Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pdw_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N SER 3.A OG no hydrogen 2.915 N/A VAL 6.A N SER 3.A O no hydrogen 3.313 N/A GLN 7.A N THR 18.A O no hydrogen 2.960 N/A GLN 8.A NE2 THR 10.A OG1 no hydrogen 3.044 N/A ILE 9.A N ILE 16.A O no hydrogen 2.960 N/A THR 10.A OG1 THR 15.A OG1 no hydrogen 2.849 N/A LEU 11.A N SER 14.A O no hydrogen 2.932 N/A SER 14.A N LEU 11.A O no hydrogen 3.062 N/A SER 14.A OG LEU 11.A O no hydrogen 2.719 N/A THR 15.A OG1 THR 10.A OG1 no hydrogen 2.849 N/A ILE 16.A N ILE 9.A O no hydrogen 2.906 N/A THR 18.A N GLN 7.A O no hydrogen 3.048 N/A THR 18.A OG1 THR 189.A OG1 no hydrogen 3.227 N/A GLU 20.A N THR 18.A OG1 no hydrogen 3.347 N/A ALA 21.A N ARG 5.A O no hydrogen 2.811 N/A ALA 24.A N ASN 23.A OD1 no hydrogen 2.804 N/A VAL 25.A N THR 191.A O no hydrogen 2.920 N/A CYS 27.A N VAL 193.A O no hydrogen 3.040 N/A CYS 27.A SG VAL 193.A O no hydrogen 3.308 N/A ALA 29.A N VAL 26.A O no hydrogen 2.697 N/A GLU 30.A N CYS 27.A O no hydrogen 2.987 N/A LEU 35.A N GLU 243.A OE1 no hydrogen 2.923 N/A ASP 39.A N PRO 36.A O no hydrogen 2.987 N/A ALA 40.A N PRO 36.A O no hydrogen 3.208 N/A ALA 40.A N ASP 37.A O no hydrogen 3.117 N/A ASN 44.A ND2 ASP 42.A OD1 no hydrogen 2.959 N/A THR 46.A OG1 GLU 243.A OE2 no hydrogen 3.287 N/A SER 47.A N PHE 244.A O no hydrogen 2.835 N/A LYS 48.A NZ THR 46.A OG1 no hydrogen 2.982 N/A SER 52.A N PRO 49.A O no hydrogen 3.315 N/A VAL 53.A N ASP 50.A O no hydrogen 3.068 N/A CYS 54.A N ASP 50.A O no hydrogen 2.842 N/A CYS 54.A SG THR 242.A OG1 no hydrogen 3.456 N/A ARG 55.A NE ASN 13.A OD1 no hydrogen 3.213 N/A ARG 55.A NH2 ASN 13.A OD1 no hydrogen 3.035 N/A PHE 56.A N SER 14.A OG no hydrogen 2.779 N/A TYR 57.A N ILE 237.A O no hydrogen 2.799 N/A THR 58.A OG1 THR 236.A OG1 no hydrogen 2.959 N/A LEU 59.A N VAL 235.A O no hydrogen 2.938 N/A SER 61.A OG THR 234.A OG1 no hydrogen 2.829 N/A LYS 62.A N ILE 233.A O no hydrogen 2.785 N/A LYS 62.A NZ ARG 145.A O no hydrogen 2.609 N/A TRP 64.A N LEU 231.A O no hydrogen 2.775 N/A THR 65.A N SER 68.A OG no hydrogen 2.795 N/A THR 65.A OG1 SER 68.A OG no hydrogen 3.407 N/A GLY 67.A N THR 65.A OG1 no hydrogen 3.102 N/A SER 68.A N THR 65.A O no hydrogen 3.204 N/A SER 68.A OG THR 63.A O no hydrogen 3.537 N/A SER 68.A OG THR 65.A O no hydrogen 3.318 N/A SER 68.A OG THR 65.A OG1 no hydrogen 3.407 N/A TRP 71.A N VAL 215.A O no hydrogen 2.980 N/A CYS 72.A N ILE 147.A O no hydrogen 2.905 N/A CYS 72.A SG TRP 73.A O no hydrogen 3.777 N/A TRP 73.A N LEU 213.A O no hydrogen 2.775 N/A TRP 73.A NE1 GLU 144.A O no hydrogen 3.113 N/A LYS 74.A NZ HIS 123.A O no hydrogen 3.452 N/A LEU 75.A N VAL 211.A O no hydrogen 2.869 N/A ASP 77.A N ASN 209.A OD1 no hydrogen 3.294 N/A ALA 78.A N LYS 74.A O no hydrogen 2.600 N/A LEU 79.A N PRO 76.A O no hydrogen 2.885 N/A LYS 80.A N ASP 77.A O no hydrogen 2.898 N/A LYS 80.A NZ ASP 77.A OD1 no hydrogen 3.099 N/A LYS 80.A NZ HIS 141.A O no hydrogen 2.967 N/A MET 82.A N LEU 79.A O no hydrogen 2.959 N/A GLY 86.A N MET 82.A O no hydrogen 2.996 N/A GLN 87.A N GLY 83.A O no hydrogen 3.395 N/A ASN 88.A N VAL 84.A O no hydrogen 2.987 N/A ASN 88.A ND2 VAL 84.A O no hydrogen 2.835 N/A MET 89.A N PHE 85.A O no hydrogen 3.108 N/A PHE 90.A N GLY 86.A O no hydrogen 3.426 N/A PHE 90.A N GLN 87.A O no hydrogen 3.234 N/A PHE 91.A N GLN 87.A O no hydrogen 3.118 N/A HIS 92.A N ASN 88.A O no hydrogen 3.195 N/A HIS 92.A ND1 ASN 88.A O no hydrogen 2.885 N/A SER 93.A N GLY 246.A O no hydrogen 2.819 N/A LEU 94.A N SER 245.A O no hydrogen 2.878 N/A GLY 95.A N ASP 203.A O no hydrogen 2.802 N/A ARG 96.A N GLU 243.A O no hydrogen 2.937 N/A ARG 96.A NE PRO 201.A O no hydrogen 2.783 N/A ARG 96.A NH1 GLU 33.A O no hydrogen 2.997 N/A SER 97.A OG GLY 98.A O no hydrogen 2.843 N/A SER 97.A OG THR 242.A OG1 no hydrogen 3.016 N/A GLY 98.A N MET 240.A O no hydrogen 2.981 N/A TYR 99.A N ILE 194.A O no hydrogen 2.815 N/A THR 100.A N ALA 238.A O no hydrogen 2.887 N/A VAL 101.A N ILE 192.A O no hydrogen 2.754 N/A HIS 102.A N THR 236.A O no hydrogen 2.807 N/A HIS 102.A ND1 THR 191.A OG1 no hydrogen 3.004 N/A VAL 103.A N ALA 190.A O no hydrogen 2.926 N/A GLN 104.A N THR 234.A O no hydrogen 2.695 N/A CYS 105.A N ASN 188.A O no hydrogen 2.957 N/A CYS 105.A SG PRO 232.A O no hydrogen 3.582 N/A THR 108.A N HIS 111.A ND1 no hydrogen 3.331 N/A THR 108.A OG1 HIS 111.A ND1 no hydrogen 2.796 N/A PHE 110.A N THR 108.A OG1 no hydrogen 2.994 N/A HIS 111.A N THR 108.A O no hydrogen 3.104 N/A HIS 111.A ND1 THR 108.A OG1 no hydrogen 2.796 N/A SER 112.A N THR 222.A O no hydrogen 3.178 N/A SER 112.A OG THR 222.A OG1 no hydrogen 2.820 N/A CYS 114.A N ALA 219.A O no hydrogen 2.926 N/A LEU 115.A N ILE 182.A O no hydrogen 2.824 N/A LEU 116.A N ILE 216.A O no hydrogen 2.736 N/A VAL 117.A N GLN 180.A O no hydrogen 2.783 N/A VAL 118.A N MET 214.A O no hydrogen 3.013 N/A VAL 119.A N PRO 178.A O no hydrogen 3.126 N/A ILE 120.A N SER 212.A O no hydrogen 2.939 N/A GLU 122.A N ASN 210.A O no hydrogen 2.897 N/A HIS 123.A ND1 SER 212.A OG no hydrogen 2.622 N/A HIS 123.A NE2 ASN 165.A O no hydrogen 2.942 N/A GLN 124.A N GLU 122.A O no hydrogen 3.057 N/A ALA 126.A N MET 166.A O no hydrogen 2.884 N/A SER 127.A OG SER 134.A O no hydrogen 3.569 N/A GLY 130.A N SER 127.A O no hydrogen 3.115 N/A VAL 133.A N GLY 130.A O no hydrogen 3.182 N/A LYS 136.A N GLY 156.A O no hydrogen 2.891 N/A TYR 137.A OH THR 206.A O no hydrogen 3.028 N/A PHE 139.A N LYS 136.A O no hydrogen 2.952 N/A THR 140.A N TYR 137.A O no hydrogen 3.154 N/A THR 140.A OG1 TYR 137.A O no hydrogen 3.282 N/A THR 140.A OG1 HIS 141.A ND1 no hydrogen 3.108 N/A HIS 141.A N THR 138.A O no hydrogen 3.201 N/A HIS 141.A ND1 TYR 137.A O no hydrogen 2.786 N/A HIS 141.A NE2 THR 206.A O no hydrogen 2.860 N/A GLY 143.A N ASP 77.A OD2 no hydrogen 2.732 N/A GLY 146.A N GLY 143.A O no hydrogen 3.231 N/A ILE 147.A N CYS 72.A O no hydrogen 2.707 N/A LEU 149.A N GLY 70.A O no hydrogen 2.875 N/A SER 150.A N ASP 148.A OD1 no hydrogen 2.756 N/A SER 150.A OG ASP 148.A OD1 no hydrogen 2.647 N/A SER 151.A N ASP 148.A O no hydrogen 3.122 N/A SER 151.A OG ASP 148.A O no hydrogen 2.760 N/A GLY 157.A N GLU 154.A O no hydrogen 2.751 N/A VAL 159.A N ALA 126.A O no hydrogen 2.822 N/A LYS 160.A NZ SER 151.A OG no hydrogen 2.641 N/A LYS 160.A NZ ALA 152.A O no hydrogen 2.914 N/A TYR 164.A N ASP 161.A O no hydrogen 2.839 N/A ASN 165.A N VAL 162.A O no hydrogen 3.265 N/A ASN 165.A ND2 THR 169.A OG1 no hydrogen 2.916 N/A ASN 167.A N TYR 164.A O no hydrogen 2.900 N/A GLY 168.A N TYR 164.A O no hydrogen 2.976 N/A THR 169.A N TYR 164.A O no hydrogen 3.361 N/A THR 169.A N ASN 167.A OD1 no hydrogen 3.220 N/A THR 169.A OG1 ASN 167.A OD1 no hydrogen 2.532 N/A LEU 171.A N ILE 163.A O no hydrogen 3.024 N/A ASN 173.A N LEU 170.A O no hydrogen 3.093 N/A LEU 174.A N LEU 171.A O no hydrogen 2.853 N/A ILE 176.A N ASN 173.A O no hydrogen 3.258 N/A PHE 177.A N LEU 174.A O no hydrogen 3.028 N/A HIS 179.A ND1 PHE 177.A O no hydrogen 2.998 N/A GLN 180.A N VAL 117.A O no hydrogen 2.893 N/A ILE 182.A N LEU 115.A O no hydrogen 2.753 N/A LEU 184.A N GLY 113.A O no hydrogen 2.953 N/A THR 186.A N ASN 183.A O no hydrogen 2.589 N/A ASN 187.A N ASN 183.A O no hydrogen 2.615 N/A ASN 188.A ND2 GLU 20.A OE1 no hydrogen 3.504 N/A THR 189.A OG1 THR 18.A OG1 no hydrogen 3.227 N/A ALA 190.A N VAL 103.A O no hydrogen 2.987 N/A THR 191.A N GLN 180.A OE1 no hydrogen 2.705 N/A THR 191.A OG1 HIS 102.A ND1 no hydrogen 3.004 N/A ILE 192.A N VAL 101.A O no hydrogen 2.895 N/A VAL 193.A N VAL 25.A O no hydrogen 2.637 N/A ILE 194.A N TYR 99.A O no hydrogen 2.664 N/A ASN 198.A ND2 TYR 196.A OH no hydrogen 2.947 N/A ASN 198.A ND2 ASP 203.A OD2 no hydrogen 3.092 N/A SER 199.A N ASN 198.A OD1 no hydrogen 2.731 N/A ASP 203.A N GLY 95.A O no hydrogen 3.326 N/A SER 204.A N ASP 203.A OD1 no hydrogen 2.756 N/A THR 206.A N SER 204.A OG no hydrogen 3.316 N/A ARG 207.A N SER 204.A OG no hydrogen 3.191 N/A HIS 208.A ND1 ASP 203.A OD2 no hydrogen 2.944 N/A HIS 208.A NE2 GLU 122.A OE1 no hydrogen 2.984 N/A HIS 208.A NE2 GLU 122.A OE2 no hydrogen 2.870 N/A SER 212.A N ILE 120.A O no hydrogen 2.999 N/A SER 212.A OG HIS 123.A ND1 no hydrogen 2.622 N/A LEU 213.A N TRP 73.A O no hydrogen 2.797 N/A MET 214.A N VAL 118.A O no hydrogen 2.931 N/A VAL 215.A N TRP 71.A O no hydrogen 3.028 N/A ILE 216.A N LEU 116.A O no hydrogen 2.846 N/A ILE 218.A N CYS 114.A O no hydrogen 2.788 N/A ALA 219.A N CYS 114.A O no hydrogen 3.338 N/A THR 222.A N SER 112.A O no hydrogen 2.943 N/A THR 222.A OG1 SER 112.A OG no hydrogen 2.820 N/A ALA 227.A N PRO 224.A O no hydrogen 3.092 N/A SER 230.A N THR 228.A O no hydrogen 2.830 N/A LEU 231.A N TRP 64.A O no hydrogen 2.980 N/A ILE 233.A N LYS 62.A O no hydrogen 2.865 N/A THR 234.A N GLN 104.A O no hydrogen 2.892 N/A THR 234.A OG1 SER 61.A OG no hydrogen 2.829 N/A THR 236.A N HIS 102.A O no hydrogen 2.909 N/A THR 236.A OG1 THR 58.A OG1 no hydrogen 2.959 N/A THR 236.A OG1 GLN 104.A OE1 no hydrogen 3.033 N/A ILE 237.A N TYR 57.A O no hydrogen 2.926 N/A ALA 238.A N THR 100.A O no hydrogen 3.063 N/A MET 240.A N GLY 98.A O no hydrogen 2.755 N/A CYS 241.A SG PRO 32.A O no hydrogen 3.485 N/A THR 242.A OG1 SER 97.A OG no hydrogen 3.016 N/A GLU 243.A N ARG 96.A O no hydrogen 2.945 N/A PHE 244.A N SER 47.A O no hydrogen 2.988 N/A SER 245.A N LEU 94.A O no hydrogen 2.918 N/A SER 245.A OG ASP 42.A OD2 no hydrogen 2.570 N/A ARG 248.A N PHE 91.A O no hydrogen 2.900 N/A ARG 248.A NE SER 249.A O no hydrogen 3.207 N/A ARG 248.A NH2 PHE 90.A O no hydrogen 3.151 N/A LYS 250.A NZ GLN 87.A OE1 no hydrogen 3.375 N/A SER 251.A N PHE 90.A O no hydrogen 2.882 N/A