Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e00_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A N ASP 10.A O no hydrogen 2.605 N/A CYS 5.A SG HIS 20.A O no hydrogen 3.809 N/A ARG 6.A N HIS 20.A O no hydrogen 2.901 N/A ARG 6.A NH2 VAL 67.A O no hydrogen 2.589 N/A LYS 11.A N ASP 10.A OD2 no hydrogen 3.101 N/A SER 13.A N ALA 21.A O no hydrogen 3.176 N/A SER 13.A OG HIS 16.A NE2 no hydrogen 2.728 N/A SER 13.A OG ALA 21.A O no hydrogen 3.515 N/A SER 13.A OG GLU 23.A OE1 no hydrogen 3.225 N/A HIS 16.A N VAL 19.A O no hydrogen 3.196 N/A HIS 16.A NE2 SER 13.A OG no hydrogen 2.728 N/A ALA 21.A N GLY 14.A O no hydrogen 3.393 N/A LYS 26.A N CYS 22.A O no hydrogen 3.056 N/A LYS 26.A NZ GLU 23.A OE2 no hydrogen 3.217 N/A PHE 28.A N GLY 24.A O no hydrogen 3.094 N/A PHE 29.A N CYS 25.A O no hydrogen 2.776 N/A ARG 30.A N LYS 26.A O no hydrogen 3.123 N/A ARG 31.A N GLY 27.A O no hydrogen 2.973 N/A ARG 31.A N PHE 28.A O no hydrogen 3.206 N/A THR 32.A N PHE 28.A O no hydrogen 2.943 N/A THR 32.A N PHE 29.A O no hydrogen 2.859 N/A THR 32.A OG1 PHE 28.A O no hydrogen 2.534 N/A THR 32.A OG1 PHE 29.A O no hydrogen 3.317 N/A ILE 33.A N PHE 29.A O no hydrogen 3.173 N/A ARG 34.A N ARG 30.A O no hydrogen 3.278 N/A LEU 35.A N ARG 31.A O no hydrogen 3.234 N/A LYS 36.A N ILE 33.A O no hydrogen 2.695 N/A CYS 46.A SG LEU 44.A O no hydrogen 3.015 N/A HIS 49.A N SER 52.A OG no hydrogen 2.977 N/A SER 52.A OG ARG 47.A O no hydrogen 3.423 N/A SER 52.A OG HIS 49.A ND1 no hydrogen 2.822 N/A SER 52.A OG HIS 49.A O no hydrogen 3.248 N/A ARG 53.A N HIS 49.A O no hydrogen 3.090 N/A ARG 53.A NH2 ASP 10.A OD1 no hydrogen 2.840 N/A LYS 55.A N SER 52.A O no hydrogen 2.558 N/A CYS 59.A SG LEU 44.A O no hydrogen 3.595 N/A ARG 60.A N CYS 56.A O no hydrogen 3.169 N/A PHE 61.A N GLN 57.A O no hydrogen 3.281 N/A GLN 62.A N CYS 59.A O no hydrogen 3.297 N/A LYS 63.A N CYS 59.A O no hydrogen 2.929 N/A LYS 63.A NZ ARG 6.A O no hydrogen 3.119 N/A LYS 63.A NZ VAL 7.A O no hydrogen 3.216 N/A CYS 64.A N ARG 60.A O no hydrogen 3.359 N/A CYS 64.A SG ARG 60.A O no hydrogen 3.154 N/A ALA 66.A N GLN 62.A O no hydrogen 2.818 N/A VAL 67.A N CYS 64.A O no hydrogen 2.914 N/A SER 70.A N TYR 17.A O no hydrogen 3.320 N/A ASN 72.A N SER 70.A OG no hydrogen 2.908 N/A ARG 75.A NE ARG 75.A O no hydrogen 2.698 N/A LYS 84.A N GLN 81.A O no hydrogen 3.050 N/A GLU 85.A N ALA 82.A O no hydrogen 2.676 N/A LYS 86.A N GLU 83.A O no hydrogen 2.879 N/A LEU 98.A N ASP 94.A O no hydrogen 2.456 N/A ASP 104.A N GLU 101.A O no hydrogen 2.875 N/A ARG 106.A N SER 102.A O no hydrogen 2.694 N/A ALA 107.A N ALA 103.A O no hydrogen 3.151 N/A LEU 108.A N ASP 104.A O no hydrogen 2.784 N/A ALA 109.A N LEU 105.A O no hydrogen 2.913 N/A LYS 110.A N ARG 106.A O no hydrogen 3.049 N/A LYS 110.A NZ ASP 114.A OD2 no hydrogen 2.775 N/A HIS 111.A N ALA 107.A O no hydrogen 2.817 N/A LEU 112.A N LEU 108.A O no hydrogen 3.013 N/A TYR 113.A N ALA 109.A O no hydrogen 3.147 N/A ASP 114.A N LYS 110.A O no hydrogen 2.642 N/A SER 115.A N HIS 111.A O no hydrogen 2.726 N/A SER 115.A OG SER 188.A OG no hydrogen 2.639 N/A TYR 116.A N LEU 112.A O no hydrogen 2.899 N/A TYR 116.A OH ASP 267.A OD1 no hydrogen 2.554 N/A ILE 117.A N TYR 113.A O no hydrogen 2.901 N/A LYS 118.A N SER 115.A O no hydrogen 3.128 N/A LYS 118.A NZ ASP 114.A O no hydrogen 3.341 N/A SER 119.A N SER 115.A O no hydrogen 2.956 N/A SER 119.A N TYR 116.A O no hydrogen 3.251 N/A SER 119.A OG SER 115.A O no hydrogen 2.885 N/A PHE 120.A N TYR 116.A O no hydrogen 3.184 N/A LYS 124.A N ASP 267.A OD1 no hydrogen 3.027 N/A LYS 124.A NZ ASN 261.A OD1 no hydrogen 3.386 N/A ALA 125.A N ASP 267.A OD2 no hydrogen 2.865 N/A LYS 126.A NZ PRO 121.A O no hydrogen 3.549 N/A ALA 127.A N THR 123.A O no hydrogen 3.211 N/A ARG 128.A N LYS 124.A O no hydrogen 3.023 N/A ARG 128.A N ALA 125.A O no hydrogen 3.167 N/A ALA 129.A N ALA 125.A O no hydrogen 3.261 N/A ALA 129.A N LYS 126.A O no hydrogen 2.570 N/A ILE 130.A N LYS 126.A O no hydrogen 3.060 N/A LEU 131.A N ALA 127.A O no hydrogen 2.927 N/A THR 132.A N ALA 129.A O no hydrogen 3.278 N/A THR 132.A OG1 ARG 128.A O no hydrogen 2.567 N/A GLY 133.A N ILE 130.A O no hydrogen 2.958 N/A THR 135.A OG1 ASP 137.A OD2 no hydrogen 3.119 N/A PHE 141.A N GLN 231.A O no hydrogen 3.021 N/A ILE 143.A N PHE 233.A O no hydrogen 3.209 N/A ASP 145.A N SER 148.A OG no hydrogen 2.881 N/A SER 148.A N ASP 145.A OD2 no hydrogen 3.103 N/A SER 148.A OG ASP 145.A O no hydrogen 2.795 N/A SER 148.A OG ASP 145.A OD2 no hydrogen 2.762 N/A LEU 149.A N ASP 145.A O no hydrogen 2.949 N/A MET 150.A N MET 146.A O no hydrogen 2.735 N/A GLY 152.A N SER 148.A O no hydrogen 2.935 N/A GLU 153.A N LEU 149.A O no hydrogen 2.646 N/A ASP 154.A N MET 151.A O no hydrogen 3.129 N/A LYS 155.A N MET 151.A O no hydrogen 3.214 N/A LYS 161.A NZ ASP 348.A OD2 no hydrogen 3.364 N/A ARG 166.A N GLU 162.A O no hydrogen 2.452 N/A ILE 167.A N VAL 163.A O no hydrogen 2.844 N/A GLN 169.A N ILE 165.A O no hydrogen 2.898 N/A GLN 169.A NE2 MET 349.A O no hydrogen 2.919 N/A GLY 170.A N ARG 166.A O no hydrogen 2.773 N/A CYS 171.A N PHE 168.A O no hydrogen 3.361 N/A CYS 171.A SG ILE 167.A O no hydrogen 3.678 N/A GLN 172.A N GLN 169.A O no hydrogen 3.128 N/A ARG 174.A N CYS 171.A O no hydrogen 2.615 N/A SER 175.A N CYS 171.A O no hydrogen 3.231 N/A VAL 176.A N GLN 172.A O no hydrogen 3.102 N/A GLU 177.A N PHE 173.A O no hydrogen 2.927 N/A ALA 178.A N ARG 174.A O no hydrogen 2.575 N/A VAL 179.A N SER 175.A O no hydrogen 2.720 N/A GLN 180.A N VAL 176.A O no hydrogen 2.815 N/A GLU 181.A N GLU 177.A O no hydrogen 2.839 N/A ILE 182.A N ALA 178.A O no hydrogen 2.934 N/A THR 183.A N VAL 179.A O no hydrogen 3.147 N/A THR 183.A OG1 VAL 179.A O no hydrogen 2.892 N/A GLU 184.A N GLN 180.A O no hydrogen 3.203 N/A TYR 185.A N GLU 181.A O no hydrogen 2.867 N/A TYR 185.A OH LEU 112.A O no hydrogen 3.373 N/A TYR 185.A OH ALA 271.A O no hydrogen 2.367 N/A ALA 186.A N ILE 182.A O no hydrogen 2.689 N/A LYS 187.A N THR 183.A O no hydrogen 3.311 N/A LYS 187.A NZ GLU 184.A OE2 no hydrogen 2.723 N/A SER 188.A N TYR 185.A O no hydrogen 2.762 N/A SER 188.A OG SER 115.A OG no hydrogen 2.639 N/A SER 188.A OG TYR 185.A O no hydrogen 2.299 N/A ILE 189.A N ALA 186.A O no hydrogen 2.983 N/A PHE 192.A N ILE 189.A O no hydrogen 3.008 N/A ASP 199.A N ASP 196.A O no hydrogen 2.924 N/A GLN 200.A N ASP 196.A O no hydrogen 2.989 N/A GLN 200.A NE2 VAL 193.A O no hydrogen 2.817 N/A GLN 200.A NE2 LEU 195.A O no hydrogen 3.027 N/A VAL 201.A N LEU 197.A O no hydrogen 3.286 N/A THR 202.A N ASN 198.A O no hydrogen 3.395 N/A THR 202.A OG1 ASN 198.A O no hydrogen 2.804 N/A LEU 203.A N ASP 199.A O no hydrogen 2.627 N/A LEU 204.A N GLN 200.A O no hydrogen 3.267 N/A LEU 204.A N VAL 201.A O no hydrogen 3.014 N/A LYS 205.A N VAL 201.A O no hydrogen 2.718 N/A TYR 206.A N THR 202.A O no hydrogen 3.171 N/A TYR 206.A OH LEU 362.A O no hydrogen 3.090 N/A GLY 207.A N LEU 204.A O no hydrogen 2.519 N/A VAL 208.A N LEU 204.A O no hydrogen 3.194 N/A ILE 211.A N GLY 207.A O no hydrogen 3.041 N/A ILE 212.A N VAL 208.A O no hydrogen 2.628 N/A TYR 213.A N HIS 209.A O no hydrogen 3.280 N/A THR 214.A N GLU 210.A O no hydrogen 3.314 N/A THR 214.A OG1 GLU 210.A O no hydrogen 3.103 N/A MET 215.A N ILE 211.A O no hydrogen 3.142 N/A LEU 216.A N ILE 212.A O no hydrogen 2.696 N/A SER 218.A N MET 215.A O no hydrogen 2.816 N/A MET 220.A N ALA 217.A O no hydrogen 2.978 N/A ASN 221.A N GLY 224.A O no hydrogen 3.296 N/A ASP 223.A N ASN 221.A OD1 no hydrogen 2.435 N/A GLY 224.A N ASN 221.A OD1 no hydrogen 3.205 N/A VAL 225.A N MET 234.A O no hydrogen 2.785 N/A LEU 226.A N LEU 219.A O no hydrogen 3.141 N/A ILE 227.A N GLY 232.A O no hydrogen 3.066 N/A GLY 230.A N ILE 227.A O no hydrogen 2.677 N/A GLN 231.A N ILE 227.A O no hydrogen 3.105 N/A GLY 232.A N ILE 227.A O no hydrogen 3.211 N/A PHE 233.A N PHE 141.A O no hydrogen 3.435 N/A THR 235.A N ILE 143.A O no hydrogen 3.242 N/A ARG 236.A N ASP 223.A O no hydrogen 2.698 N/A ARG 236.A NE GLU 251.A OE1 no hydrogen 3.140 N/A ARG 236.A NE GLU 251.A OE2 no hydrogen 3.493 N/A ARG 236.A NH2 GLU 251.A OE2 no hydrogen 3.042 N/A PHE 238.A N THR 235.A OG1 no hydrogen 3.056 N/A LEU 239.A N THR 235.A O no hydrogen 3.264 N/A LYS 240.A N ARG 236.A O no hydrogen 2.953 N/A LYS 240.A NZ GLU 237.A OE2 no hydrogen 3.230 N/A SER 241.A N PHE 238.A O no hydrogen 2.638 N/A SER 241.A OG PHE 238.A O no hydrogen 2.380 N/A LEU 242.A N LEU 239.A O no hydrogen 2.904 N/A ARG 243.A NE GLU 162.A OE1 no hydrogen 2.551 N/A ARG 243.A NH2 GLU 346.A OE2 no hydrogen 3.027 N/A PHE 246.A N ARG 243.A O no hydrogen 2.690 N/A LYS 253.A NZ PHE 249.A O no hydrogen 2.992 N/A LYS 253.A NZ HIS 335.A ND1 no hydrogen 2.764 N/A PHE 254.A N MET 250.A O no hydrogen 3.262 N/A PHE 254.A N GLU 251.A O no hydrogen 2.712 N/A GLU 255.A N GLU 251.A O no hydrogen 3.127 N/A PHE 256.A N PRO 252.A O no hydrogen 3.268 N/A ALA 257.A N LYS 253.A O no hydrogen 2.785 N/A VAL 258.A N PHE 254.A O no hydrogen 2.797 N/A LYS 259.A N GLU 255.A O no hydrogen 3.292 N/A PHE 260.A N PHE 256.A O no hydrogen 2.741 N/A ASN 261.A N ALA 257.A O no hydrogen 2.852 N/A ASN 261.A ND2 ALA 217.A O no hydrogen 3.386 N/A ALA 262.A N LYS 259.A O no hydrogen 2.868 N/A GLU 264.A N ASN 261.A O no hydrogen 3.057 N/A ASP 269.A N ASP 266.A OD2 no hydrogen 2.808 N/A LEU 270.A N ASP 266.A O no hydrogen 2.738 N/A ALA 271.A N ASP 267.A O no hydrogen 2.713 N/A ILE 272.A N ASP 269.A O no hydrogen 3.349 N/A PHE 273.A N ASP 269.A O no hydrogen 3.252 N/A ILE 274.A N LEU 270.A O no hydrogen 3.187 N/A VAL 276.A N ILE 272.A O no hydrogen 3.031 N/A VAL 276.A N PHE 273.A O no hydrogen 2.973 N/A ILE 277.A N PHE 273.A O no hydrogen 3.320 N/A ILE 277.A N ILE 274.A O no hydrogen 2.840 N/A ILE 278.A N ILE 274.A O no hydrogen 3.331 N/A LEU 279.A N ALA 275.A O no hydrogen 3.322 N/A SER 280.A OG VAL 276.A O no hydrogen 3.441 N/A SER 280.A OG ILE 277.A O no hydrogen 3.015 N/A ARG 283.A NH1 GLU 210.A OE2 no hydrogen 2.933 N/A ARG 283.A NH2 GLU 210.A OE1 no hydrogen 3.007 N/A ARG 283.A NH2 ILE 277.A O no hydrogen 3.186 N/A LEU 287.A N ASP 199.A OD2 no hydrogen 3.434 N/A ASN 288.A N ASP 199.A OD2 no hydrogen 2.987 N/A GLU 293.A N VAL 289.A O no hydrogen 2.905 N/A ASP 294.A N LYS 290.A O no hydrogen 2.743 N/A ASP 294.A N PRO 291.A O no hydrogen 2.749 N/A ILE 295.A N PRO 291.A O no hydrogen 3.310 N/A GLN 296.A N ILE 292.A O no hydrogen 3.428 N/A ASP 297.A N GLU 293.A O no hydrogen 3.006 N/A ASN 298.A N ASP 294.A O no hydrogen 3.097 N/A LEU 299.A N ILE 295.A O no hydrogen 2.564 N/A LEU 300.A N GLN 296.A O no hydrogen 2.671 N/A GLN 301.A N ASP 297.A O no hydrogen 3.090 N/A ALA 302.A N ASN 298.A O no hydrogen 2.938 N/A LEU 303.A N LEU 299.A O no hydrogen 2.755 N/A GLU 304.A N LEU 300.A O no hydrogen 2.894 N/A LEU 305.A N GLN 301.A O no hydrogen 3.418 N/A GLN 306.A N ALA 302.A O no hydrogen 3.033 N/A LEU 307.A N LEU 303.A O no hydrogen 3.005 N/A LYS 308.A N GLU 304.A O no hydrogen 3.155 N/A LEU 309.A N LEU 305.A O no hydrogen 3.043 N/A ASN 310.A N GLN 306.A O no hydrogen 2.858 N/A ASN 310.A ND2 ASP 266.A OD1 no hydrogen 2.924 N/A ASN 310.A ND2 GLN 306.A OE1 no hydrogen 3.219 N/A HIS 311.A N LEU 307.A O no hydrogen 2.840 N/A HIS 311.A NE2 ASP 269.A OD2 no hydrogen 2.486 N/A SER 314.A OG HIS 311.A O no hydrogen 2.966 N/A LEU 317.A N SER 314.A O no hydrogen 3.359 N/A LYS 320.A N GLN 316.A O no hydrogen 2.626 N/A LEU 321.A N LEU 317.A O no hydrogen 2.595 N/A LEU 322.A N PHE 318.A O no hydrogen 3.078 N/A GLN 323.A N ALA 319.A O no hydrogen 3.192 N/A LYS 324.A N LEU 321.A O no hydrogen 3.144 N/A MET 325.A N LEU 322.A O no hydrogen 2.759 N/A THR 326.A N GLN 323.A O no hydrogen 3.048 N/A ASP 327.A N LYS 324.A O no hydrogen 2.888 N/A LEU 328.A N LYS 324.A O no hydrogen 3.004 N/A ARG 329.A N MET 325.A O no hydrogen 3.396 N/A ARG 329.A NH1 ASP 282.A OD2 no hydrogen 3.279 N/A ARG 329.A NH2 ASP 282.A OD2 no hydrogen 2.740 N/A GLN 330.A N THR 326.A O no hydrogen 3.367 N/A ILE 331.A N ASP 327.A O no hydrogen 2.931 N/A VAL 332.A N LEU 328.A O no hydrogen 3.034 N/A THR 333.A N ARG 329.A O no hydrogen 2.993 N/A THR 333.A OG1 GLN 330.A O no hydrogen 3.100 N/A GLU 334.A N GLN 330.A O no hydrogen 2.748 N/A HIS 335.A N ILE 331.A O no hydrogen 2.675 N/A VAL 336.A N VAL 332.A O no hydrogen 2.860 N/A VAL 336.A N THR 333.A O no hydrogen 3.187 N/A GLN 337.A N THR 333.A O no hydrogen 3.044 N/A LEU 338.A N GLU 334.A O no hydrogen 3.311 N/A LEU 339.A N HIS 335.A O no hydrogen 3.183 N/A VAL 341.A N GLN 337.A O no hydrogen 3.374 N/A ILE 342.A N LEU 338.A O no hydrogen 3.006 N/A LYS 343.A N LEU 339.A O no hydrogen 3.473 N/A LYS 344.A N GLN 340.A O no hydrogen 3.106 N/A LYS 344.A N VAL 341.A O no hydrogen 2.839 N/A THR 345.A N VAL 341.A O no hydrogen 2.865 N/A THR 345.A OG1 VAL 341.A O no hydrogen 3.244 N/A GLU 346.A N ILE 342.A O no hydrogen 2.649 N/A THR 347.A OG1 ASP 348.A OD1 no hydrogen 2.956 N/A SER 350.A OG ASP 348.A O no hydrogen 2.697 N/A HIS 352.A N GLN 172.A OE1 no hydrogen 2.870 N/A LEU 354.A N HIS 352.A ND1 no hydrogen 2.560 N/A GLN 356.A N HIS 352.A O no hydrogen 2.981 N/A GLU 357.A N PRO 353.A O no hydrogen 3.350 N/A ILE 358.A N LEU 354.A O no hydrogen 3.114 N/A TYR 359.A N LEU 355.A O no hydrogen 3.088 N/A LYS 360.A N GLN 356.A O no hydrogen 3.226 N/A LYS 360.A N GLU 357.A O no hydrogen 3.238 N/A LYS 360.A NZ GLU 357.A OE2 no hydrogen 3.305 N/A LEU 362.A N TYR 359.A O no hydrogen 3.381 N/A