Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bq1_I.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 7.A ND2 ASN 5.A OD1 no hydrogen 2.817 N/A ASP 11.A N ASP 14.A OD2 no hydrogen 3.290 N/A LYS 13.A N ASP 11.A OD1 no hydrogen 3.134 N/A LYS 13.A NZ GLU 16.A OE2 no hydrogen 3.019 N/A LEU 15.A N ASP 12.A O no hydrogen 3.368 N/A VAL 17.A N LYS 13.A O no hydrogen 2.680 N/A TRP 18.A N ASP 14.A O no hydrogen 3.210 N/A ASN 19.A N LEU 15.A O no hydrogen 2.678 N/A ARG 20.A N GLU 16.A O no hydrogen 3.073 N/A LEU 21.A N VAL 17.A O no hydrogen 2.945 N/A THR 22.A OG1 TRP 18.A O no hydrogen 2.189 N/A SER 23.A OG ASN 19.A O no hydrogen 2.859 N/A ASN 24.A N ARG 20.A O no hydrogen 3.070 N/A TRP 26.A NE1 ASP 186.A OD2 no hydrogen 2.776 N/A GLU 29.A N GLU 29.A OE1 no hydrogen 3.053 N/A LYS 30.A N LEU 27.A O no hydrogen 3.164 N/A VAL 31.A N PRO 28.A O no hydrogen 3.363 N/A ASP 36.A N LEU 33.A O no hydrogen 3.103 N/A TRP 40.A N ASP 36.A O no hydrogen 2.793 N/A GLN 41.A N ILE 37.A O no hydrogen 2.940 N/A THR 42.A N ALA 39.A O no hydrogen 3.178 N/A THR 42.A OG1 ALA 39.A O no hydrogen 2.382 N/A LEU 43.A N TRP 40.A O no hydrogen 2.988 N/A SER 44.A N GLU 47.A OE1 no hydrogen 2.640 N/A GLU 47.A N SER 44.A OG no hydrogen 2.875 N/A GLN 48.A N SER 44.A O no hydrogen 2.912 N/A GLN 49.A N ALA 45.A O no hydrogen 3.219 N/A LEU 50.A N ALA 46.A O no hydrogen 3.058 N/A LEU 50.A N GLU 47.A O no hydrogen 3.155 N/A THR 51.A N GLU 47.A O no hydrogen 3.146 N/A THR 51.A OG1 GLU 47.A O no hydrogen 3.184 N/A ILE 52.A N GLN 48.A O no hydrogen 3.150 N/A VAL 54.A N LEU 50.A O no hydrogen 3.067 N/A PHE 55.A N THR 51.A O no hydrogen 3.434 N/A THR 56.A N ILE 52.A O no hydrogen 3.013 N/A THR 56.A OG1 ILE 52.A O no hydrogen 2.637 N/A GLY 57.A N ARG 53.A O no hydrogen 2.905 N/A LEU 58.A N VAL 54.A O no hydrogen 2.711 N/A THR 59.A N PHE 55.A O no hydrogen 2.760 N/A THR 59.A OG1 PHE 55.A O no hydrogen 2.564 N/A LEU 60.A N THR 56.A O no hydrogen 3.328 N/A ASP 62.A N LEU 58.A O no hydrogen 3.232 N/A THR 63.A N THR 59.A O no hydrogen 2.790 N/A THR 63.A OG1 THR 59.A O no hydrogen 2.569 N/A ILE 64.A N LEU 60.A O no hydrogen 2.875 N/A GLN 65.A N LEU 61.A O no hydrogen 3.057 N/A GLN 65.A NE2 GLU 153.A OE2 no hydrogen 2.733 N/A ASN 66.A N ASP 62.A O no hydrogen 3.286 N/A ILE 67.A N THR 63.A O no hydrogen 3.245 N/A ILE 67.A N ILE 64.A O no hydrogen 3.246 N/A ALA 68.A N ILE 64.A O no hydrogen 2.871 N/A GLY 69.A N ILE 64.A O no hydrogen 2.803 N/A ALA 70.A N GLN 65.A O no hydrogen 2.663 N/A SER 72.A OG ALA 68.A O no hydrogen 3.481 N/A SER 72.A OG GLY 69.A O no hydrogen 3.008 N/A LEU 73.A N ALA 70.A O no hydrogen 2.812 N/A MET 74.A N PRO 71.A O no hydrogen 3.153 N/A ASP 76.A N LEU 73.A O no hydrogen 3.430 N/A ALA 77.A N MET 74.A O no hydrogen 3.214 N/A ILE 78.A N GLU 82.A OE1 no hydrogen 3.224 N/A THR 79.A OG1 ASP 14.A OD1 no hydrogen 3.223 N/A THR 79.A OG1 ASP 14.A OD2 no hydrogen 2.916 N/A THR 79.A OG1 HIS 81.A ND1 no hydrogen 3.108 N/A GLU 82.A N THR 79.A O no hydrogen 2.757 N/A LEU 86.A N GLU 82.A O no hydrogen 2.832 N/A SER 87.A N GLU 83.A O no hydrogen 2.883 N/A SER 87.A OG GLU 83.A O no hydrogen 3.361 N/A SER 87.A OG ALA 84.A O no hydrogen 2.502 N/A ASN 88.A N ALA 84.A O no hydrogen 3.284 N/A ILE 89.A N VAL 85.A O no hydrogen 3.051 N/A SER 90.A N LEU 86.A O no hydrogen 2.898 N/A SER 90.A OG SER 87.A O no hydrogen 3.286 N/A PHE 91.A N SER 87.A O no hydrogen 2.984 N/A MET 92.A N ASN 88.A O no hydrogen 2.696 N/A GLU 93.A N ILE 89.A O no hydrogen 2.866 N/A ALA 94.A N PHE 91.A O no hydrogen 2.766 N/A VAL 95.A N PHE 91.A O no hydrogen 3.243 N/A VAL 95.A N MET 92.A O no hydrogen 2.922 N/A HIS 96.A N MET 92.A O no hydrogen 2.919 N/A ALA 97.A N GLU 93.A O no hydrogen 2.769 N/A ARG 98.A N ALA 94.A O no hydrogen 2.859 N/A ARG 98.A NH1 ARG 98.A O no hydrogen 3.347 N/A SER 99.A N VAL 95.A O no hydrogen 3.016 N/A SER 99.A OG VAL 95.A O no hydrogen 2.638 N/A SER 99.A OG HIS 96.A O no hydrogen 3.369 N/A TYR 100.A OH ASP 62.A OD2 no hydrogen 2.816 N/A SER 102.A N ARG 98.A O no hydrogen 2.943 N/A SER 102.A OG ARG 98.A O no hydrogen 2.536 N/A SER 102.A OG SER 99.A O no hydrogen 3.017 N/A ILE 103.A N SER 99.A O no hydrogen 2.663 N/A PHE 104.A N TYR 100.A O no hydrogen 2.463 N/A SER 105.A N SER 101.A O no hydrogen 3.109 N/A THR 106.A OG1 SER 102.A O no hydrogen 2.630 N/A LEU 107.A N ILE 103.A O no hydrogen 2.942 N/A CYS 108.A SG PHE 104.A O no hydrogen 3.340 N/A GLN 109.A N GLU 112.A OE2 no hydrogen 3.386 N/A GLU 112.A N GLN 109.A O no hydrogen 2.931 N/A VAL 113.A N GLN 109.A O no hydrogen 2.834 N/A ASP 114.A N THR 110.A O no hydrogen 3.293 N/A ALA 116.A N GLU 112.A O no hydrogen 3.329 N/A TYR 117.A N VAL 113.A O no hydrogen 2.816 N/A ALA 118.A N ASP 114.A O no hydrogen 3.116 N/A TRP 119.A N ALA 115.A O no hydrogen 3.225 N/A SER 120.A N ALA 116.A O no hydrogen 3.018 N/A SER 120.A OG TYR 117.A O no hydrogen 2.588 N/A GLU 121.A N TYR 117.A O no hydrogen 3.128 N/A GLU 122.A N TRP 119.A O no hydrogen 2.789 N/A ASN 123.A N TRP 119.A O no hydrogen 2.530 N/A GLN 127.A N ASN 123.A O no hydrogen 3.416 N/A ARG 128.A N PRO 124.A O no hydrogen 3.110 N/A LYS 129.A N PRO 125.A O no hydrogen 3.348 N/A LYS 129.A NZ GLU 228.A OE1 no hydrogen 3.483 N/A LYS 129.A NZ GLU 228.A OE2 no hydrogen 2.633 N/A ALA 130.A N LEU 126.A O no hydrogen 3.362 N/A GLN 131.A N GLN 127.A O no hydrogen 2.796 N/A ILE 132.A N ARG 128.A O no hydrogen 2.888 N/A ALA 135.A N GLN 131.A O no hydrogen 2.989 N/A HIS 136.A N ILE 133.A O no hydrogen 3.188 N/A TYR 137.A N ILE 133.A O no hydrogen 2.843 N/A TYR 137.A N LEU 134.A O no hydrogen 3.247 N/A TYR 137.A OH SER 149.A OG no hydrogen 2.798 N/A VAL 138.A N LEU 134.A O no hydrogen 3.106 N/A GLU 141.A N SER 139.A OG no hydrogen 3.200 N/A LYS 145.A NZ SER 72.A O no hydrogen 3.040 N/A LYS 145.A NZ TYR 137.A O no hydrogen 3.380 N/A ILE 147.A N LEU 143.A O no hydrogen 3.373 N/A ALA 148.A N LYS 144.A O no hydrogen 3.156 N/A SER 149.A N LYS 145.A O no hydrogen 3.221 N/A SER 149.A OG GLN 65.A OE1 no hydrogen 2.862 N/A SER 149.A OG TYR 137.A OH no hydrogen 2.798 N/A VAL 150.A N LYS 146.A O no hydrogen 2.711 N/A PHE 151.A N ILE 147.A O no hydrogen 2.716 N/A LEU 152.A N ALA 148.A O no hydrogen 2.782 N/A GLU 153.A N SER 149.A O no hydrogen 2.600 N/A SER 154.A N VAL 150.A O no hydrogen 2.596 N/A SER 154.A OG ASN 259.A OD1 no hydrogen 3.556 N/A LEU 156.A N PHE 151.A O no hydrogen 3.178 N/A LEU 156.A N LEU 152.A O no hydrogen 3.123 N/A TYR 158.A N PHE 155.A O no hydrogen 3.145 N/A SER 159.A OG LEU 156.A O no hydrogen 3.332 N/A SER 159.A OG GLU 228.A OE2 no hydrogen 2.915 N/A PHE 161.A N PHE 157.A O no hydrogen 2.940 N/A TYR 166.A N TRP 162.A O no hydrogen 2.631 N/A PHE 167.A N LEU 163.A O no hydrogen 2.966 N/A SER 168.A N PRO 164.A O no hydrogen 3.384 N/A SER 169.A N MET 165.A O no hydrogen 3.127 N/A SER 169.A N TYR 166.A O no hydrogen 2.905 N/A SER 169.A OG TYR 166.A O no hydrogen 2.776 N/A ARG 170.A N PHE 167.A O no hydrogen 2.665 N/A GLY 171.A N SER 168.A O no hydrogen 3.378 N/A LYS 172.A N PHE 167.A O no hydrogen 3.241 N/A ASN 175.A ND2 ASP 36.A OD1 no hydrogen 2.922 N/A THR 176.A OG1 ASP 36.A OD2 no hydrogen 2.406 N/A ALA 177.A N LEU 173.A O no hydrogen 3.429 N/A ASP 178.A N THR 174.A O no hydrogen 2.838 N/A LEU 179.A N ASN 175.A O no hydrogen 3.308 N/A ILE 180.A N THR 176.A O no hydrogen 3.026 N/A ARG 181.A N ALA 177.A O no hydrogen 2.617 N/A ARG 181.A NE ASP 178.A OD1 no hydrogen 3.241 N/A ARG 181.A NH1 SER 168.A OG no hydrogen 3.184 N/A ARG 181.A NH1 ALA 280.A O no hydrogen 3.125 N/A ARG 181.A NH2 ASP 178.A OD1 no hydrogen 2.887 N/A ILE 184.A N ILE 180.A O no hydrogen 2.832 N/A ARG 185.A N ARG 181.A O no hydrogen 3.004 N/A ARG 185.A NE ASP 186.A OD1 no hydrogen 3.285 N/A ASP 186.A N LEU 182.A O no hydrogen 3.414 N/A ASP 186.A N ILE 183.A O no hydrogen 2.785 N/A GLU 187.A N ILE 183.A O no hydrogen 3.029 N/A ALA 188.A N ILE 184.A O no hydrogen 2.739 N/A HIS 190.A N ASP 186.A O no hydrogen 3.098 N/A GLY 191.A N GLU 187.A O no hydrogen 3.107 N/A TYR 192.A N ALA 188.A O no hydrogen 3.206 N/A TYR 193.A N VAL 189.A O no hydrogen 2.948 N/A TYR 193.A OH ASP 14.A OD1 no hydrogen 2.585 N/A ILE 194.A N HIS 190.A O no hydrogen 3.296 N/A GLY 195.A N GLY 191.A O no hydrogen 3.050 N/A TYR 196.A N TYR 192.A O no hydrogen 2.655 N/A TYR 196.A OH ASP 11.A OD2 no hydrogen 2.729 N/A LYS 197.A N TYR 193.A O no hydrogen 2.691 N/A LYS 197.A NZ ASP 14.A OD1 no hydrogen 3.318 N/A LYS 197.A NZ GLU 82.A OE1 no hydrogen 2.977 N/A TYR 198.A N GLY 195.A O no hydrogen 2.769 N/A TYR 198.A OH TYR 262.A OH no hydrogen 2.534 N/A GLN 199.A N GLY 195.A O no hydrogen 3.064 N/A ILE 200.A N TYR 196.A O no hydrogen 3.222 N/A LEU 202.A N TYR 198.A O no hydrogen 3.026 N/A GLN 203.A N GLN 199.A O no hydrogen 2.916 N/A LEU 205.A N LEU 202.A O no hydrogen 3.047 N/A ARG 210.A NE LEU 202.A O no hydrogen 3.044 N/A ARG 210.A NH2 LEU 202.A O no hydrogen 3.383 N/A ARG 210.A NH2 GLN 203.A O no hydrogen 2.681 N/A GLU 211.A N ILE 208.A O no hydrogen 3.303 N/A LEU 213.A N GLU 209.A O no hydrogen 3.284 N/A LEU 215.A N GLU 211.A O no hydrogen 3.292 N/A PHE 216.A N GLU 212.A O no hydrogen 3.357 N/A ALA 217.A N LEU 213.A O no hydrogen 3.145 N/A ASP 219.A N LEU 215.A O no hydrogen 2.863 N/A LEU 220.A N PHE 216.A O no hydrogen 2.695 N/A LEU 221.A N ALA 217.A O no hydrogen 2.697 N/A MET 222.A N LEU 218.A O no hydrogen 2.627 N/A GLU 223.A N ASP 219.A O no hydrogen 2.875 N/A GLU 223.A N LEU 220.A O no hydrogen 3.024 N/A LEU 224.A N LEU 220.A O no hydrogen 2.837 N/A TYR 225.A N LEU 221.A O no hydrogen 2.627 N/A ASP 226.A N MET 222.A O no hydrogen 3.120 N/A ASN 227.A N GLU 223.A O no hydrogen 2.936 N/A GLU 228.A N LEU 224.A O no hydrogen 2.982 N/A ILE 229.A N TYR 225.A O no hydrogen 2.927 N/A ARG 230.A N ASP 226.A O no hydrogen 3.392 N/A ARG 230.A NH1 ASP 226.A OD2 no hydrogen 2.871 N/A ARG 230.A NH2 ASP 226.A OD2 no hydrogen 3.400 N/A TYR 231.A N ASN 227.A O no hydrogen 2.730 N/A THR 232.A N GLU 228.A O no hydrogen 2.871 N/A THR 232.A OG1 GLU 228.A O no hydrogen 2.807 N/A GLU 233.A N ILE 229.A O no hydrogen 2.888 N/A TYR 236.A N THR 232.A O no hydrogen 3.152 N/A TYR 236.A OH SER 159.A O no hydrogen 3.259 N/A THR 239.A N TYR 236.A O no hydrogen 3.121 N/A THR 239.A OG1 TYR 236.A O no hydrogen 2.614 N/A ASP 244.A N TRP 241.A O no hydrogen 2.629 N/A VAL 245.A N TRP 241.A O no hydrogen 3.246 N/A LYS 246.A N VAL 242.A O no hydrogen 2.724 N/A PHE 248.A N ASP 244.A O no hydrogen 2.950 N/A LEU 249.A N VAL 245.A O no hydrogen 2.916 N/A CYS 250.A SG TYR 225.A OH no hydrogen 3.899 N/A CYS 250.A SG LYS 246.A O no hydrogen 3.132 N/A CYS 250.A SG MET 270.A O no hydrogen 3.657 N/A TYR 251.A N ALA 247.A O no hydrogen 3.182 N/A ASN 252.A N PHE 248.A O no hydrogen 2.777 N/A ASN 252.A ND2 PHE 248.A O no hydrogen 2.465 N/A ALA 253.A N CYS 250.A O no hydrogen 2.924 N/A ASN 254.A N CYS 250.A O no hydrogen 2.953 N/A ASN 254.A ND2 PHE 266.A O no hydrogen 3.139 N/A LYS 255.A N TYR 251.A O no hydrogen 3.137 N/A LYS 255.A NZ TYR 251.A OH no hydrogen 2.777 N/A LEU 257.A N ALA 253.A O no hydrogen 3.259 N/A MET 258.A N ASN 254.A O no hydrogen 2.849 N/A ASN 259.A N ALA 256.A O no hydrogen 3.039 N/A LEU 260.A N LEU 257.A O no hydrogen 2.947 N/A TYR 262.A N LEU 257.A O no hydrogen 3.022 N/A TYR 262.A OH TYR 198.A OH no hydrogen 2.534 N/A LEU 265.A N ASN 254.A OD1 no hydrogen 2.918 N/A MET 270.A N PRO 267.A O no hydrogen 2.740 N/A ALA 271.A N PRO 267.A O no hydrogen 3.386 N/A LEU 278.A N ASN 274.A O no hydrogen 3.173 N/A ALA 279.A N PRO 275.A O no hydrogen 2.647 N/A ALA 280.A N ALA 276.A O no hydrogen 2.892 N/A LEU 281.A N ILE 277.A O no hydrogen 3.113 N/A SER 282.A N ALA 279.A O no hydrogen 3.188 N/A TRP 292.A N GLU 288.A O no hydrogen 2.839 N/A ASN 293.A N GLU 290.A O no hydrogen 2.304 N/A