Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n43_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A ND2 ASP 54.A O no hydrogen 2.942 N/A THR 6.A OG1 VAL 2.A O no hydrogen 3.468 N/A ARG 7.A N TRP 229.A O no hydrogen 3.193 N/A TYR 9.A N SER 45.A O no hydrogen 3.306 N/A TYR 9.A OH GLU 29.A OE2 no hydrogen 2.936 N/A ALA 11.A N SER 24.A O no hydrogen 3.288 N/A CYS 13.A N CYS 22.A O no hydrogen 3.156 N/A CYS 13.A SG ASP 15.A O no hydrogen 3.362 N/A CYS 16.A N HIS 20.A O no hydrogen 2.898 N/A GLY 17.A N ASP 15.A OD2 no hydrogen 3.152 N/A GLY 19.A N ASP 15.A OD2 no hydrogen 3.038 N/A HIS 20.A N GLY 17.A O no hydrogen 3.413 N/A SER 21.A OG CYS 13.A O no hydrogen 2.983 N/A CYS 22.A N CYS 13.A O no hydrogen 3.283 N/A SER 24.A N ALA 11.A O no hydrogen 2.937 N/A VAL 26.A N SER 24.A OG no hydrogen 3.237 N/A GLU 29.A N GLN 43.A O no hydrogen 2.878 N/A ARG 32.A N LYS 41.A O no hydrogen 2.870 N/A ARG 32.A NE GLU 34.A OE1 no hydrogen 2.819 N/A ARG 32.A NE GLU 34.A OE2 no hydrogen 3.320 N/A ARG 32.A NH1 GLU 159.A OE1 no hydrogen 2.875 N/A ARG 32.A NH2 GLU 34.A OE1 no hydrogen 3.038 N/A ARG 32.A NH2 GLU 159.A OE1 no hydrogen 3.131 N/A ARG 32.A NH2 GLU 159.A OE2 no hydrogen 3.056 N/A GLU 34.A N TYR 150.A OH no hydrogen 3.148 N/A THR 36.A N SER 148.A OG no hydrogen 3.025 N/A THR 36.A OG1 SER 148.A OG no hydrogen 3.209 N/A ASP 37.A N SER 148.A O no hydrogen 3.356 N/A THR 39.A N ASP 37.A OD1 no hydrogen 3.323 N/A THR 39.A OG1 ASP 37.A OD1 no hydrogen 3.156 N/A THR 39.A OG1 ASP 37.A OD2 no hydrogen 2.900 N/A THR 39.A OG1 THR 149.A OG1 no hydrogen 3.224 N/A LEU 40.A N ALA 97.A O no hydrogen 3.179 N/A LYS 41.A N ARG 32.A O no hydrogen 2.896 N/A LYS 41.A NZ GLU 159.A OE1 no hydrogen 2.707 N/A LYS 41.A NZ PRO 252.A O no hydrogen 2.991 N/A LYS 41.A NZ PHE 253.A O no hydrogen 2.785 N/A ILE 42.A N ILE 95.A O no hydrogen 2.923 N/A GLN 43.A N ARG 30.A O no hydrogen 2.842 N/A VAL 44.A N HIS 93.A O no hydrogen 2.812 N/A SER 45.A N ALA 27.A O no hydrogen 2.985 N/A SER 45.A OG TYR 9.A O no hydrogen 3.220 N/A SER 45.A OG PRO 25.A O no hydrogen 2.915 N/A GLN 47.A N ARG 62.A O no hydrogen 3.076 N/A GLN 47.A NE2 THR 6.A OG1 no hydrogen 3.227 N/A GLN 47.A NE2 HIS 93.A NE2 no hydrogen 3.278 N/A ILE 48.A N GLY 92.A O no hydrogen 2.805 N/A GLY 49.A N LYS 60.A O no hydrogen 3.082 N/A LYS 51.A N SER 55.A O no hydrogen 2.993 N/A THR 52.A N ASP 71.A OD1 no hydrogen 3.020 N/A THR 52.A OG1 ASP 71.A OD2 no hydrogen 3.059 N/A ASP 54.A N LYS 51.A O no hydrogen 2.996 N/A SER 55.A N ASP 53.A OD1 no hydrogen 3.337 N/A SER 55.A OG ASP 53.A OD1 no hydrogen 2.636 N/A HIS 56.A NE2 ASN 1.A OD1 no hydrogen 2.799 N/A ASP 57.A N GLY 49.A O no hydrogen 2.799 N/A THR 59.A OG1 ASP 57.A OD1 no hydrogen 2.678 N/A LYS 60.A N ASP 57.A O no hydrogen 3.183 N/A LYS 60.A NZ GLU 73.A OE1 no hydrogen 3.514 N/A LYS 60.A NZ GLU 73.A OE2 no hydrogen 3.217 N/A LEU 61.A N ALA 72.A O no hydrogen 2.796 N/A ARG 62.A N GLN 47.A O no hydrogen 2.820 N/A ARG 62.A NE GLN 47.A OE1 no hydrogen 2.788 N/A ARG 62.A NH1 LYS 51.A O no hydrogen 3.177 N/A ARG 62.A NH1 ASP 54.A OD1 no hydrogen 2.797 N/A ARG 62.A NH2 TYR 3.A O no hydrogen 2.693 N/A ARG 62.A NH2 GLN 47.A OE1 no hydrogen 2.891 N/A TYR 63.A N ALA 70.A O no hydrogen 3.032 N/A TYR 63.A OH ASP 65.A OD2 no hydrogen 2.916 N/A ASP 65.A N MET 68.A O no hydrogen 2.958 N/A MET 68.A N ASP 65.A O no hydrogen 3.072 N/A ALA 70.A N TYR 63.A O no hydrogen 2.801 N/A ALA 72.A N LEU 61.A O no hydrogen 2.790 N/A ARG 74.A N THR 59.A O no hydrogen 3.081 N/A ARG 74.A NH1 ARG 74.A O no hydrogen 3.266 N/A LEU 77.A N ARG 74.A O no hydrogen 3.120 N/A PHE 78.A N GLY 108.A O no hydrogen 2.791 N/A ARG 80.A N THR 106.A O no hydrogen 2.911 N/A THR 81.A N ALA 83.A O no hydrogen 3.334 N/A THR 81.A OG1 PRO 100.A O no hydrogen 3.255 N/A SER 82.A OG LYS 101.A O no hydrogen 2.801 N/A CYS 85.A N VAL 79.A O no hydrogen 2.799 N/A THR 86.A N ARG 98.A O no hydrogen 3.063 N/A THR 88.A N LEU 96.A O no hydrogen 2.909 N/A THR 88.A OG1 LEU 96.A O no hydrogen 3.224 N/A GLY 89.A N LEU 96.A O no hydrogen 3.479 N/A MET 91.A N PHE 94.A O no hydrogen 3.426 N/A GLY 92.A N ILE 48.A O no hydrogen 2.772 N/A HIS 93.A ND1 VAL 44.A O no hydrogen 2.827 N/A PHE 94.A N MET 91.A O no hydrogen 3.474 N/A ILE 95.A N ILE 42.A O no hydrogen 2.849 N/A LEU 96.A N GLY 89.A O no hydrogen 2.743 N/A ALA 97.A N LEU 40.A O no hydrogen 3.444 N/A ARG 98.A N THR 86.A O no hydrogen 3.013 N/A ARG 98.A NH1 ASP 37.A O no hydrogen 3.369 N/A ARG 98.A NH2 ASP 37.A O no hydrogen 2.984 N/A GLY 102.A N HIS 125.A O no hydrogen 3.052 N/A LEU 105.A N HIS 121.A O no hydrogen 2.969 N/A THR 106.A N ARG 80.A O no hydrogen 2.778 N/A THR 106.A OG1 THR 120.A OG1 no hydrogen 3.157 N/A VAL 107.A N CYS 119.A O no hydrogen 3.163 N/A GLY 108.A N PHE 78.A O no hydrogen 2.831 N/A PHE 109.A N HIS 117.A O no hydrogen 3.019 N/A SER 112.A OG ASP 71.A O no hydrogen 3.127 N/A ARG 113.A N ASP 111.A OD2 no hydrogen 3.083 N/A ILE 115.A N ARG 113.A O no hydrogen 2.779 N/A HIS 117.A N PHE 109.A O no hydrogen 3.073 N/A SER 118.A OG CYS 16.A O no hydrogen 3.293 N/A CYS 119.A N VAL 107.A O no hydrogen 3.157 N/A THR 120.A N ASP 15.A O no hydrogen 2.796 N/A THR 120.A OG1 THR 106.A OG1 no hydrogen 3.157 N/A HIS 121.A N LEU 105.A O no hydrogen 3.039 N/A HIS 124.A ND1 GLU 103.A OE2 no hydrogen 2.977 N/A HIS 125.A N GLY 102.A O no hydrogen 2.911 N/A HIS 125.A NE2 CYS 99.A O no hydrogen 2.863 N/A ARG 132.A N ASN 326.A OD1 no hydrogen 2.939 N/A ARG 132.A NE GLY 325.A O no hydrogen 2.910 N/A ARG 132.A NH2 SER 290.A OG no hydrogen 2.732 N/A ARG 132.A NH2 THR 323.A O no hydrogen 2.826 N/A LYS 134.A N PRO 286.A O no hydrogen 2.827 N/A LYS 143.A N VAL 262.A O no hydrogen 2.924 N/A LEU 145.A N CYS 260.A O no hydrogen 3.126 N/A CYS 147.A N VAL 258.A O no hydrogen 3.252 N/A SER 148.A N THR 36.A OG1 no hydrogen 2.794 N/A SER 148.A OG THR 36.A OG1 no hydrogen 3.209 N/A THR 149.A N ALA 256.A O no hydrogen 3.313 N/A THR 149.A OG1 ASP 37.A OD1 no hydrogen 3.098 N/A THR 149.A OG1 ASP 37.A OD2 no hydrogen 2.837 N/A THR 149.A OG1 THR 39.A OG1 no hydrogen 3.224 N/A TYR 150.A OH GLU 34.A OE1 no hydrogen 2.886 N/A VAL 151.A N PRO 254.A O no hydrogen 3.296 N/A GLN 152.A NE2 THR 88.A O no hydrogen 2.792 N/A ILE 161.A N ILE 249.A O no hydrogen 3.139 N/A VAL 163.A N GLY 247.A O no hydrogen 2.721 N/A HIS 164.A N GLN 230.A O no hydrogen 2.681 N/A HIS 164.A ND1 MET 165.A O no hydrogen 2.934 N/A THR 169.A N VAL 223.A O no hydrogen 2.810 N/A THR 169.A OG1 ASN 225.A OD1 no hydrogen 2.901 N/A ASP 171.A N ALA 221.A O no hydrogen 3.278 N/A THR 173.A OG1 ASP 171.A OD1 no hydrogen 2.820 N/A THR 173.A OG1 ASP 171.A OD2 no hydrogen 2.885 N/A SER 176.A N LYS 183.A O no hydrogen 2.872 N/A SER 176.A OG LYS 183.A O no hydrogen 3.174 N/A GLN 178.A N ASN 181.A O no hydrogen 2.784 N/A GLY 180.A N GLN 178.A O no hydrogen 2.721 N/A ASN 181.A N GLN 178.A O no hydrogen 2.917 N/A VAL 182.A N ILE 211.A O no hydrogen 3.067 N/A LYS 183.A N SER 176.A O no hydrogen 2.829 N/A ILE 184.A N LYS 209.A O no hydrogen 2.971 N/A THR 185.A N LEU 174.A O no hydrogen 3.011 N/A VAL 186.A N ASP 208.A OD1 no hydrogen 2.863 N/A GLN 189.A N VAL 186.A O no hydrogen 3.300 N/A VAL 191.A N THR 205.A O no hydrogen 2.791 N/A ARG 192.A N ALA 222.A O no hydrogen 2.798 N/A ARG 192.A NE ASP 168.A OD2 no hydrogen 2.828 N/A ARG 192.A NH1 GLU 241.A OE1 no hydrogen 3.419 N/A ARG 192.A NH2 GLU 241.A OE1 no hydrogen 3.112 N/A TYR 193.A N GLY 203.A O no hydrogen 3.198 N/A LYS 194.A N HIS 220.A O no hydrogen 2.963 N/A CYS 195.A N ASN 201.A O no hydrogen 2.930 N/A ASN 196.A N GLN 218.A O no hydrogen 2.911 N/A CYS 197.A SG ASN 213.A O no hydrogen 3.515 N/A ASN 201.A N GLY 199.A O no hydrogen 2.979 N/A GLY 203.A N TYR 193.A O no hydrogen 3.343 N/A THR 205.A N VAL 191.A O no hydrogen 2.805 N/A THR 205.A OG1 THR 207.A O no hydrogen 2.814 N/A THR 207.A N THR 205.A OG1 no hydrogen 3.310 N/A LYS 209.A N ILE 184.A O no hydrogen 3.311 N/A LYS 209.A NZ THR 205.A OG1 no hydrogen 3.147 N/A ILE 211.A N VAL 182.A O no hydrogen 2.818 N/A ASN 213.A N ASN 181.A OD1 no hydrogen 2.770 N/A GLN 218.A N LYS 215.A O no hydrogen 3.148 N/A CYS 219.A N VAL 216.A O no hydrogen 3.469 N/A CYS 219.A SG LYS 215.A O no hydrogen 3.997 N/A HIS 220.A N LYS 194.A O no hydrogen 2.855 N/A ALA 222.A N ARG 192.A O no hydrogen 2.931 N/A VAL 223.A N THR 169.A O no hydrogen 2.813 N/A THR 224.A N THR 190.A O no hydrogen 3.028 N/A THR 224.A OG1 THR 190.A O no hydrogen 3.081 N/A LYS 228.A NZ LYS 4.A O no hydrogen 2.842 N/A TRP 229.A N ALA 5.A O no hydrogen 2.732 N/A GLN 230.A N HIS 164.A O no hydrogen 2.758 N/A ASN 232.A N GLU 162.A O no hydrogen 2.796 N/A ASN 232.A ND2 GLU 162.A OE1 no hydrogen 3.182 N/A SER 233.A N TYR 231.A O no hydrogen 2.772 N/A SER 233.A OG GLU 29.A OE1 no hydrogen 3.002 N/A SER 233.A OG GLU 29.A OE2 no hydrogen 2.718 N/A LEU 235.A N SER 233.A OG no hydrogen 3.115 N/A VAL 236.A N SER 233.A O no hydrogen 3.321 N/A ASN 239.A ND2 PRO 166.A O no hydrogen 2.913 N/A GLU 241.A N ASN 239.A OD1 no hydrogen 3.263 N/A LEU 242.A N ASN 239.A OD1 no hydrogen 3.430 N/A LYS 246.A NZ GLU 162.A OE1 no hydrogen 3.493 N/A GLY 247.A N VAL 163.A O no hydrogen 2.685 N/A ILE 249.A N ILE 161.A O no hydrogen 3.177 N/A HIS 250.A ND1 GLU 159.A O no hydrogen 3.045 N/A ILE 251.A N GLU 159.A O no hydrogen 2.913 N/A LEU 255.A N GLU 159.A OE2 no hydrogen 3.318 N/A ALA 256.A N THR 149.A O no hydrogen 3.099 N/A VAL 258.A N CYS 147.A O no hydrogen 2.723 N/A CYS 260.A N LEU 145.A O no hydrogen 2.893 N/A VAL 262.A N LYS 143.A O no hydrogen 3.037 N/A ALA 265.A N GLU 133.A OE2 no hydrogen 3.063 N/A THR 271.A N ILE 278.A O no hydrogen 2.954 N/A THR 271.A OG1 ILE 278.A O no hydrogen 3.509 N/A GLY 273.A N GLN 276.A O no hydrogen 2.975 N/A GLN 276.A N GLY 273.A O no hydrogen 3.342 N/A VAL 277.A N LEU 313.A O no hydrogen 2.779 N/A ILE 278.A N THR 271.A O no hydrogen 2.930 N/A MET 279.A N VAL 311.A O no hydrogen 3.166 N/A LEU 280.A N THR 269.A O no hydrogen 3.053 N/A LEU 281.A N LYS 309.A O no hydrogen 3.106 N/A HIS 285.A NE2 GLU 133.A OE1 no hydrogen 2.775 N/A THR 287.A N VAL 305.A O no hydrogen 2.962 N/A THR 287.A OG1 HIS 285.A O no hydrogen 2.893 N/A LEU 288.A N ARG 132.A O no hydrogen 3.013 N/A LEU 289.A N GLU 303.A O no hydrogen 2.864 N/A SER 290.A N THR 323.A O no hydrogen 3.097 N/A TYR 291.A N GLN 301.A O no hydrogen 3.176 N/A ARG 292.A N GLU 321.A O no hydrogen 3.014 N/A ARG 292.A NE GLU 321.A OE1 no hydrogen 2.868 N/A ARG 292.A NH2 GLU 321.A OE1 no hydrogen 2.949 N/A ARG 292.A NH2 GLU 321.A OE2 no hydrogen 3.396 N/A ASN 293.A N PRO 298.A O no hydrogen 2.804 N/A ASN 293.A ND2 GLU 297.A O no hydrogen 3.435 N/A MET 294.A N.B GLY 319.A O no hydrogen 2.813 N/A MET 294.A O.B GLU 318.A O no hydrogen 3.502 N/A TYR 300.A OH GLU 302.A OE2 no hydrogen 2.817 N/A GLN 301.A N TYR 291.A O no hydrogen 3.342 N/A GLU 303.A N LEU 289.A O no hydrogen 2.916 N/A VAL 305.A N THR 287.A O no hydrogen 2.797 N/A LYS 309.A N LEU 281.A O no hydrogen 3.487 N/A LYS 309.A NZ GLU 303.A OE1 no hydrogen 2.793 N/A VAL 311.A N MET 279.A O no hydrogen 3.025 N/A LEU 313.A N VAL 277.A O no hydrogen 2.991 N/A VAL 315.A N ASN 275.A O no hydrogen 2.956 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.829 N/A GLY 319.A N PRO 316.A O no hydrogen 3.184 N/A LEU 320.A N TYR 332.A O no hydrogen 2.844 N/A GLU 321.A N ARG 292.A O no hydrogen 2.900 N/A VAL 322.A N TYR 330.A O no hydrogen 2.770 N/A THR 323.A N SER 290.A O no hydrogen 2.828 N/A GLY 325.A N LEU 288.A O no hydrogen 2.961 N/A ASN 326.A N GLU 133.A OE2 no hydrogen 2.828 N/A ASN 326.A ND2 PRO 263.A O no hydrogen 2.997 N/A ASN 327.A ND2 ALA 265.A O no hydrogen 2.717 N/A ASN 327.A ND2 TRP 324.A O no hydrogen 2.939 N/A TYR 330.A N VAL 322.A O no hydrogen 2.761 N/A TYR 330.A OH ASN 267.A OD1 no hydrogen 2.726 N/A LYS 331.A NZ GLU 321.A OE2 no hydrogen 3.183 N/A TYR 332.A N LEU 320.A O no hydrogen 2.766 N/A