Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nmb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N LEU 22.A O no hydrogen 2.938 N/A LEU 6.A N LEU 20.A O no hydrogen 2.791 N/A SER 7.A OG GLU 16.A OE1 no hydrogen 2.404 N/A SER 7.A OG HIS 82.A ND1 no hydrogen 3.395 N/A TYR 8.A N ASP 18.A O no hydrogen 2.832 N/A SER 9.A N ALA 81.A O no hydrogen 3.016 N/A LYS 13.A N GLU 109.A OE1 no hydrogen 2.901 N/A LYS 13.A NZ THR 111.A OG1 no hydrogen 3.207 N/A ALA 14.A N SER 11.A O no hydrogen 3.133 N/A THR 17.A N PRO 15.A O no hydrogen 2.925 N/A ASP 18.A N TYR 8.A O no hydrogen 3.398 N/A SER 19.A OG LEU 6.A O no hydrogen 3.308 N/A LEU 20.A N LEU 6.A O no hydrogen 2.942 N/A LEU 22.A N VAL 4.A O no hydrogen 2.919 N/A VAL 24.A N SER 2.A O no hydrogen 3.172 N/A ASP 25.A N TYR 29.A O no hydrogen 3.009 N/A ASN 27.A N ASP 25.A OD1 no hydrogen 2.841 N/A GLY 28.A N ASP 25.A O no hydrogen 3.053 N/A TYR 29.A N ASP 25.A OD1 no hydrogen 3.056 N/A TYR 29.A OH GLU 88.A OE2 no hydrogen 2.584 N/A ILE 30.A N VAL 249.A O no hydrogen 2.831 N/A THR 31.A N PRO 23.A O no hydrogen 2.907 N/A ILE 32.A N ILE 247.A O no hydrogen 2.917 N/A GLU 36.A N ASP 34.A OD1 no hydrogen 2.773 N/A THR 37.A N ASP 34.A OD1 no hydrogen 2.708 N/A THR 37.A OG1 ASP 34.A OD2 no hydrogen 2.867 N/A ASN 39.A N THR 37.A OG1 no hydrogen 2.962 N/A TRP 41.A N PHE 38.A O no hydrogen 2.869 N/A TRP 41.A NE1 ILE 32.A O no hydrogen 3.043 N/A ARG 42.A N ILE 79.A O no hydrogen 3.069 N/A ARG 42.A NE SER 9.A O no hydrogen 2.941 N/A ARG 42.A NH1 LYS 46.A O no hydrogen 2.932 N/A ARG 42.A NH1 GLU 109.A OE2 no hydrogen 2.757 N/A ARG 42.A NH2 SER 9.A OG no hydrogen 3.094 N/A ARG 42.A NH2 GLU 109.A OE1 no hydrogen 3.053 N/A ARG 42.A NH2 GLU 109.A OE2 no hydrogen 3.352 N/A GLY 43.A N ARG 48.A O no hydrogen 2.953 N/A TYR 44.A N ASP 77.A O no hydrogen 2.891 N/A TYR 44.A OH GLN 108.A O no hydrogen 3.297 N/A TYR 44.A OH GLU 122.A O no hydrogen 2.718 N/A GLY 45.A N GLU 109.A OE2 no hydrogen 2.924 N/A LYS 46.A N GLY 43.A O no hydrogen 2.859 N/A LYS 46.A NZ GLY 75.A O no hydrogen 3.293 N/A ARG 48.A NH1 ASP 74.A OD1 no hydrogen 2.801 N/A ARG 48.A NH2 ASP 74.A OD1 no hydrogen 3.499 N/A ARG 48.A NH2 ASP 74.A OD2 no hydrogen 2.727 N/A THR 51.A N ASP 74.A OD2 no hydrogen 2.825 N/A THR 51.A OG1 ASP 74.A OD2 no hydrogen 2.745 N/A LYS 52.A N ASP 74.A O no hydrogen 3.035 N/A LYS 52.A NZ SER 65.A OG no hydrogen 3.073 N/A LYS 52.A NZ ASP 72.A O no hydrogen 2.714 N/A TRP 53.A N PRO 50.A O no hydrogen 2.921 N/A TRP 53.A NE1 GLY 76.A O no hydrogen 2.845 N/A THR 54.A N LYS 61.A O no hydrogen 2.901 N/A GLU 56.A N CYS 59.A O no hydrogen 3.044 N/A CYS 59.A N GLU 56.A O no hydrogen 2.940 N/A CYS 59.A SG ASP 57.A O no hydrogen 3.465 N/A ILE 60.A N PHE 244.A O no hydrogen 2.931 N/A LYS 61.A N THR 54.A O no hydrogen 2.865 N/A LYS 61.A NZ ASN 63.A OD1 no hydrogen 3.142 N/A PHE 62.A N VAL 242.A O no hydrogen 2.930 N/A ASN 63.A N LYS 52.A O no hydrogen 2.754 N/A ASN 63.A ND2 LYS 52.A O no hydrogen 2.951 N/A ASN 63.A ND2 THR 54.A OG1 no hydrogen 3.001 N/A GLY 64.A N ASP 241.A OD1 no hydrogen 3.006 N/A GLY 66.A N GLY 239.A O no hydrogen 2.817 N/A ALA 70.A N GLY 67.A O no hydrogen 3.060 N/A GLN 71.A NE2 ASP 77.A OD2 no hydrogen 2.793 N/A GLN 71.A NE2 ASP 237.A O no hydrogen 3.036 N/A GLY 76.A N ASP 237.A OD2 no hydrogen 2.789 N/A LEU 78.A N LEU 235.A O no hydrogen 2.996 N/A ILE 79.A N ARG 42.A O no hydrogen 2.875 N/A PHE 80.A N ILE 233.A O no hydrogen 3.000 N/A ALA 81.A N GLY 40.A O no hydrogen 2.918 N/A HIS 82.A N PHE 80.A O no hydrogen 2.641 N/A HIS 82.A ND1 SER 7.A O no hydrogen 2.582 N/A LYS 83.A N GLU 16.A OE2 no hydrogen 2.822 N/A LYS 83.A NZ.A GLU 16.A OE2 no hydrogen 3.071 N/A LYS 83.A NZ.B ALA 107.A O no hydrogen 2.737 N/A PHE 84.A N GLY 231.A O no hydrogen 2.951 N/A PHE 87.A N VAL 177.A O no hydrogen 2.889 N/A GLU 88.A N LYS 250.A O no hydrogen 2.870 N/A LEU 89.A N ILE 176.A O no hydrogen 2.896 N/A GLU 90.A N ARG 248.A O no hydrogen 2.876 N/A LEU 91.A N ALA 174.A O no hydrogen 3.000 N/A GLU 92.A N ARG 245.A O no hydrogen 2.930 N/A TRP 93.A N ASN 172.A O no hydrogen 2.865 N/A LYS 94.A N TRP 243.A O no hydrogen 2.915 N/A LYS 94.A NZ GLY 169.A O no hydrogen 3.144 N/A ALA 96.A N ASP 241.A O no hydrogen 3.332 N/A GLY 98.A N ASP 135.A OD2 no hydrogen 2.723 N/A SER 99.A N ALA 96.A O no hydrogen 3.150 N/A SER 99.A OG ALA 96.A O no hydrogen 3.330 N/A SER 99.A OG ASP 241.A O no hydrogen 2.708 N/A ASN 100.A N ASP 240.A OD2 no hydrogen 2.825 N/A SER 101.A N ILE 133.A O no hydrogen 2.815 N/A SER 101.A OG GLN 236.A O no hydrogen 2.734 N/A ILE 103.A N TYR 131.A O no hydrogen 2.793 N/A LEU 104.A N GLY 234.A O no hydrogen 2.949 N/A TYR 105.A N PRO 129.A O no hydrogen 3.267 N/A TYR 105.A OH HIS 184.A NE2 no hydrogen 2.639 N/A TYR 105.A OH TYR 194.A OH no hydrogen 2.807 N/A ALA 107.A N PHE 232.A O no hydrogen 3.058 N/A GLN 108.A N SER 127.A OG no hydrogen 3.189 N/A VAL 110.A N TYR 44.A OH no hydrogen 3.349 N/A SER 112.A N VAL 120.A O no hydrogen 2.826 N/A SER 112.A OG GLU 122.A OE2 no hydrogen 2.688 N/A LYS 113.A NZ ASP 119.A OD1 no hydrogen 3.182 N/A ASP 114.A N ASN 118.A O no hydrogen 2.982 N/A LYS 115.A NZ ASP 116.A OD1 no hydrogen 3.453 N/A LYS 115.A NZ ASP 116.A OD2 no hydrogen 3.206 N/A ASP 116.A N ASP 114.A OD1 no hydrogen 3.035 N/A GLY 117.A N ASP 114.A O no hydrogen 2.820 N/A ASN 118.A N ASP 114.A OD1 no hydrogen 3.038 N/A VAL 120.A N SER 112.A O no hydrogen 2.590 N/A GLU 122.A N VAL 110.A O no hydrogen 2.881 N/A ILE 126.A N PRO 123.A O no hydrogen 3.212 N/A SER 127.A N ILE 124.A O no hydrogen 3.269 N/A SER 127.A OG GLN 108.A O no hydrogen 3.160 N/A SER 127.A OG ILE 124.A O no hydrogen 3.166 N/A ALA 128.A N ILE 124.A O no hydrogen 3.059 N/A TYR 131.A N ILE 103.A O no hydrogen 2.761 N/A TYR 131.A OH GLY 185.A O no hydrogen 2.847 N/A GLN 132.A N SER 154.A O no hydrogen 3.081 N/A GLN 132.A NE2 ASP 141.A OD2 no hydrogen 3.522 N/A GLN 132.A NE2 ARG 150.A O no hydrogen 2.887 N/A ILE 133.A N SER 101.A O no hydrogen 3.134 N/A ASP 135.A N SER 99.A O no hydrogen 2.981 N/A ASN 136.A ND2 SER 152.A OG no hydrogen 3.028 N/A ALA 137.A N ASP 135.A OD1 no hydrogen 3.155 N/A ASN 138.A N ASP 135.A O no hydrogen 3.389 N/A ASN 138.A ND2 ASP 135.A OD2 no hydrogen 2.987 N/A HIS 139.A N ASP 135.A O no hydrogen 3.146 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 3.154 N/A ALA 142.A N HIS 139.A O no hydrogen 2.965 N/A LYS 143.A N PRO 140.A O no hydrogen 2.906 N/A LEU 144.A N ASP 141.A O no hydrogen 3.172 N/A LYS 146.A N ASN 149.A OD1 no hydrogen 3.015 N/A ASN 149.A N LYS 146.A O no hydrogen 2.827 N/A ARG 150.A NE ASP 157.A OD1 no hydrogen 2.865 N/A ARG 150.A NH1 ASP 141.A OD1 no hydrogen 3.474 N/A ARG 150.A NH2 ASP 157.A OD1 no hydrogen 2.886 N/A GLN 151.A N ASN 148.A O no hydrogen 3.196 N/A GLN 151.A NE2 ALA 142.A O no hydrogen 2.913 N/A SER 152.A N ASN 136.A OD1 no hydrogen 2.837 N/A SER 152.A OG GLN 163.A OE1 no hydrogen 3.322 N/A SER 152.A OG GLN 186.A OE1 no hydrogen 2.667 N/A ALA 153.A N GLN 132.A O no hydrogen 2.717 N/A SER 154.A N GLN 151.A O no hydrogen 3.081 N/A SER 154.A OG ASN 148.A O no hydrogen 3.404 N/A SER 154.A OG GLN 151.A O no hydrogen 2.758 N/A TYR 156.A N GLU 130.A O no hydrogen 3.113 N/A TYR 156.A OH ASP 141.A OD1 no hydrogen 3.348 N/A TYR 156.A OH ASP 141.A OD2 no hydrogen 2.965 N/A ASP 157.A N ASN 149.A O no hydrogen 2.757 N/A ALA 160.A N SER 154.A OG no hydrogen 3.290 N/A VAL 161.A N VAL 191.A O no hydrogen 2.898 N/A GLN 163.A NE2 SER 152.A O no hydrogen 2.794 N/A ASN 164.A ND2 GLN 186.A O no hydrogen 2.937 N/A ASN 164.A ND2 GLU 189.A OE2 no hydrogen 3.105 N/A SER 165.A N GLN 163.A OE1 no hydrogen 3.040 N/A SER 165.A OG LYS 166.A O no hydrogen 2.875 N/A LYS 166.A N ASN 172.A OD1 no hydrogen 2.873 N/A LYS 166.A NZ TRP 171.A O no hydrogen 3.381 N/A LYS 166.A NZ ASN 187.A OD1 no hydrogen 3.122 N/A GLY 169.A N VAL 95.A O no hydrogen 3.027 N/A GLU 170.A N PRO 167.A O no hydrogen 3.375 N/A ASN 172.A N TRP 93.A O no hydrogen 2.780 N/A LYS 173.A N ASN 187.A OD1 no hydrogen 2.812 N/A LYS 173.A NZ ASP 188.A OD1 no hydrogen 3.366 N/A LYS 173.A NZ ASP 188.A OD2 no hydrogen 3.365 N/A ALA 174.A N LEU 91.A O no hydrogen 2.730 N/A LYS 175.A N GLY 185.A O no hydrogen 3.027 N/A LYS 175.A NZ ASN 190.A OD1 no hydrogen 2.475 N/A ILE 176.A N LEU 89.A O no hydrogen 3.039 N/A TYR 178.A N THR 181.A O no hydrogen 2.863 N/A TYR 178.A OH ASP 253.A O no hydrogen 2.676 N/A LYS 179.A N ASN 86.A OD1 no hydrogen 2.835 N/A LYS 179.A NZ TYR 178.A OH no hydrogen 3.449 N/A THR 181.A N TYR 178.A O no hydrogen 3.025 N/A THR 181.A OG1 HIS 195.A ND1 no hydrogen 3.419 N/A VAL 182.A N TYR 194.A O no hydrogen 2.795 N/A HIS 184.A N LEU 192.A O no hydrogen 3.076 N/A HIS 184.A ND1 ALA 153.A O no hydrogen 2.735 N/A HIS 184.A NE2 TYR 105.A OH no hydrogen 2.639 N/A GLY 185.A N LYS 175.A O no hydrogen 2.675 N/A GLN 186.A N GLU 189.A O no hydrogen 2.889 N/A GLN 186.A NE2 GLN 163.A OE1 no hydrogen 3.045 N/A GLN 186.A NE2 ASN 164.A OD1 no hydrogen 2.922 N/A ASN 187.A N LYS 173.A O no hydrogen 2.837 N/A ASN 187.A ND2 ASN 164.A O no hydrogen 3.079 N/A ASN 187.A ND2 ASN 172.A OD1 no hydrogen 2.916 N/A GLU 189.A N GLN 186.A O no hydrogen 3.136 N/A VAL 191.A N HIS 184.A O no hydrogen 2.920 N/A TYR 194.A N VAL 182.A O no hydrogen 2.868 N/A TYR 194.A OH TYR 105.A OH no hydrogen 2.807 N/A HIS 195.A NE2 GLU 193.A OE2 no hydrogen 2.854 N/A LEU 196.A N GLY 180.A O no hydrogen 2.832 N/A TRP 197.A NE1 CYS 224.A O no hydrogen 2.853 N/A THR 198.A OG1 HIS 195.A O no hydrogen 3.528 N/A LYS 199.A NZ ASP 203.A OD2 no hydrogen 3.393 N/A TRP 201.A N THR 198.A OG1 no hydrogen 3.258 N/A TRP 201.A NE1 LEU 221.A O no hydrogen 2.940 N/A THR 202.A N THR 198.A O no hydrogen 3.024 N/A THR 202.A OG1 THR 198.A O no hydrogen 3.484 N/A THR 202.A OG1 ASN 222.A OD1 no hydrogen 2.613 N/A ASP 203.A N LYS 199.A O no hydrogen 2.901 N/A GLN 205.A N THR 202.A O no hydrogen 2.927 N/A GLN 205.A NE2 GLU 211.A OE1 no hydrogen 3.192 N/A ALA 206.A N ASP 203.A O no hydrogen 3.156 N/A SER 207.A N LEU 204.A O no hydrogen 2.997 N/A SER 207.A OG LEU 204.A O no hydrogen 2.681 N/A PHE 209.A N SER 207.A OG no hydrogen 2.879 N/A SER 210.A N SER 207.A O no hydrogen 3.297 N/A GLU 211.A N GLN 205.A OE1 no hydrogen 2.956 N/A LYS 213.A N SER 210.A OG no hydrogen 3.208 N/A TRP 214.A N SER 210.A O no hydrogen 2.937 N/A PHE 218.A N TRP 214.A O no hydrogen 2.919 N/A GLU 219.A N PRO 215.A O no hydrogen 2.952 N/A LEU 220.A N LEU 216.A O no hydrogen 2.977 N/A LEU 221.A N ALA 217.A O no hydrogen 2.920 N/A ASN 222.A N PHE 218.A O no hydrogen 2.904 N/A ASN 223.A N GLU 219.A O no hydrogen 3.430 N/A CYS 224.A SG SER 127.A O no hydrogen 3.859 N/A GLY 226.A N ASN 223.A O no hydrogen 2.902 N/A HIS 229.A N GLY 226.A O no hydrogen 2.945 N/A HIS 229.A NE2 ASN 223.A OD1 no hydrogen 2.829 N/A GLU 230.A N GLY 225.A O no hydrogen 3.031 N/A GLY 231.A N PHE 84.A O no hydrogen 2.878 N/A PHE 232.A N ALA 107.A O no hydrogen 2.931 N/A GLY 234.A N LEU 104.A O no hydrogen 2.772 N/A LEU 235.A N LEU 78.A O no hydrogen 2.677 N/A GLN 236.A N GLY 102.A O no hydrogen 3.065 N/A ASP 237.A N ASP 77.A OD1 no hydrogen 2.905 N/A GLY 239.A N ASP 237.A OD1 no hydrogen 2.883 N/A TRP 243.A N LYS 94.A O no hydrogen 2.899 N/A TRP 243.A NE1 GLU 56.A OE2 no hydrogen 2.971 N/A PHE 244.A N ILE 60.A O no hydrogen 2.872 N/A ARG 245.A N GLU 92.A O no hydrogen 2.992 N/A ARG 245.A NE GLU 92.A OE1 no hydrogen 3.230 N/A ARG 245.A NH2 GLU 92.A OE1 no hydrogen 3.038 N/A ASN 246.A ND2 GLU 92.A OE2 no hydrogen 2.817 N/A ARG 248.A N GLU 90.A O no hydrogen 2.986 N/A ARG 248.A NH1 GLU 90.A OE1 no hydrogen 3.038 N/A ARG 248.A NH2 GLU 90.A OE1 no hydrogen 3.342 N/A VAL 249.A N ILE 30.A O no hydrogen 2.854 N/A LYS 250.A N GLU 88.A O no hydrogen 2.973 N/A LYS 250.A NZ ASN 27.A O no hydrogen 2.806 N/A LEU 252.A N ASN 86.A O no hydrogen 2.972 N/A