Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4udd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 SER 6.A OG no hydrogen 3.190 N/A SER 6.A N THR 3.A OG1 no hydrogen 3.122 N/A SER 6.A OG THR 3.A O no hydrogen 2.732 N/A SER 6.A OG THR 3.A OG1 no hydrogen 3.190 N/A LEU 7.A N THR 3.A O no hydrogen 3.239 N/A LEU 8.A N LEU 4.A O no hydrogen 3.126 N/A GLU 9.A N VAL 5.A O no hydrogen 2.933 N/A VAL 10.A N SER 6.A O no hydrogen 3.094 N/A GLU 12.A N GLU 9.A O no hydrogen 3.101 N/A ALA 18.A N ASP 98.A OD1 no hydrogen 2.766 N/A GLY 19.A N ASP 98.A OD2 no hydrogen 2.745 N/A TYR 20.A N ASP 98.A OD2 no hydrogen 3.193 N/A TYR 20.A OH ASP 26.A OD1 no hydrogen 2.663 N/A SER 23.A N ASP 21.A OD1 no hydrogen 3.120 N/A SER 23.A OG ASP 21.A OD1 no hydrogen 2.720 N/A SER 23.A OG ASP 21.A OD2 no hydrogen 3.330 N/A TRP 29.A NE1 SER 218.A O no hydrogen 2.913 N/A ARG 30.A N SER 27.A OG no hydrogen 2.928 N/A ARG 30.A NH1 ASP 21.A O no hydrogen 3.284 N/A ARG 30.A NH1 VAL 24.A O no hydrogen 3.021 N/A ARG 30.A NH1 PRO 25.A O no hydrogen 2.948 N/A ARG 30.A NH2 ASP 21.A O no hydrogen 2.717 N/A ILE 31.A N SER 27.A O no hydrogen 3.142 N/A MET 32.A N THR 28.A O no hydrogen 2.826 N/A THR 33.A N TRP 29.A O no hydrogen 2.974 N/A THR 33.A OG1 TRP 29.A O no hydrogen 2.839 N/A THR 34.A N ARG 30.A O no hydrogen 2.976 N/A THR 34.A OG1 ARG 30.A O no hydrogen 2.768 N/A LEU 35.A N ILE 31.A O no hydrogen 2.877 N/A ASN 36.A N MET 32.A O no hydrogen 2.966 N/A ASN 36.A ND2 GLU 220.A O no hydrogen 3.078 N/A MET 37.A N THR 33.A O no hydrogen 3.120 N/A LEU 38.A N THR 34.A O no hydrogen 2.924 N/A GLY 39.A N LEU 35.A O no hydrogen 2.767 N/A GLY 40.A N ASN 36.A O no hydrogen 3.023 N/A ARG 41.A N.A MET 37.A O no hydrogen 3.396 N/A ARG 41.A N.B MET 37.A O no hydrogen 3.400 N/A ARG 41.A NH1.A TYR 17.A O no hydrogen 2.818 N/A ARG 41.A NH1.B TYR 17.A O no hydrogen 3.032 N/A ARG 41.A NH2.A TYR 17.A O no hydrogen 3.449 N/A ARG 41.A NH2.B TYR 17.A O no hydrogen 3.286 N/A GLN 42.A N LEU 38.A O no hydrogen 2.891 N/A MET 43.A N GLY 39.A O no hydrogen 2.897 N/A ILE 44.A N GLY 40.A O no hydrogen 3.035 N/A ALA 45.A N ARG 41.A O.A no hydrogen 3.113 N/A ALA 45.A N ARG 41.A O.B no hydrogen 3.096 N/A ALA 46.A N GLN 42.A O no hydrogen 2.820 N/A VAL 47.A N MET 43.A O no hydrogen 3.085 N/A VAL 47.A N ILE 44.A O no hydrogen 3.237 N/A LYS 48.A N ILE 44.A O no hydrogen 3.382 N/A TRP 49.A N ALA 45.A O no hydrogen 2.944 N/A ALA 50.A N ALA 46.A O no hydrogen 2.857 N/A LYS 51.A N VAL 47.A O no hydrogen 3.104 N/A ALA 52.A N TRP 49.A O no hydrogen 2.960 N/A ILE 53.A N ALA 50.A O no hydrogen 2.988 N/A PHE 56.A N ILE 53.A O no hydrogen 3.031 N/A ASN 58.A N GLY 55.A O no hydrogen 3.014 N/A LEU 59.A N PHE 56.A O no hydrogen 3.101 N/A HIS 60.A N SER 154.A OG no hydrogen 3.045 N/A ASP 62.A N HIS 60.A ND1 no hydrogen 2.905 N/A ASP 63.A N HIS 60.A O no hydrogen 2.811 N/A GLN 64.A N HIS 60.A O no hydrogen 3.090 N/A GLN 64.A NE2 LEU 59.A O no hydrogen 3.013 N/A MET 65.A N LEU 61.A O no hydrogen 3.152 N/A THR 66.A N ASP 62.A O no hydrogen 3.030 N/A THR 66.A OG1 ASP 62.A O no hydrogen 2.852 N/A LEU 67.A N ASP 63.A O no hydrogen 2.865 N/A LEU 68.A N GLN 64.A O no hydrogen 3.216 N/A GLN 69.A N MET 65.A O no hydrogen 2.967 N/A GLN 69.A NE2 MET 65.A O no hydrogen 3.427 N/A TYR 70.A N THR 66.A O no hydrogen 2.860 N/A TYR 70.A OH ASN 240.A O no hydrogen 2.645 N/A SER 71.A N LEU 67.A O no hydrogen 3.018 N/A SER 71.A OG LEU 67.A O no hydrogen 2.726 N/A TRP 72.A N LEU 68.A O no hydrogen 3.039 N/A SER 74.A N.B SER 71.A O no hydrogen 2.982 N/A LEU 75.A N SER 71.A O no hydrogen 3.036 N/A MET 76.A N TRP 72.A O no hydrogen 3.096 N/A ALA 77.A N MET 73.A O no hydrogen 2.925 N/A PHE 78.A N SER 74.A O.A no hydrogen 2.880 N/A PHE 78.A N SER 74.A O.B no hydrogen 2.831 N/A ALA 79.A N LEU 75.A O no hydrogen 2.964 N/A LEU 80.A N MET 76.A O no hydrogen 2.895 N/A GLY 81.A N ALA 77.A O no hydrogen 2.880 N/A TRP 82.A N PHE 78.A O no hydrogen 2.988 N/A ARG 83.A N ALA 79.A O no hydrogen 2.941 N/A ARG 83.A NE CYS 94.A O.A no hydrogen 3.421 N/A ARG 83.A NE CYS 94.A O.B no hydrogen 3.330 N/A ARG 83.A NH2 PHE 95.A O no hydrogen 2.967 N/A SER 84.A N LEU 80.A O no hydrogen 2.944 N/A SER 84.A OG LEU 80.A O no hydrogen 2.876 N/A TYR 85.A N GLY 81.A O no hydrogen 2.905 N/A TYR 85.A OH VAL 130.A O no hydrogen 2.741 N/A ARG 86.A N TRP 82.A O no hydrogen 2.898 N/A GLN 87.A N ARG 83.A O no hydrogen 2.937 N/A GLN 87.A NE2 GLN 87.A O no hydrogen 3.580 N/A SER 88.A N SER 84.A O no hydrogen 3.137 N/A SER 88.A OG SER 84.A O no hydrogen 2.728 N/A SER 88.A OG LEU 92.A O no hydrogen 3.290 N/A SER 89.A OG TYR 85.A O no hydrogen 3.198 N/A LEU 92.A N SER 88.A OG no hydrogen 3.063 N/A CYS 94.A N.A SER 84.A OG no hydrogen 2.901 N/A CYS 94.A N.B SER 84.A OG no hydrogen 2.879 N/A CYS 94.A SG.A LEU 92.A O no hydrogen 3.617 N/A CYS 94.A SG.B GLN 87.A OE1 no hydrogen 3.993 N/A CYS 94.A SG.B ALA 96.A O no hydrogen 3.940 N/A ALA 96.A N LEU 99.A O no hydrogen 3.297 N/A LEU 99.A N ALA 96.A O no hydrogen 2.903 N/A ILE 101.A N LEU 93.A O no hydrogen 2.896 N/A ASN 102.A N ILE 100.A O no hydrogen 2.941 N/A ARG 105.A N ASN 102.A OD1 no hydrogen 2.833 N/A ARG 105.A NE ASP 26.A OD1 no hydrogen 3.219 N/A ARG 105.A NE ASP 26.A OD2 no hydrogen 2.970 N/A ARG 105.A NH1 ILE 100.A O no hydrogen 2.861 N/A ARG 105.A NH2 ASP 26.A OD1 no hydrogen 3.195 N/A MET 106.A N ASN 102.A O no hydrogen 2.950 N/A THR 107.A N GLN 104.A O no hydrogen 3.306 N/A THR 107.A OG1 GLN 104.A O no hydrogen 2.677 N/A LEU 108.A N ARG 105.A O no hydrogen 3.147 N/A MET 111.A N LEU 108.A O no hydrogen 3.195 N/A GLN 114.A N ASP 110.A O no hydrogen 3.227 N/A CYS 115.A N TYR 112.A O no hydrogen 3.100 N/A CYS 115.A SG MET 111.A O no hydrogen 3.379 N/A LYS 116.A N TYR 112.A O no hydrogen 2.824 N/A LYS 116.A NZ ASP 113.A OD1 no hydrogen 2.816 N/A LEU 119.A N CYS 115.A O no hydrogen 2.836 N/A TYR 120.A N LYS 116.A O no hydrogen 2.944 N/A SER 122.A OG LEU 119.A O no hydrogen 2.879 N/A SER 123.A N LEU 119.A O no hydrogen 2.845 N/A GLU 124.A N TYR 120.A O no hydrogen 2.903 N/A LEU 125.A N VAL 121.A O no hydrogen 3.019 N/A HIS 126.A N SER 122.A O no hydrogen 2.985 N/A ARG 127.A N SER 123.A O no hydrogen 2.867 N/A ARG 127.A NE GLU 124.A OE2 no hydrogen 2.909 N/A ARG 127.A NH2 GLU 124.A OE1 no hydrogen 2.816 N/A LEU 128.A N GLU 124.A O no hydrogen 2.881 N/A GLN 129.A N HIS 126.A O no hydrogen 3.110 N/A GLN 129.A NE2 HIS 126.A O no hydrogen 2.898 N/A VAL 130.A N LEU 125.A O no hydrogen 3.025 N/A SER 131.A N GLU 134.A OE1 no hydrogen 2.867 N/A TYR 132.A OH GLU 9.A OE2 no hydrogen 2.717 N/A GLU 134.A N SER 131.A OG no hydrogen 3.115 N/A TYR 135.A N SER 131.A O no hydrogen 2.863 N/A LEU 136.A N TYR 132.A O no hydrogen 2.952 N/A CYS 137.A N GLU 133.A O no hydrogen 3.231 N/A CYS 137.A SG GLU 133.A O no hydrogen 3.380 N/A MET 138.A N GLU 134.A O no hydrogen 2.850 N/A LYS 139.A N TYR 135.A O no hydrogen 2.852 N/A LYS 139.A NZ GLU 12.A OE1 no hydrogen 2.802 N/A LYS 139.A NZ GLU 12.A OE2 no hydrogen 3.432 N/A THR 140.A N LEU 136.A O no hydrogen 3.250 N/A THR 140.A OG1 LEU 136.A O no hydrogen 3.209 N/A LEU 141.A N CYS 137.A O no hydrogen 3.002 N/A LEU 142.A N MET 138.A O no hydrogen 3.046 N/A LEU 143.A N LYS 139.A O no hydrogen 3.366 N/A LEU 143.A N THR 140.A O no hydrogen 3.095 N/A LEU 144.A N LEU 141.A O no hydrogen 2.976 N/A SER 145.A N LEU 142.A O no hydrogen 3.273 N/A SER 145.A OG LEU 142.A O no hydrogen 2.669 N/A VAL 147.A N LYS 242.A O no hydrogen 3.116 N/A LYS 149.A N ASN 240.A OD1 no hydrogen 3.285 N/A LYS 149.A NZ GLY 239.A O no hydrogen 3.516 N/A LYS 149.A NZ ILE 241.A O no hydrogen 2.808 N/A GLY 151.A N PRO 148.A O no hydrogen 2.884 N/A LEU 152.A N GLN 155.A OE1 no hydrogen 2.854 N/A LYS 153.A N ASP 63.A OD1 no hydrogen 2.920 N/A LYS 153.A NZ ASP 62.A OD2 no hydrogen 2.812 N/A SER 154.A N ASP 63.A OD2 no hydrogen 2.741 N/A SER 154.A OG ASP 63.A OD2 no hydrogen 3.408 N/A GLN 155.A NE2 ASP 159.A OD1 no hydrogen 3.276 N/A GLN 155.A NE2 ASP 159.A OD2 no hydrogen 3.300 N/A PHE 158.A N SER 154.A O no hydrogen 2.806 N/A ASP 159.A N GLN 155.A O no hydrogen 2.918 N/A GLU 160.A N GLU 156.A O no hydrogen 3.127 N/A ILE 161.A N LEU 157.A O no hydrogen 2.831 N/A ARG 162.A N PHE 158.A O no hydrogen 2.762 N/A ARG 162.A NE LEU 144.A O no hydrogen 2.978 N/A MET 163.A N ASP 159.A O no hydrogen 3.005 N/A THR 164.A N GLU 160.A O no hydrogen 2.982 N/A THR 164.A OG1 GLU 160.A O no hydrogen 2.813 N/A TYR 165.A N ILE 161.A O no hydrogen 3.160 N/A TYR 165.A OH PRO 54.A O no hydrogen 2.757 N/A ILE 166.A N ARG 162.A O no hydrogen 3.013 N/A LYS 167.A N MET 163.A O no hydrogen 2.891 N/A GLU 168.A N THR 164.A O no hydrogen 2.929 N/A LEU 169.A N TYR 165.A O no hydrogen 2.895 N/A GLY 170.A N ILE 166.A O no hydrogen 3.018 N/A LYS 171.A N LYS 167.A O no hydrogen 2.939 N/A LYS 171.A NZ GLU 168.A OE2 no hydrogen 2.774 N/A ALA 172.A N GLU 168.A O no hydrogen 3.073 N/A ILE 173.A N LEU 169.A O no hydrogen 3.044 N/A VAL 174.A N GLY 170.A O no hydrogen 3.092 N/A LYS 175.A NZ GLU 133.A OE1 no hydrogen 2.812 N/A LYS 175.A NZ GLU 133.A OE2 no hydrogen 3.389 N/A ARG 176.A N ILE 173.A O no hydrogen 2.957 N/A ARG 176.A NH1 GLN 129.A O no hydrogen 2.893 N/A ARG 176.A NH1 GLU 134.A OE2 no hydrogen 3.369 N/A ARG 176.A NH2 GLN 129.A O no hydrogen 2.912 N/A GLU 177.A N VAL 174.A O no hydrogen 2.988 N/A ASN 179.A N GLN 182.A OE1 no hydrogen 2.900 N/A GLN 182.A N ASN 179.A OD1 no hydrogen 2.820 N/A ASN 183.A N ASN 179.A O no hydrogen 2.905 N/A ASN 183.A ND2 GLY 178.A O no hydrogen 3.478 N/A TRP 184.A N SER 180.A O no hydrogen 3.092 N/A GLN 185.A N SER 181.A O no hydrogen 3.104 N/A ARG 186.A N GLN 182.A O no hydrogen 2.960 N/A ARG 186.A NE GLU 134.A OE2 no hydrogen 2.763 N/A ARG 186.A NH1 LEU 128.A O no hydrogen 2.832 N/A ARG 186.A NH2 LEU 128.A O no hydrogen 2.777 N/A ARG 186.A NH2 GLU 134.A OE1 no hydrogen 2.777 N/A ARG 186.A NH2 GLU 134.A OE2 no hydrogen 3.514 N/A PHE 187.A N ASN 183.A O no hydrogen 2.906 N/A TYR 188.A N TRP 184.A O no hydrogen 2.958 N/A GLN 189.A N GLN 185.A O no hydrogen 2.871 N/A LEU 190.A N ARG 186.A O no hydrogen 2.922 N/A THR 191.A N PHE 187.A O no hydrogen 3.079 N/A THR 191.A OG1 PHE 187.A O no hydrogen 2.657 N/A THR 191.A OG1 TYR 188.A O no hydrogen 3.258 N/A THR 191.A OG1 HIS 247.A NE2 no hydrogen 2.774 N/A LYS 192.A N TYR 188.A O no hydrogen 2.922 N/A LEU 193.A N GLN 189.A O no hydrogen 3.129 N/A LEU 194.A N LEU 190.A O no hydrogen 3.039 N/A ASP 195.A N THR 191.A O no hydrogen 2.976 N/A SER 196.A N.A LYS 192.A O no hydrogen 2.899 N/A SER 196.A N.B LYS 192.A O no hydrogen 2.902 N/A SER 196.A OG.A LEU 193.A O no hydrogen 2.727 N/A SER 196.A OG.B LYS 192.A O no hydrogen 3.220 N/A MET 197.A N LEU 193.A O no hydrogen 3.241 N/A MET 197.A N LEU 194.A O no hydrogen 3.099 N/A HIS 198.A N ASP 195.A O no hydrogen 3.142 N/A HIS 198.A NE2 LEU 244.A O no hydrogen 2.812 N/A VAL 200.A N SER 196.A O.A no hydrogen 3.098 N/A VAL 200.A N SER 196.A O.B no hydrogen 3.100 N/A VAL 201.A N MET 197.A O no hydrogen 2.923 N/A GLU 202.A N HIS 198.A O no hydrogen 3.038 N/A ASN 203.A N GLU 199.A O no hydrogen 3.431 N/A LEU 204.A N VAL 200.A O no hydrogen 3.027 N/A LEU 205.A N VAL 201.A O no hydrogen 2.747 N/A ASN 206.A N GLU 202.A O no hydrogen 2.979 N/A TYR 207.A N ASN 203.A O no hydrogen 3.285 N/A TYR 207.A OH GLN 114.A OE1 no hydrogen 2.651 N/A CYS 208.A N LEU 204.A O no hydrogen 2.879 N/A PHE 209.A N LEU 205.A O no hydrogen 2.779 N/A GLN 210.A N ASN 206.A O no hydrogen 3.117 N/A THR 211.A N TYR 207.A O no hydrogen 3.030 N/A THR 211.A OG1 TYR 207.A O no hydrogen 3.274 N/A THR 211.A OG1 CYS 208.A O no hydrogen 3.101 N/A PHE 212.A N CYS 208.A O no hydrogen 2.898 N/A LEU 213.A N PHE 209.A O no hydrogen 2.904 N/A ASP 214.A N GLN 210.A O no hydrogen 2.869 N/A LYS 215.A NZ PHE 212.A O no hydrogen 2.800 N/A THR 216.A N ASP 214.A OD1 no hydrogen 3.057 N/A THR 216.A OG1 ASP 214.A OD1 no hydrogen 2.686 N/A THR 216.A OG1 ASP 214.A OD2 no hydrogen 3.412 N/A MET 217.A N ASP 214.A O no hydrogen 3.092 N/A SER 218.A N LYS 215.A O no hydrogen 3.293 N/A ALA 226.A N PRO 222.A O no hydrogen 2.920 N/A GLU 227.A N GLU 223.A O no hydrogen 2.891 N/A ILE 228.A N MET 224.A O no hydrogen 3.431 N/A ILE 229.A N LEU 225.A O no hydrogen 2.806 N/A THR 230.A N ALA 226.A O no hydrogen 2.927 N/A THR 230.A OG1 ALA 226.A O no hydrogen 2.818 N/A ASN 231.A N GLU 227.A O no hydrogen 3.134 N/A GLN 232.A N ILE 228.A O no hydrogen 2.908 N/A ILE 233.A N ILE 229.A O no hydrogen 3.063 N/A LYS 235.A NZ ASN 231.A OD1 no hydrogen 3.482 N/A TYR 236.A N GLN 232.A O no hydrogen 3.173 N/A SER 237.A N ILE 233.A O no hydrogen 3.174 N/A ASN 238.A N PRO 234.A O no hydrogen 2.862 N/A ASN 240.A N LYS 235.A O no hydrogen 3.064 N/A ASN 240.A N ASN 238.A OD1 no hydrogen 3.292 N/A LYS 242.A N VAL 147.A O no hydrogen 2.795 N/A LEU 244.A N SER 145.A O no hydrogen 2.812 N/A PHE 246.A N ASP 195.A OD1 no hydrogen 2.812 N/A HIS 247.A N ASP 195.A OD2 no hydrogen 2.886 N/A HIS 247.A NE2 THR 191.A OG1 no hydrogen 2.774 N/A