NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing in_recoord stage position program type subtype subsubtype
7102 1jzu 4664 cing recoord 1-original 8 XPLOR/CNS distance hydrogen bond simple


! hbonds
! alpha-I
assign ( resid  8  and name HN ) ( resid  5  and name O )  1.80  0.30  0.60 !r
assign ( resid  8  and name N )  ( resid  5  and name O )  2.80  0.30  0.60 !r

assign ( resid  9  and name HN ) ( resid  6  and name O )  1.80  0.30  0.60 !r
assign ( resid  9  and name N )  ( resid  6  and name O )  2.80  0.30  0.60 !r

assign ( resid 10  and name HN ) ( resid  7  and name O )  1.80  0.30  0.60 !r
assign ( resid 10  and name N )  ( resid  7  and name O )  2.80  0.30  0.60 !r


! beta-I to beta-II
assign ( resid  11  and name HN ) ( resid  39  and name O )  1.80  0.30  0.60 !a2
assign ( resid  11  and name N )  ( resid  39  and name O )  2.80  0.30  0.60 !a2

assign ( resid  13  and name HN ) ( resid  37  and name O )  1.80  0.30  0.60 !n
assign ( resid  13  and name N )  ( resid  37  and name O )  2.80  0.30  0.60 !n

assign ( resid  15  and name HN ) ( resid  35  and name O )  1.80  0.30  0.60 !c 14 36
assign ( resid  15  and name N )  ( resid  35  and name O )  2.80  0.30  0.60 !c 14 36

assign ( resid  35  and name HN ) ( resid  15  and name O )  1.80  0.30  0.60 !a1
assign ( resid  35  and name N )  ( resid  15  and name O )  2.80  0.30  0.60 !a1

assign ( resid  37  and name HN ) ( resid  13  and name O )  1.80  0.30  0.60 !c 14 36
assign ( resid  37  and name N )  ( resid  13  and name O )  2.80  0.30  0.60 !c 14 36

assign ( resid  39  and name HN ) ( resid  11  and name O )  1.80  0.30  0.60 !n a Lys  12 HA  Arg  38 HA w
assign ( resid  39  and name N )  ( resid  11  and name O )  2.80  0.30  0.60 !n a Lys  12 HA  Arg  38 HA w

! alpha-II

! beta-Ia to beta-VIII
assign ( resid  14  and name HN ) ( resid 116  and name O )  1.80  0.30  0.60 !n a Trp  13 HA  Arg 117 HA
assign ( resid  14  and name N )  ( resid 116  and name O )  2.80  0.30  0.60 !n a Trp  13 HA  Arg 117 HA



assign ( resid 116  and name HN ) ( resid  14  and name O )  1.80  0.30  0.60 !c
assign ( resid 116  and name N )  ( resid  14  and name O )  2.80  0.30  0.60 !c


! beta-Ia to beta-IX
assign ( resid  18  and name HN ) ( resid 144  and name O )  1.80  0.30  0.60 !n
assign ( resid  18  and name N )  ( resid 144  and name O )  2.80  0.30  0.60 !n

assign ( resid  20  and name HN ) ( resid 143  and name O )  1.80  0.30  0.60 !n
assign ( resid  20  and name N )  ( resid 143  and name O )  2.80  0.30  0.60 !n

assign ( resid 144  and name HN ) ( resid  18  and name O )  1.80  0.30  0.60 !n a Ala 19 HA Met 143 HA m
assign ( resid 144  and name N )  ( resid  18  and name O )  2.80  0.30  0.60 !n a Ala 19 HA Met 143 HA m

assign ( resid 146  and name HN ) ( resid  16  and name O )  1.80  0.30  0.60 !n a Ala  17 HA Met 145 HA m
assign ( resid 146  and name N )  ( resid  16  and name O )  2.80  0.30  0.60 !n a Ala  17 HA Met 145 HA m


! beta-Ib to beta-VIII


assign ( resid  19  and name HN ) ( resid 112  and name O )  1.80  0.30  0.60 !c (a2)
assign ( resid  19  and name N )  ( resid 112  and name O )  2.80  0.30  0.60 !c (a2)

assign ( resid  21  and name HN ) ( resid 110  and name O )  1.80  0.30  0.60 !a1
assign ( resid  21  and name N )  ( resid 110  and name O )  2.80  0.30  0.60 !a1

assign ( resid 110  and name HN ) ( resid  21  and name O )  1.80  0.30  0.60 !a1 (a2)
assign ( resid 110  and name N )  ( resid  21  and name O )  2.80  0.30  0.60 !a1 (a2)

assign ( resid 112  and name HN ) ( resid  19  and name O )  1.80  0.30  0.60 !n a Ser  20 HA  Met 111 HA
assign ( resid 112  and name N )  ( resid  19  and name O )  2.80  0.30  0.60 !n a Ser  20 HA  Met 111 HA

assign ( resid 114  and name HN ) ( resid  17  and name O )  1.80  0.30  0.60 !c
assign ( resid 114  and name N )  ( resid  17  and name O )  2.80  0.30  0.60 !c


! beta-II to beta-III
assign ( resid  34  and name HN ) ( resid  54  and name O )  1.80  0.30  0.60 !a1
assign ( resid  34  and name N )  ( resid  54  and name O )  2.80  0.30  0.60 !a1

assign ( resid  36  and name HN ) ( resid  52  and name O )  1.80  0.30  0.60 !c
assign ( resid  36  and name N )  ( resid  52  and name O )  2.80  0.30  0.60 !c

assign ( resid  38  and name HN ) ( resid  50  and name O )  1.80  0.30  0.60 !n a Ala  37 HA  Tyr  51 HA m
assign ( resid  38  and name N )  ( resid  50  and name O )  2.80  0.30  0.60 !n a Ala  37 HA  Tyr  51 HA m

assign ( resid  40  and name HN ) ( resid  48  and name O )  1.80  0.30  0.60 !n a Ile  39 HA Val 49 HA w
assign ( resid  40  and name N )  ( resid  48  and name O )  2.80  0.30  0.60 !n a Ile  39 HA Val 49 HA w

assign ( resid  42  and name HN ) ( resid  46  and name O )  1.80  0.30  0.60 !a2
assign ( resid  42  and name N )  ( resid  46  and name O )  2.80  0.30  0.60 !a2

assign ( resid  46  and name HN ) ( resid  42  and name O )  1.80  0.30  0.60 !a2
assign ( resid  46  and name N )  ( resid  42  and name O )  2.80  0.30  0.60 !a2

assign ( resid  48  and name HN ) ( resid  40  and name O )  1.80  0.30  0.60 !c
assign ( resid  48  and name N )  ( resid  40  and name O )  2.80  0.30  0.60 !c

assign ( resid  50  and name HN ) ( resid  38  and name O )  1.80  0.30  0.60 !n a Ile  39 HA Val 49 HA w
assign ( resid  50  and name N )  ( resid  38  and name O )  2.80  0.30  0.60 !n a Ile  39 HA Val 49 HA w

assign ( resid  52  and name HN ) ( resid  36  and name O )  1.80  0.30  0.60 !n a Ala  37 HA  Tyr  51 HA
assign ( resid  52  and name N )  ( resid  36  and name O )  2.80  0.30  0.60 !n a Ala  37 HA  Tyr  51 HA


! beta-III to beta-IV
 
assign ( resid  47  and name HN ) ( resid  68  and name O )  1.80  0.30  0.60 !a1 check
assign ( resid  47  and name N )  ( resid  68  and name O )  2.80  0.30  0.60 !a1 check

assign ( resid  49  and name HN ) ( resid  66  and name O )  1.80  0.30  0.60 !a1 check a2
assign ( resid  49  and name N )  ( resid  66  and name O )  2.80  0.30  0.60 !a1 check a2

assign ( resid  51  and name HN ) ( resid  64  and name O )  1.80  0.30  0.60 !n a Thr 65 HA Ser 50 HA m
assign ( resid  51  and name N )  ( resid  64  and name O )  2.80  0.30  0.60 !n a Thr 65 HA Ser 50 HA m

assign ( resid  53  and name HN ) ( resid  62  and name O )  1.80  0.30  0.60 !n a Glu 63 HA Ala 52 HA  s
assign ( resid  53  and name N )  ( resid  62  and name O )  2.80  0.30  0.60 !n a Glu 63 HA Ala 52 HA  s

assign ( resid  55  and name HN ) ( resid  60  and name O )  1.80  0.30  0.60 !a2
assign ( resid  55  and name N )  ( resid  60  and name O )  2.80  0.30  0.60 !a2

assign ( resid  60  and name HN ) ( resid  55  and name O )  1.80  0.30  0.60 !a2
assign ( resid  60  and name N )  ( resid  55  and name O )  2.80  0.30  0.60 !a2

assign ( resid  62  and name HN ) ( resid  53  and name O )  1.80  0.30  0.60 !c
assign ( resid  62  and name N )  ( resid  53  and name O )  1.80  0.30  0.60 !c

assign ( resid  64  and name HN ) ( resid  51  and name O )  1.80  0.30  0.60 !n a Glu 63 HA Ala 52 HA  s
assign ( resid  64  and name N )  ( resid  51  and name O )  2.80  0.30  0.60 !n a Glu 63 HA Ala 52 HA  s

assign ( resid  66  and name HN ) ( resid  49  and name O )  1.80  0.30  0.60 !n a Thr 65 HA Ser 50 HA m
assign ( resid  66  and name N )  ( resid  49  and name O )  2.80  0.30  0.60 !n a Thr 65 HA Ser 50 HA m

assign ( resid  68  and name HN ) ( resid  47  and name O )  1.80  0.30  0.60 !a1 check
assign ( resid  68  and name N )  ( resid  47  and name O )  2.80  0.30  0.60 !a1 check


! beta-IV to beta-V
assign ( resid  69  and name HN ) ( resid  78  and name O )  1.80  0.30  0.60 !c check
assign ( resid  69  and name N )  ( resid  78  and name O )  2.80  0.30  0.60 !c check

assign ( resid  71  and name HN ) ( resid  76  and name O )  1.80  0.30  0.60 !c check
assign ( resid  71  and name N )  ( resid  76  and name O )  2.80  0.30  0.60 !c check

assign ( resid  78  and name HN ) ( resid  69  and name O )  1.80  0.30  0.60 !c check
assign ( resid  78  and name N )  ( resid  69  and name O )  2.80  0.30  0.60 !c check


! beta-V to beta-VI
assign ( resid  75  and name HN ) ( resid  87  and name O )  1.80  0.30  0.60 !c check (a2)
assign ( resid  75  and name N )  ( resid  87  and name O )  2.80  0.30  0.60 !c check (a2)

assign ( resid  77  and name HN ) ( resid  85  and name O )  1.80  0.30  0.60 !c check ok (a2)
assign ( resid  77  and name N )  ( resid  85  and name O )  2.80  0.30  0.60 !c check ok (a2)

assign ( resid  79  and name HN ) ( resid  83  and name O )  1.80  0.30  0.60 !a2
assign ( resid  79  and name N )  ( resid  83  and name O )  2.80  0.30  0.60 !a2

assign ( resid  83  and name HN ) ( resid  79  and name O )  1.80  0.30  0.60 !a2
assign ( resid  83  and name N )  ( resid  79  and name O )  2.80  0.30  0.60 !a2

assign ( resid  85  and name HN ) ( resid  77  and name O )  1.80  0.30  0.60 !c check ok
assign ( resid  85  and name N )  ( resid  77  and name O )  2.80  0.30  0.60 !c check ok

assign ( resid  87  and name HN ) ( resid  75  and name O )  1.80  0.30  0.60 !c check (a2)
assign ( resid  87  and name N )  ( resid  75  and name O )  2.80  0.30  0.60 !c check (a2)


! beta-VI to beta-VII

assign ( resid  82  and name HN ) ( resid 103  and name O )  1.80  0.30  0.60 !a2
assign ( resid  82  and name N )  ( resid 103  and name O )  2.80  0.30  0.60 !a2

assign ( resid  84  and name HN ) ( resid 101  and name O )  1.80  0.30  0.60 !a1
assign ( resid  84  and name N )  ( resid 101  and name O )  2.80  0.30  0.60 !a1

assign ( resid  86  and name HN ) ( resid  99  and name O )  1.80  0.30  0.60 !n m Ile 98 HD1# Val 87 HA m ok maybe s || m Ile 98 HG2# Val 87 HA vw ok
assign ( resid  86  and name N )  ( resid  99  and name O )  2.80  0.30  0.60 !n m Ile 98 HD1# Val 87 HA m ok maybe s || m Ile 98 HG2# Val 87 HA vw ok

assign ( resid  88  and name HN ) ( resid  97  and name O )  1.80  0.30  0.60 !n m Ile 98 HD1# Val 87 HA m ok maybe s || m Ile 98 HG2# Val 87 HA vw ok
assign ( resid  88  and name N )  ( resid  97  and name O )  2.80  0.30  0.60 !n m Ile 98 HD1# Val 87 HA m ok maybe s || m Ile 98 HG2# Val 87 HA vw ok



assign ( resid  97  and name HN ) ( resid  88  and name O )  1.80  0.30  0.60 !n m Ile 98 HD1# Val 87 HA m ok maybe s || m Ile 98 HG2# Val 87 HA vw ok
assign ( resid  97  and name N )  ( resid  88  and name O )  2.80  0.30  0.60 !n m Ile 98 HD1# Val 87 HA m ok maybe s || m Ile 98 HG2# Val 87 HA vw ok

assign ( resid  99  and name HN ) ( resid  86  and name O )  1.80  0.30  0.60 !n m Ile 98 HD1# Val 87 HA m ok maybe s || m Ile 98 HG2# Val 87 HA vw ok
assign ( resid  99  and name N )  ( resid  86  and name O )  2.80  0.30  0.60 !n m Ile 98 HD1# Val 87 HA m ok maybe s || m Ile 98 HG2# Val 87 HA vw ok

assign ( resid 101  and name HN ) ( resid 84  and name O )  1.80  0.30  0.60 !a1
assign ( resid 101  and name N )  ( resid 84  and name O )  2.80  0.30  0.60 !a1

assign ( resid 103  and name HN ) ( resid  82  and name O )  1.80  0.30  0.60 !a1
assign ( resid 103  and name N )  ( resid  82  and name O )  2.80  0.30  0.60 !a1



! beta-VII to beta-VIII
assign ( resid  96  and name HN ) ( resid 115  and name O )  1.80  0.30  0.60 !n a Tyr  95 HA Ser 116 HA s
assign ( resid  96  and name N )  ( resid 115  and name O )  2.80  0.30  0.60 !n a Tyr  95 HA Ser 116 HA s

assign ( resid  98  and name HN ) ( resid 113  and name O )  1.80  0.30  0.60 !n a Val  97 HA Leu 114 HA s
assign ( resid  98  and name N )  ( resid 113  and name O )  2.80  0.30  0.60 !n a Val  97 HA Leu 114 HA s

assign ( resid 100  and name HN ) ( resid 111  and name O )  1.80  0.30  0.60 !a2
assign ( resid 100  and name N )  ( resid 111  and name O )  2.80  0.30  0.60 !a2

assign ( resid 102  and name HN ) ( resid 109  and name O )  1.80  0.30  0.60 !a2
assign ( resid 102  and name N )  ( resid 109  and name O )  2.80  0.30  0.60 !a2

assign ( resid 104  and name HN ) ( resid 107  and name O )  1.80  0.30  0.60 !c (a2)
assign ( resid 104  and name N )  ( resid 107  and name O )  2.80  0.30  0.60 !c (a2)

assign ( resid 107  and name HN ) ( resid 104  and name O )  1.80  0.30  0.60 !a1
assign ( resid 107  and name N )  ( resid 104  and name O )  2.80  0.30  0.60 !a1

assign ( resid 109  and name HN ) ( resid 102  and name O )  1.80  0.30  0.60 !c
assign ( resid 109  and name N )  ( resid 102  and name O )  2.80  0.30  0.60 !c

assign ( resid 111  and name HN ) ( resid 100  and name O )  1.80  0.30  0.60 !c
assign ( resid 111  and name N )  ( resid 100  and name O )  2.80  0.30  0.60 !c

assign ( resid 113  and name HN ) ( resid  98  and name O )  1.80  0.30  0.60 !c
assign ( resid 113  and name N )  ( resid  98  and name O )  2.80  0.30  0.60 !c

assign ( resid 115  and name HN ) ( resid  96  and name O )  1.80  0.30  0.60 !n a Val  97 HA Leu 114 HA s
assign ( resid 115  and name N )  ( resid  96  and name O )  2.80  0.30  0.60 !n a Val  97 HA Leu 114 HA s

assign ( resid 117  and name HN ) ( resid  94  and name O )  1.80  0.30  0.60 !n a Tyr  95 HA Ser 116 HA s
assign ( resid 117  and name N )  ( resid  94  and name O )  2.80  0.30  0.60 !n a Tyr  95 HA Ser 116 HA s

 
! alpha-III 122-135

assign ( resid 126  and name HN ) ( resid 122  and name O )  1.80  0.30  0.60
assign ( resid 126  and name N )  ( resid 122  and name O )  2.80  0.30  0.60

assign ( resid 127  and name HN ) ( resid 123  and name O )  1.80  0.30  0.60
assign ( resid 127  and name N )  ( resid 123  and name O )  2.80  0.30  0.60

assign ( resid 128  and name HN ) ( resid 124  and name O )  1.80  0.30  0.60
assign ( resid 128  and name N )  ( resid 124  and name O )  2.80  0.30  0.60

assign ( resid 129  and name HN ) ( resid 125  and name O )  1.80  0.30  0.60
assign ( resid 129  and name N )  ( resid 125  and name O )  2.80  0.30  0.60

assign ( resid 130  and name HN ) ( resid 126  and name O )  1.80  0.30  0.60
assign ( resid 130  and name N )  ( resid 126  and name O )  2.80  0.30  0.60

assign ( resid 131  and name HN ) ( resid 127  and name O )  1.80  0.30  0.60
assign ( resid 131  and name N )  ( resid 127  and name O )  2.80  0.30  0.60

assign ( resid 132  and name HN ) ( resid 128  and name O )  1.80  0.30  0.60
assign ( resid 132  and name N )  ( resid 128  and name O )  2.80  0.30  0.60

assign ( resid 133  and name HN ) ( resid 129  and name O )  1.80  0.30  0.60
assign ( resid 133  and name N )  ( resid 129  and name O )  2.80  0.30  0.60

assign ( resid 134  and name HN ) ( resid 130  and name O )  1.80  0.30  0.60
assign ( resid 134  and name N )  ( resid 130  and name O )  2.80  0.30  0.60

assign ( resid 135  and name HN ) ( resid 131  and name O )  1.80  0.30  0.60
assign ( resid 135  and name N )  ( resid 131  and name O )  2.80  0.30  0.60







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