Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n41_F.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N ASP 282.A OD1 no hydrogen 3.030 N/A GLY 1.A N ILE 283.A O no hydrogen 3.186 N/A TYR 2.A N ILE 283.A O no hydrogen 2.941 N/A HIS 4.A N ILE 281.A O no hydrogen 2.763 N/A HIS 4.A NE2 THR 18.A OG1 no hydrogen 2.748 N/A THR 6.A N ILE 279.A O no hydrogen 2.924 N/A ILE 8.A N MET 277.A O no hydrogen 3.138 N/A ASN 10.A N GLY 275.A O no hydrogen 2.941 N/A ASN 10.A ND2 VAL 274.A O no hydrogen 3.043 N/A THR 11.A N PRO 9.A O no hydrogen 2.810 N/A GLY 13.A N LEU 34.A O no hydrogen 3.121 N/A TYR 16.A N MET 32.A O no hydrogen 2.744 N/A LYS 17.A NZ GLU 31.A OE2 no hydrogen 3.151 N/A LYS 17.A NZ ILE 340.A O no hydrogen 2.655 N/A LYS 17.A NZ ARG 341.A O no hydrogen 3.010 N/A THR 18.A N LEU 30.A O no hydrogen 2.906 N/A THR 18.A OG1 HIS 4.A NE2 no hydrogen 2.748 N/A VAL 20.A N MET 28.A O no hydrogen 2.659 N/A TYR 25.A N ARG 22.A O no hydrogen 3.058 N/A SER 26.A N THR 289.A O no hydrogen 3.088 N/A MET 28.A N VAL 20.A O no hydrogen 2.901 N/A LEU 30.A N THR 18.A O no hydrogen 2.981 N/A MET 32.A N TYR 16.A O no hydrogen 2.782 N/A GLU 33.A N ARG 135.A O no hydrogen 2.890 N/A LEU 35.A N LYS 133.A O no hydrogen 2.788 N/A SER 36.A N LYS 133.A O no hydrogen 3.436 N/A VAL 37.A N ASN 271.A OD1 no hydrogen 3.392 N/A THR 38.A N SER 131.A O no hydrogen 2.783 N/A LEU 39.A N ALA 269.A O no hydrogen 2.808 N/A GLU 40.A N SER 129.A O no hydrogen 3.146 N/A THR 42.A OG1 THR 127.A O no hydrogen 3.549 N/A SER 44.A N ARG 124.A O no hydrogen 3.231 N/A ASP 46.A N ALA 122.A O no hydrogen 2.988 N/A TYR 47.A OH PRO 191.A O no hydrogen 2.710 N/A ILE 48.A N SER 206.A O no hydrogen 2.640 N/A THR 49.A N ALA 120.A O no hydrogen 2.786 N/A THR 49.A OG1 ILE 204.A O no hydrogen 2.648 N/A CYS 50.A SG GLU 51.A O no hydrogen 3.970 N/A TYR 52.A OH ALA 237.A O no hydrogen 2.657 N/A LYS 53.A N GLU 110.A O no hydrogen 2.872 N/A LYS 53.A NZ GLU 113.A OE2 no hydrogen 3.118 N/A THR 54.A OG1 GLN 236.A OE1 no hydrogen 2.722 N/A VAL 55.A N HIS 108.A O no hydrogen 2.830 N/A TYR 60.A N LEU 104.A O no hydrogen 3.020 N/A LYS 62.A N THR 102.A O no hydrogen 2.745 N/A CYS 63.A SG TYR 94.A O no hydrogen 3.799 N/A CYS 64.A N ASN 101.A OD1 no hydrogen 2.763 N/A ALA 67.A N THR 102.A OG1 no hydrogen 2.887 N/A LYS 72.A NZ GLU 106.A OE1 no hydrogen 2.858 N/A LEU 74.A N LYS 72.A O no hydrogen 2.949 N/A TYR 77.A N LEU 74.A O no hydrogen 3.374 N/A TYR 77.A OH GLU 106.A OE1 no hydrogen 2.830 N/A SER 78.A N ALA 107.A O no hydrogen 2.834 N/A SER 78.A OG ASP 76.A O no hydrogen 3.384 N/A SER 78.A OG LEU 220.A O no hydrogen 3.318 N/A CYS 79.A SG SER 105.A O no hydrogen 3.918 N/A LYS 80.A N SER 105.A O no hydrogen 3.203 N/A PHE 82.A N GLN 103.A O no hydrogen 2.874 N/A VAL 85.A N.A ASN 101.A O no hydrogen 3.426 N/A VAL 85.A N.B ASN 101.A O no hydrogen 3.428 N/A PHE 88.A N GLY 228.A O no hydrogen 3.113 N/A MET 89.A N GLY 92.A O no hydrogen 2.762 N/A GLY 92.A N MET 89.A O no hydrogen 3.382 N/A TYR 94.A N PRO 87.A O no hydrogen 3.002 N/A ASN 101.A N ALA 99.A O no hydrogen 2.695 N/A ASN 101.A ND2 CYS 97.A O no hydrogen 2.705 N/A THR 102.A N LYS 62.A O no hydrogen 3.060 N/A THR 102.A OG1 GLY 65.A O no hydrogen 2.792 N/A GLN 103.A N PHE 82.A O no hydrogen 3.048 N/A LEU 104.A N TYR 60.A O no hydrogen 2.787 N/A SER 105.A N LYS 80.A O no hydrogen 2.945 N/A SER 105.A OG GLN 103.A OE1 no hydrogen 3.151 N/A ALA 107.A N SER 78.A O no hydrogen 3.093 N/A HIS 108.A N VAL 55.A O no hydrogen 3.214 N/A HIS 108.A NE2 GLU 110.A OE1 no hydrogen 2.957 N/A VAL 109.A N PRO 75.A O no hydrogen 2.781 N/A GLU 110.A N LYS 53.A O no hydrogen 3.062 N/A LYS 111.A NZ SER 206.A OG no hydrogen 2.670 N/A LYS 111.A NZ SER 211.A O no hydrogen 2.753 N/A SER 112.A OG GLU 113.A OE1 no hydrogen 3.438 N/A SER 112.A OG SER 114.A OG no hydrogen 3.234 N/A GLU 113.A N GLU 113.A OE1 no hydrogen 2.758 N/A SER 114.A OG SER 112.A OG no hydrogen 3.234 N/A CYS 115.A N SER 112.A O no hydrogen 3.161 N/A CYS 115.A SG GLU 51.A O no hydrogen 3.411 N/A CYS 115.A SG SER 112.A O no hydrogen 3.429 N/A THR 117.A N SER 114.A O no hydrogen 2.873 N/A GLU 118.A N SER 114.A O no hydrogen 2.613 N/A ALA 120.A N THR 49.A O no hydrogen 2.806 N/A SER 121.A N VAL 180.A O no hydrogen 2.816 N/A ALA 122.A N TYR 47.A O no hydrogen 2.873 N/A TYR 123.A N ILE 178.A O no hydrogen 2.866 N/A ARG 124.A N SER 44.A O no hydrogen 2.899 N/A ALA 125.A N ASN 176.A O no hydrogen 2.788 N/A HIS 126.A N THR 42.A O no hydrogen 3.288 N/A SER 129.A N GLU 40.A O no hydrogen 3.079 N/A SER 131.A N THR 38.A O no hydrogen 2.887 N/A SER 131.A OG THR 38.A O no hydrogen 3.349 N/A ALA 132.A N ALA 147.A O no hydrogen 2.744 N/A LYS 133.A N SER 36.A O no hydrogen 2.844 N/A LEU 134.A N VAL 145.A O no hydrogen 2.811 N/A ARG 135.A N GLU 33.A O no hydrogen 2.776 N/A ARG 135.A NE GLU 33.A OE1 no hydrogen 3.141 N/A ARG 135.A NH1 GLU 31.A OE1 no hydrogen 3.042 N/A ARG 135.A NH1 ASN 142.A OD1 no hydrogen 2.782 N/A ARG 135.A NH2 GLU 31.A OE1 no hydrogen 2.935 N/A ARG 135.A NH2 GLU 33.A OE1 no hydrogen 2.924 N/A VAL 136.A N ILE 143.A O no hydrogen 2.809 N/A LEU 137.A N GLU 31.A O no hydrogen 2.852 N/A TYR 138.A N ASN 141.A O no hydrogen 2.789 N/A ASN 141.A N TYR 138.A O no hydrogen 3.231 N/A ASN 141.A ND2 GLN 139.A O no hydrogen 3.064 N/A ILE 143.A N VAL 136.A O no hydrogen 2.815 N/A VAL 145.A N LEU 134.A O no hydrogen 2.855 N/A ALA 147.A N ALA 132.A O no hydrogen 3.005 N/A ALA 149.A N ALA 130.A O no hydrogen 2.887 N/A ASN 150.A ND2 TYR 148.A O no hydrogen 3.007 N/A GLY 151.A N VAL 164.A O no hydrogen 2.960 N/A VAL 155.A N PHE 162.A O no hydrogen 2.984 N/A VAL 157.A N ALA 160.A O no hydrogen 3.138 N/A ALA 160.A N VAL 157.A O no hydrogen 3.182 N/A LYS 161.A N ASP 282.A O no hydrogen 3.186 N/A PHE 162.A N VAL 155.A O no hydrogen 2.798 N/A ILE 163.A N SER 280.A O no hydrogen 2.887 N/A GLY 165.A N PRO 278.A O no hydrogen 2.878 N/A SER 168.A N ASN 276.A O no hydrogen 3.453 N/A SER 168.A OG ASN 276.A O no hydrogen 3.276 N/A ASP 175.A N ASN 187.A OD1 no hydrogen 2.960 N/A LYS 177.A NZ TYR 190.A O no hydrogen 3.173 N/A ILE 178.A N TYR 123.A O no hydrogen 2.968 N/A VAL 179.A N TYR 186.A O no hydrogen 2.812 N/A VAL 180.A N SER 121.A O no hydrogen 2.830 N/A TYR 181.A N ASP 184.A O no hydrogen 2.850 N/A TYR 181.A OH GLU 118.A OE1 no hydrogen 2.664 N/A LYS 182.A NZ GLU 118.A OE2 no hydrogen 2.757 N/A ASP 184.A N TYR 181.A O no hydrogen 2.857 N/A TYR 186.A N VAL 179.A O no hydrogen 2.751 N/A TYR 186.A OH GLY 249.A O no hydrogen 3.250 N/A ASN 187.A ND2 PRO 173.A O no hydrogen 2.748 N/A MET 188.A N LYS 177.A O no hydrogen 3.376 N/A TYR 190.A OH ASP 46.A OD2 no hydrogen 2.675 N/A GLY 194.A N GLN 205.A OE1 no hydrogen 2.829 N/A ALA 195.A N PRO 192.A O no hydrogen 3.149 N/A GLN 200.A N ARG 197.A O no hydrogen 3.402 N/A ASP 203.A N GLN 200.A O no hydrogen 3.101 N/A GLN 205.A N TYR 215.A O no hydrogen 2.878 N/A GLN 205.A NE2 PRO 191.A O no hydrogen 3.430 N/A GLN 205.A NE2 PRO 192.A O no hydrogen 3.252 N/A SER 206.A N ILE 48.A O no hydrogen 3.043 N/A SER 206.A OG THR 208.A O no hydrogen 2.694 N/A SER 211.A N THR 208.A O no hydrogen 3.286 N/A SER 211.A OG ASP 213.A O no hydrogen 2.795 N/A TYR 215.A N GLN 205.A O no hydrogen 2.819 N/A TYR 215.A OH GLY 196.A O no hydrogen 3.220 N/A ASN 217.A N ASP 203.A O no hydrogen 2.908 N/A ASN 217.A ND2 GLY 196.A O no hydrogen 2.908 N/A THR 218.A N ASP 76.A OD2 no hydrogen 2.760 N/A THR 218.A OG1 ASP 76.A OD2 no hydrogen 2.750 N/A VAL 221.A N SER 235.A O no hydrogen 2.921 N/A GLN 223.A N PRO 233.A O no hydrogen 2.844 N/A ARG 224.A NH1 THR 83.A O no hydrogen 2.793 N/A ARG 224.A NH2 THR 83.A O no hydrogen 2.844 N/A THR 229.A N ALA 226.A O no hydrogen 3.067 N/A THR 229.A OG1 ALA 227.A O no hydrogen 3.331 N/A SER 235.A N VAL 221.A O no hydrogen 2.819 N/A SER 235.A OG VAL 221.A O no hydrogen 3.296 N/A GLN 236.A NE2 THR 218.A OG1 no hydrogen 2.870 N/A ALA 237.A N THR 218.A O no hydrogen 3.030 N/A GLY 240.A N ASP 203.A OD1 no hydrogen 2.815 N/A LYS 242.A N SER 239.A OG no hydrogen 3.359 N/A LYS 242.A NZ GLU 51.A OE2 no hydrogen 2.967 N/A TYR 243.A N SER 239.A O no hydrogen 3.039 N/A TRP 244.A N GLY 240.A O no hydrogen 2.859 N/A LEU 245.A N PHE 241.A O no hydrogen 2.915 N/A LYS 246.A NZ GLU 247.A OE2 no hydrogen 3.482 N/A GLU 247.A N TYR 243.A O no hydrogen 3.087 N/A GLU 247.A N TRP 244.A O no hydrogen 3.128 N/A ARG 248.A NE TYR 186.A OH no hydrogen 2.691 N/A ARG 248.A NH1 LEU 245.A O no hydrogen 2.687 N/A SER 251.A OG ASP 184.A OD1 no hydrogen 2.829 N/A LEU 252.A N VAL 185.A O no hydrogen 2.985 N/A GLN 253.A NE2 GLN 253.A O no hydrogen 3.170 N/A GLN 253.A NE2 GLN 261.A OE1 no hydrogen 3.115 N/A HIS 254.A N SER 251.A O no hydrogen 3.023 N/A THR 255.A N SER 251.A O no hydrogen 3.153 N/A THR 255.A OG1 SER 251.A O no hydrogen 3.340 N/A ALA 256.A N LEU 252.A O no hydrogen 2.935 N/A CYS 260.A SG PRO 257.A O no hydrogen 3.235 N/A GLN 261.A N VAL 270.A O no hydrogen 2.772 N/A GLN 261.A NE2 GLY 259.A O no hydrogen 3.347 N/A ILE 262.A N GLN 253.A OE1 no hydrogen 2.763 N/A ALA 263.A N ARG 268.A O no hydrogen 3.191 N/A THR 264.A OG1 LYS 182.A O no hydrogen 3.214 N/A ARG 268.A N ALA 263.A O no hydrogen 3.077 N/A ARG 268.A NH1 THR 264.A O no hydrogen 3.079 N/A ARG 268.A NH1 PRO 266.A O no hydrogen 2.769 N/A ALA 269.A N LEU 39.A O no hydrogen 2.908 N/A VAL 270.A N GLN 261.A O no hydrogen 2.699 N/A ASN 271.A N VAL 37.A O no hydrogen 2.993 N/A ALA 273.A N PHE 258.A O no hydrogen 2.816 N/A VAL 274.A N CYS 272.A O no hydrogen 2.917 N/A ASN 276.A N SER 168.A OG no hydrogen 2.767 N/A MET 277.A N ILE 8.A O no hydrogen 2.702 N/A ILE 279.A N THR 6.A O no hydrogen 2.681 N/A SER 280.A N ILE 163.A O no hydrogen 2.908 N/A SER 280.A OG GLU 3.A OE1 no hydrogen 2.746 N/A ILE 281.A N HIS 4.A O no hydrogen 2.820 N/A ASP 282.A N LYS 161.A O no hydrogen 2.797 N/A ILE 283.A N TYR 2.A O no hydrogen 2.859 N/A ALA 287.A N PRO 284.A O no hydrogen 3.275 N/A PHE 288.A N GLU 285.A O no hydrogen 3.194 N/A ALA 294.A N ARG 290.A O no hydrogen 2.750 N/A SER 296.A N SER 324.A OG no hydrogen 3.024 N/A THR 298.A N ALA 322.A O no hydrogen 3.125 N/A THR 298.A OG1 ALA 322.A O no hydrogen 3.078 N/A SER 301.A N LYS 320.A O no hydrogen 3.271 N/A GLU 303.A N ILE 318.A O no hydrogen 3.022 N/A THR 308.A N GLY 314.A O no hydrogen 3.054 N/A HIS 309.A N HIS 382.A O no hydrogen 3.006 N/A SER 310.A OG ASP 312.A O no hydrogen 3.547 N/A SER 310.A OG ASP 312.A OD1 no hydrogen 2.732 N/A GLY 314.A N ASP 312.A O no hydrogen 2.973 N/A GLY 315.A N PHE 357.A O no hydrogen 2.899 N/A VAL 316.A N ALA 306.A O no hydrogen 2.828 N/A ALA 317.A N ILE 355.A O no hydrogen 2.950 N/A ILE 318.A N GLU 303.A O no hydrogen 2.816 N/A ILE 319.A N LEU 353.A O no hydrogen 2.807 N/A LYS 320.A N SER 301.A O no hydrogen 3.035 N/A TYR 321.A N SER 351.A O no hydrogen 3.090 N/A ALA 322.A N THR 298.A O no hydrogen 3.128 N/A ALA 323.A N GLY 349.A O no hydrogen 2.792 N/A SER 324.A N SER 296.A O no hydrogen 3.248 N/A LYS 325.A NZ VAL 292.A O no hydrogen 3.356 N/A LYS 325.A NZ ALA 294.A O no hydrogen 3.034 N/A GLY 327.A N VAL 347.A O no hydrogen 3.323 N/A CYS 329.A N ILE 345.A O no hydrogen 3.011 N/A VAL 331.A N ALA 343.A O no hydrogen 2.960 N/A HIS 332.A N GLN 369.A O no hydrogen 3.230 N/A SER 333.A OG THR 335.A O no hydrogen 3.142 N/A SER 333.A OG VAL 338.A O no hydrogen 3.036 N/A MET 334.A N ARG 367.A O no hydrogen 2.779 N/A VAL 338.A N THR 335.A O no hydrogen 3.317 N/A THR 339.A N SER 358.A O no hydrogen 2.990 N/A ARG 341.A N SER 356.A O no hydrogen 2.777 N/A GLU 342.A N GLU 342.A OE1 no hydrogen 2.830 N/A ILE 345.A N CYS 329.A O no hydrogen 2.977 N/A VAL 347.A N GLY 327.A O no hydrogen 2.909 N/A GLU 348.A N TYR 321.A OH no hydrogen 3.263 N/A GLN 352.A N SER 351.A OG no hydrogen 2.755 N/A LEU 353.A N ILE 319.A O no hydrogen 2.804 N/A ILE 355.A N ALA 317.A O no hydrogen 2.870 N/A SER 356.A N GLU 342.A OE1 no hydrogen 2.805 N/A PHE 357.A N GLY 315.A O no hydrogen 2.866 N/A SER 358.A N THR 339.A O no hydrogen 2.802 N/A SER 358.A OG SER 310.A O no hydrogen 3.332 N/A SER 358.A OG SER 311.A O no hydrogen 3.177 N/A SER 358.A OG ASP 312.A O no hydrogen 2.836 N/A THR 359.A OG1 ALA 337.A O no hydrogen 3.169 N/A ALA 364.A N ALA 379.A O no hydrogen 2.801 N/A PHE 366.A N CYS 377.A O no hydrogen 3.094 N/A ARG 367.A N THR 335.A OG1 no hydrogen 3.394 N/A VAL 368.A N VAL 375.A O no hydrogen 2.774 N/A GLN 369.A N HIS 332.A O no hydrogen 2.835 N/A VAL 370.A N THR 373.A O no hydrogen 3.064 N/A CYS 371.A N ALA 330.A O no hydrogen 3.030 N/A CYS 371.A SG LYS 328.A O no hydrogen 3.998 N/A THR 373.A N VAL 370.A O no hydrogen 3.319 N/A THR 373.A OG1 LEU 297.A O no hydrogen 2.980 N/A GLN 374.A NE2 GLN 369.A OE1 no hydrogen 3.447 N/A VAL 375.A N VAL 368.A O no hydrogen 2.881 N/A CYS 377.A N PHE 366.A O no hydrogen 2.709 N/A ALA 379.A N ALA 364.A O no hydrogen 2.883 N/A CYS 381.A N ALA 362.A O no hydrogen 2.771 N/A HIS 382.A N CYS 307.A O no hydrogen 3.215 N/A