Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qqr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A N SER 50.A OG no hydrogen 2.915 N/A ASN 3.A ND2 VAL 47.A O no hydrogen 2.823 N/A ASN 3.A ND2 LYS 48.A O no hydrogen 3.489 N/A PHE 4.A N THR 27.A O no hydrogen 2.794 N/A LEU 5.A N HIS 51.A O no hydrogen 3.010 N/A ILE 6.A N THR 29.A O no hydrogen 2.834 N/A TYR 7.A N PHE 53.A O no hydrogen 2.733 N/A TYR 7.A OH ASP 43.A OD2 no hydrogen 2.666 N/A GLY 11.A N GLY 8.A O no hydrogen 3.256 N/A ILE 13.A N THR 59.A OG1 no hydrogen 3.332 N/A GLY 15.A N GLY 11.A O no hydrogen 3.108 N/A LEU 16.A N TRP 12.A O no hydrogen 3.005 N/A LEU 17.A N ILE 13.A O no hydrogen 2.708 N/A GLY 18.A N GLY 14.A O no hydrogen 3.314 N/A LYS 19.A N GLY 15.A O no hydrogen 3.369 N/A LEU 20.A N LEU 16.A O no hydrogen 3.054 N/A CYS 21.A N LEU 17.A O no hydrogen 3.011 N/A CYS 21.A SG LEU 17.A O no hydrogen 3.728 N/A GLU 22.A N GLY 18.A O no hydrogen 3.045 N/A ALA 23.A N LYS 19.A O no hydrogen 2.981 N/A GLN 24.A N LEU 20.A O no hydrogen 2.815 N/A GLY 25.A N GLU 22.A O no hydrogen 3.110 N/A ILE 26.A N CYS 21.A O no hydrogen 2.717 N/A TYR 28.A OH GLU 22.A OE2 no hydrogen 2.721 N/A THR 29.A N PHE 4.A O no hydrogen 2.777 N/A TYR 30.A OH GLY 14.A O no hydrogen 2.936 N/A GLY 31.A N ILE 6.A O no hydrogen 2.873 N/A GLY 33.A N ASP 43.A OD2 no hydrogen 2.872 N/A ARG 37.A NH1 ASP 87.A OD1 no hydrogen 3.416 N/A ARG 37.A NH2 ASP 87.A OD1 no hydrogen 3.150 N/A ILE 40.A N ASP 36.A O no hydrogen 3.282 N/A VAL 41.A N ARG 37.A O no hydrogen 2.593 N/A ALA 42.A N GLN 38.A O no hydrogen 2.917 N/A ASP 43.A N SER 39.A O no hydrogen 3.407 N/A ILE 44.A N ILE 40.A O no hydrogen 3.059 N/A GLU 45.A N VAL 41.A O no hydrogen 3.274 N/A SER 46.A N ALA 42.A O no hydrogen 2.784 N/A VAL 47.A N ASP 43.A O no hydrogen 2.824 N/A LYS 48.A N ILE 44.A O no hydrogen 2.846 N/A SER 50.A N ASN 3.A O no hydrogen 2.745 N/A SER 50.A OG ASN 3.A O no hydrogen 3.292 N/A SER 50.A OG HIS 51.A ND1 no hydrogen 2.663 N/A HIS 51.A N ASN 3.A O no hydrogen 3.494 N/A HIS 51.A ND1 SER 50.A OG no hydrogen 2.663 N/A VAL 52.A N VAL 95.A O no hydrogen 2.983 N/A PHE 53.A N LEU 5.A O no hydrogen 2.637 N/A ASN 54.A N ILE 97.A O no hydrogen 2.791 N/A ASN 54.A ND2 ASN 98.A OD1 no hydrogen 2.482 N/A ALA 55.A N TYR 7.A O no hydrogen 2.854 N/A ALA 56.A N ASN 54.A OD1 no hydrogen 3.054 N/A CYS 67.A N ASP 65.A OD2 no hydrogen 3.453 N/A CYS 67.A SG ASP 65.A OD2 no hydrogen 3.664 N/A HIS 70.A N CYS 67.A O no hydrogen 3.103 N/A HIS 70.A ND1 ASP 65.A OD2 no hydrogen 3.056 N/A LYS 71.A N CYS 67.A O no hydrogen 2.780 N/A VAL 72.A N GLU 68.A O no hydrogen 2.759 N/A GLU 73.A N SER 69.A O no hydrogen 3.158 N/A THR 74.A N HIS 70.A O no hydrogen 3.206 N/A THR 74.A N LYS 71.A O no hydrogen 3.066 N/A THR 74.A OG1 HIS 70.A O no hydrogen 2.932 N/A ILE 75.A N LYS 71.A O no hydrogen 3.072 N/A ARG 76.A N VAL 72.A O no hydrogen 2.972 N/A THR 77.A OG1 ASN 78.A OD1 no hydrogen 3.347 N/A ASN 78.A N THR 74.A O no hydrogen 2.689 N/A VAL 79.A N ILE 75.A O no hydrogen 3.205 N/A ALA 80.A N ILE 75.A O no hydrogen 2.858 N/A GLY 81.A N ARG 76.A O no hydrogen 2.949 N/A THR 82.A N THR 77.A O no hydrogen 3.221 N/A THR 82.A OG1 THR 77.A O no hydrogen 3.085 N/A THR 82.A OG1 ASN 78.A O no hydrogen 2.774 N/A LEU 83.A N VAL 79.A O no hydrogen 2.853 N/A THR 84.A N ALA 80.A O no hydrogen 2.901 N/A THR 84.A OG1 ALA 80.A O no hydrogen 2.887 N/A LEU 85.A N GLY 81.A O no hydrogen 2.882 N/A ALA 86.A N THR 82.A O no hydrogen 2.900 N/A ASP 87.A N LEU 83.A O no hydrogen 3.042 N/A ILE 88.A N THR 84.A O no hydrogen 3.158 N/A CYS 89.A N LEU 85.A O no hydrogen 3.061 N/A CYS 89.A SG LEU 85.A O no hydrogen 3.289 N/A ARG 90.A N ALA 86.A O no hydrogen 2.886 N/A GLU 91.A N ASP 87.A O no hydrogen 2.878 N/A LYS 92.A N ILE 88.A O no hydrogen 3.072 N/A GLY 93.A N ARG 90.A O no hydrogen 3.038 N/A LEU 94.A N CYS 89.A O no hydrogen 2.743 N/A LEU 96.A N ASN 148.A O no hydrogen 3.144 N/A ILE 97.A N VAL 52.A O no hydrogen 2.855 N/A ASN 98.A N CYS 150.A O no hydrogen 2.926 N/A TYR 99.A N ASN 54.A O no hydrogen 3.271 N/A TYR 99.A OH SER 195.A OG no hydrogen 2.508 N/A ALA 100.A N LEU 152.A O no hydrogen 2.723 N/A GLY 102.A N VAL 154.A O no hydrogen 3.088 N/A CYS 103.A N THR 101.A OG1 no hydrogen 2.956 N/A GLU 106.A N ASN 126.A OD1 no hydrogen 2.644 N/A TYR 107.A N ASN 243.A O no hydrogen 2.959 N/A TYR 107.A OH PRO 182.A O no hydrogen 2.841 N/A ASP 108.A N HIS 111.A O no hydrogen 3.147 N/A GLY 110.A N ASP 108.A OD2 no hydrogen 3.032 N/A HIS 111.A N ASP 108.A O no hydrogen 3.060 N/A HIS 111.A N ASP 108.A OD2 no hydrogen 2.579 N/A HIS 111.A ND1 ASP 108.A OD2 no hydrogen 2.516 N/A SER 115.A N PRO 112.A O no hydrogen 3.074 N/A SER 115.A OG PRO 112.A O no hydrogen 2.869 N/A ILE 117.A N SER 115.A OG no hydrogen 2.958 N/A PHE 119.A N GLU 245.A O no hydrogen 2.923 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.473 N/A ASP 123.A N LYS 120.A O no hydrogen 3.102 N/A ASN 126.A ND2 GLU 106.A O no hydrogen 2.744 N/A PHE 127.A N ILE 104.A O no hydrogen 3.169 N/A SER 133.A OG CYS 103.A O no hydrogen 3.438 N/A SER 133.A OG PHE 127.A O no hydrogen 2.524 N/A LYS 134.A N SER 130.A O no hydrogen 2.948 N/A LYS 134.A NZ THR 128.A O no hydrogen 3.232 N/A LYS 134.A NZ GLY 129.A O no hydrogen 3.452 N/A THR 135.A N PHE 131.A O no hydrogen 2.887 N/A THR 135.A OG1 PHE 131.A O no hydrogen 2.818 N/A LYS 136.A N TYR 132.A O no hydrogen 2.973 N/A ALA 137.A N SER 133.A O no hydrogen 3.155 N/A MET 138.A N LYS 134.A O no hydrogen 2.960 N/A VAL 139.A N THR 135.A O no hydrogen 3.066 N/A GLU 140.A N LYS 136.A O no hydrogen 2.903 N/A GLU 141.A N ALA 137.A O no hydrogen 2.802 N/A LEU 142.A N MET 138.A O no hydrogen 2.906 N/A LEU 143.A N VAL 139.A O no hydrogen 2.763 N/A LYS 144.A N GLU 141.A O no hydrogen 3.175 N/A ASN 145.A N LEU 142.A O no hydrogen 2.936 N/A ASN 145.A ND2 LEU 142.A O no hydrogen 3.002 N/A TYR 146.A N LEU 143.A O no hydrogen 2.999 N/A ASN 148.A ND2 ALA 86.A O no hydrogen 3.681 N/A ASN 148.A ND2 LEU 94.A O no hydrogen 2.702 N/A VAL 149.A N TYR 146.A O no hydrogen 3.034 N/A CYS 150.A N LEU 96.A O no hydrogen 2.818 N/A CYS 150.A SG GLY 205.A O no hydrogen 4.037 N/A THR 151.A N GLY 205.A O no hydrogen 3.019 N/A LEU 152.A N ASN 98.A O no hydrogen 2.844 N/A ARG 153.A N TYR 207.A O no hydrogen 2.930 N/A ARG 153.A NE GLU 140.A OE1 no hydrogen 2.852 N/A ARG 153.A NE GLU 140.A OE2 no hydrogen 3.381 N/A ARG 153.A NH1 LYS 120.A O no hydrogen 3.072 N/A ARG 153.A NH1 ASN 208.A OD1 no hydrogen 2.890 N/A ARG 153.A NH2 GLU 121.A O no hydrogen 2.929 N/A ARG 153.A NH2 GLU 140.A OE2 no hydrogen 2.900 N/A VAL 154.A N ALA 100.A O no hydrogen 2.858 N/A ARG 155.A N THR 186.A OG1 no hydrogen 2.983 N/A ARG 155.A NE SER 184.A O no hydrogen 3.376 N/A ARG 155.A NH1 SER 242.A O no hydrogen 3.119 N/A ARG 155.A NH2 ASN 183.A OD1 no hydrogen 2.247 N/A ILE 158.A N THR 186.A O no hydrogen 2.978 N/A SER 159.A OG ASP 189.A OD2 no hydrogen 3.561 N/A SER 160.A N ASP 189.A OD2 no hydrogen 2.876 N/A SER 160.A OG ASP 189.A OD1 no hydrogen 2.943 N/A ASP 161.A N SER 159.A OG no hydrogen 2.894 N/A THR 163.A N ASP 161.A OD2 no hydrogen 3.363 N/A THR 163.A OG1 ASP 161.A OD2 no hydrogen 2.456 N/A ASN 164.A N ASP 161.A O no hydrogen 3.440 N/A ARG 166.A N ASN 164.A OD1 no hydrogen 2.694 N/A ASN 167.A N ASN 164.A O no hydrogen 2.809 N/A ASN 167.A ND2 SER 159.A O no hydrogen 2.808 N/A ASN 167.A ND2 ASP 161.A O no hydrogen 3.209 N/A PHE 168.A N PRO 157.A O no hydrogen 3.212 N/A ILE 169.A N ASN 167.A OD1 no hydrogen 3.039 N/A LYS 171.A N ASN 167.A O no hydrogen 3.144 N/A ILE 172.A N PHE 168.A O no hydrogen 3.130 N/A ALA 173.A N ILE 169.A O no hydrogen 2.700 N/A ARG 174.A N LYS 171.A O no hydrogen 2.858 N/A TYR 175.A N ILE 172.A O no hydrogen 3.319 N/A VAL 178.A N LYS 235.A O no hydrogen 3.254 N/A ILE 181.A N HIS 217.A ND1 no hydrogen 2.879 N/A ASN 183.A N VAL 215.A O no hydrogen 2.858 N/A ASN 183.A ND2 ILE 181.A O no hydrogen 2.967 N/A ASN 183.A ND2 ASN 243.A OD1 no hydrogen 2.774 N/A SER 184.A N ASN 244.A O no hydrogen 3.038 N/A SER 184.A OG GLY 213.A O no hydrogen 3.442 N/A THR 186.A N ARG 155.A O no hydrogen 2.960 N/A THR 186.A OG1 ARG 155.A O no hydrogen 3.058 N/A THR 186.A OG1 PHE 209.A O no hydrogen 2.897 N/A ILE 187.A N ASN 211.A OD1 no hydrogen 2.860 N/A LEU 188.A N ILE 158.A O no hydrogen 2.909 N/A GLU 190.A N ILE 187.A O no hydrogen 3.007 N/A LEU 191.A N ILE 187.A O no hydrogen 2.811 N/A LEU 192.A N LEU 188.A O no hydrogen 2.833 N/A SER 195.A N LEU 191.A O no hydrogen 3.000 N/A SER 195.A OG TYR 99.A OH no hydrogen 2.508 N/A SER 195.A OG LEU 192.A O no hydrogen 2.790 N/A ILE 196.A N LEU 192.A O no hydrogen 3.297 N/A GLU 197.A N PRO 193.A O no hydrogen 3.268 N/A MET 198.A N ILE 194.A O no hydrogen 2.929 N/A MET 198.A N SER 195.A O no hydrogen 3.219 N/A ALA 199.A N SER 195.A O no hydrogen 3.258 N/A LYS 200.A N ILE 196.A O no hydrogen 3.108 N/A LYS 200.A NZ GLN 24.A OE1 no hydrogen 3.244 N/A LYS 200.A NZ GLU 197.A OE2 no hydrogen 3.485 N/A ARG 201.A N GLU 197.A O no hydrogen 2.972 N/A ARG 201.A N MET 198.A O no hydrogen 3.147 N/A ARG 201.A NH1 GLU 254.A O no hydrogen 2.947 N/A ARG 201.A NH1 GLU 254.A OE2 no hydrogen 2.678 N/A ASN 202.A N ALA 199.A O no hydrogen 2.823 N/A LEU 203.A N MET 198.A O no hydrogen 2.960 N/A GLY 205.A N VAL 149.A O no hydrogen 3.065 N/A TYR 207.A N THR 151.A O no hydrogen 2.820 N/A ASN 208.A N GLU 121.A OE2 no hydrogen 3.174 N/A ASN 208.A ND2 PHE 119.A O no hydrogen 2.739 N/A ASN 208.A ND2 ASP 247.A O no hydrogen 2.847 N/A PHE 209.A N ARG 153.A O no hydrogen 2.950 N/A ASN 211.A N MET 185.A O no hydrogen 2.851 N/A ASN 211.A ND2 GLU 190.A OE1 no hydrogen 2.783 N/A ASN 211.A ND2 MET 259.A O no hydrogen 2.927 N/A VAL 215.A N ASN 183.A O no hydrogen 3.073 N/A SER 216.A N GLU 219.A OE2 no hydrogen 2.824 N/A SER 216.A OG ASP 180.A OD1 no hydrogen 2.874 N/A SER 216.A OG GLU 219.A OE2 no hydrogen 3.418 N/A ASN 218.A N ASP 180.A OD1 no hydrogen 3.139 N/A ASN 218.A ND2 ASN 236.A OD1 no hydrogen 3.374 N/A GLU 219.A N SER 216.A OG no hydrogen 3.163 N/A ILE 220.A N SER 216.A O no hydrogen 3.364 N/A LEU 221.A N HIS 217.A O no hydrogen 2.942 N/A GLU 222.A N ASN 218.A O no hydrogen 2.880 N/A MET 223.A N GLU 219.A O no hydrogen 3.403 N/A TYR 224.A N ILE 220.A O no hydrogen 2.820 N/A ARG 225.A N LEU 221.A O no hydrogen 2.861 N/A ARG 225.A NE ASP 226.A OD1 no hydrogen 2.644 N/A ARG 225.A NH2 ASP 226.A OD1 no hydrogen 3.236 N/A ARG 225.A NH2 ASP 226.A OD2 no hydrogen 3.286 N/A ASP 226.A N GLU 222.A O no hydrogen 3.011 N/A TYR 227.A N MET 223.A O no hydrogen 3.092 N/A ILE 228.A N TYR 224.A O no hydrogen 2.714 N/A ASP 229.A N TYR 224.A O no hydrogen 3.188 N/A PHE 232.A N ASP 229.A O no hydrogen 3.015 N/A TRP 234.A NE1 ASN 218.A OD1 no hydrogen 2.798 N/A ASN 236.A ND2 VAL 178.A O no hydrogen 3.408 N/A ASN 236.A ND2 ASN 218.A OD1 no hydrogen 3.346 N/A SER 242.A OG PHE 105.A O no hydrogen 2.764 N/A ASN 244.A N ASN 183.A OD1 no hydrogen 3.042 N/A ASN 244.A ND2 GLY 102.A O no hydrogen 3.175 N/A ASN 244.A ND2 PHE 105.A O no hydrogen 3.060 N/A LEU 246.A N SER 184.A OG no hydrogen 2.948 N/A ASP 247.A N PHE 119.A O no hydrogen 2.867 N/A THR 249.A N ASP 247.A OD2 no hydrogen 2.941 N/A THR 249.A OG1 ASP 247.A OD2 no hydrogen 2.535 N/A LYS 250.A NZ ILE 206.A O no hydrogen 2.983 N/A LYS 252.A N ALA 248.A O no hydrogen 2.884 N/A LYS 252.A NZ LEU 258.A O no hydrogen 3.138 N/A THR 253.A N THR 249.A O no hydrogen 2.868 N/A THR 253.A OG1 THR 249.A O no hydrogen 3.079 N/A GLU 254.A N LYS 250.A O no hydrogen 3.424 N/A PHE 255.A N LEU 251.A O no hydrogen 2.749 N/A LEU 258.A N PHE 255.A O no hydrogen 2.914 N/A MET 259.A N GLU 190.A OE2 no hydrogen 2.899 N/A SER 260.A N GLU 263.A OE2 no hydrogen 2.999 N/A SER 260.A OG PRO 212.A O no hydrogen 3.458 N/A ILE 261.A N PRO 212.A O no hydrogen 3.152 N/A LYS 262.A NZ GLU 219.A OE1 no hydrogen 2.691 N/A SER 264.A N SER 260.A O no hydrogen 2.693 N/A SER 264.A OG GLU 190.A OE1 no hydrogen 2.501 N/A LEU 265.A N ILE 261.A O no hydrogen 2.422 N/A ILE 266.A N LYS 262.A O no hydrogen 2.921 N/A LYS 267.A N GLU 263.A O no hydrogen 2.940 N/A PHE 268.A N SER 264.A O no hydrogen 2.901 N/A VAL 269.A N LEU 265.A O no hydrogen 2.925 N/A PHE 270.A N LEU 265.A O no hydrogen 2.982 N/A GLU 271.A N ILE 266.A O no hydrogen 2.892 N/A ASN 273.A N PHE 270.A O no hydrogen 3.042 N/A ASN 273.A ND2 SER 160.A O no hydrogen 2.951 N/A