NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type
618803 5ue5 25485 cing 1-original 2 DYANA/DIANA dihedral angle


# Restraints file 3: dihre.aco
# 123 HIS   PHI    -137.5  -103.6  3.00
  60 GLU   PHI     -67.1   -60.0  4.44
  21 ARG   PSI     -52.0   -28.7  5.00
   3 GLU   PHI     -95.4   -56.0  5.00
   3 GLU   PSI     -53.3    -7.1  5.00
   4 ALA   PHI     -70.5   -56.4  5.00
   4 ALA   PSI     -45.1   -34.0  5.00
   5 GLY   PHI     -87.7   -55.9  5.00
   5 GLY   PSI     -42.7    -1.6  5.00
   6 GLY   PHI    -108.9   -77.5  5.00
   6 GLY   PSI     -20.4    21.6  5.00
   7 MET   PHI    -103.3   -59.7  5.00
   7 MET   PSI     111.6   164.2  5.00
   8 SER   PHI    -115.7   -51.4  5.00
   8 SER   PSI     147.3   168.7  5.00
   9 GLU   PHI     -63.1   -54.4  5.00
   9 GLU   PSI     -41.6   -32.0  5.00
  10 LEU   PHI     -68.4   -60.6  5.00
  11 GLN   PHI     -69.6   -61.8  5.00
  12 TRP   PHI     -73.1   -60.2  5.00
  13 GLU   PHI     -73.3   -59.0  5.00
  13 GLU   PSI     -47.0   -35.5  5.00
  14 GLN   PHI     -73.8   -63.1  5.00
  14 GLN   PSI     -45.3   -36.8  5.00
  15 ALA   PHI     -71.2   -57.3  5.00
  15 ALA   PSI     -43.7   -35.0  5.00
  16 GLN   PHI     -72.9   -58.7  5.00
  16 GLN   PSI     -42.9   -32.8  5.00
  17 ASP   PHI     -77.6   -59.1  5.00
  17 ASP   PSI     -41.4   -31.8  5.00
  18 TYR   PHI     -70.0   -60.3  5.00
  18 TYR   PSI     -50.9   -36.7  5.00
  19 LEU   PSI     -42.4   -21.2  5.00
  20 LYS   PHI     -77.8   -57.4  5.00
  20 LYS   PSI     -48.1   -26.6  5.00
  21 ARG   PHI     -86.2   -63.9  5.00
  22 PHE   PHI    -102.4   -60.5  5.00
  22 PHE   PSI     -37.7     2.0  5.00
  23 TYR   PHI    -120.2   -74.6  5.00
  25 TYR   PSI   90     160       5.00
  26 ASP   PHI -125     -75       5.00
  26 ASP   PSI      90.5   136.3  5.00
  27 SER   PHI  -85     -50       5.00
  27 SER   PSI     -36.1    -6.5  5.00
  28 GLU   PHI  -95     -55       5.00
  28 GLU   PSI     -38.8   -11.5  5.00
  29 THR   PHI    -114.4   -76.9  5.00
  29 THR   PSI     -21.0     9.4  5.00
  30 LYS   PHI    -146.4   -24.2  5.00
  30 LYS   PSI  100     170       5.00
  31 ASN   PSI     104.9   169.2  5.00
  32 ALA   PHI  -75     -50       5.00
  32 ALA   PSI     -40.1   -19.5  5.00
  33 ASN   PHI  -85     -50       5.00
  33 ASN   PSI     -49.0   -18.8  5.00
  34 SER   PHI     -85.5   -58.4  5.00
  34 SER   PSI     -46.7   -20.2  5.00
  35 LEU   PHI     -68.7   -58.0  5.00
  35 LEU   PSI     -44.3   -36.3  5.00
  36 GLU   PHI     -63.6   -58.2  5.00
  36 GLU   PSI     -50.9   -38.0  5.00
  37 ALA   PHI     -65.6   -53.1  5.00
  37 ALA   PSI     -51.1   -36.9  5.00
  38 LYS   PHI     -70.4   -60.0  5.00
  38 LYS   PSI     -49.0   -38.8  5.00
  39 LEU   PHI     -67.4   -54.8  5.00
  39 LEU   PSI     -46.2   -36.9  5.00
  40 LYS   PHI     -68.1   -58.8  5.00
  40 LYS   PSI     -45.4   -37.3  5.00
  41 GLU   PHI     -69.3   -60.8  5.00
  41 GLU   PSI     -43.9   -33.7  5.00
  42 MET   PHI     -68.2   -61.6  5.00
  42 MET   PSI     -46.8   -34.8  5.00
  43 GLN   PHI     -66.1   -57.5  5.00
  43 GLN   PSI     -48.9   -40.4  5.00
  44 LYS   PHI     -72.3   -59.9  5.00
  44 LYS   PSI     -43.7   -21.3  5.00
  45 PHE   PHI     -69.8   -57.5  5.00
  45 PHE   PSI     -47.0   -37.7  5.00
  46 PHE   PHI    -103.4   -82.2  5.00
  46 PHE   PSI  -35      40       5.00
  47 GLY   PHI   50     115       5.00
  47 GLY   PSI  -10      50       5.00
  48 LEU   PHI -140     -60       5.00
  48 LEU   PSI   95     160       5.00
  50 ILE   PSI     108.4   148.6  5.00
  51 THR   PHI    -129.1   -84.1  5.00
  52 GLY   PHI   35      115      5.00
  52 GLY   PSI     -10.6    41.4  5.00
  53 MET   PHI    -134.7   -89.8  5.00
  53 MET   PSI     134.0   161.0  5.00
  56 SER   PHI    -125.9   -57.7  5.00
  57 ARG   PHI     -84.3   -47.8  5.00
  57 ARG   PSI     -45.4   -20.6  5.00
  58 VAL   PHI     -68.5   -59.0  5.00
  58 VAL   PSI     -49.1   -40.5  5.00
  59 ILE   PHI     -74.1   -58.1  5.00
  59 ILE   PSI     -51.9   -32.4  5.00
  60 GLU   PSI     -43.6   -33.1  5.00
  61 ILE   PHI     -77.5   -60.0  5.00
  61 ILE   PSI     -45.6   -30.3  5.00
  62 MET   PHI     -71.7   -58.2  5.00
  62 MET   PSI     -43.9   -20.5  5.00
  63 GLN   PHI    -102.7   -73.2  5.00
  63 GLN   PSI     -26.2     2.6  5.00
  64 LYS   PHI  -85     -45       5.00
  64 LYS   PSI  110     160       5.00
  67 CYS   PHI -145     -70       5.00
  67 CYS   PSI     114.7   156.0  5.00
  68 GLY   PHI -150     -65       5.00
  69 VAL   PHI -125     -65       5.00
  69 VAL   PSI   75     145       5.00
  70 PRO   PSI  120     180       5.00
  72 VAL   PHI -165     -90       5.00
  72 VAL   PSI     130.0   164.8  5.00
  73 ALA   PHI    -130.7   -71.1  5.00
  73 ALA   PSI  120     170       5.00
  74 GLU   PHI    -189.5    -4.7  5.00
  74 GLU   PSI      82.4   172.8  5.00
  75 TYR   PSI   85     170       5.00
  76 SER   PSI     100.7   179.3  5.00
  79 PRO   PSI  115     185       5.00
  80 ASN   PSI      97.5   154.1  5.00
  81 SER   PSI   95     175       5.00
  84 TRP   PHI -125     -45       5.00
  84 TRP   PSI  110     155       5.00
  85 THR   PHI -115     -70       5.00
  85 THR   PSI     -39.4     1.2  5.00
  87 LYS   PHI -120     -65       5.00
  87 LYS   PSI     -30.2    -7.9  5.00
  88 VAL   PSI     119.8   144.8  5.00
  89 VAL   PHI    -134.6   -92.1  5.00
  89 VAL   PSI     130.6   154.2  5.00
  90 THR   PHI    -134.2  -116.0  5.00
  90 THR   PSI     136.3   167.9  5.00
  91 TYR   PHI    -151.2  -130.9  5.00
  91 TYR   PSI     148.0   159.9  5.00
  92 ARG   PHI    -151.0  -124.8  5.00
  92 ARG   PSI     117.7   138.9  5.00
  93 ILE   PHI     -92.6   -75.3  5.00
  93 ILE   PSI     104.2   135.0  5.00
  94 VAL   PHI    -107.0   -73.7  5.00
  94 VAL   PSI     -39.1   -15.0  5.00
  95 SER   PHI    -175.0  -136.0  5.00
  95 SER   PSI     155.0   169.3  5.00
  96 TYR   PHI    -139.8   -94.5  5.00
  96 TYR   PSI   95     155       5.00
  97 THR   PHI    -128.6   -83.6  5.00
  97 THR   PSI   70     140       5.00
  98 ARG   PHI     -78.5   -53.6  5.00
  98 ARG   PSI     -34.5    -4.4  5.00
  99 ASP   PHI     -96.1   -65.6  5.00
  99 ASP   PSI     -62.9   -19.3  5.00
 100 LEU   PHI    -147.8  -119.8  5.00
 100 LEU   PSI      91.7   153.5  5.00
 101 PRO   PSI     137.3   150.6  5.00
 102 HIS   PHI     -72.3   -41.0  5.00
 102 HIS   PSI     -46.6   -25.7  5.00
 103 ILE   PHI     -77.4   -61.3  5.00
 103 ILE   PSI     -44.0   -12.5  5.00
 104 THR   PHI     -68.0   -60.9  5.00
 104 THR   PSI     -43.5   -35.5  5.00
 105 VAL   PHI     -72.7   -58.8  5.00
 105 VAL   PSI     -52.1   -36.0  5.00
 106 ASP   PSI     -49.3   -33.9  5.00
 107 ARG   PSI     -46.8   -36.5  5.00
 108 LEU   PHI     -71.0   -61.4  5.00
 108 LEU   PSI     -48.7   -33.4  5.00
 109 VAL   PHI     -68.7   -58.1  5.00
 109 VAL   PSI     -47.9   -38.0  5.00
 110 SER   PHI     -69.0   -53.9  5.00
 110 SER   PSI     -45.2   -35.7  5.00
 111 LYS   PHI     -69.7   -62.8  5.00
 111 LYS   PSI     -44.9   -33.7  5.00
 112 ALA   PSI     -50.9   -41.3  5.00
 113 LEU   PHI     -65.2   -57.7  5.00
 113 LEU   PSI     -45.7   -34.0  5.00
 114 ASN   PHI     -69.3   -61.3  5.00
 114 ASN   PSI     -49.7   -35.3  5.00
 115 MET   PHI     -70.7   -58.0  5.00
 115 MET   PSI     -49.0   -35.2  5.00
 116 TRP   PHI     -92.2   -60.4  5.00
 116 TRP   PSI     -52.3   -22.8  5.00
 117 GLY   PHI     -72.8   -60.2  5.00
 117 GLY   PSI     -43.9   -16.3  5.00
 118 LYS   PHI     -89.6   -61.6  5.00
 118 LYS   PSI     -45.3   -14.3  5.00
 119 GLU   PHI    -114.9   -91.6  5.00
 119 GLU   PSI     -33.0    13.2  5.00
 120 ILE   PHI    -149.5  -113.2  5.00
 120 ILE   PSI     127.1   184.3  5.00
 107 ARG   PHI     -68.5   -64.6  5.00
  12 TRP   PSI     -44.3   -31.0  5.00
  19 LEU   PHI     -71.3   -58.8  5.00
  10 LEU   PSI     -42.8   -36.8  5.00
 106 ASP   PHI     -68.6   -56.4  5.00
  11 GLN   PSI     -45.1   -37.8  5.00
 123 HIS   PSI     121.7   153.4  5.00
 124 PHE   PHI    -129.4   -95.2  5.00
 124 PHE   PSI     122.9   148.5  5.00
 125 ARG   PHI    -145.0  -115.3  5.00
 126 LYS   PHI    -119.8   -81.9  5.00
 126 LYS   PSI   90     160       5.00
 127 VAL   PHI    -142.5  -103.9  5.00
 127 VAL   PSI     127.1   167.8  5.00
 129 TRP   PHI    -162.7  -122.1  5.00
 129 TRP   PSI  110     175       5.00
 131 THR   PHI    -101.7   -70.8  5.00
 131 THR   PSI  105     155       5.00
 132 ALA   PHI    -136.9  -112.4  5.00
 132 ALA   PSI  115     165       5.00
 134 ILE   PHI    -115.6   -82.7  5.00
 134 ILE   PSI     107.8   142.0  5.00
 135 MET   PHI    -118.0   -74.4  5.00
 135 MET   PSI     114.9   138.0  5.00
 136 ILE   PHI    -126.9  -106.3  5.00
 137 GLY   PHI    -172.7  -130.1  5.00
 137 GLY   PSI     147.4   177.0  5.00
 138 PHE   PHI    -138.2  -105.4  5.00
 138 PHE   PSI     127.0   149.6  5.00
 139 ALA   PSI     131.7   166.0  5.00
 140 ARG   PHI -175    -105       5.00
 142 ALA   PHI    -102.6   -61.4  5.00
 143 HIS   PSI     -33.3     8.6  5.00
 146 SER   PHI     -87.5   -64.0  5.00
 146 SER   PSI  100     180       5.00
 148 PRO   PSI     134.8   151.1  5.00
 149 PHE   PHI     -90.8   -54.5  5.00
 149 PHE   PSI  -50       5       5.00
 152 PRO   PSI     127.9   141.1  5.00
 153 GLY   PHI      81.2   102.5  5.00
 154 ASN   PHI -105     -35       5.00
 154 ASN   PSI  125     155       5.00
 157 ALA   PHI -170    -110       5.00
 157 ALA   PSI     152.3   173.9  5.00
 159 ALA   PHI    -161.9  -112.0  5.00
 159 ALA   PSI     139.0   174.0  5.00
 161 ALA   PHI    -110.3   -54.6  5.00
 161 ALA   PSI     117.9   164.0  5.00
 163 GLY   PHI -165     -80       5.00
 163 GLY   PSI  100     170       5.00
 166 LEU   PHI     -71.3   -54.1  5.00
 166 LEU   PSI     -39.9   -18.0  5.00
 168 GLY   PHI      73.1   102.7  5.00
 168 GLY   PSI     -19.9    22.7  5.00
 170 ALA   PHI    -146.4  -112.6  5.00
 170 ALA   PSI     132.6   163.1  5.00
 171 HIS   PHI    -138.3  -116.0  5.00
 171 HIS   PSI     132.8   158.4  5.00
 172 PHE   PHI    -143.5   -97.8  5.00
 172 PHE   PSI     129.1   147.9  5.00
 173 ASP   PHI     -82.9   -65.3  5.00
 174 GLU   PHI     -76.1   -54.1  5.00
 174 GLU   PSI     -25.1   -11.0  5.00
 175 ASP   PHI     -78.9   -55.9  5.00
 175 ASP   PSI     -32.2   -16.5  5.00
 177 ARG   PHI    -116.3   -89.7  5.00
 177 ARG   PSI     107.0   128.9  5.00
 178 TRP   PHI    -116.7   -81.6  5.00
 178 TRP   PSI     133.1   160.6  5.00
 179 THR   PSI     143.2   163.2  5.00
 180 ASP   PHI    -143.1   -74.7  5.00
 181 GLY   PHI     -70.3   -53.6  5.00
 181 GLY   PSI     -36.0   -10.9  5.00
 182 SER   PHI    -110.2   -84.6  5.00
 182 SER   PSI     -23.5    14.2  5.00
 184 LEU   PHI    -116.7   -77.5  5.00
 184 LEU   PSI     -33.4    10.0  5.00
 186 ILE   PHI -115     -80       5.00
 186 ILE   PSI      97.8   131.6  5.00
 187 ASN   PHI    -109.3   -42.9  5.00
 187 ASN   PSI     115.0   135.0  5.00
 188 PHE   PHI     -60.6   -54.4  5.00
 188 PHE   PSI     -51.4   -30.1  5.00
 189 LEU   PHI     -66.9   -55.4  5.00
 189 LEU   PSI     -46.6   -36.2  5.00
 190 TYR   PHI     -69.1   -58.2  5.00
 190 TYR   PSI     -47.9   -36.1  5.00
 191 ALA   PHI     -72.5   -56.8  5.00
 191 ALA   PSI     -43.8   -36.0  5.00
 192 ALA   PHI     -69.6   -57.4  5.00
 192 ALA   PSI     -44.4   -36.5  5.00
 193 THR   PHI     -71.0   -58.9  5.00
 193 THR   PSI     -48.9   -39.1  5.00
 194 HIS   PHI     -71.6   -60.4  5.00
 194 HIS   PSI     -49.7   -29.7  5.00
 195 GLU   PHI     -77.1   -62.0  5.00
 195 GLU   PSI     -46.3   -16.1  5.00
 196 LEU   PHI     -73.0   -52.7  5.00
 196 LEU   PSI     -46.6   -17.9  5.00
 197 GLY   PSI     -47.9   -21.3  5.00
 198 HIS   PHI     -69.9   -62.5  5.00
 198 HIS   PSI     -44.3   -32.5  5.00
 199 SER   PHI     -73.9   -58.9  5.00
 199 SER   PSI     -45.5   -21.5  5.00
 200 LEU   PHI    -103.4   -69.3  5.00
 200 LEU   PSI     -19.4    18.0  5.00
 201 GLY   PHI      84.3   115.7  5.00
 201 GLY   PSI      -9.3    14.2  5.00
 203 GLY   PHI    -137.1  -101.4  5.00
 203 GLY   PSI     159.2   185.2  5.00
 205 SER   PHI    -137.6  -104.1  5.00
 205 SER   PSI     120.7   174.2  5.00
 206 SER   PHI     -87.5   -59.7  5.00
 206 SER   PSI  -55      -5       5.00
 207 ASP   PHI    -139.3   -72.1  5.00
 207 ASP   PSI     109.7   143.3  5.00
 208 PRO   PSI     -34.3    -6.3  5.00
 210 ALA   PHI     -87.0   -71.3  5.00
 210 ALA   PSI  100     145       5.00
 211 VAL   PHI     -72.9   -57.5  5.00
 211 VAL   PSI     -38.1   -25.1  5.00
 213 TYR   PHI     -88.8   -56.5  5.00
 213 TYR   PSI     107.3   149.1  5.00
 214 PRO   PSI     -38.1   -18.6  5.00
 215 THR   PHI    -124.2   -84.6  5.00
 216 TYR   PSI     122.8   150.5  5.00
 220 ASP   PHI    -120.2   -75.3  5.00
 220 ASP   PSI     101.8   153.4  5.00
 221 PRO   PSI     114.2   168.6  5.00
 222 GLN   PHI     -81.4   -53.5  5.00
 222 GLN   PSI  -45      10       5.00
 223 ASN   PHI -130     -85       5.00
 223 ASN   PSI  -40      40       5.00
 224 PHE   PSI     120.1   157.3  5.00
 225 LYS   PHI    -143.1   -99.8  5.00
 225 LYS   PSI  135     195       5.00
 226 LEU   PHI -120     -60       5.00
 226 LEU   PSI     104.2   146.8  5.00
 227 SER   PHI    -128.3   -88.6  5.00
 227 SER   PSI     131.9   170.3  5.00
 229 ASP   PHI     -66.6   -55.9  5.00
 229 ASP   PSI     -56.1   -26.1  5.00
 230 ASP   PHI     -67.3   -53.0  5.00
 230 ASP   PSI     -47.7   -35.8  5.00
 231 ILE   PHI     -67.9   -61.1  5.00
 231 ILE   PSI     -47.3   -36.4  5.00
 232 LYS   PHI     -65.9   -57.2  5.00
 232 LYS   PSI     -45.6   -32.7  5.00
 233 GLY   PHI     -71.4   -63.2  5.00
 233 GLY   PSI     -49.7   -35.0  5.00
 234 ILE   PHI     -72.4   -65.9  5.00
 234 ILE   PSI     -47.5   -30.9  5.00
 235 GLN   PHI     -76.4   -62.2  5.00
 235 GLN   PSI     -40.4   -24.8  5.00
 236 LYS   PHI     -73.5   -59.8  5.00
 236 LYS   PSI     -42.4   -16.0  5.00
 237 LEU   PHI     -96.9   -71.1  5.00
 237 LEU   PSI     -52.2   -16.2  5.00
 238 TYR   PHI    -129.7   -92.6  5.00
 238 TYR   PSI  -35      20       5.00
# 240 LYS   PHI -140     -80       5.00
# 240 LYS   PSI     111.7   156.8  5.00
 143 HIS   PHI    -109.0   -68.9  5.00
 125 ARG   PSI     117.3   140.2  5.00
 142 ALA   PSI     -23.6    12.9  5.00
 197 GLY   PHI     -83.3   -55.0  5.00
 140 ARG   PSI     149.5   172.8  5.00
# Restraints file 4: 2_dp8_dihre.aco
# Angle restraints from TALOS
# column 1: residue number
# column 2: amino acid
# column 3: angle identifier
# column 4: the angle's lower limit
# column 5: the angle's upper limit

 501 IDS   PHI     -38.7    36.2   # IDS to SGN
 502 SGN   PSI     -50.6    17.8   # SGN to IDS
 502 SGN   PHI     -24.9    43.5   # SGN to IDS
 503 IDS   PSI     -17.8    46.6
 503 IDS   PHI     -38.7    36.2
 504 SGN   PSI     -50.6    17.8
 504 SGN   PHI     -24.9    43.5
 505 IDS   PSI     -17.8    46.6
 505 IDS   PHI     -38.7    36.2
 506 SGN   PSI     -50.6    17.8
 506 SGN   PHI     -24.9    43.5
 507 IDS   PSI     -17.8    46.6
 507 IDS   PHI     -38.7    36.2
 508 SGN   PSI     -50.6    17.8

 601 IDS   PHI     -38.7    36.2   # IDS to SGN
 602 SGN   PSI     -50.6    17.8   # SGN to IDS
 602 SGN   PHI     -24.9    43.5   # SGN to IDS
 603 IDS   PSI     -17.8    46.6
 603 IDS   PHI     -38.7    36.2
 604 SGN   PSI     -50.6    17.8
 604 SGN   PHI     -24.9    43.5
 605 IDS   PSI     -17.8    46.6
 605 IDS   PHI     -38.7    36.2
 606 SGN   PSI     -50.6    17.8
 606 SGN   PHI     -24.9    43.5
 607 IDS   PSI     -17.8    46.6
 607 IDS   PHI     -38.7    36.2
 608 SGN   PSI     -50.6    17.8


Please acknowledge these references in publications where the data from this site have been utilized.

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