Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ha8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 PRO 89.A O no hydrogen 2.815 N/A ARG 2.A NH2 PRO 89.A O no hydrogen 3.517 N/A TYR 6.A N VAL 17.A O no hydrogen 2.895 N/A TYR 6.A OH TYR 21.A O no hydrogen 2.772 N/A GLN 8.A N TRP 15.A O no hydrogen 2.957 N/A LEU 10.A N THR 13.A O no hydrogen 2.870 N/A ASN 11.A ND2 ASN 11.A O no hydrogen 3.265 N/A THR 13.A OG1 ASN 11.A O no hydrogen 3.193 N/A TRP 15.A N GLN 8.A O no hydrogen 2.706 N/A GLU 16.A N TYR 100.A OH no hydrogen 3.030 N/A VAL 17.A N TYR 6.A O no hydrogen 3.222 N/A GLU 19.A N THR 4.A O no hydrogen 2.885 N/A ARG 20.A NE ASP 40.A OD1 no hydrogen 2.819 N/A ARG 20.A NH2 ASP 40.A OD1 no hydrogen 3.190 N/A ARG 20.A NH2 ASP 40.A OD2 no hydrogen 2.842 N/A TYR 21.A N PRO 18.A O no hydrogen 3.081 N/A TYR 21.A OH ASP 85.A OD1 no hydrogen 2.702 N/A GLN 22.A N PHE 39.A O no hydrogen 2.843 N/A GLN 22.A NE2 GLU 19.A O no hydrogen 2.932 N/A SER 25.A N ALA 37.A O no hydrogen 2.846 N/A VAL 27.A N VAL 35.A O no hydrogen 2.863 N/A GLY 30.A N GLY 28.A O no hydrogen 2.966 N/A SER 34.A N LYS 51.A O no hydrogen 3.406 N/A CYS 36.A N VAL 49.A O no hydrogen 2.813 N/A ALA 37.A N SER 25.A O no hydrogen 2.816 N/A ALA 38.A N VAL 47.A O no hydrogen 2.731 N/A PHE 39.A N GLN 22.A O no hydrogen 2.802 N/A ASP 40.A N LEU 45.A O no hydrogen 2.974 N/A THR 41.A N ARG 20.A O no hydrogen 2.880 N/A THR 41.A OG1 ARG 20.A O no hydrogen 2.695 N/A LYS 42.A N ASP 40.A OD1 no hydrogen 3.179 N/A THR 43.A OG1 ASP 40.A OD2 no hydrogen 2.519 N/A GLY 44.A N ASP 40.A O no hydrogen 2.894 N/A LEU 45.A N THR 43.A OG1 no hydrogen 3.228 N/A VAL 47.A N ALA 38.A O no hydrogen 2.864 N/A ALA 48.A N THR 103.A O no hydrogen 2.775 N/A VAL 49.A N CYS 36.A O no hydrogen 2.787 N/A LYS 50.A N LEU 101.A O no hydrogen 2.755 N/A LYS 51.A N SER 34.A O no hydrogen 2.991 N/A LYS 51.A NZ ILE 14.A O no hydrogen 3.389 N/A LYS 51.A NZ ASP 98.A OD2 no hydrogen 3.167 N/A LYS 51.A NZ TYR 100.A OH no hydrogen 3.072 N/A LEU 52.A N VAL 99.A O no hydrogen 3.061 N/A SER 58.A OG HIS 61.A ND1 no hydrogen 3.148 N/A HIS 61.A N SER 58.A OG no hydrogen 3.429 N/A HIS 61.A ND1 SER 58.A OG no hydrogen 3.148 N/A ALA 62.A N SER 58.A O no hydrogen 2.865 N/A LYS 63.A N ILE 59.A O no hydrogen 2.953 N/A LYS 63.A NZ GLU 318.A O no hydrogen 2.645 N/A ARG 64.A N ILE 60.A O no hydrogen 2.973 N/A THR 65.A N HIS 61.A O no hydrogen 2.869 N/A THR 65.A OG1 PRO 55.A O no hydrogen 2.780 N/A THR 65.A OG1 HIS 61.A O no hydrogen 2.867 N/A TYR 66.A N ALA 62.A O no hydrogen 3.097 N/A ARG 67.A N LYS 63.A O no hydrogen 2.790 N/A ARG 67.A NE GLU 318.A OE2 no hydrogen 2.781 N/A ARG 67.A NH1 GLU 318.A OE1 no hydrogen 2.532 N/A ARG 67.A NH1 GLU 318.A OE2 no hydrogen 3.430 N/A GLU 68.A N ARG 64.A O no hydrogen 2.805 N/A LEU 69.A N THR 65.A O no hydrogen 2.993 N/A ARG 70.A N TYR 66.A O no hydrogen 2.850 N/A ARG 70.A NH1 TYR 66.A OH no hydrogen 2.986 N/A ARG 70.A NH2 ASP 314.A O no hydrogen 3.016 N/A LEU 71.A N ARG 67.A O no hydrogen 2.873 N/A LEU 72.A N GLU 68.A O no hydrogen 3.045 N/A LYS 73.A N LEU 69.A O no hydrogen 2.835 N/A LYS 73.A NZ GLU 334.A O no hydrogen 3.063 N/A LYS 73.A NZ GLU 334.A OE1 no hydrogen 2.735 N/A LYS 73.A NZ SER 337.A OG no hydrogen 2.784 N/A HIS 74.A N ARG 70.A O no hydrogen 3.026 N/A HIS 74.A N LEU 71.A O no hydrogen 3.126 N/A HIS 74.A NE2 ASP 311.A O no hydrogen 2.898 N/A MET 75.A N LEU 71.A O no hydrogen 2.865 N/A LYS 76.A N TYR 137.A OH no hydrogen 2.925 N/A ASN 79.A N HIS 77.A ND1 no hydrogen 3.012 N/A ASN 79.A ND2 LEU 161.A O no hydrogen 3.139 N/A VAL 80.A N HIS 77.A O no hydrogen 3.462 N/A ILE 81.A N ILE 163.A O no hydrogen 2.867 N/A LEU 84.A N VAL 102.A O no hydrogen 2.924 N/A ASP 85.A N VAL 102.A O no hydrogen 3.378 N/A PHE 87.A N TYR 100.A O no hydrogen 3.149 N/A THR 88.A OG1 ASP 98.A O no hydrogen 2.829 N/A ALA 90.A N THR 88.A OG1 no hydrogen 3.349 N/A ARG 91.A N GLU 95.A OE2 no hydrogen 3.109 N/A SER 92.A OG GLU 94.A OE1 no hydrogen 3.030 N/A SER 92.A OG GLU 94.A OE2 no hydrogen 2.723 N/A PHE 96.A N LEU 93.A O no hydrogen 3.271 N/A TYR 100.A N PHE 87.A O no hydrogen 3.057 N/A LEU 101.A N LYS 50.A O no hydrogen 2.783 N/A VAL 102.A N ASP 85.A O no hydrogen 2.888 N/A THR 103.A N ALA 48.A O no hydrogen 2.923 N/A THR 103.A OG1 GLY 82.A O no hydrogen 2.572 N/A LEU 105.A N ARG 46.A O no hydrogen 2.992 N/A ALA 108.A N VAL 155.A O no hydrogen 2.992 N/A LEU 110.A N PRO 150.A O no hydrogen 3.127 N/A ASN 112.A N ASP 109.A OD1 no hydrogen 2.747 N/A ILE 113.A N LEU 110.A O no hydrogen 3.014 N/A VAL 114.A N LEU 110.A O no hydrogen 2.913 N/A LYS 115.A N ASN 111.A O no hydrogen 3.051 N/A CYS 116.A SG ASN 112.A O no hydrogen 3.736 N/A GLN 117.A N ILE 113.A O no hydrogen 2.709 N/A THR 120.A OG1 HIS 123.A ND1 no hydrogen 2.777 N/A HIS 123.A N THR 120.A OG1 no hydrogen 3.312 N/A VAL 124.A N THR 120.A O no hydrogen 3.166 N/A GLN 125.A N ASP 121.A O no hydrogen 3.017 N/A GLN 125.A NE2 ASP 121.A O no hydrogen 3.695 N/A GLN 125.A NE2 ASP 121.A OD2 no hydrogen 2.932 N/A PHE 126.A N ASP 122.A O no hydrogen 3.205 N/A LEU 127.A N HIS 123.A O no hydrogen 2.939 N/A ILE 128.A N VAL 124.A O no hydrogen 2.929 N/A TYR 129.A N GLN 125.A O no hydrogen 2.850 N/A TYR 129.A OH GLU 307.A OE2 no hydrogen 2.833 N/A GLN 130.A N PHE 126.A O no hydrogen 3.058 N/A GLN 130.A NE2 PHE 126.A O no hydrogen 3.267 N/A GLN 130.A NE2 CYS 159.A O no hydrogen 2.712 N/A ILE 131.A N LEU 127.A O no hydrogen 2.999 N/A LEU 132.A N ILE 128.A O no hydrogen 2.863 N/A ARG 133.A N TYR 129.A O no hydrogen 2.881 N/A ARG 133.A NE ASP 306.A O no hydrogen 2.862 N/A ARG 133.A NH1 GLU 78.A OE2 no hydrogen 2.800 N/A ARG 133.A NH1 ASP 306.A O no hydrogen 2.882 N/A ARG 133.A NH1 ASP 306.A OD1 no hydrogen 3.171 N/A ARG 133.A NH2 GLU 78.A OE2 no hydrogen 3.314 N/A ARG 133.A NH2 ASN 79.A OD1 no hydrogen 2.887 N/A GLY 134.A N GLN 130.A O no hydrogen 3.029 N/A LEU 135.A N ILE 131.A O no hydrogen 2.924 N/A LYS 136.A N LEU 132.A O no hydrogen 2.944 N/A LYS 136.A NZ GLU 307.A O no hydrogen 2.772 N/A TYR 137.A OH HIS 74.A O no hydrogen 3.279 N/A ILE 138.A N GLY 134.A O no hydrogen 2.952 N/A HIS 139.A N LEU 135.A O no hydrogen 2.696 N/A HIS 139.A NE2 ASP 195.A OD2 no hydrogen 2.786 N/A SER 140.A N LYS 136.A O no hydrogen 3.064 N/A SER 140.A OG LYS 136.A O no hydrogen 3.373 N/A SER 140.A OG TYR 137.A O no hydrogen 2.698 N/A ALA 141.A N ILE 138.A O no hydrogen 3.150 N/A ASP 142.A N HIS 139.A O no hydrogen 2.943 N/A ILE 143.A N ILE 138.A O no hydrogen 3.302 N/A HIS 145.A N ASP 195.A OD2 no hydrogen 2.985 N/A HIS 145.A NE2 LEU 164.A O no hydrogen 2.614 N/A ARG 146.A N ASP 195.A OD1 no hydrogen 2.930 N/A ARG 146.A NE TYR 190.A OH no hydrogen 2.875 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 3.144 N/A ASN 152.A N LYS 149.A O no hydrogen 2.852 N/A ASN 152.A ND2 ASP 147.A O no hydrogen 2.303 N/A LEU 153.A N PRO 150.A O no hydrogen 3.219 N/A ALA 154.A N LYS 162.A O no hydrogen 2.942 N/A VAL 155.A N ALA 108.A O no hydrogen 2.720 N/A ASN 156.A N GLU 160.A O no hydrogen 3.112 N/A CYS 159.A N ASN 156.A O no hydrogen 2.721 N/A LEU 161.A N GLN 130.A OE1 no hydrogen 2.838 N/A LYS 162.A N ALA 154.A O no hydrogen 2.802 N/A LYS 162.A NZ GLU 78.A O no hydrogen 2.902 N/A ILE 163.A N ASN 79.A O no hydrogen 2.774 N/A THR 170.A N ASP 167.A O no hydrogen 3.115 N/A THR 170.A OG1 ASP 167.A O no hydrogen 3.202 N/A THR 175.A OG1 GLU 168.A O no hydrogen 2.663 N/A ARG 176.A N VAL 173.A O no hydrogen 3.400 N/A ARG 176.A NE GLN 221.A OE1 no hydrogen 3.360 N/A ARG 176.A NH1 MET 169.A O no hydrogen 3.073 N/A ARG 176.A NH1 GLY 171.A O no hydrogen 2.744 N/A ARG 176.A NH2 GLY 171.A O no hydrogen 3.107 N/A ARG 176.A NH2 GLN 221.A OE1 no hydrogen 3.372 N/A TRP 177.A N ALA 174.A O no hydrogen 3.331 N/A TRP 177.A NE1 GLY 215.A O no hydrogen 2.901 N/A TYR 178.A OH GLU 205.A OE2 no hydrogen 2.585 N/A ARG 179.A N ARG 176.A O no hydrogen 3.330 N/A GLU 182.A N GLU 182.A OE2 no hydrogen 2.704 N/A ILE 183.A N ALA 180.A O no hydrogen 3.036 N/A MET 184.A N ALA 180.A O no hydrogen 2.874 N/A LEU 185.A N PRO 181.A O no hydrogen 2.872 N/A TRP 187.A N GLU 182.A O no hydrogen 3.001 N/A THR 193.A N ASN 191.A OD1 no hydrogen 2.850 N/A THR 193.A OG1 ASN 191.A OD1 no hydrogen 2.389 N/A THR 193.A OG1 SER 283.A O no hydrogen 3.042 N/A VAL 194.A N ASN 191.A O no hydrogen 3.360 N/A ASP 195.A N GLN 192.A O no hydrogen 3.220 N/A SER 198.A N VAL 194.A O no hydrogen 3.328 N/A SER 198.A OG TYR 178.A O no hydrogen 2.795 N/A SER 198.A OG VAL 194.A O no hydrogen 3.311 N/A VAL 199.A N ASP 195.A O no hydrogen 3.006 N/A GLY 200.A N ILE 196.A O no hydrogen 2.977 N/A CYS 201.A N TRP 197.A O no hydrogen 3.085 N/A CYS 201.A SG TRP 177.A O no hydrogen 3.869 N/A CYS 201.A SG TRP 197.A O no hydrogen 3.468 N/A ILE 202.A N SER 198.A O no hydrogen 3.009 N/A MET 203.A N VAL 199.A O no hydrogen 2.763 N/A ALA 204.A N GLY 200.A O no hydrogen 3.095 N/A GLU 205.A N CYS 201.A O no hydrogen 3.082 N/A LEU 206.A N ILE 202.A O no hydrogen 2.933 N/A LEU 207.A N MET 203.A O no hydrogen 3.084 N/A THR 208.A N.A ALA 204.A O no hydrogen 2.869 N/A THR 208.A N.B ALA 204.A O no hydrogen 2.877 N/A THR 208.A OG1.A ALA 204.A O no hydrogen 3.300 N/A THR 208.A OG1.B ALA 204.A O no hydrogen 3.046 N/A GLY 209.A N GLU 205.A O no hydrogen 2.714 N/A ARG 210.A N THR 208.A OG1.B no hydrogen 3.145 N/A GLY 215.A N PHE 213.A O no hydrogen 2.788 N/A THR 216.A N ASP 220.A OD2 no hydrogen 2.916 N/A THR 216.A OG1 ASP 220.A OD2 no hydrogen 3.253 N/A ASP 220.A N ASP 217.A OD1 no hydrogen 2.795 N/A GLN 221.A N ASP 217.A O no hydrogen 2.903 N/A GLN 221.A NE2 ARG 176.A O no hydrogen 2.733 N/A LEU 222.A N HIS 218.A O no hydrogen 3.076 N/A LYS 223.A N ILE 219.A O no hydrogen 2.993 N/A LEU 224.A N ASP 220.A O no hydrogen 3.087 N/A ILE 225.A N GLN 221.A O no hydrogen 2.979 N/A LEU 226.A N LEU 222.A O no hydrogen 2.895 N/A ARG 227.A N LYS 223.A O no hydrogen 3.014 N/A LEU 228.A N ILE 225.A O no hydrogen 3.108 N/A VAL 229.A N ILE 225.A O no hydrogen 2.892 N/A GLY 230.A N LEU 226.A O no hydrogen 2.771 N/A THR 231.A N MET 255.A O no hydrogen 3.178 N/A THR 231.A OG1 MET 255.A O no hydrogen 3.240 N/A LEU 237.A N GLY 233.A O no hydrogen 3.148 N/A LYS 238.A N ALA 234.A O no hydrogen 3.244 N/A LYS 239.A N LEU 236.A O no hydrogen 3.117 N/A LYS 239.A NZ ASP 282.A OD1 no hydrogen 2.624 N/A LYS 239.A NZ ASP 282.A OD2 no hydrogen 3.238 N/A LYS 239.A NZ ASP 284.A OD1 no hydrogen 2.891 N/A ILE 240.A N LEU 236.A O no hydrogen 3.290 N/A ILE 240.A N LEU 237.A O no hydrogen 3.240 N/A SER 241.A OG TRP 187.A O no hydrogen 3.487 N/A SER 242.A N TRP 187.A O no hydrogen 3.227 N/A ALA 245.A N SER 242.A OG no hydrogen 3.280 N/A ARG 246.A N SER 242.A O no hydrogen 2.961 N/A ARG 246.A NH1 ILE 240.A O no hydrogen 2.673 N/A ASN 247.A N GLU 243.A O no hydrogen 3.113 N/A TYR 248.A N SER 244.A O no hydrogen 3.245 N/A ILE 249.A N ALA 245.A O no hydrogen 3.016 N/A GLN 250.A N ARG 246.A O no hydrogen 3.217 N/A SER 251.A N TYR 248.A O no hydrogen 2.975 N/A SER 251.A OG TYR 248.A O no hydrogen 2.622 N/A LEU 252.A N ILE 249.A O no hydrogen 3.039 N/A MET 255.A N THR 231.A OG1 no hydrogen 2.820 N/A LYS 257.A NZ MET 258.A O no hydrogen 3.065 N/A LYS 257.A NZ GLU 276.A OE2 no hydrogen 2.865 N/A MET 258.A N LEU 228.A O no hydrogen 2.828 N/A ALA 261.A N ASN 259.A OD1 no hydrogen 3.193 N/A ASN 262.A N ASN 259.A O no hydrogen 2.996 N/A VAL 263.A N PHE 260.A O no hydrogen 3.083 N/A PHE 264.A N PHE 260.A O no hydrogen 2.993 N/A ALA 267.A N PHE 264.A O no hydrogen 3.384 N/A ASN 268.A ND2 ASP 121.A OD2 no hydrogen 3.004 N/A LEU 270.A N ASN 268.A OD1 no hydrogen 2.886 N/A VAL 272.A N ASN 268.A O no hydrogen 2.962 N/A ASP 273.A N PRO 269.A O no hydrogen 2.927 N/A LEU 274.A N LEU 270.A O no hydrogen 3.083 N/A LEU 275.A N ALA 271.A O no hydrogen 2.997 N/A GLU 276.A N VAL 272.A O no hydrogen 3.103 N/A LYS 277.A N ASP 273.A O no hydrogen 3.195 N/A LYS 277.A N LEU 274.A O no hydrogen 3.106 N/A LYS 277.A NZ HIS 295.A NE2 no hydrogen 3.428 N/A MET 278.A N LEU 275.A O no hydrogen 3.187 N/A LEU 279.A N LEU 275.A O no hydrogen 2.850 N/A ASP 284.A N ASP 282.A OD2 no hydrogen 3.051 N/A LYS 285.A N ASP 282.A O no hydrogen 2.975 N/A ARG 286.A NE VAL 280.A O no hydrogen 2.840 N/A ARG 286.A NH1 GLU 182.A OE1 no hydrogen 2.928 N/A ARG 286.A NH1 GLU 182.A OE2 no hydrogen 2.750 N/A ARG 286.A NH1 LEU 281.A O no hydrogen 3.067 N/A ARG 286.A NH2 GLU 182.A OE1 no hydrogen 2.695 N/A ARG 286.A NH2 THR 193.A O no hydrogen 2.787 N/A ILE 287.A N LYS 277.A O no hydrogen 2.984 N/A THR 288.A N GLN 291.A OE1 no hydrogen 3.175 N/A GLN 291.A N THR 288.A OG1 no hydrogen 3.197 N/A ALA 292.A N THR 288.A O no hydrogen 2.828 N/A LEU 293.A N ALA 289.A O no hydrogen 2.968 N/A ALA 294.A N GLN 291.A O no hydrogen 3.180 N/A HIS 295.A N ALA 292.A O no hydrogen 3.198 N/A HIS 295.A NE2 ASP 273.A OD1 no hydrogen 2.906 N/A TYR 297.A N HIS 295.A ND1 no hydrogen 3.185 N/A TYR 297.A OH ASP 121.A OD1 no hydrogen 3.123 N/A PHE 298.A N HIS 295.A O no hydrogen 3.010 N/A ALA 299.A N ALA 296.A O no hydrogen 3.323 N/A TYR 301.A N PHE 298.A O no hydrogen 2.716 N/A HIS 302.A N PHE 298.A O no hydrogen 2.711 N/A HIS 302.A ND1 GLU 307.A OE2 no hydrogen 2.800 N/A ASP 303.A N GLU 307.A OE2 no hydrogen 3.273 N/A ASP 306.A N ASP 303.A O no hydrogen 2.785 N/A ALA 310.A N SER 140.A OG no hydrogen 2.918 N/A SER 316.A N ASP 314.A OD1 no hydrogen 3.358 N/A SER 316.A OG ASP 314.A OD1 no hydrogen 2.688 N/A GLU 318.A N GLN 315.A O no hydrogen 3.149 N/A ARG 320.A N PHE 317.A O no hydrogen 3.056 N/A LEU 323.A N GLU 326.A OE1 no hydrogen 3.362 N/A GLU 326.A N LEU 323.A O no hydrogen 3.053 N/A TRP 327.A N LEU 323.A O no hydrogen 3.148 N/A LYS 328.A N ILE 324.A O no hydrogen 3.010 N/A LYS 328.A NZ PHE 96.A O no hydrogen 2.962 N/A SER 329.A N ASP 325.A O no hydrogen 2.902 N/A LEU 330.A N GLU 326.A O no hydrogen 3.066 N/A THR 331.A N TRP 327.A O no hydrogen 2.753 N/A THR 331.A OG1 TRP 327.A O no hydrogen 2.955 N/A TYR 332.A N LYS 328.A O no hydrogen 2.906 N/A ASP 333.A N SER 329.A O no hydrogen 2.970 N/A GLU 334.A N LEU 330.A O no hydrogen 3.203 N/A VAL 335.A N THR 331.A O no hydrogen 2.908 N/A ILE 336.A N TYR 332.A O no hydrogen 2.994 N/A SER 337.A N ASP 333.A O no hydrogen 2.927 N/A SER 337.A OG ASP 333.A O no hydrogen 2.997 N/A SER 337.A OG GLU 334.A O no hydrogen 3.294 N/A PHE 338.A N VAL 335.A O no hydrogen 3.303 N/A