Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2cmc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N HIS 4.A ND1 no hydrogen 3.504 N/A HIS 5.A N HIS 1.A O no hydrogen 3.323 N/A HIS 6.A N HIS 2.A O no hydrogen 2.886 N/A GLU 7.A N HIS 3.A O no hydrogen 2.856 N/A MET 8.A N HIS 4.A O no hydrogen 2.974 N/A GLU 9.A N HIS 5.A O no hydrogen 2.830 N/A LYS 10.A N HIS 6.A O no hydrogen 2.955 N/A GLU 11.A N GLU 7.A O no hydrogen 2.890 N/A PHE 12.A N MET 8.A O no hydrogen 3.038 N/A GLU 13.A N GLU 9.A O no hydrogen 2.872 N/A GLN 14.A N LYS 10.A O no hydrogen 2.673 N/A GLN 14.A NE2 LYS 10.A O no hydrogen 3.604 N/A ILE 15.A N GLU 11.A O no hydrogen 2.977 N/A ASP 16.A N PHE 12.A O no hydrogen 2.858 N/A LYS 17.A N GLU 13.A O no hydrogen 2.824 N/A SER 18.A N GLN 14.A O no hydrogen 3.235 N/A SER 18.A OG GLN 14.A O no hydrogen 2.864 N/A SER 18.A OG ILE 15.A O no hydrogen 3.261 N/A SER 18.A OG SER 20.A OG no hydrogen 2.536 N/A GLY 19.A N ASP 16.A O no hydrogen 2.739 N/A SER 20.A N ILE 15.A O no hydrogen 2.862 N/A SER 20.A OG SER 18.A OG no hydrogen 2.536 N/A TRP 21.A NE1 ASP 16.A OD2 no hydrogen 2.791 N/A ILE 24.A N SER 20.A O no hydrogen 3.336 N/A TYR 25.A N TRP 21.A O no hydrogen 2.895 N/A TYR 25.A OH ILE 266.A O no hydrogen 2.877 N/A GLN 26.A N ALA 22.A O no hydrogen 2.794 N/A ASP 27.A N ALA 23.A O no hydrogen 2.871 N/A ILE 28.A N ILE 24.A O no hydrogen 3.122 N/A ARG 29.A N TYR 25.A O no hydrogen 3.041 N/A HIS 30.A N GLN 26.A O no hydrogen 2.843 N/A GLU 31.A N ASP 27.A O no hydrogen 2.812 N/A GLU 31.A N ILE 28.A O no hydrogen 3.294 N/A ALA 32.A N ARG 29.A O no hydrogen 3.277 N/A CYS 37.A SG PHE 35.A O no hydrogen 3.920 N/A CYS 37.A SG PRO 56.A O no hydrogen 3.315 N/A ARG 38.A N ASP 58.A OD2 no hydrogen 2.855 N/A VAL 39.A N ASP 58.A OD1 no hydrogen 3.026 N/A LYS 41.A N CYS 37.A O no hydrogen 3.151 N/A LYS 41.A N ARG 38.A O no hydrogen 3.118 N/A LYS 41.A NZ ARG 52.A O no hydrogen 2.741 N/A LEU 42.A N VAL 39.A O no hydrogen 2.813 N/A ASN 45.A N LEU 42.A O no hydrogen 2.788 N/A ASN 45.A ND2 ASN 69.A OD1 no hydrogen 3.567 N/A LYS 46.A N PRO 43.A O no hydrogen 2.993 N/A ARG 48.A N ASN 45.A O no hydrogen 3.097 N/A ARG 48.A NH1 ASN 69.A O no hydrogen 2.894 N/A ARG 48.A NH1 TYR 71.A O no hydrogen 3.006 N/A ASN 49.A N LYS 46.A O no hydrogen 3.379 N/A ASN 49.A ND2 ALA 40.A O no hydrogen 2.973 N/A ARG 50.A N GLN 90.A OE1 no hydrogen 3.064 N/A ARG 50.A NE GLY 91.A O no hydrogen 3.116 N/A ARG 50.A NH1 LEU 124.A O no hydrogen 2.900 N/A ARG 50.A NH2 GLY 91.A O no hydrogen 3.028 N/A ARG 50.A NH2 PRO 92.A O no hydrogen 2.823 N/A TYR 51.A OH SER 221.A OG no hydrogen 2.677 N/A VAL 54.A N TYR 51.A O no hydrogen 3.484 N/A ASP 58.A N PRO 36.A O no hydrogen 2.804 N/A SER 60.A OG PHE 261.A O no hydrogen 2.651 N/A ARG 61.A N ASP 58.A O no hydrogen 3.376 N/A ARG 61.A NH1 ASP 70.A O no hydrogen 3.402 N/A ARG 61.A NH1 ASP 70.A OD1 no hydrogen 3.242 N/A ARG 61.A NH2 ASP 70.A OD1 no hydrogen 3.286 N/A ILE 62.A N ALA 74.A O no hydrogen 2.887 N/A LEU 64.A N ASP 70.A O no hydrogen 2.900 N/A HIS 65.A N GLU 106.A OE1 no hydrogen 2.781 N/A GLN 66.A NE2 GLU 102.A OE2 no hydrogen 2.762 N/A ASN 69.A N GLN 66.A OE1 no hydrogen 3.127 N/A TYR 71.A N ASN 69.A OD1 no hydrogen 3.040 N/A TYR 71.A OH ASN 49.A OD1 no hydrogen 2.566 N/A ASN 73.A ND2 ASN 49.A OD1 no hydrogen 2.801 N/A ASN 73.A ND2 VAL 54.A O no hydrogen 3.141 N/A SER 75.A N LEU 88.A O no hydrogen 2.945 N/A LEU 76.A N SER 60.A O no hydrogen 2.770 N/A ILE 77.A N TYR 86.A O no hydrogen 2.890 N/A MET 79.A N ARG 84.A O no hydrogen 3.061 N/A GLN 83.A N GLU 80.A O no hydrogen 2.906 N/A ARG 84.A N MET 79.A O no hydrogen 3.221 N/A ARG 84.A NH1 ASP 234.A OD2 no hydrogen 2.689 N/A TYR 86.A N ILE 77.A O no hydrogen 2.967 N/A TYR 86.A OH ASP 234.A OD2 no hydrogen 2.509 N/A TYR 86.A OH THR 235.A OG1 no hydrogen 2.705 N/A ILE 87.A N VAL 216.A O no hydrogen 2.916 N/A LEU 88.A N SER 75.A O no hydrogen 3.067 N/A THR 89.A N VAL 218.A O no hydrogen 2.899 N/A THR 89.A OG1 ASN 73.A O no hydrogen 2.766 N/A GLN 90.A N ASN 73.A O no hydrogen 3.345 N/A GLN 90.A NE2 ARG 48.A O no hydrogen 2.889 N/A GLY 91.A N SER 221.A O no hydrogen 3.041 N/A LEU 93.A N THR 96.A OG1 no hydrogen 2.801 N/A ASN 95.A ND2 ASN 47.A O no hydrogen 2.816 N/A THR 96.A N LEU 93.A O no hydrogen 2.920 N/A THR 96.A OG1 LEU 93.A O no hydrogen 3.429 N/A CYS 97.A SG LEU 93.A O no hydrogen 3.474 N/A PHE 100.A N THR 96.A O no hydrogen 2.884 N/A TRP 101.A N CYS 97.A O no hydrogen 3.077 N/A TRP 101.A NE1 TYR 129.A O no hydrogen 2.874 N/A GLU 102.A N GLY 98.A O no hydrogen 2.696 N/A MET 103.A N HIS 99.A O no hydrogen 2.787 N/A VAL 104.A N PHE 100.A O no hydrogen 3.076 N/A TRP 105.A N TRP 101.A O no hydrogen 2.940 N/A GLU 106.A N GLU 102.A O no hydrogen 2.799 N/A GLN 107.A N MET 103.A O no hydrogen 2.773 N/A LYS 108.A N TRP 105.A O no hydrogen 3.040 N/A SER 109.A N VAL 104.A O no hydrogen 3.067 N/A SER 109.A OG PRO 215.A O no hydrogen 2.710 N/A ARG 110.A NE SER 206.A O no hydrogen 3.031 N/A ARG 110.A NH1 GLU 175.A OE2 no hydrogen 3.145 N/A ARG 110.A NH2 GLU 175.A OE2 no hydrogen 3.246 N/A ARG 110.A NH2 SER 206.A O no hydrogen 3.450 N/A VAL 112.A N LEU 177.A O no hydrogen 2.992 N/A VAL 113.A N VAL 217.A O no hydrogen 2.836 N/A MET 114.A N PHE 179.A O no hydrogen 2.756 N/A LEU 115.A N HIS 219.A O no hydrogen 2.765 N/A ARG 117.A N GLU 120.A OE2 no hydrogen 3.248 N/A GLU 120.A N SER 123.A O no hydrogen 3.003 N/A LYS 121.A NZ ASP 186.A OD1 no hydrogen 3.307 N/A SER 123.A N GLU 120.A O no hydrogen 3.260 N/A LYS 125.A N VAL 118.A O no hydrogen 2.773 N/A LYS 125.A NZ GLU 120.A O no hydrogen 3.179 N/A CYS 126.A SG ALA 127.A O no hydrogen 3.511 N/A ALA 127.A N PRO 92.A O no hydrogen 2.982 N/A GLN 128.A NE2 TRP 130.A O no hydrogen 3.548 N/A TYR 129.A OH HIS 178.A NE2 no hydrogen 2.970 N/A TYR 129.A OH HIS 219.A NE2 no hydrogen 2.794 N/A GLN 132.A NE2 GLU 135.A OE2 no hydrogen 3.229 N/A MET 138.A N LEU 147.A O no hydrogen 2.777 N/A PHE 140.A N LEU 145.A O no hydrogen 2.940 N/A THR 143.A OG1 GLY 98.A O no hydrogen 3.406 N/A LYS 146.A N GLU 166.A O no hydrogen 2.879 N/A LYS 146.A NZ GLU 137.A OE2 no hydrogen 3.124 N/A LEU 147.A N MET 138.A O no hydrogen 2.855 N/A THR 148.A N GLU 164.A O no hydrogen 2.954 N/A LEU 149.A N LYS 136.A O no hydrogen 2.911 N/A ILE 150.A N GLN 162.A O no hydrogen 2.811 N/A SER 151.A N GLN 162.A O no hydrogen 3.321 N/A ASP 153.A N VAL 160.A O no hydrogen 2.851 N/A LYS 155.A N TYR 158.A O no hydrogen 2.887 N/A LYS 155.A NZ ASP 153.A OD2 no hydrogen 3.463 N/A THR 159.A N HIS 180.A O no hydrogen 2.800 N/A VAL 160.A N ASP 153.A O no hydrogen 2.983 N/A ARG 161.A N HIS 178.A O no hydrogen 2.864 N/A ARG 161.A NE GLU 152.A OE1 no hydrogen 2.696 N/A ARG 161.A NH1 HIS 178.A ND1 no hydrogen 3.473 N/A ARG 161.A NH2 GLU 152.A OE1 no hydrogen 3.475 N/A GLN 162.A N SER 151.A O no hydrogen 2.983 N/A LEU 163.A N ILE 176.A O no hydrogen 2.759 N/A GLU 164.A N THR 148.A O no hydrogen 2.817 N/A LEU 165.A N ARG 174.A O no hydrogen 2.829 N/A GLU 166.A N LYS 146.A O no hydrogen 2.696 N/A ASN 167.A N GLU 172.A O no hydrogen 2.941 N/A LEU 168.A N ASN 144.A O no hydrogen 3.250 N/A THR 169.A N ASN 167.A OD1 no hydrogen 2.811 N/A THR 170.A N ASN 167.A OD1 no hydrogen 3.082 N/A GLN 171.A N ASN 167.A O no hydrogen 2.662 N/A GLU 172.A N THR 170.A OG1 no hydrogen 3.269 N/A ARG 174.A N LEU 165.A O no hydrogen 2.752 N/A ARG 174.A NE GLU 172.A OE1 no hydrogen 3.031 N/A ARG 174.A NH1 TRP 105.A O no hydrogen 2.767 N/A ARG 174.A NH2 GLU 172.A OE1 no hydrogen 3.317 N/A ILE 176.A N LEU 163.A O no hydrogen 2.775 N/A LEU 177.A N ARG 110.A O no hydrogen 2.932 N/A HIS 178.A N ARG 161.A O no hydrogen 2.804 N/A PHE 179.A N VAL 112.A O no hydrogen 2.817 N/A HIS 180.A N THR 159.A O no hydrogen 2.924 N/A HIS 180.A NE2 ASN 116.A O no hydrogen 2.713 N/A TYR 181.A N MET 114.A O no hydrogen 2.797 N/A TYR 181.A OH SER 195.A OG no hydrogen 2.755 N/A THR 182.A N TYR 157.A O no hydrogen 3.217 N/A TRP 184.A NE1 GLY 188.A O no hydrogen 2.803 N/A GLY 188.A N PRO 185.A O no hydrogen 2.987 N/A GLU 191.A N TYR 181.A OH no hydrogen 3.186 N/A SER 195.A N SER 192.A OG no hydrogen 3.230 N/A SER 195.A OG TYR 181.A OH no hydrogen 2.755 N/A SER 195.A OG SER 192.A O no hydrogen 3.197 N/A PHE 196.A N SER 192.A O no hydrogen 3.196 N/A LEU 197.A N PRO 193.A O no hydrogen 2.932 N/A ASN 198.A N ALA 194.A O no hydrogen 2.930 N/A PHE 199.A N SER 195.A O no hydrogen 2.942 N/A LEU 200.A N PHE 196.A O no hydrogen 2.786 N/A PHE 201.A N LEU 197.A O no hydrogen 2.746 N/A LYS 202.A N ASN 198.A O no hydrogen 3.112 N/A VAL 203.A N PHE 199.A O no hydrogen 3.036 N/A ARG 204.A N LEU 200.A O no hydrogen 2.979 N/A ARG 204.A NE ASP 234.A OD1 no hydrogen 2.920 N/A ARG 204.A NH2 ASP 234.A OD1 no hydrogen 2.767 N/A GLU 205.A N PHE 201.A O no hydrogen 2.869 N/A SER 206.A OG VAL 203.A O no hydrogen 2.580 N/A SER 206.A OG SER 208.A OG no hydrogen 2.687 N/A GLY 207.A N ARG 204.A O no hydrogen 3.149 N/A SER 208.A N SER 206.A OG no hydrogen 3.116 N/A SER 208.A OG SER 206.A OG no hydrogen 2.687 N/A GLU 212.A N SER 210.A OG no hydrogen 3.000 N/A HIS 213.A N SER 210.A O no hydrogen 3.244 N/A GLY 214.A N LYS 108.A O no hydrogen 2.847 N/A VAL 217.A N GLY 111.A O no hydrogen 3.040 N/A VAL 218.A N ILE 87.A O no hydrogen 2.794 N/A HIS 219.A N VAL 113.A O no hydrogen 3.003 N/A HIS 219.A ND1 CYS 220.A O no hydrogen 3.107 N/A HIS 219.A NE2 TYR 129.A OH no hydrogen 2.794 N/A CYS 220.A SG SER 227.A OG no hydrogen 3.055 N/A SER 221.A OG TYR 51.A OH no hydrogen 2.677 N/A ARG 226.A NH1 GLU 120.A OE2 no hydrogen 2.607 N/A ARG 226.A NH1 TRP 184.A O no hydrogen 2.978 N/A ARG 226.A NH2 GLU 120.A OE1 no hydrogen 3.179 N/A GLY 228.A N ILE 224.A O no hydrogen 3.046 N/A THR 229.A N GLY 225.A O no hydrogen 2.981 N/A THR 229.A OG1 GLY 225.A O no hydrogen 2.665 N/A PHE 230.A N ARG 226.A O no hydrogen 2.929 N/A CYS 231.A N SER 227.A O no hydrogen 3.066 N/A CYS 231.A SG SER 227.A O no hydrogen 3.524 N/A LEU 232.A N GLY 228.A O no hydrogen 2.895 N/A ALA 233.A N THR 229.A O no hydrogen 3.167 N/A ASP 234.A N PHE 230.A O no hydrogen 3.164 N/A THR 235.A N CYS 231.A O no hydrogen 3.078 N/A THR 235.A OG1 TYR 86.A OH no hydrogen 2.705 N/A THR 235.A OG1 CYS 231.A O no hydrogen 3.116 N/A CYS 236.A N LEU 232.A O no hydrogen 2.926 N/A CYS 236.A SG LEU 232.A O no hydrogen 3.353 N/A LEU 237.A N ALA 233.A O no hydrogen 3.020 N/A LEU 238.A N ASP 234.A O no hydrogen 2.961 N/A LEU 239.A N THR 235.A O no hydrogen 2.859 N/A MET 240.A N CYS 236.A O no hydrogen 2.877 N/A ASP 241.A N LEU 237.A O no hydrogen 3.184 N/A ASP 241.A N LEU 238.A O no hydrogen 3.009 N/A LYS 242.A N LEU 238.A O no hydrogen 2.998 N/A LYS 242.A NZ GLU 81.A O no hydrogen 2.738 N/A LYS 242.A NZ GLN 83.A OE1 no hydrogen 3.095 N/A ARG 243.A N LEU 239.A O no hydrogen 3.049 N/A ARG 243.A NE GLU 81.A OE2 no hydrogen 2.627 N/A ARG 243.A NH1 SER 248.A OG no hydrogen 3.272 N/A ARG 243.A NH2 GLU 81.A OE1 no hydrogen 2.798 N/A ARG 243.A NH2 GLU 81.A OE2 no hydrogen 3.425 N/A SER 247.A N ASP 245.A OD1 no hydrogen 2.861 N/A SER 247.A OG ASP 245.A OD1 no hydrogen 2.691 N/A SER 247.A OG ASP 245.A OD2 no hydrogen 2.704 N/A SER 248.A N ASP 245.A O no hydrogen 3.024 N/A SER 248.A OG ASP 245.A O no hydrogen 2.594 N/A VAL 249.A N PRO 246.A O no hydrogen 3.328 N/A LYS 252.A NZ GLU 31.A OE2 no hydrogen 2.736 N/A LYS 253.A N ASP 250.A OD1 no hydrogen 3.114 N/A VAL 254.A N ASP 250.A O no hydrogen 2.815 N/A LEU 255.A N ILE 251.A O no hydrogen 2.969 N/A LEU 256.A N LYS 252.A O no hydrogen 2.929 N/A GLU 257.A N LYS 253.A O no hydrogen 2.952 N/A MET 258.A N VAL 254.A O no hydrogen 3.057 N/A ARG 259.A N LEU 255.A O no hydrogen 2.888 N/A ARG 259.A NE LEU 265.A O no hydrogen 3.035 N/A ARG 259.A NH2 LEU 265.A O no hydrogen 2.969 N/A ARG 259.A NH2 ILE 266.A O no hydrogen 3.037 N/A LYS 260.A N GLU 257.A O no hydrogen 3.125 N/A LYS 260.A NZ GLU 257.A OE2 no hydrogen 3.337 N/A PHE 261.A N MET 258.A O no hydrogen 2.941 N/A ARG 262.A NE GLY 223.A O no hydrogen 3.046 N/A ARG 262.A NH1 ASN 73.A OD1 no hydrogen 3.057 N/A ARG 262.A NH1 SER 75.A OG no hydrogen 2.817 N/A ARG 262.A NH2 ASN 73.A OD1 no hydrogen 2.903 N/A ARG 262.A NH2 ALA 222.A O no hydrogen 2.967 N/A ILE 266.A N ILE 224.A O no hydrogen 2.775 N/A GLN 267.A N GLN 271.A OE1 no hydrogen 2.702 N/A GLN 267.A NE2 GLY 264.A O no hydrogen 3.084 N/A GLN 271.A N THR 268.A OG1 no hydrogen 2.956 N/A GLN 271.A NE2 GLY 188.A O no hydrogen 3.092 N/A LEU 272.A N THR 268.A O no hydrogen 3.117 N/A ARG 273.A N ALA 269.A O no hydrogen 2.953 N/A ARG 273.A NE ASP 16.A OD1 no hydrogen 3.455 N/A ARG 273.A NE ASP 16.A OD2 no hydrogen 2.776 N/A ARG 273.A NH2 ASP 16.A OD1 no hydrogen 2.971 N/A PHE 274.A N ASP 270.A O no hydrogen 2.796 N/A SER 275.A N GLN 271.A O no hydrogen 3.055 N/A TYR 276.A N LEU 272.A O no hydrogen 3.133 N/A LEU 277.A N ARG 273.A O no hydrogen 2.933 N/A ALA 278.A N PHE 274.A O no hydrogen 2.740 N/A VAL 279.A N SER 275.A O no hydrogen 3.150 N/A VAL 279.A N TYR 276.A O no hydrogen 3.137 N/A ILE 280.A N TYR 276.A O no hydrogen 3.232 N/A GLU 281.A N LEU 277.A O no hydrogen 3.157 N/A GLY 282.A N ALA 278.A O no hydrogen 2.848 N/A ALA 283.A N VAL 279.A O no hydrogen 2.672 N/A LYS 284.A N GLU 281.A O no hydrogen 3.295 N/A LYS 284.A NZ GLU 281.A OE1 no hydrogen 2.762 N/A PHE 285.A N GLY 282.A O no hydrogen 2.966 N/A