Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8e5n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ALA 1.A O no hydrogen 2.960 N/A ARG 4.A NE TYR 263.A OH no hydrogen 3.013 N/A ARG 4.A NH1 GLN 41.A O no hydrogen 2.952 N/A ARG 4.A NH2 TYR 263.A OH no hydrogen 3.317 N/A THR 5.A OG1 ALA 1.A O no hydrogen 2.355 N/A ILE 6.A N ASP 44.A O no hydrogen 2.880 N/A GLY 7.A N ILE 91.A O no hydrogen 3.007 N/A ILE 8.A N LYS 46.A O no hydrogen 2.951 N/A ILE 9.A N LEU 93.A O no hydrogen 2.840 N/A GLY 10.A N GLY 49.A O no hydrogen 2.855 N/A ALA 11.A N LEU 95.A O no hydrogen 2.780 N/A SER 14.A OG GLU 23.A OE1 no hydrogen 3.129 N/A GLN 17.A N SER 14.A O no hydrogen 3.338 N/A GLN 17.A NE2 SER 14.A O no hydrogen 3.003 N/A GLN 17.A NE2 ARG 19.A O no hydrogen 2.870 N/A ARG 19.A NH1 GLY 243.A O no hydrogen 3.239 N/A GLY 21.A N GLU 23.A OE1 no hydrogen 2.915 N/A GLU 23.A N GLU 23.A OE1 no hydrogen 2.826 N/A GLU 24.A N GLY 21.A O no hydrogen 3.200 N/A THR 27.A OG1 GLU 24.A OE1 no hydrogen 2.838 N/A LEU 29.A N GLY 25.A O no hydrogen 3.240 N/A ARG 30.A NE ASP 50.A OD1 no hydrogen 2.794 N/A ARG 30.A NH1 ASP 47.A OD1 no hydrogen 3.406 N/A ARG 30.A NH1 ASP 47.A OD2 no hydrogen 2.665 N/A ARG 30.A NH2 ASP 47.A OD1 no hydrogen 2.773 N/A ARG 30.A NH2 ASP 47.A OD2 no hydrogen 3.093 N/A ARG 30.A NH2 ASP 50.A OD1 no hydrogen 2.886 N/A LYS 31.A N THR 27.A O no hydrogen 3.033 N/A ALA 32.A N VAL 28.A O no hydrogen 3.065 N/A GLY 33.A N ARG 30.A O no hydrogen 3.149 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.812 N/A LYS 37.A N GLY 33.A O no hydrogen 3.337 N/A LYS 37.A NZ ALA 32.A O no hydrogen 3.520 N/A LYS 37.A NZ GLY 33.A O no hydrogen 3.381 N/A LEU 38.A N LEU 34.A O no hydrogen 3.278 N/A LYS 39.A N LEU 35.A O no hydrogen 3.274 N/A GLN 41.A N LYS 37.A O no hydrogen 3.190 N/A GLN 41.A NE2 LEU 299.A O no hydrogen 3.188 N/A CYS 43.A N LEU 38.A O no hydrogen 3.211 N/A CYS 43.A SG GLN 41.A O no hydrogen 3.909 N/A ASP 44.A N ARG 4.A O no hydrogen 2.947 N/A LYS 46.A N ILE 6.A O no hydrogen 3.157 N/A TYR 48.A N ILE 8.A O no hydrogen 3.269 N/A LEU 51.A N GLY 10.A O no hydrogen 2.872 N/A PHE 62.A N VAL 65.A O no hydrogen 3.119 N/A VAL 65.A N PHE 62.A O no hydrogen 3.190 N/A LYS 66.A N GLY 136.A O no hydrogen 3.089 N/A LYS 66.A NZ ILE 64.A O no hydrogen 3.184 N/A ARG 69.A N ASP 59.A OD1 no hydrogen 3.340 N/A SER 70.A N ASP 59.A OD2 no hydrogen 2.911 N/A SER 70.A OG ASP 59.A OD2 no hydrogen 2.618 N/A VAL 71.A N ASN 67.A O no hydrogen 3.388 N/A GLY 72.A N PRO 68.A O no hydrogen 2.899 N/A LYS 73.A N ARG 69.A O no hydrogen 2.985 N/A LYS 73.A NZ GLU 76.A OE1 no hydrogen 3.520 N/A ALA 74.A N SER 70.A O no hydrogen 2.848 N/A SER 75.A N VAL 71.A O no hydrogen 3.012 N/A SER 75.A OG VAL 71.A O no hydrogen 3.161 N/A SER 75.A OG SER 100.A O no hydrogen 2.945 N/A GLN 77.A N LYS 73.A O no hydrogen 2.846 N/A LEU 78.A N ALA 74.A O no hydrogen 3.049 N/A ALA 79.A N SER 75.A O no hydrogen 2.896 N/A LYS 81.A NZ GLU 84.A OE1 no hydrogen 2.720 N/A VAL 82.A N LEU 78.A O no hydrogen 2.802 N/A ALA 83.A N ALA 79.A O no hydrogen 3.068 N/A GLU 84.A N GLY 80.A O no hydrogen 3.279 N/A VAL 85.A N LYS 81.A O no hydrogen 3.012 N/A LYS 86.A N VAL 82.A O no hydrogen 2.903 N/A LYS 86.A NZ ARG 90.A O no hydrogen 3.404 N/A LYS 86.A NZ SER 269.A O no hydrogen 2.920 N/A LYS 87.A N ALA 83.A O no hydrogen 2.854 N/A ASN 88.A N GLU 84.A O no hydrogen 2.909 N/A ASN 88.A N VAL 85.A O no hydrogen 3.138 N/A ASN 88.A ND2 TYR 48.A OH no hydrogen 3.335 N/A ARG 90.A NH1 ILE 6.A O no hydrogen 2.841 N/A ARG 90.A NH1 ASP 44.A O no hydrogen 2.867 N/A ARG 90.A NH2 ASP 44.A OD2 no hydrogen 2.849 N/A ILE 91.A N THR 5.A O no hydrogen 2.986 N/A LEU 93.A N GLY 7.A O no hydrogen 3.150 N/A VAL 94.A N LEU 271.A O no hydrogen 2.961 N/A LEU 95.A N ILE 9.A O no hydrogen 2.885 N/A GLY 96.A N ILE 273.A O no hydrogen 2.939 N/A GLY 97.A N VAL 22.A O no hydrogen 2.855 N/A ASP 98.A N PHE 13.A O no hydrogen 3.177 N/A HIS 99.A N GLU 275.A OE2 no hydrogen 3.124 N/A HIS 99.A ND1 ASP 230.A OD2 no hydrogen 3.179 N/A HIS 99.A NE2 SER 228.A OG no hydrogen 2.773 N/A SER 100.A N ASP 98.A OD1 no hydrogen 2.848 N/A SER 100.A OG ASP 98.A OD1 no hydrogen 2.709 N/A ALA 102.A N HIS 99.A O no hydrogen 2.912 N/A ILE 103.A N SER 100.A O no hydrogen 3.499 N/A SER 105.A N LEU 101.A O no hydrogen 3.107 N/A SER 105.A OG LEU 101.A O no hydrogen 3.546 N/A SER 105.A OG ASP 272.A OD1 no hydrogen 3.499 N/A ILE 106.A N ALA 102.A O no hydrogen 3.044 N/A SER 107.A N ILE 103.A O no hydrogen 2.880 N/A SER 107.A OG ILE 103.A O no hydrogen 2.831 N/A GLY 108.A N GLY 104.A O no hydrogen 2.807 N/A HIS 109.A N SER 105.A O no hydrogen 3.205 N/A HIS 109.A ND1 HIS 226.A ND1 no hydrogen 2.994 N/A ALA 110.A N ILE 106.A O no hydrogen 2.930 N/A VAL 112.A N HIS 109.A O no hydrogen 3.159 N/A HIS 113.A N HIS 109.A O no hydrogen 2.853 N/A LEU 116.A N HIS 113.A O no hydrogen 3.210 N/A GLY 117.A N PRO 224.A O no hydrogen 3.030 N/A VAL 118.A N ASP 171.A O no hydrogen 2.946 N/A ILE 119.A N HIS 226.A O no hydrogen 3.301 N/A TRP 120.A N VAL 173.A O no hydrogen 2.901 N/A TRP 120.A NE1 ASP 122.A OD2 no hydrogen 3.018 N/A TRP 120.A NE1 ASP 126.A OD2 no hydrogen 3.211 N/A VAL 121.A N SER 228.A O no hydrogen 3.340 N/A ASP 122.A N ILE 175.A O no hydrogen 3.323 N/A ALA 123.A N ASP 232.A OD1 no hydrogen 3.208 N/A HIS 124.A N ASP 122.A OD1 no hydrogen 3.114 N/A HIS 124.A NE2 ASP 179.A OD2 no hydrogen 2.867 N/A THR 125.A OG1 GLU 184.A OE2 no hydrogen 2.576 N/A ILE 127.A N GLU 184.A OE2 no hydrogen 2.808 N/A ASN 128.A N GLY 140.A O no hydrogen 3.156 N/A ASN 128.A ND2 ASP 181.A OD2 no hydrogen 3.337 N/A THR 129.A N THR 132.A OG1 no hydrogen 2.877 N/A THR 129.A OG1 THR 132.A OG1 no hydrogen 3.224 N/A LEU 131.A N THR 129.A OG1 no hydrogen 3.350 N/A THR 132.A N THR 129.A OG1 no hydrogen 3.005 N/A THR 132.A OG1 ASN 128.A OD1 no hydrogen 2.750 N/A THR 132.A OG1 THR 129.A OG1 no hydrogen 3.224 N/A THR 133.A N THR 129.A O no hydrogen 2.893 N/A GLY 136.A N THR 133.A OG1 no hydrogen 3.048 N/A ASN 137.A N SER 135.A OG no hydrogen 3.419 N/A HIS 139.A N GLY 16.A O no hydrogen 2.889 N/A HIS 139.A ND1 GLU 275.A OE2 no hydrogen 2.629 N/A GLN 141.A N LEU 138.A O no hydrogen 3.182 N/A GLN 141.A NE2 ASN 137.A O no hydrogen 2.925 N/A SER 144.A N GLN 141.A O no hydrogen 3.277 N/A SER 144.A OG ASN 128.A O no hydrogen 2.775 N/A SER 144.A OG GLN 141.A O no hydrogen 2.298 N/A LEU 146.A N PRO 142.A O no hydrogen 3.249 N/A LEU 147.A N VAL 143.A O no hydrogen 3.082 N/A LYS 148.A N ILE 167.A O no hydrogen 2.884 N/A GLU 149.A N GLU 149.A OE1 no hydrogen 2.838 N/A LYS 151.A N LYS 148.A O no hydrogen 3.028 N/A LYS 153.A N LEU 150.A O no hydrogen 2.861 N/A LYS 153.A NZ GLY 152.A O no hydrogen 3.389 N/A PHE 160.A N VAL 157.A O no hydrogen 3.171 N/A TRP 162.A NE1 GLY 72.A O no hydrogen 3.162 N/A TRP 162.A NE1 GLY 159.A O no hydrogen 2.841 N/A VAL 163.A N PHE 160.A O no hydrogen 3.235 N/A CYS 166.A N LEU 146.A O no hydrogen 2.879 N/A CYS 166.A SG ILE 106.A O no hydrogen 3.954 N/A ILE 167.A N LEU 146.A O no hydrogen 2.943 N/A SER 168.A N ASP 171.A OD2 no hydrogen 3.400 N/A SER 168.A OG ASP 171.A OD2 no hydrogen 3.301 N/A ALA 169.A N GLU 149.A OE1 no hydrogen 2.923 N/A ALA 169.A N GLU 149.A OE2 no hydrogen 3.348 N/A ASP 171.A N SER 168.A O no hydrogen 2.912 N/A VAL 173.A N VAL 118.A O no hydrogen 2.897 N/A TYR 174.A N LYS 194.A O no hydrogen 3.147 N/A ILE 175.A N TRP 120.A O no hydrogen 2.885 N/A GLY 176.A N PHE 196.A O no hydrogen 3.076 N/A ARG 178.A N ALA 123.A O no hydrogen 3.044 N/A ARG 178.A NE VAL 246.A O no hydrogen 3.014 N/A ARG 178.A NH1 GLY 176.A O no hydrogen 3.138 N/A ARG 178.A NH1 GLY 233.A O no hydrogen 2.867 N/A ARG 178.A NH2 ASP 232.A O no hydrogen 2.681 N/A ARG 178.A NH2 LEU 234.A O no hydrogen 3.112 N/A ARG 178.A NH2 VAL 246.A O no hydrogen 2.885 N/A ASP 179.A N ALA 123.A O no hydrogen 3.455 N/A GLU 184.A N ASP 181.A O no hydrogen 2.838 N/A HIS 185.A N ASP 181.A O no hydrogen 3.070 N/A TYR 186.A N PRO 182.A O no hydrogen 2.899 N/A ILE 187.A N GLY 183.A O no hydrogen 3.448 N/A LEU 188.A N GLU 184.A O no hydrogen 3.335 N/A LYS 189.A N HIS 185.A O no hydrogen 3.204 N/A THR 190.A N TYR 186.A O no hydrogen 2.984 N/A THR 190.A OG1 TYR 186.A O no hydrogen 2.932 N/A ILE 193.A N LEU 188.A O no hydrogen 3.460 N/A PHE 196.A N TYR 174.A O no hydrogen 2.937 N/A SER 197.A N GLU 200.A OE1 no hydrogen 3.120 N/A SER 197.A OG GLU 200.A OE1 no hydrogen 2.590 N/A MET 198.A N LEU 177.A O no hydrogen 2.886 N/A VAL 201.A N SER 197.A O no hydrogen 3.071 N/A ASP 202.A N MET 198.A O no hydrogen 2.908 N/A ARG 203.A N THR 199.A O no hydrogen 3.124 N/A ARG 203.A NH2 GLU 200.A OE2 no hydrogen 3.014 N/A LEU 204.A N GLU 200.A O no hydrogen 3.069 N/A GLY 205.A N VAL 201.A O no hydrogen 2.801 N/A LYS 208.A N GLY 205.A O no hydrogen 3.096 N/A LYS 208.A NZ LYS 208.A O no hydrogen 3.410 N/A VAL 209.A N GLY 205.A O no hydrogen 3.129 N/A MET 210.A N ILE 206.A O no hydrogen 3.097 N/A GLU 211.A N GLY 207.A O no hydrogen 2.890 N/A GLU 212.A N LYS 208.A O no hydrogen 2.905 N/A THR 213.A N VAL 209.A O no hydrogen 3.107 N/A THR 213.A OG1 VAL 209.A O no hydrogen 2.494 N/A SER 215.A N GLU 211.A O no hydrogen 3.323 N/A SER 215.A OG GLU 211.A O no hydrogen 3.148 N/A SER 215.A OG GLU 212.A O no hydrogen 3.212 N/A TYR 216.A N GLU 212.A O no hydrogen 3.180 N/A TYR 216.A N THR 213.A O no hydrogen 3.256 N/A LEU 217.A N THR 213.A O no hydrogen 2.978 N/A LEU 218.A N LEU 214.A O no hydrogen 3.208 N/A LYS 221.A NZ LYS 222.A O no hydrogen 2.941 N/A ARG 223.A NE ASP 115.A O no hydrogen 2.773 N/A ARG 223.A NH1 LEU 217.A O no hydrogen 2.764 N/A ARG 223.A NH2 ASP 115.A O no hydrogen 3.073 N/A ARG 223.A NH2 ASP 171.A OD1 no hydrogen 2.881 N/A ILE 225.A N LEU 267.A O no hydrogen 2.784 N/A HIS 226.A N GLY 117.A O no hydrogen 2.857 N/A HIS 226.A ND1 HIS 109.A ND1 no hydrogen 2.994 N/A HIS 226.A NE2 ASP 272.A OD2 no hydrogen 2.683 N/A LEU 227.A N GLY 270.A O no hydrogen 2.813 N/A SER 228.A N ILE 119.A O no hydrogen 2.963 N/A SER 228.A OG HIS 99.A NE2 no hydrogen 2.773 N/A SER 228.A OG ASP 272.A OD2 no hydrogen 2.627 N/A PHE 229.A N ASP 272.A O no hydrogen 2.851 N/A ASP 230.A N VAL 121.A O no hydrogen 3.071 N/A VAL 231.A N MET 274.A O no hydrogen 3.062 N/A ASP 232.A N ASP 230.A OD1 no hydrogen 2.973 N/A GLY 233.A N ASP 230.A O no hydrogen 3.007 N/A ASP 235.A N LEU 250.A O no hydrogen 2.783 N/A SER 237.A OG ASP 235.A OD2 no hydrogen 2.622 N/A PHE 238.A N ASP 235.A O no hydrogen 3.143 N/A THR 239.A N ASP 235.A O no hydrogen 3.307 N/A THR 239.A OG1 VAL 231.A O no hydrogen 2.758 N/A THR 239.A OG1 ASP 235.A O no hydrogen 3.320 N/A ALA 241.A N THR 290.A OG1 no hydrogen 3.007 N/A THR 242.A N PRO 240.A O no hydrogen 2.812 N/A THR 242.A OG1 GLU 275.A O no hydrogen 2.413 N/A THR 244.A OG1 ASP 232.A OD2 no hydrogen 3.143 N/A THR 244.A OG1 THR 244.A O no hydrogen 2.685 N/A GLY 249.A N ASP 235.A OD1 no hydrogen 2.997 N/A THR 251.A N GLU 254.A OE1 no hydrogen 2.854 N/A THR 251.A OG1 GLU 254.A OE1 no hydrogen 3.231 N/A GLU 254.A N THR 251.A OG1 no hydrogen 2.976 N/A GLY 255.A N THR 251.A O no hydrogen 3.092 N/A TYR 257.A N ARG 253.A O no hydrogen 2.818 N/A ILE 258.A N GLU 254.A O no hydrogen 3.019 N/A THR 259.A N GLY 255.A O no hydrogen 3.377 N/A THR 259.A OG1 GLY 255.A O no hydrogen 3.067 N/A THR 259.A OG1 LEU 256.A O no hydrogen 2.904 N/A GLU 260.A N LEU 256.A O no hydrogen 2.821 N/A GLU 261.A N TYR 257.A O no hydrogen 3.281 N/A ILE 262.A N ILE 258.A O no hydrogen 3.330 N/A TYR 263.A N THR 259.A O no hydrogen 3.293 N/A LYS 264.A N GLU 260.A O no hydrogen 3.069 N/A THR 265.A N GLU 261.A O no hydrogen 3.378 N/A THR 265.A OG1 ILE 262.A O no hydrogen 2.502 N/A LEU 267.A N THR 265.A OG1 no hydrogen 3.196 N/A SER 269.A N ILE 225.A O no hydrogen 2.789 N/A SER 269.A OG LEU 267.A O no hydrogen 3.205 N/A LEU 271.A N SER 92.A O no hydrogen 2.885 N/A ASP 272.A N LEU 227.A O no hydrogen 3.035 N/A ILE 273.A N VAL 94.A O no hydrogen 2.996 N/A MET 274.A N PHE 229.A O no hydrogen 2.805 N/A GLU 275.A N GLY 97.A O no hydrogen 2.878 N/A ASN 277.A N ALA 241.A O no hydrogen 2.993 N/A ASN 277.A ND2 ARG 19.A O no hydrogen 3.510 N/A ASN 277.A ND2 GLY 20.A O no hydrogen 3.402 N/A SER 279.A N ASN 277.A OD1 no hydrogen 2.991 N/A SER 279.A OG GLY 20.A O no hydrogen 2.638 N/A SER 279.A OG ASN 277.A OD1 no hydrogen 3.032 N/A LEU 280.A N ASN 277.A O no hydrogen 3.095 N/A LYS 282.A NZ PRO 240.A O no hydrogen 3.098 N/A THR 283.A OG1 GLU 286.A OE2 no hydrogen 2.697 N/A GLU 286.A N THR 283.A O no hydrogen 2.919 N/A THR 288.A N PRO 284.A O no hydrogen 3.296 N/A THR 288.A OG1 PRO 284.A O no hydrogen 2.380 N/A ARG 289.A N GLU 285.A O no hydrogen 2.765 N/A THR 290.A N GLU 286.A O no hydrogen 2.991 N/A THR 290.A OG1 GLU 286.A O no hydrogen 2.402 N/A VAL 291.A N VAL 287.A O no hydrogen 2.856 N/A ASN 292.A N THR 288.A O no hydrogen 3.099 N/A THR 293.A N ARG 289.A O no hydrogen 3.046 N/A THR 293.A OG1 PHE 238.A O no hydrogen 3.180 N/A THR 293.A OG1 ARG 289.A O no hydrogen 2.937 N/A ALA 294.A N THR 290.A O no hydrogen 2.964 N/A VAL 295.A N VAL 291.A O no hydrogen 3.092 N/A ALA 296.A N ASN 292.A O no hydrogen 2.902 N/A ILE 297.A N THR 293.A O no hydrogen 3.089 N/A THR 298.A N ALA 294.A O no hydrogen 3.212 N/A THR 298.A OG1 ALA 294.A O no hydrogen 3.063 N/A LEU 299.A N VAL 295.A O no hydrogen 2.896 N/A ALA 300.A N ALA 296.A O no hydrogen 3.196 N/A CYS 301.A N ILE 297.A O no hydrogen 3.248 N/A CYS 301.A N THR 298.A O no hydrogen 2.961 N/A CYS 301.A SG ILE 297.A O no hydrogen 3.496 N/A PHE 302.A N LEU 299.A O no hydrogen 3.152 N/A LEU 304.A N LEU 299.A O no hydrogen 2.996 N/A ALA 305.A N GLY 303.A O no hydrogen 2.839 N/A ALA 305.A N ASN 309.A OD1 no hydrogen 3.000 N/A ARG 306.A NE GLU 260.A OE2 no hydrogen 2.874 N/A ARG 306.A NH2 GLU 260.A OE1 no hydrogen 3.266 N/A GLY 308.A N ALA 305.A O no hydrogen 3.403 N/A ASN 309.A ND2 GLY 303.A O no hydrogen 2.867 N/A LYS 311.A N TYR 315.A OH no hydrogen 2.987 N/A LYS 311.A NZ GLU 42.A OE2 no hydrogen 3.302 N/A ILE 313.A N LYS 311.A O no hydrogen 2.757 N/A