Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5bwt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG PHE 3.A O no hydrogen 2.795 N/A ALA 5.A N GLU 114.A OE1 no hydrogen 2.937 N/A ASP 7.A N LYS 4.A O no hydrogen 2.995 N/A LEU 8.A N ALA 5.A O no hydrogen 3.085 N/A GLN 9.A N PRO 49.A O no hydrogen 3.028 N/A GLN 9.A NE2 LEU 10.A O no hydrogen 3.424 N/A GLU 11.A N ILE 51.A O no hydrogen 2.877 N/A THR 13.A N HIS 35.A NE2 no hydrogen 3.141 N/A LYS 15.A N THR 13.A OG1 no hydrogen 3.164 N/A HIS 17.A N ASP 34.A OD1 no hydrogen 2.663 N/A GLY 21.A N GLU 24.A OE1 no hydrogen 2.908 N/A LYS 30.A N VAL 27.A O no hydrogen 3.331 N/A THR 33.A N LEU 165.A O no hydrogen 3.092 N/A THR 33.A OG1 HIS 35.A O no hydrogen 3.378 N/A THR 33.A OG1 ASP 126.A OD2 no hydrogen 2.823 N/A HIS 35.A N ASP 126.A OD2 no hydrogen 2.959 N/A HIS 35.A ND1 ASP 126.A OD1 no hydrogen 2.692 N/A MET 36.A N GLN 52.A O no hydrogen 2.912 N/A LEU 37.A N VAL 163.A O no hydrogen 3.014 N/A MET 38.A N ARG 50.A O no hydrogen 2.816 N/A VAL 39.A N LEU 161.A O no hydrogen 2.780 N/A TRP 41.A N ALA 159.A O no hydrogen 3.165 N/A ASN 42.A N GLY 45.A O no hydrogen 2.977 N/A LYS 44.A N ASN 42.A OD1 no hydrogen 2.828 N/A GLY 45.A N ASN 42.A O no hydrogen 2.894 N/A TRP 46.A NE1 SER 109.A O no hydrogen 2.769 N/A GLY 47.A N GLU 40.A O no hydrogen 2.769 N/A ARG 50.A N MET 38.A O no hydrogen 2.856 N/A ARG 50.A NH2 GLU 11.A OE1 no hydrogen 3.487 N/A ILE 51.A N GLN 9.A O no hydrogen 2.999 N/A GLN 52.A N MET 36.A O no hydrogen 2.912 N/A PHE 54.A N ASP 34.A O no hydrogen 2.755 N/A GLN 55.A NE2 PRO 53.A O no hydrogen 2.832 N/A ALA 62.A N HIS 60.A ND1 no hydrogen 3.059 N/A SER 63.A N HIS 60.A O no hydrogen 3.073 N/A SER 63.A OG SER 65.A OG no hydrogen 2.712 N/A SER 63.A OG ASN 147.A OD1 no hydrogen 2.796 N/A SER 64.A N GLU 148.A O no hydrogen 3.037 N/A SER 65.A OG SER 63.A OG no hydrogen 2.712 N/A LEU 66.A N SER 63.A O no hydrogen 2.905 N/A HIS 67.A NE2 PRO 61.A O no hydrogen 2.762 N/A TYR 68.A N SER 64.A O no hydrogen 3.167 N/A TYR 68.A OH LEU 151.A O no hydrogen 2.405 N/A LEU 70.A N SER 64.A O no hydrogen 3.513 N/A GLN 71.A NE2 SER 65.A O no hydrogen 3.001 N/A LEU 72.A N LEU 144.A O no hydrogen 2.997 N/A PHE 73.A N LYS 197.A O no hydrogen 3.194 N/A GLU 74.A N PRO 142.A O no hydrogen 2.914 N/A GLY 75.A N GLU 74.A OE1 no hydrogen 3.258 N/A MET 76.A N VAL 140.A O no hydrogen 3.042 N/A LYS 77.A NZ THR 308.A O no hydrogen 2.938 N/A ALA 78.A N LEU 138.A O no hydrogen 2.777 N/A PHE 79.A N ARG 87.A O no hydrogen 2.766 N/A LYS 80.A NZ LYS 127.A O no hydrogen 3.062 N/A LYS 80.A NZ VAL 130.A O no hydrogen 2.857 N/A GLY 81.A N GLN 85.A O no hydrogen 2.947 N/A GLN 84.A N GLY 81.A O no hydrogen 2.906 N/A GLN 84.A NE2 LYS 82.A O no hydrogen 2.997 N/A GLN 84.A NE2 ASP 132.A OD2 no hydrogen 3.300 N/A GLN 85.A N ASP 83.A OD1 no hydrogen 2.982 N/A GLN 85.A NE2 VAL 86.A O no hydrogen 3.173 N/A GLN 85.A NE2 VAL 360.A OXT no hydrogen 3.248 N/A ARG 87.A N PHE 79.A O no hydrogen 2.795 N/A LEU 88.A N PHE 358.A O no hydrogen 2.711 N/A PHE 89.A N LYS 77.A O no hydrogen 3.215 N/A ARG 90.A N TRP 356.A O no hydrogen 2.830 N/A ARG 90.A NH1 SER 268.A OG no hydrogen 2.968 N/A ARG 90.A NH1 ASP 271.A OD2 no hydrogen 3.104 N/A LEU 93.A N ARG 90.A O no hydrogen 3.061 N/A ASN 94.A ND2 GLU 74.A OE1 no hydrogen 2.943 N/A MET 95.A N PRO 91.A O no hydrogen 3.025 N/A ASP 96.A N TRP 92.A O no hydrogen 2.909 N/A ARG 97.A N LEU 93.A O no hydrogen 2.994 N/A ARG 97.A NE GLU 74.A OE2 no hydrogen 2.699 N/A ARG 97.A NH1 PRO 262.A O no hydrogen 3.085 N/A ARG 97.A NH2 GLU 74.A OE1 no hydrogen 2.613 N/A ARG 97.A NH2 GLU 74.A OE2 no hydrogen 3.456 N/A MET 98.A N ASN 94.A O no hydrogen 2.797 N/A LEU 99.A N MET 95.A O no hydrogen 3.096 N/A ARG 100.A N ASP 96.A O no hydrogen 3.152 N/A SER 101.A N ARG 97.A O no hydrogen 3.027 N/A SER 101.A OG ARG 97.A O no hydrogen 3.335 N/A ALA 102.A N MET 98.A O no hydrogen 2.954 N/A MET 103.A N LEU 99.A O no hydrogen 2.987 N/A ARG 104.A N ARG 100.A O no hydrogen 2.947 N/A ARG 104.A NH1 ARG 104.A O no hydrogen 2.886 N/A LEU 105.A N SER 101.A O no hydrogen 3.139 N/A LEU 105.A N ALA 102.A O no hydrogen 3.219 N/A CYS 106.A N MET 103.A O no hydrogen 3.210 N/A LEU 107.A N ALA 102.A O no hydrogen 2.915 N/A ASP 111.A N SER 2.A OG no hydrogen 2.996 N/A LYS 112.A NZ ASP 96.A OD1 no hydrogen 2.684 N/A LEU 113.A N ASP 111.A OD1 no hydrogen 3.001 N/A GLU 114.A N ASP 111.A OD1 no hydrogen 3.113 N/A LEU 115.A N ASP 111.A O no hydrogen 2.897 N/A LEU 116.A N LYS 112.A O no hydrogen 2.891 N/A GLU 117.A N LEU 113.A O no hydrogen 3.017 N/A CYS 118.A N GLU 114.A O no hydrogen 2.945 N/A CYS 118.A SG GLU 114.A O no hydrogen 3.452 N/A ILE 119.A N LEU 115.A O no hydrogen 2.807 N/A ARG 120.A N LEU 116.A O no hydrogen 2.761 N/A ARG 120.A NE GLU 117.A OE1 no hydrogen 3.024 N/A ARG 120.A NE GLU 117.A OE2 no hydrogen 3.258 N/A ARG 120.A NH1 GLU 124.A OE2 no hydrogen 3.089 N/A ARG 120.A NH1 VAL 360.A O no hydrogen 2.950 N/A ARG 120.A NH2 GLU 117.A OE2 no hydrogen 2.690 N/A ARG 121.A N GLU 117.A O no hydrogen 2.785 N/A LEU 122.A N CYS 118.A O no hydrogen 2.924 N/A ILE 123.A N ILE 119.A O no hydrogen 2.937 N/A GLU 124.A N ARG 120.A O no hydrogen 2.858 N/A VAL 125.A N ARG 121.A O no hydrogen 3.132 N/A ASP 126.A N LEU 122.A O no hydrogen 3.265 N/A LYS 127.A N GLU 124.A O no hydrogen 3.153 N/A LYS 127.A NZ ASP 128.A OD1 no hydrogen 3.325 N/A TRP 129.A N ASP 126.A O no hydrogen 2.884 N/A TRP 129.A NE1 ASP 34.A OD2 no hydrogen 3.206 N/A VAL 130.A N LYS 127.A O no hydrogen 3.038 N/A THR 136.A N ALA 133.A O no hydrogen 3.266 N/A THR 136.A OG1 ALA 133.A O no hydrogen 2.629 N/A SER 137.A N VAL 168.A O no hydrogen 3.126 N/A LEU 138.A N ALA 78.A O no hydrogen 2.837 N/A TYR 139.A N CYS 166.A O no hydrogen 2.762 N/A VAL 140.A N MET 76.A O no hydrogen 2.751 N/A ARG 141.A N ILE 164.A O no hydrogen 2.944 N/A ARG 141.A NE GLU 74.A O no hydrogen 2.740 N/A ARG 141.A NH2 TYR 139.A OH no hydrogen 2.814 N/A VAL 143.A N PHE 162.A O no hydrogen 2.750 N/A LEU 144.A N LEU 72.A O no hydrogen 3.102 N/A ILE 145.A N LEU 160.A O no hydrogen 2.842 N/A GLY 146.A N LEU 70.A O no hydrogen 2.806 N/A ASN 147.A N ARG 158.A O no hydrogen 2.819 N/A GLU 148.A N SER 64.A OG no hydrogen 3.384 N/A GLY 152.A N SER 150.A OG no hydrogen 3.411 N/A SER 154.A OG GLY 152.A O no hydrogen 3.328 N/A THR 157.A N GLU 148.A OE1 no hydrogen 2.963 N/A THR 157.A OG1 GLU 148.A OE1 no hydrogen 2.531 N/A ALA 159.A N TRP 41.A O no hydrogen 3.041 N/A LEU 160.A N ILE 145.A O no hydrogen 2.826 N/A LEU 161.A N VAL 39.A O no hydrogen 2.860 N/A PHE 162.A N VAL 143.A O no hydrogen 2.896 N/A VAL 163.A N LEU 37.A O no hydrogen 3.083 N/A ILE 164.A N ARG 141.A O no hydrogen 3.113 N/A CYS 166.A N TYR 139.A O no hydrogen 2.882 N/A VAL 168.A N SER 137.A O no hydrogen 2.847 N/A VAL 177.A N PRO 314.A O no hydrogen 2.925 N/A SER 178.A N GLU 218.A OE1 no hydrogen 2.837 N/A SER 178.A OG GLU 218.A OE1 no hydrogen 3.265 N/A LEU 179.A N ARG 317.A O no hydrogen 2.715 N/A LEU 180.A N GLN 219.A O no hydrogen 2.969 N/A ALA 181.A N LEU 319.A O no hydrogen 2.915 N/A ALA 184.A N ASP 182.A OD1 no hydrogen 2.981 N/A PHE 185.A N ASP 182.A O no hydrogen 3.159 N/A ARG 187.A NH2 GLY 194.A O no hydrogen 3.078 N/A ARG 187.A NH2 VAL 259.A O no hydrogen 3.076 N/A VAL 190.A N TYR 224.A OH no hydrogen 3.107 N/A GLY 192.A N TRP 189.A O no hydrogen 2.895 N/A TYR 196.A N VAL 193.A O no hydrogen 3.168 N/A GLY 199.A N GLN 71.A O no hydrogen 3.258 N/A ASN 201.A N LEU 198.A O no hydrogen 3.013 N/A ASN 201.A ND2 VAL 193.A O no hydrogen 2.964 N/A ASN 201.A ND2 TYR 196.A O no hydrogen 2.921 N/A TYR 202.A N GLY 199.A O no hydrogen 3.015 N/A THR 205.A N TYR 202.A O no hydrogen 2.845 N/A THR 205.A OG1 TYR 202.A O no hydrogen 2.574 N/A VAL 206.A N GLY 203.A O no hydrogen 3.311 N/A GLN 209.A N THR 205.A O no hydrogen 2.859 N/A GLN 209.A NE2 GLU 218.A O no hydrogen 2.889 N/A GLN 210.A N VAL 206.A O no hydrogen 3.045 N/A GLU 211.A N LEU 207.A O no hydrogen 3.194 N/A ALA 212.A N VAL 208.A O no hydrogen 3.042 N/A LEU 213.A N GLN 209.A O no hydrogen 3.114 N/A LYS 214.A N GLN 210.A O no hydrogen 2.895 N/A LYS 214.A NZ GLU 211.A OE1 no hydrogen 3.157 N/A ARG 215.A N GLU 211.A O no hydrogen 2.944 N/A ARG 215.A NE GLU 211.A OE2 no hydrogen 2.867 N/A ARG 215.A NH1 ASP 182.A OD2 no hydrogen 3.354 N/A ARG 215.A NH2 ASP 182.A OD2 no hydrogen 2.962 N/A GLY 216.A N LEU 213.A O no hydrogen 2.730 N/A CYS 217.A N ALA 212.A O no hydrogen 2.734 N/A GLU 218.A N SER 178.A O no hydrogen 3.055 N/A GLN 219.A N SER 178.A O no hydrogen 3.271 N/A LEU 221.A N LEU 180.A O no hydrogen 2.863 N/A TRP 222.A N GLU 232.A O no hydrogen 2.873 N/A TYR 224.A N GLN 229.A O no hydrogen 2.936 N/A HIS 228.A N GLY 225.A O no hydrogen 2.898 N/A GLN 229.A N TYR 224.A O no hydrogen 2.732 N/A GLN 229.A NE2 ASP 227.A OD1 no hydrogen 3.071 N/A LEU 230.A N ILE 286.A O no hydrogen 2.792 N/A THR 231.A N TRP 222.A O no hydrogen 2.958 N/A THR 231.A OG1 TRP 222.A O no hydrogen 2.748 N/A VAL 233.A N MET 236.A O no hydrogen 2.764 N/A GLY 234.A N VAL 220.A O no hydrogen 2.779 N/A MET 236.A N VAL 233.A O no hydrogen 2.715 N/A ASN 237.A N SER 306.A O no hydrogen 2.886 N/A ASN 237.A ND2 LEU 261.A O no hydrogen 2.860 N/A PHE 239.A N PHE 304.A O no hydrogen 2.908 N/A VAL 240.A N VAL 252.A O no hydrogen 2.927 N/A TYR 241.A N GLU 302.A O no hydrogen 2.813 N/A TRP 242.A N GLU 250.A O no hydrogen 2.902 N/A TRP 242.A NE1 GLU 250.A OE2 no hydrogen 2.887 N/A THR 243.A N ARG 299.A O no hydrogen 2.821 N/A HIS 244.A N VAL 248.A O no hydrogen 2.553 N/A GLY 247.A N HIS 244.A O no hydrogen 3.043 N/A VAL 248.A N ASP 246.A OD1 no hydrogen 3.128 N/A GLU 250.A N TRP 242.A O no hydrogen 2.758 N/A LEU 251.A N ARG 280.A O no hydrogen 2.895 N/A VAL 252.A N VAL 240.A O no hydrogen 2.850 N/A THR 253.A N VAL 282.A O no hydrogen 3.259 N/A THR 253.A OG1 ILE 238.A O no hydrogen 2.612 N/A ASN 257.A N PRO 255.A O no hydrogen 2.878 N/A LEU 261.A N GLU 232.A OE2 no hydrogen 2.684 N/A ARG 266.A NH2 PRO 254.A O no hydrogen 2.949 N/A ARG 266.A NH2 GLU 283.A OE1 no hydrogen 2.781 N/A GLN 267.A N GLY 263.A O no hydrogen 3.074 N/A GLN 267.A NE2 ASP 271.A OD1 no hydrogen 2.970 N/A SER 268.A N VAL 264.A O no hydrogen 3.000 N/A SER 268.A OG VAL 264.A O no hydrogen 2.748 N/A LEU 269.A N VAL 265.A O no hydrogen 2.844 N/A LEU 270.A N ARG 266.A O no hydrogen 3.037 N/A ASP 271.A N GLN 267.A O no hydrogen 2.865 N/A MET 272.A N SER 268.A O no hydrogen 2.908 N/A ALA 273.A N LEU 269.A O no hydrogen 2.951 N/A GLN 274.A N LEU 270.A O no hydrogen 2.844 N/A THR 275.A N ASP 271.A O no hydrogen 2.952 N/A THR 275.A OG1 ASP 271.A O no hydrogen 2.865 N/A TRP 276.A N MET 272.A O no hydrogen 3.116 N/A TRP 276.A NE1 GLU 343.A OE2 no hydrogen 2.561 N/A GLY 277.A N ALA 273.A O no hydrogen 3.410 N/A ARG 280.A N LEU 249.A O no hydrogen 3.248 N/A ARG 280.A NE GLU 250.A OE1 no hydrogen 2.929 N/A ARG 280.A NH1 ASP 246.A OD2 no hydrogen 2.562 N/A ARG 280.A NH2 ASP 246.A OD1 no hydrogen 3.094 N/A ARG 280.A NH2 ASP 246.A OD2 no hydrogen 2.956 N/A ARG 280.A NH2 GLU 250.A OE1 no hydrogen 2.996 N/A VAL 282.A N LEU 251.A O no hydrogen 2.945 N/A ARG 284.A N THR 253.A O no hydrogen 3.121 N/A ARG 284.A NH1 GLU 250.A OE2 no hydrogen 3.166 N/A ARG 284.A NH2 GLU 250.A OE1 no hydrogen 2.668 N/A ARG 284.A NH2 GLU 250.A OE2 no hydrogen 2.893 N/A THR 287.A N GLN 290.A OE1 no hydrogen 3.228 N/A MET 288.A N HIS 228.A O no hydrogen 3.146 N/A GLN 290.A N THR 287.A OG1 no hydrogen 3.086 N/A LEU 291.A N THR 287.A O no hydrogen 3.075 N/A LEU 292.A N MET 288.A O no hydrogen 2.712 N/A ARG 293.A N LYS 289.A O no hydrogen 3.113 N/A ARG 293.A NE GLU 297.A OE2 no hydrogen 3.111 N/A ALA 294.A N GLN 290.A O no hydrogen 2.919 N/A LEU 295.A N LEU 291.A O no hydrogen 2.789 N/A GLU 296.A N LEU 292.A O no hydrogen 3.110 N/A GLU 297.A N ARG 293.A O no hydrogen 3.063 N/A GLY 298.A N LEU 295.A O no hydrogen 3.060 N/A ARG 299.A N ALA 294.A O no hydrogen 2.755 N/A ARG 299.A NE GLU 297.A OE1 no hydrogen 2.777 N/A ARG 299.A NH1 THR 243.A O no hydrogen 2.893 N/A ARG 299.A NH2 GLU 297.A OE1 no hydrogen 3.214 N/A ARG 301.A N TYR 241.A O no hydrogen 2.862 N/A GLU 302.A N TYR 241.A O no hydrogen 3.095 N/A VAL 303.A N THR 329.A OG1 no hydrogen 3.041 N/A PHE 304.A N PHE 239.A O no hydrogen 3.254 N/A GLY 305.A N CYS 313.A O no hydrogen 2.865 N/A SER 306.A N ASN 237.A O no hydrogen 2.823 N/A THR 308.A OG1 GLY 75.A O no hydrogen 3.546 N/A CYS 310.A N.A GLY 307.A O no hydrogen 3.177 N/A GLN 311.A N.A GLY 307.A O no hydrogen 2.420 N/A GLN 311.A NE2.A GLN 348.A OE1 no hydrogen 2.841 N/A GLN 311.A NE2.B GLN 348.A OE1 no hydrogen 3.107 N/A CYS 313.A N GLY 305.A O no hydrogen 2.803 N/A CYS 313.A SG PRO 314.A O no hydrogen 4.036 N/A VAL 315.A N VAL 303.A O no hydrogen 2.903 N/A HIS 316.A N VAL 177.A O no hydrogen 2.972 N/A ARG 317.A NH1 ASN 324.A OD1 no hydrogen 2.969 N/A ARG 317.A NH2 GLY 216.A O no hydrogen 2.856 N/A ILE 318.A N LEU 325.A O no hydrogen 2.931 N/A LEU 319.A N LEU 179.A O no hydrogen 2.732 N/A TYR 320.A N ARG 323.A O no hydrogen 2.985 N/A TYR 320.A OH HIS 228.A ND1 no hydrogen 2.602 N/A ARG 323.A N TYR 320.A O no hydrogen 2.869 N/A LEU 325.A N ILE 318.A O no hydrogen 2.844 N/A HIS 326.A NE2 GLU 331.A OE2 no hydrogen 2.637 N/A ILE 327.A N HIS 316.A O no hydrogen 2.796 N/A THR 329.A OG1 VAL 303.A O no hydrogen 3.413 N/A THR 329.A OG1 VAL 315.A O no hydrogen 2.670 N/A GLU 331.A N GLU 331.A OE1 no hydrogen 2.834 N/A ASN 332.A N THR 329.A O no hydrogen 3.131 N/A ASN 332.A ND2 ARG 301.A O no hydrogen 3.189 N/A ASN 332.A ND2 PRO 328.A O no hydrogen 2.896 N/A GLU 335.A N ASN 332.A O no hydrogen 2.944 N/A LEU 336.A N GLU 302.A OE2 no hydrogen 2.771 N/A ILE 337.A N GLU 302.A OE1 no hydrogen 2.889 N/A LEU 338.A N PRO 334.A O no hydrogen 2.884 N/A ARG 339.A N GLU 335.A O no hydrogen 3.092 N/A ARG 339.A NH1 GLU 278.A OE1 no hydrogen 2.892 N/A ARG 339.A NH1 GLU 278.A OE2 no hydrogen 3.207 N/A ARG 339.A NH2 GLU 278.A OE2 no hydrogen 2.818 N/A PHE 340.A N LEU 336.A O no hydrogen 2.827 N/A GLN 341.A N ILE 337.A O no hydrogen 2.886 N/A GLN 341.A NE2 VAL 312.A O no hydrogen 3.346 N/A LYS 342.A N LEU 338.A O no hydrogen 2.867 N/A LYS 342.A NZ GLU 346.A OE2 no hydrogen 2.892 N/A GLU 343.A N ARG 339.A O no hydrogen 3.018 N/A LEU 344.A N PHE 340.A O no hydrogen 2.955 N/A LYS 345.A N GLN 341.A O no hydrogen 2.948 N/A GLU 346.A N LYS 342.A O no hydrogen 3.098 N/A ILE 347.A N GLU 343.A O no hydrogen 3.053 N/A GLN 348.A N LEU 344.A O no hydrogen 2.709 N/A GLN 348.A NE2 GLN 311.A OE1.A no hydrogen 3.307 N/A GLN 348.A NE2 GLN 311.A OE1.B no hydrogen 2.902 N/A TYR 349.A N LYS 345.A O no hydrogen 2.949 N/A TYR 349.A OH THR 136.A O no hydrogen 2.688 N/A GLY 350.A N ILE 347.A O no hydrogen 3.311 N/A ARG 352.A N GLU 346.A O no hydrogen 3.130 N/A ARG 352.A NH1 GLU 343.A OE1 no hydrogen 3.417 N/A ARG 352.A NH2 GLU 343.A OE1 no hydrogen 3.485 N/A TRP 356.A N HIS 354.A ND1 no hydrogen 3.197 N/A MET 357.A N HIS 354.A O no hydrogen 3.195 N/A PHE 358.A N LEU 88.A O no hydrogen 2.854 N/A VAL 360.A N VAL 86.A O no hydrogen 2.872 N/A