Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4inu_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A OG1 GLY 3.A O no hydrogen 2.721 N/A SER 8.A N ARG 12.A O no hydrogen 2.694 N/A SER 8.A OG ARG 12.A O no hydrogen 2.836 N/A GLY 11.A N SER 8.A O no hydrogen 2.866 N/A ARG 12.A N SER 8.A OG no hydrogen 2.946 N/A PHE 14.A N THR 6.A O no hydrogen 3.445 N/A GLU 17.A N LEU 13.A O no hydrogen 2.998 N/A TYR 18.A N PHE 14.A O no hydrogen 2.894 N/A SER 19.A N GLN 15.A O no hydrogen 3.086 N/A SER 19.A OG PHE 130.A O no hydrogen 2.586 N/A LEU 20.A N VAL 16.A O no hydrogen 3.197 N/A GLU 21.A N TYR 18.A O no hydrogen 3.272 N/A ALA 22.A N SER 19.A O no hydrogen 3.222 N/A ILE 23.A N SER 19.A O no hydrogen 3.371 N/A LYS 24.A N LEU 20.A O no hydrogen 3.271 N/A LYS 24.A NZ GLU 21.A OE1 no hydrogen 3.229 N/A LEU 25.A N ALA 22.A O no hydrogen 3.354 N/A GLY 26.A N ILE 23.A O no hydrogen 2.980 N/A THR 28.A N GLU 43.A OE2 no hydrogen 3.418 N/A THR 28.A OG1 GLU 43.A OE2 no hydrogen 3.344 N/A THR 28.A OG1 SER 166.A OG no hydrogen 3.166 N/A ALA 29.A N ILE 164.A O no hydrogen 2.759 N/A ILE 30.A N GLY 41.A O no hydrogen 2.746 N/A GLY 31.A N LYS 162.A O no hydrogen 2.841 N/A ILE 32.A N VAL 39.A O no hydrogen 2.886 N/A ALA 33.A N ASN 160.A O no hydrogen 2.751 N/A THR 34.A N GLY 37.A O no hydrogen 2.900 N/A THR 34.A OG1 GLY 37.A O no hydrogen 2.577 N/A GLY 37.A N THR 34.A OG1 no hydrogen 3.235 N/A VAL 38.A N ILE 214.A O no hydrogen 3.163 N/A VAL 39.A N ILE 32.A O no hydrogen 2.778 N/A LEU 40.A N SER 212.A O no hydrogen 2.715 N/A GLY 41.A N ILE 30.A O no hydrogen 2.837 N/A VAL 42.A N GLN 210.A O no hydrogen 3.108 N/A GLU 43.A N THR 28.A O no hydrogen 2.877 N/A LYS 44.A N ASN 208.A O no hydrogen 2.886 N/A LYS 44.A NZ SER 53.A O no hydrogen 3.104 N/A LYS 44.A NZ ASN 207.A O no hydrogen 3.293 N/A ARG 45.A NE GLU 43.A OE1 no hydrogen 2.984 N/A ARG 45.A NH1 LEU 25.A O no hydrogen 3.041 N/A ARG 45.A NH2 GLY 26.A O no hydrogen 3.397 N/A LEU 51.A N SER 48.A O no hydrogen 3.142 N/A SER 53.A OG ASN 207.A O no hydrogen 3.405 N/A SER 55.A N GLU 52.A O no hydrogen 3.152 N/A SER 55.A OG GLU 52.A O no hydrogen 2.653 N/A ILE 56.A N SER 53.A O no hydrogen 3.369 N/A LYS 58.A NZ SER 27.A OG no hydrogen 2.830 N/A LYS 58.A NZ GLU 43.A O no hydrogen 3.277 N/A LYS 58.A NZ LYS 44.A O no hydrogen 2.799 N/A VAL 60.A N CYS 68.A O no hydrogen 3.046 N/A ILE 62.A N ILE 66.A O no hydrogen 2.965 N/A ASP 63.A N ILE 66.A O no hydrogen 2.873 N/A ARG 64.A N ASP 63.A OD2 no hydrogen 2.801 N/A ARG 64.A NH1 GLN 217.A O no hydrogen 3.376 N/A HIS 65.A NE2 ILE 99.A O no hydrogen 2.738 N/A ILE 66.A N ASP 63.A O no hydrogen 3.185 N/A GLY 67.A N ALA 137.A O no hydrogen 2.832 N/A CYS 68.A N VAL 60.A O no hydrogen 3.090 N/A ALA 69.A N LEU 135.A O no hydrogen 3.212 N/A MET 70.A N LYS 58.A O no hydrogen 3.007 N/A SER 71.A N ALA 133.A O no hydrogen 3.129 N/A SER 71.A OG SER 27.A O no hydrogen 2.652 N/A LEU 73.A N GLY 131.A O no hydrogen 2.758 N/A ASP 76.A N LEU 73.A O no hydrogen 3.176 N/A ALA 77.A N THR 74.A O no hydrogen 3.293 N/A ARG 78.A NH2 GLU 57.A O no hydrogen 3.308 N/A SER 79.A OG ASP 76.A O no hydrogen 3.402 N/A ILE 81.A N ALA 77.A O no hydrogen 2.862 N/A GLU 82.A N ARG 78.A O no hydrogen 3.208 N/A HIS 83.A N SER 79.A O no hydrogen 3.133 N/A HIS 83.A NE2 SER 107.A OG no hydrogen 2.989 N/A ALA 84.A N MET 80.A O no hydrogen 3.015 N/A ARG 85.A N ILE 81.A O no hydrogen 2.803 N/A ARG 85.A NE GLU 61.A O no hydrogen 2.700 N/A ARG 85.A NH2 GLU 61.A O no hydrogen 3.219 N/A THR 86.A N GLU 82.A O no hydrogen 3.061 N/A THR 86.A OG1 GLU 82.A O no hydrogen 2.657 N/A ALA 87.A N HIS 83.A O no hydrogen 2.916 N/A ALA 88.A N ALA 84.A O no hydrogen 3.076 N/A VAL 89.A N ARG 85.A O no hydrogen 3.195 N/A THR 90.A N THR 86.A O no hydrogen 2.690 N/A THR 90.A OG1 THR 86.A O no hydrogen 2.533 N/A HIS 91.A N ALA 87.A O no hydrogen 3.129 N/A HIS 91.A NE2 GLU 97.A OE1 no hydrogen 3.137 N/A ASN 92.A N ALA 88.A O no hydrogen 3.233 N/A ASN 92.A ND2 GLU 97.A O no hydrogen 3.050 N/A LEU 93.A N VAL 89.A O no hydrogen 2.943 N/A TYR 94.A N THR 90.A O no hydrogen 2.999 N/A TYR 95.A N HIS 91.A O no hydrogen 2.938 N/A ASP 96.A N ASN 92.A O no hydrogen 2.991 N/A VAL 101.A N ASP 140.A OD1 no hydrogen 3.074 N/A LEU 104.A N ASN 100.A O no hydrogen 2.875 N/A THR 105.A N VAL 101.A O no hydrogen 3.034 N/A THR 105.A OG1 VAL 101.A O no hydrogen 2.711 N/A GLN 106.A N GLU 102.A O no hydrogen 2.974 N/A SER 107.A N SER 103.A O no hydrogen 3.213 N/A SER 107.A OG HIS 83.A NE2 no hydrogen 2.989 N/A VAL 108.A N LEU 104.A O no hydrogen 3.197 N/A CYS 109.A N THR 105.A O no hydrogen 3.064 N/A CYS 109.A SG THR 105.A O no hydrogen 3.359 N/A CYS 109.A SG THR 155.A O no hydrogen 3.929 N/A LEU 111.A N VAL 108.A O no hydrogen 3.323 N/A ALA 112.A N CYS 109.A O no hydrogen 3.383 N/A ARG 114.A N LEU 111.A O no hydrogen 3.203 N/A ARG 114.A NE ASP 110.A O no hydrogen 2.868 N/A ARG 114.A NH1 GLU 122.A OE1 no hydrogen 3.436 N/A ARG 114.A NH1 GLU 122.A OE2 no hydrogen 3.381 N/A GLY 116.A N MET 126.A O no hydrogen 2.839 N/A ARG 128.A NH1 ASP 76.A OD1 no hydrogen 2.750 N/A ARG 128.A NH1 PRO 129.A O no hydrogen 3.182 N/A ARG 128.A NH2 ASP 76.A OD1 no hydrogen 3.429 N/A ARG 128.A NH2 ASP 76.A OD2 no hydrogen 3.192 N/A GLY 131.A N ASP 76.A OD1 no hydrogen 2.896 N/A ALA 133.A N SER 71.A O no hydrogen 3.054 N/A LEU 134.A N ALA 150.A O no hydrogen 3.016 N/A LEU 135.A N ALA 69.A O no hydrogen 2.779 N/A ALA 137.A N GLY 67.A O no hydrogen 2.694 N/A GLY 138.A N GLN 146.A O no hydrogen 3.098 N/A HIS 139.A N HIS 65.A O no hydrogen 3.089 N/A ASP 140.A N GLY 144.A O no hydrogen 3.317 N/A ASP 142.A N ASP 140.A OD2 no hydrogen 3.113 N/A ASP 143.A N ASP 140.A OD2 no hydrogen 2.832 N/A GLY 144.A N ASP 140.A O no hydrogen 3.072 N/A GLN 146.A N GLY 138.A O no hydrogen 2.845 N/A PHE 148.A N ILE 136.A O no hydrogen 2.713 N/A HIS 149.A N TYR 157.A O no hydrogen 2.792 N/A ALA 150.A N LEU 134.A O no hydrogen 2.812 N/A GLU 151.A N THR 155.A O no hydrogen 3.280 N/A SER 153.A OG THR 155.A OG1 no hydrogen 2.710 N/A GLY 154.A N GLU 151.A O no hydrogen 3.248 N/A THR 155.A OG1 SER 153.A OG no hydrogen 2.710 N/A TYR 157.A N HIS 149.A O no hydrogen 3.314 N/A ARG 158.A NH2 TYR 145.A O no hydrogen 3.357 N/A TYR 159.A N LEU 147.A O no hydrogen 2.853 N/A LYS 162.A N GLY 31.A O no hydrogen 2.871 N/A LYS 162.A NZ TYR 159.A OH no hydrogen 3.322 N/A ALA 163.A N GLN 172.A OE1 no hydrogen 3.083 N/A ILE 164.A N ALA 29.A O no hydrogen 2.881 N/A SER 166.A OG THR 28.A OG1 no hydrogen 3.166 N/A SER 168.A OG GLY 165.A O no hydrogen 3.252 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 2.708 N/A ALA 171.A N GLY 167.A O no hydrogen 3.038 N/A GLN 172.A N SER 168.A O no hydrogen 3.012 N/A GLN 172.A NE2 ALA 161.A O no hydrogen 3.315 N/A GLU 174.A N GLY 170.A O no hydrogen 3.269 N/A LEU 175.A N ALA 171.A O no hydrogen 2.946 N/A LEU 176.A N GLN 172.A O no hydrogen 2.984 N/A GLU 178.A N GLU 174.A O no hydrogen 3.205 N/A TRP 179.A N LEU 175.A O no hydrogen 3.251 N/A TRP 179.A NE1 ALA 33.A O no hydrogen 3.354 N/A HIS 180.A ND1 SER 182.A OG no hydrogen 2.798 N/A SER 182.A N HIS 180.A ND1 no hydrogen 3.363 N/A SER 182.A OG HIS 180.A ND1 no hydrogen 2.798 N/A LEU 183.A N HIS 180.A O no hydrogen 3.401 N/A THR 184.A N GLU 187.A OE1 no hydrogen 2.944 N/A THR 184.A OG1 GLU 187.A OE1 no hydrogen 3.276 N/A LEU 185.A N GLU 36.A OE1 no hydrogen 3.009 N/A GLU 187.A N THR 184.A OG1 no hydrogen 3.285 N/A ALA 188.A N THR 184.A O no hydrogen 3.189 N/A GLU 189.A N LEU 185.A O no hydrogen 3.067 N/A LEU 190.A N LYS 186.A O no hydrogen 3.145 N/A LEU 191.A N GLU 187.A O no hydrogen 3.142 N/A VAL 192.A N ALA 188.A O no hydrogen 2.987 N/A LEU 193.A N GLU 189.A O no hydrogen 3.359 N/A LYS 194.A N LEU 190.A O no hydrogen 2.791 N/A LYS 194.A NZ GLU 178.A OE1 no hydrogen 3.437 N/A ILE 195.A N LEU 191.A O no hydrogen 3.063 N/A LEU 196.A N VAL 192.A O no hydrogen 2.959 N/A GLN 198.A N LYS 194.A O no hydrogen 3.264 N/A GLN 198.A N ILE 195.A O no hydrogen 3.248 N/A GLN 198.A NE2 GLU 174.A OE2 no hydrogen 2.979 N/A VAL 199.A N ILE 195.A O no hydrogen 3.308 N/A MET 200.A N LEU 196.A O no hydrogen 2.992 N/A ASP 205.A N ASN 208.A OD1 no hydrogen 3.157 N/A GLU 206.A N GLU 206.A OE2 no hydrogen 2.951 N/A ASN 208.A N ASP 205.A OD1 no hydrogen 3.235 N/A ASN 208.A ND2 LYS 203.A O no hydrogen 2.879 N/A GLN 210.A N VAL 42.A O no hydrogen 3.313 N/A SER 212.A N LEU 40.A O no hydrogen 2.778 N/A SER 212.A OG LEU 40.A O no hydrogen 3.190 N/A CYS 213.A N LYS 221.A O no hydrogen 3.020 N/A CYS 213.A SG TYR 223.A OH no hydrogen 3.161 N/A ILE 214.A N VAL 38.A O no hydrogen 2.956 N/A THR 215.A N GLY 219.A O no hydrogen 3.305 N/A LYS 216.A N TYR 145.A OH no hydrogen 2.971 N/A GLY 219.A N THR 215.A O no hydrogen 2.914 N/A PHE 220.A N ARG 64.A O no hydrogen 2.897 N/A LYS 221.A N CYS 213.A O no hydrogen 2.854 N/A TYR 223.A N LEU 211.A O no hydrogen 2.985 N/A TYR 223.A OH GLU 189.A OE1 no hydrogen 2.694 N/A THR 228.A N ASP 224.A O no hydrogen 3.090 N/A THR 228.A OG1 ASP 224.A O no hydrogen 3.003 N/A ALA 229.A N ASN 225.A O no hydrogen 3.010 N/A LEU 231.A N THR 228.A O no hydrogen 3.025 N/A ILE 232.A N THR 228.A O no hydrogen 3.024 N/A LYS 233.A N ALA 229.A O no hydrogen 3.183 N/A LYS 233.A NZ GLU 237.A OE2 no hydrogen 2.804 N/A GLU 234.A N GLU 230.A O no hydrogen 3.115 N/A LEU 235.A N LEU 231.A O no hydrogen 2.875 N/A LYS 236.A N ILE 232.A O no hydrogen 2.910 N/A GLU 237.A N LYS 233.A O no hydrogen 3.232 N/A LYS 238.A N GLU 234.A O no hydrogen 3.264 N/A LYS 238.A NZ GLU 234.A OE2 no hydrogen 3.243 N/A GLU 239.A N LEU 235.A O no hydrogen 3.198 N/A ALA 240.A N LYS 236.A O no hydrogen 3.133 N/A