Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3d7m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N HIS 153.A O no hydrogen 2.744 N/A LYS 2.A N THR 177.A OG1 no hydrogen 2.702 N/A LYS 2.A NZ GLY 175.A O no hydrogen 2.817 N/A LEU 3.A N LYS 155.A O no hydrogen 3.383 N/A LEU 4.A N ALA 178.A O no hydrogen 3.118 N/A LEU 5.A N PHE 157.A O no hydrogen 2.954 N/A LEU 6.A N ILE 180.A O no hydrogen 3.011 N/A SER 11.A OG ALA 8.A O no hydrogen 2.977 N/A LYS 13.A NZ ALA 8.A O no hydrogen 2.916 N/A SER 14.A OG THR 139.A OG1 no hydrogen 2.874 N/A SER 14.A OG ASP 158.A OD2 no hydrogen 3.026 N/A ILE 16.A N GLY 12.A O no hydrogen 2.946 N/A ILE 16.A N LYS 13.A O no hydrogen 3.064 N/A VAL 17.A N LYS 13.A O no hydrogen 3.125 N/A LYS 18.A N SER 14.A O no hydrogen 3.184 N/A GLN 19.A NE2 THR 287.A OG1 no hydrogen 3.376 N/A MET 20.A N VAL 17.A O no hydrogen 2.544 N/A LYS 21.A N VAL 17.A O no hydrogen 3.431 N/A ILE 22.A N LYS 18.A O no hydrogen 3.278 N/A ILE 22.A N GLN 19.A O no hydrogen 3.185 N/A CYS 23.A N GLN 19.A O no hydrogen 2.944 N/A CYS 23.A SG GLN 19.A O no hydrogen 3.439 N/A HIS 24.A N MET 20.A O no hydrogen 2.911 N/A GLU 25.A N LYS 21.A O no hydrogen 3.109 N/A GLU 32.A N SER 29.A OG no hydrogen 3.285 N/A CYS 33.A N SER 29.A O no hydrogen 2.896 N/A CYS 33.A SG TYR 28.A O no hydrogen 3.911 N/A CYS 33.A SG SER 29.A O no hydrogen 3.729 N/A LYS 34.A N GLU 30.A O no hydrogen 3.271 N/A GLN 35.A N GLU 31.A O no hydrogen 2.994 N/A TYR 36.A N CYS 33.A O no hydrogen 2.684 N/A LYS 37.A N LYS 34.A O no hydrogen 3.114 N/A LYS 37.A NZ TYR 41.A OH no hydrogen 2.981 N/A VAL 40.A N TYR 36.A O no hydrogen 2.934 N/A TYR 41.A N LYS 37.A O no hydrogen 3.041 N/A TYR 41.A OH ILE 120.A O no hydrogen 3.329 N/A SER 42.A N ALA 38.A O no hydrogen 2.898 N/A ASN 43.A N VAL 39.A O no hydrogen 2.794 N/A ASN 43.A ND2 GLN 46.A OE1 no hydrogen 3.532 N/A ASN 43.A ND2 ARG 136.A O no hydrogen 3.500 N/A THR 44.A N VAL 40.A O no hydrogen 2.866 N/A THR 44.A OG1 VAL 40.A O no hydrogen 3.272 N/A ILE 45.A N TYR 41.A O no hydrogen 3.484 N/A GLN 46.A N SER 42.A O no hydrogen 3.246 N/A SER 47.A N ASN 43.A O no hydrogen 2.844 N/A SER 47.A OG ASN 43.A O no hydrogen 2.812 N/A ILE 48.A N THR 44.A O no hydrogen 3.051 N/A ILE 49.A N ILE 45.A O no hydrogen 2.826 N/A ALA 50.A N GLN 46.A O no hydrogen 3.079 N/A ILE 51.A N ILE 48.A O no hydrogen 3.167 N/A ILE 52.A N ILE 48.A O no hydrogen 3.329 N/A ARG 53.A N ILE 49.A O no hydrogen 3.130 N/A ALA 54.A N ALA 50.A O no hydrogen 3.005 N/A ALA 54.A N ILE 51.A O no hydrogen 2.685 N/A MET 55.A N ILE 51.A O no hydrogen 2.872 N/A ARG 57.A N ALA 54.A O no hydrogen 3.159 N/A LEU 58.A N ALA 54.A O no hydrogen 2.917 N/A LYS 59.A NZ ARG 57.A O no hydrogen 3.400 N/A ILE 60.A N MET 55.A O no hydrogen 2.691 N/A GLY 63.A N ASP 91.A OD1 no hydrogen 3.186 N/A GLY 63.A N ASP 91.A OD2 no hydrogen 3.175 N/A ASP 64.A N ASP 91.A OD1 no hydrogen 3.222 N/A ALA 66.A N ASP 64.A OD1 no hydrogen 2.659 N/A ARG 67.A N ASP 64.A O no hydrogen 3.407 N/A ARG 67.A NE ASP 70.A OD2 no hydrogen 2.903 N/A ARG 67.A NH2 ASP 70.A OD2 no hydrogen 2.643 N/A ALA 71.A N ARG 67.A O no hydrogen 2.885 N/A ARG 72.A N ALA 68.A O no hydrogen 2.833 N/A ARG 72.A NE GLN 73.A OE1 no hydrogen 3.251 N/A GLN 73.A N ASP 69.A O no hydrogen 2.750 N/A LEU 74.A N ASP 70.A O no hydrogen 2.779 N/A PHE 75.A N ALA 71.A O no hydrogen 3.362 N/A VAL 76.A N ARG 72.A O no hydrogen 3.016 N/A LEU 77.A N GLN 73.A O no hydrogen 2.909 N/A ALA 78.A N LEU 74.A O no hydrogen 3.084 N/A ALA 82.A N ALA 79.A O no hydrogen 3.122 N/A VAL 84.A N GLU 80.A O no hydrogen 2.930 N/A ILE 85.A N LEU 81.A O no hydrogen 2.798 N/A LYS 86.A N ALA 82.A O no hydrogen 2.686 N/A LYS 86.A NZ ASP 118.A OD2 no hydrogen 3.173 N/A ARG 87.A N GLY 83.A O no hydrogen 2.744 N/A ARG 87.A NE ASP 70.A OD1 no hydrogen 2.818 N/A ARG 87.A NE ASP 70.A OD2 no hydrogen 3.078 N/A ARG 87.A NH2 ASP 70.A OD1 no hydrogen 2.886 N/A LEU 88.A N VAL 84.A O no hydrogen 3.368 N/A TRP 89.A N ILE 85.A O no hydrogen 2.950 N/A TRP 89.A NE1 ASN 115.A OD1 no hydrogen 3.077 N/A LYS 90.A N LYS 86.A O no hydrogen 3.251 N/A LYS 90.A N ARG 87.A O no hydrogen 3.247 N/A ASP 91.A N ARG 87.A O no hydrogen 3.300 N/A GLY 93.A N ASP 91.A OD2 no hydrogen 2.613 N/A VAL 94.A N ASP 91.A OD2 no hydrogen 3.193 N/A GLN 95.A N ASP 91.A O no hydrogen 3.033 N/A ALA 96.A N SER 92.A O no hydrogen 2.794 N/A CYS 97.A N GLY 93.A O no hydrogen 3.200 N/A CYS 97.A N VAL 94.A O no hydrogen 2.968 N/A CYS 97.A SG ILE 51.A O no hydrogen 3.934 N/A CYS 97.A SG TYR 104.A OH no hydrogen 3.385 N/A PHE 98.A N VAL 94.A O no hydrogen 2.954 N/A ASN 99.A ND2 ALA 96.A O no hydrogen 3.119 N/A SER 101.A N PHE 98.A O no hydrogen 3.328 N/A GLU 103.A N ARG 100.A O no hydrogen 2.956 N/A TYR 104.A N SER 101.A O no hydrogen 3.117 N/A TYR 104.A OH CYS 97.A O no hydrogen 3.148 N/A SER 109.A OG ARG 134.A O no hydrogen 2.587 N/A ALA 110.A N ASN 107.A O no hydrogen 2.738 N/A TYR 112.A OH ASP 131.A OD1 no hydrogen 2.833 N/A TYR 113.A N SER 109.A O no hydrogen 2.994 N/A TYR 113.A OH ASP 131.A O no hydrogen 2.529 N/A LEU 114.A N ALA 110.A O no hydrogen 3.149 N/A ASN 115.A N ALA 111.A O no hydrogen 2.937 N/A ASN 115.A N TYR 112.A O no hydrogen 3.116 N/A ASP 116.A N TYR 112.A O no hydrogen 3.229 N/A ASP 116.A N TYR 113.A O no hydrogen 2.963 N/A ARG 119.A NH1 ASP 131.A OD2 no hydrogen 3.059 N/A ARG 119.A NH2 ASP 116.A OD2 no hydrogen 3.542 N/A ARG 119.A NH2 ASP 131.A OD1 no hydrogen 2.920 N/A ARG 119.A NH2 ASP 131.A OD2 no hydrogen 2.817 N/A ILE 120.A N ASP 116.A O no hydrogen 3.132 N/A ALA 121.A N LEU 117.A O no hydrogen 2.888 N/A GLN 122.A N ARG 119.A O no hydrogen 3.304 N/A TYR 125.A N GLN 122.A O no hydrogen 2.778 N/A TYR 125.A OH ASP 131.A OD2 no hydrogen 2.958 N/A THR 128.A N ASP 131.A OD2 no hydrogen 3.004 N/A THR 128.A OG1 ASP 131.A OD2 no hydrogen 2.852 N/A GLN 129.A NE2 TYR 28.A O no hydrogen 3.142 N/A GLN 130.A NE2 THR 285.A O no hydrogen 2.687 N/A ASP 131.A N THR 128.A OG1 no hydrogen 3.246 N/A VAL 132.A N THR 128.A O no hydrogen 3.060 N/A LEU 133.A N GLN 129.A O no hydrogen 3.018 N/A ARG 134.A N GLN 130.A O no hydrogen 2.815 N/A ARG 134.A NE GLN 130.A OE1 no hydrogen 3.139 N/A ARG 134.A NE THR 285.A OG1 no hydrogen 3.398 N/A THR 135.A N ASP 131.A O no hydrogen 3.295 N/A THR 135.A OG1 VAL 132.A O no hydrogen 2.766 N/A ARG 136.A N ASN 43.A OD1 no hydrogen 2.614 N/A LYS 138.A NZ GLN 162.A OE1 no hydrogen 3.209 N/A THR 139.A OG1 SER 14.A OG no hydrogen 2.874 N/A GLY 141.A N GLU 165.A OE1 no hydrogen 2.992 N/A VAL 143.A N ASP 158.A O no hydrogen 2.903 N/A THR 145.A N MET 156.A O no hydrogen 3.057 N/A HIS 146.A NE2 GLU 144.A OE2 no hydrogen 2.372 N/A PHE 147.A N PHE 154.A O no hydrogen 2.877 N/A PHE 149.A N LEU 152.A O no hydrogen 2.956 N/A LEU 152.A N PHE 149.A O no hydrogen 2.632 N/A PHE 154.A N PHE 147.A O no hydrogen 2.641 N/A LYS 155.A N VAL 1.A O no hydrogen 2.747 N/A MET 156.A N THR 145.A O no hydrogen 2.865 N/A PHE 157.A N LEU 3.A O no hydrogen 3.134 N/A ASP 158.A N VAL 143.A O no hydrogen 2.872 N/A GLY 160.A N GLY 141.A O no hydrogen 3.130 N/A ARG 163.A NE GLU 203.A OE2 no hydrogen 2.911 N/A SER 164.A OG GLU 165.A OE2 no hydrogen 3.562 N/A GLU 165.A N GLN 162.A O no hydrogen 2.768 N/A ARG 166.A N GLN 162.A O no hydrogen 2.778 N/A ARG 166.A NH1 GLU 203.A OE2 no hydrogen 2.884 N/A ARG 166.A NH2 GLU 203.A OE2 no hydrogen 3.464 N/A LYS 168.A N GLU 165.A O no hydrogen 2.863 N/A TRP 169.A NE1 GLY 160.A O no hydrogen 3.169 N/A CYS 172.A N TRP 169.A O no hydrogen 2.967 N/A ALA 178.A N LYS 2.A O no hydrogen 3.181 N/A ILE 179.A N SER 221.A O no hydrogen 2.871 N/A ILE 180.A N LEU 4.A O no hydrogen 2.875 N/A PHE 181.A N ILE 223.A O no hydrogen 2.655 N/A CYS 182.A N LEU 6.A O no hydrogen 2.895 N/A VAL 183.A N PHE 225.A O no hydrogen 2.928 N/A LEU 185.A N ASN 227.A O no hydrogen 2.822 N/A ASP 187.A N ALA 184.A O no hydrogen 2.999 N/A LEU 190.A N ASP 187.A O no hydrogen 3.273 N/A LEU 192.A N MET 198.A O no hydrogen 2.790 N/A GLU 197.A N ASP 195.A OD1 no hydrogen 2.712 N/A ASN 199.A ND2 TYR 188.A O no hydrogen 3.204 N/A ARG 200.A N LEU 190.A O no hydrogen 2.854 N/A ARG 200.A NE VAL 191.A O no hydrogen 3.019 N/A ARG 200.A NH1 GLU 10.A OE1 no hydrogen 3.403 N/A ARG 200.A NH2 GLU 10.A OE1 no hydrogen 3.464 N/A HIS 202.A N ASN 199.A O no hydrogen 2.945 N/A HIS 202.A NE2 CYS 244.A O no hydrogen 2.819 N/A GLU 203.A N ASN 199.A O no hydrogen 3.125 N/A SER 204.A N ARG 200.A O no hydrogen 3.377 N/A MET 205.A N MET 201.A O no hydrogen 2.996 N/A LYS 206.A N HIS 202.A O no hydrogen 2.846 N/A LEU 207.A N GLU 203.A O no hydrogen 2.910 N/A PHE 208.A N SER 204.A O no hydrogen 2.736 N/A ASP 209.A N MET 205.A O no hydrogen 2.911 N/A SER 210.A N LYS 206.A O no hydrogen 3.019 N/A ILE 211.A N LEU 207.A O no hydrogen 2.832 N/A CYS 212.A N PHE 208.A O no hydrogen 2.585 N/A CYS 212.A SG ASN 213.A OD1 no hydrogen 4.017 N/A CYS 212.A SG ASN 269.A OD1 no hydrogen 3.519 N/A ASN 213.A N ASP 209.A O no hydrogen 3.360 N/A ASN 213.A ND2 ASP 209.A O no hydrogen 3.559 N/A ASN 213.A ND2 LEU 268.A O no hydrogen 2.979 N/A ASN 214.A N ILE 211.A O no hydrogen 3.144 N/A TRP 216.A N ASN 214.A OD1 no hydrogen 3.129 N/A PHE 217.A N ASN 214.A O no hydrogen 3.314 N/A THR 218.A N LYS 215.A O no hydrogen 3.289 N/A THR 218.A OG1 LYS 215.A O no hydrogen 3.100 N/A THR 220.A N PHE 217.A O no hydrogen 3.202 N/A THR 220.A OG1 VAL 176.A O no hydrogen 2.644 N/A SER 221.A N THR 177.A O no hydrogen 3.361 N/A ILE 223.A N ILE 179.A O no hydrogen 2.781 N/A LEU 224.A N TYR 278.A O no hydrogen 2.928 N/A PHE 225.A N PHE 181.A O no hydrogen 2.998 N/A LEU 226.A N HIS 280.A O no hydrogen 2.861 N/A ASN 227.A ND2 SER 11.A O no hydrogen 2.822 N/A LYS 228.A NZ ASP 108.A OD2 no hydrogen 2.816 N/A LYS 229.A N THR 282.A O no hydrogen 3.163 N/A PHE 232.A N LYS 228.A O no hydrogen 2.957 N/A GLU 233.A N LYS 229.A O no hydrogen 2.804 N/A GLU 234.A N LEU 231.A O no hydrogen 3.282 N/A LYS 235.A N PHE 232.A O no hydrogen 3.127 N/A LYS 235.A NZ SER 186.A O no hydrogen 2.969 N/A LYS 235.A NZ ASP 189.A OD1 no hydrogen 3.364 N/A ILE 236.A N PHE 232.A O no hydrogen 3.260 N/A LYS 238.A N LYS 235.A O no hydrogen 3.150 N/A SER 239.A N ILE 236.A O no hydrogen 3.430 N/A SER 239.A OG ASP 189.A OD2 no hydrogen 3.107 N/A ILE 243.A N PRO 240.A O no hydrogen 2.942 N/A CYS 244.A N LEU 241.A O no hydrogen 3.060 N/A CYS 244.A SG HIS 202.A NE2 no hydrogen 3.585 N/A TYR 245.A N LEU 241.A O no hydrogen 2.773 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 3.037 N/A TYR 248.A N TYR 245.A O no hydrogen 3.311 N/A TYR 248.A OH SER 251.A O no hydrogen 2.902 N/A SER 251.A N GLU 256.A OE2 no hydrogen 3.069 N/A SER 251.A OG THR 253.A OG1 no hydrogen 2.876 N/A SER 251.A OG GLU 256.A OE1 no hydrogen 2.295 N/A THR 253.A OG1 SER 251.A OG no hydrogen 2.876 N/A GLU 256.A N THR 253.A OG1 no hydrogen 3.219 N/A ALA 257.A N THR 253.A O no hydrogen 2.958 N/A ALA 258.A N TYR 254.A O no hydrogen 3.342 N/A ALA 259.A N GLU 255.A O no hydrogen 3.236 N/A TYR 260.A N ALA 257.A O no hydrogen 2.956 N/A TYR 260.A OH GLU 247.A OE2 no hydrogen 3.324 N/A ILE 261.A N ALA 257.A O no hydrogen 2.995 N/A GLN 262.A N ALA 258.A O no hydrogen 3.290 N/A GLN 262.A NE2 GLU 266.A OE2 no hydrogen 3.072 N/A CYS 263.A SG ALA 259.A O no hydrogen 3.614 N/A GLN 264.A N TYR 260.A O no hydrogen 2.681 N/A PHE 265.A N ILE 261.A O no hydrogen 3.023 N/A GLU 266.A N GLN 262.A O no hydrogen 3.035 N/A ASP 267.A N CYS 263.A O no hydrogen 3.117 N/A LEU 268.A N PHE 265.A O no hydrogen 3.345 N/A ASN 269.A N GLU 266.A O no hydrogen 3.202 N/A ASN 269.A ND2 LYS 275.A O no hydrogen 3.324 N/A LYS 270.A N ASN 213.A OD1 no hydrogen 2.675 N/A ARG 271.A NH1 CYS 212.A O no hydrogen 3.246 N/A THR 274.A N ARG 271.A O no hydrogen 2.877 N/A THR 274.A OG1 ARG 271.A O no hydrogen 3.006 N/A LYS 275.A N LYS 272.A O no hydrogen 3.500 N/A LYS 275.A NZ THR 218.A O no hydrogen 3.029 N/A LYS 275.A NZ THR 220.A O no hydrogen 2.957 N/A TYR 278.A N ILE 222.A O no hydrogen 3.112 N/A TYR 278.A OH GLU 276.A OE1 no hydrogen 2.823 N/A THR 279.A OG1 GLU 266.A OE2 no hydrogen 2.791 N/A HIS 280.A N LEU 224.A O no hydrogen 2.838 N/A THR 282.A N LEU 226.A O no hydrogen 3.215 N/A THR 282.A OG1 ASN 227.A OD1 no hydrogen 2.708 N/A CYS 283.A N ASN 289.A OD1 no hydrogen 2.974 N/A CYS 283.A SG THR 285.A OG1 no hydrogen 3.750 N/A ALA 284.A N ASN 227.A OD1 no hydrogen 3.160 N/A ASP 286.A N CYS 283.A O no hydrogen 2.703 N/A THR 287.A OG1 GLN 19.A OE1 no hydrogen 3.424 N/A ASN 289.A N ASP 286.A OD2 no hydrogen 3.146 N/A VAL 290.A N ASP 286.A O no hydrogen 3.177 N/A CYS 291.A N THR 287.A O no hydrogen 3.245 N/A CYS 291.A SG THR 287.A O no hydrogen 2.748 N/A PHE 292.A N LYS 288.A O no hydrogen 3.188 N/A VAL 293.A N ASN 289.A O no hydrogen 2.827 N/A PHE 294.A N VAL 290.A O no hydrogen 2.963 N/A ASP 295.A N CYS 291.A O no hydrogen 2.679 N/A VAL 297.A N VAL 293.A O no hydrogen 2.868 N/A THR 298.A N PHE 294.A O no hydrogen 2.977 N/A THR 298.A OG1 PHE 294.A O no hydrogen 3.073 N/A THR 298.A OG1 ASP 295.A O no hydrogen 2.885 N/A ASP 299.A N ASP 295.A O no hydrogen 3.274 N/A VAL 300.A N ALA 296.A O no hydrogen 2.906 N/A ILE 301.A N VAL 297.A O no hydrogen 3.277 N/A ILE 302.A N THR 298.A O no hydrogen 3.051 N/A LYS 303.A N ASP 299.A O no hydrogen 3.010 N/A ASN 304.A N VAL 300.A O no hydrogen 2.866 N/A ASN 304.A ND2 SER 221.A OG no hydrogen 2.542 N/A