Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8e3z_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A SG CYS 173.A O no hydrogen 3.924 N/A ASP 3.A N ASP 3.A OD1 no hydrogen 2.629 N/A GLN 6.A NE2 CYS 2.A O no hydrogen 3.284 N/A ILE 8.A N VAL 5.A O no hydrogen 3.184 N/A GLU 9.A N GLU 9.A OE1 no hydrogen 3.117 N/A VAL 10.A N GLN 6.A O no hydrogen 2.949 N/A GLN 11.A N MET 7.A O no hydrogen 2.858 N/A HIS 12.A N ILE 8.A O no hydrogen 2.930 N/A LYS 13.A N GLU 9.A O no hydrogen 2.893 N/A GLN 14.A N VAL 10.A O no hydrogen 2.910 N/A CYS 15.A N GLN 11.A O no hydrogen 3.125 N/A LEU 16.A N LYS 13.A O no hydrogen 3.434 N/A CYS 28.A SG CYS 70.A O no hydrogen 2.975 N/A LYS 30.A N TRP 38.A O no hydrogen 2.855 N/A ASP 33.A N THR 36.A O no hydrogen 3.163 N/A CYS 37.A SG MET 31.A O no hydrogen 3.155 N/A LEU 49.A N VAL 66.A O no hydrogen 2.911 N/A CYS 51.A SG PRO 52.A O no hydrogen 3.712 N/A LYS 56.A N LEU 53.A O no hydrogen 2.908 N/A SER 59.A OG ILE 61.A O no hydrogen 2.823 N/A ILE 61.A N SER 59.A OG no hydrogen 3.396 N/A VAL 66.A N LEU 49.A O no hydrogen 2.897 N/A SER 67.A OG VAL 47.A O no hydrogen 3.399 N/A SER 69.A N TRP 75.A O no hydrogen 2.412 N/A SER 69.A OG TRP 75.A O no hydrogen 2.866 N/A CYS 87.A SG PRO 52.A O no hydrogen 3.834 N/A GLN 99.A N SER 95.A O no hydrogen 2.924 N/A GLN 100.A N LEU 96.A O no hydrogen 2.890 N/A THR 101.A N ASP 97.A O no hydrogen 2.912 N/A MET 102.A N GLU 98.A O no hydrogen 2.926 N/A PHE 103.A N GLN 99.A O no hydrogen 2.927 N/A TYR 104.A N GLN 100.A O no hydrogen 2.900 N/A GLY 105.A N THR 101.A O no hydrogen 2.891 N/A SER 106.A N MET 102.A O no hydrogen 2.921 N/A VAL 107.A N PHE 103.A O no hydrogen 2.945 N/A LYS 108.A N TYR 104.A O no hydrogen 2.867 N/A THR 109.A N GLY 105.A O no hydrogen 2.927 N/A THR 109.A OG1 GLY 105.A O no hydrogen 3.270 N/A THR 109.A OG1 SER 106.A O no hydrogen 2.537 N/A GLY 110.A N SER 106.A O no hydrogen 2.926 N/A TYR 111.A N VAL 107.A O no hydrogen 2.946 N/A TYR 111.A OH ASP 161.A OD1 no hydrogen 3.010 N/A TYR 111.A OH ASP 161.A OD2 no hydrogen 2.869 N/A THR 112.A N LYS 108.A O no hydrogen 2.942 N/A THR 112.A OG1 LYS 108.A O no hydrogen 2.606 N/A THR 112.A OG1 THR 109.A O no hydrogen 2.697 N/A ILE 113.A N THR 109.A O no hydrogen 2.948 N/A GLY 114.A N GLY 110.A O no hydrogen 2.972 N/A TYR 115.A N TYR 111.A O no hydrogen 2.872 N/A GLY 116.A N THR 112.A O no hydrogen 2.894 N/A LEU 117.A N ILE 113.A O no hydrogen 2.942 N/A SER 118.A N GLY 114.A O no hydrogen 2.927 N/A LEU 119.A N TYR 115.A O no hydrogen 2.855 N/A ALA 120.A N GLY 116.A O no hydrogen 2.921 N/A THR 121.A N LEU 117.A O no hydrogen 2.970 N/A THR 121.A OG1 LEU 117.A O no hydrogen 2.871 N/A LEU 122.A N SER 118.A O no hydrogen 2.856 N/A LEU 123.A N LEU 119.A O no hydrogen 2.972 N/A ALA 125.A N THR 121.A O no hydrogen 2.954 N/A THR 126.A N LEU 122.A O no hydrogen 2.866 N/A THR 126.A OG1 LEU 122.A O no hydrogen 2.607 N/A ALA 127.A N LEU 123.A O no hydrogen 2.923 N/A ILE 128.A N VAL 124.A O no hydrogen 2.918 N/A LEU 129.A N ALA 125.A O no hydrogen 2.933 N/A SER 130.A N THR 126.A O no hydrogen 2.882 N/A LEU 131.A N ALA 127.A O no hydrogen 2.911 N/A HIS 136.A N ARG 133.A O no hydrogen 3.222 N/A HIS 136.A NE2 SER 130.A O no hydrogen 3.014 N/A CYS 137.A SG LEU 135.A O no hydrogen 3.415 N/A ARG 139.A NH1 GLU 359.A OE1 no hydrogen 3.339 N/A ASN 140.A ND2 LEU 135.A O no hydrogen 2.303 N/A TYR 141.A N CYS 137.A O no hydrogen 2.679 N/A ILE 142.A N THR 138.A O no hydrogen 2.917 N/A HIS 143.A N ARG 139.A O no hydrogen 2.814 N/A MET 144.A N ASN 140.A O no hydrogen 2.809 N/A MET 144.A N TYR 141.A O no hydrogen 3.242 N/A HIS 145.A N TYR 141.A O no hydrogen 2.896 N/A LEU 146.A N ILE 142.A O no hydrogen 2.977 N/A PHE 147.A N HIS 143.A O no hydrogen 3.195 N/A ILE 148.A N MET 144.A O no hydrogen 2.916 N/A SER 149.A N HIS 145.A O no hydrogen 2.911 N/A SER 149.A OG LEU 146.A O no hydrogen 2.627 N/A PHE 150.A N LEU 146.A O no hydrogen 2.991 N/A ILE 151.A N PHE 147.A O no hydrogen 2.882 N/A LEU 152.A N ILE 148.A O no hydrogen 2.879 N/A ARG 153.A N SER 149.A O no hydrogen 2.920 N/A ARG 153.A NH2 ASN 194.A OD1 no hydrogen 2.863 N/A ALA 154.A N PHE 150.A O no hydrogen 2.918 N/A ALA 155.A N ILE 151.A O no hydrogen 2.913 N/A ALA 156.A N LEU 152.A O no hydrogen 2.878 N/A VAL 157.A N ARG 153.A O no hydrogen 2.888 N/A PHE 158.A N ALA 154.A O no hydrogen 2.954 N/A ILE 159.A N ALA 155.A O no hydrogen 2.906 N/A LYS 160.A N ALA 156.A O no hydrogen 2.879 N/A ASP 161.A N VAL 157.A O no hydrogen 2.930 N/A LEU 162.A N PHE 158.A O no hydrogen 2.911 N/A ALA 163.A N ILE 159.A O no hydrogen 2.897 N/A LEU 164.A N LYS 160.A O no hydrogen 2.904 N/A PHE 165.A N ASP 161.A O no hydrogen 3.230 N/A ASP 166.A N ASP 161.A O no hydrogen 3.178 N/A GLN 172.A N GLY 168.A O no hydrogen 2.985 N/A CYS 173.A N GLU 169.A O no hydrogen 2.898 N/A SER 174.A N SER 170.A O no hydrogen 2.899 N/A SER 174.A OG SER 170.A O no hydrogen 2.832 N/A GLU 175.A N ASP 171.A O no hydrogen 3.117 N/A CYS 180.A N SER 177.A O no hydrogen 3.202 N/A LYS 181.A NZ ASP 247.A OD1 no hydrogen 3.560 N/A LYS 181.A NZ ASP 247.A OD2 no hydrogen 3.056 N/A ALA 182.A N VAL 178.A O no hydrogen 2.927 N/A ALA 183.A N GLY 179.A O no hydrogen 2.870 N/A MET 184.A N CYS 180.A O no hydrogen 2.925 N/A VAL 185.A N LYS 181.A O no hydrogen 2.901 N/A PHE 186.A N ALA 182.A O no hydrogen 2.925 N/A PHE 187.A N ALA 183.A O no hydrogen 2.866 N/A GLN 188.A N MET 184.A O no hydrogen 2.934 N/A TYR 189.A N VAL 185.A O no hydrogen 2.901 N/A CYS 190.A N PHE 186.A O no hydrogen 2.887 N/A CYS 190.A SG LEU 152.A O no hydrogen 3.123 N/A CYS 190.A SG PHE 186.A O no hydrogen 3.462 N/A VAL 191.A N PHE 187.A O no hydrogen 2.940 N/A MET 192.A N GLN 188.A O no hydrogen 2.949 N/A ALA 193.A N TYR 189.A O no hydrogen 2.853 N/A ASN 194.A N CYS 190.A O no hydrogen 2.893 N/A ASN 194.A ND2 SER 149.A OG no hydrogen 3.021 N/A PHE 195.A N VAL 191.A O no hydrogen 2.979 N/A PHE 196.A N MET 192.A O no hydrogen 2.879 N/A TRP 197.A N ALA 193.A O no hydrogen 2.968 N/A TRP 197.A N ASN 194.A O no hydrogen 3.192 N/A LEU 198.A N ASN 194.A O no hydrogen 3.132 N/A LEU 198.A N PHE 195.A O no hydrogen 3.192 N/A LEU 199.A N PHE 195.A O no hydrogen 3.227 N/A VAL 200.A N PHE 196.A O no hydrogen 3.021 N/A GLU 201.A N TRP 197.A O no hydrogen 3.035 N/A GLY 202.A N LEU 198.A O no hydrogen 3.076 N/A LEU 203.A N LEU 199.A O no hydrogen 2.741 N/A TYR 204.A N VAL 200.A O no hydrogen 2.702 N/A LEU 205.A N GLU 201.A O no hydrogen 3.232 N/A TYR 206.A N GLY 202.A O no hydrogen 2.875 N/A THR 207.A N LEU 203.A O no hydrogen 2.751 N/A THR 207.A OG1 LEU 203.A O no hydrogen 2.860 N/A THR 207.A OG1 TYR 204.A O no hydrogen 2.660 N/A THR 207.A OG1 TYR 223.A OH no hydrogen 2.995 N/A LEU 208.A N TYR 204.A O no hydrogen 2.808 N/A LEU 209.A N LEU 205.A O no hydrogen 2.805 N/A ALA 210.A N TYR 206.A O no hydrogen 2.788 N/A VAL 211.A N THR 207.A O no hydrogen 2.972 N/A TYR 219.A N GLU 216.A O no hydrogen 3.258 N/A TYR 223.A N TYR 219.A O no hydrogen 3.209 N/A TYR 223.A OH THR 207.A OG1 no hydrogen 2.995 N/A ILE 224.A N PHE 220.A O no hydrogen 2.924 N/A LEU 225.A N TRP 221.A O no hydrogen 2.881 N/A ILE 226.A N GLY 222.A O no hydrogen 2.909 N/A GLY 227.A N TYR 223.A O no hydrogen 2.916 N/A TRP 228.A N ILE 224.A O no hydrogen 2.923 N/A TRP 228.A N LEU 225.A O no hydrogen 3.215 N/A GLY 229.A N LEU 225.A O no hydrogen 2.869 N/A SER 232.A N TRP 228.A O no hydrogen 3.235 N/A SER 232.A OG GLY 229.A O no hydrogen 2.405 N/A THR 233.A N GLY 229.A O no hydrogen 2.676 N/A THR 233.A OG1 GLY 229.A O no hydrogen 3.024 N/A PHE 234.A N VAL 230.A O no hydrogen 2.946 N/A THR 235.A N PRO 231.A O no hydrogen 2.877 N/A THR 235.A OG1 PRO 231.A O no hydrogen 2.496 N/A MET 236.A N SER 232.A O no hydrogen 2.912 N/A VAL 237.A N THR 233.A O no hydrogen 2.919 N/A TRP 238.A N PHE 234.A O no hydrogen 2.908 N/A THR 239.A N THR 235.A O no hydrogen 2.884 N/A THR 239.A OG1 THR 235.A O no hydrogen 2.737 N/A ILE 240.A N MET 236.A O no hydrogen 2.913 N/A ALA 241.A N VAL 237.A O no hydrogen 2.915 N/A ARG 242.A N TRP 238.A O no hydrogen 2.898 N/A ARG 242.A NE GLU 246.A O no hydrogen 3.035 N/A ARG 242.A NH1 GLU 246.A O no hydrogen 3.552 N/A ARG 242.A NH1 ASP 247.A O no hydrogen 3.403 N/A ARG 242.A NH2 THR 253.A O no hydrogen 3.414 N/A ILE 243.A N THR 239.A O no hydrogen 2.907 N/A HIS 244.A N ILE 240.A O no hydrogen 2.893 N/A PHE 245.A N ALA 241.A O no hydrogen 2.752 N/A GLY 249.A N ASP 247.A OD1 no hydrogen 2.891 N/A CYS 250.A SG GLN 172.A OE1 no hydrogen 3.760 N/A THR 253.A OG1 ASN 255.A OD1 no hydrogen 2.936 N/A SER 256.A OG ASN 255.A OD1 no hydrogen 3.236 N/A TRP 259.A N SER 256.A O no hydrogen 3.365 N/A TRP 260.A N SER 257.A O no hydrogen 2.912 N/A ILE 261.A N LEU 258.A O no hydrogen 2.917 N/A ILE 262.A N TRP 259.A O no hydrogen 2.914 N/A LYS 263.A N TRP 259.A O no hydrogen 2.783 N/A GLY 264.A N TRP 260.A O no hydrogen 2.472 N/A LEU 267.A N LYS 263.A O no hydrogen 3.329 N/A THR 268.A N GLY 264.A O no hydrogen 3.284 N/A THR 268.A OG1 GLY 264.A O no hydrogen 3.346 N/A SER 269.A N PRO 265.A O no hydrogen 2.656 N/A SER 269.A OG PRO 265.A O no hydrogen 3.533 N/A SER 269.A OG ILE 266.A O no hydrogen 2.372 N/A ILE 270.A N ILE 266.A O no hydrogen 2.982 N/A ILE 270.A N LEU 267.A O no hydrogen 2.943 N/A LEU 271.A N LEU 267.A O no hydrogen 2.832 N/A VAL 272.A N THR 268.A O no hydrogen 3.088 N/A PHE 274.A N ILE 270.A O no hydrogen 2.842 N/A ILE 275.A N LEU 271.A O no hydrogen 2.950 N/A LEU 276.A N VAL 272.A O no hydrogen 2.769 N/A PHE 277.A N ASN 273.A O no hydrogen 2.693 N/A ILE 278.A N PHE 274.A O no hydrogen 2.824 N/A CYS 279.A N ILE 275.A O no hydrogen 2.944 N/A CYS 279.A SG ILE 275.A O no hydrogen 3.504 N/A ILE 280.A N LEU 276.A O no hydrogen 2.789 N/A ILE 281.A N PHE 277.A O no hydrogen 2.870 N/A ARG 282.A N ILE 278.A O no hydrogen 3.073 N/A ILE 283.A N CYS 279.A O no hydrogen 2.846 N/A LEU 284.A N ILE 280.A O no hydrogen 2.938 N/A LEU 285.A N ILE 281.A O no hydrogen 3.002 N/A LEU 285.A N ARG 282.A O no hydrogen 2.952 N/A LYS 287.A N LEU 284.A O no hydrogen 2.941 N/A LEU 288.A N LEU 284.A O no hydrogen 2.784 N/A ARG 289.A N LEU 285.A O no hydrogen 2.975 N/A LYS 295.A NZ ILE 293.A O no hydrogen 2.704 N/A SER 298.A N SER 296.A O no hydrogen 2.981 N/A LEU 304.A N PRO 300.A O no hydrogen 2.936 N/A ALA 305.A N TYR 301.A O no hydrogen 2.854 N/A ARG 306.A N SER 302.A O no hydrogen 2.927 N/A SER 307.A N ARG 303.A O no hydrogen 2.919 N/A SER 307.A OG ARG 303.A O no hydrogen 2.898 N/A THR 308.A N LEU 304.A O no hydrogen 2.891 N/A THR 308.A OG1 LEU 304.A O no hydrogen 2.912 N/A LEU 309.A N ALA 305.A O no hydrogen 2.875 N/A LEU 310.A N ARG 306.A O no hydrogen 2.934 N/A LEU 311.A N SER 307.A O no hydrogen 2.907 N/A LEU 311.A N THR 308.A O no hydrogen 3.125 N/A ILE 312.A N THR 308.A O no hydrogen 2.925 N/A PHE 315.A N LEU 311.A O no hydrogen 3.214 N/A GLY 316.A N ILE 312.A O no hydrogen 2.872 N/A TYR 319.A OH GLN 345.A OE1 no hydrogen 3.140 N/A ILE 320.A N VAL 317.A O no hydrogen 2.925 N/A MET 321.A N HIS 318.A O no hydrogen 2.924 N/A LYS 330.A NZ PRO 326.A O no hydrogen 3.495 N/A VAL 333.A N PHE 329.A O no hydrogen 3.045 N/A LYS 334.A N PHE 329.A O no hydrogen 3.305 N/A MET 335.A N LYS 330.A O no hydrogen 3.058 N/A PHE 337.A N VAL 333.A O no hydrogen 2.776 N/A GLU 338.A N LYS 334.A O no hydrogen 2.812 N/A LEU 339.A N MET 335.A O no hydrogen 2.714 N/A VAL 340.A N VAL 336.A O no hydrogen 3.219 N/A VAL 341.A N PHE 337.A O no hydrogen 3.034 N/A GLY 342.A N GLU 338.A O no hydrogen 3.088 N/A SER 343.A N LEU 339.A O no hydrogen 2.880 N/A SER 343.A OG LEU 339.A O no hydrogen 2.896 N/A SER 343.A OG VAL 340.A O no hydrogen 2.673 N/A PHE 344.A N VAL 340.A O no hydrogen 2.970 N/A GLN 345.A NE2 PRO 313.A O no hydrogen 2.930 N/A VAL 348.A N PHE 344.A O no hydrogen 2.923 N/A VAL 349.A N GLN 345.A O no hydrogen 2.883 N/A ALA 350.A N GLY 346.A O no hydrogen 2.906 N/A ILE 351.A N PHE 347.A O no hydrogen 2.934 N/A LEU 352.A N VAL 348.A O no hydrogen 2.890 N/A LEU 352.A N VAL 349.A O no hydrogen 3.234 N/A TYR 353.A N VAL 349.A O no hydrogen 2.909 N/A TYR 353.A OH LEU 310.A O no hydrogen 3.337 N/A CYS 354.A N ALA 350.A O no hydrogen 3.109 N/A PHE 355.A N ALA 350.A O no hydrogen 3.348 N/A LEU 356.A N ILE 351.A O no hydrogen 3.245 N/A ASN 357.A ND2 TYR 353.A O no hydrogen 3.693 N/A GLN 361.A N ASN 357.A O no hydrogen 2.970 N/A ALA 362.A N GLY 358.A O no hydrogen 2.900 N/A GLU 363.A N GLU 359.A O no hydrogen 2.922 N/A LEU 364.A N VAL 360.A O no hydrogen 2.854 N/A ARG 365.A N GLN 361.A O no hydrogen 2.934 N/A LYS 367.A N GLU 363.A O no hydrogen 2.917 N/A TRP 368.A N LEU 364.A O no hydrogen 2.873 N/A ARG 369.A N ARG 365.A O no hydrogen 2.929 N/A ARG 370.A N ARG 366.A O no hydrogen 2.886 N/A TRP 371.A N LYS 367.A O no hydrogen 2.909 N/A HIS 372.A N TRP 368.A O no hydrogen 2.861 N/A