Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8w3v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N LEU 330.A O no hydrogen 3.048 N/A LEU 8.A N ILE 328.A O no hydrogen 2.824 N/A HIS 11.A ND1 ASP 32.A OD1 no hydrogen 3.170 N/A HIS 11.A ND1 ASP 32.A OD2 no hydrogen 3.071 N/A HIS 11.A NE2 SER 28.A OG no hydrogen 2.624 N/A HIS 12.A N ASP 32.A OD2 no hydrogen 2.884 N/A ILE 14.A N ASP 13.A OD1 no hydrogen 2.617 N/A VAL 15.A N SER 323.A O no hydrogen 3.071 N/A ARG 16.A N ALA 29.A O no hydrogen 2.960 N/A ARG 16.A NE ASP 31.A OD1 no hydrogen 2.689 N/A ARG 16.A NH2 ASP 31.A OD2 no hydrogen 2.972 N/A PHE 17.A N ALA 29.A O no hydrogen 3.019 N/A VAL 19.A N ALA 27.A O no hydrogen 2.999 N/A GLN 20.A NE2 ASP 22.A O no hydrogen 2.348 N/A LEU 21.A N ARG 25.A O no hydrogen 2.903 N/A ASP 22.A N ARG 25.A O no hydrogen 3.516 N/A TYR 24.A N ASP 22.A OD1 no hydrogen 2.834 N/A ARG 25.A N ASP 22.A OD1 no hydrogen 2.852 N/A ARG 25.A NE ASP 22.A OD2 no hydrogen 2.698 N/A ARG 25.A NH2 ASP 22.A OD2 no hydrogen 2.917 N/A PHE 26.A N TRP 38.A O no hydrogen 3.166 N/A ALA 27.A N VAL 19.A O no hydrogen 2.817 N/A SER 28.A N VAL 36.A O no hydrogen 2.869 N/A SER 28.A OG HIS 11.A NE2 no hydrogen 2.624 N/A ALA 29.A N PHE 17.A O no hydrogen 2.918 N/A GLY 30.A N ILE 34.A O no hydrogen 3.346 N/A ASP 31.A N ILE 14.A O no hydrogen 2.798 N/A GLY 33.A N GLY 30.A O no hydrogen 2.938 N/A ILE 34.A N ASP 32.A OD1 no hydrogen 3.127 N/A VAL 35.A N LEU 49.A O no hydrogen 3.208 N/A VAL 36.A N SER 28.A O no hydrogen 2.985 N/A VAL 37.A N LEU 47.A O no hydrogen 2.851 N/A TRP 38.A N PHE 26.A O no hydrogen 2.933 N/A TRP 38.A NE1 SER 28.A OG no hydrogen 3.004 N/A ASN 39.A N GLU 44.A O no hydrogen 2.790 N/A ALA 40.A N TYR 24.A O no hydrogen 2.617 N/A GLN 41.A N ASN 39.A OD1 no hydrogen 2.816 N/A THR 42.A N ASN 39.A OD1 no hydrogen 3.036 N/A GLY 43.A N ASN 39.A O no hydrogen 2.687 N/A GLU 44.A N THR 42.A OG1 no hydrogen 3.096 N/A LYS 45.A NZ GLU 48.A OE2 no hydrogen 2.660 N/A LEU 46.A N VAL 37.A O no hydrogen 2.719 N/A LEU 47.A N VAL 37.A O no hydrogen 3.324 N/A LEU 49.A N VAL 35.A O no hydrogen 2.736 N/A ASN 50.A ND2 GLU 48.A OE1 no hydrogen 2.809 N/A HIS 52.A ND1 ASP 73.A OD2 no hydrogen 2.921 N/A HIS 52.A NE2 THR 69.A OG1 no hydrogen 2.709 N/A THR 53.A N ASP 73.A OD2 no hydrogen 3.095 N/A THR 53.A OG1 ASP 73.A OD2 no hydrogen 3.553 N/A ILE 56.A N GLY 30.A O no hydrogen 3.402 N/A THR 57.A N ALA 70.A O no hydrogen 2.726 N/A THR 57.A OG1 VAL 97.A O no hydrogen 2.746 N/A ILE 60.A N LEU 68.A O no hydrogen 2.986 N/A PHE 62.A N LEU 66.A O no hydrogen 2.851 N/A GLN 65.A NE2 LEU 21.A O no hydrogen 3.140 N/A LEU 66.A N PHE 62.A O no hydrogen 2.923 N/A ILE 67.A N TRP 79.A O no hydrogen 3.058 N/A LEU 68.A N ILE 60.A O no hydrogen 2.824 N/A THR 69.A N ILE 77.A O no hydrogen 2.981 N/A THR 69.A OG1 HIS 52.A NE2 no hydrogen 2.709 N/A ALA 70.A N ALA 58.A O no hydrogen 2.850 N/A SER 71.A N THR 75.A O no hydrogen 3.226 N/A SER 71.A OG GLN 54.A O no hydrogen 2.879 N/A SER 71.A OG LYS 55.A O no hydrogen 2.866 N/A ALA 72.A N LYS 55.A O no hydrogen 2.897 N/A ASP 73.A N SER 71.A OG no hydrogen 3.226 N/A ARG 74.A N SER 71.A O no hydrogen 3.078 N/A THR 75.A N ASP 73.A OD1 no hydrogen 2.948 N/A THR 75.A OG1 ASP 73.A OD1 no hydrogen 2.469 N/A VAL 76.A N ILE 90.A O no hydrogen 2.894 N/A ILE 77.A N THR 69.A O no hydrogen 2.898 N/A VAL 78.A N GLN 88.A O no hydrogen 2.827 N/A TRP 79.A N ILE 67.A O no hydrogen 2.758 N/A TRP 79.A NE1 THR 69.A OG1 no hydrogen 3.075 N/A ASP 80.A N ARG 85.A O no hydrogen 2.799 N/A THR 83.A N ASP 80.A OD1 no hydrogen 2.966 N/A THR 84.A N ASP 80.A O no hydrogen 2.722 N/A ARG 85.A N THR 83.A OG1 no hydrogen 3.173 N/A VAL 87.A N VAL 78.A O no hydrogen 2.764 N/A GLN 88.A N VAL 78.A O no hydrogen 3.334 N/A ILE 90.A N VAL 76.A O no hydrogen 2.785 N/A LYS 98.A N GLY 112.A O no hydrogen 2.832 N/A CYS 99.A N GLY 112.A O no hydrogen 3.292 N/A CYS 99.A SG GLY 112.A O no hydrogen 3.795 N/A CYS 99.A SG ILE 137.A O no hydrogen 3.430 N/A THR 101.A N LEU 110.A O no hydrogen 3.114 N/A LEU 103.A N VAL 108.A O no hydrogen 2.856 N/A ARG 105.A NE ASN 146.A OD1 no hydrogen 3.089 N/A ASP 107.A N LEU 103.A O no hydrogen 2.669 N/A VAL 108.A N LEU 103.A O no hydrogen 3.252 N/A TRP 109.A N TRP 119.A O no hydrogen 3.137 N/A LEU 110.A N THR 101.A O no hydrogen 2.704 N/A SER 111.A N CYS 117.A O no hydrogen 3.108 N/A GLY 112.A N CYS 99.A O no hydrogen 2.979 N/A GLY 113.A N ASP 115.A O no hydrogen 2.957 N/A LEU 116.A N THR 129.A OG1 no hydrogen 3.046 N/A CYS 117.A N SER 111.A O no hydrogen 3.034 N/A VAL 118.A N CYS 127.A O no hydrogen 2.909 N/A TRP 119.A N TRP 109.A O no hydrogen 2.885 N/A TRP 119.A NE1 SER 111.A OG no hydrogen 2.879 N/A ASN 120.A N ASP 124.A O no hydrogen 3.281 N/A LEU 123.A N ASN 120.A O no hydrogen 2.903 N/A ASP 124.A N ASN 120.A OD1 no hydrogen 2.899 N/A LEU 126.A N VAL 118.A O no hydrogen 2.868 N/A THR 129.A N LEU 116.A O no hydrogen 3.016 N/A THR 129.A OG1 ASP 115.A OD1 no hydrogen 2.554 N/A HIS 131.A N ASP 115.A OD2 no hydrogen 3.139 N/A LEU 132.A N ASP 115.A OD1 no hydrogen 2.729 N/A GLY 136.A N SER 133.A OG no hydrogen 2.868 N/A ILE 137.A N GLY 113.A O no hydrogen 2.734 N/A SER 138.A N ALA 151.A O no hydrogen 2.914 N/A SER 138.A OG ALA 151.A O no hydrogen 3.395 N/A VAL 141.A N VAL 149.A O no hydrogen 2.922 N/A ILE 143.A N CYS 147.A O no hydrogen 3.011 N/A CYS 147.A N PRO 144.A O no hydrogen 3.360 N/A CYS 147.A SG ALA 145.A O no hydrogen 3.568 N/A VAL 148.A N PHE 159.A O no hydrogen 2.772 N/A VAL 149.A N VAL 141.A O no hydrogen 2.845 N/A ALA 150.A N ILE 157.A O no hydrogen 2.924 N/A ALA 151.A N ALA 139.A O no hydrogen 2.771 N/A VAL 152.A N GLU 155.A O no hydrogen 2.811 N/A LYS 154.A NZ HIS 182.A O no hydrogen 3.362 N/A GLU 155.A N VAL 152.A O no hydrogen 2.902 N/A LEU 156.A N LEU 179.A O no hydrogen 3.095 N/A ILE 157.A N ALA 150.A O no hydrogen 2.994 N/A ILE 158.A N LYS 177.A O no hydrogen 2.912 N/A PHE 159.A N VAL 148.A O no hydrogen 2.933 N/A ARG 160.A N LEU 174.A O no hydrogen 2.768 N/A LEU 161.A N ASN 146.A O no hydrogen 3.038 N/A VAL 162.A N ALA 172.A O no hydrogen 3.093 N/A SER 168.A N THR 165.A O no hydrogen 2.674 N/A ALA 172.A N VAL 162.A O no hydrogen 3.187 N/A LEU 174.A N ARG 160.A O no hydrogen 2.988 N/A VAL 176.A N ILE 158.A O no hydrogen 2.775 N/A ARG 178.A NE GLU 175.A OE1 no hydrogen 3.332 N/A ARG 178.A NH1 GLU 155.A OE2 no hydrogen 3.433 N/A ARG 178.A NH2 GLU 175.A OE2 no hydrogen 2.742 N/A LEU 179.A N LEU 156.A O no hydrogen 2.864 N/A HIS 182.A NE2 THR 199.A OG1 no hydrogen 2.639 N/A GLN 183.A N GLU 205.A OE1 no hydrogen 3.072 N/A ASP 184.A N GLU 205.A OE2 no hydrogen 3.274 N/A ILE 186.A N GLY 153.A O no hydrogen 2.736 N/A LEU 187.A N GLY 200.A O no hydrogen 2.712 N/A SER 188.A N GLY 200.A O no hydrogen 3.277 N/A ILE 190.A N VAL 198.A O no hydrogen 3.015 N/A ASN 191.A ND2 GLU 142.A O no hydrogen 3.205 N/A ASN 191.A ND2 ASP 194.A OD1 no hydrogen 3.064 N/A VAL 192.A N SER 196.A O no hydrogen 2.865 N/A ASP 194.A N ASN 191.A OD1 no hydrogen 2.820 N/A LEU 195.A N VAL 192.A O no hydrogen 3.361 N/A LEU 195.A N ASN 193.A OD1 no hydrogen 2.747 N/A SER 196.A N VAL 192.A O no hydrogen 3.298 N/A SER 196.A OG TRP 209.A O no hydrogen 3.506 N/A SER 196.A OG GLN 217.A OE1 no hydrogen 2.739 N/A PHE 197.A N TRP 209.A O no hydrogen 2.936 N/A VAL 198.A N ILE 190.A O no hydrogen 2.911 N/A THR 199.A N ILE 207.A O no hydrogen 2.923 N/A THR 199.A OG1 HIS 182.A NE2 no hydrogen 2.639 N/A GLY 200.A N SER 188.A O no hydrogen 3.020 N/A SER 201.A N GLU 205.A O no hydrogen 3.244 N/A SER 201.A OG GLU 205.A OE2 no hydrogen 2.787 N/A HIS 202.A ND1 ASP 184.A OD2 no hydrogen 2.536 N/A VAL 203.A N ASP 184.A OD2 no hydrogen 3.250 N/A GLY 204.A N SER 201.A O no hydrogen 3.141 N/A LEU 206.A N GLU 220.A O no hydrogen 3.047 N/A ILE 207.A N THR 199.A O no hydrogen 2.874 N/A ILE 208.A N ALA 218.A O no hydrogen 3.054 N/A TRP 209.A N PHE 197.A O no hydrogen 2.678 N/A TRP 209.A NE1 THR 199.A OG1 no hydrogen 3.007 N/A ASP 210.A N THR 215.A O no hydrogen 2.882 N/A ALA 211.A N LEU 195.A O no hydrogen 2.965 N/A LEU 212.A N ASP 210.A OD1 no hydrogen 2.638 N/A ASP 213.A N ASP 210.A OD1 no hydrogen 2.841 N/A TRP 214.A N ASP 210.A O no hydrogen 2.915 N/A THR 215.A N ASP 213.A OD1 no hydrogen 3.063 N/A THR 215.A OG1 ASP 213.A OD1 no hydrogen 2.537 N/A GLN 217.A N ILE 208.A O no hydrogen 2.868 N/A ALA 218.A N ILE 208.A O no hydrogen 3.428 N/A GLU 220.A N LEU 206.A O no hydrogen 2.915 N/A PHE 223.A N GLY 204.A O no hydrogen 2.981 N/A ASP 225.A N ASN 222.A OD1 no hydrogen 2.853 N/A ILE 228.A N HIS 202.A O no hydrogen 3.110 N/A HIS 229.A N ALA 241.A O no hydrogen 2.945 N/A THR 232.A N PHE 239.A O no hydrogen 3.058 N/A THR 232.A OG1 VAL 271.A O no hydrogen 2.778 N/A ASP 234.A N ASN 237.A O no hydrogen 3.106 N/A GLU 236.A N ASP 234.A OD1 no hydrogen 3.027 N/A ASN 237.A N ASP 234.A OD1 no hydrogen 2.667 N/A VAL 238.A N TYR 249.A O no hydrogen 2.758 N/A PHE 239.A N THR 232.A O no hydrogen 2.931 N/A ALA 240.A N TYR 247.A O no hydrogen 2.918 N/A ALA 241.A N HIS 230.A O no hydrogen 2.998 N/A VAL 242.A N GLY 245.A O no hydrogen 3.020 N/A GLY 243.A N SER 227.A O no hydrogen 3.353 N/A ARG 244.A NE HIS 264.A O no hydrogen 2.912 N/A GLY 245.A N VAL 242.A O no hydrogen 2.858 N/A LEU 246.A N GLN 260.A O no hydrogen 2.780 N/A TYR 247.A N ALA 240.A O no hydrogen 3.057 N/A VAL 248.A N ALA 258.A O no hydrogen 2.835 N/A TYR 249.A N VAL 238.A O no hydrogen 2.893 N/A TYR 249.A OH GLU 220.A OE1 no hydrogen 3.142 N/A SER 250.A N ARG 255.A O no hydrogen 2.765 N/A LEU 251.A N GLU 236.A O no hydrogen 2.955 N/A MET 253.A N SER 250.A OG no hydrogen 3.129 N/A ILE 257.A N VAL 248.A O no hydrogen 2.827 N/A ALA 258.A N VAL 248.A O no hydrogen 3.462 N/A GLN 260.A N LEU 246.A O no hydrogen 2.923 N/A ALA 263.A N ARG 244.A O no hydrogen 2.690 N/A HIS 264.A N ARG 244.A O no hydrogen 3.296 N/A HIS 264.A ND1 SER 287.A OG no hydrogen 3.247 N/A HIS 264.A NE2 SER 281.A OG no hydrogen 2.754 N/A SER 266.A OG ASP 285.A OD2 no hydrogen 2.172 N/A VAL 268.A N GLY 243.A O no hydrogen 2.832 N/A LEU 269.A N CYS 282.A O no hydrogen 2.717 N/A HIS 270.A N CYS 282.A O no hydrogen 3.411 N/A ALA 272.A N ILE 280.A O no hydrogen 3.022 N/A ARG 273.A NE ASP 234.A OD2 no hydrogen 2.892 N/A LEU 274.A N GLN 278.A O no hydrogen 2.764 N/A ASN 276.A ND2 TYR 313.A OH no hydrogen 3.440 N/A ARG 277.A N LEU 274.A O no hydrogen 2.783 N/A GLN 278.A N ASN 276.A OD1 no hydrogen 2.969 N/A GLN 278.A NE2 ASN 276.A OD1 no hydrogen 3.458 N/A LEU 279.A N TRP 291.A O no hydrogen 2.805 N/A ILE 280.A N ALA 272.A O no hydrogen 2.890 N/A SER 281.A N ARG 289.A O no hydrogen 2.902 N/A SER 281.A OG HIS 264.A NE2 no hydrogen 2.754 N/A CYS 282.A N HIS 270.A O no hydrogen 2.834 N/A CYS 282.A SG HIS 270.A O no hydrogen 4.041 N/A SER 283.A N SER 287.A O no hydrogen 3.174 N/A SER 283.A OG ASP 285.A OD2 no hydrogen 3.434 N/A SER 283.A OG SER 287.A O no hydrogen 2.811 N/A SER 283.A OG SER 287.A OG no hydrogen 2.663 N/A GLU 284.A N ASN 267.A O no hydrogen 3.036 N/A ASP 285.A N SER 266.A OG no hydrogen 3.091 N/A SER 287.A N ASP 285.A OD1 no hydrogen 3.094 N/A SER 287.A OG HIS 264.A ND1 no hydrogen 3.247 N/A SER 287.A OG SER 283.A OG no hydrogen 2.663 N/A SER 287.A OG ASP 285.A OD1 no hydrogen 2.669 N/A SER 287.A OG ASP 285.A OD2 no hydrogen 3.171 N/A VAL 288.A N LEU 301.A O no hydrogen 3.138 N/A ARG 289.A N SER 281.A O no hydrogen 3.008 N/A ILE 290.A N GLY 299.A O no hydrogen 2.922 N/A TRP 291.A N LEU 279.A O no hydrogen 2.797 N/A TRP 291.A NE1 SER 281.A OG no hydrogen 2.744 N/A GLU 292.A N GLU 296.A O no hydrogen 2.919 N/A GLU 296.A N GLU 292.A O no hydrogen 2.676 N/A ILE 298.A N ILE 290.A O no hydrogen 2.888 N/A GLY 299.A N ILE 290.A O no hydrogen 3.121 N/A LEU 301.A N VAL 288.A O no hydrogen 2.691 N/A HIS 304.A ND1 ASP 325.A OD2 no hydrogen 3.288 N/A HIS 304.A NE2 THR 321.A OG1 no hydrogen 2.629 N/A SER 305.A N ASP 325.A OD2 no hydrogen 2.946 N/A SER 307.A OG GLU 284.A O no hydrogen 3.281 N/A VAL 308.A N SER 283.A O no hydrogen 3.205 N/A GLU 309.A N CYS 322.A O no hydrogen 2.911 N/A LEU 312.A N VAL 320.A O no hydrogen 2.861 N/A PHE 314.A N GLY 318.A O no hydrogen 2.858 N/A HIS 317.A N PHE 314.A O no hydrogen 3.381 N/A GLY 318.A N PHE 314.A O no hydrogen 2.994 N/A LEU 319.A N TRP 331.A O no hydrogen 2.789 N/A VAL 320.A N LEU 312.A O no hydrogen 2.767 N/A THR 321.A N ILE 329.A O no hydrogen 2.785 N/A THR 321.A OG1 HIS 304.A NE2 no hydrogen 2.629 N/A THR 321.A OG1 ILE 329.A O no hydrogen 3.311 N/A CYS 322.A N MET 310.A O no hydrogen 3.227 N/A CYS 322.A SG VAL 15.A O no hydrogen 3.407 N/A CYS 322.A SG MET 310.A O no hydrogen 3.881 N/A SER 323.A OG SER 306.A O no hydrogen 2.694 N/A SER 323.A OG SER 307.A O no hydrogen 2.794 N/A ALA 324.A N SER 307.A O no hydrogen 2.750 N/A ASP 325.A N SER 323.A OG no hydrogen 3.124 N/A HIS 326.A N SER 323.A O no hydrogen 3.175 N/A LEU 327.A N ASP 325.A OD1 no hydrogen 2.869 N/A ILE 328.A N LEU 8.A O no hydrogen 3.324 N/A ILE 329.A N THR 321.A O no hydrogen 2.886 N/A LEU 330.A N LEU 6.A O no hydrogen 2.953 N/A TRP 331.A N LEU 319.A O no hydrogen 2.584 N/A TRP 331.A NE1 THR 321.A OG1 no hydrogen 2.929 N/A LYS 332.A N GLU 4.A O no hydrogen 2.918 N/A LYS 332.A NZ ALA 40.A O no hydrogen 2.829 N/A LYS 332.A NZ GLN 41.A O no hydrogen 2.911 N/A LYS 332.A NZ HIS 317.A O no hydrogen 2.962 N/A