Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zix_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A OG TYR 9.A OH no hydrogen 3.325 N/A ASP 6.A N GLN 243.A OE1 no hydrogen 2.868 N/A GLY 7.A N ILE 111.A O no hydrogen 2.980 N/A TYR 9.A N ILE 109.A O no hydrogen 2.829 N/A TYR 9.A OH SER 5.A O no hydrogen 2.513 N/A VAL 10.A N LYS 164.A O no hydrogen 2.967 N/A ILE 11.A N GLN 107.A O no hydrogen 2.810 N/A ASP 12.A N ILE 162.A O no hydrogen 2.781 N/A LYS 13.A N LYS 105.A O no hydrogen 2.851 N/A LYS 13.A NZ ASP 161.A OD2 no hydrogen 2.879 N/A GLY 14.A N ASP 12.A OD1 no hydrogen 2.952 N/A TRP 17.A N TYR 103.A O no hydrogen 3.048 N/A TRP 17.A NE1 LYS 13.A O no hydrogen 3.122 N/A ILE 18.A N ARG 152.A O no hydrogen 2.898 N/A LEU 19.A N SER 23.A OG no hydrogen 2.872 N/A SER 23.A N GLY 20.A O no hydrogen 2.991 N/A VAL 24.A N GLU 21.A O no hydrogen 3.112 N/A VAL 25.A N VAL 99.A O no hydrogen 2.756 N/A SER 27.A OG.A TYR 96.A OH no hydrogen 2.672 N/A GLN 28.A N TYR 97.A O no hydrogen 3.029 N/A GLN 28.A NE2.A ILE 29.A O no hydrogen 3.212 N/A LEU 30.A N VAL 95.A O no hydrogen 2.730 N/A ASN 31.A N GLU 34.A OE1 no hydrogen 2.961 N/A ASN 31.A ND2 GLU 34.A OE2 no hydrogen 3.534 N/A ASN 33.A N ALA 89.A O no hydrogen 2.893 N/A ASN 33.A N GLY 90.A O no hydrogen 3.190 N/A GLU 34.A N ASN 31.A O no hydrogen 3.003 N/A THR 35.A OG1 THR 88.A OG1 no hydrogen 2.724 N/A GLY 36.A N THR 87.A O no hydrogen 2.773 N/A THR 37.A OG1 SER 86.A OG no hydrogen 2.822 N/A PHE 38.A N VAL 85.A O no hydrogen 2.907 N/A SER 39.A OG SER 84.A OG no hydrogen 2.656 N/A GLN 40.A N ARG 83.A O no hydrogen 3.184 N/A GLN 40.A NE2 SER 41.A O no hydrogen 3.019 N/A SER 41.A OG GLU 82.A OE1 no hydrogen 3.244 N/A SER 41.A OG GLU 82.A OE2 no hydrogen 2.837 N/A LEU 42.A N ILE 81.A O no hydrogen 2.850 N/A THR 43.A OG1 THR 80.A OG1 no hydrogen 2.686 N/A LYS 44.A N ASN 79.A O no hydrogen 3.129 N/A LYS 46.A N GLU 77.A O no hydrogen 2.932 N/A LYS 46.A NZ GLN 64.A OE1 no hydrogen 2.961 N/A LYS 46.A NZ GLU 77.A OE1.C no hydrogen 3.295 N/A LYS 46.A NZ GLU 77.A OE2.A no hydrogen 2.469 N/A GLU 47.A N TYR 123.A O no hydrogen 3.072 N/A SER 49.A N SER 121.A O no hydrogen 2.804 N/A SER 49.A OG ASN 51.A OD1 no hydrogen 2.848 N/A ASN 51.A N ASP 119.A O no hydrogen 2.857 N/A ASN 51.A ND2 ASP 119.A O no hydrogen 3.696 N/A VAL 52.A N ASP 119.A O no hydrogen 2.957 N/A PHE 54.A N SER 117.A O no hydrogen 2.816 N/A SER 55.A N ASP 118.A OD1 no hydrogen 2.882 N/A SER 55.A OG ASP 118.A OD1 no hydrogen 3.377 N/A SER 55.A OG ASP 118.A OD2 no hydrogen 2.591 N/A PHE 58.A N SER 55.A O no hydrogen 3.169 N/A SER 60.A OG.A GLU 61.A OE1 no hydrogen 3.233 N/A GLU 61.A N GLU 61.A OE1 no hydrogen 2.860 N/A PHE 62.A N THR 59.A OG1 no hydrogen 3.115 N/A ILE 63.A N THR 59.A O no hydrogen 3.007 N/A GLN 64.A N SER 60.A O no hydrogen 3.096 N/A GLN 64.A NE2 GLU 68.A OE2 no hydrogen 2.794 N/A ALA 65.A N GLU 61.A O no hydrogen 2.858 N/A SER 66.A N PHE 62.A O no hydrogen 2.910 N/A SER 66.A OG PHE 62.A O no hydrogen 2.921 N/A VAL 67.A N ILE 63.A O no hydrogen 3.157 N/A GLU 68.A N GLN 64.A O no hydrogen 2.918 N/A TYR 69.A N ALA 65.A O no hydrogen 2.951 N/A GLY 70.A N SER 66.A O no hydrogen 2.905 N/A PHE 71.A N VAL 67.A O no hydrogen 2.967 N/A ILE 73.A N GLU 68.A O no hydrogen 3.216 N/A ILE 75.A N GLU 68.A OE2 no hydrogen 2.753 N/A GLN 78.A NE2.A SER 45.A OG no hydrogen 2.704 N/A ASN 79.A N LYS 44.A O no hydrogen 3.061 N/A ASN 79.A ND2 LEU 125.A O no hydrogen 2.725 N/A THR 80.A OG1 THR 43.A OG1 no hydrogen 2.686 N/A ILE 81.A N LEU 42.A O no hydrogen 2.906 N/A ARG 83.A N GLN 40.A O no hydrogen 3.225 N/A ARG 83.A NH1 GLU 82.A O no hydrogen 2.911 N/A SER 84.A OG SER 39.A OG no hydrogen 2.656 N/A VAL 85.A N PHE 38.A O no hydrogen 2.842 N/A SER 86.A OG THR 37.A OG1 no hydrogen 2.822 N/A THR 87.A N GLY 36.A O no hydrogen 2.804 N/A THR 88.A OG1 THR 35.A OG1 no hydrogen 2.724 N/A ALA 89.A N GLU 34.A O no hydrogen 2.911 N/A GLY 90.A N GLU 93.A OE2 no hydrogen 2.955 N/A TYR 94.A N ALA 135.A O no hydrogen 2.592 N/A VAL 95.A N LEU 30.A O no hydrogen 3.276 N/A TYR 96.A N THR 133.A O no hydrogen 3.003 N/A TYR 96.A OH SER 27.A OG.A no hydrogen 2.672 N/A TYR 97.A N GLN 28.A O no hydrogen 3.042 N/A TYR 97.A OH GLN 28.A OE1.B no hydrogen 2.762 N/A LYS 98.A N SER 131.A O no hydrogen 2.841 N/A LYS 98.A NZ GLU 21.A OE1 no hydrogen 2.711 N/A LYS 98.A NZ GLU 21.A OE2 no hydrogen 3.458 N/A LYS 98.A NZ TYR 100.A OH no hydrogen 3.129 N/A LYS 98.A NZ LEU 146.A O no hydrogen 3.056 N/A VAL 99.A N SER 26.A O no hydrogen 2.784 N/A TYR 100.A N TRP 129.A O no hydrogen 2.843 N/A TYR 100.A OH GLU 21.A OE2 no hydrogen 2.599 N/A TYR 100.A OH LEU 146.A O no hydrogen 2.958 N/A ALA 101.A N SER 23.A O no hydrogen 2.811 N/A THR 102.A N GLY 127.A O no hydrogen 2.841 N/A TYR 103.A N TRP 17.A O no hydrogen 2.752 N/A ARG 104.A N LYS 124.A O no hydrogen 2.826 N/A ARG 104.A NE ASP 12.A OD1 no hydrogen 2.856 N/A ARG 104.A NH2 ASP 12.A OD2 no hydrogen 2.728 N/A LYS 105.A N GLY 14.A O no hydrogen 3.038 N/A LYS 105.A NZ GLU 151.A OE2 no hydrogen 2.719 N/A TYR 106.A N ILE 122.A O no hydrogen 2.897 N/A GLN 107.A N ILE 11.A O no hydrogen 2.795 N/A GLN 107.A NE2 ASP 119.A OD1 no hydrogen 2.941 N/A GLN 107.A NE2 ASP 119.A OD2 no hydrogen 3.534 N/A ALA 108.A N GLY 120.A O no hydrogen 2.812 N/A ILE 109.A N TYR 9.A O no hydrogen 2.825 N/A ARG 110.A N ASP 118.A O no hydrogen 2.852 N/A ARG 110.A NE ASP 168.A OD2 no hydrogen 2.870 N/A ARG 110.A NH1 ASP 118.A OD2 no hydrogen 2.919 N/A ARG 110.A NH2 ASP 168.A OD1 no hydrogen 2.866 N/A ARG 110.A NH2 ASP 168.A OD2 no hydrogen 3.410 N/A ILE 111.A N GLY 7.A O no hydrogen 2.907 N/A SER 112.A N ASN 115.A O no hydrogen 2.838 N/A SER 112.A OG SER 117.A OG no hydrogen 2.823 N/A HIS 113.A N ASP 6.A OD2 no hydrogen 2.819 N/A HIS 113.A ND1 ASP 227.A OD1 no hydrogen 3.192 N/A HIS 113.A ND1 ASP 227.A OD2 no hydrogen 2.667 N/A GLY 114.A N ASP 6.A OD1 no hydrogen 2.711 N/A ASN 115.A N SER 112.A O no hydrogen 3.094 N/A SER 117.A N ARG 110.A O no hydrogen 2.910 N/A SER 117.A OG ARG 110.A O no hydrogen 3.366 N/A SER 117.A OG SER 112.A OG no hydrogen 2.823 N/A SER 117.A OG ASP 118.A OD2 no hydrogen 2.814 N/A ASP 118.A N ARG 110.A O no hydrogen 3.359 N/A ASP 119.A N VAL 52.A O no hydrogen 2.818 N/A GLY 120.A N ALA 108.A O no hydrogen 2.943 N/A SER 121.A N SER 49.A O no hydrogen 2.869 N/A ILE 122.A N TYR 106.A O no hydrogen 2.845 N/A TYR 123.A N GLU 47.A O no hydrogen 2.802 N/A TYR 123.A OH GLU 151.A OE2 no hydrogen 2.715 N/A LYS 124.A N ARG 104.A O no hydrogen 3.005 N/A THR 126.A N THR 102.A O no hydrogen 2.935 N/A THR 126.A OG1 ASP 15.A OD1 no hydrogen 2.703 N/A GLY 127.A N THR 102.A O no hydrogen 3.093 N/A TRP 129.A N TYR 100.A O no hydrogen 2.881 N/A SER 131.A N LYS 98.A O no hydrogen 2.929 N/A THR 133.A N TYR 96.A O no hydrogen 2.997 N/A SER 134.A OG GLU 93.A OE1 no hydrogen 3.467 N/A ALA 135.A N TYR 94.A O no hydrogen 2.962 N/A ASN 140.A N SER 137.A O no hydrogen 3.239 N/A ASN 140.A ND2 ASP 136.A OD1 no hydrogen 2.715 N/A SER 145.A N ASP 142.A OD1 no hydrogen 3.296 N/A SER 145.A OG ASP 142.A O no hydrogen 2.597 N/A LEU 146.A N GLN 143.A O no hydrogen 3.081 N/A ILE 147.A N GLY 144.A O no hydrogen 3.129 N/A GLU 148.A N GLU 21.A OE2 no hydrogen 2.915 N/A ARG 152.A N ILE 18.A O no hydrogen 3.329 N/A ARG 152.A NE GLU 148.A OE1 no hydrogen 2.801 N/A ARG 152.A NH2 GLU 148.A OE1 no hydrogen 3.516 N/A ARG 152.A NH2 GLU 148.A OE2 no hydrogen 3.038 N/A CYS 153.A SG ASP 15.A O no hydrogen 3.409 N/A VAL 154.A N GLY 16.A O no hydrogen 2.827 N/A THR 160.A OG1 ASP 161.A O no hydrogen 3.524 N/A ILE 162.A N ASP 12.A O no hydrogen 3.192 N/A LYS 164.A N VAL 10.A O no hydrogen 2.911 N/A ILE 166.A N LEU 8.A O no hydrogen 2.975 N/A ALA 170.A N ASP 168.A OD1 no hydrogen 3.039 N/A ALA 171.A N ASP 168.A O no hydrogen 3.009 N/A ALA 172.A N LYS 204.A O no hydrogen 2.975 N/A GLU 174.A N ASN 206.A O no hydrogen 3.070 N/A LEU 176.A N HIS 208.A O no hydrogen 2.902 N/A LEU 178.A N THR 210.A O no hydrogen 2.848 N/A ASP 180.A N ASN 177.A OD1 no hydrogen 2.973 N/A ALA 181.A N ASN 177.A O no hydrogen 3.127 N/A LEU 182.A N LEU 178.A O no hydrogen 2.928 N/A ASN 183.A N THR 179.A O no hydrogen 3.012 N/A SER 184.A N ALA 181.A O no hydrogen 3.204 N/A SER 184.A OG ALA 181.A O no hydrogen 2.659 N/A ASN 185.A N LEU 182.A O no hydrogen 3.343 N/A ALA 187.A N ASN 185.A OD1 no hydrogen 3.244 N/A GLY 188.A N ASN 185.A O no hydrogen 3.018 N/A TYR 191.A N PHE 283.A O no hydrogen 2.796 N/A TRP 193.A N ILE 281.A O no hydrogen 2.831 N/A SER 195.A N TYR 279.A O no hydrogen 2.948 N/A SER 195.A OG ASN 197.A O no hydrogen 2.711 N/A SER 196.A N GLU 174.A OE1 no hydrogen 2.873 N/A ASN 197.A N GLU 174.A OE2 no hydrogen 3.292 N/A ASN 197.A ND2 TYR 199.A OH no hydrogen 3.497 N/A TYR 199.A N TYR 277.A O no hydrogen 2.810 N/A TYR 199.A OH GLU 174.A OE2 no hydrogen 2.579 N/A GLN 203.A N PRO 200.A O no hydrogen 3.062 N/A GLN 203.A NE2 ALA 170.A O no hydrogen 2.902 N/A GLN 203.A NE2 LYS 204.A O no hydrogen 2.991 N/A LYS 204.A NZ ASP 168.A OD2 no hydrogen 2.849 N/A LEU 205.A N MET 267.A O no hydrogen 2.908 N/A ASN 206.A N ALA 172.A O no hydrogen 2.844 N/A LEU 207.A N LEU 265.A O no hydrogen 2.786 N/A HIS 208.A N GLU 174.A O no hydrogen 2.892 N/A LEU 209.A N TYR 263.A O no hydrogen 2.799 N/A THR 210.A N LEU 176.A O no hydrogen 2.908 N/A THR 210.A OG1 GLN 262.A OE1 no hydrogen 2.632 N/A ILE 211.A N GLY 261.A O no hydrogen 3.025 N/A THR 212.A N THR 179.A OG1 no hydrogen 2.810 N/A ALA 213.A N THR 179.A OG1 no hydrogen 3.309 N/A GLN 216.A NE2 THR 214.A O no hydrogen 2.977 N/A TYR 218.A N ILE 256.A O no hydrogen 2.828 N/A ARG 219.A N GLN 284.A O no hydrogen 2.822 N/A ARG 219.A NE ASP 255.A OD1 no hydrogen 2.790 N/A ARG 219.A NH2 ASP 255.A OD2 no hydrogen 3.042 N/A ILE 220.A N VAL 254.A O no hydrogen 3.007 N/A LEU 221.A N LEU 282.A O no hydrogen 2.873 N/A ALA 222.A N HIS 252.A O no hydrogen 2.904 N/A LYS 224.A N ASP 251.A OD1 no hydrogen 3.268 N/A ILE 225.A N SER 223.A OG no hydrogen 3.165 N/A VAL 226.A N SER 223.A O no hydrogen 3.018 N/A ASP 227.A N LYS 268.A O no hydrogen 2.792 N/A PHE 228.A N SER 244.A O no hydrogen 2.948 N/A ASN 229.A N VAL 266.A O no hydrogen 2.923 N/A ASN 229.A ND2 GLU 242.A O no hydrogen 3.273 N/A ASN 229.A ND2 GLN 243.A OE1 no hydrogen 3.213 N/A ILE 230.A N GLU 242.A O no hydrogen 3.012 N/A TYR 231.A N VAL 264.A O no hydrogen 2.876 N/A TYR 231.A OH GLU 165.A OE2 no hydrogen 2.619 N/A SER 232.A N VAL 239.A O no hydrogen 2.829 N/A ASN 233.A N GLN 262.A O no hydrogen 2.738 N/A ASN 237.A N ASN 234.A O no hydrogen 3.165 N/A VAL 239.A N SER 232.A O no hydrogen 3.032 N/A LYS 240.A NZ SER 5.A OG no hydrogen 2.844 N/A LYS 240.A NZ ASP 6.A O no hydrogen 2.698 N/A LYS 240.A NZ GLU 165.A OE1 no hydrogen 2.814 N/A LYS 240.A NZ GLU 165.A OE2 no hydrogen 3.163 N/A LEU 241.A N ILE 230.A O no hydrogen 2.749 N/A GLU 242.A N ILE 230.A O no hydrogen 3.206 N/A GLN 243.A N GLU 242.A OE1 no hydrogen 3.317 N/A GLN 243.A NE2 GLY 4.A O no hydrogen 3.076 N/A SER 244.A N PHE 228.A O no hydrogen 2.837 N/A SER 244.A OG HIS 252.A ND1 no hydrogen 2.647 N/A GLY 246.A N ASP 227.A OD1 no hydrogen 2.895 N/A GLY 248.A N LYS 224.A O no hydrogen 2.896 N/A VAL 249.A N ASP 247.A OD1 no hydrogen 3.001 N/A LYS 250.A N ASP 247.A OD1 no hydrogen 2.955 N/A LYS 250.A NZ ASP 247.A OD2 no hydrogen 2.840 N/A HIS 252.A N ALA 222.A O no hydrogen 3.081 N/A HIS 252.A ND1 SER 244.A OG no hydrogen 2.647 N/A HIS 252.A NE2 SER 223.A O no hydrogen 2.851 N/A HIS 252.A NE2 VAL 226.A O no hydrogen 2.701 N/A VAL 254.A N ILE 220.A O no hydrogen 3.071 N/A ILE 256.A N TYR 218.A O no hydrogen 2.849 N/A LEU 258.A N GLN 216.A O no hydrogen 3.152 N/A ALA 260.A N ASP 259.A OD1 no hydrogen 3.170 N/A GLY 261.A N ILE 211.A O no hydrogen 2.919 N/A GLN 262.A N ASN 234.A OD1 no hydrogen 2.829 N/A TYR 263.A N LEU 209.A O no hydrogen 2.860 N/A TYR 263.A OH ASP 259.A O no hydrogen 2.660 N/A VAL 264.A N TYR 231.A O no hydrogen 2.880 N/A LEU 265.A N LEU 207.A O no hydrogen 2.746 N/A VAL 266.A N ASN 229.A O no hydrogen 2.858 N/A MET 267.A N LEU 205.A O no hydrogen 2.881 N/A LYS 268.A N ASP 227.A O no hydrogen 2.874 N/A LYS 268.A NZ TRP 201.A O no hydrogen 2.929 N/A LYS 268.A NZ ALA 269.A O no hydrogen 2.863 N/A ALA 269.A N TYR 279.A OH no hydrogen 3.044 N/A ASN 270.A N ILE 225.A O no hydrogen 2.671 N/A ASN 270.A ND2 LYS 224.A O no hydrogen 3.537 N/A ASN 270.A ND2 ASP 227.A OD1 no hydrogen 2.801 N/A SER 271.A OG ASN 270.A OD1 no hydrogen 2.750 N/A TYR 273.A OH TYR 199.A O no hydrogen 2.823 N/A TYR 277.A N TYR 199.A O no hydrogen 3.010 N/A TYR 279.A N SER 195.A OG no hydrogen 2.857 N/A TYR 279.A OH GLN 203.A O no hydrogen 2.633 N/A ILE 281.A N TRP 193.A O no hydrogen 2.971 N/A LEU 282.A N LEU 221.A O no hydrogen 2.925 N/A PHE 283.A N TYR 191.A O no hydrogen 2.891 N/A GLN 284.A N ARG 219.A O no hydrogen 2.909 N/A LYS 285.A N ASN 189.A O no hydrogen 2.880 N/A LYS 285.A NZ GLN 216.A OE1 no hydrogen 2.963 N/A PHE 286.A N LYS 217.A O no hydrogen 2.999 N/A