data_nef_c25307_2mw8 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MW8 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 637 GLY start . false 2 A 638 SER middle . . 3 A 639 HIS middle . . 4 A 640 MET middle . . 5 A 641 ASN middle . . 6 A 642 ARG middle . . 7 A 643 GLN middle . . 8 A 644 LYS middle . . 9 A 645 THR middle . . 10 A 646 ARG middle . . 11 A 647 PRO middle . false 12 A 648 ARG middle . . 13 A 649 THR middle . . 14 A 650 LYS middle . . 15 A 651 ILE middle . . 16 A 652 SER middle . . 17 A 653 VAL middle . . 18 A 654 GLU middle . . 19 A 655 ALA middle . . 20 A 656 LEU middle . . 21 A 657 GLY middle . false 22 A 658 ILE middle . . 23 A 659 LEU middle . . 24 A 660 GLN middle . . 25 A 661 SER middle . . 26 A 662 PHE middle . . 27 A 663 ILE middle . . 28 A 664 GLN middle . . 29 A 665 ASP middle . . 30 A 666 VAL middle . . 31 A 667 GLY middle . false 32 A 668 LEU middle . . 33 A 669 TYR middle . . 34 A 670 PRO middle . false 35 A 671 ASP middle . . 36 A 672 GLU middle . . 37 A 673 GLU middle . . 38 A 674 ALA middle . . 39 A 675 ILE middle . . 40 A 676 GLN middle . . 41 A 677 THR middle . . 42 A 678 LEU middle . . 43 A 679 SER middle . . 44 A 680 ALA middle . . 45 A 681 GLN middle . . 46 A 682 LEU middle . . 47 A 683 ASP middle . . 48 A 684 LEU middle . . 49 A 685 PRO middle . false 50 A 686 LYS middle . . 51 A 687 TYR middle . . 52 A 688 THR middle . . 53 A 689 ILE middle . . 54 A 690 ILE middle . . 55 A 691 LYS middle . . 56 A 692 PHE middle . . 57 A 693 PHE middle . . 58 A 694 GLN middle . . 59 A 695 ASN middle . . 60 A 696 GLN middle . . 61 A 697 ARG middle . . 62 A 698 TYR middle . . 63 A 699 TYR middle . . 64 A 700 LEU middle . . 65 A 701 LYS middle . . 66 A 702 HIS middle . . 67 A 703 HIS middle . . 68 A 704 GLY middle . false 69 A 705 LYS middle . . 70 A 706 LEU middle . . 71 A 707 LYS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 641 ASN H H 1 8.61 0.01 A 641 ASN HD2x H 1 6.98 0.01 A 641 ASN HD2y H 1 7.66 0.01 A 641 ASN N N 15 120.60 0.10 A 641 ASN ND2 N 15 113.10 0.10 A 642 ARG H H 1 8.39 0.01 A 642 ARG N N 15 121.90 0.10 A 643 GLN H H 1 8.41 0.01 A 643 GLN HE2x H 1 6.89 0.01 A 643 GLN HE2y H 1 7.55 0.01 A 643 GLN N N 15 121.30 0.10 A 643 GLN NE2 N 15 112.70 0.10 A 644 LYS H H 1 8.40 0.01 A 644 LYS N N 15 122.90 0.10 A 645 THR H H 1 8.16 0.01 A 645 THR N N 15 115.80 0.10 A 646 ARG H H 1 8.41 0.01 A 646 ARG N N 15 124.90 0.10 A 648 ARG H H 1 8.60 0.01 A 648 ARG N N 15 122.20 0.10 A 649 THR H H 1 8.25 0.01 A 649 THR N N 15 114.70 0.10 A 650 LYS H H 1 8.12 0.01 A 650 LYS N N 15 124.30 0.10 A 651 ILE H H 1 8.30 0.01 A 651 ILE N N 15 124.10 0.10 A 652 SER H H 1 8.73 0.01 A 652 SER N N 15 124.80 0.10 A 653 VAL H H 1 8.64 0.01 A 653 VAL N N 15 120.10 0.10 A 654 GLU H H 1 8.71 0.01 A 654 GLU N N 15 121.30 0.10 A 655 ALA H H 1 7.98 0.01 A 655 ALA N N 15 123.70 0.10 A 656 LEU H H 1 8.56 0.01 A 656 LEU N N 15 118.90 0.10 A 657 GLY H H 1 7.81 0.01 A 657 GLY N N 15 105.50 0.10 A 658 ILE H H 1 7.43 0.01 A 658 ILE N N 15 124.20 0.10 A 659 LEU H H 1 8.37 0.01 A 659 LEU N N 15 122.60 0.10 A 660 GLN H H 1 8.85 0.01 A 660 GLN HE2x H 1 6.73 0.01 A 660 GLN HE2y H 1 7.31 0.01 A 660 GLN N N 15 117.70 0.10 A 660 GLN NE2 N 15 110.10 0.10 A 661 SER H H 1 8.07 0.01 A 661 SER N N 15 116.80 0.10 A 662 PHE H H 1 8.14 0.01 A 662 PHE N N 15 123.80 0.10 A 663 ILE H H 1 8.41 0.01 A 663 ILE N N 15 120.80 0.10 A 664 GLN H H 1 7.75 0.01 A 664 GLN HE2x H 1 6.85 0.01 A 664 GLN HE2y H 1 7.60 0.01 A 664 GLN N N 15 117.50 0.10 A 664 GLN NE2 N 15 112.20 0.10 A 665 ASP H H 1 8.15 0.01 A 665 ASP N N 15 117.60 0.10 A 666 VAL H H 1 8.48 0.01 A 666 VAL N N 15 120.30 0.10 A 667 GLY H H 1 7.88 0.01 A 667 GLY N N 15 109.70 0.10 A 668 LEU H H 1 8.05 0.01 A 668 LEU N N 15 114.10 0.10 A 669 TYR H H 1 8.45 0.01 A 669 TYR N N 15 117.50 0.10 A 671 ASP H H 1 8.32 0.01 A 671 ASP N N 15 121.40 0.10 A 672 GLU H H 1 8.46 0.01 A 672 GLU N N 15 118.10 0.10 A 673 GLU H H 1 8.23 0.01 A 673 GLU N N 15 119.90 0.10 A 674 ALA H H 1 8.35 0.01 A 674 ALA N N 15 124.70 0.10 A 675 ILE H H 1 8.22 0.01 A 675 ILE N N 15 118.10 0.10 A 676 GLN H H 1 8.17 0.01 A 676 GLN HE2x H 1 6.91 0.01 A 676 GLN HE2y H 1 7.62 0.01 A 676 GLN N N 15 120.10 0.10 A 676 GLN NE2 N 15 112.20 0.10 A 677 THR H H 1 8.53 0.01 A 677 THR N N 15 118.60 0.10 A 678 LEU H H 1 8.48 0.01 A 678 LEU N N 15 122.80 0.10 A 679 SER H H 1 8.32 0.01 A 679 SER N N 15 113.50 0.10 A 680 ALA H H 1 7.86 0.01 A 680 ALA N N 15 121.50 0.10 A 681 GLN H H 1 8.45 0.01 A 681 GLN HE2x H 1 6.64 0.01 A 681 GLN HE2y H 1 7.31 0.01 A 681 GLN N N 15 118.10 0.10 A 681 GLN NE2 N 15 108.90 0.10 A 682 LEU H H 1 8.15 0.01 A 682 LEU N N 15 114.80 0.10 A 683 ASP H H 1 7.83 0.01 A 683 ASP N N 15 119.60 0.10 A 684 LEU H H 1 7.66 0.01 A 684 LEU N N 15 117.10 0.10 A 686 LYS H H 1 8.96 0.01 A 686 LYS N N 15 123.60 0.10 A 687 TYR H H 1 8.15 0.01 A 687 TYR N N 15 114.20 0.10 A 688 THR H H 1 6.97 0.01 A 688 THR N N 15 118.50 0.10 A 689 ILE H H 1 7.28 0.01 A 689 ILE N N 15 122.10 0.10 A 690 ILE H H 1 8.63 0.01 A 690 ILE N N 15 120.40 0.10 A 691 LYS H H 1 8.01 0.01 A 691 LYS N N 15 119.60 0.10 A 692 PHE H H 1 7.82 0.01 A 692 PHE N N 15 120.30 0.10 A 693 PHE H H 1 8.11 0.01 A 693 PHE N N 15 118.20 0.10 A 694 GLN H H 1 8.55 0.01 A 694 GLN HE2x H 1 6.85 0.01 A 694 GLN HE2y H 1 7.48 0.01 A 694 GLN N N 15 119.30 0.10 A 694 GLN NE2 N 15 111.30 0.10 A 695 ASN H H 1 8.56 0.01 A 695 ASN HD2x H 1 6.89 0.01 A 695 ASN HD2y H 1 7.63 0.01 A 695 ASN N N 15 118.90 0.10 A 695 ASN ND2 N 15 112.00 0.10 A 696 GLN H H 1 8.02 0.01 A 696 GLN HE2x H 1 6.52 0.01 A 696 GLN HE2y H 1 6.73 0.01 A 696 GLN N N 15 119.70 0.10 A 696 GLN NE2 N 15 113.10 0.10 A 697 ARG H H 1 8.24 0.01 A 697 ARG N N 15 118.30 0.10 A 698 TYR H H 1 7.93 0.01 A 698 TYR N N 15 120.30 0.10 A 699 TYR H H 1 8.29 0.01 A 699 TYR N N 15 120.10 0.10 A 700 LEU H H 1 8.10 0.01 A 700 LEU N N 15 119.80 0.10 A 701 LYS H H 1 7.75 0.01 A 701 LYS N N 15 118.60 0.10 A 702 HIS H H 1 7.81 0.01 A 702 HIS N N 15 115.70 0.10 A 703 HIS H H 1 8.15 0.01 A 703 HIS N N 15 117.80 0.10 A 704 GLY H H 1 8.27 0.01 A 704 GLY N N 15 109.30 0.10 A 705 LYS H H 1 8.06 0.01 A 705 LYS N N 15 119.80 0.10 A 706 LEU H H 1 8.25 0.01 A 706 LEU N N 15 123.00 0.10 A 707 LYS H H 1 7.83 0.01 A 707 LYS N N 15 126.60 0.10 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 641 ASN HA A 642 ARG H 1.0 2.5 6.0 2 2 A 642 ARG H A 641 ASN HBx 1.0 2.5 6.0 3 2 A 642 ARG H A 641 ASN HBy 1.0 2.5 6.0 4 3 A 643 GLN H A 642 ARG HBx 1.0 2.0 4.5 5 3 A 642 ARG HBy A 643 GLN H 1.0 2.0 4.5 6 4 A 643 GLN HA A 644 LYS H 1.0 1.5 2.8 7 5 A 644 LYS H A 643 GLN HBx 1.0 2.0 4.5 8 5 A 644 LYS H A 643 GLN HBy 1.0 2.0 4.5 9 6 A 644 LYS HA A 645 THR H 1.0 1.5 3.5 10 7 A 645 THR H A 644 LYS HBx 1.0 2.0 4.5 11 7 A 645 THR H A 644 LYS HBy 1.0 2.0 4.5 12 8 A 644 LYS H A 645 THR H 1.0 2.0 4.5 13 9 A 645 THR HA A 646 ARG H 1.0 1.5 2.8 14 10 A 646 ARG H A 645 THR HB 1.0 2.0 4.5 15 11 A 646 ARG H A 645 THR HG21 1.0 2.5 6.0 16 12 A 645 THR H A 646 ARG H 1.0 2.0 4.5 17 13 A 646 ARG HA A 647 PRO HDy 1.0 1.5 3.5 18 14 A 646 ARG HA A 647 PRO HDx 1.0 1.5 3.5 19 15 A 646 ARG HA A 647 PRO HGx 1.0 2.5 6.0 20 15 A 646 ARG HA A 647 PRO HGy 1.0 2.5 6.0 21 16 A 646 ARG HBx A 647 PRO HDx 1.0 2.5 6.0 22 16 A 646 ARG HBy A 647 PRO HDx 1.0 2.5 6.0 23 16 A 647 PRO HDy A 646 ARG HBx 1.0 2.5 6.0 24 16 A 646 ARG HBy A 647 PRO HDy 1.0 2.5 6.0 25 17 A 646 ARG H A 647 PRO HDy 1.0 2.5 6.0 26 18 A 646 ARG H A 647 PRO HDx 1.0 2.5 6.0 27 19 A 647 PRO HA A 648 ARG H 1.0 1.5 3.5 28 20 A 648 ARG H A 647 PRO HBx 1.0 2.0 4.5 29 20 A 648 ARG H A 647 PRO HBy 1.0 2.0 4.5 30 21 A 648 ARG H A 647 PRO HDx 1.0 2.5 6.0 31 21 A 647 PRO HDy A 648 ARG H 1.0 2.5 6.0 32 22 A 648 ARG HA A 649 THR H 1.0 1.5 3.5 33 23 A 649 THR H A 648 ARG HBx 1.0 2.0 4.5 34 23 A 649 THR H A 648 ARG HBy 1.0 2.0 4.5 35 24 A 649 THR H A 648 ARG HGx 1.0 2.0 4.5 36 24 A 649 THR H A 648 ARG HGy 1.0 2.0 4.5 37 25 A 648 ARG H A 649 THR H 1.0 2.5 6.0 38 26 A 649 THR HA A 650 LYS H 1.0 1.5 3.5 39 27 A 650 LYS H A 649 THR HB 1.0 2.5 6.0 40 28 A 650 LYS H A 649 THR HG21 1.0 2.0 4.5 41 29 A 649 THR H A 650 LYS H 1.0 2.0 4.5 42 30 A 650 LYS HA A 651 ILE HG1x 1.0 2.0 4.5 43 30 A 650 LYS HA A 651 ILE HG1y 1.0 2.0 4.5 44 31 A 650 LYS HA A 651 ILE H 1.0 1.5 2.8 45 32 A 651 ILE H A 650 LYS HBx 1.0 2.0 4.5 46 32 A 651 ILE H A 650 LYS HBy 1.0 2.0 4.5 47 33 A 651 ILE H A 650 LYS HGy 1.0 2.5 6.0 48 34 A 651 ILE H A 650 LYS HGx 1.0 2.5 6.0 49 35 A 650 LYS H A 651 ILE H 1.0 2.0 4.5 50 36 A 651 ILE HA A 652 SER H 1.0 1.5 2.8 51 37 A 652 SER H A 651 ILE HB 1.0 2.5 6.0 52 38 A 652 SER H A 651 ILE HD11 1.0 2.5 6.0 53 39 A 652 SER H A 651 ILE HG1x 1.0 2.5 6.0 54 39 A 651 ILE HG1y A 652 SER H 1.0 2.5 6.0 55 40 A 652 SER H A 651 ILE HG21 1.0 2.0 4.5 56 41 A 651 ILE H A 652 SER H 1.0 2.5 6.0 57 42 A 651 ILE HG21 A 655 ALA HB1 1.0 1.5 2.8 58 43 A 651 ILE HG21 A 655 ALA H 1.0 2.0 4.5 59 44 A 651 ILE HG21 A 656 LEU HA 1.0 2.0 4.5 60 45 A 651 ILE HG21 A 656 LEU H 1.0 2.0 4.5 61 46 A 651 ILE HD11 A 659 LEU HD11 1.0 1.5 3.5 62 46 A 651 ILE HD11 A 659 LEU HD21 1.0 1.5 3.5 63 47 A 651 ILE HG21 A 659 LEU HD11 1.0 1.5 3.5 64 47 A 651 ILE HG21 A 659 LEU HD21 1.0 1.5 3.5 65 48 A 651 ILE HA A 684 LEU HD11 1.0 2.0 4.5 66 48 A 651 ILE HA A 684 LEU HD21 1.0 2.0 4.5 67 49 A 651 ILE HD11 A 684 LEU HD11 1.0 1.5 3.5 68 49 A 651 ILE HD11 A 684 LEU HD21 1.0 1.5 3.5 69 50 A 651 ILE HG1y A 684 LEU HD11 1.0 1.5 2.8 70 50 A 651 ILE HG1x A 684 LEU HD11 1.0 1.5 2.8 71 50 A 684 LEU HD21 A 651 ILE HG1x 1.0 1.5 2.8 72 50 A 651 ILE HG1y A 684 LEU HD21 1.0 1.5 2.8 73 51 A 651 ILE HG21 A 684 LEU HD11 1.0 1.5 2.8 74 51 A 651 ILE HG21 A 684 LEU HD21 1.0 1.5 2.8 75 52 A 651 ILE HD11 A 688 THR HG21 1.0 1.5 3.5 76 53 A 688 THR HG21 A 651 ILE HG1x 1.0 2.0 4.5 77 53 A 651 ILE HG1y A 688 THR HG21 1.0 2.0 4.5 78 54 A 651 ILE HG21 A 688 THR HG21 1.0 2.0 4.5 79 55 A 651 ILE HB A 692 PHE HE% 1.0 2.5 6.0 80 56 A 651 ILE HD11 A 692 PHE HBy 1.0 2.0 4.5 81 57 A 651 ILE HD11 A 692 PHE HBx 1.0 2.0 4.5 82 58 A 651 ILE HD11 A 692 PHE HD% 1.0 1.5 3.5 83 59 A 651 ILE HD11 A 692 PHE HE% 1.0 2.0 4.5 84 60 A 651 ILE HD11 A 692 PHE H 1.0 2.5 6.0 85 61 A 692 PHE HD% A 651 ILE HG1x 1.0 2.5 6.0 86 61 A 651 ILE HG1y A 692 PHE HD% 1.0 2.5 6.0 87 62 A 652 SER HA A 653 VAL HA 1.0 2.0 4.5 88 63 A 652 SER HA A 653 VAL HG11 1.0 2.5 6.0 89 64 A 652 SER HA A 653 VAL HG21 1.0 2.0 4.5 90 65 A 652 SER HA A 653 VAL H 1.0 1.5 3.5 91 66 A 653 VAL H A 652 SER HBx 1.0 2.0 4.5 92 66 A 653 VAL H A 652 SER HBy 1.0 2.0 4.5 93 67 A 652 SER HA A 654 GLU H 1.0 2.0 4.5 94 68 A 655 ALA H A 652 SER HA 1.0 2.5 6.0 95 69 A 655 ALA H A 652 SER HBx 1.0 2.5 6.0 96 69 A 655 ALA H A 652 SER HBy 1.0 2.5 6.0 97 70 A 652 SER H A 655 ALA HB1 1.0 2.0 4.5 98 71 A 652 SER H A 684 LEU HD11 1.0 2.5 6.0 99 71 A 652 SER H A 684 LEU HD21 1.0 2.5 6.0 100 72 A 653 VAL HA A 654 GLU H 1.0 2.0 4.5 101 73 A 653 VAL HG11 A 654 GLU HA 1.0 2.0 4.5 102 74 A 653 VAL HG11 A 654 GLU H 1.0 2.0 4.5 103 75 A 653 VAL HG21 A 654 GLU H 1.0 2.0 4.5 104 76 A 653 VAL H A 654 GLU HA 1.0 2.5 6.0 105 77 A 653 VAL H A 654 GLU H 1.0 1.5 3.5 106 78 A 655 ALA H A 653 VAL HA 1.0 2.5 6.0 107 79 A 655 ALA HB1 A 653 VAL H 1.0 2.5 6.0 108 80 A 655 ALA H A 653 VAL H 1.0 2.5 6.0 109 81 A 653 VAL HA A 657 GLY H 1.0 2.5 6.0 110 82 A 655 ALA H A 654 GLU HA 1.0 2.0 4.5 111 83 A 655 ALA H A 654 GLU HBy 1.0 2.0 4.5 112 84 A 655 ALA H A 654 GLU HBx 1.0 2.0 4.5 113 85 A 655 ALA H A 654 GLU HGy 1.0 2.5 6.0 114 86 A 655 ALA H A 654 GLU HGx 1.0 2.5 6.0 115 87 A 655 ALA H A 654 GLU H 1.0 2.0 4.5 116 88 A 656 LEU H A 654 GLU H 1.0 2.0 4.5 117 89 A 654 GLU HA A 657 GLY H 1.0 2.0 4.5 118 90 A 654 GLU H A 657 GLY H 1.0 2.5 6.0 119 91 A 656 LEU H A 655 ALA HA 1.0 2.5 6.0 120 92 A 655 ALA HB1 A 656 LEU H 1.0 2.0 4.5 121 93 A 655 ALA H A 656 LEU HBx 1.0 2.5 6.0 122 93 A 655 ALA H A 656 LEU HBy 1.0 2.5 6.0 123 94 A 655 ALA H A 656 LEU H 1.0 2.0 4.5 124 95 A 657 GLY H A 655 ALA HA 1.0 2.5 6.0 125 96 A 655 ALA H A 657 GLY H 1.0 2.0 4.5 126 97 A 655 ALA HA A 658 ILE HB 1.0 1.5 3.5 127 98 A 655 ALA HA A 658 ILE HD11 1.0 1.5 2.8 128 99 A 655 ALA HA A 658 ILE HG1x 1.0 2.0 4.5 129 99 A 655 ALA HA A 658 ILE HG1y 1.0 2.0 4.5 130 100 A 655 ALA HA A 658 ILE H 1.0 2.0 4.5 131 101 A 655 ALA H A 658 ILE HD11 1.0 2.5 6.0 132 102 A 655 ALA HA A 659 LEU H 1.0 2.5 6.0 133 103 A 655 ALA HA A 682 LEU HD11 1.0 1.5 2.8 134 103 A 655 ALA HA A 682 LEU HD21 1.0 1.5 2.8 135 104 A 655 ALA HB1 A 682 LEU HD11 1.0 1.5 2.8 136 104 A 655 ALA HB1 A 682 LEU HD21 1.0 1.5 2.8 137 105 A 655 ALA H A 682 LEU HD11 1.0 2.5 6.0 138 105 A 655 ALA H A 682 LEU HD21 1.0 2.5 6.0 139 106 A 656 LEU HA A 657 GLY H 1.0 2.0 4.5 140 107 A 657 GLY H A 656 LEU HBx 1.0 1.5 3.5 141 107 A 657 GLY H A 656 LEU HBy 1.0 1.5 3.5 142 108 A 656 LEU HD21 A 657 GLY HAx 1.0 2.0 4.5 143 108 A 656 LEU HD11 A 657 GLY HAx 1.0 2.0 4.5 144 108 A 657 GLY HAy A 656 LEU HD11 1.0 2.0 4.5 145 108 A 656 LEU HD21 A 657 GLY HAy 1.0 2.0 4.5 146 109 A 657 GLY H A 656 LEU HD11 1.0 2.5 6.0 147 109 A 657 GLY H A 656 LEU HD21 1.0 2.5 6.0 148 110 A 657 GLY H A 656 LEU HG 1.0 2.0 4.5 149 111 A 656 LEU H A 657 GLY H 1.0 2.0 4.5 150 112 A 656 LEU HA A 659 LEU HBx 1.0 2.0 4.5 151 112 A 656 LEU HA A 659 LEU HBy 1.0 2.0 4.5 152 113 A 656 LEU HA A 659 LEU HD11 1.0 2.0 4.5 153 113 A 656 LEU HA A 659 LEU HD21 1.0 2.0 4.5 154 114 A 656 LEU HA A 659 LEU H 1.0 2.5 6.0 155 115 A 656 LEU HA A 660 GLN H 1.0 2.5 6.0 156 116 A 656 LEU HD11 A 660 GLN HE2x 1.0 2.0 4.5 157 116 A 656 LEU HD21 A 660 GLN HE2x 1.0 2.0 4.5 158 116 A 660 GLN HE2y A 656 LEU HD11 1.0 2.0 4.5 159 116 A 656 LEU HD21 A 660 GLN HE2y 1.0 2.0 4.5 160 117 A 660 GLN H A 656 LEU HD11 1.0 2.0 4.5 161 117 A 656 LEU HD21 A 660 GLN H 1.0 2.0 4.5 162 118 A 660 GLN HE2y A 656 LEU HD11 1.0 2.5 6.0 163 118 A 656 LEU HD11 A 660 GLN HE2x 1.0 2.5 6.0 164 119 A 656 LEU HD21 A 660 GLN HE2y 1.0 2.5 6.0 165 119 A 656 LEU HD21 A 660 GLN HE2x 1.0 2.5 6.0 166 120 A 656 LEU HG A 660 GLN HGx 1.0 2.5 6.0 167 120 A 656 LEU HG A 660 GLN HGy 1.0 2.5 6.0 168 121 A 656 LEU HA A 692 PHE HE% 1.0 2.0 4.5 169 122 A 656 LEU HA A 692 PHE HZ 1.0 2.5 6.0 170 123 A 692 PHE HD% A 656 LEU HD11 1.0 2.0 4.5 171 123 A 692 PHE HD% A 656 LEU HD21 1.0 2.0 4.5 172 124 A 692 PHE HE% A 656 LEU HD11 1.0 1.5 3.5 173 124 A 692 PHE HE% A 656 LEU HD21 1.0 1.5 3.5 174 125 A 692 PHE HZ A 656 LEU HD11 1.0 1.5 3.5 175 125 A 656 LEU HD21 A 692 PHE HZ 1.0 1.5 3.5 176 126 A 658 ILE H A 657 GLY HAx 1.0 2.0 4.5 177 126 A 658 ILE H A 657 GLY HAy 1.0 2.0 4.5 178 127 A 657 GLY H A 658 ILE HA 1.0 2.5 6.0 179 128 A 657 GLY H A 658 ILE H 1.0 2.0 4.5 180 129 A 659 LEU H A 657 GLY HAx 1.0 2.0 4.5 181 129 A 659 LEU H A 657 GLY HAy 1.0 2.0 4.5 182 130 A 657 GLY H A 659 LEU H 1.0 2.5 6.0 183 131 A 660 GLN H A 657 GLY HAx 1.0 2.0 4.5 184 131 A 657 GLY HAy A 660 GLN H 1.0 2.0 4.5 185 132 A 659 LEU H A 658 ILE HA 1.0 2.5 6.0 186 133 A 658 ILE HB A 659 LEU H 1.0 2.0 4.5 187 134 A 658 ILE HD11 A 659 LEU H 1.0 2.0 4.5 188 135 A 659 LEU H A 658 ILE HG21 1.0 2.0 4.5 189 136 A 658 ILE H A 659 LEU HBx 1.0 2.5 6.0 190 136 A 658 ILE H A 659 LEU HBy 1.0 2.5 6.0 191 137 A 658 ILE H A 659 LEU H 1.0 2.0 4.5 192 138 A 660 GLN H A 658 ILE HA 1.0 2.5 6.0 193 139 A 658 ILE H A 660 GLN H 1.0 2.5 6.0 194 140 A 658 ILE HA A 661 SER HA 1.0 2.5 6.0 195 141 A 658 ILE HA A 661 SER HBy 1.0 2.5 6.0 196 142 A 658 ILE HA A 661 SER HBx 1.0 2.0 4.5 197 143 A 658 ILE HA A 661 SER H 1.0 2.0 4.5 198 144 A 658 ILE HA A 662 PHE H 1.0 2.5 6.0 199 145 A 658 ILE HG21 A 662 PHE H 1.0 2.5 6.0 200 146 A 658 ILE HD11 A 681 GLN HE2x 1.0 2.0 4.5 201 146 A 658 ILE HD11 A 681 GLN HE2y 1.0 2.0 4.5 202 147 A 658 ILE HG21 A 681 GLN HE2x 1.0 2.0 4.5 203 147 A 658 ILE HG21 A 681 GLN HE2y 1.0 2.0 4.5 204 148 A 658 ILE HB A 682 LEU HD11 1.0 2.0 4.5 205 148 A 658 ILE HB A 682 LEU HD21 1.0 2.0 4.5 206 149 A 658 ILE HD11 A 682 LEU HD11 1.0 1.5 3.5 207 149 A 658 ILE HD11 A 682 LEU HD21 1.0 1.5 3.5 208 150 A 658 ILE HG21 A 682 LEU HD11 1.0 1.5 3.5 209 150 A 682 LEU HD21 A 658 ILE HG21 1.0 1.5 3.5 210 151 A 660 GLN H A 659 LEU HA 1.0 2.5 6.0 211 152 A 660 GLN HA A 659 LEU HBx 1.0 2.0 4.5 212 152 A 659 LEU HBy A 660 GLN HA 1.0 2.0 4.5 213 153 A 660 GLN H A 659 LEU HBx 1.0 2.0 4.5 214 153 A 659 LEU HBy A 660 GLN H 1.0 2.0 4.5 215 154 A 660 GLN H A 659 LEU HD11 1.0 2.5 6.0 216 155 A 659 LEU HD21 A 660 GLN H 1.0 2.5 6.0 217 156 A 659 LEU H A 660 GLN H 1.0 2.0 4.5 218 157 A 659 LEU H A 661 SER H 1.0 2.5 6.0 219 158 A 659 LEU HA A 662 PHE HBy 1.0 2.0 4.5 220 159 A 659 LEU HA A 662 PHE HBx 1.0 2.0 4.5 221 160 A 659 LEU HA A 662 PHE HD% 1.0 2.5 6.0 222 161 A 662 PHE H A 659 LEU HA 1.0 2.0 4.5 223 162 A 662 PHE HD% A 659 LEU HD11 1.0 2.5 6.0 224 162 A 659 LEU HD21 A 662 PHE HD% 1.0 2.5 6.0 225 163 A 659 LEU HD21 A 678 LEU HD11 1.0 1.5 2.8 226 163 A 659 LEU HD11 A 678 LEU HD11 1.0 1.5 2.8 227 163 A 678 LEU HD21 A 659 LEU HD11 1.0 1.5 2.8 228 163 A 659 LEU HD21 A 678 LEU HD21 1.0 1.5 2.8 229 164 A 682 LEU HD21 A 659 LEU HD11 1.0 1.5 3.5 230 164 A 659 LEU HD11 A 682 LEU HD11 1.0 1.5 3.5 231 165 A 659 LEU HD21 A 682 LEU HD21 1.0 1.5 3.5 232 165 A 659 LEU HD21 A 682 LEU HD11 1.0 1.5 3.5 233 166 A 659 LEU H A 682 LEU HD11 1.0 2.5 6.0 234 166 A 659 LEU H A 682 LEU HD21 1.0 2.5 6.0 235 167 A 689 ILE HG21 A 659 LEU HD11 1.0 2.0 4.5 236 167 A 659 LEU HD21 A 689 ILE HG21 1.0 2.0 4.5 237 168 A 692 PHE HE% A 659 LEU HA 1.0 2.5 6.0 238 169 A 692 PHE HE% A 659 LEU HBx 1.0 2.0 4.5 239 169 A 692 PHE HE% A 659 LEU HBy 1.0 2.0 4.5 240 170 A 692 PHE HZ A 659 LEU HBx 1.0 2.0 4.5 241 170 A 659 LEU HBy A 692 PHE HZ 1.0 2.0 4.5 242 171 A 692 PHE HD% A 659 LEU HD11 1.0 2.0 4.5 243 171 A 659 LEU HD21 A 692 PHE HD% 1.0 2.0 4.5 244 172 A 692 PHE HE% A 659 LEU HD11 1.0 2.0 4.5 245 172 A 659 LEU HD21 A 692 PHE HE% 1.0 2.0 4.5 246 173 A 692 PHE HZ A 659 LEU HD11 1.0 2.5 6.0 247 173 A 659 LEU HD21 A 692 PHE HZ 1.0 2.5 6.0 248 174 A 692 PHE HD% A 659 LEU HD11 1.0 2.0 4.5 249 175 A 692 PHE HE% A 659 LEU HD11 1.0 2.0 4.5 250 176 A 692 PHE HZ A 659 LEU HD11 1.0 2.5 6.0 251 177 A 659 LEU HD21 A 692 PHE HD% 1.0 2.0 4.5 252 178 A 659 LEU HD21 A 692 PHE HE% 1.0 2.0 4.5 253 179 A 659 LEU HD21 A 692 PHE HZ 1.0 2.5 6.0 254 180 A 693 PHE HD% A 659 LEU HD11 1.0 2.5 6.0 255 180 A 659 LEU HD21 A 693 PHE HD% 1.0 2.5 6.0 256 181 A 693 PHE HE% A 659 LEU HD11 1.0 2.0 4.5 257 181 A 659 LEU HD21 A 693 PHE HE% 1.0 2.0 4.5 258 182 A 693 PHE HZ A 659 LEU HD11 1.0 2.0 4.5 259 182 A 659 LEU HD21 A 693 PHE HZ 1.0 2.0 4.5 260 183 A 661 SER H A 660 GLN HA 1.0 2.0 4.5 261 184 A 661 SER H A 660 GLN HBy 1.0 2.0 4.5 262 185 A 661 SER H A 660 GLN HBx 1.0 2.0 4.5 263 186 A 660 GLN H A 661 SER HA 1.0 2.5 6.0 264 187 A 660 GLN H A 661 SER H 1.0 2.0 4.5 265 188 A 662 PHE H A 660 GLN HA 1.0 2.0 4.5 266 189 A 660 GLN H A 662 PHE H 1.0 2.5 6.0 267 190 A 660 GLN HA A 663 ILE HD11 1.0 1.5 3.5 268 191 A 660 GLN HA A 663 ILE HG1x 1.0 2.0 4.5 269 191 A 660 GLN HA A 663 ILE HG1y 1.0 2.0 4.5 270 192 A 660 GLN HA A 663 ILE H 1.0 2.0 4.5 271 193 A 660 GLN H A 663 ILE HD11 1.0 2.5 6.0 272 194 A 660 GLN HA A 664 GLN H 1.0 2.5 6.0 273 195 A 692 PHE HE% A 660 GLN HA 1.0 2.5 6.0 274 196 A 692 PHE HZ A 660 GLN HA 1.0 2.5 6.0 275 197 A 692 PHE HZ A 660 GLN HGx 1.0 2.5 6.0 276 197 A 660 GLN HGy A 692 PHE HZ 1.0 2.5 6.0 277 198 A 692 PHE HE% A 660 GLN H 1.0 2.5 6.0 278 199 A 660 GLN H A 692 PHE HZ 1.0 2.5 6.0 279 200 A 661 SER HBy A 662 PHE H 1.0 2.0 4.5 280 201 A 661 SER HBx A 662 PHE H 1.0 2.0 4.5 281 202 A 661 SER H A 662 PHE H 1.0 1.5 3.5 282 203 A 661 SER H A 663 ILE H 1.0 2.5 6.0 283 204 A 661 SER HA A 664 GLN HBx 1.0 1.5 3.5 284 204 A 661 SER HA A 664 GLN HBy 1.0 1.5 3.5 285 205 A 661 SER HA A 664 GLN HGx 1.0 2.0 4.5 286 205 A 661 SER HA A 664 GLN HGy 1.0 2.0 4.5 287 206 A 661 SER HA A 664 GLN H 1.0 2.0 4.5 288 207 A 663 ILE H A 662 PHE HA 1.0 2.0 4.5 289 208 A 662 PHE HBy A 663 ILE H 1.0 2.0 4.5 290 209 A 662 PHE HBx A 663 ILE H 1.0 2.0 4.5 291 210 A 662 PHE HD% A 663 ILE HA 1.0 2.0 4.5 292 211 A 662 PHE HD% A 663 ILE HG1x 1.0 2.0 4.5 293 211 A 662 PHE HD% A 663 ILE HG1y 1.0 2.0 4.5 294 212 A 662 PHE HD% A 663 ILE H 1.0 2.0 4.5 295 213 A 663 ILE HA A 662 PHE HE% 1.0 2.5 6.0 296 214 A 662 PHE H A 663 ILE H 1.0 2.0 4.5 297 215 A 662 PHE H A 664 GLN H 1.0 2.0 4.5 298 216 A 662 PHE HA A 665 ASP HBx 1.0 2.0 4.5 299 216 A 662 PHE HA A 665 ASP HBy 1.0 2.0 4.5 300 217 A 662 PHE HA A 665 ASP H 1.0 2.0 4.5 301 218 A 662 PHE HA A 666 VAL HG21 1.0 2.0 4.5 302 219 A 662 PHE HA A 666 VAL H 1.0 2.0 4.5 303 220 A 662 PHE HD% A 666 VAL HB 1.0 2.0 4.5 304 221 A 662 PHE HD% A 666 VAL HG11 1.0 2.5 6.0 305 222 A 662 PHE HD% A 666 VAL HG21 1.0 2.0 4.5 306 223 A 662 PHE HD% A 666 VAL H 1.0 2.5 6.0 307 224 A 662 PHE HE% A 666 VAL HA 1.0 2.5 6.0 308 225 A 662 PHE HE% A 666 VAL HB 1.0 2.0 4.5 309 226 A 662 PHE HE% A 666 VAL HG11 1.0 1.5 3.5 310 227 A 662 PHE HE% A 666 VAL HG21 1.0 2.0 4.5 311 228 A 666 VAL HG11 A 662 PHE HZ 1.0 1.5 3.5 312 229 A 666 VAL HG21 A 662 PHE HZ 1.0 2.0 4.5 313 230 A 662 PHE HD% A 667 GLY H 1.0 2.5 6.0 314 231 A 662 PHE HE% A 667 GLY H 1.0 2.5 6.0 315 232 A 662 PHE HD% A 668 LEU HA 1.0 2.5 6.0 316 233 A 662 PHE HD% A 670 PRO HDx 1.0 2.5 6.0 317 233 A 662 PHE HD% A 670 PRO HDy 1.0 2.5 6.0 318 234 A 662 PHE HE% A 670 PRO HA 1.0 2.0 4.5 319 235 A 662 PHE HE% A 670 PRO HBx 1.0 2.0 4.5 320 235 A 662 PHE HE% A 670 PRO HBy 1.0 2.0 4.5 321 236 A 662 PHE HE% A 670 PRO HDx 1.0 2.5 6.0 322 236 A 662 PHE HE% A 670 PRO HDy 1.0 2.5 6.0 323 237 A 662 PHE HZ A 670 PRO HA 1.0 2.0 4.5 324 238 A 662 PHE HZ A 670 PRO HBx 1.0 2.0 4.5 325 238 A 662 PHE HZ A 670 PRO HBy 1.0 2.0 4.5 326 239 A 662 PHE HE% A 671 ASP H 1.0 2.5 6.0 327 240 A 662 PHE HZ A 671 ASP H 1.0 2.5 6.0 328 241 A 662 PHE HE% A 674 ALA HA 1.0 2.5 6.0 329 242 A 662 PHE HE% A 674 ALA HB1 1.0 1.5 3.5 330 243 A 662 PHE HZ A 674 ALA HA 1.0 2.5 6.0 331 244 A 662 PHE HZ A 674 ALA HB1 1.0 1.5 3.5 332 245 A 662 PHE HBx A 678 LEU HD11 1.0 2.5 6.0 333 245 A 662 PHE HBx A 678 LEU HD21 1.0 2.5 6.0 334 246 A 662 PHE HD% A 678 LEU HD11 1.0 2.0 4.5 335 246 A 662 PHE HD% A 678 LEU HD21 1.0 2.0 4.5 336 247 A 662 PHE HE% A 678 LEU HD11 1.0 2.0 4.5 337 247 A 678 LEU HD21 A 662 PHE HE% 1.0 2.0 4.5 338 248 A 662 PHE HZ A 678 LEU HD11 1.0 2.5 6.0 339 248 A 678 LEU HD21 A 662 PHE HZ 1.0 2.5 6.0 340 249 A 662 PHE HBy A 693 PHE HZ 1.0 2.5 6.0 341 250 A 662 PHE HBx A 693 PHE HZ 1.0 2.0 4.5 342 251 A 662 PHE HD% A 693 PHE HE% 1.0 2.0 4.5 343 252 A 662 PHE HD% A 693 PHE HZ 1.0 1.5 3.5 344 253 A 693 PHE HD% A 662 PHE HE% 1.0 2.5 6.0 345 254 A 693 PHE HE% A 662 PHE HE% 1.0 2.0 4.5 346 255 A 693 PHE HZ A 662 PHE HE% 1.0 2.0 4.5 347 256 A 664 GLN H A 663 ILE HA 1.0 2.0 4.5 348 257 A 664 GLN H A 663 ILE HB 1.0 2.0 4.5 349 258 A 664 GLN H A 663 ILE HG21 1.0 2.0 4.5 350 259 A 663 ILE H A 664 GLN H 1.0 2.0 4.5 351 260 A 663 ILE HA A 667 GLY HAx 1.0 2.0 4.5 352 260 A 663 ILE HA A 667 GLY HAy 1.0 2.0 4.5 353 261 A 663 ILE HA A 667 GLY H 1.0 2.0 4.5 354 262 A 663 ILE H A 667 GLY H 1.0 2.5 6.0 355 263 A 663 ILE HA A 668 LEU HA 1.0 2.0 4.5 356 264 A 663 ILE HD11 A 668 LEU HA 1.0 2.5 6.0 357 265 A 668 LEU HA A 663 ILE HG1x 1.0 2.5 6.0 358 265 A 663 ILE HG1y A 668 LEU HA 1.0 2.5 6.0 359 266 A 668 LEU HA A 663 ILE HG21 1.0 2.5 6.0 360 267 A 663 ILE HG21 A 668 LEU HG 1.0 1.5 3.5 361 268 A 692 PHE HD% A 663 ILE HD11 1.0 2.0 4.5 362 269 A 692 PHE HE% A 663 ILE HD11 1.0 1.5 3.5 363 270 A 692 PHE HZ A 663 ILE HD11 1.0 2.0 4.5 364 271 A 692 PHE HE% A 663 ILE HG1x 1.0 2.5 6.0 365 271 A 692 PHE HE% A 663 ILE HG1y 1.0 2.5 6.0 366 272 A 693 PHE HE% A 663 ILE HA 1.0 2.5 6.0 367 273 A 693 PHE HD% A 663 ILE HD11 1.0 2.5 6.0 368 274 A 693 PHE HE% A 663 ILE HD11 1.0 2.0 4.5 369 275 A 693 PHE HZ A 663 ILE HD11 1.0 2.5 6.0 370 276 A 693 PHE HD% A 663 ILE HG1x 1.0 2.5 6.0 371 276 A 693 PHE HD% A 663 ILE HG1y 1.0 2.5 6.0 372 277 A 693 PHE HE% A 663 ILE HG1x 1.0 2.0 4.5 373 277 A 693 PHE HE% A 663 ILE HG1y 1.0 2.0 4.5 374 278 A 693 PHE HZ A 663 ILE HG1x 1.0 2.5 6.0 375 278 A 693 PHE HZ A 663 ILE HG1y 1.0 2.5 6.0 376 279 A 693 PHE HE% A 663 ILE H 1.0 2.5 6.0 377 280 A 663 ILE HD11 A 696 GLN HE2x 1.0 2.5 6.0 378 280 A 663 ILE HD11 A 696 GLN HE2y 1.0 2.5 6.0 379 281 A 665 ASP H A 664 GLN HA 1.0 1.5 3.5 380 282 A 665 ASP HA A 664 GLN HBx 1.0 2.5 6.0 381 282 A 664 GLN HBy A 665 ASP HA 1.0 2.5 6.0 382 283 A 665 ASP H A 664 GLN HBx 1.0 1.5 3.5 383 283 A 664 GLN HBy A 665 ASP H 1.0 1.5 3.5 384 284 A 664 GLN H A 665 ASP HA 1.0 2.5 6.0 385 285 A 664 GLN H A 665 ASP H 1.0 1.5 3.5 386 286 A 664 GLN H A 666 VAL H 1.0 2.5 6.0 387 287 A 664 GLN H A 667 GLY H 1.0 2.5 6.0 388 288 A 666 VAL HG21 A 665 ASP HA 1.0 2.5 6.0 389 289 A 666 VAL H A 665 ASP HA 1.0 2.0 4.5 390 290 A 666 VAL HG21 A 665 ASP HBx 1.0 1.5 3.5 391 290 A 665 ASP HBy A 666 VAL HG21 1.0 1.5 3.5 392 291 A 666 VAL H A 665 ASP HBx 1.0 2.0 4.5 393 291 A 665 ASP HBy A 666 VAL H 1.0 2.0 4.5 394 292 A 665 ASP H A 666 VAL HB 1.0 2.5 6.0 395 293 A 665 ASP H A 666 VAL HG11 1.0 2.5 6.0 396 294 A 665 ASP H A 666 VAL HG21 1.0 2.5 6.0 397 295 A 665 ASP H A 666 VAL H 1.0 1.5 3.5 398 296 A 667 GLY H A 665 ASP HBx 1.0 2.5 6.0 399 296 A 665 ASP HBy A 667 GLY H 1.0 2.5 6.0 400 297 A 665 ASP H A 667 GLY H 1.0 2.0 4.5 401 298 A 666 VAL HA A 667 GLY H 1.0 2.0 4.5 402 299 A 666 VAL HB A 667 GLY HAx 1.0 2.0 4.5 403 299 A 666 VAL HB A 667 GLY HAy 1.0 2.0 4.5 404 300 A 666 VAL HB A 667 GLY H 1.0 1.5 3.5 405 301 A 666 VAL HG11 A 667 GLY H 1.0 2.0 4.5 406 302 A 666 VAL HG21 A 667 GLY H 1.0 2.0 4.5 407 303 A 666 VAL H A 667 GLY H 1.0 1.5 3.5 408 304 A 666 VAL HG11 A 670 PRO HA 1.0 2.5 6.0 409 305 A 666 VAL HG21 A 674 ALA HB1 1.0 2.5 6.0 410 306 A 666 VAL HG21 A 678 LEU HD11 1.0 2.5 6.0 411 306 A 678 LEU HD21 A 666 VAL HG21 1.0 2.5 6.0 412 307 A 667 GLY HAy A 668 LEU H 1.0 2.0 4.5 413 308 A 668 LEU H A 667 GLY HAx 1.0 2.0 4.5 414 309 A 667 GLY H A 668 LEU H 1.0 2.0 4.5 415 310 A 669 TYR H A 667 GLY HAx 1.0 2.0 4.5 416 310 A 667 GLY HAy A 669 TYR H 1.0 2.0 4.5 417 311 A 668 LEU HA A 669 TYR HD% 1.0 2.5 6.0 418 312 A 668 LEU HA A 669 TYR H 1.0 2.0 4.5 419 313 A 669 TYR HD% A 668 LEU HBx 1.0 2.0 4.5 420 313 A 669 TYR HD% A 668 LEU HBy 1.0 2.0 4.5 421 314 A 669 TYR HE% A 668 LEU HBx 1.0 2.0 4.5 422 314 A 668 LEU HBy A 669 TYR HE% 1.0 2.0 4.5 423 315 A 669 TYR H A 668 LEU HBx 1.0 2.0 4.5 424 315 A 669 TYR H A 668 LEU HBy 1.0 2.0 4.5 425 316 A 669 TYR HE% A 668 LEU HD11 1.0 2.0 4.5 426 316 A 669 TYR HE% A 668 LEU HD21 1.0 2.0 4.5 427 317 A 668 LEU HG A 669 TYR H 1.0 2.5 6.0 428 318 A 668 LEU H A 669 TYR HD% 1.0 2.0 4.5 429 319 A 668 LEU H A 669 TYR H 1.0 2.0 4.5 430 320 A 668 LEU HA A 670 PRO HDx 1.0 2.5 6.0 431 320 A 668 LEU HA A 670 PRO HDy 1.0 2.5 6.0 432 321 A 693 PHE HD% A 668 LEU HA 1.0 2.0 4.5 433 322 A 693 PHE HE% A 668 LEU HA 1.0 2.0 4.5 434 323 A 693 PHE HD% A 668 LEU HD11 1.0 2.0 4.5 435 323 A 693 PHE HD% A 668 LEU HD21 1.0 2.0 4.5 436 324 A 696 GLN HBy A 668 LEU HD11 1.0 2.0 4.5 437 324 A 668 LEU HD21 A 696 GLN HBy 1.0 2.0 4.5 438 325 A 696 GLN HBx A 668 LEU HD11 1.0 1.5 3.5 439 325 A 668 LEU HD21 A 696 GLN HBx 1.0 1.5 3.5 440 326 A 668 LEU HD21 A 697 ARG HDy 1.0 2.5 6.0 441 326 A 697 ARG HDy A 668 LEU HD11 1.0 2.5 6.0 442 327 A 668 LEU HD11 A 697 ARG HDx 1.0 2.5 6.0 443 327 A 668 LEU HD21 A 697 ARG HDx 1.0 2.5 6.0 444 328 A 668 LEU HD11 A 697 ARG HGx 1.0 1.5 3.5 445 328 A 668 LEU HD21 A 697 ARG HGx 1.0 1.5 3.5 446 328 A 697 ARG HGy A 668 LEU HD11 1.0 1.5 3.5 447 328 A 668 LEU HD21 A 697 ARG HGy 1.0 1.5 3.5 448 329 A 669 TYR HA A 670 PRO HDx 1.0 1.5 3.5 449 329 A 670 PRO HDy A 669 TYR HA 1.0 1.5 3.5 450 330 A 669 TYR HA A 670 PRO HGy 1.0 2.5 6.0 451 330 A 669 TYR HA A 670 PRO HGx 1.0 2.5 6.0 452 331 A 670 PRO HA A 669 TYR H 1.0 2.5 6.0 453 332 A 670 PRO HDy A 669 TYR H 1.0 2.5 6.0 454 333 A 669 TYR H A 670 PRO HDx 1.0 2.5 6.0 455 334 A 669 TYR HE% A 697 ARG HDy 1.0 2.0 4.5 456 335 A 669 TYR HE% A 697 ARG HDx 1.0 2.0 4.5 457 336 A 670 PRO HA A 671 ASP HA 1.0 2.5 6.0 458 337 A 670 PRO HA A 671 ASP H 1.0 1.5 2.8 459 338 A 671 ASP H A 670 PRO HBx 1.0 2.0 4.5 460 338 A 670 PRO HBy A 671 ASP H 1.0 2.0 4.5 461 339 A 671 ASP H A 670 PRO HDx 1.0 2.5 6.0 462 339 A 670 PRO HDy A 671 ASP H 1.0 2.5 6.0 463 340 A 670 PRO HA A 674 ALA HB1 1.0 2.0 4.5 464 341 A 670 PRO HBx A 675 ILE HG1x 1.0 1.5 3.5 465 341 A 670 PRO HBy A 675 ILE HG1x 1.0 1.5 3.5 466 341 A 675 ILE HG1y A 670 PRO HBx 1.0 1.5 3.5 467 341 A 670 PRO HBy A 675 ILE HG1y 1.0 1.5 3.5 468 342 A 675 ILE HD11 A 670 PRO HGy 1.0 2.0 4.5 469 342 A 670 PRO HGx A 675 ILE HD11 1.0 2.0 4.5 470 343 A 670 PRO HGx A 675 ILE HG1x 1.0 2.0 4.5 471 343 A 670 PRO HGy A 675 ILE HG1x 1.0 2.0 4.5 472 343 A 675 ILE HG1y A 670 PRO HGy 1.0 2.0 4.5 473 343 A 670 PRO HGx A 675 ILE HG1y 1.0 2.0 4.5 474 344 A 675 ILE HD11 A 670 PRO HGy 1.0 2.0 4.5 475 345 A 670 PRO HGx A 675 ILE HD11 1.0 2.0 4.5 476 346 A 693 PHE HD% A 670 PRO HDx 1.0 2.5 6.0 477 346 A 693 PHE HD% A 670 PRO HDy 1.0 2.5 6.0 478 347 A 693 PHE HE% A 670 PRO HDx 1.0 2.5 6.0 479 347 A 693 PHE HE% A 670 PRO HDy 1.0 2.5 6.0 480 348 A 693 PHE HD% A 670 PRO HGy 1.0 2.0 4.5 481 348 A 693 PHE HD% A 670 PRO HGx 1.0 2.0 4.5 482 349 A 671 ASP HA A 672 GLU HA 1.0 2.0 4.5 483 350 A 671 ASP HA A 672 GLU H 1.0 1.5 3.5 484 351 A 672 GLU H A 671 ASP HBx 1.0 1.5 3.5 485 351 A 672 GLU H A 671 ASP HBy 1.0 1.5 3.5 486 352 A 671 ASP HA A 673 GLU H 1.0 2.5 6.0 487 353 A 673 GLU H A 671 ASP HBx 1.0 2.0 4.5 488 353 A 671 ASP HBy A 673 GLU H 1.0 2.0 4.5 489 354 A 674 ALA HB1 A 671 ASP HA 1.0 2.5 6.0 490 355 A 671 ASP HA A 674 ALA H 1.0 2.5 6.0 491 356 A 674 ALA H A 671 ASP HBx 1.0 2.5 6.0 492 356 A 671 ASP HBy A 674 ALA H 1.0 2.5 6.0 493 357 A 671 ASP H A 674 ALA HB1 1.0 1.5 3.5 494 358 A 671 ASP HA A 675 ILE H 1.0 2.5 6.0 495 359 A 672 GLU HA A 673 GLU H 1.0 2.0 4.5 496 360 A 673 GLU H A 672 GLU HBx 1.0 1.5 3.5 497 361 A 672 GLU H A 673 GLU H 1.0 2.0 4.5 498 362 A 672 GLU HA A 674 ALA H 1.0 2.5 6.0 499 363 A 672 GLU H A 674 ALA H 1.0 2.0 4.5 500 364 A 672 GLU HA A 675 ILE HB 1.0 2.0 4.5 501 365 A 675 ILE HD11 A 672 GLU HA 1.0 2.0 4.5 502 366 A 672 GLU HA A 675 ILE HG1x 1.0 2.5 6.0 503 366 A 675 ILE HG1y A 672 GLU HA 1.0 2.5 6.0 504 367 A 672 GLU HA A 675 ILE H 1.0 2.0 4.5 505 368 A 672 GLU HA A 676 GLN H 1.0 2.5 6.0 506 369 A 672 GLU HGy A 676 GLN HE2x 1.0 2.5 6.0 507 369 A 672 GLU HGx A 676 GLN HE2x 1.0 2.5 6.0 508 369 A 676 GLN HE2y A 672 GLU HGx 1.0 2.5 6.0 509 369 A 672 GLU HGy A 676 GLN HE2y 1.0 2.5 6.0 510 370 A 674 ALA H A 673 GLU HA 1.0 2.0 4.5 511 371 A 674 ALA H A 673 GLU HBx 1.0 2.0 4.5 512 371 A 674 ALA H A 673 GLU HBy 1.0 2.0 4.5 513 372 A 674 ALA H A 673 GLU HGx 1.0 2.0 4.5 514 372 A 674 ALA H A 673 GLU HGy 1.0 2.0 4.5 515 373 A 673 GLU H A 674 ALA H 1.0 1.5 3.5 516 374 A 673 GLU HA A 676 GLN HBx 1.0 1.5 3.5 517 374 A 673 GLU HA A 676 GLN HBy 1.0 1.5 3.5 518 375 A 673 GLU HA A 676 GLN HGx 1.0 2.0 4.5 519 375 A 673 GLU HA A 676 GLN HGy 1.0 2.0 4.5 520 376 A 676 GLN H A 673 GLU HA 1.0 2.0 4.5 521 377 A 673 GLU HA A 677 THR H 1.0 2.5 6.0 522 378 A 674 ALA HA A 675 ILE H 1.0 2.0 4.5 523 379 A 674 ALA HB1 A 675 ILE H 1.0 1.5 3.5 524 380 A 674 ALA H A 675 ILE HA 1.0 2.5 6.0 525 381 A 674 ALA H A 675 ILE H 1.0 1.5 3.5 526 382 A 674 ALA HA A 676 GLN H 1.0 2.5 6.0 527 383 A 674 ALA H A 676 GLN H 1.0 2.0 4.5 528 384 A 674 ALA HA A 677 THR HB 1.0 1.5 3.5 529 385 A 674 ALA HA A 677 THR H 1.0 2.0 4.5 530 386 A 674 ALA HA A 678 LEU H 1.0 2.5 6.0 531 387 A 674 ALA HB1 A 678 LEU HD11 1.0 2.0 4.5 532 387 A 678 LEU HD21 A 674 ALA HB1 1.0 2.0 4.5 533 388 A 676 GLN H A 675 ILE HA 1.0 2.0 4.5 534 389 A 675 ILE HB A 676 GLN H 1.0 1.5 3.5 535 390 A 675 ILE HD11 A 676 GLN H 1.0 2.5 6.0 536 391 A 676 GLN H A 675 ILE HG1x 1.0 2.5 6.0 537 391 A 675 ILE HG1y A 676 GLN H 1.0 2.5 6.0 538 392 A 675 ILE HG21 A 676 GLN HA 1.0 2.0 4.5 539 393 A 676 GLN H A 675 ILE HG21 1.0 2.0 4.5 540 394 A 675 ILE H A 676 GLN H 1.0 1.5 3.5 541 395 A 677 THR H A 675 ILE HA 1.0 2.5 6.0 542 396 A 675 ILE H A 677 THR H 1.0 2.5 6.0 543 397 A 675 ILE HA A 678 LEU HBy 1.0 2.0 4.5 544 398 A 675 ILE HA A 678 LEU HBx 1.0 2.0 4.5 545 399 A 675 ILE HA A 678 LEU HD11 1.0 2.0 4.5 546 399 A 678 LEU HD21 A 675 ILE HA 1.0 2.0 4.5 547 400 A 675 ILE HA A 678 LEU H 1.0 2.0 4.5 548 401 A 675 ILE HA A 679 SER H 1.0 2.5 6.0 549 402 A 675 ILE HG21 A 686 LYS HA 1.0 2.0 4.5 550 403 A 675 ILE HG21 A 686 LYS HBy 1.0 1.5 3.5 551 404 A 675 ILE HG21 A 686 LYS HBx 1.0 2.5 6.0 552 405 A 675 ILE HG21 A 686 LYS HEx 1.0 2.0 4.5 553 405 A 675 ILE HG21 A 686 LYS HEy 1.0 2.0 4.5 554 406 A 675 ILE HG21 A 686 LYS HGx 1.0 1.5 3.5 555 406 A 675 ILE HG21 A 686 LYS HGy 1.0 1.5 3.5 556 407 A 675 ILE HG21 A 686 LYS H 1.0 2.5 6.0 557 408 A 675 ILE HA A 689 ILE HD11 1.0 2.5 6.0 558 409 A 689 ILE HG21 A 675 ILE HA 1.0 2.0 4.5 559 410 A 689 ILE HG21 A 675 ILE HD11 1.0 1.5 3.5 560 411 A 675 ILE HG21 A 689 ILE HB 1.0 2.0 4.5 561 412 A 689 ILE HG21 A 675 ILE HG21 1.0 1.5 3.5 562 413 A 675 ILE HG21 A 689 ILE H 1.0 2.5 6.0 563 414 A 675 ILE HD11 A 690 ILE HA 1.0 2.0 4.5 564 415 A 675 ILE HD11 A 690 ILE HG1x 1.0 2.0 4.5 565 415 A 675 ILE HD11 A 690 ILE HG1y 1.0 2.0 4.5 566 416 A 675 ILE HD11 A 690 ILE HG21 1.0 2.0 4.5 567 417 A 675 ILE HD11 A 690 ILE H 1.0 2.5 6.0 568 418 A 675 ILE HG21 A 690 ILE HG1x 1.0 2.0 4.5 569 418 A 675 ILE HG21 A 690 ILE HG1y 1.0 2.0 4.5 570 419 A 693 PHE HD% A 675 ILE HD11 1.0 2.5 6.0 571 420 A 677 THR H A 676 GLN HA 1.0 2.0 4.5 572 421 A 677 THR H A 676 GLN HBx 1.0 1.5 3.5 573 421 A 676 GLN HBy A 677 THR H 1.0 1.5 3.5 574 422 A 677 THR H A 676 GLN HGx 1.0 2.5 6.0 575 422 A 676 GLN HGy A 677 THR H 1.0 2.5 6.0 576 423 A 676 GLN H A 677 THR H 1.0 2.0 4.5 577 424 A 678 LEU H A 676 GLN HA 1.0 2.5 6.0 578 425 A 676 GLN H A 678 LEU H 1.0 2.5 6.0 579 426 A 676 GLN HA A 679 SER H 1.0 2.0 4.5 580 427 A 676 GLN HA A 680 ALA H 1.0 2.0 4.5 581 428 A 676 GLN HA A 686 LYS HDx 1.0 2.0 4.5 582 428 A 676 GLN HA A 686 LYS HDy 1.0 2.0 4.5 583 429 A 676 GLN HA A 686 LYS HEx 1.0 2.0 4.5 584 429 A 676 GLN HA A 686 LYS HEy 1.0 2.0 4.5 585 430 A 676 GLN HA A 686 LYS HGx 1.0 2.0 4.5 586 430 A 676 GLN HA A 686 LYS HGy 1.0 2.0 4.5 587 431 A 676 GLN HE2x A 686 LYS HEx 1.0 2.5 6.0 588 431 A 676 GLN HE2y A 686 LYS HEx 1.0 2.5 6.0 589 431 A 686 LYS HEy A 676 GLN HE2x 1.0 2.5 6.0 590 431 A 676 GLN HE2y A 686 LYS HEy 1.0 2.5 6.0 591 432 A 678 LEU H A 677 THR HA 1.0 2.0 4.5 592 433 A 677 THR HB A 678 LEU H 1.0 2.0 4.5 593 434 A 678 LEU H A 677 THR HG21 1.0 2.0 4.5 594 435 A 677 THR H A 679 SER H 1.0 2.5 6.0 595 436 A 677 THR HA A 680 ALA HB1 1.0 1.5 3.5 596 437 A 680 ALA H A 677 THR HA 1.0 2.0 4.5 597 438 A 677 THR HG21 A 681 GLN HE2x 1.0 2.5 6.0 598 438 A 681 GLN HE2y A 677 THR HG21 1.0 2.5 6.0 599 439 A 679 SER H A 678 LEU HA 1.0 2.0 4.5 600 440 A 678 LEU HBy A 679 SER HA 1.0 2.5 6.0 601 441 A 678 LEU HBy A 679 SER H 1.0 2.0 4.5 602 442 A 679 SER H A 678 LEU HD11 1.0 2.5 6.0 603 442 A 678 LEU HD21 A 679 SER H 1.0 2.5 6.0 604 443 A 678 LEU H A 679 SER H 1.0 1.5 3.5 605 444 A 678 LEU HA A 681 GLN HBx 1.0 1.5 3.5 606 444 A 678 LEU HA A 681 GLN HBy 1.0 1.5 3.5 607 445 A 678 LEU HA A 681 GLN H 1.0 2.0 4.5 608 446 A 678 LEU HA A 682 LEU HD11 1.0 2.0 4.5 609 446 A 682 LEU HD21 A 678 LEU HA 1.0 2.0 4.5 610 447 A 678 LEU HBy A 682 LEU HD11 1.0 2.0 4.5 611 447 A 682 LEU HD21 A 678 LEU HBy 1.0 2.0 4.5 612 448 A 678 LEU HD11 A 682 LEU HD11 1.0 2.0 4.5 613 448 A 678 LEU HD21 A 682 LEU HD11 1.0 2.0 4.5 614 448 A 682 LEU HD21 A 678 LEU HD11 1.0 2.0 4.5 615 448 A 682 LEU HD21 A 678 LEU HD21 1.0 2.0 4.5 616 449 A 678 LEU HBy A 689 ILE HD11 1.0 1.5 3.5 617 450 A 678 LEU HBx A 689 ILE HD11 1.0 2.0 4.5 618 451 A 689 ILE HG21 A 678 LEU HBx 1.0 2.0 4.5 619 452 A 689 ILE HD11 A 678 LEU HD11 1.0 1.5 3.5 620 452 A 678 LEU HD21 A 689 ILE HD11 1.0 1.5 3.5 621 453 A 689 ILE HG21 A 678 LEU HD11 1.0 1.5 3.5 622 453 A 678 LEU HD21 A 689 ILE HG21 1.0 1.5 3.5 623 454 A 693 PHE HE% A 678 LEU HD11 1.0 1.5 3.5 624 454 A 678 LEU HD21 A 693 PHE HE% 1.0 1.5 3.5 625 455 A 693 PHE HZ A 678 LEU HD11 1.0 2.5 6.0 626 455 A 678 LEU HD21 A 693 PHE HZ 1.0 2.5 6.0 627 456 A 693 PHE HZ A 678 LEU HD11 1.0 2.0 4.5 628 457 A 678 LEU HD21 A 693 PHE HZ 1.0 2.0 4.5 629 458 A 680 ALA H A 679 SER HA 1.0 2.0 4.5 630 459 A 680 ALA H A 679 SER HBy 1.0 1.5 3.5 631 459 A 680 ALA H A 679 SER HBx 1.0 1.5 3.5 632 460 A 680 ALA H A 679 SER HBy 1.0 2.0 4.5 633 461 A 680 ALA H A 679 SER HBx 1.0 2.0 4.5 634 462 A 679 SER H A 680 ALA HB1 1.0 2.0 4.5 635 463 A 679 SER H A 680 ALA H 1.0 2.0 4.5 636 464 A 679 SER H A 681 GLN H 1.0 2.5 6.0 637 465 A 679 SER HA A 682 LEU HBx 1.0 2.5 6.0 638 466 A 679 SER HA A 682 LEU HD11 1.0 2.0 4.5 639 466 A 682 LEU HD21 A 679 SER HA 1.0 2.0 4.5 640 467 A 679 SER HA A 682 LEU H 1.0 2.5 6.0 641 468 A 679 SER HA A 683 ASP H 1.0 2.5 6.0 642 469 A 679 SER HA A 684 LEU HA 1.0 2.5 6.0 643 470 A 679 SER HA A 684 LEU HBx 1.0 2.0 4.5 644 471 A 679 SER HA A 684 LEU H 1.0 2.0 4.5 645 472 A 684 LEU H A 679 SER HBy 1.0 2.5 6.0 646 472 A 679 SER HBx A 684 LEU H 1.0 2.5 6.0 647 473 A 686 LYS HA A 679 SER HBy 1.0 2.0 4.5 648 473 A 686 LYS HA A 679 SER HBx 1.0 2.0 4.5 649 474 A 679 SER HBy A 686 LYS HGx 1.0 2.5 6.0 650 474 A 679 SER HBx A 686 LYS HGx 1.0 2.5 6.0 651 474 A 686 LYS HGy A 679 SER HBy 1.0 2.5 6.0 652 474 A 686 LYS HGy A 679 SER HBx 1.0 2.5 6.0 653 475 A 689 ILE HD11 A 679 SER HA 1.0 1.5 3.5 654 476 A 679 SER HA A 689 ILE HG1x 1.0 2.5 6.0 655 476 A 679 SER HA A 689 ILE HG1y 1.0 2.5 6.0 656 477 A 689 ILE HD11 A 679 SER HBy 1.0 2.0 4.5 657 478 A 689 ILE HD11 A 679 SER HBx 1.0 2.0 4.5 658 479 A 679 SER H A 689 ILE HD11 1.0 2.0 4.5 659 480 A 681 GLN H A 680 ALA HA 1.0 2.0 4.5 660 481 A 680 ALA HB1 A 681 GLN H 1.0 1.5 3.5 661 482 A 680 ALA H A 681 GLN H 1.0 1.5 3.5 662 483 A 680 ALA H A 682 LEU H 1.0 2.5 6.0 663 484 A 682 LEU H A 681 GLN HA 1.0 2.0 4.5 664 485 A 681 GLN HBy A 682 LEU HD11 1.0 2.5 6.0 665 485 A 681 GLN HBx A 682 LEU HD11 1.0 2.5 6.0 666 485 A 682 LEU HD21 A 681 GLN HBx 1.0 2.5 6.0 667 485 A 682 LEU HD21 A 681 GLN HBy 1.0 2.5 6.0 668 486 A 682 LEU HG A 681 GLN HBx 1.0 2.0 4.5 669 486 A 681 GLN HBy A 682 LEU HG 1.0 2.0 4.5 670 487 A 682 LEU H A 681 GLN HBx 1.0 1.5 3.5 671 487 A 681 GLN HBy A 682 LEU H 1.0 1.5 3.5 672 488 A 681 GLN H A 682 LEU H 1.0 1.5 3.5 673 489 A 681 GLN H A 683 ASP H 1.0 2.5 6.0 674 490 A 683 ASP H A 682 LEU HA 1.0 2.0 4.5 675 491 A 683 ASP H A 682 LEU HBy 1.0 2.5 6.0 676 492 A 682 LEU HBx A 683 ASP H 1.0 2.0 4.5 677 493 A 683 ASP H A 682 LEU HD11 1.0 2.5 6.0 678 494 A 682 LEU HD21 A 683 ASP H 1.0 2.5 6.0 679 495 A 682 LEU H A 683 ASP H 1.0 1.5 3.5 680 496 A 684 LEU H A 682 LEU HBy 1.0 2.5 6.0 681 497 A 682 LEU HBx A 684 LEU HBx 1.0 1.5 3.5 682 498 A 682 LEU H A 684 LEU H 1.0 2.5 6.0 683 499 A 689 ILE HG21 A 682 LEU HD11 1.0 2.0 4.5 684 499 A 682 LEU HD21 A 689 ILE HG21 1.0 2.0 4.5 685 500 A 684 LEU H A 683 ASP HA 1.0 1.5 3.5 686 501 A 684 LEU H A 683 ASP HBy 1.0 2.5 6.0 687 502 A 684 LEU H A 683 ASP HBx 1.0 2.5 6.0 688 503 A 683 ASP H A 684 LEU HA 1.0 2.5 6.0 689 504 A 683 ASP H A 684 LEU H 1.0 1.5 3.5 690 505 A 684 LEU HA A 685 PRO HBy 1.0 2.5 6.0 691 505 A 684 LEU HA A 685 PRO HBx 1.0 2.5 6.0 692 506 A 684 LEU HA A 685 PRO HDy 1.0 1.5 3.5 693 507 A 684 LEU HA A 685 PRO HDx 1.0 1.5 3.5 694 508 A 684 LEU HA A 685 PRO HGx 1.0 2.0 4.5 695 508 A 684 LEU HA A 685 PRO HGy 1.0 2.0 4.5 696 509 A 684 LEU HBy A 685 PRO HDx 1.0 2.5 6.0 697 509 A 684 LEU HBy A 685 PRO HDy 1.0 2.5 6.0 698 510 A 684 LEU HBy A 685 PRO HDy 1.0 2.0 4.5 699 511 A 684 LEU HBy A 685 PRO HDx 1.0 2.0 4.5 700 512 A 684 LEU HD11 A 685 PRO HDx 1.0 1.5 3.5 701 512 A 684 LEU HD21 A 685 PRO HDx 1.0 1.5 3.5 702 512 A 685 PRO HDy A 684 LEU HD11 1.0 1.5 3.5 703 512 A 684 LEU HD21 A 685 PRO HDy 1.0 1.5 3.5 704 513 A 684 LEU HG A 685 PRO HDx 1.0 2.5 6.0 705 513 A 685 PRO HDy A 684 LEU HG 1.0 2.5 6.0 706 514 A 684 LEU H A 685 PRO HDx 1.0 2.5 6.0 707 514 A 684 LEU H A 685 PRO HDy 1.0 2.5 6.0 708 515 A 684 LEU HA A 688 THR HB 1.0 2.5 6.0 709 516 A 684 LEU HBy A 688 THR HB 1.0 2.0 4.5 710 517 A 688 THR HG21 A 684 LEU HD11 1.0 1.5 3.5 711 517 A 684 LEU HD21 A 688 THR HG21 1.0 1.5 3.5 712 518 A 688 THR HG21 A 684 LEU HD11 1.0 1.5 3.5 713 519 A 684 LEU HD21 A 688 THR HG21 1.0 1.5 3.5 714 520 A 689 ILE HD11 A 684 LEU H 1.0 2.5 6.0 715 521 A 686 LYS HA A 685 PRO HA 1.0 2.0 4.5 716 522 A 686 LYS H A 685 PRO HA 1.0 1.5 3.5 717 523 A 686 LYS H A 685 PRO HBy 1.0 2.0 4.5 718 524 A 686 LYS H A 685 PRO HDx 1.0 2.5 6.0 719 524 A 686 LYS H A 685 PRO HDy 1.0 2.5 6.0 720 525 A 686 LYS H A 685 PRO HBx 1.0 2.0 4.5 721 526 A 686 LYS H A 685 PRO HGx 1.0 2.5 6.0 722 526 A 686 LYS H A 685 PRO HGy 1.0 2.5 6.0 723 527 A 687 TYR HD% A 685 PRO HBy 1.0 2.5 6.0 724 527 A 685 PRO HBx A 687 TYR HD% 1.0 2.5 6.0 725 528 A 687 TYR HE% A 685 PRO HBy 1.0 2.5 6.0 726 528 A 685 PRO HBx A 687 TYR HE% 1.0 2.5 6.0 727 529 A 687 TYR H A 685 PRO HBy 1.0 2.0 4.5 728 529 A 685 PRO HBx A 687 TYR H 1.0 2.0 4.5 729 530 A 687 TYR HE% A 685 PRO HDx 1.0 2.5 6.0 730 530 A 685 PRO HDy A 687 TYR HE% 1.0 2.5 6.0 731 531 A 687 TYR HD% A 685 PRO HGx 1.0 2.5 6.0 732 531 A 685 PRO HGy A 687 TYR HD% 1.0 2.5 6.0 733 532 A 687 TYR HE% A 685 PRO HGx 1.0 2.0 4.5 734 532 A 685 PRO HGy A 687 TYR HE% 1.0 2.0 4.5 735 533 A 685 PRO HA A 688 THR H 1.0 2.5 6.0 736 534 A 688 THR H A 685 PRO HBy 1.0 2.0 4.5 737 534 A 685 PRO HBx A 688 THR H 1.0 2.0 4.5 738 535 A 688 THR HB A 685 PRO HDx 1.0 2.0 4.5 739 535 A 685 PRO HDy A 688 THR HB 1.0 2.0 4.5 740 536 A 688 THR H A 685 PRO HDx 1.0 2.5 6.0 741 536 A 685 PRO HDy A 688 THR H 1.0 2.5 6.0 742 537 A 688 THR H A 685 PRO HGx 1.0 2.5 6.0 743 537 A 685 PRO HGy A 688 THR H 1.0 2.5 6.0 744 538 A 686 LYS HA A 687 TYR H 1.0 2.0 4.5 745 539 A 686 LYS HBy A 687 TYR H 1.0 1.5 3.5 746 540 A 686 LYS HBx A 687 TYR H 1.0 2.0 4.5 747 541 A 686 LYS H A 687 TYR HD% 1.0 2.5 6.0 748 542 A 686 LYS H A 687 TYR H 1.0 2.0 4.5 749 543 A 686 LYS HA A 688 THR H 1.0 2.5 6.0 750 544 A 686 LYS H A 688 THR H 1.0 2.5 6.0 751 545 A 686 LYS HA A 689 ILE HB 1.0 2.0 4.5 752 546 A 686 LYS HA A 689 ILE HD11 1.0 2.0 4.5 753 547 A 686 LYS HA A 689 ILE HG1x 1.0 2.0 4.5 754 547 A 686 LYS HA A 689 ILE HG1y 1.0 2.0 4.5 755 548 A 686 LYS HA A 689 ILE H 1.0 2.0 4.5 756 549 A 686 LYS HBy A 690 ILE HD11 1.0 1.5 3.5 757 550 A 688 THR H A 687 TYR HA 1.0 2.0 4.5 758 551 A 688 THR H A 687 TYR HBx 1.0 2.0 4.5 759 551 A 688 THR H A 687 TYR HBy 1.0 2.0 4.5 760 552 A 687 TYR HD% A 688 THR HA 1.0 2.0 4.5 761 553 A 687 TYR HD% A 688 THR H 1.0 2.0 4.5 762 554 A 687 TYR H A 688 THR H 1.0 2.0 4.5 763 555 A 689 ILE H A 687 TYR HA 1.0 2.5 6.0 764 556 A 689 ILE H A 687 TYR H 1.0 2.5 6.0 765 557 A 687 TYR HA A 690 ILE HB 1.0 1.5 3.5 766 558 A 690 ILE HD11 A 687 TYR HA 1.0 1.5 3.5 767 559 A 687 TYR HA A 690 ILE HG1x 1.0 2.0 4.5 768 559 A 690 ILE HG1y A 687 TYR HA 1.0 2.0 4.5 769 560 A 690 ILE HG21 A 687 TYR HA 1.0 2.0 4.5 770 561 A 690 ILE H A 687 TYR HA 1.0 2.0 4.5 771 562 A 690 ILE HB A 687 TYR HBx 1.0 2.5 6.0 772 562 A 687 TYR HBy A 690 ILE HB 1.0 2.5 6.0 773 563 A 690 ILE HD11 A 687 TYR HBx 1.0 2.5 6.0 774 563 A 690 ILE HD11 A 687 TYR HBy 1.0 2.5 6.0 775 564 A 687 TYR HD% A 690 ILE HB 1.0 2.5 6.0 776 565 A 687 TYR HD% A 690 ILE HG1x 1.0 2.5 6.0 777 565 A 690 ILE HG1y A 687 TYR HD% 1.0 2.5 6.0 778 566 A 687 TYR H A 690 ILE HD11 1.0 2.5 6.0 779 567 A 690 ILE H A 687 TYR H 1.0 2.5 6.0 780 568 A 687 TYR HA A 691 LYS H 1.0 2.0 4.5 781 569 A 687 TYR HE% A 691 LYS HDx 1.0 2.0 4.5 782 569 A 687 TYR HE% A 691 LYS HDy 1.0 2.0 4.5 783 570 A 689 ILE H A 688 THR HA 1.0 2.5 6.0 784 571 A 688 THR HB A 689 ILE HA 1.0 2.5 6.0 785 572 A 688 THR HB A 689 ILE HG1x 1.0 2.0 4.5 786 572 A 689 ILE HG1y A 688 THR HB 1.0 2.0 4.5 787 573 A 689 ILE H A 688 THR HB 1.0 2.0 4.5 788 574 A 688 THR HG21 A 689 ILE HA 1.0 2.5 6.0 789 575 A 688 THR HG21 A 689 ILE H 1.0 2.0 4.5 790 576 A 688 THR H A 689 ILE HA 1.0 2.5 6.0 791 577 A 689 ILE HB A 688 THR H 1.0 2.5 6.0 792 578 A 689 ILE HD11 A 688 THR H 1.0 2.5 6.0 793 579 A 689 ILE H A 688 THR H 1.0 2.0 4.5 794 580 A 690 ILE H A 688 THR HA 1.0 2.5 6.0 795 581 A 690 ILE H A 688 THR H 1.0 2.5 6.0 796 582 A 688 THR HA A 691 LYS HBy 1.0 2.0 4.5 797 583 A 688 THR HA A 691 LYS HBx 1.0 2.0 4.5 798 584 A 688 THR HA A 691 LYS H 1.0 2.0 4.5 799 585 A 692 PHE H A 688 THR HA 1.0 2.5 6.0 800 586 A 688 THR HG21 A 692 PHE HD% 1.0 2.5 6.0 801 587 A 690 ILE H A 689 ILE HA 1.0 2.5 6.0 802 588 A 689 ILE HB A 690 ILE HA 1.0 2.5 6.0 803 589 A 689 ILE HB A 690 ILE HG1x 1.0 2.0 4.5 804 589 A 689 ILE HB A 690 ILE HG1y 1.0 2.0 4.5 805 590 A 689 ILE HB A 690 ILE H 1.0 2.0 4.5 806 591 A 690 ILE H A 689 ILE HG1x 1.0 2.5 6.0 807 591 A 690 ILE H A 689 ILE HG1y 1.0 2.5 6.0 808 592 A 689 ILE HG21 A 690 ILE HA 1.0 2.0 4.5 809 593 A 689 ILE HG21 A 690 ILE H 1.0 2.0 4.5 810 594 A 689 ILE H A 690 ILE H 1.0 2.0 4.5 811 595 A 691 LYS H A 689 ILE HA 1.0 2.5 6.0 812 596 A 689 ILE H A 691 LYS H 1.0 2.5 6.0 813 597 A 689 ILE HA A 692 PHE HA 1.0 2.5 6.0 814 598 A 692 PHE HBy A 689 ILE HA 1.0 2.0 4.5 815 599 A 692 PHE HBx A 689 ILE HA 1.0 2.0 4.5 816 600 A 692 PHE HD% A 689 ILE HA 1.0 2.0 4.5 817 601 A 692 PHE H A 689 ILE HA 1.0 2.0 4.5 818 602 A 692 PHE HD% A 689 ILE HG21 1.0 2.5 6.0 819 603 A 693 PHE HD% A 689 ILE HA 1.0 2.5 6.0 820 604 A 693 PHE HE% A 689 ILE HA 1.0 2.5 6.0 821 605 A 689 ILE HA A 693 PHE H 1.0 2.5 6.0 822 606 A 693 PHE HD% A 689 ILE HD11 1.0 2.5 6.0 823 607 A 693 PHE HE% A 689 ILE HD11 1.0 2.0 4.5 824 608 A 689 ILE HG21 A 693 PHE HD% 1.0 1.5 3.5 825 609 A 689 ILE HG21 A 693 PHE HE% 1.0 1.5 3.5 826 610 A 689 ILE HG21 A 693 PHE HZ 1.0 2.5 6.0 827 611 A 690 ILE HA A 691 LYS H 1.0 2.0 4.5 828 612 A 690 ILE HB A 691 LYS H 1.0 1.5 3.5 829 613 A 690 ILE HG21 A 691 LYS H 1.0 2.0 4.5 830 614 A 690 ILE H A 691 LYS H 1.0 2.0 4.5 831 615 A 692 PHE H A 690 ILE HA 1.0 2.0 4.5 832 616 A 692 PHE H A 690 ILE H 1.0 2.5 6.0 833 617 A 690 ILE HA A 693 PHE HBx 1.0 2.0 4.5 834 618 A 690 ILE HA A 694 GLN H 1.0 2.0 4.5 835 619 A 690 ILE HG21 A 694 GLN HE2x 1.0 2.0 4.5 836 619 A 690 ILE HG21 A 694 GLN HE2y 1.0 2.0 4.5 837 620 A 692 PHE H A 691 LYS HA 1.0 2.0 4.5 838 621 A 692 PHE H A 691 LYS HBy 1.0 2.0 4.5 839 622 A 692 PHE H A 691 LYS HBx 1.0 2.0 4.5 840 623 A 692 PHE HBy A 691 LYS H 1.0 2.5 6.0 841 624 A 692 PHE HBx A 691 LYS H 1.0 2.5 6.0 842 625 A 692 PHE H A 691 LYS H 1.0 2.0 4.5 843 626 A 691 LYS HA A 694 GLN HBx 1.0 2.0 4.5 844 626 A 691 LYS HA A 694 GLN HBy 1.0 2.0 4.5 845 627 A 691 LYS HA A 694 GLN HGx 1.0 2.5 6.0 846 627 A 691 LYS HA A 694 GLN HGy 1.0 2.5 6.0 847 628 A 691 LYS HA A 694 GLN HGy 1.0 2.5 6.0 848 629 A 691 LYS HA A 694 GLN HGx 1.0 2.5 6.0 849 630 A 694 GLN H A 691 LYS HA 1.0 2.0 4.5 850 631 A 691 LYS HA A 695 ASN H 1.0 2.0 4.5 851 632 A 692 PHE HA A 693 PHE H 1.0 2.0 4.5 852 633 A 692 PHE HBy A 693 PHE HD% 1.0 2.5 6.0 853 634 A 692 PHE HBy A 693 PHE H 1.0 2.0 4.5 854 635 A 692 PHE HBx A 693 PHE H 1.0 2.0 4.5 855 636 A 692 PHE HD% A 693 PHE HA 1.0 2.0 4.5 856 637 A 692 PHE HD% A 693 PHE HD% 1.0 2.0 4.5 857 638 A 692 PHE HD% A 693 PHE H 1.0 2.0 4.5 858 639 A 692 PHE HD% A 693 PHE HZ 1.0 2.5 6.0 859 640 A 692 PHE HE% A 693 PHE HE% 1.0 2.5 6.0 860 641 A 692 PHE H A 693 PHE H 1.0 2.0 4.5 861 642 A 692 PHE HA A 694 GLN H 1.0 2.5 6.0 862 643 A 692 PHE HBy A 694 GLN H 1.0 2.5 6.0 863 644 A 692 PHE HA A 695 ASN HBy 1.0 2.0 4.5 864 645 A 692 PHE HA A 695 ASN HBx 1.0 2.0 4.5 865 646 A 692 PHE HA A 695 ASN HD2y 1.0 2.5 6.0 866 646 A 692 PHE HA A 695 ASN HD2x 1.0 2.5 6.0 867 647 A 692 PHE HA A 695 ASN H 1.0 2.5 6.0 868 648 A 692 PHE HA A 696 GLN H 1.0 2.5 6.0 869 649 A 692 PHE HD% A 696 GLN HE2x 1.0 2.0 4.5 870 649 A 692 PHE HD% A 696 GLN HE2y 1.0 2.0 4.5 871 650 A 692 PHE HD% A 696 GLN HGx 1.0 2.0 4.5 872 650 A 692 PHE HD% A 696 GLN HGy 1.0 2.0 4.5 873 651 A 692 PHE HD% A 696 GLN H 1.0 2.5 6.0 874 652 A 692 PHE HE% A 696 GLN HE2x 1.0 2.0 4.5 875 652 A 692 PHE HE% A 696 GLN HE2y 1.0 2.0 4.5 876 653 A 692 PHE HE% A 696 GLN HGx 1.0 2.5 6.0 877 653 A 692 PHE HE% A 696 GLN HGy 1.0 2.5 6.0 878 654 A 692 PHE HZ A 696 GLN HE2x 1.0 2.0 4.5 879 654 A 692 PHE HZ A 696 GLN HE2y 1.0 2.0 4.5 880 655 A 694 GLN H A 693 PHE HA 1.0 2.0 4.5 881 656 A 694 GLN H A 693 PHE HBy 1.0 2.0 4.5 882 657 A 693 PHE HBx A 694 GLN H 1.0 2.0 4.5 883 658 A 693 PHE HD% A 694 GLN H 1.0 2.5 6.0 884 659 A 693 PHE H A 694 GLN H 1.0 2.0 4.5 885 660 A 693 PHE H A 695 ASN H 1.0 2.5 6.0 886 661 A 696 GLN HBy A 693 PHE HA 1.0 2.5 6.0 887 662 A 693 PHE HA A 696 GLN HGx 1.0 1.5 3.5 888 662 A 693 PHE HA A 696 GLN HGy 1.0 1.5 3.5 889 663 A 693 PHE HA A 696 GLN H 1.0 2.0 4.5 890 664 A 693 PHE HA A 697 ARG H 1.0 2.5 6.0 891 665 A 695 ASN H A 694 GLN HA 1.0 2.0 4.5 892 666 A 695 ASN H A 694 GLN HBx 1.0 2.0 4.5 893 666 A 694 GLN HBy A 695 ASN H 1.0 2.0 4.5 894 667 A 694 GLN H A 695 ASN HBx 1.0 2.5 6.0 895 668 A 694 GLN H A 696 GLN H 1.0 2.5 6.0 896 669 A 694 GLN HA A 697 ARG HBy 1.0 2.5 6.0 897 670 A 694 GLN HA A 697 ARG HDx 1.0 2.5 6.0 898 670 A 694 GLN HA A 697 ARG HDy 1.0 2.5 6.0 899 671 A 697 ARG H A 694 GLN HA 1.0 2.0 4.5 900 672 A 694 GLN HA A 698 TYR H 1.0 2.5 6.0 901 673 A 696 GLN H A 695 ASN HA 1.0 2.0 4.5 902 674 A 695 ASN HBy A 696 GLN H 1.0 2.0 4.5 903 675 A 695 ASN HBx A 696 GLN H 1.0 2.0 4.5 904 676 A 695 ASN H A 696 GLN H 1.0 2.0 4.5 905 677 A 697 ARG H A 695 ASN HA 1.0 2.5 6.0 906 678 A 695 ASN H A 697 ARG H 1.0 2.5 6.0 907 679 A 695 ASN HA A 698 TYR HBx 1.0 1.5 3.5 908 679 A 695 ASN HA A 698 TYR HBy 1.0 1.5 3.5 909 680 A 695 ASN HA A 698 TYR HD% 1.0 2.5 6.0 910 681 A 698 TYR H A 695 ASN HA 1.0 2.0 4.5 911 682 A 695 ASN HA A 699 TYR H 1.0 2.5 6.0 912 683 A 697 ARG H A 696 GLN HA 1.0 2.0 4.5 913 684 A 696 GLN HBx A 697 ARG HA 1.0 2.5 6.0 914 685 A 696 GLN HBx A 697 ARG H 1.0 2.0 4.5 915 686 A 696 GLN H A 697 ARG H 1.0 2.0 4.5 916 687 A 696 GLN H A 698 TYR H 1.0 2.0 4.5 917 688 A 696 GLN HA A 699 TYR HBx 1.0 1.5 3.5 918 688 A 696 GLN HA A 699 TYR HBy 1.0 1.5 3.5 919 689 A 696 GLN HA A 699 TYR HD% 1.0 2.0 4.5 920 690 A 699 TYR H A 696 GLN HA 1.0 2.0 4.5 921 691 A 696 GLN HE2y A 700 LEU HD11 1.0 2.5 6.0 922 691 A 696 GLN HE2x A 700 LEU HD11 1.0 2.5 6.0 923 691 A 700 LEU HD21 A 696 GLN HE2x 1.0 2.5 6.0 924 691 A 696 GLN HE2y A 700 LEU HD21 1.0 2.5 6.0 925 692 A 698 TYR H A 697 ARG HA 1.0 2.0 4.5 926 693 A 698 TYR H A 697 ARG HBx 1.0 2.0 4.5 927 694 A 698 TYR HD% A 697 ARG HDx 1.0 2.5 6.0 928 694 A 697 ARG HDy A 698 TYR HD% 1.0 2.5 6.0 929 695 A 697 ARG H A 698 TYR HBx 1.0 2.5 6.0 930 695 A 697 ARG H A 698 TYR HBy 1.0 2.5 6.0 931 696 A 697 ARG H A 698 TYR H 1.0 2.0 4.5 932 697 A 697 ARG HA A 700 LEU HBx 1.0 2.0 4.5 933 697 A 697 ARG HA A 700 LEU HBy 1.0 2.0 4.5 934 698 A 697 ARG HA A 700 LEU HD11 1.0 1.5 3.5 935 698 A 697 ARG HA A 700 LEU HD21 1.0 1.5 3.5 936 699 A 697 ARG HA A 700 LEU H 1.0 2.0 4.5 937 700 A 698 TYR HD% A 699 TYR H 1.0 2.0 4.5 938 701 A 698 TYR H A 699 TYR H 1.0 2.0 4.5 939 702 A 698 TYR H A 700 LEU H 1.0 2.5 6.0 940 703 A 698 TYR HA A 701 LYS HBx 1.0 2.0 4.5 941 703 A 698 TYR HA A 701 LYS HBy 1.0 2.0 4.5 942 704 A 698 TYR HA A 701 LYS H 1.0 2.0 4.5 943 705 A 698 TYR HA A 702 HIS HD2 1.0 2.0 4.5 944 706 A 698 TYR HA A 702 HIS H 1.0 2.5 6.0 945 707 A 698 TYR HD% A 702 HIS HE1 1.0 2.5 6.0 946 708 A 700 LEU H A 699 TYR HA 1.0 2.0 4.5 947 709 A 700 LEU H A 699 TYR HBx 1.0 1.5 3.5 948 709 A 699 TYR HBy A 700 LEU H 1.0 1.5 3.5 949 710 A 699 TYR HD% A 700 LEU HA 1.0 2.0 4.5 950 711 A 699 TYR HD% A 700 LEU HD11 1.0 1.5 3.5 951 711 A 699 TYR HD% A 700 LEU HD21 1.0 1.5 3.5 952 712 A 699 TYR HD% A 700 LEU HG 1.0 2.0 4.5 953 713 A 699 TYR HD% A 700 LEU H 1.0 2.0 4.5 954 714 A 700 LEU HA A 699 TYR HE% 1.0 2.5 6.0 955 715 A 699 TYR HE% A 700 LEU HD11 1.0 2.0 4.5 956 715 A 700 LEU HD21 A 699 TYR HE% 1.0 2.0 4.5 957 716 A 700 LEU HG A 699 TYR HE% 1.0 2.5 6.0 958 717 A 699 TYR H A 700 LEU H 1.0 2.0 4.5 959 718 A 699 TYR H A 701 LYS H 1.0 2.5 6.0 960 719 A 702 HIS H A 699 TYR HA 1.0 2.0 4.5 961 720 A 699 TYR HA A 703 HIS HD2 1.0 2.0 4.5 962 721 A 699 TYR HD% A 703 HIS HBx 1.0 2.5 6.0 963 721 A 699 TYR HD% A 703 HIS HBy 1.0 2.5 6.0 964 722 A 699 TYR HD% A 703 HIS HD2 1.0 2.0 4.5 965 723 A 699 TYR HE% A 703 HIS HBx 1.0 2.5 6.0 966 723 A 699 TYR HE% A 703 HIS HBy 1.0 2.5 6.0 967 724 A 699 TYR HD% A 706 LEU HA 1.0 2.5 6.0 968 725 A 699 TYR HD% A 706 LEU HD11 1.0 2.0 4.5 969 725 A 699 TYR HD% A 706 LEU HD21 1.0 2.0 4.5 970 726 A 699 TYR HE% A 706 LEU HD11 1.0 2.5 6.0 971 726 A 699 TYR HE% A 706 LEU HD21 1.0 2.5 6.0 972 727 A 701 LYS H A 700 LEU HBx 1.0 2.0 4.5 973 727 A 700 LEU HBy A 701 LYS H 1.0 2.0 4.5 974 728 A 700 LEU H A 701 LYS H 1.0 1.5 3.5 975 729 A 700 LEU H A 702 HIS H 1.0 2.5 6.0 976 730 A 702 HIS H A 701 LYS HA 1.0 2.0 4.5 977 731 A 702 HIS HD2 A 701 LYS HBx 1.0 2.0 4.5 978 731 A 701 LYS HBy A 702 HIS HD2 1.0 2.0 4.5 979 732 A 702 HIS H A 701 LYS HBx 1.0 2.0 4.5 980 732 A 701 LYS HBy A 702 HIS H 1.0 2.0 4.5 981 733 A 702 HIS HD2 A 701 LYS HGx 1.0 2.5 6.0 982 733 A 702 HIS HD2 A 701 LYS HGy 1.0 2.5 6.0 983 734 A 701 LYS H A 702 HIS HBx 1.0 2.5 6.0 984 735 A 701 LYS H A 702 HIS H 1.0 1.5 3.5 985 736 A 702 HIS HA A 703 HIS H 1.0 2.5 6.0 986 737 A 703 HIS HD2 A 702 HIS HBy 1.0 2.5 6.0 987 738 A 703 HIS HA A 704 GLY H 1.0 2.0 4.5 988 739 A 705 LYS H A 704 GLY HAx 1.0 1.5 3.5 989 739 A 704 GLY HAy A 705 LYS H 1.0 1.5 3.5 990 740 A 704 GLY H A 705 LYS H 1.0 2.5 6.0 991 741 A 705 LYS HA A 706 LEU H 1.0 1.5 2.8 992 742 A 706 LEU H A 705 LYS HBy 1.0 2.0 4.5 993 743 A 706 LEU H A 705 LYS HBx 1.0 2.0 4.5 994 744 A 705 LYS H A 706 LEU H 1.0 2.0 4.5 995 745 A 706 LEU HA A 707 LYS H 1.0 1.5 3.5 996 746 A 707 LYS H A 706 LEU HBx 1.0 1.5 3.5 997 746 A 707 LYS H A 706 LEU HBy 1.0 1.5 3.5 998 747 A 707 LYS H A 706 LEU HD11 1.0 2.5 6.0 999 748 A 706 LEU HD21 A 707 LYS H 1.0 2.5 6.0 1000 749 A 706 LEU H A 707 LYS H 1.0 2.5 6.0 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 655 ALA N A 652 SER O 1.0 2.5 3.5 2 2 A 655 ALA H A 652 SER O 1.0 1.5 2.5 3 3 A 652 SER O A 656 LEU N 1.0 2.5 3.5 4 4 A 656 LEU H A 652 SER O 1.0 1.5 2.5 5 5 A 657 GLY N A 653 VAL O 1.0 2.5 3.5 6 6 A 657 GLY H A 653 VAL O 1.0 1.5 2.5 7 7 A 658 ILE N A 654 GLU O 1.0 2.5 3.5 8 8 A 658 ILE H A 654 GLU O 1.0 1.5 2.5 9 9 A 659 LEU N A 655 ALA O 1.0 2.5 3.5 10 10 A 659 LEU H A 655 ALA O 1.0 1.5 2.5 11 11 A 660 GLN N A 656 LEU O 1.0 2.5 3.5 12 12 A 660 GLN H A 656 LEU O 1.0 1.5 2.5 13 13 A 661 SER N A 657 GLY O 1.0 2.5 3.5 14 14 A 661 SER H A 657 GLY O 1.0 1.5 2.5 15 15 A 662 PHE N A 658 ILE O 1.0 2.5 3.5 16 16 A 662 PHE H A 658 ILE O 1.0 1.5 2.5 17 17 A 663 ILE N A 659 LEU O 1.0 2.5 3.5 18 18 A 663 ILE H A 659 LEU O 1.0 1.5 2.5 19 19 A 664 GLN N A 660 GLN O 1.0 2.5 3.5 20 20 A 664 GLN H A 660 GLN O 1.0 1.5 2.5 21 21 A 665 ASP N A 661 SER O 1.0 2.5 3.5 22 22 A 665 ASP H A 661 SER O 1.0 1.5 2.5 23 23 A 666 VAL N A 662 PHE O 1.0 2.5 3.5 24 24 A 666 VAL H A 662 PHE O 1.0 1.5 2.5 25 25 A 662 PHE O A 667 GLY N 1.0 2.5 3.5 26 26 A 667 GLY H A 662 PHE O 1.0 1.5 2.5 27 27 A 674 ALA N A 671 ASP O 1.0 2.5 3.5 28 28 A 674 ALA H A 671 ASP O 1.0 1.5 2.5 29 29 A 671 ASP O A 675 ILE N 1.0 2.5 3.5 30 30 A 675 ILE H A 671 ASP O 1.0 1.5 2.5 31 31 A 676 GLN N A 672 GLU O 1.0 2.5 3.5 32 32 A 676 GLN H A 672 GLU O 1.0 1.5 2.5 33 33 A 677 THR N A 673 GLU O 1.0 2.5 3.5 34 34 A 677 THR H A 673 GLU O 1.0 1.5 2.5 35 35 A 678 LEU N A 674 ALA O 1.0 2.5 3.5 36 36 A 678 LEU H A 674 ALA O 1.0 1.5 2.5 37 37 A 679 SER N A 675 ILE O 1.0 2.5 3.5 38 38 A 679 SER H A 675 ILE O 1.0 1.5 2.5 39 39 A 680 ALA N A 676 GLN O 1.0 2.5 3.5 40 40 A 680 ALA H A 676 GLN O 1.0 1.5 2.5 41 41 A 681 GLN N A 677 THR O 1.0 2.5 3.5 42 42 A 681 GLN H A 677 THR O 1.0 1.5 2.5 43 43 A 682 LEU N A 678 LEU O 1.0 2.5 3.5 44 44 A 682 LEU H A 678 LEU O 1.0 1.5 2.5 45 45 A 683 ASP N A 679 SER O 1.0 2.5 3.5 46 46 A 683 ASP H A 679 SER O 1.0 1.5 2.5 47 47 A 679 SER O A 684 LEU N 1.0 2.5 3.5 48 48 A 684 LEU H A 679 SER O 1.0 1.5 2.5 49 49 A 689 ILE N A 686 LYS O 1.0 2.5 3.5 50 50 A 689 ILE H A 686 LYS O 1.0 1.5 2.5 51 51 A 686 LYS O A 690 ILE N 1.0 2.5 3.5 52 52 A 690 ILE H A 686 LYS O 1.0 1.5 2.5 53 53 A 691 LYS N A 687 TYR O 1.0 2.5 3.5 54 54 A 691 LYS H A 687 TYR O 1.0 1.5 2.5 55 55 A 692 PHE N A 688 THR O 1.0 2.5 3.5 56 56 A 692 PHE H A 688 THR O 1.0 1.5 2.5 57 57 A 693 PHE N A 689 ILE O 1.0 2.5 3.5 58 58 A 693 PHE H A 689 ILE O 1.0 1.5 2.5 59 59 A 694 GLN N A 690 ILE O 1.0 2.5 3.5 60 60 A 694 GLN H A 690 ILE O 1.0 1.5 2.5 61 61 A 695 ASN N A 691 LYS O 1.0 2.5 3.5 62 62 A 695 ASN H A 691 LYS O 1.0 1.5 2.5 63 63 A 696 GLN N A 692 PHE O 1.0 2.5 3.5 64 64 A 696 GLN H A 692 PHE O 1.0 1.5 2.5 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 652 SER C A 653 VAL N A 653 VAL CA A 653 VAL C 1.0 -100.0 -30.0 PHI 2 2 A 653 VAL C A 654 GLU N A 654 GLU CA A 654 GLU C 1.0 -100.0 -30.0 PHI 3 3 A 654 GLU C A 655 ALA N A 655 ALA CA A 655 ALA C 1.0 -100.0 -30.0 PHI 4 4 A 655 ALA C A 656 LEU N A 656 LEU CA A 656 LEU C 1.0 -100.0 -30.0 PHI 5 5 A 657 GLY C A 658 ILE N A 658 ILE CA A 658 ILE C 1.0 -100.0 -30.0 PHI 6 6 A 658 ILE C A 659 LEU N A 659 LEU CA A 659 LEU C 1.0 -100.0 -30.0 PHI 7 7 A 659 LEU C A 660 GLN N A 660 GLN CA A 660 GLN C 1.0 -100.0 -30.0 PHI 8 8 A 660 GLN C A 661 SER N A 661 SER CA A 661 SER C 1.0 -100.0 -30.0 PHI 9 9 A 661 SER C A 662 PHE N A 662 PHE CA A 662 PHE C 1.0 -100.0 -30.0 PHI 10 10 A 662 PHE C A 663 ILE N A 663 ILE CA A 663 ILE C 1.0 -100.0 -30.0 PHI 11 11 A 663 ILE C A 664 GLN N A 664 GLN CA A 664 GLN C 1.0 -100.0 -30.0 PHI 12 12 A 665 ASP C A 666 VAL N A 666 VAL CA A 666 VAL C 1.0 -170.0 -70.0 PHI 13 13 A 668 LEU C A 669 TYR N A 669 TYR CA A 669 TYR C 1.0 -170.0 -70.0 PHI 14 14 A 670 PRO C A 671 ASP N A 671 ASP CA A 671 ASP C 1.0 -170.0 -70.0 PHI 15 15 A 671 ASP C A 672 GLU N A 672 GLU CA A 672 GLU C 1.0 -100.0 -30.0 PHI 16 16 A 672 GLU C A 673 GLU N A 673 GLU CA A 673 GLU C 1.0 -100.0 -30.0 PHI 17 17 A 673 GLU C A 674 ALA N A 674 ALA CA A 674 ALA C 1.0 -100.0 -30.0 PHI 18 18 A 674 ALA C A 675 ILE N A 675 ILE CA A 675 ILE C 1.0 -100.0 -30.0 PHI 19 19 A 675 ILE C A 676 GLN N A 676 GLN CA A 676 GLN C 1.0 -100.0 -30.0 PHI 20 20 A 676 GLN C A 677 THR N A 677 THR CA A 677 THR C 1.0 -100.0 -30.0 PHI 21 21 A 677 THR C A 678 LEU N A 678 LEU CA A 678 LEU C 1.0 -100.0 -30.0 PHI 22 22 A 678 LEU C A 679 SER N A 679 SER CA A 679 SER C 1.0 -100.0 -30.0 PHI 23 23 A 679 SER C A 680 ALA N A 680 ALA CA A 680 ALA C 1.0 -100.0 -30.0 PHI 24 24 A 680 ALA C A 681 GLN N A 681 GLN CA A 681 GLN C 1.0 -100.0 -30.0 PHI 25 25 A 681 GLN C A 682 LEU N A 682 LEU CA A 682 LEU C 1.0 -170.0 -70.0 PHI 26 26 A 683 ASP C A 684 LEU N A 684 LEU CA A 684 LEU C 1.0 -170.0 -70.0 PHI 27 27 A 685 PRO C A 686 LYS N A 686 LYS CA A 686 LYS C 1.0 -100.0 -30.0 PHI 28 28 A 686 LYS C A 687 TYR N A 687 TYR CA A 687 TYR C 1.0 -100.0 -30.0 PHI 29 29 A 689 ILE C A 690 ILE N A 690 ILE CA A 690 ILE C 1.0 -100.0 -30.0 PHI 30 30 A 690 ILE C A 691 LYS N A 691 LYS CA A 691 LYS C 1.0 -100.0 -30.0 PHI 31 31 A 691 LYS C A 692 PHE N A 692 PHE CA A 692 PHE C 1.0 -100.0 -30.0 PHI 32 32 A 692 PHE C A 693 PHE N A 693 PHE CA A 693 PHE C 1.0 -100.0 -30.0 PHI 33 33 A 693 PHE C A 694 GLN N A 694 GLN CA A 694 GLN C 1.0 -100.0 -30.0 PHI 34 34 A 694 GLN C A 695 ASN N A 695 ASN CA A 695 ASN C 1.0 -100.0 -30.0 PHI 35 35 A 695 ASN C A 696 GLN N A 696 GLN CA A 696 GLN C 1.0 -100.0 -30.0 PHI 36 36 A 696 GLN C A 697 ARG N A 697 ARG CA A 697 ARG C 1.0 -100.0 -30.0 PHI 37 37 A 697 ARG C A 698 TYR N A 698 TYR CA A 698 TYR C 1.0 -100.0 -30.0 PHI 38 38 A 698 TYR C A 699 TYR N A 699 TYR CA A 699 TYR C 1.0 -100.0 -30.0 PHI 39 39 A 699 TYR C A 700 LEU N A 700 LEU CA A 700 LEU C 1.0 -100.0 -30.0 PHI 40 40 A 653 VAL N A 653 VAL CA A 653 VAL CB A 653 VAL CG1 1.0 140.0 220.0 CHI1 41 41 A 666 VAL N A 666 VAL CA A 666 VAL CB A 666 VAL CG1 1.0 140.0 220.0 CHI1 42 42 A 660 GLN N A 660 GLN CA A 660 GLN CB A 660 GLN CG 1.0 -100.0 -20.0 CHI1 43 43 A 661 SER N A 661 SER CA A 661 SER CB A 661 SER OG 1.0 -100.0 -20.0 CHI1 44 44 A 662 PHE N A 662 PHE CA A 662 PHE CB A 662 PHE CG 1.0 140.0 220.0 CHI1 45 45 A 669 TYR N A 669 TYR CA A 669 TYR CB A 669 TYR CG 1.0 -100.0 -20.0 CHI1 46 46 A 672 GLU N A 672 GLU CA A 672 GLU CB A 672 GLU CG 1.0 -100.0 -20.0 CHI1 47 47 A 678 LEU N A 678 LEU CA A 678 LEU CB A 678 LEU CG 1.0 -100.0 -20.0 CHI1 48 48 A 681 GLN N A 681 GLN CA A 681 GLN CB A 681 GLN CG 1.0 140.0 220.0 CHI1 49 49 A 682 LEU N A 682 LEU CA A 682 LEU CB A 682 LEU CG 1.0 -100.0 -20.0 CHI1 50 50 A 684 LEU N A 684 LEU CA A 684 LEU CB A 684 LEU CG 1.0 -100.0 -20.0 CHI1 51 51 A 686 LYS N A 686 LYS CA A 686 LYS CB A 686 LYS CG 1.0 -100.0 -20.0 CHI1 52 52 A 692 PHE N A 692 PHE CA A 692 PHE CB A 692 PHE CG 1.0 140.0 220.0 CHI1 53 53 A 693 PHE N A 693 PHE CA A 693 PHE CB A 693 PHE CG 1.0 -100.0 -20.0 CHI1 54 54 A 695 ASN N A 695 ASN CA A 695 ASN CB A 695 ASN CG 1.0 -100.0 -20.0 CHI1 55 55 A 696 GLN N A 696 GLN CA A 696 GLN CB A 696 GLN CG 1.0 -100.0 -20.0 CHI1 56 56 A 697 ARG N A 697 ARG CA A 697 ARG CB A 697 ARG CG 1.0 -100.0 -20.0 CHI1 57 57 A 702 HIS N A 702 HIS CA A 702 HIS CB A 702 HIS CG 1.0 -100.0 -20.0 CHI1 stop_ save_