Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cnz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N MET 269.A O no hydrogen 2.958 N/A TYR 5.A OH ASP 60.A O no hydrogen 2.892 N/A CYS 6.A N ARG 46.A O no hydrogen 3.297 N/A ARG 7.A N VAL 271.A O no hydrogen 3.276 N/A ARG 7.A NH1 GLN 54.A OE1 no hydrogen 2.815 N/A ARG 7.A NH1 THR 89.A OG1 no hydrogen 2.976 N/A ARG 7.A NH2 ALA 52.A O no hydrogen 3.460 N/A ARG 7.A NH2 GLN 54.A OE1 no hydrogen 2.591 N/A LEU 8.A N PHE 48.A O no hydrogen 2.842 N/A ARG 9.A N ILE 273.A O no hydrogen 3.433 N/A CYS 12.A SG GLU 15.A OE2 no hydrogen 3.825 N/A GLU 20.A N GLU 15.A O no hydrogen 2.267 N/A ARG 21.A N GLU 20.A OE1 no hydrogen 3.018 N/A ALA 23.A N PRO 275.A O no hydrogen 2.749 N/A ARG 25.A N GLU 33.A O no hydrogen 3.076 N/A PHE 30.A N ASP 28.A OD1 no hydrogen 3.334 N/A THR 31.A N ASP 28.A OD1 no hydrogen 2.675 N/A THR 31.A OG1 ASP 28.A OD1 no hydrogen 2.706 N/A VAL 32.A N HIS 42.A O no hydrogen 3.046 N/A GLU 33.A N ARG 25.A O no hydrogen 2.925 N/A HIS 34.A N LYS 40.A O no hydrogen 3.187 N/A TRP 36.A N LYS 38.A O no hydrogen 3.147 N/A LYS 40.A N HIS 34.A O no hydrogen 2.702 N/A HIS 42.A N VAL 32.A O no hydrogen 3.078 N/A TYR 44.A N PHE 30.A O no hydrogen 3.139 N/A TYR 44.A OH LEU 287.A O no hydrogen 2.849 N/A TYR 44.A OH SER 291.A OG no hydrogen 3.099 N/A ASP 45.A N VAL 4.A O no hydrogen 2.889 N/A ARG 46.A NE VAL 47.A O no hydrogen 3.235 N/A PHE 48.A N CYS 6.A O no hydrogen 2.852 N/A ASN 51.A N ASP 49.A OD1 no hydrogen 2.600 N/A ASN 51.A ND2 ASP 49.A OD2 no hydrogen 3.407 N/A ALA 52.A N ASP 49.A O no hydrogen 3.255 N/A ALA 52.A N ASP 49.A OD1 no hydrogen 2.751 N/A THR 53.A N ASP 56.A OD2 no hydrogen 2.568 N/A THR 53.A OG1 ASP 56.A OD2 no hydrogen 2.850 N/A GLN 54.A NE2 PHE 88.A O no hydrogen 2.703 N/A GLN 54.A NE2 ASN 96.A O no hydrogen 3.593 N/A ASP 56.A N THR 53.A OG1 no hydrogen 3.424 N/A VAL 57.A N THR 53.A O no hydrogen 3.033 N/A PHE 58.A N GLN 54.A O no hydrogen 2.932 N/A GLU 59.A N ASP 55.A O no hydrogen 2.755 N/A GLU 59.A N ASP 56.A O no hydrogen 2.837 N/A ASP 60.A N ASP 56.A O no hydrogen 3.413 N/A THR 61.A N PHE 58.A O no hydrogen 3.363 N/A THR 61.A OG1 VAL 57.A O no hydrogen 2.853 N/A LYS 62.A N PHE 58.A O no hydrogen 2.949 N/A LYS 62.A NZ GLU 106.A OE1 no hydrogen 2.830 N/A LEU 64.A N THR 61.A O no hydrogen 2.968 N/A VAL 65.A N LYS 62.A O no hydrogen 3.118 N/A GLN 66.A NE2 ASP 70.A OD2 no hydrogen 3.469 N/A SER 67.A N TYR 63.A O no hydrogen 3.221 N/A SER 67.A OG TYR 63.A O no hydrogen 3.338 N/A ALA 68.A N LEU 64.A O no hydrogen 2.718 N/A VAL 69.A N VAL 65.A O no hydrogen 3.056 N/A ASP 70.A N GLN 66.A O no hydrogen 2.675 N/A GLY 71.A N ALA 68.A O no hydrogen 3.111 N/A TYR 72.A N SER 67.A O no hydrogen 3.134 N/A ASN 73.A ND2 ASP 259.A OD2 no hydrogen 2.409 N/A VAL 74.A N LYS 215.A O no hydrogen 2.771 N/A CYS 75.A N LYS 266.A O no hydrogen 2.749 N/A CYS 75.A SG SER 260.A OG no hydrogen 2.912 N/A ILE 76.A N SER 217.A O no hydrogen 2.879 N/A PHE 77.A N LEU 268.A O no hydrogen 2.935 N/A ALA 78.A N VAL 219.A O no hydrogen 3.163 N/A TYR 79.A N PHE 270.A O no hydrogen 2.734 N/A THR 82.A N GLU 225.A OE2 no hydrogen 2.423 N/A THR 82.A OG1 GLU 225.A OE1 no hydrogen 2.424 N/A THR 82.A OG1 GLU 225.A OE2 no hydrogen 3.437 N/A SER 84.A N GLN 81.A O no hydrogen 3.016 N/A SER 84.A OG GLN 81.A O no hydrogen 3.200 N/A SER 84.A OG ASN 272.A O no hydrogen 2.801 N/A LYS 86.A NZ GLY 80.A O no hydrogen 2.973 N/A THR 87.A OG1 ASP 220.A OD1 no hydrogen 3.549 N/A THR 87.A OG1 ASP 220.A OD2 no hydrogen 2.614 N/A THR 89.A N GLY 85.A O no hydrogen 2.756 N/A THR 89.A N LYS 86.A O no hydrogen 2.920 N/A THR 89.A OG1 GLY 85.A O no hydrogen 2.744 N/A ILE 90.A N LYS 86.A O no hydrogen 2.835 N/A TYR 91.A N THR 87.A O no hydrogen 2.698 N/A GLY 92.A N THR 87.A O no hydrogen 2.812 N/A GLY 98.A N TYR 91.A O no hydrogen 2.545 N/A LEU 99.A N THR 89.A O no hydrogen 3.010 N/A THR 100.A N ILE 90.A O no hydrogen 3.024 N/A THR 100.A OG1 ILE 90.A O no hydrogen 2.578 N/A ARG 102.A NE PRO 97.A O no hydrogen 2.603 N/A ARG 102.A NH2 PRO 97.A O no hydrogen 3.558 N/A ALA 103.A N LEU 99.A O no hydrogen 2.707 N/A MET 104.A N THR 100.A O no hydrogen 2.720 N/A SER 105.A N PRO 101.A O no hydrogen 3.069 N/A SER 105.A N ARG 102.A O no hydrogen 3.236 N/A SER 105.A OG TYR 171.A OH no hydrogen 2.524 N/A GLU 106.A N ARG 102.A O no hydrogen 2.905 N/A LEU 107.A N ALA 103.A O no hydrogen 2.746 N/A PHE 108.A N MET 104.A O no hydrogen 3.497 N/A ARG 109.A N SER 105.A O no hydrogen 3.087 N/A ILE 110.A N GLU 106.A O no hydrogen 2.954 N/A MET 111.A N LEU 107.A O no hydrogen 3.218 N/A LYS 112.A N PHE 108.A O no hydrogen 2.957 N/A LYS 112.A N ARG 109.A O no hydrogen 3.019 N/A LYS 113.A N ARG 109.A O no hydrogen 2.961 N/A LYS 113.A NZ ASP 114.A OD2 no hydrogen 3.231 N/A ASP 114.A N ILE 110.A O no hydrogen 2.874 N/A SER 115.A N LYS 112.A O no hydrogen 3.345 N/A LYS 117.A N ASP 114.A O no hydrogen 3.383 N/A SER 119.A N THR 204.A O no hydrogen 3.075 N/A SER 119.A OG THR 204.A O no hydrogen 3.435 N/A SER 121.A N GLU 202.A O no hydrogen 2.954 N/A LYS 123.A N ILE 200.A O no hydrogen 3.330 N/A ALA 124.A N VAL 166.A O no hydrogen 3.143 N/A TYR 125.A N SER 198.A O no hydrogen 2.964 N/A VAL 127.A N ILE 196.A O no hydrogen 3.002 N/A GLU 128.A N VAL 135.A O no hydrogen 3.095 N/A LEU 129.A N HIS 194.A O no hydrogen 2.698 N/A TYR 130.A N THR 133.A O no hydrogen 2.771 N/A VAL 135.A N GLU 128.A O no hydrogen 2.891 N/A LEU 137.A N MET 126.A O no hydrogen 2.961 N/A LEU 138.A N ASP 136.A OD2 no hydrogen 2.514 N/A LYS 151.A N SER 159.A O no hydrogen 2.709 N/A LYS 151.A NZ GLU 161.A OE2 no hydrogen 2.788 N/A LYS 152.A N GLU 328.A O no hydrogen 3.480 N/A ASP 153.A N MET 157.A O no hydrogen 3.171 N/A GLY 156.A N ASP 153.A OD2 no hydrogen 2.823 N/A MET 157.A N ASP 153.A OD2 no hydrogen 2.707 N/A VAL 158.A N ASP 259.A OD2 no hydrogen 3.441 N/A SER 159.A N LYS 151.A O no hydrogen 2.354 N/A SER 159.A OG LYS 151.A O no hydrogen 3.152 N/A GLU 161.A N ASP 149.A O no hydrogen 2.697 N/A THR 164.A N ASP 136.A OD1 no hydrogen 2.959 N/A THR 164.A OG1 ASP 136.A OD1 no hydrogen 3.133 N/A VAL 166.A N ALA 124.A O no hydrogen 2.876 N/A ILE 168.A N LEU 122.A O no hydrogen 2.605 N/A SER 169.A N GLU 173.A OE1 no hydrogen 2.781 N/A SER 169.A OG GLU 173.A OE1 no hydrogen 2.476 N/A GLU 173.A N THR 170.A O no hydrogen 3.104 N/A LEU 174.A N THR 170.A O no hydrogen 3.196 N/A LYS 175.A N TYR 171.A O no hydrogen 2.828 N/A THR 176.A N GLU 172.A O no hydrogen 3.173 N/A THR 176.A N GLU 173.A O no hydrogen 3.148 N/A THR 176.A OG1 GLU 172.A O no hydrogen 3.549 N/A THR 176.A OG1 GLU 173.A O no hydrogen 2.843 N/A ILE 177.A N LEU 174.A O no hydrogen 2.776 N/A ILE 178.A N LEU 174.A O no hydrogen 3.130 N/A GLN 179.A N LYS 175.A O no hydrogen 3.246 N/A ARG 180.A N THR 176.A O no hydrogen 2.934 N/A GLY 181.A N ILE 178.A O no hydrogen 2.937 N/A SER 182.A N ILE 178.A O no hydrogen 2.759 N/A GLU 183.A N GLN 179.A O no hydrogen 3.270 N/A GLN 184.A NE2 GLU 128.A OE2 no hydrogen 2.714 N/A ARG 185.A N GLY 181.A O no hydrogen 3.214 N/A ARG 185.A NH2 ASP 220.A OD1 no hydrogen 3.413 N/A HIS 186.A N GLU 183.A O no hydrogen 3.455 N/A SER 190.A OG GLN 184.A O no hydrogen 3.357 N/A ARG 192.A N GLN 189.A O no hydrogen 2.343 N/A HIS 194.A N LEU 129.A O no hydrogen 3.017 N/A ILE 196.A N VAL 127.A O no hydrogen 2.920 N/A VAL 197.A N PHE 218.A O no hydrogen 3.220 N/A SER 198.A N TYR 125.A O no hydrogen 3.065 N/A SER 198.A OG SER 217.A OG no hydrogen 2.588 N/A VAL 199.A N LEU 216.A O no hydrogen 3.034 N/A ILE 200.A N LYS 123.A O no hydrogen 2.593 N/A ILE 201.A N GLY 214.A O no hydrogen 2.961 N/A GLU 202.A N SER 121.A O no hydrogen 2.877 N/A SER 203.A N ALA 212.A O no hydrogen 2.507 N/A ASN 205.A N ALA 210.A O no hydrogen 2.999 N/A GLN 207.A N ASN 205.A OD1 no hydrogen 3.100 N/A THR 208.A N ASN 205.A OD1 no hydrogen 3.046 N/A GLN 209.A N ASN 205.A O no hydrogen 2.562 N/A ALA 212.A N SER 203.A O no hydrogen 3.151 N/A ARG 213.A N ASN 303.A O no hydrogen 3.379 N/A ARG 213.A NH1 ARG 213.A O no hydrogen 3.382 N/A LYS 215.A N TYR 72.A O no hydrogen 2.957 N/A LYS 215.A NZ TYR 125.A OH no hydrogen 3.348 N/A LYS 215.A NZ VAL 158.A O no hydrogen 3.420 N/A LEU 216.A N VAL 199.A O no hydrogen 3.057 N/A SER 217.A N VAL 74.A O no hydrogen 3.174 N/A PHE 218.A N VAL 197.A O no hydrogen 3.025 N/A VAL 219.A N ILE 76.A O no hydrogen 2.976 N/A ASP 220.A N LEU 195.A O no hydrogen 3.408 N/A GLY 223.A N SER 191.A O no hydrogen 3.484 N/A SER 224.A N GLY 80.A O no hydrogen 3.170 N/A SER 228.A OG HIS 194.A NE2 no hydrogen 3.330 N/A SER 230.A N ASN 226.A O no hydrogen 2.949 N/A SER 230.A OG LYS 227.A O no hydrogen 3.155 N/A ALA 231.A N LYS 227.A O no hydrogen 2.887 N/A ALA 231.A N SER 228.A O no hydrogen 2.855 N/A LEU 232.A N SER 228.A O no hydrogen 2.948 N/A GLY 233.A N LEU 229.A O no hydrogen 2.754 N/A ASP 234.A N SER 230.A O no hydrogen 3.441 N/A VAL 235.A N ALA 231.A O no hydrogen 3.281 N/A ILE 236.A N LEU 232.A O no hydrogen 2.965 N/A SER 237.A N GLY 233.A O no hydrogen 2.723 N/A SER 237.A OG GLY 233.A O no hydrogen 3.410 N/A ALA 238.A N ASP 234.A O no hydrogen 2.558 N/A LEU 239.A N VAL 235.A O no hydrogen 2.751 N/A SER 240.A N ILE 236.A O no hydrogen 2.850 N/A SER 241.A N SER 237.A O no hydrogen 2.793 N/A SER 241.A OG SER 237.A O no hydrogen 2.824 N/A GLY 242.A N LEU 239.A O no hydrogen 3.335 N/A TYR 248.A OH LEU 261.A O no hydrogen 2.340 N/A ARG 249.A NE ILE 330.A O no hydrogen 2.860 N/A LYS 252.A NZ ASP 132.A O no hydrogen 3.500 N/A LEU 253.A N HIS 251.A ND1 no hydrogen 3.381 N/A THR 254.A OG1 TYR 248.A O no hydrogen 2.431 N/A THR 254.A OG1 HIS 251.A O no hydrogen 3.132 N/A MET 255.A N LYS 252.A O no hydrogen 2.866 N/A LEU 256.A N LYS 252.A O no hydrogen 2.920 N/A MET 257.A N LEU 253.A O no hydrogen 2.999 N/A SER 258.A N MET 255.A O no hydrogen 3.188 N/A SER 258.A OG THR 254.A O no hydrogen 3.442 N/A SER 258.A OG MET 255.A O no hydrogen 2.488 N/A LEU 261.A N MET 257.A O no hydrogen 3.110 N/A GLY 262.A N ASN 298.A OD1 no hydrogen 2.533 N/A ASN 264.A ND2 LYS 155.A O no hydrogen 2.833 N/A LYS 266.A N ASN 73.A O no hydrogen 2.622 N/A THR 267.A OG1 SER 260.A O no hydrogen 2.832 N/A LEU 268.A N CYS 75.A O no hydrogen 2.765 N/A MET 269.A N ARG 3.A O no hydrogen 3.055 N/A PHE 270.A N PHE 77.A O no hydrogen 2.900 N/A VAL 271.A N TYR 5.A O no hydrogen 3.087 N/A ASN 272.A N TYR 79.A O no hydrogen 2.530 N/A ASN 272.A ND2 SER 84.A O no hydrogen 3.603 N/A ASN 272.A ND2 THR 89.A OG1 no hydrogen 3.281 N/A ILE 273.A N ARG 7.A O no hydrogen 3.156 N/A SER 278.A N GLU 20.A OE2 no hydrogen 2.863 N/A SER 278.A OG GLU 20.A OE2 no hydrogen 2.982 N/A SER 278.A OG ASN 279.A OD1 no hydrogen 3.058 N/A LEU 280.A N GLU 277.A O no hydrogen 2.775 N/A THR 283.A N ASN 279.A O no hydrogen 3.226 N/A THR 283.A OG1 SER 274.A O no hydrogen 2.794 N/A THR 283.A OG1 ASN 279.A O no hydrogen 3.374 N/A HIS 284.A N ASP 281.A O no hydrogen 2.642 N/A ASN 285.A N ASP 281.A O no hydrogen 3.124 N/A ASN 285.A ND2 GLU 282.A OE1 no hydrogen 2.714 N/A SER 286.A N GLU 282.A O no hydrogen 2.864 N/A SER 286.A OG GLU 282.A O no hydrogen 3.107 N/A LEU 287.A N THR 283.A O no hydrogen 3.279 N/A THR 288.A N HIS 284.A O no hydrogen 2.862 N/A THR 288.A N ASN 285.A O no hydrogen 2.950 N/A THR 288.A OG1 HIS 284.A O no hydrogen 2.979 N/A TYR 289.A N ASN 285.A O no hydrogen 2.848 N/A ALA 290.A N SER 286.A O no hydrogen 3.207 N/A SER 291.A N LEU 287.A O no hydrogen 2.867 N/A SER 291.A OG TYR 44.A OH no hydrogen 3.099 N/A SER 291.A OG LEU 287.A O no hydrogen 2.912 N/A ARG 292.A N THR 288.A O no hydrogen 3.015 N/A VAL 293.A N TYR 289.A O no hydrogen 3.267 N/A ARG 294.A N ALA 290.A O no hydrogen 3.203 N/A SER 295.A N ARG 292.A O no hydrogen 2.401 N/A SER 295.A OG ARG 292.A O no hydrogen 2.951 N/A ILE 296.A N VAL 293.A O no hydrogen 2.667 N/A ASN 298.A ND2 ALA 265.A O no hydrogen 3.215 N/A ASP 299.A N GLY 263.A O no hydrogen 3.405 N/A ASN 303.A N GLY 71.A O no hydrogen 2.671 N/A ASN 303.A N ASN 303.A OD1 no hydrogen 2.447 N/A ALA 310.A N SER 306.A O no hydrogen 3.072 N/A LYS 313.A N VAL 309.A O no hydrogen 3.286 N/A LYS 314.A N ALA 310.A O no hydrogen 3.051 N/A LEU 315.A N ARG 311.A O no hydrogen 3.185 N/A VAL 316.A N LEU 312.A O no hydrogen 2.617 N/A SER 317.A N LYS 313.A O no hydrogen 3.023 N/A SER 317.A OG LYS 313.A O no hydrogen 3.095 N/A TRP 319.A N LEU 315.A O no hydrogen 2.837 N/A LYS 320.A N SER 317.A O no hydrogen 2.931 N/A GLU 321.A N TYR 318.A O no hydrogen 2.379 N/A GLN 322.A NE2 TYR 318.A OH no hydrogen 3.565 N/A