Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mz3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N VAL 113.A O no hydrogen 2.805 N/A TYR 5.A N ARG 42.A O no hydrogen 3.072 N/A TYR 5.A OH HIS 29.A ND1 no hydrogen 2.904 N/A ILE 6.A N ILE 115.A O no hydrogen 3.006 N/A TYR 7.A N TYR 5.A O no hydrogen 2.939 N/A SER 8.A OG GLU 10.A OE1 no hydrogen 2.572 N/A TYR 11.A N SER 8.A OG no hydrogen 3.181 N/A TYR 11.A OH ASN 116.A OD1 no hydrogen 2.706 N/A VAL 12.A N SER 8.A O no hydrogen 3.020 N/A SER 13.A N PRO 9.A O no hydrogen 3.193 N/A MET 14.A N TYR 11.A O no hydrogen 2.626 N/A CYS 15.A N TYR 11.A O no hydrogen 2.867 N/A CYS 15.A SG TYR 11.A O no hydrogen 3.514 N/A CYS 15.A SG SER 118.A OG no hydrogen 3.386 N/A ASP 16.A N VAL 12.A O no hydrogen 2.985 N/A SER 17.A N MET 14.A O no hydrogen 3.375 N/A SER 17.A OG MET 14.A O no hydrogen 2.563 N/A LEU 18.A N CYS 15.A O no hydrogen 2.648 N/A ILE 21.A N LEU 18.A O no hydrogen 3.268 N/A ARG 24.A N ILE 21.A O no hydrogen 3.103 N/A ARG 24.A NH1 GLY 285.A O no hydrogen 3.190 N/A ARG 24.A NH2 GLY 283.A O no hydrogen 2.518 N/A SER 26.A N ASP 16.A OD2 no hydrogen 3.163 N/A SER 26.A OG ASP 16.A OD1 no hydrogen 2.245 N/A SER 26.A OG ASP 16.A OD2 no hydrogen 2.905 N/A MET 27.A N LYS 23.A O no hydrogen 3.143 N/A VAL 28.A N ARG 24.A O no hydrogen 3.003 N/A HIS 29.A N ALA 25.A O no hydrogen 2.910 N/A HIS 29.A ND1 TYR 5.A OH no hydrogen 2.904 N/A SER 30.A N SER 26.A O no hydrogen 2.753 N/A SER 30.A OG SER 26.A O no hydrogen 2.829 N/A SER 30.A OG MET 27.A O no hydrogen 3.053 N/A LEU 31.A N MET 27.A O no hydrogen 3.187 N/A ILE 32.A N VAL 28.A O no hydrogen 3.012 N/A GLU 33.A N HIS 29.A O no hydrogen 2.725 N/A ALA 34.A N SER 30.A O no hydrogen 2.680 N/A TYR 35.A OH SER 308.A O no hydrogen 2.847 N/A ALA 36.A N GLU 33.A O no hydrogen 2.611 N/A LEU 37.A N ILE 32.A O no hydrogen 3.173 N/A HIS 38.A N HIS 38.A ND1 no hydrogen 2.690 N/A LYS 39.A N ALA 36.A O no hydrogen 3.256 N/A GLN 40.A N LEU 37.A O no hydrogen 3.272 N/A MET 41.A N HIS 38.A O no hydrogen 3.280 N/A ARG 42.A N PRO 3.A O no hydrogen 2.743 N/A VAL 44.A N TYR 5.A O no hydrogen 2.837 N/A LYS 47.A N THR 101.A OG1 no hydrogen 2.958 N/A LYS 47.A NZ GLU 53.A OE1 no hydrogen 3.537 N/A LYS 47.A NZ GLU 53.A OE2 no hydrogen 2.938 N/A ALA 49.A N ALA 93.A O no hydrogen 3.040 N/A SER 50.A N GLU 53.A OE1 no hydrogen 3.003 N/A GLU 53.A N SER 50.A O no hydrogen 2.881 N/A GLU 53.A N SER 50.A OG no hydrogen 2.913 N/A MET 54.A N SER 50.A O no hydrogen 3.078 N/A ALA 55.A N MET 51.A O no hydrogen 3.209 N/A THR 56.A N GLU 53.A O no hydrogen 3.176 N/A THR 56.A OG1 GLU 52.A O no hydrogen 3.416 N/A THR 56.A OG1 GLU 53.A O no hydrogen 2.702 N/A PHE 57.A N MET 54.A O no hydrogen 2.920 N/A HIS 58.A N MET 54.A O no hydrogen 2.934 N/A THR 59.A N LYS 126.A O no hydrogen 2.878 N/A TYR 62.A N THR 59.A O no hydrogen 3.201 N/A TYR 62.A N THR 59.A OG1 no hydrogen 2.983 N/A TYR 62.A OH TYR 134.A O no hydrogen 2.796 N/A LEU 63.A N THR 59.A O no hydrogen 2.837 N/A GLN 64.A N ASP 60.A O no hydrogen 2.808 N/A LEU 66.A N TYR 62.A O no hydrogen 2.981 N/A GLN 67.A N LEU 63.A O no hydrogen 3.207 N/A LYS 68.A N GLN 64.A O no hydrogen 2.996 N/A SER 70.A N GLN 67.A O no hydrogen 3.253 N/A SER 70.A OG GLN 67.A O no hydrogen 3.310 N/A GLN 71.A NE2 GLN 67.A O no hydrogen 3.152 N/A SER 73.A OG LEU 78.A O no hydrogen 3.451 N/A TYR 76.A N SER 73.A O no hydrogen 2.899 N/A CYS 82.A SG CYS 133.A O no hydrogen 3.884 N/A ILE 88.A N THR 85.A O no hydrogen 3.017 N/A TYR 91.A N GLY 87.A O no hydrogen 3.018 N/A ALA 92.A N ILE 88.A O no hydrogen 2.793 N/A ALA 93.A N PHE 89.A O no hydrogen 3.115 N/A ILE 95.A N TYR 91.A O no hydrogen 3.159 N/A GLY 96.A N ALA 92.A O no hydrogen 2.824 N/A GLY 97.A N ALA 93.A O no hydrogen 2.744 N/A ALA 98.A N ALA 94.A O no hydrogen 2.956 N/A THR 99.A N ILE 95.A O no hydrogen 3.132 N/A THR 99.A N GLY 96.A O no hydrogen 2.788 N/A THR 99.A OG1 ILE 95.A O no hydrogen 3.248 N/A THR 99.A OG1 ASP 137.A OD2 no hydrogen 2.835 N/A ILE 100.A N GLY 96.A O no hydrogen 3.067 N/A THR 101.A N GLY 97.A O no hydrogen 2.858 N/A THR 101.A OG1 GLY 97.A O no hydrogen 2.660 N/A ALA 102.A N ALA 98.A O no hydrogen 3.429 N/A ALA 103.A N THR 99.A O no hydrogen 2.895 N/A GLN 104.A N ILE 100.A O no hydrogen 3.024 N/A GLN 104.A NE2 ASP 108.A OD1 no hydrogen 3.139 N/A CYS 105.A N THR 101.A O no hydrogen 3.284 N/A CYS 105.A SG THR 101.A O no hydrogen 3.062 N/A LEU 106.A N ALA 103.A O no hydrogen 3.026 N/A ILE 107.A N ALA 103.A O no hydrogen 3.222 N/A CYS 111.A SG CYS 105.A O no hydrogen 2.936 N/A CYS 111.A SG VAL 113.A O no hydrogen 3.486 N/A LYS 112.A NZ GLN 275.A O no hydrogen 3.100 N/A ALA 114.A N THR 278.A O no hydrogen 2.982 N/A ILE 115.A N VAL 4.A O no hydrogen 2.859 N/A ASN 116.A N ILE 280.A O no hydrogen 2.875 N/A TRP 117.A NE1 THR 299.A OG1 no hydrogen 3.245 N/A GLY 119.A N ASN 116.A O no hydrogen 3.144 N/A GLY 120.A N ASP 137.A OD1 no hydrogen 3.147 N/A HIS 122.A ND1 ASP 156.A OD2 no hydrogen 2.607 N/A HIS 122.A NE2 HIS 123.A NE2 no hydrogen 2.970 N/A HIS 123.A ND1 ASP 163.A OD2 no hydrogen 2.815 N/A LYS 125.A N GLU 128.A O no hydrogen 2.874 N/A LYS 125.A NZ ASP 163.A OD1 no hydrogen 3.419 N/A GLU 128.A N LYS 125.A O no hydrogen 3.170 N/A ALA 129.A N TYR 76.A O no hydrogen 2.683 N/A SER 130.A N CYS 133.A O no hydrogen 2.972 N/A GLY 131.A N ASP 81.A OD2 no hydrogen 2.444 N/A CYS 133.A N SER 130.A O no hydrogen 2.817 N/A CYS 133.A SG GLY 131.A O no hydrogen 3.593 N/A TYR 134.A OH PRO 83.A O no hydrogen 2.900 N/A ASN 136.A N HIS 58.A NE2 no hydrogen 3.038 N/A ASN 136.A ND2 HIS 122.A O no hydrogen 3.280 N/A ASN 136.A ND2 ALA 124.A O no hydrogen 2.594 N/A VAL 139.A N ASN 136.A OD1 no hydrogen 3.120 N/A LEU 140.A N ASN 136.A O no hydrogen 3.058 N/A GLY 141.A N ASP 137.A O no hydrogen 2.986 N/A ILE 142.A N ALA 138.A O no hydrogen 2.828 N/A LEU 143.A N VAL 139.A O no hydrogen 2.783 N/A ARG 144.A N GLY 141.A O no hydrogen 2.959 N/A ARG 144.A NH1 GLU 53.A OE2 no hydrogen 2.699 N/A ARG 144.A NH2 GLN 104.A OE1 no hydrogen 2.669 N/A LEU 145.A N GLY 141.A O no hydrogen 3.064 N/A LEU 145.A N ILE 142.A O no hydrogen 3.122 N/A ARG 146.A N ILE 142.A O no hydrogen 3.010 N/A ARG 147.A N ARG 144.A O no hydrogen 3.453 N/A LYS 148.A N LEU 145.A O no hydrogen 3.047 N/A PHE 149.A N LEU 145.A O no hydrogen 2.807 N/A ARG 151.A NE PHE 235.A O no hydrogen 2.957 N/A ARG 151.A NE ASN 236.A O no hydrogen 3.052 N/A ARG 151.A NH1 ASN 236.A O no hydrogen 2.881 N/A ILE 152.A N LYS 174.A O no hydrogen 3.092 N/A LEU 153.A N ALA 239.A O no hydrogen 3.067 N/A TYR 154.A N MET 176.A O no hydrogen 3.050 N/A TYR 154.A OH ASP 156.A OD2 no hydrogen 2.657 N/A VAL 155.A N VAL 241.A O no hydrogen 2.776 N/A ASP 156.A N VAL 178.A O no hydrogen 2.827 N/A LEU 157.A N GLN 243.A O no hydrogen 2.813 N/A ASP 158.A N ASP 156.A OD1 no hydrogen 3.048 N/A LEU 159.A N ASP 247.A OD1 no hydrogen 3.094 N/A HIS 160.A N ASP 158.A OD2 no hydrogen 3.023 N/A HIS 161.A ND1 THR 191.A OG1 no hydrogen 2.699 N/A HIS 161.A NE2 GLU 166.A OE1 no hydrogen 3.199 N/A GLY 162.A N SER 179.A OG no hydrogen 3.298 N/A ASP 163.A N HIS 161.A O no hydrogen 2.685 N/A VAL 165.A N HIS 122.A O no hydrogen 3.239 N/A GLU 166.A N GLY 162.A O no hydrogen 3.137 N/A ASP 167.A N ASP 163.A O no hydrogen 2.814 N/A ALA 168.A N GLY 164.A O no hydrogen 3.190 N/A PHE 169.A N GLU 166.A O no hydrogen 3.064 N/A SER 170.A N ASP 167.A O no hydrogen 3.243 N/A SER 170.A OG ASP 167.A O no hydrogen 3.466 N/A THR 172.A N PHE 169.A O no hydrogen 3.074 N/A LYS 174.A N THR 172.A OG1 no hydrogen 3.004 N/A MET 176.A N ILE 152.A O no hydrogen 3.138 N/A THR 177.A N TYR 205.A O no hydrogen 3.341 N/A VAL 178.A N TYR 154.A O no hydrogen 2.790 N/A SER 179.A N VAL 207.A O no hydrogen 3.282 N/A SER 179.A OG HIS 181.A ND1 no hydrogen 2.823 N/A LEU 180.A N ASP 156.A O no hydrogen 3.062 N/A HIS 181.A ND1 SER 179.A OG no hydrogen 2.823 N/A HIS 181.A NE2 GLY 192.A O no hydrogen 2.548 N/A LYS 182.A N LEU 159.A O no hydrogen 3.055 N/A LYS 182.A NZ ASP 213.A OD1 no hydrogen 2.934 N/A LYS 182.A NZ SER 256.A OG no hydrogen 3.393 N/A PHE 183.A N ILE 211.A O no hydrogen 2.978 N/A SER 184.A OG PRO 185.A O no hydrogen 3.562 N/A THR 191.A OG1 HIS 161.A ND1 no hydrogen 2.699 N/A VAL 194.A N ASP 193.A OD2 no hydrogen 2.621 N/A LEU 199.A N SER 170.A O no hydrogen 3.124 N/A ARG 203.A N GLY 200.A O no hydrogen 2.936 N/A TYR 204.A N VAL 197.A O no hydrogen 2.692 N/A TYR 205.A N GLY 202.A O no hydrogen 3.259 N/A VAL 207.A N THR 177.A O no hydrogen 2.770 N/A ASN 208.A ND2 GLU 166.A OE1 no hydrogen 3.234 N/A ASN 208.A ND2 ASP 196.A O no hydrogen 2.938 N/A VAL 209.A N SER 179.A O no hydrogen 2.944 N/A ILE 211.A N HIS 181.A O no hydrogen 3.286 N/A GLN 212.A N ASN 337.A OD1 no hydrogen 3.043 N/A GLN 212.A NE2 PHE 183.A O no hydrogen 2.903 N/A GLY 214.A N SER 256.A O no hydrogen 3.135 N/A LYS 219.A NZ ASP 335.A OD1 no hydrogen 3.437 N/A TYR 220.A N GLN 216.A O no hydrogen 3.151 N/A TYR 221.A N ASP 217.A O no hydrogen 3.268 N/A GLN 222.A N GLU 218.A O no hydrogen 3.307 N/A ILE 223.A N LYS 219.A O no hydrogen 3.138 N/A CYS 224.A N TYR 220.A O no hydrogen 2.878 N/A GLU 225.A N TYR 221.A O no hydrogen 3.053 N/A SER 226.A N GLN 222.A O no hydrogen 2.837 N/A SER 226.A OG GLN 222.A O no hydrogen 2.875 N/A SER 226.A OG ILE 223.A O no hydrogen 3.054 N/A VAL 227.A N ILE 223.A O no hydrogen 3.009 N/A LEU 228.A N CYS 224.A O no hydrogen 2.865 N/A LYS 229.A N GLU 225.A O no hydrogen 2.548 N/A GLU 230.A N SER 226.A O no hydrogen 3.190 N/A VAL 231.A N VAL 227.A O no hydrogen 3.307 N/A TYR 232.A N LEU 228.A O no hydrogen 2.765 N/A TYR 232.A N LYS 229.A O no hydrogen 3.106 N/A GLN 233.A N GLU 230.A O no hydrogen 3.116 N/A ALA 234.A N GLU 230.A O no hydrogen 2.977 N/A PHE 235.A N VAL 231.A O no hydrogen 3.121 N/A LYS 238.A N ARG 151.A O no hydrogen 2.750 N/A ALA 239.A N ARG 151.A O no hydrogen 3.341 N/A VAL 240.A N ALA 277.A O no hydrogen 2.769 N/A VAL 241.A N LEU 153.A O no hydrogen 2.824 N/A LEU 242.A N LEU 279.A O no hydrogen 3.019 N/A GLN 243.A N VAL 155.A O no hydrogen 2.822 N/A GLN 243.A NE2 GLY 120.A O no hydrogen 3.386 N/A LEU 244.A N LEU 281.A O no hydrogen 2.798 N/A GLY 245.A N GLN 243.A OE1 no hydrogen 2.733 N/A ALA 246.A N GLY 284.A O no hydrogen 3.009 N/A ASP 247.A N ASP 247.A OD1 no hydrogen 2.467 N/A ILE 249.A N ALA 246.A O no hydrogen 3.464 N/A ALA 250.A N MET 259.A O no hydrogen 2.756 N/A ASP 252.A N ILE 249.A O no hydrogen 2.937 N/A MET 254.A N ASP 252.A OD2 no hydrogen 2.576 N/A CYS 255.A N ASP 252.A O no hydrogen 3.246 N/A SER 256.A OG ASP 213.A OD1 no hydrogen 2.938 N/A ASN 258.A N ILE 215.A O no hydrogen 3.141 N/A ASN 258.A ND2 SER 331.A O no hydrogen 2.992 N/A MET 259.A N THR 248.A O no hydrogen 3.078 N/A THR 260.A N ASP 217.A OD1 no hydrogen 3.108 N/A THR 260.A OG1 ASP 217.A OD2 no hydrogen 2.659 N/A VAL 262.A N THR 260.A OG1 no hydrogen 3.165 N/A GLY 265.A N PRO 261.A O no hydrogen 2.958 N/A LYS 266.A N VAL 262.A O no hydrogen 2.893 N/A CYS 267.A N GLY 263.A O no hydrogen 3.371 N/A CYS 267.A SG GLY 263.A O no hydrogen 3.526 N/A LEU 268.A N ILE 264.A O no hydrogen 3.071 N/A LYS 269.A N GLY 265.A O no hydrogen 2.738 N/A TYR 270.A N LYS 266.A O no hydrogen 2.787 N/A ILE 271.A N CYS 267.A O no hydrogen 2.889 N/A LEU 272.A N LEU 268.A O no hydrogen 2.857 N/A GLN 273.A N LYS 269.A O no hydrogen 2.947 N/A TRP 274.A N ILE 271.A O no hydrogen 3.298 N/A GLN 275.A N LEU 272.A O no hydrogen 2.972 N/A THR 278.A N LYS 112.A O no hydrogen 2.887 N/A THR 278.A OG1 LEU 276.A O no hydrogen 2.962 N/A LEU 279.A N VAL 240.A O no hydrogen 2.719 N/A ILE 280.A N ALA 114.A O no hydrogen 2.795 N/A LEU 281.A N LEU 242.A O no hydrogen 2.944 N/A TYR 286.A N ASP 252.A OD1 no hydrogen 2.723 N/A ASN 287.A ND2 GLY 251.A O no hydrogen 3.073 N/A ASN 290.A N ASN 287.A OD1 no hydrogen 3.160 N/A THR 291.A N ASN 287.A O no hydrogen 2.609 N/A THR 291.A OG1 ASN 287.A O no hydrogen 3.275 N/A ALA 292.A N LEU 288.A O no hydrogen 3.107 N/A ARG 293.A N ALA 289.A O no hydrogen 3.124 N/A ARG 293.A NE VAL 325.A O no hydrogen 2.940 N/A CYS 294.A N ASN 290.A O no hydrogen 2.928 N/A TRP 295.A N THR 291.A O no hydrogen 3.050 N/A TRP 295.A NE1 LEU 244.A O no hydrogen 2.820 N/A THR 296.A N ALA 292.A O no hydrogen 2.860 N/A THR 296.A OG1 ALA 292.A O no hydrogen 2.636 N/A TYR 297.A N ARG 293.A O no hydrogen 2.972 N/A LEU 298.A N CYS 294.A O no hydrogen 3.009 N/A THR 299.A N TRP 295.A O no hydrogen 2.626 N/A THR 299.A OG1 TRP 295.A O no hydrogen 2.932 N/A GLY 300.A N THR 296.A O no hydrogen 2.805 N/A VAL 301.A N LEU 298.A O no hydrogen 3.111 N/A ILE 302.A N LEU 298.A O no hydrogen 2.987 N/A LEU 303.A N THR 299.A O no hydrogen 3.020 N/A GLY 304.A N VAL 301.A O no hydrogen 2.682 N/A SER 308.A OG GLU 310.A O no hydrogen 3.327 N/A SER 309.A OG GLU 327.A OE1 no hydrogen 2.532 N/A SER 309.A OG GLU 327.A OE2 no hydrogen 3.232 N/A ILE 311.A N TYR 324.A O no hydrogen 3.016 N/A HIS 314.A ND1 PRO 312.A O no hydrogen 3.034 N/A PHE 317.A N HIS 314.A O no hydrogen 2.828 N/A ALA 319.A N PHE 316.A O no hydrogen 2.849 N/A TYR 320.A N PHE 317.A O no hydrogen 3.340 N/A TYR 324.A N TYR 320.A O no hydrogen 2.901 N/A LEU 326.A N SER 309.A O no hydrogen 2.944 N/A SER 331.A N ASN 258.A OD1 no hydrogen 2.826 N/A SER 331.A OG ASN 258.A OD1 no hydrogen 3.494 N/A ARG 333.A NH1 SER 256.A O no hydrogen 2.924 N/A ARG 333.A NH2 SER 256.A O no hydrogen 3.453 N/A ARG 333.A NH2 PHE 257.A O no hydrogen 2.629 N/A ASN 337.A N ASP 335.A O no hydrogen 2.339 N/A ASN 337.A N ASP 335.A OD1 no hydrogen 3.000 N/A ASN 337.A ND2 GLN 212.A O no hydrogen 3.000 N/A ILE 342.A N GLU 338.A O no hydrogen 3.061 N/A GLN 343.A NE2 GLN 343.A O no hydrogen 3.663 N/A GLN 343.A NE2 ASN 347.A OD1 no hydrogen 3.234 N/A GLN 344.A N HIS 340.A O no hydrogen 3.192 N/A GLN 344.A NE2 HIS 340.A NE2 no hydrogen 3.296 N/A ILE 345.A N ARG 341.A O no hydrogen 3.296 N/A LEU 346.A N ILE 342.A O no hydrogen 2.895 N/A ASN 347.A N GLN 343.A O no hydrogen 2.960 N/A TYR 348.A N GLN 344.A O no hydrogen 2.880 N/A ILE 349.A N ILE 345.A O no hydrogen 2.800 N/A LYS 350.A N LEU 346.A O no hydrogen 3.181 N/A LYS 350.A NZ LEU 346.A O no hydrogen 3.366 N/A GLY 351.A N ASN 347.A O no hydrogen 2.582 N/A ASN 352.A N TYR 348.A O no hydrogen 2.931 N/A LEU 353.A N ILE 349.A O no hydrogen 2.559 N/A LYS 354.A N ASN 352.A O no hydrogen 2.781 N/A LYS 354.A NZ LYS 350.A O no hydrogen 3.305 N/A LYS 354.A NZ GLY 351.A O no hydrogen 2.956 N/A