Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8rgr_N.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASN 1.A OD1 no hydrogen 3.404 N/A LEU 5.A N ASN 1.A O no hydrogen 2.940 N/A ALA 6.A N PRO 2.A O no hydrogen 2.873 N/A ILE 7.A N ILE 3.A O no hydrogen 2.979 N/A ILE 8.A N THR 4.A O no hydrogen 2.923 N/A TYR 9.A N LEU 5.A O no hydrogen 2.923 N/A PHE 10.A N ALA 6.A O no hydrogen 2.873 N/A THR 11.A N ILE 7.A O no hydrogen 2.967 N/A THR 11.A OG1 ILE 7.A O no hydrogen 2.665 N/A ILE 12.A N ILE 8.A O no hydrogen 2.904 N/A PHE 13.A N TYR 9.A O no hydrogen 2.923 N/A LEU 14.A N PHE 10.A O no hydrogen 2.810 N/A GLY 15.A N THR 11.A O no hydrogen 2.984 N/A ILE 18.A N LEU 14.A O no hydrogen 2.876 N/A THR 19.A N GLY 15.A O no hydrogen 2.967 N/A THR 19.A OG1 GLY 15.A O no hydrogen 2.828 N/A THR 19.A OG1 MET 28.A O no hydrogen 3.407 N/A MET 20.A N PRO 16.A O no hydrogen 2.865 N/A SER 21.A N VAL 17.A O no hydrogen 2.922 N/A SER 21.A OG VAL 17.A O no hydrogen 2.820 N/A SER 22.A OG ILE 18.A O no hydrogen 2.284 N/A LEU 25.A N TRP 83.A O no hydrogen 3.055 N/A MET 26.A N ASN 24.A OD1 no hydrogen 2.709 N/A MET 28.A N ASN 24.A O no hydrogen 2.962 N/A TRP 29.A N LEU 25.A O no hydrogen 2.881 N/A TRP 29.A NE1 SER 66.A O no hydrogen 3.125 N/A VAL 30.A N MET 26.A O no hydrogen 2.908 N/A GLY 31.A N LEU 27.A O no hydrogen 2.942 N/A LEU 32.A N MET 28.A O no hydrogen 3.022 N/A GLU 33.A N TRP 29.A O no hydrogen 2.914 N/A PHE 34.A N VAL 30.A O no hydrogen 2.867 N/A SER 35.A N GLY 31.A O no hydrogen 2.984 N/A SER 35.A OG GLN 133.A OE1 no hydrogen 2.589 N/A LEU 36.A N LEU 32.A O no hydrogen 3.017 N/A LEU 37.A N GLU 33.A O no hydrogen 2.933 N/A ALA 38.A N PHE 34.A O no hydrogen 2.920 N/A ILE 39.A N SER 35.A O no hydrogen 2.977 N/A ILE 39.A N LEU 36.A O no hydrogen 3.201 N/A ILE 40.A N LEU 36.A O no hydrogen 3.107 N/A LEU 43.A N ILE 39.A O no hydrogen 3.163 N/A ILE 44.A N ILE 40.A O no hydrogen 3.002 N/A LYS 47.A N ILE 44.A O no hydrogen 3.093 N/A ASN 48.A N SER 51.A OG no hydrogen 2.809 N/A SER 51.A N ASN 48.A OD1 no hydrogen 2.501 N/A SER 51.A OG ASN 48.A O no hydrogen 2.583 N/A THR 52.A N ASN 48.A O no hydrogen 2.932 N/A THR 52.A OG1 ASN 48.A O no hydrogen 2.882 N/A GLU 53.A N PRO 49.A O no hydrogen 2.933 N/A ALA 54.A N ARG 50.A O no hydrogen 2.894 N/A ALA 55.A N SER 51.A O no hydrogen 2.900 N/A THR 56.A N THR 52.A O no hydrogen 2.936 N/A THR 56.A OG1 THR 52.A O no hydrogen 2.638 N/A LYS 57.A N GLU 53.A O no hydrogen 2.927 N/A LYS 57.A NZ GLU 53.A OE2 no hydrogen 2.699 N/A LYS 57.A NZ GLU 116.A OE1 no hydrogen 2.438 N/A TYR 58.A N ALA 54.A O no hydrogen 2.941 N/A PHE 59.A N ALA 55.A O no hydrogen 2.893 N/A VAL 60.A N THR 56.A O no hydrogen 3.004 N/A THR 61.A N LYS 57.A O no hydrogen 3.001 N/A THR 61.A OG1 LYS 57.A O no hydrogen 2.885 N/A GLN 62.A N TYR 58.A O no hydrogen 2.958 N/A GLN 62.A NE2 LYS 104.A O no hydrogen 3.478 N/A ALA 63.A N PHE 59.A O no hydrogen 2.871 N/A THR 64.A N VAL 60.A O no hydrogen 2.972 N/A THR 64.A OG1 VAL 60.A O no hydrogen 2.620 N/A ALA 65.A N THR 61.A O no hydrogen 3.006 N/A SER 66.A N GLN 62.A O no hydrogen 2.869 N/A SER 66.A OG GLN 62.A O no hydrogen 3.024 N/A SER 66.A OG ALA 63.A O no hydrogen 2.666 N/A MET 67.A N ALA 63.A O no hydrogen 2.928 N/A ILE 68.A N THR 64.A O no hydrogen 3.027 N/A ILE 69.A N ALA 65.A O no hydrogen 2.932 N/A LEU 70.A N SER 66.A O no hydrogen 2.883 N/A LEU 71.A N MET 67.A O no hydrogen 2.907 N/A ALA 72.A N ILE 68.A O no hydrogen 2.982 N/A ILE 73.A N ILE 69.A O no hydrogen 2.931 N/A VAL 74.A N LEU 70.A O no hydrogen 2.908 N/A LEU 75.A N LEU 71.A O no hydrogen 2.900 N/A ASN 76.A N ALA 72.A O no hydrogen 2.937 N/A ASN 76.A ND2 MET 84.A O no hydrogen 3.417 N/A TYR 77.A N ILE 73.A O no hydrogen 2.914 N/A LYS 78.A N VAL 74.A O no hydrogen 2.862 N/A GLN 79.A N LEU 75.A O no hydrogen 2.919 N/A GLN 79.A NE2 GLN 88.A O no hydrogen 3.070 N/A LEU 80.A N ASN 76.A O no hydrogen 2.857 N/A GLY 81.A N TYR 77.A O no hydrogen 2.940 N/A THR 89.A OG1 ASN 76.A OD1 no hydrogen 3.411 N/A ASN 90.A N GLN 79.A OE1 no hydrogen 3.064 N/A LEU 94.A N ASN 90.A O no hydrogen 2.972 N/A ASN 95.A N GLY 91.A O no hydrogen 2.864 N/A MET 96.A N LEU 92.A O no hydrogen 2.924 N/A THR 97.A N ILE 93.A O no hydrogen 2.933 N/A THR 97.A OG1 ILE 93.A O no hydrogen 2.621 N/A LEU 98.A N LEU 94.A O no hydrogen 2.903 N/A MET 99.A N ASN 95.A O no hydrogen 2.873 N/A ALA 100.A N MET 96.A O no hydrogen 2.923 N/A LEU 101.A N THR 97.A O no hydrogen 2.919 N/A SER 102.A N LEU 98.A O no hydrogen 2.872 N/A SER 102.A OG LEU 98.A O no hydrogen 3.084 N/A SER 102.A OG MET 99.A O no hydrogen 2.569 N/A MET 103.A N MET 99.A O no hydrogen 2.948 N/A LYS 104.A N ALA 100.A O no hydrogen 2.926 N/A LEU 105.A N LEU 101.A O no hydrogen 2.868 N/A GLY 106.A N SER 102.A O no hydrogen 2.904 N/A LEU 107.A N SER 102.A O no hydrogen 3.366 N/A PHE 110.A N LEU 107.A O no hydrogen 2.952 N/A HIS 111.A N HIS 111.A ND1 no hydrogen 3.039 N/A LEU 114.A N HIS 111.A O no hydrogen 3.183 N/A VAL 117.A N TRP 113.A O no hydrogen 2.672 N/A THR 118.A N LEU 114.A O no hydrogen 2.904 N/A THR 118.A OG1 LEU 114.A O no hydrogen 2.423 N/A GLN 119.A N PRO 115.A O no hydrogen 2.911 N/A GLN 119.A NE2 GLN 173.A OE1 no hydrogen 3.633 N/A GLY 126.A N PRO 122.A O no hydrogen 2.958 N/A LEU 127.A N LEU 123.A O no hydrogen 2.912 N/A ILE 128.A N HIS 124.A O no hydrogen 2.913 N/A LEU 129.A N MET 125.A O no hydrogen 2.893 N/A LEU 130.A N GLY 126.A O no hydrogen 2.912 N/A THR 131.A N LEU 127.A O no hydrogen 2.983 N/A THR 131.A OG1 LEU 127.A O no hydrogen 2.417 N/A TRP 132.A N ILE 128.A O no hydrogen 2.873 N/A TRP 132.A NE1 ILE 12.A O no hydrogen 2.889 N/A GLN 133.A N LEU 129.A O no hydrogen 2.983 N/A LYS 134.A NZ SER 182.A OG no hydrogen 3.009 N/A ILE 135.A N TRP 132.A O no hydrogen 3.384 N/A LEU 138.A N LYS 134.A O no hydrogen 3.258 N/A SER 139.A N ILE 135.A O no hydrogen 2.793 N/A SER 139.A OG ILE 135.A O no hydrogen 3.511 N/A SER 139.A OG ALA 136.A O no hydrogen 2.427 N/A ILE 140.A N ALA 136.A O no hydrogen 2.976 N/A LEU 141.A N PRO 137.A O no hydrogen 2.936 N/A ILE 142.A N LEU 138.A O no hydrogen 2.847 N/A GLN 143.A N SER 139.A O no hydrogen 2.961 N/A ILE 144.A N LEU 141.A O no hydrogen 3.294 N/A TYR 145.A N ILE 142.A O no hydrogen 3.342 N/A LEU 147.A N ILE 144.A O no hydrogen 3.187 N/A ILE 153.A N ASN 149.A O no hydrogen 2.972 N/A LEU 154.A N SER 150.A O no hydrogen 2.841 N/A MET 155.A N THR 151.A O no hydrogen 2.950 N/A LEU 156.A N ILE 152.A O no hydrogen 2.933 N/A ALA 157.A N ILE 153.A O no hydrogen 2.866 N/A ILE 158.A N LEU 154.A O no hydrogen 2.896 N/A THR 159.A N MET 155.A O no hydrogen 3.010 N/A SER 160.A N LEU 156.A O no hydrogen 2.892 N/A SER 160.A OG ILE 183.A O no hydrogen 2.504 N/A ILE 161.A N ALA 157.A O no hydrogen 2.959 N/A PHE 162.A N ILE 158.A O no hydrogen 2.969 N/A MET 163.A N THR 159.A O no hydrogen 2.921 N/A GLY 164.A N SER 160.A O no hydrogen 2.893 N/A ALA 165.A N ILE 161.A O no hydrogen 2.951 N/A TRP 166.A N PHE 162.A O no hydrogen 3.008 N/A GLY 167.A N MET 163.A O no hydrogen 2.890 N/A GLY 168.A N GLY 164.A O no hydrogen 2.930 N/A LEU 169.A N ALA 165.A O no hydrogen 2.937 N/A ASN 170.A N TRP 166.A O no hydrogen 2.998 N/A GLN 171.A N GLY 167.A O no hydrogen 2.971 N/A GLN 173.A NE2 THR 172.A OG1 no hydrogen 3.213 N/A MET 174.A N MET 224.A O no hydrogen 2.900 N/A ARG 175.A NH1 ILE 121.A O no hydrogen 2.843 N/A ILE 177.A N GLN 173.A O no hydrogen 2.930 N/A MET 178.A N MET 174.A O no hydrogen 2.911 N/A ALA 179.A N ARG 175.A O no hydrogen 2.917 N/A TYR 180.A N LYS 176.A O no hydrogen 2.948 N/A SER 181.A N ILE 177.A O no hydrogen 2.929 N/A SER 181.A OG TYR 292.A OH no hydrogen 2.468 N/A SER 182.A N MET 178.A O no hydrogen 2.886 N/A ILE 183.A N ALA 179.A O no hydrogen 2.931 N/A ALA 184.A N TYR 180.A O no hydrogen 2.981 N/A HIS 185.A N SER 181.A O no hydrogen 2.976 N/A HIS 185.A ND1 SER 181.A O no hydrogen 2.688 N/A MET 186.A N SER 182.A O no hydrogen 2.855 N/A GLY 187.A N ILE 183.A O no hydrogen 2.927 N/A TRP 188.A N ALA 184.A O no hydrogen 3.026 N/A MET 189.A N HIS 185.A O no hydrogen 2.944 N/A LEU 190.A N MET 186.A O no hydrogen 2.903 N/A ALA 191.A N GLY 187.A O no hydrogen 2.903 N/A ILE 192.A N TRP 188.A O no hydrogen 3.047 N/A LEU 193.A N LEU 190.A O no hydrogen 3.166 N/A ASN 196.A N ILE 192.A O no hydrogen 3.146 N/A LEU 199.A N ASN 196.A O no hydrogen 3.167 N/A THR 200.A OG1 MET 189.A O no hydrogen 3.395 N/A LEU 201.A N PRO 197.A O no hydrogen 2.932 N/A LEU 202.A N SER 198.A O no hydrogen 2.906 N/A ASN 203.A N LEU 199.A O no hydrogen 2.892 N/A LEU 204.A N THR 200.A O no hydrogen 2.901 N/A MET 205.A N LEU 201.A O no hydrogen 2.905 N/A ILE 206.A N LEU 202.A O no hydrogen 2.938 N/A TYR 207.A N ASN 203.A O no hydrogen 2.870 N/A ILE 208.A N LEU 204.A O no hydrogen 2.891 N/A ILE 209.A N MET 205.A O no hydrogen 2.949 N/A LEU 210.A N ILE 206.A O no hydrogen 2.928 N/A THR 211.A N TYR 207.A O no hydrogen 2.830 N/A THR 211.A OG1 TYR 207.A O no hydrogen 2.318 N/A ALA 212.A N ILE 208.A O no hydrogen 2.927 N/A PHE 215.A N THR 211.A O no hydrogen 3.034 N/A MET 216.A N ALA 212.A O no hydrogen 2.932 N/A ALA 217.A N PRO 213.A O no hydrogen 2.844 N/A LEU 218.A N MET 214.A O no hydrogen 2.960 N/A MET 219.A N PHE 215.A O no hydrogen 2.828 N/A LEU 220.A N ALA 217.A O no hydrogen 3.405 N/A SER 223.A N LEU 218.A O no hydrogen 3.298 N/A THR 225.A OG1 SER 228.A OG no hydrogen 3.021 N/A SER 228.A OG THR 225.A OG1 no hydrogen 3.021 N/A ILE 229.A N THR 225.A O no hydrogen 2.929 N/A SER 230.A N ASN 227.A O no hydrogen 2.877 N/A SER 230.A OG ASN 227.A O no hydrogen 2.484 N/A LEU 231.A N ASN 227.A O no hydrogen 3.050 N/A TRP 233.A NE1 PHE 304.A O no hydrogen 2.837 N/A ASN 234.A N LEU 231.A O no hydrogen 3.321 N/A ASN 234.A ND2 THR 306.A OG1 no hydrogen 2.722 N/A THR 236.A N LEU 232.A O no hydrogen 2.802 N/A MET 239.A N THR 236.A O no hydrogen 3.438 N/A ILE 243.A N MET 239.A O no hydrogen 2.893 N/A SER 244.A N LEU 240.A O no hydrogen 2.914 N/A SER 244.A OG LEU 240.A O no hydrogen 2.534 N/A SER 244.A OG SER 300.A OG no hydrogen 2.961 N/A LEU 245.A N THR 241.A O no hydrogen 2.903 N/A MET 246.A N MET 242.A O no hydrogen 2.893 N/A LEU 247.A N ILE 243.A O no hydrogen 2.919 N/A LEU 248.A N SER 244.A O no hydrogen 2.915 N/A SER 249.A N LEU 245.A O no hydrogen 2.887 N/A SER 249.A OG SER 332.A O no hydrogen 2.863 N/A LEU 250.A N MET 246.A O no hydrogen 2.888 N/A GLY 251.A N LEU 247.A O no hydrogen 2.923 N/A GLY 252.A N SER 249.A O no hydrogen 3.099 N/A LEU 253.A N LEU 248.A O no hydrogen 3.223 N/A LEU 256.A N LEU 253.A O no hydrogen 3.022 N/A THR 257.A N THR 333.A O no hydrogen 3.438 N/A GLY 258.A N SER 249.A OG no hydrogen 2.889 N/A PHE 259.A N LEU 256.A O no hydrogen 3.227 N/A LEU 260.A N THR 257.A O no hydrogen 3.237 N/A TRP 263.A N PHE 259.A O no hydrogen 2.899 N/A ILE 264.A N LEU 260.A O no hydrogen 2.909 N/A ILE 265.A N PRO 261.A O no hydrogen 2.916 N/A ILE 266.A N LYS 262.A O no hydrogen 2.917 N/A THR 267.A N TRP 263.A O no hydrogen 2.922 N/A THR 267.A OG1 TRP 263.A O no hydrogen 2.749 N/A GLU 268.A N ILE 264.A O no hydrogen 2.941 N/A LEU 269.A N ILE 265.A O no hydrogen 2.947 N/A MET 270.A N ILE 266.A O no hydrogen 2.875 N/A LYS 271.A N THR 267.A O no hydrogen 2.926 N/A ASN 272.A N GLU 268.A O no hydrogen 2.975 N/A ASN 272.A ND2 GLU 268.A O no hydrogen 2.630 N/A ASN 273.A N MET 270.A O no hydrogen 3.269 N/A CYS 274.A N LEU 269.A O no hydrogen 3.087 N/A CYS 274.A SG LEU 269.A O no hydrogen 3.166 N/A ALA 278.A N CYS 274.A O no hydrogen 2.936 N/A THR 279.A N LEU 275.A O no hydrogen 2.903 N/A THR 279.A OG1 LEU 275.A O no hydrogen 2.785 N/A THR 279.A OG1 ILE 276.A O no hydrogen 2.732 N/A LEU 280.A N ILE 276.A O no hydrogen 3.000 N/A MET 281.A N MET 277.A O no hydrogen 2.935 N/A ALA 282.A N ALA 278.A O no hydrogen 2.923 N/A MET 283.A N THR 279.A O no hydrogen 2.981 N/A MET 284.A N LEU 280.A O no hydrogen 3.029 N/A ALA 285.A N MET 281.A O no hydrogen 2.885 N/A LEU 286.A N ALA 282.A O no hydrogen 2.954 N/A LEU 287.A N MET 283.A O no hydrogen 3.095 N/A ASN 288.A N MET 284.A O no hydrogen 2.978 N/A LEU 289.A N ALA 285.A O no hydrogen 2.921 N/A PHE 290.A N LEU 286.A O no hydrogen 2.912 N/A PHE 291.A N LEU 287.A O no hydrogen 3.165 N/A TYR 292.A N ASN 288.A O no hydrogen 3.042 N/A TYR 292.A OH SER 181.A OG no hydrogen 2.468 N/A THR 293.A N LEU 289.A O no hydrogen 2.863 N/A THR 293.A OG1 LEU 289.A O no hydrogen 2.373 N/A ARG 294.A N PHE 290.A O no hydrogen 2.956 N/A ARG 294.A NH2 LEU 169.A O no hydrogen 2.368 N/A LEU 295.A N PHE 291.A O no hydrogen 3.036 N/A ILE 296.A N TYR 292.A O no hydrogen 2.920 N/A TYR 297.A N THR 293.A O no hydrogen 2.881 N/A SER 298.A N ARG 294.A O no hydrogen 2.991 N/A SER 298.A OG ARG 294.A O no hydrogen 3.364 N/A SER 298.A OG LEU 295.A O no hydrogen 2.439 N/A THR 299.A N LEU 295.A O no hydrogen 2.970 N/A THR 299.A OG1 ILE 229.A O no hydrogen 2.695 N/A SER 300.A N ILE 296.A O no hydrogen 2.887 N/A SER 300.A OG SER 244.A OG no hydrogen 2.961 N/A LEU 301.A N ILE 296.A O no hydrogen 3.329 N/A THR 302.A N TYR 297.A O no hydrogen 3.336 N/A THR 302.A OG1 TYR 297.A O no hydrogen 2.250 N/A THR 306.A OG1 ASN 307.A O no hydrogen 3.405 N/A SER 310.A OG THR 306.A OG1 no hydrogen 3.258 N/A LYS 311.A N ASN 308.A O no hydrogen 3.275 N/A MET 313.A N ASN 309.A O no hydrogen 3.013 N/A THR 314.A N SER 310.A O no hydrogen 2.878 N/A THR 314.A OG1 SER 310.A O no hydrogen 3.202 N/A THR 314.A OG1 LYS 311.A O no hydrogen 2.470 N/A HIS 315.A N LYS 311.A O no hydrogen 2.916 N/A HIS 315.A ND1 LYS 311.A O no hydrogen 2.321 N/A GLN 316.A N MET 312.A O no hydrogen 2.998 N/A ASN 322.A N ASN 322.A OD1 no hydrogen 2.589 N/A PHE 325.A N ASN 322.A O no hydrogen 3.449 N/A LEU 328.A N MET 324.A O no hydrogen 3.377 N/A ALA 329.A N PHE 325.A O no hydrogen 2.929 N/A ILE 330.A N SER 326.A O no hydrogen 2.913 N/A MET 331.A N THR 327.A O no hydrogen 2.919 N/A SER 332.A N LEU 328.A O no hydrogen 2.895 N/A SER 332.A OG ILE 209.A O no hydrogen 3.405 N/A SER 332.A OG LEU 328.A O no hydrogen 2.640 N/A SER 332.A OG ALA 329.A O no hydrogen 3.005 N/A THR 333.A N ILE 330.A O no hydrogen 3.102 N/A THR 333.A OG1 ALA 329.A O no hydrogen 2.663 N/A MET 334.A N ILE 330.A O no hydrogen 2.901 N/A THR 335.A OG1 MET 331.A O no hydrogen 2.324 N/A LEU 338.A N THR 335.A O no hydrogen 3.288 N/A ALA 339.A N LEU 336.A O no hydrogen 2.980 N/A LEU 342.A N LEU 338.A O no hydrogen 2.914 N/A ILE 343.A N ALA 339.A O no hydrogen 2.948 N/A