Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1htr_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 7.A N GLU 5.A OE2 no hydrogen 2.971 N/A ALA 8.A N GLU 5.A O no hydrogen 2.578 N/A TYR 9.A N PRO 6.A O no hydrogen 2.929 N/A TYR 9.A OH ASP 32.A OD2 no hydrogen 2.609 N/A ALA 12.A N TYR 9.A O no hydrogen 3.305 N/A TYR 14.A OH SER 156.A O no hydrogen 3.414 N/A TYR 14.A OH GLN 159.A OE1 no hydrogen 3.030 N/A GLY 16.A N VAL 29.A O no hydrogen 3.075 N/A ILE 18.A N PHE 27.A O no hydrogen 2.991 N/A SER 19.A N THR 90.A O no hydrogen 2.967 N/A SER 19.A OG ASN 26.A OD1 no hydrogen 2.505 N/A ILE 20.A N GLN 25.A O no hydrogen 2.850 N/A GLY 21.A N THR 88.A O no hydrogen 2.917 N/A THR 22.A N SER 61.A OG no hydrogen 3.079 N/A THR 22.A OG1 THR 63.A OG1 no hydrogen 2.728 N/A GLN 25.A N ILE 20.A O no hydrogen 2.853 N/A GLN 25.A NE2 ASN 57.A O no hydrogen 2.887 N/A PHE 27.A N ILE 18.A O no hydrogen 2.989 N/A LEU 28.A N ASP 118.A OD2 no hydrogen 2.782 N/A VAL 29.A N GLY 16.A O no hydrogen 2.695 N/A LEU 30.A N GLY 119.A O no hydrogen 3.201 N/A ASP 32.A N MET 121.A O no hydrogen 3.062 N/A THR 33.A N THR 218.A OG1 no hydrogen 2.989 N/A THR 33.A OG1 VAL 216.A O no hydrogen 2.847 N/A THR 33.A OG1 THR 218.A OG1 no hydrogen 3.411 N/A GLY 34.A N ASP 32.A OD1 no hydrogen 2.895 N/A SER 35.A N ASP 32.A O no hydrogen 3.366 N/A SER 35.A OG ASP 32.A OD2 no hydrogen 2.648 N/A TRP 39.A N ILE 120.A O no hydrogen 3.037 N/A VAL 40.A N GLY 102.A O no hydrogen 3.077 N/A SER 42.A N SER 104.A O no hydrogen 3.285 N/A SER 42.A OG SER 104.A O no hydrogen 2.860 N/A VAL 43.A N PHE 56.A O no hydrogen 2.903 N/A TYR 44.A N SER 42.A OG no hydrogen 3.134 N/A CYS 45.A N SER 42.A O no hydrogen 2.884 N/A CYS 45.A SG GLU 107.A OE1.A no hydrogen 3.563 N/A SER 47.A OG GLU 107.A OE1.A no hydrogen 2.556 N/A SER 47.A OG GLU 107.A OE1.B no hydrogen 2.714 N/A CYS 50.A N SER 47.A OG no hydrogen 3.195 N/A THR 51.A N SER 47.A O no hydrogen 2.832 N/A THR 51.A OG1 SER 47.A O no hydrogen 3.256 N/A THR 51.A OG1 GLN 48.A O no hydrogen 3.313 N/A SER 52.A N GLN 48.A O no hydrogen 3.015 N/A SER 52.A OG GLN 48.A O no hydrogen 3.236 N/A SER 52.A OG ALA 49.A O no hydrogen 2.895 N/A HIS 53.A N CYS 50.A O no hydrogen 2.777 N/A HIS 53.A ND1 ASP 118.A OD1 no hydrogen 3.204 N/A HIS 53.A NE2 PHE 112.A O no hydrogen 2.789 N/A SER 54.A N ASP 118.A OD1 no hydrogen 3.088 N/A ARG 55.A NH1 CYS 45.A O no hydrogen 2.734 N/A PHE 56.A N PRO 41.A O no hydrogen 2.860 N/A ASN 57.A N GLN 25.A OE1 no hydrogen 2.870 N/A SER 59.A N ASN 57.A OD1 no hydrogen 3.029 N/A SER 59.A OG ASN 57.A OD1 no hydrogen 2.703 N/A GLU 60.A N ASN 57.A O no hydrogen 3.076 N/A SER 61.A N PRO 58.A O no hydrogen 3.037 N/A SER 61.A OG ASP 87.A OD1 no hydrogen 3.521 N/A SER 61.A OG ASP 87.A OD2 no hydrogen 2.715 N/A SER 62.A N THR 22.A O no hydrogen 2.944 N/A SER 62.A OG THR 22.A O no hydrogen 3.501 N/A THR 63.A N SER 61.A OG no hydrogen 3.341 N/A THR 63.A OG1 THR 22.A OG1 no hydrogen 2.728 N/A THR 63.A OG1 SER 61.A OG no hydrogen 3.358 N/A THR 63.A OG1 ASP 87.A OD1 no hydrogen 2.661 N/A SER 65.A N TYR 86.A O no hydrogen 3.016 N/A THR 66.A OG1 PHE 84.A O no hydrogen 2.662 N/A GLY 68.A N THR 66.A OG1 no hydrogen 2.882 N/A PHE 71.A N GLY 82.A O no hydrogen 3.104 N/A LEU 73.A N LEU 80.A O no hydrogen 2.640 N/A TYR 75.A N GLY 78.A O no hydrogen 2.295 N/A GLY 76.A N GLU 5.A OE1 no hydrogen 3.040 N/A GLY 78.A N TYR 75.A O no hydrogen 3.178 N/A LEU 80.A N LEU 73.A O no hydrogen 2.840 N/A THR 81.A OG1 GLU 105.A OE1 no hydrogen 3.271 N/A GLY 82.A N PHE 71.A O no hydrogen 3.239 N/A PHE 83.A N LEU 103.A O no hydrogen 2.985 N/A PHE 84.A N GLN 69.A O no hydrogen 2.884 N/A GLY 85.A N PHE 101.A O no hydrogen 2.949 N/A TYR 86.A N SER 65.A O no hydrogen 2.805 N/A TYR 86.A OH GLU 100.A OE2 no hydrogen 2.718 N/A ASP 87.A N GLN 99.A O no hydrogen 3.119 N/A THR 88.A N ASP 87.A OD1 no hydrogen 2.525 N/A LEU 89.A N VAL 96.A O no hydrogen 2.899 N/A THR 90.A N SER 19.A O no hydrogen 2.832 N/A THR 90.A OG1 GLN 95.A OE1 no hydrogen 3.061 N/A VAL 91.A N ILE 94.A O no hydrogen 2.810 N/A ILE 94.A N VAL 91.A O no hydrogen 3.154 N/A VAL 96.A N LEU 89.A O no hydrogen 2.758 N/A GLN 99.A N ASP 87.A O no hydrogen 2.743 N/A GLN 99.A NE2 GLU 100.A O no hydrogen 3.042 N/A GLN 99.A NE2 THR 134.A O no hydrogen 3.042 N/A PHE 101.A N GLY 85.A O no hydrogen 2.933 N/A GLY 102.A N LEU 38.A O no hydrogen 2.832 N/A LEU 103.A N PHE 83.A O no hydrogen 2.900 N/A SER 104.A N VAL 40.A O no hydrogen 3.140 N/A SER 104.A OG ASN 106.A O no hydrogen 3.054 N/A GLU 105.A N THR 81.A O no hydrogen 3.016 N/A ASN 106.A ND2 THR 81.A OG1 no hydrogen 3.414 N/A GLY 109.A N TYR 75.A OH no hydrogen 2.857 N/A PHE 112.A N GLY 109.A O no hydrogen 3.338 N/A TYR 114.A N ASN 111.A O no hydrogen 2.867 N/A ALA 115.A N PHE 112.A O no hydrogen 2.938 N/A ASP 118.A N LEU 28.A O no hydrogen 2.722 N/A GLY 119.A N LEU 28.A O no hydrogen 3.293 N/A ILE 120.A N TRP 39.A O no hydrogen 3.104 N/A MET 121.A N LEU 30.A O no hydrogen 2.947 N/A GLY 122.A N ASN 37.A O no hydrogen 2.800 N/A LEU 123.A N ASP 32.A O no hydrogen 2.852 N/A ALA 124.A N SER 35.A O no hydrogen 2.950 N/A SER 129.A OG GLU 132.A O no hydrogen 3.221 N/A SER 129.A OG GLN 138.A OE1 no hydrogen 3.178 N/A THR 134.A N GLN 138.A OE1 no hydrogen 3.258 N/A GLY 139.A N THR 135.A O no hydrogen 2.938 N/A MET 140.A N ALA 136.A O no hydrogen 2.929 N/A VAL 141.A N MET 137.A O no hydrogen 3.142 N/A GLN 142.A N GLN 138.A O no hydrogen 2.761 N/A GLN 142.A NE2 VAL 130.A O no hydrogen 3.577 N/A GLU 143.A N GLY 139.A O no hydrogen 2.928 N/A GLY 144.A N VAL 141.A O no hydrogen 2.599 N/A ALA 145.A N MET 140.A O no hydrogen 3.094 N/A SER 148.A N GLY 169.A O no hydrogen 3.192 N/A VAL 150.A N SER 148.A O no hydrogen 2.868 N/A PHE 151.A N TYR 316.A O no hydrogen 3.130 N/A SER 152.A N VAL 167.A O no hydrogen 2.863 N/A SER 152.A OG GLY 170.A O no hydrogen 2.857 N/A SER 152.A OG TYR 313.A OH no hydrogen 2.578 N/A VAL 153.A N SER 314.A O no hydrogen 2.913 N/A TYR 154.A N ALA 165.A O no hydrogen 2.882 N/A TYR 154.A OH ALA 329.A O no hydrogen 2.797 N/A SER 156.A N GLY 163.A O no hydrogen 2.676 N/A SER 156.A OG GLN 158.A O no hydrogen 2.297 N/A GLN 158.A N SER 156.A OG no hydrogen 3.243 N/A GLN 159.A NE2 ASN 157.A O no hydrogen 2.955 N/A ALA 165.A N TYR 154.A O no hydrogen 2.877 N/A VAL 167.A N SER 152.A O no hydrogen 2.744 N/A GLY 169.A N VAL 150.A O no hydrogen 2.823 N/A ASP 172.A N TYR 313.A OH no hydrogen 2.959 N/A SER 174.A N ASP 172.A OD1 no hydrogen 2.810 N/A SER 174.A OG ASP 172.A OD1 no hydrogen 2.559 N/A SER 174.A OG ASP 172.A OD2 no hydrogen 3.358 N/A LEU 175.A N ASP 172.A O no hydrogen 2.892 N/A THR 177.A N THR 327.A O no hydrogen 2.961 N/A TYR 181.A N PHE 325.A O no hydrogen 2.861 N/A ALA 183.A N VAL 323.A O no hydrogen 2.820 N/A VAL 185.A N ASN 321.A O no hydrogen 2.967 N/A THR 186.A N GLN 192.A O no hydrogen 2.810 N/A THR 186.A OG1 GLN 192.A O no hydrogen 3.368 N/A THR 186.A OG1 GLN 213.A OE1 no hydrogen 2.640 N/A GLN 187.A NE2 GLN 192.A OE1 no hydrogen 3.123 N/A LEU 189.A N GLN 187.A OE1 no hydrogen 2.764 N/A TYR 190.A N GLN 187.A OE1 no hydrogen 2.866 N/A TRP 191.A NE1 LEU 123.A O no hydrogen 2.904 N/A GLN 192.A NE2 GLN 213.A OE1 no hydrogen 2.818 N/A ILE 193.A N ALA 214.A O no hydrogen 2.824 N/A ILE 195.A N CYS 212.A O no hydrogen 2.919 N/A GLU 196.A N ILE 263.A O no hydrogen 2.769 N/A PHE 198.A N GLU 197.A OE1 no hydrogen 2.941 N/A LEU 199.A N THR 261.A O no hydrogen 2.904 N/A ILE 200.A N GLN 203.A O no hydrogen 3.205 N/A GLY 201.A N SER 259.A O no hydrogen 2.846 N/A GLN 203.A N ILE 200.A O no hydrogen 2.936 N/A SER 205.A N PHE 198.A O no hydrogen 2.964 N/A SER 205.A OG GLU 197.A OE1 no hydrogen 3.412 N/A SER 205.A OG PHE 198.A O no hydrogen 2.944 N/A GLY 206.A N GLU 197.A OE1 no hydrogen 3.056 N/A TRP 207.A N SER 205.A OG no hydrogen 2.675 N/A SER 209.A N GLY 206.A O no hydrogen 3.359 N/A GLY 211.A N CYS 208.A O no hydrogen 2.989 N/A CYS 212.A N ILE 195.A O no hydrogen 3.387 N/A GLN 213.A N PRO 300.A O no hydrogen 2.840 N/A GLN 213.A NE2 GLN 299.A OE1 no hydrogen 3.003 N/A ALA 214.A N ILE 193.A O no hydrogen 2.694 N/A ILE 215.A N TRP 302.A O no hydrogen 3.000 N/A VAL 216.A N TRP 191.A O no hydrogen 2.943 N/A ASP 217.A N LEU 304.A O no hydrogen 3.052 N/A THR 218.A N THR 33.A OG1 no hydrogen 2.794 N/A THR 218.A OG1 PHE 31.A O no hydrogen 2.735 N/A THR 218.A OG1 THR 33.A OG1 no hydrogen 3.411 N/A GLY 219.A N ASP 217.A OD1 no hydrogen 2.684 N/A THR 220.A N ASP 217.A O no hydrogen 3.358 N/A SER 221.A OG.A ASP 306.A OD1 no hydrogen 2.651 N/A SER 221.A OG.B ASP 11.A O no hydrogen 3.474 N/A SER 221.A OG.B ASP 306.A OD1 no hydrogen 3.154 N/A SER 221.A OG.B ASP 306.A OD2 no hydrogen 2.646 N/A LEU 223.A N GLY 287.A O no hydrogen 2.964 N/A THR 224.A N ILE 303.A O no hydrogen 2.977 N/A VAL 225.A N GLU 289.A O no hydrogen 3.009 N/A GLN 227.A N THR 291.A O no hydrogen 3.012 N/A GLN 228.A N GLN 228.A OE1 no hydrogen 2.623 N/A TYR 229.A N PRO 226.A O no hydrogen 2.905 N/A MET 230.A N GLN 227.A O no hydrogen 3.282 N/A LEU 233.A N TYR 229.A O no hydrogen 3.339 N/A LEU 234.A N MET 230.A O no hydrogen 2.791 N/A GLN 235.A N SER 231.A O no hydrogen 2.991 N/A GLN 235.A NE2 SER 231.A O no hydrogen 3.637 N/A ALA 236.A N ALA 232.A O no hydrogen 3.038 N/A THR 237.A N LEU 233.A O no hydrogen 3.173 N/A THR 237.A N LEU 234.A O no hydrogen 3.256 N/A THR 237.A OG1 LEU 233.A O no hydrogen 2.928 N/A THR 237.A OG1 LEU 234.A O no hydrogen 3.408 N/A GLY 238.A N GLN 235.A O no hydrogen 3.319 N/A ALA 239.A N LEU 234.A O no hydrogen 3.114 N/A GLN 240.A N LEU 248.A O no hydrogen 2.959 N/A ASP 242.A N GLN 246.A O no hydrogen 2.726 N/A GLY 245.A N ASP 242.A O no hydrogen 2.836 N/A GLN 246.A N ASP 242.A OD1 no hydrogen 2.759 N/A GLN 246.A NE2 ASP 242.A OD2 no hydrogen 2.488 N/A GLN 246.A NE2 TYR 283.A OH no hydrogen 3.567 N/A LEU 248.A N GLN 240.A O no hydrogen 2.859 N/A VAL 249.A N CYS 284.A O no hydrogen 2.890 N/A ASN 252.A N ASN 250.A OD1 no hydrogen 2.896 N/A SER 253.A N ASN 250.A O no hydrogen 2.871 N/A SER 253.A OG ASN 250.A O no hydrogen 2.760 N/A ILE 254.A N CYS 251.A O no hydrogen 3.408 N/A GLN 255.A N GLN 255.A OE1 no hydrogen 2.376 N/A ASN 256.A N SER 253.A O no hydrogen 2.794 N/A LEU 257.A N ILE 254.A O no hydrogen 3.100 N/A LEU 260.A N LEU 271.A O no hydrogen 2.922 N/A THR 261.A N LEU 199.A O no hydrogen 2.799 N/A PHE 262.A N PHE 269.A O no hydrogen 2.985 N/A ILE 263.A N GLU 197.A O no hydrogen 2.932 N/A ILE 264.A N VAL 267.A O no hydrogen 2.921 N/A ASN 265.A ND2 TRP 182.A O no hydrogen 2.913 N/A GLY 266.A N GLU 196.A OE1 no hydrogen 2.831 N/A VAL 267.A N ILE 264.A O no hydrogen 3.002 N/A PHE 269.A N PHE 262.A O no hydrogen 2.826 N/A LEU 271.A N LEU 260.A O no hydrogen 2.808 N/A SER 275.A N PRO 272.A O no hydrogen 2.838 N/A SER 275.A OG SER 311.A OG no hydrogen 3.326 N/A TYR 276.A N PRO 272.A O no hydrogen 3.174 N/A TYR 276.A OH PRO 258.A O no hydrogen 2.730 N/A ILE 277.A N PRO 273.A O no hydrogen 2.875 N/A LEU 278.A N THR 285.A O no hydrogen 2.695 N/A ASN 280.A N TYR 283.A O no hydrogen 2.523 N/A ASN 280.A ND2 GLN 246.A OE1 no hydrogen 3.558 N/A THR 285.A N LEU 278.A O no hydrogen 2.914 N/A THR 285.A OG1 ASN 280.A OD1 no hydrogen 3.057 N/A VAL 286.A N PHE 247.A O no hydrogen 2.859 N/A GLY 287.A N TYR 276.A O no hydrogen 2.809 N/A VAL 288.A N VAL 286.A O no hydrogen 2.786 N/A GLU 289.A N LEU 223.A O no hydrogen 3.067 N/A THR 291.A N VAL 225.A O no hydrogen 2.902 N/A LEU 293.A N THR 291.A OG1 no hydrogen 3.214 N/A SER 295.A N GLN 299.A O no hydrogen 2.833 N/A SER 295.A OG GLN 299.A O no hydrogen 3.189 N/A GLY 298.A N SER 295.A O no hydrogen 2.912 N/A GLN 299.A N ASN 297.A OD1 no hydrogen 2.979 N/A TRP 302.A N GLN 213.A O no hydrogen 2.841 N/A ILE 303.A N THR 224.A O no hydrogen 3.159 N/A LEU 304.A N ILE 215.A O no hydrogen 2.917 N/A ASP 306.A N THR 220.A O no hydrogen 2.850 N/A VAL 307.A N SER 221.A O no hydrogen 2.987 N/A PHE 308.A N GLY 305.A O no hydrogen 2.844 N/A LEU 309.A N GLY 305.A O no hydrogen 2.882 N/A ARG 310.A N ASP 306.A O no hydrogen 2.803 N/A SER 311.A N PHE 308.A O no hydrogen 2.999 N/A TYR 312.A N PHE 308.A O no hydrogen 3.278 N/A TYR 312.A OH PRO 270.A O no hydrogen 2.692 N/A TYR 313.A N ALA 326.A O no hydrogen 2.787 N/A SER 314.A N VAL 153.A O no hydrogen 3.218 N/A SER 314.A OG TYR 316.A OH no hydrogen 2.818 N/A VAL 315.A N GLY 324.A O no hydrogen 2.850 N/A TYR 316.A N PHE 151.A O no hydrogen 2.766 N/A TYR 316.A OH SER 314.A OG no hydrogen 2.818 N/A ASP 317.A N ARG 322.A O no hydrogen 2.942 N/A LEU 318.A N PRO 149.A O no hydrogen 2.892 N/A GLY 319.A N PRO 149.A O no hydrogen 3.377 N/A ASN 320.A N ASP 317.A OD1 no hydrogen 2.724 N/A ASN 320.A ND2 ASP 317.A OD2 no hydrogen 2.878 N/A ASN 321.A ND2.A PRO 126.A O no hydrogen 2.662 N/A ASN 321.A ND2.B PRO 126.A O no hydrogen 2.991 N/A ARG 322.A N ASP 317.A O no hydrogen 3.110 N/A ARG 322.A NE ASP 317.A OD2 no hydrogen 2.881 N/A ARG 322.A NH2 ASP 317.A OD2 no hydrogen 3.386 N/A VAL 323.A N ALA 183.A O no hydrogen 2.864 N/A GLY 324.A N VAL 315.A O no hydrogen 2.849 N/A PHE 325.A N TYR 181.A O no hydrogen 2.863 N/A ALA 326.A N TYR 313.A O no hydrogen 3.028 N/A ALA 328.A N SER 311.A O no hydrogen 2.955 N/A ALA 329.A N LEU 175.A O no hydrogen 2.889 N/A