Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5iaw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLN 5.A OE1 no hydrogen 2.965 N/A GLN 6.A N THR 2.A O no hydrogen 2.689 N/A GLN 6.A NE2 LEU 1.A O no hydrogen 2.888 N/A THR 7.A N PRO 3.A O no hydrogen 3.049 N/A THR 7.A OG1 PRO 3.A O no hydrogen 3.065 N/A LEU 8.A N ASP 4.A O no hydrogen 3.169 N/A LEU 9.A N GLN 5.A O no hydrogen 2.749 N/A HIS 10.A N GLN 6.A O no hydrogen 3.057 N/A PHE 11.A N THR 7.A O no hydrogen 2.794 N/A ILE 12.A N LEU 8.A O no hydrogen 3.110 N/A MET 13.A N LEU 9.A O no hydrogen 3.017 N/A ASP 14.A N HIS 10.A O no hydrogen 2.894 N/A SER 15.A N PHE 11.A O no hydrogen 3.231 N/A TYR 16.A N ILE 12.A O no hydrogen 3.089 N/A TYR 16.A OH GLU 90.A OE1 no hydrogen 2.762 N/A ASN 17.A N MET 13.A O no hydrogen 2.991 N/A LYS 18.A N ASP 14.A O no hydrogen 2.942 N/A LYS 18.A NZ ASP 14.A OD2 no hydrogen 3.321 N/A GLN 19.A N TYR 16.A O no hydrogen 3.369 N/A GLN 19.A NE2 SER 15.A O no hydrogen 3.141 N/A ASN 27.A N GLN 23.A O no hydrogen 2.822 N/A LYS 28.A N ILE 25.A O no hydrogen 3.115 N/A ILE 29.A N ILE 25.A O no hydrogen 3.488 N/A LEU 30.A N THR 26.A O no hydrogen 3.155 N/A LYS 31.A N ASN 27.A O no hydrogen 3.408 N/A GLU 32.A N ILE 29.A O no hydrogen 3.485 N/A SER 35.A OG GLU 38.A OE2 no hydrogen 2.488 N/A GLU 37.A N GLU 37.A OE1 no hydrogen 2.517 N/A ASN 39.A N SER 35.A O no hydrogen 2.929 N/A PHE 40.A N ALA 36.A O no hydrogen 2.941 N/A LEU 41.A N GLU 37.A O no hydrogen 2.905 N/A ILE 42.A N GLU 38.A O no hydrogen 3.094 N/A LEU 43.A N ASN 39.A O no hydrogen 2.874 N/A THR 44.A N PHE 40.A O no hydrogen 2.857 N/A THR 44.A OG1 PHE 40.A O no hydrogen 3.199 N/A GLU 45.A N LEU 41.A O no hydrogen 3.143 N/A MET 46.A N ILE 42.A O no hydrogen 3.011 N/A ALA 47.A N LEU 43.A O no hydrogen 2.771 N/A THR 48.A N THR 44.A O no hydrogen 2.933 N/A THR 48.A OG1 THR 44.A O no hydrogen 2.955 N/A ASN 49.A N GLU 45.A O no hydrogen 2.925 N/A ASN 49.A ND2 GLU 45.A O no hydrogen 3.650 N/A HIS 50.A N MET 46.A O no hydrogen 2.959 N/A VAL 51.A N ALA 47.A O no hydrogen 3.032 N/A GLN 52.A N THR 48.A O no hydrogen 3.023 N/A VAL 53.A N ASN 49.A O no hydrogen 3.073 N/A LEU 54.A N HIS 50.A O no hydrogen 2.886 N/A VAL 55.A N VAL 51.A O no hydrogen 2.941 N/A GLU 56.A N GLN 52.A O no hydrogen 2.971 N/A PHE 57.A N VAL 53.A O no hydrogen 2.897 N/A THR 58.A N LEU 54.A O no hydrogen 2.937 N/A THR 58.A OG1 LEU 54.A O no hydrogen 2.624 N/A LYS 59.A N VAL 55.A O no hydrogen 3.101 N/A LYS 60.A N PHE 57.A O no hydrogen 3.177 N/A LEU 61.A N THR 58.A O no hydrogen 2.984 N/A PHE 64.A N LEU 61.A O no hydrogen 2.804 N/A THR 66.A N GLY 63.A O no hydrogen 2.902 N/A THR 66.A OG1 GLY 63.A O no hydrogen 2.873 N/A LEU 67.A N PHE 64.A O no hydrogen 3.185 N/A GLU 70.A N ASP 68.A OD1 no hydrogen 2.679 N/A ASP 71.A N ASP 68.A OD1 no hydrogen 3.338 N/A GLN 72.A N ASP 68.A O no hydrogen 3.136 N/A GLN 72.A NE2 PHE 64.A O no hydrogen 2.808 N/A ILE 73.A N HIS 69.A O no hydrogen 3.464 N/A ALA 74.A N GLU 70.A O no hydrogen 3.075 N/A LEU 75.A N ASP 71.A O no hydrogen 2.983 N/A LEU 76.A N GLN 72.A O no hydrogen 3.163 N/A LYS 77.A N ILE 73.A O no hydrogen 2.968 N/A LYS 77.A NZ ASP 226.A OD1 no hydrogen 2.729 N/A GLY 78.A N ALA 74.A O no hydrogen 3.073 N/A SER 79.A N LEU 75.A O no hydrogen 2.904 N/A SER 79.A OG LEU 75.A O no hydrogen 2.658 N/A SER 79.A OG LEU 76.A O no hydrogen 3.513 N/A ALA 83.A N SER 79.A O no hydrogen 2.824 N/A MET 84.A N ALA 80.A O no hydrogen 2.749 N/A PHE 85.A N VAL 81.A O no hydrogen 2.900 N/A LEU 86.A N GLU 82.A O no hydrogen 3.081 N/A ARG 87.A N ALA 83.A O no hydrogen 3.036 N/A SER 88.A N MET 84.A O no hydrogen 2.972 N/A SER 88.A OG MET 84.A O no hydrogen 2.841 N/A ALA 89.A N PHE 85.A O no hydrogen 2.918 N/A GLU 90.A N LEU 86.A O no hydrogen 2.981 N/A ILE 91.A N ARG 87.A O no hydrogen 2.985 N/A PHE 92.A N SER 88.A O no hydrogen 2.825 N/A ASN 93.A N ALA 89.A O no hydrogen 3.085 N/A ASN 93.A N GLU 90.A O no hydrogen 3.187 N/A ASN 93.A ND2 TYR 125.A O no hydrogen 3.403 N/A LYS 94.A N ILE 91.A O no hydrogen 3.314 N/A LYS 95.A N ILE 91.A O no hydrogen 3.007 N/A HIS 100.A ND1 SER 98.A O no hydrogen 2.528 N/A LEU 104.A N HIS 100.A O no hydrogen 2.972 N/A GLU 105.A N SER 101.A O no hydrogen 2.977 N/A GLU 106.A N ASP 102.A O no hydrogen 2.924 N/A ARG 107.A N LEU 103.A O no hydrogen 2.954 N/A ARG 107.A NE ILE 29.A O no hydrogen 2.926 N/A ARG 107.A NH2 ILE 29.A O no hydrogen 3.551 N/A ARG 107.A NH2 LEU 30.A O no hydrogen 2.800 N/A ILE 108.A N LEU 104.A O no hydrogen 3.138 N/A ILE 108.A N GLU 105.A O no hydrogen 3.323 N/A ARG 109.A N GLU 105.A O no hydrogen 3.168 N/A ARG 109.A NE ASP 115.A OD1 no hydrogen 2.412 N/A ARG 109.A NH1 GLU 105.A OE1 no hydrogen 3.206 N/A ARG 109.A NH2 GLU 105.A OE1 no hydrogen 3.290 N/A ASN 110.A N GLU 106.A O no hydrogen 3.219 N/A SER 111.A N ILE 108.A O no hydrogen 3.263 N/A SER 111.A OG ARG 107.A O no hydrogen 2.814 N/A GLU 116.A N SER 114.A OG no hydrogen 3.152 N/A TYR 117.A N SER 114.A O no hydrogen 2.973 N/A ILE 118.A N SER 114.A O no hydrogen 3.339 N/A ILE 118.A N ASP 115.A O no hydrogen 3.106 N/A THR 119.A N ASP 115.A O no hydrogen 3.202 N/A THR 119.A OG1 ASP 115.A O no hydrogen 3.536 N/A MET 121.A N TYR 117.A O no hydrogen 3.402 N/A PHE 122.A N ILE 118.A O no hydrogen 3.183 N/A SER 123.A N THR 119.A O no hydrogen 3.178 N/A SER 123.A OG THR 119.A O no hydrogen 2.870 N/A PHE 124.A N PRO 120.A O no hydrogen 3.063 N/A TYR 125.A N MET 121.A O no hydrogen 2.984 N/A LYS 126.A N PHE 122.A O no hydrogen 2.985 N/A SER 127.A N SER 123.A O no hydrogen 2.842 N/A SER 127.A OG PHE 124.A O no hydrogen 2.943 N/A ILE 128.A N PHE 124.A O no hydrogen 3.038 N/A GLY 129.A N TYR 125.A O no hydrogen 3.168 N/A GLU 130.A N LYS 126.A O no hydrogen 2.813 N/A LEU 131.A N SER 127.A O no hydrogen 3.317 N/A LEU 131.A N ILE 128.A O no hydrogen 3.131 N/A LYS 132.A N GLY 129.A O no hydrogen 2.970 N/A THR 134.A N GLU 137.A OE2 no hydrogen 3.005 N/A THR 134.A OG1 GLU 136.A OE1 no hydrogen 3.505 N/A GLN 135.A NE2 GLU 90.A OE2 no hydrogen 2.944 N/A TYR 138.A N THR 134.A O no hydrogen 3.136 N/A ALA 139.A N GLN 135.A O no hydrogen 3.215 N/A LEU 140.A N GLU 136.A O no hydrogen 2.796 N/A LEU 141.A N GLU 137.A O no hydrogen 2.761 N/A THR 142.A N TYR 138.A O no hydrogen 2.919 N/A THR 142.A OG1 TYR 138.A O no hydrogen 2.842 N/A ALA 143.A N ALA 139.A O no hydrogen 2.991 N/A ILE 144.A N LEU 140.A O no hydrogen 2.819 N/A VAL 145.A N LEU 141.A O no hydrogen 2.804 N/A ILE 146.A N THR 142.A O no hydrogen 3.000 N/A LEU 147.A N ALA 143.A O no hydrogen 2.941 N/A SER 148.A N VAL 145.A O no hydrogen 3.240 N/A ARG 151.A NH1 GLU 82.A OE2 no hydrogen 2.712 N/A ARG 151.A NH2 GLU 82.A OE1 no hydrogen 2.792 N/A ARG 151.A NH2 VAL 145.A O no hydrogen 3.100 N/A LYS 155.A N ASP 71.A OD1 no hydrogen 2.880 N/A ASP 156.A N ASP 71.A OD2 no hydrogen 3.259 N/A ARG 157.A NE PRO 149.A O no hydrogen 2.866 N/A ALA 159.A N ASP 156.A OD1 no hydrogen 3.516 N/A VAL 160.A N ARG 157.A O no hydrogen 2.773 N/A GLU 161.A N ARG 157.A O no hydrogen 2.925 N/A LYS 162.A N GLU 158.A O no hydrogen 2.827 N/A GLN 164.A N VAL 160.A O no hydrogen 2.946 N/A GLN 164.A N GLU 161.A O no hydrogen 3.196 N/A GLN 164.A NE2 ILE 144.A O no hydrogen 2.840 N/A GLU 165.A N GLU 161.A O no hydrogen 3.028 N/A LEU 168.A N GLN 164.A O no hydrogen 3.087 N/A ASP 169.A N GLU 165.A O no hydrogen 2.839 N/A VAL 170.A N PRO 166.A O no hydrogen 3.024 N/A LEU 171.A N LEU 167.A O no hydrogen 2.932 N/A GLN 172.A N LEU 168.A O no hydrogen 3.130 N/A LYS 173.A N ASP 169.A O no hydrogen 3.135 N/A LYS 173.A NZ GLN 5.A OE1 no hydrogen 3.169 N/A LEU 174.A N VAL 170.A O no hydrogen 3.062 N/A CYS 175.A N LEU 171.A O no hydrogen 3.044 N/A CYS 175.A SG LEU 171.A O no hydrogen 3.321 N/A LYS 176.A N GLN 172.A O no hydrogen 3.374 N/A ILE 177.A N LYS 173.A O no hydrogen 2.675 N/A HIS 178.A N LEU 174.A O no hydrogen 3.001 N/A GLN 179.A N CYS 175.A O no hydrogen 3.007 N/A ASN 182.A N GLN 179.A O no hydrogen 3.058 N/A ASN 182.A ND2 GLN 179.A OE1 no hydrogen 3.290 N/A HIS 185.A N ASN 182.A O no hydrogen 3.181 N/A HIS 185.A NE2 GLU 137.A OE1 no hydrogen 2.805 N/A CYS 188.A N GLN 184.A O no hydrogen 3.129 N/A CYS 188.A SG GLN 184.A O no hydrogen 3.283 N/A LEU 189.A N HIS 185.A O no hydrogen 2.961 N/A LEU 190.A N PHE 186.A O no hydrogen 3.019 N/A GLY 191.A N ALA 187.A O no hydrogen 3.040 N/A ARG 192.A N CYS 188.A O no hydrogen 2.998 N/A ARG 192.A N LEU 189.A O no hydrogen 2.793 N/A ARG 192.A NH1 SER 127.A OG no hydrogen 2.578 N/A LEU 193.A N LEU 189.A O no hydrogen 3.187 N/A THR 194.A N LEU 190.A O no hydrogen 3.181 N/A GLU 195.A N GLY 191.A O no hydrogen 3.264 N/A LEU 196.A N ARG 192.A O no hydrogen 2.840 N/A ARG 197.A N LEU 193.A O no hydrogen 2.938 N/A THR 198.A N GLU 195.A O no hydrogen 3.150 N/A THR 198.A OG1 GLU 195.A O no hydrogen 2.628 N/A PHE 199.A N LEU 196.A O no hydrogen 2.951 N/A ASN 200.A N ARG 197.A O no hydrogen 3.432 N/A ASN 200.A ND2 GLU 82.A OE2 no hydrogen 3.032 N/A ASN 200.A ND2 ARG 197.A O no hydrogen 3.208 N/A HIS 203.A N PHE 199.A O no hydrogen 2.726 N/A HIS 203.A N ASN 200.A O no hydrogen 3.093 N/A ALA 204.A N ASN 200.A O no hydrogen 3.032 N/A GLU 205.A N HIS 201.A O no hydrogen 3.098 N/A MET 206.A N HIS 202.A O no hydrogen 2.789 N/A LEU 207.A N HIS 203.A O no hydrogen 2.982 N/A MET 208.A N ALA 204.A O no hydrogen 2.804 N/A SER 209.A N GLU 205.A O no hydrogen 2.921 N/A TRP 210.A N MET 206.A O no hydrogen 2.992 N/A TRP 210.A NE1 SER 111.A O no hydrogen 3.020 N/A ARG 211.A N LEU 207.A O no hydrogen 2.998 N/A ARG 211.A NH1 GLN 228.A O no hydrogen 3.339 N/A VAL 212.A N MET 208.A O no hydrogen 3.116 N/A ASN 213.A N SER 209.A O no hydrogen 3.319 N/A ASN 213.A N TRP 210.A O no hydrogen 3.232 N/A ASN 213.A ND2 SER 209.A O no hydrogen 2.815 N/A ASP 214.A N ARG 211.A O no hydrogen 3.143 N/A HIS 215.A N TRP 210.A O no hydrogen 3.092 N/A THR 218.A OG1 PRO 219.A O no hydrogen 3.278 N/A LEU 221.A N THR 218.A OG1 no hydrogen 3.413 N/A CYS 222.A N THR 218.A O no hydrogen 2.979 N/A CYS 222.A SG THR 218.A O no hydrogen 3.255 N/A ILE 224.A N LEU 220.A O no hydrogen 3.083 N/A TRP 225.A N LEU 221.A O no hydrogen 3.370 N/A ASP 226.A N GLU 223.A O no hydrogen 2.899 N/A VAL 227.A N CYS 222.A O no hydrogen 3.026 N/A