Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c6e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH ASN 362.A OD1 no hydrogen 3.296 N/A GLN 3.A N GLU 151.A O no hydrogen 2.588 N/A MET 5.A N PHE 2.A O no hydrogen 3.250 N/A ARG 6.A NE GLU 48.A OE2 no hydrogen 2.561 N/A ARG 6.A NH2 GLU 48.A OE1 no hydrogen 2.646 N/A CYS 7.A SG THR 36.A OG1 no hydrogen 3.616 N/A GLY 9.A N MET 5.A O no hydrogen 2.925 N/A MET 10.A N CYS 7.A O no hydrogen 3.179 N/A ARG 13.A NE THR 36.A OG1 no hydrogen 3.166 N/A ARG 13.A NH1 GLU 364.A OE1 no hydrogen 3.417 N/A ARG 13.A NH1 GLU 364.A OE2 no hydrogen 2.937 N/A ARG 13.A NH2 THR 36.A OG1 no hydrogen 3.117 N/A ARG 13.A NH2 GLU 364.A OE1 no hydrogen 2.945 N/A ASP 14.A N CYS 34.A O no hydrogen 3.077 N/A VAL 16.A N THR 36.A O no hydrogen 2.904 N/A VAL 25.A N LEU 284.A O no hydrogen 2.975 N/A ILE 27.A N CYS 282.A O no hydrogen 3.029 N/A LEU 29.A N LEU 280.A O no hydrogen 2.885 N/A HIS 31.A NE2 THR 52.A OG1 no hydrogen 3.062 N/A SER 33.A N GLU 30.A O no hydrogen 3.301 N/A CYS 34.A N ASN 12.A O no hydrogen 3.046 N/A CYS 34.A SG CYS 7.A O no hydrogen 3.517 N/A CYS 34.A SG ASN 12.A O no hydrogen 4.024 N/A VAL 35.A N PHE 47.A O no hydrogen 2.958 N/A THR 36.A N ASP 14.A O no hydrogen 2.769 N/A THR 36.A OG1 ASP 46.A OD2 no hydrogen 2.762 N/A THR 37.A N LEU 45.A O no hydrogen 2.875 N/A MET 38.A N VAL 16.A O no hydrogen 3.032 N/A LYS 42.A N ALA 39.A O no hydrogen 3.135 N/A LYS 42.A NZ MET 286.A O no hydrogen 3.114 N/A THR 44.A OG1 ILE 348.A O no hydrogen 2.833 N/A LEU 45.A N THR 37.A O no hydrogen 3.082 N/A ASP 46.A N THR 146.A O no hydrogen 2.724 N/A PHE 47.A N VAL 35.A O no hydrogen 2.815 N/A GLU 48.A N VAL 144.A O no hydrogen 3.086 N/A ILE 50.A N THR 142.A O no hydrogen 2.973 N/A LYS 51.A N THR 142.A O no hydrogen 3.507 N/A LYS 51.A NZ GLU 53.A OE2 no hydrogen 2.635 N/A THR 52.A OG1 HIS 31.A NE2 no hydrogen 3.062 N/A GLU 53.A N GLU 140.A O no hydrogen 3.153 N/A ALA 54.A N LEU 274.A O no hydrogen 3.103 N/A LYS 55.A NZ GLU 140.A OE1 no hydrogen 3.204 N/A LYS 55.A NZ GLU 140.A OE2 no hydrogen 2.671 N/A LEU 60.A N GLY 131.A O no hydrogen 3.012 N/A ARG 61.A NH1 TYR 63.A OH no hydrogen 2.985 N/A ARG 61.A NH1 LEU 211.A O no hydrogen 2.957 N/A LYS 62.A N LEU 218.A O no hydrogen 3.116 N/A TYR 63.A N MET 129.A O no hydrogen 2.734 N/A TYR 63.A OH PHE 210.A O no hydrogen 2.368 N/A CYS 64.A N PRO 216.A O no hydrogen 2.737 N/A CYS 64.A SG GLU 66.A O no hydrogen 3.271 N/A CYS 64.A SG LYS 127.A O no hydrogen 3.933 N/A ILE 65.A N LYS 127.A O no hydrogen 2.796 N/A LYS 68.A N ARG 124.A O no hydrogen 2.819 N/A THR 70.A N MET 122.A O no hydrogen 3.113 N/A THR 73.A N CYS 120.A O no hydrogen 2.677 N/A THR 74.A OG1 THR 119.A OG1 no hydrogen 3.045 N/A GLU 75.A N VAL 118.A O no hydrogen 2.906 N/A SER 76.A OG ALA 242.A O no hydrogen 2.819 N/A ARG 77.A N GLY 116.A O no hydrogen 2.645 N/A ARG 77.A NH1 GLN 81.A O no hydrogen 3.070 N/A CYS 78.A SG GLY 108.A O no hydrogen 3.912 N/A GLN 81.A N CYS 78.A O no hydrogen 3.273 N/A LEU 86.A N GLU 89.A OE2 no hydrogen 3.467 N/A GLU 89.A N LEU 86.A O no hydrogen 2.898 N/A GLN 90.A N ASN 87.A O no hydrogen 2.800 N/A ASP 91.A N GLU 88.A O no hydrogen 3.034 N/A ARG 93.A N ASP 91.A OD1 no hydrogen 2.824 N/A ARG 93.A NE ASP 91.A OD1 no hydrogen 3.241 N/A ARG 93.A NH2 ASP 91.A OD2 no hydrogen 2.923 N/A PHE 94.A N ASP 91.A O no hydrogen 3.050 N/A VAL 95.A N ALA 121.A O no hydrogen 2.934 N/A LYS 97.A N THR 119.A O no hydrogen 3.153 N/A HIS 98.A NE2 GLU 89.A OE1 no hydrogen 2.472 N/A SER 99.A N ILE 117.A O no hydrogen 2.936 N/A VAL 101.A N GLY 115.A O no hydrogen 2.932 N/A ARG 103.A N GLY 113.A O no hydrogen 2.893 N/A ARG 103.A NH2 ASN 107.A O no hydrogen 2.956 N/A TRP 105.A NE1 GLY 110.A O no hydrogen 2.867 N/A ASN 107.A N GLY 104.A O no hydrogen 3.025 N/A CYS 109.A N GLY 104.A O no hydrogen 2.988 N/A GLY 113.A N ARG 103.A O no hydrogen 3.453 N/A LYS 114.A NZ ASP 102.A OD1 no hydrogen 2.838 N/A GLY 115.A N VAL 101.A O no hydrogen 2.771 N/A ILE 117.A N SER 99.A O no hydrogen 3.002 N/A VAL 118.A N GLU 75.A O no hydrogen 2.729 N/A THR 119.A N LYS 97.A O no hydrogen 3.264 N/A THR 119.A OG1 THR 74.A OG1 no hydrogen 3.045 N/A CYS 120.A N THR 73.A O no hydrogen 2.909 N/A ALA 121.A N VAL 95.A O no hydrogen 2.999 N/A MET 122.A N THR 70.A O no hydrogen 2.846 N/A PHE 123.A N ARG 93.A O no hydrogen 2.776 N/A ARG 124.A N LYS 68.A O no hydrogen 2.954 N/A CYS 125.A SG GLU 66.A O no hydrogen 3.570 N/A CYS 125.A SG LYS 127.A O no hydrogen 3.635 N/A LYS 126.A N GLU 66.A O no hydrogen 2.695 N/A LYS 127.A N GLU 66.A O no hydrogen 3.295 N/A LYS 127.A NZ GLU 254.A OE1 no hydrogen 2.544 N/A MET 129.A N TYR 63.A O no hydrogen 2.741 N/A GLU 130.A N GLN 197.A O no hydrogen 3.293 N/A GLY 131.A N ARG 61.A O no hydrogen 3.208 N/A LYS 132.A N LEU 195.A O no hydrogen 2.776 N/A VAL 133.A N ALA 58.A O no hydrogen 2.820 N/A ASN 138.A ND2 GLN 135.A OE1 no hydrogen 3.210 N/A GLU 140.A N GLU 53.A O no hydrogen 2.856 N/A TYR 141.A N ILE 163.A O no hydrogen 3.040 N/A THR 142.A N LYS 51.A O no hydrogen 2.700 N/A ILE 143.A N ILE 161.A O no hydrogen 2.935 N/A VAL 144.A N GLU 48.A O no hydrogen 2.892 N/A ILE 145.A N LYS 159.A O no hydrogen 2.852 N/A THR 146.A N ASP 46.A O no hydrogen 2.791 N/A HIS 148.A N THR 44.A O no hydrogen 2.827 N/A HIS 148.A ND1 ASP 46.A OD1 no hydrogen 2.817 N/A HIS 148.A NE2 GLU 364.A OE1 no hydrogen 2.681 N/A GLY 150.A N GLN 3.A O no hydrogen 2.979 N/A GLU 151.A N SER 149.A OG no hydrogen 3.176 N/A HIS 153.A N TYR 1.A O no hydrogen 2.469 N/A LYS 156.A NZ GLU 151.A OE1 no hydrogen 2.419 N/A LYS 159.A NZ GLU 160.A O no hydrogen 2.937 N/A ILE 161.A N ILE 143.A O no hydrogen 2.981 N/A LYS 162.A NZ THR 142.A OG1 no hydrogen 2.941 N/A ILE 163.A N TYR 141.A O no hydrogen 3.053 N/A THR 164.A N SER 167.A OG no hydrogen 2.922 N/A SER 167.A N THR 164.A O no hydrogen 2.794 N/A SER 167.A OG THR 164.A O no hydrogen 2.755 N/A THR 170.A N MET 182.A O no hydrogen 2.901 N/A ALA 172.A N VAL 180.A O no hydrogen 2.830 N/A LEU 174.A N GLY 178.A O no hydrogen 2.763 N/A TYR 177.A N LEU 174.A O no hydrogen 2.777 N/A GLY 178.A N LEU 174.A O no hydrogen 3.297 N/A THR 179.A N LYS 288.A O no hydrogen 3.266 N/A THR 179.A OG1 GLU 171.A OE1 no hydrogen 3.287 N/A THR 179.A OG1 GLU 171.A OE2 no hydrogen 3.378 N/A VAL 180.A N ALA 172.A O no hydrogen 2.739 N/A THR 181.A N ARG 285.A O no hydrogen 3.209 N/A MET 182.A N THR 170.A O no hydrogen 2.926 N/A GLU 183.A N ARG 283.A O no hydrogen 3.006 N/A SER 185.A N LYS 281.A O no hydrogen 2.841 N/A MET 193.A N PHE 191.A O no hydrogen 3.244 N/A VAL 194.A N VAL 205.A O no hydrogen 2.653 N/A LEU 195.A N LYS 132.A O no hydrogen 2.851 N/A LEU 196.A N TRP 203.A O no hydrogen 2.818 N/A GLN 197.A N GLU 130.A O no hydrogen 2.878 N/A MET 198.A N LYS 201.A O no hydrogen 2.853 N/A LYS 201.A NZ GLU 266.A OE1 no hydrogen 3.239 N/A LYS 201.A NZ GLU 266.A OE2 no hydrogen 2.996 N/A TRP 203.A N LEU 196.A O no hydrogen 2.882 N/A LEU 204.A N THR 265.A O no hydrogen 3.048 N/A VAL 205.A N VAL 194.A O no hydrogen 2.635 N/A ASP 212.A N TRP 209.A O no hydrogen 3.245 N/A LEU 213.A N PHE 210.A O no hydrogen 3.349 N/A LEU 215.A N LEU 213.A O no hydrogen 2.982 N/A TRP 217.A N ILE 229.A O no hydrogen 3.092 N/A LEU 218.A N LYS 62.A O no hydrogen 2.932 N/A GLY 220.A N LEU 60.A O no hydrogen 2.935 N/A GLN 224.A N ASP 222.A OD1 no hydrogen 2.897 N/A GLY 225.A N ASP 222.A OD1 no hydrogen 3.496 N/A GLY 225.A N ASP 222.A OD2 no hydrogen 2.827 N/A SER 226.A OG GLN 224.A O no hydrogen 3.355 N/A TRP 228.A N SER 226.A O no hydrogen 2.870 N/A TRP 228.A NE1 GLY 225.A O no hydrogen 2.918 N/A ILE 229.A N TRP 217.A O no hydrogen 2.816 N/A GLN 230.A NE2 LEU 213.A O no hydrogen 3.579 N/A GLN 230.A NE2 LEU 215.A O no hydrogen 2.891 N/A LYS 231.A NZ LYS 92.A O no hydrogen 2.520 N/A LYS 231.A NZ PHE 94.A O no hydrogen 2.980 N/A THR 233.A N GLN 230.A O no hydrogen 3.291 N/A THR 233.A OG1 GLN 230.A O no hydrogen 2.523 N/A LEU 234.A N LYS 231.A O no hydrogen 2.856 N/A VAL 235.A N GLU 232.A O no hydrogen 3.141 N/A THR 236.A N VAL 248.A O no hydrogen 2.816 N/A LYS 238.A N ASP 246.A O no hydrogen 3.098 N/A HIS 241.A N LYS 244.A O no hydrogen 2.833 N/A LYS 243.A NZ SER 76.A O no hydrogen 3.447 N/A GLN 245.A NE2 THR 119.A OG1 no hydrogen 2.563 N/A VAL 248.A N THR 236.A O no hydrogen 2.989 N/A LEU 250.A N LEU 234.A O no hydrogen 2.900 N/A SER 252.A OG GLU 66.A OE2 no hydrogen 3.194 N/A GLN 253.A N ILE 65.A O no hydrogen 2.742 N/A GLN 253.A NE2 GLY 251.A O no hydrogen 2.609 N/A GLU 254.A N SER 252.A OG no hydrogen 3.234 N/A MET 257.A N GLN 253.A O no hydrogen 2.790 N/A HIS 258.A N GLU 254.A O no hydrogen 2.837 N/A HIS 258.A NE2 GLU 254.A OE2 no hydrogen 3.284 N/A THR 259.A N GLY 255.A O no hydrogen 3.133 N/A THR 259.A OG1 GLY 255.A O no hydrogen 3.089 N/A ALA 260.A N MET 257.A O no hydrogen 2.701 N/A LEU 261.A N MET 257.A O no hydrogen 2.931 N/A LEU 261.A N HIS 258.A O no hydrogen 2.867 N/A ALA 264.A N LEU 261.A O no hydrogen 3.071 N/A ILE 267.A N ALA 202.A O no hydrogen 3.049 N/A SER 270.A N ASN 273.A O no hydrogen 2.937 N/A ASN 273.A N SER 270.A O no hydrogen 2.813 N/A LEU 275.A N GLN 268.A O no hydrogen 3.171 N/A PHE 276.A N THR 52.A O no hydrogen 2.697 N/A LEU 280.A N LEU 29.A O no hydrogen 3.048 N/A LYS 281.A N SER 185.A O no hydrogen 3.097 N/A CYS 282.A N ILE 27.A O no hydrogen 3.042 N/A ARG 283.A N GLU 183.A O no hydrogen 2.988 N/A LEU 284.A N VAL 25.A O no hydrogen 2.994 N/A ARG 285.A N THR 181.A O no hydrogen 2.766 N/A ARG 285.A NH2 GLY 22.A O no hydrogen 2.427 N/A LYS 288.A NZ GLU 171.A OE1 no hydrogen 3.052 N/A LEU 289.A N MET 286.A O no hydrogen 2.873 N/A GLN 290.A N TYR 177.A O no hydrogen 2.726 N/A LYS 292.A NZ THR 175.A O no hydrogen 3.496 N/A SER 297.A OG SER 327.A OG no hydrogen 3.220 N/A CYS 299.A N LYS 330.A O no hydrogen 3.055 N/A CYS 299.A SG LYS 330.A O no hydrogen 2.585 N/A LYS 304.A N GLN 322.A O no hydrogen 3.387 N/A VAL 306.A N ARG 320.A O no hydrogen 3.140 N/A ALA 310.A N VAL 318.A O no hydrogen 3.432 N/A THR 312.A N THR 316.A O no hydrogen 2.910 N/A THR 312.A OG1 THR 316.A O no hydrogen 3.200 N/A THR 312.A OG1 THR 316.A OG1 no hydrogen 2.570 N/A HIS 314.A N THR 312.A OG1 no hydrogen 2.904 N/A THR 316.A N THR 312.A OG1 no hydrogen 3.371 N/A THR 316.A OG1 THR 312.A OG1 no hydrogen 2.570 N/A THR 316.A OG1 GLU 364.A OE2 no hydrogen 2.766 N/A ILE 317.A N ALA 365.A O no hydrogen 2.759 N/A VAL 318.A N ALA 310.A O no hydrogen 2.972 N/A ILE 319.A N ILE 363.A O no hydrogen 2.720 N/A GLY 326.A N GLY 324.A O no hydrogen 2.863 N/A SER 327.A OG SER 297.A OG no hydrogen 3.220 N/A CYS 329.A SG SER 327.A O no hydrogen 2.968 N/A CYS 329.A SG LYS 330.A O no hydrogen 3.988 N/A LYS 330.A N SER 297.A O no hydrogen 3.168 N/A ILE 331.A N PRO 352.A O no hydrogen 3.343 N/A MET 336.A N TYR 373.A O no hydrogen 3.062 N/A LYS 340.A N ASP 337.A O no hydrogen 2.930 N/A ARG 341.A N ASP 337.A OD1 no hydrogen 2.993 N/A HIS 342.A N ASP 337.A OD2 no hydrogen 3.113 N/A HIS 342.A ND1 ASP 337.A OD2 no hydrogen 2.647 N/A LEU 344.A N ILE 335.A O no hydrogen 2.632 N/A ARG 346.A N GLU 366.A O no hydrogen 2.999 N/A ARG 346.A NH1 GLU 366.A OE1 no hydrogen 3.360 N/A ILE 348.A N GLU 364.A O no hydrogen 3.074 N/A THR 349.A N GLU 364.A O no hydrogen 3.098 N/A VAL 354.A N CYS 329.A O no hydrogen 2.753 N/A GLU 356.A N SER 359.A OG no hydrogen 3.224 N/A SER 359.A OG GLU 356.A O no hydrogen 2.589 N/A SER 359.A OG SER 359.A O no hydrogen 2.535 N/A VAL 361.A N VAL 321.A O no hydrogen 2.712 N/A ILE 363.A N ILE 319.A O no hydrogen 3.034 N/A GLU 364.A N THR 349.A OG1 no hydrogen 2.947 N/A ALA 365.A N ILE 317.A O no hydrogen 2.787 N/A GLU 366.A N ARG 346.A O no hydrogen 2.717 N/A GLY 370.A N LYS 389.A O no hydrogen 3.023 N/A SER 372.A N TRP 387.A O no hydrogen 3.000 N/A TYR 373.A N MET 336.A O no hydrogen 2.882 N/A ILE 374.A N LEU 385.A O no hydrogen 2.735 N/A ILE 375.A N GLU 334.A O no hydrogen 2.890 N/A ILE 376.A N LEU 383.A O no hydrogen 3.483 N/A GLY 377.A N PRO 332.A O no hydrogen 2.892 N/A LEU 383.A N ILE 376.A O no hydrogen 2.845 N/A LYS 384.A NZ GLN 382.A O no hydrogen 3.177 N/A LEU 385.A N ILE 374.A O no hydrogen 3.077 N/A TRP 387.A N SER 372.A O no hydrogen 2.936 N/A LYS 389.A N GLY 370.A O no hydrogen 2.787 N/A LYS 389.A NZ GLY 315.A O no hydrogen 2.941 N/A LYS 389.A NZ PRO 367.A O no hydrogen 3.172 N/A