Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6hup_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A N MET 2.A O no hydrogen 2.960 N/A LYS 6.A NZ ASP 10.A OD2 no hydrogen 3.075 N/A GLU 7.A N SER 3.A O no hydrogen 2.916 N/A THR 8.A N PHE 4.A O no hydrogen 3.052 N/A THR 8.A OG1 PHE 4.A O no hydrogen 3.193 N/A THR 8.A OG1 VAL 5.A O no hydrogen 2.576 N/A VAL 9.A N VAL 5.A O no hydrogen 2.969 N/A ASP 10.A N LYS 6.A O no hydrogen 2.988 N/A LYS 11.A N GLU 7.A O no hydrogen 2.975 N/A LEU 12.A N THR 8.A O no hydrogen 2.975 N/A LEU 13.A N VAL 9.A O no hydrogen 2.990 N/A LYS 14.A N ASP 10.A O no hydrogen 3.321 N/A TYR 16.A OH ASP 62.A OD2 no hydrogen 2.808 N/A ARG 19.A N ASP 17.A OD1 no hydrogen 3.394 N/A ARG 19.A NE ASP 17.A OD1 no hydrogen 3.468 N/A ARG 21.A NH1 PRO 27.A O no hydrogen 3.100 N/A GLY 26.A N ASP 23.A O no hydrogen 3.036 N/A VAL 29.A N ASP 156.A O no hydrogen 3.004 N/A CYS 30.A SG GLU 158.A OE1 no hydrogen 3.290 N/A VAL 31.A N GLU 158.A O no hydrogen 2.610 N/A GLY 32.A N TYR 59.A O no hydrogen 2.599 N/A MET 33.A N TYR 160.A O no hydrogen 2.722 N/A ASP 36.A N TYR 55.A O no hydrogen 2.885 N/A ILE 37.A N THR 169.A O no hydrogen 3.358 N/A ALA 38.A N THR 53.A O no hydrogen 2.876 N/A SER 39.A N THR 53.A O no hydrogen 3.178 N/A SER 39.A OG ASP 41.A OD1 no hydrogen 2.595 N/A ASP 41.A N THR 51.A O no hydrogen 2.789 N/A SER 44.A N ASP 49.A O no hydrogen 3.045 N/A SER 44.A OG ASN 47.A OD1 no hydrogen 3.539 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.884 N/A ASN 47.A N SER 44.A OG no hydrogen 3.072 N/A ASP 49.A N SER 44.A O no hydrogen 3.263 N/A TYR 50.A N ALA 127.A O no hydrogen 2.847 N/A TYR 50.A OH THR 144.A O no hydrogen 3.187 N/A THR 51.A N MET 42.A O no hydrogen 3.001 N/A LEU 52.A N THR 125.A O no hydrogen 2.763 N/A THR 53.A N SER 39.A O no hydrogen 2.947 N/A THR 53.A OG1 ASP 41.A OD2 no hydrogen 3.161 N/A THR 53.A OG1 THR 124.A OG1 no hydrogen 3.022 N/A MET 54.A N ILE 123.A O no hydrogen 2.653 N/A TYR 55.A N ASP 36.A O no hydrogen 2.558 N/A PHE 56.A N LEU 121.A O no hydrogen 2.738 N/A GLN 57.A N ASN 34.A O no hydrogen 2.773 N/A GLN 58.A N TYR 119.A O no hydrogen 3.078 N/A TYR 59.A N GLY 32.A O no hydrogen 3.040 N/A TRP 60.A N VAL 117.A O no hydrogen 3.264 N/A ARG 64.A NH1 ASP 17.A O no hydrogen 3.105 N/A ARG 64.A NH2 LEU 20.A O no hydrogen 2.848 N/A LEU 65.A N ASP 62.A O no hydrogen 2.859 N/A TYR 67.A OH LEU 72.A O no hydrogen 2.640 N/A LEU 74.A N TYR 67.A OH no hydrogen 3.344 N/A LEU 76.A N ILE 109.A O no hydrogen 3.006 N/A ASN 78.A ND2 LYS 105.A O no hydrogen 2.400 N/A ARG 79.A N ASP 77.A OD2 no hydrogen 3.046 N/A VAL 80.A N ASP 77.A O no hydrogen 3.324 N/A ALA 81.A N ASN 78.A O no hydrogen 3.325 N/A GLN 83.A N VAL 80.A O no hydrogen 2.834 N/A TRP 85.A N TYR 16.A OH no hydrogen 3.341 N/A THR 89.A N PRO 87.A O no hydrogen 2.828 N/A TYR 90.A N GLU 148.A O no hydrogen 2.762 N/A LEU 92.A N GLU 146.A O no hydrogen 3.119 N/A ASN 93.A ND2 ALA 128.A O no hydrogen 3.276 N/A ASP 94.A N PHE 91.A O no hydrogen 3.226 N/A LYS 95.A N THR 126.A O no hydrogen 3.139 N/A LYS 95.A NZ ASN 47.A O no hydrogen 2.913 N/A SER 97.A OG ASP 94.A OD1 no hydrogen 3.292 N/A SER 97.A OG ASP 94.A OD2 no hydrogen 3.417 N/A PHE 98.A N THR 124.A O no hydrogen 3.303 N/A HIS 100.A N ARG 122.A O no hydrogen 3.481 N/A HIS 100.A NE2 THR 124.A OG1 no hydrogen 2.377 N/A ASN 106.A N HIS 100.A O no hydrogen 3.310 N/A ARG 107.A N LYS 105.A O no hydrogen 2.995 N/A ARG 107.A NH1 ASP 82.A OD1 no hydrogen 3.183 N/A MET 108.A N GLY 120.A O no hydrogen 3.183 N/A ARG 110.A N LEU 118.A O no hydrogen 3.209 N/A LEU 111.A N LEU 74.A O no hydrogen 2.828 N/A HIS 112.A N THR 116.A O no hydrogen 2.729 N/A HIS 112.A ND1 ASN 73.A OD1 no hydrogen 2.638 N/A GLY 115.A N HIS 112.A O no hydrogen 2.878 N/A THR 116.A N ASP 114.A OD1 no hydrogen 3.196 N/A THR 116.A OG1 ASP 114.A OD1 no hydrogen 3.009 N/A THR 116.A OG1 ASP 114.A OD2 no hydrogen 3.330 N/A VAL 117.A N TRP 60.A O no hydrogen 2.783 N/A LEU 118.A N ARG 110.A O no hydrogen 3.440 N/A TYR 119.A N GLN 58.A O no hydrogen 3.040 N/A LEU 121.A N PHE 56.A O no hydrogen 2.629 N/A ILE 123.A N MET 54.A O no hydrogen 2.862 N/A THR 124.A N PHE 98.A O no hydrogen 3.335 N/A THR 124.A OG1 THR 53.A OG1 no hydrogen 3.022 N/A THR 124.A OG1 HIS 100.A NE2 no hydrogen 2.377 N/A THR 125.A N LEU 52.A O no hydrogen 2.723 N/A THR 125.A OG1 ASP 94.A OD1 no hydrogen 2.414 N/A THR 126.A OG1 LYS 96.A O no hydrogen 3.129 N/A ALA 127.A N TYR 50.A O no hydrogen 2.896 N/A ALA 128.A N ASN 93.A O no hydrogen 2.814 N/A CYS 129.A N MET 48.A O no hydrogen 3.201 N/A LEU 133.A N TYR 270.A OH no hydrogen 2.942 N/A LEU 138.A N ARG 135.A O no hydrogen 2.664 N/A THR 144.A OG1 LEU 145.A O no hydrogen 3.551 N/A THR 144.A OG1 GLU 146.A OE2 no hydrogen 2.590 N/A LEU 145.A N LEU 203.A O no hydrogen 3.037 N/A ILE 147.A N LEU 201.A O no hydrogen 2.721 N/A GLU 148.A N TYR 90.A O no hydrogen 3.103 N/A SER 149.A OG ASP 88.A OD1 no hydrogen 3.263 N/A SER 149.A OG TYR 152.A O no hydrogen 3.454 N/A GLY 151.A N ASP 88.A OD2 no hydrogen 3.289 N/A THR 154.A N ALA 197.A O no hydrogen 2.499 N/A ASP 155.A N THR 153.A OG1 no hydrogen 3.370 N/A ASP 156.A N THR 153.A O no hydrogen 3.269 N/A ILE 157.A N THR 153.A O no hydrogen 3.137 N/A GLU 158.A N VAL 29.A O no hydrogen 2.714 N/A TYR 160.A N VAL 31.A O no hydrogen 2.995 N/A ARG 162.A N MET 33.A O no hydrogen 2.868 N/A LYS 166.A N GLY 163.A O no hydrogen 2.747 N/A THR 169.A N ILE 35.A O no hydrogen 3.279 N/A SER 180.A N LYS 208.A O no hydrogen 2.989 N/A ARG 185.A N SER 204.A O no hydrogen 2.911 N/A VAL 187.A N SER 202.A O no hydrogen 3.486 N/A ARG 189.A N ARG 200.A O no hydrogen 3.116 N/A VAL 191.A N TYR 198.A O no hydrogen 2.852 N/A PHE 193.A N GLY 196.A O no hydrogen 3.001 N/A THR 195.A OG1 TYR 198.A OH no hydrogen 2.560 N/A TYR 198.A N VAL 191.A O no hydrogen 3.351 N/A TYR 198.A OH THR 195.A OG1 no hydrogen 2.560 N/A ARG 200.A N ARG 189.A O no hydrogen 2.813 N/A ARG 200.A NE GLU 148.A OE1 no hydrogen 2.739 N/A ARG 200.A NH2 GLU 148.A OE1 no hydrogen 2.669 N/A ARG 200.A NH2 GLU 148.A OE2 no hydrogen 3.546 N/A LEU 201.A N ILE 147.A O no hydrogen 2.726 N/A SER 202.A N VAL 187.A O no hydrogen 3.132 N/A SER 202.A OG VAL 187.A O no hydrogen 3.021 N/A LEU 203.A N LEU 145.A O no hydrogen 2.857 N/A PHE 205.A N CYS 143.A O no hydrogen 3.120 N/A ARG 206.A N GLU 183.A O no hydrogen 2.863 N/A ARG 206.A NE GLU 183.A OE2 no hydrogen 3.326 N/A LEU 207.A N GLN 141.A O no hydrogen 3.042 N/A LYS 208.A N SER 180.A O no hydrogen 3.155 N/A ARG 209.A N ASP 139.A O no hydrogen 3.186 N/A ARG 209.A NE ASP 139.A OD1 no hydrogen 2.846 N/A ARG 209.A NH1 GLU 45.A OE2 no hydrogen 2.921 N/A ARG 209.A NH2 GLU 45.A OE2 no hydrogen 2.569 N/A ASN 210.A N GLN 178.A O no hydrogen 3.045 N/A PHE 214.A N ILE 211.A O no hydrogen 3.074 N/A ILE 215.A N ILE 211.A O no hydrogen 3.141 N/A LEU 216.A N GLY 212.A O no hydrogen 3.209 N/A GLN 217.A NE2 TYR 213.A OH no hydrogen 3.253 N/A THR 218.A N PHE 214.A O no hydrogen 2.934 N/A THR 218.A OG1 PHE 214.A O no hydrogen 2.541 N/A TYR 219.A N PHE 214.A O no hydrogen 2.758 N/A TYR 219.A OH TYR 331.A OH no hydrogen 2.855 N/A MET 220.A N ILE 215.A O no hydrogen 3.363 N/A SER 222.A N THR 218.A O no hydrogen 3.218 N/A ILE 223.A N TYR 219.A O no hydrogen 2.976 N/A LEU 224.A N MET 220.A O no hydrogen 3.076 N/A ILE 225.A N PRO 221.A O no hydrogen 2.892 N/A THR 226.A N SER 222.A O no hydrogen 3.042 N/A THR 226.A OG1 SER 222.A O no hydrogen 2.469 N/A ILE 227.A N ILE 223.A O no hydrogen 2.935 N/A LEU 228.A N LEU 224.A O no hydrogen 3.005 N/A SER 229.A N ILE 225.A O no hydrogen 2.964 N/A SER 229.A OG THR 226.A O no hydrogen 2.275 N/A TRP 230.A N ILE 227.A O no hydrogen 2.753 N/A SER 232.A OG SER 229.A O no hydrogen 3.209 N/A TRP 234.A N VAL 231.A O no hydrogen 3.183 N/A TYR 237.A N ASN 236.A OD1 no hydrogen 2.725 N/A ALA 239.A N ASN 236.A O no hydrogen 3.172 N/A SER 240.A OG TYR 292.A OH no hydrogen 2.606 N/A ARG 243.A N ALA 239.A O no hydrogen 3.355 N/A ARG 243.A NE SER 232.A O no hydrogen 2.688 N/A VAL 244.A N SER 240.A O no hydrogen 2.966 N/A LEU 246.A N ALA 242.A O no hydrogen 2.969 N/A GLY 247.A N ARG 243.A O no hydrogen 3.085 N/A ILE 248.A N VAL 244.A O no hydrogen 2.917 N/A THR 249.A N ALA 245.A O no hydrogen 3.082 N/A THR 249.A OG1 ALA 245.A O no hydrogen 2.762 N/A THR 250.A N LEU 246.A O no hydrogen 2.979 N/A THR 250.A OG1 LEU 246.A O no hydrogen 2.301 N/A VAL 251.A N GLY 247.A O no hydrogen 3.024 N/A LEU 252.A N ILE 248.A O no hydrogen 3.012 N/A THR 253.A N THR 249.A O no hydrogen 2.958 N/A THR 253.A OG1 THR 249.A O no hydrogen 2.819 N/A MET 254.A N THR 250.A O no hydrogen 3.086 N/A THR 255.A N VAL 251.A O no hydrogen 3.090 N/A THR 255.A OG1 VAL 251.A O no hydrogen 2.666 N/A THR 256.A N LEU 252.A O no hydrogen 2.968 N/A THR 256.A OG1 LEU 252.A O no hydrogen 3.408 N/A THR 256.A OG1 THR 253.A O no hydrogen 2.851 N/A ILE 257.A N THR 253.A O no hydrogen 2.988 N/A ASN 258.A N MET 254.A O no hydrogen 3.018 N/A THR 259.A N THR 255.A O no hydrogen 2.986 N/A THR 259.A OG1 THR 256.A O no hydrogen 2.651 N/A THR 259.A OG1 HIS 260.A ND1 no hydrogen 3.166 N/A HIS 260.A ND1 THR 256.A O no hydrogen 3.057 N/A LEU 261.A N ILE 257.A O no hydrogen 3.082 N/A ARG 262.A N ASN 258.A O no hydrogen 2.919 N/A GLU 263.A N THR 259.A O no hydrogen 3.140 N/A THR 264.A N HIS 260.A O no hydrogen 3.121 N/A THR 264.A OG1 HIS 260.A O no hydrogen 3.402 N/A LYS 272.A N ASP 275.A OD2 no hydrogen 3.410 N/A LYS 272.A NZ ASP 275.A OD1 no hydrogen 3.309 N/A LYS 272.A NZ ASP 275.A OD2 no hydrogen 2.479 N/A LEU 278.A N ILE 274.A O no hydrogen 3.435 N/A MET 279.A N ASP 275.A O no hydrogen 2.903 N/A GLY 280.A N MET 276.A O no hydrogen 3.024 N/A CYS 281.A N TYR 277.A O no hydrogen 2.903 N/A CYS 281.A SG SER 222.A OG no hydrogen 3.312 N/A CYS 281.A SG TYR 277.A O no hydrogen 3.230 N/A PHE 282.A N LEU 278.A O no hydrogen 2.842 N/A VAL 283.A N MET 279.A O no hydrogen 2.977 N/A PHE 284.A N GLY 280.A O no hydrogen 3.036 N/A VAL 285.A N CYS 281.A O no hydrogen 3.139 N/A PHE 286.A N PHE 282.A O no hydrogen 2.865 N/A LEU 287.A N VAL 283.A O no hydrogen 2.783 N/A ALA 288.A N PHE 284.A O no hydrogen 2.953 N/A LEU 289.A N VAL 285.A O no hydrogen 3.038 N/A LEU 290.A N PHE 286.A O no hydrogen 2.908 N/A GLU 291.A N LEU 287.A O no hydrogen 3.008 N/A TYR 292.A OH TYR 237.A O no hydrogen 3.161 N/A TYR 292.A OH SER 240.A OG no hydrogen 2.606 N/A ALA 293.A N LEU 289.A O no hydrogen 3.202 N/A PHE 294.A N LEU 290.A O no hydrogen 2.817 N/A VAL 295.A N GLU 291.A O no hydrogen 2.852 N/A ASN 296.A N TYR 292.A O no hydrogen 2.848 N/A TYR 297.A N ALA 293.A O no hydrogen 3.035 N/A ILE 298.A N PHE 294.A O no hydrogen 3.063 N/A PHE 299.A N VAL 295.A O no hydrogen 2.912 N/A PHE 300.A N ASN 296.A O no hydrogen 2.919 N/A GLY 301.A N TYR 297.A O no hydrogen 3.107 N/A ARG 302.A N TYR 297.A O no hydrogen 3.050 N/A ARG 302.A N ILE 298.A O no hydrogen 3.192 N/A ARG 306.A N GLY 303.A O no hydrogen 2.851 N/A VAL 309.A N ASP 308.A OD1 no hydrogen 2.597 N/A ASN 310.A N ASP 308.A OD1 no hydrogen 3.267 N/A ASP 313.A N VAL 309.A O no hydrogen 3.000 N/A ARG 314.A N ASN 310.A O no hydrogen 2.935 N/A TRP 315.A N ALA 311.A O no hydrogen 2.920 N/A SER 316.A N ILE 312.A O no hydrogen 2.813 N/A SER 316.A OG ILE 312.A O no hydrogen 2.939 N/A ARG 317.A N ASP 313.A O no hydrogen 3.008 N/A ARG 317.A NE PHE 233.A O no hydrogen 3.327 N/A ARG 317.A NH2 PHE 233.A O no hydrogen 2.684 N/A ILE 318.A N ARG 314.A O no hydrogen 3.166 N/A VAL 319.A N TRP 315.A O no hydrogen 2.922 N/A PHE 320.A N SER 316.A O no hydrogen 2.951 N/A THR 323.A N VAL 319.A O no hydrogen 2.654 N/A THR 323.A OG1 VAL 319.A O no hydrogen 2.621 N/A PHE 324.A N PHE 320.A O no hydrogen 2.982 N/A SER 325.A N PRO 321.A O no hydrogen 3.025 N/A LEU 326.A N PHE 322.A O no hydrogen 3.033 N/A PHE 327.A N THR 323.A O no hydrogen 2.899 N/A ASN 328.A N PHE 324.A O no hydrogen 2.991 N/A LEU 329.A N SER 325.A O no hydrogen 2.892 N/A VAL 330.A N LEU 326.A O no hydrogen 2.922 N/A TYR 331.A N PHE 327.A O no hydrogen 2.848 N/A TYR 331.A OH TYR 219.A OH no hydrogen 2.855 N/A TYR 331.A OH ALA 273.A O no hydrogen 2.868 N/A TRP 332.A N ASN 328.A O no hydrogen 2.999 N/A LEU 333.A N LEU 329.A O no hydrogen 3.138 N/A