NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
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21087 |
2h3f   |
cing | 1-original | 2 | DYANA/DIANA | distance | hydrogen bond | simple |
#=========================== #---------H-BONDS----------- #=========================== #9 SER OG 12 GLU H 2.3 1.00E+00 #9 SER OG 12 GLU N 3.3 1.00E+00 #9 SER O 13 LEU H 2.0 1.00E+00 #relaxed to satisfy ori #9 SER O 13 LEU N 3.0 1.00E+00 #relaxed to satisfy ori #10 GLY O 14 ASP H 2.0 1.00E+00 #10 GLY O 14 ASP N 3.0 1.00E+00 #11 GLY O 15 LYS H 2.0 1.00E+00 #11 GLY O 15 LYS N 3.0 1.00E+00 #12 GLU O 16 TRP H 2.0 1.00E+00 #12 GLU O 16 TRP N 3.0 1.00E+00 #13 LEU O 17 GLU H 2.0 1.00E+00 #13 LEU O 17 GLU N 3.0 1.00E+00 # ---- H-BONDS ---- 15 LYS O 18 LYS H 2.0 1.00E+00 15 LYS O 18 LYS N 3.0 1.00E+00 29 TYR H 19 ILE O 2.0 1.00E+00 29 TYR N 19 ILE O 3.0 1.00E+00 #19 ILE H 29 TYR O 2.0 1.00E+00 #19 ILE N 29 TYR O 3.0 1.00E+00 21 LEU H 27 LYS O 2.0 1.00E+00 21 LEU N 27 LYS O 3.0 1.00E+00 #25 GLY H 22 ARG O 2.0 1.00E+00 #relaxed to satisfy ori #25 GLY N 22 ARG O 3.5 1.00E+00 #relaxed to satisfy ori # ---- H-BONDS --- 30 LYS O 34 ILE H 2.0 1.00E+00 30 LYS O 34 ILE N 3.0 1.00E+00 31 LEU O 35 VAL H 2.0 1.00E+00 31 LEU O 35 VAL N 3.0 1.00E+00 32 LYS O 36 TRP H 2.0 1.00E+00 32 LYS O 36 TRP N 3.0 1.00E+00 33 HIS O 37 ALA H 2.0 1.00E+00 33 HIS O 37 ALA N 3.0 1.00E+00 34 ILE O 38 SER H 2.0 1.00E+00 34 ILE O 38 SER N 3.0 1.00E+00 35 VAL O 39 ARG H 2.0 1.00E+00 35 VAL O 39 ARG N 3.0 1.00E+00 36 TRP O 40 GLU H 2.0 1.00E+00 36 TRP O 40 GLU N 3.0 1.00E+00 37 ALA O 41 LEU H 2.0 1.00E+00 37 ALA O 41 LEU N 3.0 1.00E+00 38 SER O 42 GLU H 2.0 1.00E+00 38 SER O 42 GLU N 3.0 1.00E+00 #39 ARG O 43 ARG H 2.0 1.00E+00 #relaxed to satisfy ori #39 ARG O 43 ARG N 3.0 1.00E+00 #relaxed to satisfy ori 40 GLU O 44 PHE H 2.0 1.00E+00 40 GLU O 44 PHE N 3.0 1.00E+00 #42 GLU O 45 ALA H 2.0 1.00E+00 #42 GLU O 45 ALA N 3.0 1.00E+00 # --- H-BONDS --- #47 ASN OD1 50 LEU H 2.0 1.00E+00 #47 ASN O 51 LEU H 2.0 1.00E+00 #47 ASN O 51 LEU N 3.0 1.00E+00 48 PRO O 51 LEU H 2.0 1.00E+00 48 PRO O 51 LEU N 3.0 1.00E+00 49 GLY O 52 GLU H 2.0 1.00E+00 49 GLY O 52 GLU N 3.0 1.00E+00 # --- H-BONDS --- 53 THR OG1 56 GLY H 2.3 1.00E+00 53 THR OG1 56 GLY N 3.3 1.00E+00 53 THR O 57 CYS H 2.0 1.00E+00 53 THR O 57 CYS N 3.0 1.00E+00 54 SER O 58 ARG H 2.0 1.00E+00 54 SER O 58 ARG N 3.0 1.00E+00 #55 GLU O 59 GLN H 2.0 1.00E+00 #relaxed to satisfy ori #55 GLU O 59 GLN N 3.0 1.00E+00 #relaxed to satisfy ori 56 GLY O 60 ILE H 2.0 1.00E+00 56 GLY O 60 ILE N 3.0 1.00E+00 57 CYS O 61 LEU H 2.0 1.00E+00 57 CYS O 61 LEU N 3.0 1.00E+00 58 ARG O 62 GLY H 2.0 1.00E+00 58 ARG O 62 GLY N 3.0 1.00E+00 59 GLN O 63 GLN H 2.0 1.00E+00 59 GLN O 63 GLN N 3.0 1.00E+00 60 ILE O 64 LEU H 2.0 1.00E+00 60 ILE O 64 LEU N 3.0 1.00E+00 61 LEU O 65 GLN H 2.0 1.00E+00 61 LEU O 65 GLN N 3.0 1.00E+00 # --- H-Bonds --- #66 PRO O 69 GLN H 2.0 1.00E+00 #Incompat w/ Xray..ORI? #66 PRO O 69 GLN N 3.0 1.00E+00 #Incompat w/ Xray..ORI? 68 LEU O 71 GLY H 2.0 1.00E+00 68 LEU O 71 GLY N 3.0 1.00E+00 # --- H-BONDS --- 72 SER OG 75 LEU H 2.0 1.00E+00 # Helix N-Cap; relaxed to satisfy ori 72 SER OG 75 LEU N 3.0 1.00E+00 # Helix N-Cap; relaxed to satisfy ori 72 SER O 76 ARG H 2.0 1.00E+00 72 SER O 76 ARG N 3.0 1.00E+00 73 GLU O 77 SER H 2.0 1.00E+00 74 GLU O 78 LEU N 3.0 1.00E+00 75 LEU O 79 TYR H 2.0 1.00E+00 75 LEU O 79 TYR N 3.0 1.00E+00 76 ARG O 80 ASN H 2.0 1.00E+00 76 ARG O 80 ASN N 3.0 1.00E+00 77 SER O 81 THR H 2.0 1.00E+00 77 SER O 81 THR N 3.0 1.00E+00 78 LEU O 82 ILE H 2.0 1.00E+00 78 LEU O 82 ILE N 3.0 1.00E+00 79 TYR O 83 ALA H 2.0 1.00E+00 79 TYR O 83 ALA N 3.0 1.00E+00 80 ASN O 84 VAL H 2.0 1.00E+00 80 ASN O 84 VAL N 3.0 1.00E+00 81 THR O 85 LEU H 2.0 1.00E+00 81 THR O 85 LEU N 3.0 1.00E+00 82 ILE O 86 TYR H 2.0 1.00E+00 82 ILE O 86 TYR N 3.0 1.00E+00 83 ALA O 87 CYS H 2.0 1.00E+00 83 ALA O 87 CYS N 3.0 1.00E+00 84 VAL O 88 VAL H 2.0 1.00E+00 84 VAL O 88 VAL N 3.0 1.00E+00 85 LEU O 89 HIS H 2.0 1.00E+00 85 LEU O 89 HIS N 3.0 1.00E+00 86 TYR O 90 GLN H 2.0 1.00E+00 86 TYR O 90 GLN N 3.0 1.00E+00 #87 CYS O 92 ILE H 2.0 1.00E+00 #87 CYS O 92 ILE N 3.0 1.00E+00 #88 VAL O 91 ARG H 2.0 1.00E+00 #88 VAL O 91 ARG N 3.0 1.00E+00 # --- H-BONDS ---- 95 LYS O 20 ARG H 2.0 1.00E+00 95 LYS O 20 ARG N 3.0 1.00E+00 97 THR H 20 ARG O 2.0 1.00E+00 97 THR N 20 ARG O 3.0 1.00E+00 # --- H-BONDS --- 96 ASP OD1 99 GLU H 2.0 1.00E+00 96 ASP OD1 99 GLU N 3.0 1.00E+00 96 ASP O 100 ALA H 2.0 1.00E+00 96 ASP O 100 ALA N 3.0 1.00E+00 97 THR O 101 LEU H 2.0 1.00E+00 97 THR O 101 LEU N 3.0 1.00E+00 98 LYS O 102 ASP H 2.0 1.00E+00 98 LYS O 102 ASP N 3.0 1.00E+00 99 GLU O 103 LYS H 2.0 1.00E+00 99 GLU O 103 LYS N 3.0 1.00E+00 100 ALA O 104 ILE H 2.0 1.00E+00 100 ALA O 104 ILE N 3.0 1.00E+00 101 LEU O 105 GLU H 2.0 1.00E+00 101 LEU O 105 GLU N 3.0 1.00E+00 102 ASP O 106 GLU H 2.0 1.00E+00 102 ASP O 106 GLU N 3.0 1.00E+00 103 LYS O 107 GLU H 2.0 1.00E+00 103 LYS O 107 GLU N 3.0 1.00E+00 104 ILE O 108 GLN H 2.0 1.00E+00 104 ILE O 108 GLN N 3.0 1.00E+00 105 GLU O 109 ASN H 2.0 1.00E+00 105 GLU O 109 ASN N 3.0 1.00E+00 106 GLU O 110 LYS H 2.0 1.00E+00 106 GLU O 110 LYS N 3.0 1.00E+00 107 GLU O 111 SER H 2.0 1.00E+00 107 GLU O 111 SER N 3.0 1.00E+00 108 GLN O 112 LYS H 2.0 1.00E+00 108 GLN O 112 LYS N 3.0 1.00E+00 109 ASN O 113 LYS H 2.0 1.00E-01 109 ASN O 113 LYS N 3.0 1.00E-01 110 LYS O 114 LYS H 2.0 1.00E-01 110 LYS O 114 LYS N 3.0 1.00E-01 111 SER O 115 ALA H 2.0 1.00E-01 111 SER O 115 ALA N 3.0 1.00E-01 112 LYS O 116 GLN H 2.0 1.00E-01 112 LYS O 116 GLN N 3.0 1.00E-01 113 LYS O 117 GLN H 2.0 1.00E-01 113 LYS O 117 GLN N 3.0 1.00E-01 114 LYS O 118 ALA H 2.0 1.00E-01 114 LYS O 118 ALA N 3.0 1.00E-01 115 ALA O 119 ALA H 2.0 1.00E-01 115 ALA O 119 ALA N 3.0 1.00E-01 116 GLN O 120 ALA H 2.0 1.00E-01 116 GLN O 120 ALA N 3.0 1.00E-01 117 GLN O 121 ASP H 2.0 1.00E-01 117 GLN O 121 ASP N 3.0 1.00E-01 118 ALA O 122 THR H 2.0 1.00E-01 118 ALA O 122 THR N 3.0 1.00E-01
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