0.340 1.00 . A C . 644 GLY CA 1 1
1 1180 1 1 88 GLY H H 15.447 10.747 -0.314 1.00 . A C . 644 GLY H 1 1
1 1181 1 1 88 GLY HA2 H 17.997 11.015 1.230 1.00 . A C . 644 GLY HA2 1 1
1 1182 1 1 88 GLY HA3 H 17.951 11.113 -0.531 1.00 . A C . 644 GLY HA3 1 1
1 1183 1 1 88 GLY N N 16.056 11.031 0.397 1.00 . A C . 644 GLY N 1 1
1 1184 1 1 88 GLY O O 17.103 8.568 -0.680 1.00 . A C . 644 GLY O 1 1
1 1185 1 1 88 GLY OXT O 18.268 8.573 1.132 1.00 . A C . 644 GLY OXT 1 1
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