Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mg8_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG ASP 67.A OD1 no hydrogen 2.546 N/A ALA 5.A N SER 3.A OG no hydrogen 3.117 N/A LEU 6.A N SER 3.A O no hydrogen 3.374 N/A SER 7.A N LEU 4.A O no hydrogen 3.074 N/A LEU 8.A N ALA 5.A O no hydrogen 3.279 N/A THR 9.A N GLN 12.A OE1 no hydrogen 3.037 N/A GLN 12.A N THR 9.A OG1 no hydrogen 3.184 N/A MET 13.A N THR 9.A O no hydrogen 2.926 N/A VAL 14.A N ALA 10.A O no hydrogen 2.939 N/A SER 15.A N ASP 11.A O no hydrogen 2.930 N/A SER 15.A OG.A ASP 11.A O no hydrogen 2.818 N/A SER 15.A OG.B GLN 12.A O no hydrogen 3.006 N/A ALA 16.A N GLN 12.A O no hydrogen 2.903 N/A LEU 17.A N MET 13.A O no hydrogen 3.027 N/A LEU 18.A N VAL 14.A O no hydrogen 2.978 N/A ASP 19.A N SER 15.A O no hydrogen 3.028 N/A ALA 20.A N ALA 16.A O no hydrogen 3.074 N/A ALA 20.A N LEU 17.A O no hydrogen 3.120 N/A GLU 21.A N LEU 18.A O no hydrogen 3.261 N/A SER 27.A N ASN 104.A OD1 no hydrogen 2.973 N/A ARG 33.A NH2 ASP 30.A O no hydrogen 3.228 N/A ARG 33.A NH2 THR 32.A O no hydrogen 2.924 N/A SER 36.A N SER 39.A OG no hydrogen 3.095 N/A SER 36.A OG SER 39.A OG no hydrogen 3.201 N/A SER 39.A N SER 36.A OG no hydrogen 2.982 N/A SER 39.A OG SER 36.A O no hydrogen 3.549 N/A SER 39.A OG SER 36.A OG no hydrogen 3.201 N/A MET 40.A N SER 36.A O no hydrogen 2.908 N/A MET 41.A N GLU 37.A O no hydrogen 3.053 N/A GLY 42.A N ALA 38.A O no hydrogen 2.875 N/A LEU 43.A N SER 39.A O no hydrogen 3.031 N/A LEU 44.A N MET 40.A O no hydrogen 2.944 N/A THR 45.A N MET 41.A O no hydrogen 2.879 N/A THR 45.A OG1 MET 41.A O no hydrogen 2.714 N/A THR 45.A OG1 GLY 42.A O no hydrogen 3.243 N/A ASN 46.A N GLY 42.A O no hydrogen 3.001 N/A LEU 47.A N LEU 43.A O no hydrogen 3.052 N/A ALA 48.A N LEU 44.A O no hydrogen 2.839 N/A ASP 49.A N THR 45.A O no hydrogen 2.986 N/A ARG 50.A N ASN 46.A O no hydrogen 3.118 N/A ARG 50.A NE ASN 46.A OD1 no hydrogen 2.829 N/A ARG 50.A NH1 TYR 26.A O no hydrogen 2.863 N/A ARG 50.A NH2 TYR 26.A O no hydrogen 2.818 N/A ARG 50.A NH2 ASN 46.A OD1 no hydrogen 3.044 N/A GLU 51.A N LEU 47.A O no hydrogen 2.892 N/A LEU 52.A N ALA 48.A O no hydrogen 2.932 N/A VAL 53.A N ASP 49.A O no hydrogen 3.377 N/A HIS 54.A N ARG 50.A O no hydrogen 3.488 N/A MET 55.A N GLU 51.A O no hydrogen 2.798 N/A ILE 56.A N LEU 52.A O no hydrogen 2.996 N/A ASN 57.A N VAL 53.A O no hydrogen 3.425 N/A ASN 57.A ND2 VAL 53.A O no hydrogen 3.021 N/A TRP 58.A N HIS 54.A O no hydrogen 2.834 N/A ALA 59.A N MET 55.A O no hydrogen 2.836 N/A LYS 60.A N ILE 56.A O no hydrogen 3.391 N/A ARG 61.A N TRP 58.A O no hydrogen 2.901 N/A ARG 61.A NH1 ASP 19.A OD2 no hydrogen 2.627 N/A VAL 62.A N ALA 59.A O no hydrogen 2.998 N/A PHE 65.A N VAL 62.A O no hydrogen 2.942 N/A ASP 67.A N GLY 64.A O no hydrogen 3.347 N/A LEU 68.A N PHE 65.A O no hydrogen 3.209 N/A ASP 72.A N THR 69.A OG1 no hydrogen 3.128 N/A GLN 73.A N THR 69.A O no hydrogen 2.978 N/A GLN 73.A NE2 PHE 65.A O no hydrogen 3.337 N/A GLN 73.A NE2 LEU 68.A O no hydrogen 3.188 N/A VAL 74.A N LEU 70.A O no hydrogen 2.900 N/A HIS 75.A N HIS 71.A O no hydrogen 2.981 N/A HIS 75.A NE2 GLY 153.A O no hydrogen 2.960 N/A HIS 75.A NE2 THR 156.A OG1 no hydrogen 2.842 N/A LEU 76.A N ASP 72.A O no hydrogen 3.019 N/A LEU 77.A N GLN 73.A O no hydrogen 3.134 N/A GLU 78.A N VAL 74.A O no hydrogen 2.883 N/A TRP 80.A N LEU 77.A O no hydrogen 2.900 N/A ILE 83.A N ALA 79.A O no hydrogen 2.947 N/A LEU 84.A N TRP 80.A O no hydrogen 3.026 N/A MET 85.A N LEU 81.A O no hydrogen 2.890 N/A ILE 86.A N GLU 82.A O no hydrogen 2.915 N/A GLY 87.A N ILE 83.A O no hydrogen 3.206 N/A LEU 88.A N LEU 84.A O no hydrogen 2.903 N/A VAL 89.A N MET 85.A O no hydrogen 2.897 N/A TRP 90.A N ILE 86.A O no hydrogen 2.922 N/A ARG 91.A N GLY 87.A O no hydrogen 2.976 N/A ARG 91.A NE LEU 100.A O no hydrogen 3.025 N/A ARG 91.A NH2 GLU 51.A OE1 no hydrogen 3.201 N/A ARG 91.A NH2 PHE 101.A O no hydrogen 3.142 N/A SER 92.A N LEU 88.A O no hydrogen 3.010 N/A SER 92.A N VAL 89.A O no hydrogen 3.295 N/A SER 92.A OG LEU 88.A O no hydrogen 2.699 N/A MET 93.A N TRP 90.A O no hydrogen 3.226 N/A HIS 95.A N SER 92.A O no hydrogen 2.928 N/A LYS 98.A N HIS 95.A O no hydrogen 2.956 N/A LEU 99.A N LEU 107.A O no hydrogen 2.668 N/A LEU 100.A N SER 92.A OG no hydrogen 2.848 N/A PHE 101.A N LEU 99.A O no hydrogen 3.042 N/A ALA 102.A N LEU 105.A O no hydrogen 3.298 N/A ASN 104.A ND2 SER 27.A O no hydrogen 2.829 N/A LEU 105.A N ALA 102.A O no hydrogen 2.854 N/A LEU 107.A N LEU 99.A O no hydrogen 2.948 N/A ASP 108.A N GLN 111.A OE1 no hydrogen 3.062 N/A ARG 109.A NE ASP 122.A OD1 no hydrogen 3.391 N/A ARG 109.A NE ASP 122.A OD2 no hydrogen 2.747 N/A ARG 109.A NH2 ASP 122.A OD1 no hydrogen 2.892 N/A GLN 111.A N ASP 108.A OD1 no hydrogen 2.970 N/A GLY 112.A N ASP 108.A O no hydrogen 3.232 N/A LYS 113.A N ARG 109.A O no hydrogen 3.272 N/A LYS 113.A N ASN 110.A O no hydrogen 3.083 N/A GLU 115.A N GLU 37.A OE1 no hydrogen 2.698 N/A MET 117.A N VAL 114.A O no hydrogen 3.101 N/A GLU 119.A N GLU 119.A OE1 no hydrogen 2.817 N/A PHE 121.A N MET 117.A O no hydrogen 3.011 N/A ASP 122.A N VAL 118.A O no hydrogen 2.906 N/A MET 123.A N GLU 119.A O no hydrogen 3.178 N/A LEU 124.A N ILE 120.A O no hydrogen 2.953 N/A LEU 125.A N PHE 121.A O no hydrogen 2.795 N/A ALA 126.A N ASP 122.A O no hydrogen 3.034 N/A THR 127.A N MET 123.A O no hydrogen 3.088 N/A THR 127.A OG1 MET 123.A O no hydrogen 2.799 N/A SER 128.A N LEU 124.A O no hydrogen 2.874 N/A SER 129.A N LEU 125.A O no hydrogen 2.895 N/A ARG 130.A N ALA 126.A O no hydrogen 2.916 N/A PHE 131.A N THR 127.A O no hydrogen 2.973 N/A ARG 132.A N SER 128.A O no hydrogen 2.898 N/A MET 133.A N SER 129.A O no hydrogen 2.866 N/A MET 134.A N ARG 130.A O no hydrogen 2.985 N/A MET 134.A N PHE 131.A O no hydrogen 3.166 N/A ASN 135.A N ARG 132.A O no hydrogen 2.913 N/A LEU 136.A N PHE 131.A O no hydrogen 3.122 N/A GLN 137.A N GLU 140.A OE1 no hydrogen 2.985 N/A GLU 139.A N GLU 139.A OE1 no hydrogen 2.777 N/A PHE 141.A N GLN 137.A O no hydrogen 2.905 N/A VAL 142.A N GLY 138.A O no hydrogen 3.009 N/A CYS 143.A N GLU 139.A O no hydrogen 3.425 N/A CYS 143.A SG GLU 139.A O no hydrogen 3.474 N/A LEU 144.A N GLU 140.A O no hydrogen 2.974 N/A LYS 145.A N PHE 141.A O no hydrogen 2.923 N/A LYS 145.A NZ GLU 21.A OE1 no hydrogen 2.537 N/A LYS 145.A NZ GLU 21.A OE2 no hydrogen 3.450 N/A SER 146.A N VAL 142.A O no hydrogen 3.179 N/A SER 146.A OG.A VAL 142.A O no hydrogen 3.205 N/A SER 146.A OG.A CYS 143.A O no hydrogen 2.690 N/A SER 146.A OG.B VAL 142.A O no hydrogen 3.482 N/A ILE 147.A N CYS 143.A O no hydrogen 2.977 N/A ILE 148.A N LEU 144.A O no hydrogen 3.032 N/A LEU 149.A N LYS 145.A O no hydrogen 3.235 N/A LEU 150.A N SER 146.A O no hydrogen 3.104 N/A ASN 151.A N ILE 147.A O no hydrogen 2.709 N/A ASN 151.A ND2 TYR 155.A OH.A no hydrogen 2.490 N/A SER 152.A N ILE 148.A O no hydrogen 3.017 N/A SER 152.A OG GLU 82.A OE1 no hydrogen 2.660 N/A SER 152.A OG GLU 82.A OE2 no hydrogen 3.417 N/A SER 152.A OG ILE 148.A O no hydrogen 3.330 N/A VAL 154.A N ASN 151.A O no hydrogen 3.083 N/A THR 156.A N GLY 153.A O no hydrogen 3.227 N/A THR 156.A OG1 HIS 75.A NE2 no hydrogen 2.842 N/A THR 156.A OG1 GLY 153.A O no hydrogen 3.015 N/A HIS 160.A NE2 GLY 64.A O no hydrogen 2.921 N/A HIS 162.A N LYS 158.A O no hydrogen 2.879 N/A ARG 163.A N ASP 159.A O no hydrogen 3.013 N/A VAL 164.A N HIS 160.A O no hydrogen 2.926 N/A LEU 165.A N ILE 161.A O no hydrogen 2.881 N/A ASP 166.A N HIS 162.A O no hydrogen 2.984 N/A LYS 167.A N ARG 163.A O no hydrogen 3.027 N/A LYS 167.A NZ LEU 6.A O no hydrogen 2.947 N/A LYS 167.A NZ LEU 8.A O no hydrogen 3.044 N/A ILE 168.A N VAL 164.A O no hydrogen 2.972 N/A THR 169.A N LEU 165.A O no hydrogen 2.929 N/A THR 169.A OG1 LEU 165.A O no hydrogen 3.279 N/A ASP 170.A N ASP 166.A O no hydrogen 2.964 N/A THR 171.A N LYS 167.A O no hydrogen 2.993 N/A THR 171.A OG1 LYS 167.A O no hydrogen 2.792 N/A LEU 172.A N ILE 168.A O no hydrogen 2.897 N/A ILE 173.A N THR 169.A O no hydrogen 2.917 N/A HIS 174.A N ASP 170.A O no hydrogen 2.805 N/A HIS 174.A NE2 ASP 11.A OD1 no hydrogen 3.022 N/A LEU 175.A N THR 171.A O no hydrogen 2.926 N/A MET 176.A N LEU 172.A O no hydrogen 3.106 N/A ALA 177.A N ILE 173.A O no hydrogen 2.960 N/A LYS 178.A N HIS 174.A O no hydrogen 2.844 N/A ALA 179.A N LEU 175.A O no hydrogen 2.992 N/A GLY 180.A N ALA 177.A O no hydrogen 2.941 N/A LEU 181.A N MET 176.A O no hydrogen 3.094 N/A THR 182.A N GLN 185.A OE1 no hydrogen 3.013 N/A GLN 185.A N THR 182.A OG1 no hydrogen 3.062 N/A GLN 186.A N THR 182.A O no hydrogen 2.857 N/A GLN 186.A NE2 LEU 181.A O no hydrogen 2.733 N/A HIS 187.A N LEU 183.A O no hydrogen 3.098 N/A GLN 188.A N GLN 184.A O no hydrogen 3.110 N/A ARG 189.A N GLN 185.A O no hydrogen 2.843 N/A ARG 189.A NE GLU 140.A OE2 no hydrogen 2.797 N/A ARG 189.A NH1 MET 134.A O no hydrogen 2.900 N/A ARG 189.A NH2 MET 134.A O no hydrogen 2.823 N/A ARG 189.A NH2 GLU 140.A OE1 no hydrogen 2.971 N/A LEU 190.A N GLN 186.A O no hydrogen 2.847 N/A ALA 191.A N HIS 187.A O no hydrogen 3.015 N/A GLN 192.A N GLN 188.A O no hydrogen 2.948 N/A LEU 193.A N ARG 189.A O no hydrogen 2.943 N/A LEU 194.A N LEU 190.A O no hydrogen 3.029 N/A LEU 195.A N ALA 191.A O no hydrogen 2.867 N/A ILE 196.A N GLN 192.A O no hydrogen 3.365 N/A ILE 196.A N LEU 193.A O no hydrogen 3.100 N/A LEU 197.A N LEU 194.A O no hydrogen 3.091 N/A SER 198.A N LEU 195.A O no hydrogen 3.138 N/A ILE 200.A N ILE 196.A O no hydrogen 2.980 N/A ARG 201.A N LEU 197.A O no hydrogen 3.001 N/A ARG 201.A NH1 SER 152.A O no hydrogen 3.452 N/A ARG 201.A NH2 SER 152.A O no hydrogen 3.151 N/A HIS 202.A N SER 198.A O no hydrogen 3.118 N/A MET 203.A N HIS 199.A O no hydrogen 2.909 N/A SER 204.A N ILE 200.A O no hydrogen 2.939 N/A ASN 205.A N ARG 201.A O no hydrogen 2.945 N/A LYS 206.A N HIS 202.A O no hydrogen 3.015 N/A GLY 207.A N MET 203.A O no hydrogen 2.757 N/A MET 208.A N SER 204.A O no hydrogen 2.825 N/A GLU 209.A N ASN 205.A O no hydrogen 3.234 N/A HIS 210.A N LYS 206.A O no hydrogen 3.002 N/A HIS 210.A NE2 GLU 115.A O no hydrogen 2.733 N/A LEU 211.A N GLY 207.A O no hydrogen 2.909 N/A TYR 212.A N MET 208.A O no hydrogen 3.043 N/A SER 213.A N GLU 209.A O no hydrogen 3.122 N/A SER 213.A OG HIS 210.A O no hydrogen 2.670 N/A MET 214.A N HIS 210.A O no hydrogen 3.043 N/A LYS 215.A N LEU 211.A O no hydrogen 2.818 N/A ASN 217.A N MET 214.A O no hydrogen 3.091 N/A ASN 217.A N LYS 215.A O no hydrogen 2.993 N/A SER 222.A OG ASP 49.A OD1 no hydrogen 2.779 N/A LEU 225.A N SER 222.A OG no hydrogen 3.028 N/A LEU 226.A N SER 222.A O no hydrogen 2.854 N/A GLU 227.A N ASP 223.A O no hydrogen 2.900 N/A MET 228.A N LEU 224.A O no hydrogen 2.943 N/A LEU 229.A N LEU 225.A O no hydrogen 2.949 N/A ASP 230.A N LEU 226.A O no hydrogen 3.003 N/A ALA 231.A N GLU 227.A O no hydrogen 3.172 N/A HIS 232.A N LEU 229.A O no hydrogen 3.078 N/A HIS 232.A NE2 GLU 78.A O no hydrogen 2.828 N/A ARG 233.A N ASP 230.A O no hydrogen 2.739 N/A