Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wxe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N GLU 4.A OE2 no hydrogen 2.900 N/A GLU 4.A N GLU 4.A OE2 no hydrogen 2.878 N/A MET 6.A N LEU 3.A O no hydrogen 2.959 N/A GLY 8.A N VAL 252.A O no hydrogen 2.797 N/A LYS 11.A N PRO 250.A O no hydrogen 3.136 N/A LYS 11.A NZ VAL 5.A O no hydrogen 3.171 N/A LYS 11.A NZ HIS 70.A O no hydrogen 3.047 N/A GLY 12.A N GLY 71.A O no hydrogen 2.516 N/A GLN 14.A N VAL 73.A O no hydrogen 3.029 N/A GLN 14.A NE2 ASN 248.A O no hydrogen 2.836 N/A GLY 15.A N SER 236.A O no hydrogen 2.982 N/A HIS 16.A N SER 19.A OG no hydrogen 2.768 N/A ASN 18.A ND2 SER 96.A O no hydrogen 3.016 N/A SER 19.A OG HIS 16.A O no hydrogen 3.250 N/A SER 19.A OG ASP 23.A OD2 no hydrogen 2.746 N/A SER 20.A OG GLU 98.A OE1 no hydrogen 2.701 N/A SER 20.A OG GLU 98.A OE2 no hydrogen 3.022 N/A TYR 21.A N GLU 98.A OE1 no hydrogen 2.640 N/A LEU 22.A N SER 19.A O no hydrogen 2.946 N/A ASP 23.A N SER 19.A O no hydrogen 3.116 N/A SER 24.A N SER 20.A O no hydrogen 3.001 N/A SER 24.A OG SER 20.A O no hydrogen 3.291 N/A THR 25.A OG1 TYR 21.A O no hydrogen 2.806 N/A THR 25.A OG1 LEU 22.A O no hydrogen 2.672 N/A LEU 26.A N LEU 22.A O no hydrogen 3.008 N/A PHE 27.A N ASP 23.A O no hydrogen 3.019 N/A CYS 28.A N SER 24.A O no hydrogen 2.924 N/A CYS 28.A SG SER 24.A O no hydrogen 3.108 N/A LEU 29.A N THR 25.A O no hydrogen 2.890 N/A PHE 30.A N LEU 26.A O no hydrogen 2.914 N/A SER 31.A N PHE 27.A O no hydrogen 3.148 N/A SER 31.A OG PHE 27.A O no hydrogen 2.397 N/A SER 33.A OG GLN 294.A OE1 no hydrogen 2.652 N/A SER 34.A OG ASP 37.A OD2 no hydrogen 2.867 N/A VAL 35.A N SER 33.A OG no hydrogen 3.387 N/A ASP 37.A N SER 34.A O no hydrogen 3.250 N/A LEU 40.A N ASP 37.A O no hydrogen 2.772 N/A LEU 41.A N THR 38.A O no hydrogen 2.887 N/A ARG 42.A NH1 ASP 48.A OD1 no hydrogen 2.707 N/A SER 45.A N ASP 48.A OD2 no hydrogen 2.797 N/A THR 47.A N SER 45.A OG no hydrogen 3.031 N/A TYR 52.A N VAL 49.A O no hydrogen 3.244 N/A TYR 52.A OH ARG 42.A O no hydrogen 2.589 N/A THR 55.A N TYR 51.A O no hydrogen 3.000 N/A THR 55.A OG1 TYR 51.A O no hydrogen 2.682 N/A GLN 56.A N TYR 52.A O no hydrogen 2.979 N/A GLN 56.A NE2 VAL 39.A O no hydrogen 3.119 N/A GLN 56.A NE2 ARG 42.A O no hydrogen 3.003 N/A GLU 57.A N LYS 53.A O no hydrogen 2.888 N/A LEU 58.A N GLU 54.A O no hydrogen 2.965 N/A LEU 59.A N THR 55.A O no hydrogen 3.080 N/A ARG 60.A N GLN 56.A O no hydrogen 2.931 N/A ARG 60.A NH1 LEU 40.A O no hydrogen 2.604 N/A ARG 60.A NH1 GLN 56.A OE1 no hydrogen 3.453 N/A THR 61.A N GLU 57.A O no hydrogen 2.959 N/A THR 61.A OG1 GLU 57.A O no hydrogen 2.520 N/A GLU 62.A N LEU 58.A O no hydrogen 2.983 N/A VAL 64.A N LEU 59.A O no hydrogen 3.026 N/A ASN 65.A N ARG 60.A O no hydrogen 2.927 N/A LEU 67.A N ILE 63.A O no hydrogen 2.989 N/A ARG 68.A N VAL 64.A O no hydrogen 2.944 N/A ARG 68.A NE PHE 30.A O no hydrogen 2.832 N/A ARG 68.A NH1 ASP 37.A OD2 no hydrogen 3.095 N/A ARG 68.A NH2 PHE 30.A O no hydrogen 3.055 N/A ARG 68.A NH2 ASP 37.A OD1 no hydrogen 2.988 N/A ARG 68.A NH2 ASP 37.A OD2 no hydrogen 3.179 N/A ILE 69.A N ASN 65.A O no hydrogen 3.099 N/A HIS 70.A N PRO 66.A O no hydrogen 2.842 N/A GLY 71.A N LEU 67.A O no hydrogen 2.910 N/A VAL 73.A N GLY 12.A O no hydrogen 2.997 N/A ALA 75.A N GLN 14.A OE1 no hydrogen 2.956 N/A LYS 77.A N CYS 74.A O no hydrogen 3.333 N/A LYS 77.A NZ GLU 62.A OE1 no hydrogen 3.099 N/A MET 79.A N ALA 75.A O no hydrogen 2.838 N/A LYS 80.A N THR 76.A O no hydrogen 3.033 N/A LYS 80.A NZ GLU 62.A OE1 no hydrogen 3.209 N/A LEU 81.A N LYS 77.A O no hydrogen 3.106 N/A ARG 82.A N ILE 78.A O no hydrogen 2.859 N/A ARG 82.A NH1 TYR 17.A O no hydrogen 3.016 N/A ARG 82.A NH1 PHE 94.A O no hydrogen 3.481 N/A ARG 82.A NH2 TYR 17.A O no hydrogen 2.866 N/A ARG 83.A N MET 79.A O no hydrogen 2.958 N/A ILE 84.A N LYS 80.A O no hydrogen 3.194 N/A LEU 85.A N LEU 81.A O no hydrogen 3.099 N/A GLU 86.A N ARG 82.A O no hydrogen 2.950 N/A LYS 87.A N ARG 83.A O no hydrogen 2.835 N/A VAL 88.A N ILE 84.A O no hydrogen 3.022 N/A GLU 89.A N LEU 85.A O no hydrogen 2.712 N/A SER 92.A OG GLU 89.A O no hydrogen 3.424 N/A SER 92.A OG ALA 90.A O no hydrogen 2.952 N/A PHE 94.A N GLU 86.A OE1 no hydrogen 3.269 N/A THR 95.A N GLU 86.A OE2 no hydrogen 3.217 N/A THR 95.A OG1 GLU 86.A OE2 no hydrogen 2.518 N/A SER 96.A N GLY 93.A O no hydrogen 3.249 N/A GLU 97.A N GLY 93.A O no hydrogen 3.033 N/A LYS 99.A NZ SER 92.A O no hydrogen 3.002 N/A LYS 99.A NZ GLU 103.A OE2 no hydrogen 2.890 N/A ASP 100.A N GLU 103.A OE1 no hydrogen 3.128 N/A GLU 102.A N ASP 100.A OD1 no hydrogen 3.104 N/A GLU 103.A N ASP 100.A O no hydrogen 3.035 N/A PHE 104.A N ASP 100.A O no hydrogen 3.330 N/A LEU 105.A N PRO 101.A O no hydrogen 2.882 N/A ASN 106.A N GLU 102.A O no hydrogen 2.867 N/A ILE 107.A N GLU 103.A O no hydrogen 3.022 N/A LEU 108.A N PHE 104.A O no hydrogen 2.919 N/A PHE 109.A N LEU 105.A O no hydrogen 2.680 N/A HIS 110.A N ASN 106.A O no hydrogen 2.907 N/A HIS 111.A N ILE 107.A O no hydrogen 3.311 N/A ILE 112.A N ILE 107.A O no hydrogen 3.327 N/A LEU 113.A N LEU 108.A O no hydrogen 2.959 N/A VAL 115.A N PHE 109.A O no hydrogen 3.189 N/A LEU 119.A N CYS 131.A O no hydrogen 2.846 N/A ARG 120.A NH1 ASP 130.A OD2 no hydrogen 2.922 N/A LEU 121.A N GLN 129.A O no hydrogen 3.012 N/A ARG 122.A N LYS 163.A O no hydrogen 2.869 N/A ARG 122.A NH1 ASP 201.A OD2 no hydrogen 3.032 N/A SER 123.A OG SER 160.A O no hydrogen 3.298 N/A GLN 126.A N SER 123.A O no hydrogen 3.262 N/A GLN 129.A N LEU 121.A O no hydrogen 2.853 N/A CYS 131.A N LEU 119.A O no hydrogen 2.915 N/A CYS 131.A SG PHE 133.A O no hydrogen 3.586 N/A TYR 132.A OH VAL 115.A O no hydrogen 2.566 N/A TYR 134.A N ILE 172.A O no hydrogen 2.916 N/A TYR 134.A OH SER 156.A OG no hydrogen 2.606 N/A GLN 135.A NE2 ILE 136.A O no hydrogen 3.104 N/A GLN 135.A NE2 MET 175.A O no hydrogen 3.547 N/A ILE 136.A N GLN 174.A O no hydrogen 3.089 N/A PHE 137.A N SER 156.A OG no hydrogen 3.147 N/A ASP 142.A N ASP 142.A OD1 no hydrogen 2.473 N/A LYS 143.A N LYS 140.A O no hydrogen 2.704 N/A LYS 143.A NZ ASP 142.A OD2 no hydrogen 2.749 N/A THR 148.A N GLN 151.A OE1 no hydrogen 2.952 N/A SER 149.A N PHE 189.A O no hydrogen 2.798 N/A SER 149.A OG SER 191.A OG no hydrogen 3.294 N/A SER 149.A OG TYR 293.A OH no hydrogen 2.759 N/A GLN 151.A N THR 148.A OG1 no hydrogen 3.122 N/A LEU 152.A N THR 148.A O no hydrogen 3.102 N/A LEU 153.A N SER 149.A O no hydrogen 2.834 N/A GLU 154.A N GLN 150.A O no hydrogen 2.938 N/A TRP 155.A N GLN 151.A O no hydrogen 2.948 N/A SER 156.A N LEU 152.A O no hydrogen 2.816 N/A SER 156.A OG TYR 134.A OH no hydrogen 2.606 N/A SER 156.A OG GLN 135.A O no hydrogen 3.472 N/A PHE 157.A N LEU 153.A O no hydrogen 2.921 N/A ILE 158.A N GLU 154.A O no hydrogen 2.933 N/A ASN 159.A N TRP 155.A O no hydrogen 3.032 N/A SER 160.A N SER 156.A O no hydrogen 3.333 N/A ASP 161.A N ILE 158.A O no hydrogen 2.977 N/A LEU 162.A N PHE 157.A O no hydrogen 2.763 N/A LYS 163.A N ARG 122.A O no hydrogen 2.875 N/A PHE 164.A N LEU 199.A O no hydrogen 2.654 N/A ALA 165.A N ARG 120.A O no hydrogen 3.046 N/A LEU 171.A N TYR 293.A O no hydrogen 2.839 N/A ILE 173.A N CYS 291.A O no hydrogen 2.900 N/A GLN 174.A N TYR 134.A O no hydrogen 2.707 N/A MET 175.A N TYR 289.A O no hydrogen 2.940 N/A ARG 177.A NE ALA 288.A O no hydrogen 3.513 N/A ARG 177.A NH1 ILE 213.A O no hydrogen 2.528 N/A ARG 177.A NH1 ALA 288.A O no hydrogen 3.366 N/A ARG 177.A NH2 ILE 213.A O no hydrogen 3.134 N/A PHE 178.A N PHE 182.A O no hydrogen 2.981 N/A PHE 182.A N GLY 179.A O no hydrogen 3.479 N/A LYS 183.A NZ CYS 286.A O no hydrogen 2.746 N/A LYS 183.A NZ ASP 287.A OD1 no hydrogen 2.739 N/A MET 184.A N PRO 176.A O no hydrogen 3.380 N/A LYS 187.A NZ LEU 269.A O no hydrogen 3.331 N/A LYS 187.A NZ LEU 272.A O no hydrogen 3.340 N/A ILE 188.A N LEU 285.A O no hydrogen 2.955 N/A PHE 189.A N PRO 147.A O no hydrogen 2.879 N/A SER 191.A N SER 149.A OG no hydrogen 2.807 N/A SER 191.A OG SER 149.A OG no hydrogen 3.294 N/A LEU 194.A N MET 205.A O no hydrogen 2.894 N/A ASP 195.A N GLN 150.A OE1 no hydrogen 2.611 N/A ILE 196.A N GLN 203.A O no hydrogen 3.138 N/A THR 197.A N ASP 195.A OD1 no hydrogen 3.196 N/A THR 197.A OG1 ASP 195.A OD1 no hydrogen 2.530 N/A LEU 199.A N ILE 196.A O no hydrogen 2.806 N/A MET 205.A N LEU 194.A O no hydrogen 2.896 N/A GLU 206.A N GLN 294.A O no hydrogen 2.591 N/A LEU 207.A N LEU 192.A O no hydrogen 2.972 N/A PHE 208.A N MET 292.A O no hydrogen 2.970 N/A VAL 210.A N PHE 221.A O no hydrogen 2.774 N/A LEU 211.A N MET 290.A O no hydrogen 2.825 N/A CYS 212.A N VAL 219.A O no hydrogen 2.868 N/A CYS 212.A SG ARG 283.A O no hydrogen 3.494 N/A ILE 213.A N ASP 287.A O no hydrogen 2.825 N/A HIS 217.A NE2 ASP 235.A OD1 no hydrogen 2.923 N/A TYR 218.A N SER 20.A OG no hydrogen 3.010 N/A VAL 219.A N CYS 212.A O no hydrogen 2.892 N/A ALA 220.A N PHE 234.A O no hydrogen 2.938 N/A PHE 221.A N VAL 210.A O no hydrogen 2.824 N/A VAL 222.A N LEU 232.A O no hydrogen 2.905 N/A LYS 223.A N PHE 208.A O no hydrogen 2.835 N/A LYS 223.A NZ SER 226.A O no hydrogen 3.492 N/A TYR 224.A N ALA 230.A O no hydrogen 3.034 N/A ALA 230.A N ALA 227.A O no hydrogen 2.971 N/A TRP 231.A N SER 229.A O no hydrogen 2.951 N/A LEU 232.A N VAL 222.A O no hydrogen 2.909 N/A PHE 233.A N SER 253.A O no hydrogen 2.829 N/A PHE 234.A N ALA 220.A O no hydrogen 2.752 N/A ASP 235.A N GLN 251.A O no hydrogen 3.052 N/A SER 236.A OG ASP 23.A OD2 no hydrogen 3.162 N/A MET 237.A N ASP 235.A OD1 no hydrogen 3.251 N/A ALA 238.A N ILE 249.A O no hydrogen 2.971 N/A ASP 239.A N ILE 249.A O no hydrogen 3.120 N/A ARG 240.A N ASP 239.A OD1 no hydrogen 2.810 N/A ARG 240.A NE ASN 248.A OD1 no hydrogen 3.185 N/A ARG 240.A NH1 GLY 243.A O no hydrogen 2.892 N/A ARG 240.A NH2 ASN 248.A OD1 no hydrogen 2.987 N/A ASP 241.A N PHE 247.A O no hydrogen 2.738 N/A PHE 247.A N ASP 241.A O no hydrogen 2.777 N/A ASN 248.A ND2 GLY 15.A O no hydrogen 3.005 N/A ILE 249.A N ASP 239.A O no hydrogen 2.747 N/A GLN 251.A N ASP 235.A O no hydrogen 2.943 N/A VAL 252.A N GLY 8.A O no hydrogen 2.928 N/A SER 253.A N PHE 233.A O no hydrogen 2.837 N/A CYS 255.A N TRP 231.A O no hydrogen 3.197 N/A VAL 258.A N CYS 255.A O no hydrogen 3.067 N/A GLU 260.A N GLU 257.A O no hydrogen 3.050 N/A TYR 261.A N GLU 257.A O no hydrogen 3.181 N/A LEU 262.A N VAL 258.A O no hydrogen 2.980 N/A LYS 263.A N GLU 260.A O no hydrogen 3.239 N/A LYS 263.A NZ GLU 260.A OE2 no hydrogen 3.107 N/A MET 264.A N TYR 261.A O no hydrogen 3.231 N/A THR 265.A N GLU 268.A OE1 no hydrogen 2.860 N/A THR 265.A OG1 GLU 268.A OE1 no hydrogen 3.349 N/A GLU 267.A N GLU 267.A OE1 no hydrogen 2.945 N/A GLU 268.A N THR 265.A O no hydrogen 3.149 N/A GLU 268.A N THR 265.A OG1 no hydrogen 3.158 N/A LEU 269.A N THR 265.A O no hydrogen 3.098 N/A HIS 270.A N PRO 266.A O no hydrogen 2.803 N/A ALA 271.A N GLU 267.A O no hydrogen 3.363 N/A LEU 272.A N LEU 269.A O no hydrogen 3.142 N/A LYS 275.A NZ ASP 273.A OD2 no hydrogen 3.467 N/A ASN 276.A N ASP 273.A O no hydrogen 2.691 N/A GLN 278.A N TYR 261.A OH no hydrogen 2.798 N/A GLN 278.A NE2 ASN 276.A O no hydrogen 3.363 N/A ARG 283.A N TYR 280.A O no hydrogen 2.941 N/A LEU 285.A N ALA 281.A O no hydrogen 3.083 N/A CYS 286.A N ARG 282.A O no hydrogen 2.952 N/A CYS 286.A SG ASN 186.A O no hydrogen 3.780 N/A CYS 286.A SG ARG 282.A O no hydrogen 3.348 N/A ASP 287.A N ARG 283.A O no hydrogen 2.889 N/A TYR 289.A N LEU 211.A O no hydrogen 2.771 N/A TYR 289.A OH ASP 100.A OD1 no hydrogen 2.192 N/A MET 290.A N LEU 211.A O no hydrogen 2.992 N/A CYS 291.A N ILE 173.A O no hydrogen 2.865 N/A MET 292.A N ALA 209.A O no hydrogen 3.036 N/A TYR 293.A N LEU 171.A O no hydrogen 2.707 N/A TYR 293.A OH SER 149.A OG no hydrogen 2.759 N/A TYR 293.A OH SER 191.A O no hydrogen 2.623 N/A GLN 294.A N GLU 206.A O no hydrogen 2.776 N/A GLN 294.A NE2 GLU 206.A OE2 no hydrogen 2.948 N/A SER 295.A N SER 169.A O no hydrogen 3.219 N/A THR 297.A N GLU 206.A OE2 no hydrogen 3.066 N/A MET 298.A N GLU 206.A OE2 no hydrogen 3.055 N/A SER 299.A OG GLU 206.A OE1 no hydrogen 3.350 N/A