Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2h4q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N ASP 2.A OD1 no hydrogen 2.993 N/A SER 6.A N ASP 2.A O no hydrogen 2.952 N/A SER 6.A OG ASP 2.A O no hydrogen 3.163 N/A GLU 7.A N ARG 3.A O no hydrogen 2.832 N/A LEU 8.A N TRP 4.A O no hydrogen 3.036 N/A GLU 9.A N GLY 5.A O no hydrogen 2.943 N/A ILE 10.A N SER 6.A O no hydrogen 3.043 N/A SER 11.A N GLU 7.A O no hydrogen 2.862 N/A SER 11.A OG GLU 7.A O no hydrogen 3.485 N/A MET 12.A N LEU 8.A O no hydrogen 3.013 N/A GLU 13.A N GLU 9.A O no hydrogen 2.863 N/A GLN 14.A N ILE 10.A O no hydrogen 2.883 N/A VAL 15.A N SER 11.A O no hydrogen 3.212 N/A SER 16.A N MET 12.A O no hydrogen 2.918 N/A SER 16.A OG MET 12.A O no hydrogen 3.096 N/A ALA 17.A N GLU 13.A O no hydrogen 2.927 N/A SER 18.A N GLN 14.A O no hydrogen 2.900 N/A SER 18.A OG VAL 15.A O no hydrogen 2.704 N/A ILE 19.A N VAL 15.A O no hydrogen 2.876 N/A GLY 20.A N SER 16.A O no hydrogen 2.982 N/A ASN 21.A N ALA 17.A O no hydrogen 2.955 N/A PHE 22.A N SER 18.A O no hydrogen 2.803 N/A THR 23.A N ILE 19.A O no hydrogen 2.776 N/A THR 23.A OG1 ILE 19.A O no hydrogen 2.625 N/A VAL 24.A N GLY 20.A O no hydrogen 3.243 N/A ASP 25.A N ASN 21.A O no hydrogen 3.095 N/A LEU 26.A N PHE 22.A O no hydrogen 2.830 N/A PHE 27.A N THR 23.A O no hydrogen 2.912 N/A ASN 28.A N VAL 24.A O no hydrogen 2.900 N/A LYS 29.A N ASP 25.A O no hydrogen 3.056 N/A LYS 29.A NZ GLU 32.A OE2 no hydrogen 3.500 N/A LEU 30.A N LEU 26.A O no hydrogen 2.857 N/A ASN 31.A N PHE 27.A O no hydrogen 2.756 N/A ASN 31.A ND2 GLU 258.A OE1 no hydrogen 3.117 N/A GLU 32.A N LYS 29.A O no hydrogen 3.223 N/A ASN 34.A N LEU 30.A O no hydrogen 3.107 N/A LYS 37.A N ASN 34.A O no hydrogen 3.501 N/A PHE 40.A N ASP 291.A OD2 no hydrogen 3.291 N/A TRP 44.A NE1 SER 99.A OG no hydrogen 3.069 N/A SER 45.A N SER 42.A OG no hydrogen 3.141 N/A SER 45.A OG ASN 174.A OD1 no hydrogen 2.725 N/A SER 45.A OG THR 347.A OG1 no hydrogen 2.725 N/A ILE 46.A N SER 42.A O no hydrogen 3.109 N/A SER 47.A N PRO 43.A O no hydrogen 2.929 N/A SER 48.A N TRP 44.A O no hydrogen 2.931 N/A SER 48.A OG TRP 44.A O no hydrogen 2.863 N/A ALA 49.A N SER 45.A O no hydrogen 3.163 N/A LEU 50.A N ILE 46.A O no hydrogen 3.063 N/A ALA 51.A N SER 47.A O no hydrogen 2.698 N/A LEU 52.A N SER 48.A O no hydrogen 2.954 N/A THR 53.A N ALA 49.A O no hydrogen 3.127 N/A THR 53.A OG1 ALA 49.A O no hydrogen 2.921 N/A TYR 54.A N LEU 50.A O no hydrogen 2.752 N/A LEU 55.A N ALA 51.A O no hydrogen 2.892 N/A ALA 56.A N THR 53.A O no hydrogen 2.956 N/A ALA 57.A N TYR 54.A O no hydrogen 2.972 N/A LYS 58.A N ASP 313.A O no hydrogen 2.914 N/A ALA 62.A N LYS 58.A O no hydrogen 3.252 N/A ARG 63.A N GLY 59.A O no hydrogen 2.993 N/A GLU 64.A N SER 60.A O no hydrogen 3.024 N/A MET 65.A N THR 61.A O no hydrogen 3.381 N/A ALA 66.A N ALA 62.A O no hydrogen 2.846 N/A GLU 67.A N ARG 63.A O no hydrogen 3.124 N/A VAL 68.A N GLU 64.A O no hydrogen 3.015 N/A LEU 69.A N MET 65.A O no hydrogen 2.844 N/A HIS 70.A NE2 ASP 25.A OD2 no hydrogen 2.791 N/A PHE 71.A N ALA 66.A O no hydrogen 2.723 N/A ASN 76.A ND2 TYR 122.A OH no hydrogen 3.245 N/A HIS 78.A ND1 TYR 123.A OH no hydrogen 2.726 N/A SER 79.A N ASN 76.A O no hydrogen 2.956 N/A PHE 81.A N ILE 77.A O no hydrogen 3.219 N/A LYS 82.A N HIS 78.A O no hydrogen 3.021 N/A LYS 82.A NZ GLU 83.A OE2 no hydrogen 3.407 N/A GLU 83.A N SER 79.A O no hydrogen 2.921 N/A LEU 84.A N GLY 80.A O no hydrogen 2.913 N/A LEU 85.A N PHE 81.A O no hydrogen 2.868 N/A THR 86.A N LYS 82.A O no hydrogen 2.921 N/A THR 86.A OG1 LYS 82.A O no hydrogen 2.906 N/A ALA 87.A N GLU 83.A O no hydrogen 3.018 N/A PHE 88.A N LEU 84.A O no hydrogen 2.870 N/A ASN 89.A N LEU 85.A O no hydrogen 2.891 N/A ASN 89.A ND2 SER 99.A O no hydrogen 3.007 N/A LYS 90.A N ALA 87.A O no hydrogen 3.346 N/A ARG 92.A NH1 PHE 88.A O no hydrogen 2.953 N/A ARG 92.A NH1 LEU 97.A O no hydrogen 3.290 N/A ARG 92.A NH2 ALA 87.A O no hydrogen 3.179 N/A ARG 92.A NH2 PHE 88.A O no hydrogen 3.191 N/A ASN 94.A ND2 GLU 236.A OE2 no hydrogen 3.454 N/A TYR 95.A OH GLU 236.A OE1 no hydrogen 2.557 N/A SER 96.A N LYS 179.A O no hydrogen 2.826 N/A ARG 98.A N TYR 177.A O no hydrogen 2.963 N/A SER 99.A N ASN 89.A OD1 no hydrogen 2.875 N/A SER 99.A OG ALA 175.A O no hydrogen 2.817 N/A ALA 100.A N ALA 175.A O no hydrogen 2.918 N/A ASN 101.A ND2 TYR 123.A O no hydrogen 2.857 N/A ARG 102.A N VAL 173.A O no hydrogen 2.952 N/A ARG 102.A NE GLN 128.A OE1 no hydrogen 3.289 N/A ARG 102.A NH2 GLN 128.A OE1 no hydrogen 3.240 N/A ILE 103.A N GLU 126.A O no hydrogen 3.175 N/A TYR 104.A N ILE 171.A O no hydrogen 2.928 N/A VAL 105.A N GLN 128.A O no hydrogen 3.126 N/A GLU 106.A N ARG 169.A O no hydrogen 2.794 N/A LYS 107.A N VAL 130.A O no hydrogen 2.937 N/A THR 108.A N GLU 106.A OE2 no hydrogen 2.922 N/A THR 108.A OG1 GLU 106.A OE2 no hydrogen 3.046 N/A TYR 109.A N GLU 106.A O no hydrogen 2.766 N/A TYR 109.A OH THR 318.A OG1 no hydrogen 2.947 N/A TYR 109.A OH ASP 322.A OD1 no hydrogen 2.573 N/A LEU 112.A N MET 317.A O no hydrogen 2.835 N/A TYR 115.A OH LEU 52.A O no hydrogen 2.724 N/A LEU 116.A N LEU 112.A O no hydrogen 3.363 N/A GLN 117.A N PRO 113.A O no hydrogen 3.064 N/A LEU 118.A N THR 114.A O no hydrogen 3.084 N/A SER 119.A N TYR 115.A O no hydrogen 2.851 N/A SER 119.A OG TYR 115.A O no hydrogen 2.758 N/A LYS 120.A N LEU 116.A O no hydrogen 3.004 N/A LYS 121.A N GLN 117.A O no hydrogen 2.874 N/A LYS 121.A NZ TYR 122.A OH no hydrogen 2.825 N/A TYR 122.A N LEU 118.A O no hydrogen 2.847 N/A TYR 123.A N SER 119.A O no hydrogen 3.052 N/A TYR 123.A OH HIS 78.A ND1 no hydrogen 2.726 N/A LYS 124.A N LYS 120.A O no hydrogen 3.062 N/A ALA 125.A N SER 119.A O no hydrogen 3.185 N/A GLN 128.A N ILE 103.A O no hydrogen 2.772 N/A VAL 130.A N VAL 105.A O no hydrogen 2.859 N/A ASN 131.A ND2 THR 134.A OG1 no hydrogen 2.731 N/A PHE 132.A N GLU 106.A OE1 no hydrogen 2.868 N/A LYS 133.A N GLU 106.A OE1 no hydrogen 3.062 N/A THR 134.A N ASN 131.A OD1 no hydrogen 3.001 N/A SER 139.A N ALA 135.A O no hydrogen 3.127 N/A SER 139.A OG ASN 131.A O no hydrogen 3.020 N/A SER 139.A OG ALA 135.A O no hydrogen 2.848 N/A ARG 140.A N PRO 136.A O no hydrogen 2.708 N/A LYS 141.A N GLU 137.A O no hydrogen 2.994 N/A GLU 142.A N GLN 138.A O no hydrogen 3.246 N/A ILE 143.A N SER 139.A O no hydrogen 3.240 N/A ASN 144.A N ARG 140.A O no hydrogen 2.976 N/A ASN 144.A ND2 LEU 159.A O no hydrogen 2.866 N/A THR 145.A N LYS 141.A O no hydrogen 2.936 N/A THR 145.A OG1 LYS 141.A O no hydrogen 2.750 N/A TRP 146.A N GLU 142.A O no hydrogen 3.124 N/A VAL 147.A N ILE 143.A O no hydrogen 2.964 N/A GLU 148.A N ASN 144.A O no hydrogen 2.877 N/A LYS 149.A N THR 145.A O no hydrogen 3.040 N/A GLN 150.A N TRP 146.A O no hydrogen 2.913 N/A THR 151.A N VAL 147.A O no hydrogen 2.965 N/A THR 151.A OG1 VAL 147.A O no hydrogen 2.678 N/A THR 151.A OG1 GLU 148.A O no hydrogen 3.335 N/A THR 151.A OG1 ILE 155.A O no hydrogen 3.561 N/A SER 153.A N GLU 148.A O no hydrogen 2.718 N/A LYS 154.A N THR 151.A O no hydrogen 3.181 N/A ILE 155.A N THR 151.A OG1 no hydrogen 3.158 N/A LEU 159.A N ASN 144.A OD1 no hydrogen 2.815 N/A SER 160.A N ASP 163.A OD2 no hydrogen 2.665 N/A SER 160.A OG ASP 163.A OD2 no hydrogen 2.953 N/A ASP 163.A N SER 160.A O no hydrogen 3.106 N/A LYS 165.A N THR 168.A OG1 no hydrogen 2.944 N/A THR 168.A N LYS 165.A O no hydrogen 3.224 N/A THR 168.A OG1 LYS 165.A O no hydrogen 3.272 N/A ARG 169.A N ILE 351.A O no hydrogen 2.930 N/A ARG 169.A NH1 ALA 166.A O no hydrogen 3.232 N/A LEU 170.A N ILE 351.A O no hydrogen 2.915 N/A ILE 171.A N TYR 104.A O no hydrogen 2.768 N/A LEU 172.A N VAL 349.A O no hydrogen 2.970 N/A VAL 173.A N ARG 102.A O no hydrogen 2.965 N/A ASN 174.A N THR 347.A O no hydrogen 2.908 N/A ASN 174.A ND2 SER 99.A OG no hydrogen 3.303 N/A ASN 174.A ND2 ASN 101.A OD1 no hydrogen 2.668 N/A ALA 175.A N ALA 100.A O no hydrogen 2.881 N/A ILE 176.A N ALA 345.A O no hydrogen 2.967 N/A TYR 177.A N ARG 98.A O no hydrogen 2.812 N/A TYR 177.A OH GLU 342.A OE2 no hydrogen 2.610 N/A PHE 178.A N ALA 343.A O no hydrogen 2.715 N/A LYS 179.A N SER 96.A O no hydrogen 2.902 N/A ALA 180.A N THR 341.A O no hydrogen 3.120 N/A TRP 182.A N LYS 339.A O no hydrogen 2.861 N/A TRP 182.A NE1 ASP 337.A O no hydrogen 3.058 N/A GLU 183.A N PRO 231.A O no hydrogen 2.944 N/A LYS 185.A NZ GLU 181.A OE1 no hydrogen 2.921 N/A PHE 186.A N GLU 338.A O no hydrogen 2.911 N/A LYS 190.A N GLN 187.A O no hydrogen 2.915 N/A THR 191.A N ALA 188.A O no hydrogen 3.058 N/A THR 191.A OG1 ALA 188.A O no hydrogen 3.537 N/A THR 191.A OG1 GLU 338.A OE2 no hydrogen 2.611 N/A SER 192.A N MET 208.A O no hydrogen 3.082 N/A GLN 194.A N VAL 206.A O no hydrogen 2.968 N/A GLN 194.A NE2 SER 192.A OG no hydrogen 2.742 N/A PHE 196.A N LYS 204.A O no hydrogen 2.768 N/A LEU 198.A N LYS 202.A O no hydrogen 2.842 N/A SER 199.A N LYS 202.A O no hydrogen 3.163 N/A ASN 201.A N SER 199.A OG no hydrogen 3.219 N/A LYS 204.A N PHE 196.A O no hydrogen 2.960 N/A VAL 206.A N GLN 194.A O no hydrogen 2.943 N/A MET 208.A N SER 192.A O no hydrogen 2.747 N/A MET 209.A N LEU 284.A O no hydrogen 2.789 N/A TYR 210.A OH ASP 281.A OD1 no hydrogen 2.663 N/A MET 211.A N LEU 282.A O no hydrogen 3.134 N/A ARG 212.A NE ASP 281.A OD1 no hydrogen 2.826 N/A ARG 212.A NH2 ASP 281.A OD1 no hydrogen 3.294 N/A ASP 213.A N VAL 280.A O no hydrogen 3.127 N/A THR 214.A N ASP 213.A OD1 no hydrogen 2.813 N/A PHE 215.A N THR 278.A O no hydrogen 2.982 N/A VAL 217.A N THR 276.A O no hydrogen 2.926 N/A LEU 218.A N MET 227.A O no hydrogen 2.737 N/A MET 220.A N PHE 225.A O no hydrogen 2.886 N/A MET 223.A N MET 220.A O no hydrogen 3.105 N/A ASN 224.A N GLU 221.A O no hydrogen 2.930 N/A PHE 225.A N MET 220.A O no hydrogen 3.269 N/A LYS 226.A N LEU 243.A O no hydrogen 2.988 N/A MET 227.A N LEU 218.A O no hydrogen 2.844 N/A ILE 228.A N ILE 241.A O no hydrogen 3.025 N/A GLU 229.A N PRO 216.A O no hydrogen 2.997 N/A LEU 230.A N MET 239.A O no hydrogen 2.788 N/A TYR 232.A N LEU 237.A O no hydrogen 2.841 N/A TYR 232.A OH THR 341.A OG1 no hydrogen 2.690 N/A VAL 233.A N GLU 181.A O no hydrogen 3.003 N/A ARG 235.A N TYR 232.A O no hydrogen 2.857 N/A ARG 235.A NE GLU 229.A OE2 no hydrogen 3.122 N/A ARG 235.A NH2 GLU 229.A OE1 no hydrogen 3.067 N/A GLU 236.A N VAL 233.A O no hydrogen 3.527 N/A SER 238.A OG GLU 229.A OE2 no hydrogen 2.586 N/A MET 239.A N LEU 230.A O no hydrogen 2.884 N/A ILE 241.A N ILE 228.A O no hydrogen 3.015 N/A LEU 243.A N LYS 226.A O no hydrogen 2.931 N/A ASP 245.A N ASN 224.A O no hydrogen 3.035 N/A ILE 247.A N ASP 246.A OD1 no hydrogen 2.709 N/A THR 251.A N ASP 249.A OD1 no hydrogen 2.936 N/A THR 251.A OG1 ASP 249.A OD1 no hydrogen 3.509 N/A THR 251.A OG1 GLU 255.A OE2 no hydrogen 2.609 N/A GLY 253.A N ASP 249.A OD1 no hydrogen 2.823 N/A LEU 254.A N THR 252.A OG1 no hydrogen 3.124 N/A GLU 255.A N ASP 249.A OD2 no hydrogen 3.110 N/A GLU 258.A N LEU 254.A O no hydrogen 2.810 N/A ARG 259.A N GLU 255.A O no hydrogen 2.913 N/A GLU 260.A N GLN 256.A O no hydrogen 2.960 N/A ARG 265.A N THR 262.A OG1 no hydrogen 2.958 N/A ARG 265.A NH1 GLU 260.A O no hydrogen 2.952 N/A LEU 266.A N THR 262.A O no hydrogen 2.797 N/A SER 267.A N TYR 263.A O no hydrogen 2.704 N/A GLU 268.A N GLU 264.A O no hydrogen 3.121 N/A TRP 269.A N ARG 265.A O no hydrogen 2.984 N/A ALA 270.A N LEU 266.A O no hydrogen 3.043 N/A ASP 271.A N SER 267.A O no hydrogen 3.298 N/A SER 272.A N TRP 269.A O no hydrogen 3.137 N/A MET 274.A N SER 272.A OG no hydrogen 3.160 N/A MET 275.A N SER 272.A O no hydrogen 3.077 N/A THR 276.A N VAL 217.A O no hydrogen 3.210 N/A THR 278.A N PHE 215.A O no hydrogen 2.755 N/A THR 278.A OG1 THR 276.A O no hydrogen 2.868 N/A VAL 280.A N ASP 213.A O no hydrogen 2.788 N/A LEU 282.A N MET 211.A O no hydrogen 2.896 N/A LEU 284.A N MET 209.A O no hydrogen 2.995 N/A LYS 286.A N LYS 207.A O no hydrogen 2.792 N/A LYS 286.A NZ GLU 338.A OE1 no hydrogen 3.475 N/A PHE 287.A N VAL 336.A O no hydrogen 3.108 N/A SER 288.A OG VAL 334.A O no hydrogen 2.807 N/A LEU 289.A N VAL 334.A O no hydrogen 2.995 N/A ASP 291.A N SER 332.A O no hydrogen 3.190 N/A ARG 292.A NE LEU 158.A O no hydrogen 3.226 N/A ARG 292.A NH2 LEU 158.A O no hydrogen 3.163 N/A ILE 293.A N HIS 330.A O no hydrogen 2.952 N/A LEU 295.A N VAL 328.A O no hydrogen 2.745 N/A ARG 296.A N ASP 294.A OD1 no hydrogen 3.227 N/A ARG 296.A NH1 SER 326.A O no hydrogen 3.315 N/A LEU 299.A N LEU 295.A O no hydrogen 2.727 N/A ARG 300.A N ARG 296.A O no hydrogen 2.918 N/A ARG 300.A NH1 ASP 297.A OD1 no hydrogen 3.138 N/A ASN 301.A N ASP 297.A O no hydrogen 2.989 N/A MET 302.A N THR 298.A O no hydrogen 3.104 N/A MET 302.A N LEU 299.A O no hydrogen 3.220 N/A GLY 303.A N LEU 299.A O no hydrogen 3.200 N/A GLY 303.A N ARG 300.A O no hydrogen 3.145 N/A MET 304.A N LEU 299.A O no hydrogen 2.936 N/A THR 305.A N GLU 64.A OE1 no hydrogen 3.155 N/A THR 305.A OG1 GLU 64.A OE1 no hydrogen 3.324 N/A THR 306.A N GLU 64.A OE1 no hydrogen 2.912 N/A THR 306.A OG1 GLU 64.A OE1 no hydrogen 3.102 N/A THR 306.A OG1 GLU 64.A OE2 no hydrogen 2.675 N/A PHE 308.A N THR 305.A O no hydrogen 2.949 N/A THR 309.A N THR 306.A O no hydrogen 2.911 N/A THR 309.A OG1 THR 306.A O no hydrogen 2.798 N/A ASN 311.A N THR 309.A OG1 no hydrogen 3.202 N/A ALA 312.A N THR 309.A O no hydrogen 3.198 N/A ASP 313.A N THR 61.A OG1 no hydrogen 2.946 N/A ARG 315.A N ASP 313.A OD1 no hydrogen 3.230 N/A GLY 316.A N ALA 56.A O no hydrogen 2.800 N/A MET 317.A N PHE 314.A O no hydrogen 3.181 N/A THR 318.A OG1 TYR 109.A OH no hydrogen 2.947 N/A THR 318.A OG1 LYS 320.A O no hydrogen 3.560 N/A LYS 320.A N THR 318.A OG1 no hydrogen 3.177 N/A ALA 324.A N SER 352.A O no hydrogen 3.373 N/A ILE 325.A N ALA 307.A O no hydrogen 2.918 N/A SER 326.A N ILE 350.A O no hydrogen 2.791 N/A SER 326.A OG ILE 350.A O no hydrogen 2.948 N/A LYS 327.A N ILE 350.A O no hydrogen 3.346 N/A LYS 327.A NZ ASP 162.A O no hydrogen 3.094 N/A LYS 327.A NZ ASP 163.A OD1 no hydrogen 2.766 N/A VAL 328.A N ASP 294.A OD1 no hydrogen 3.064 N/A ILE 329.A N ALA 348.A O no hydrogen 2.889 N/A HIS 330.A N ILE 293.A O no hydrogen 2.869 N/A GLN 331.A N ALA 346.A O no hydrogen 3.019 N/A SER 332.A N ASP 291.A O no hydrogen 2.853 N/A SER 332.A OG PHE 40.A O no hydrogen 2.780 N/A PHE 333.A N VAL 344.A O no hydrogen 2.747 N/A VAL 334.A N LEU 289.A O no hydrogen 3.011 N/A ALA 335.A N GLU 342.A O no hydrogen 2.755 N/A VAL 336.A N PHE 287.A O no hydrogen 2.727 N/A ASP 337.A N GLY 340.A O no hydrogen 3.145 N/A GLU 338.A N GLU 338.A OE1 no hydrogen 2.789 N/A LYS 339.A N ASP 337.A OD1 no hydrogen 3.057 N/A GLY 340.A N ASP 337.A OD1 no hydrogen 3.074 N/A THR 341.A N ALA 180.A O no hydrogen 3.030 N/A THR 341.A OG1 TYR 232.A OH no hydrogen 2.690 N/A GLU 342.A N ALA 335.A O no hydrogen 2.945 N/A ALA 343.A N PHE 178.A O no hydrogen 2.743 N/A VAL 344.A N PHE 333.A O no hydrogen 2.835 N/A ALA 345.A N ILE 176.A O no hydrogen 3.083 N/A ALA 346.A N GLN 331.A O no hydrogen 2.921 N/A THR 347.A N ASN 174.A O no hydrogen 2.861 N/A THR 347.A OG1 SER 45.A OG no hydrogen 2.725 N/A ALA 348.A N ILE 329.A O no hydrogen 2.778 N/A VAL 349.A N LEU 172.A O no hydrogen 2.827 N/A ILE 350.A N LYS 327.A O no hydrogen 2.801 N/A ILE 351.A N LEU 170.A O no hydrogen 2.675 N/A SER 352.A N ALA 324.A O no hydrogen 3.003 N/A SER 352.A OG ALA 324.A O no hydrogen 3.474 N/A