Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7f44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 30.A O no hydrogen 3.184 N/A LEU 2.A N GLU 30.A OE1 no hydrogen 3.240 N/A LEU 3.A N GLU 30.A O no hydrogen 2.813 N/A LYS 4.A N MET 1.A O no hydrogen 3.350 N/A GLN 6.A N LEU 3.A O no hydrogen 2.834 N/A ARG 7.A N ASP 90.A OD2 no hydrogen 2.834 N/A ARG 7.A NH1 GLY 88.A O no hydrogen 3.222 N/A PHE 8.A N GLN 33.A O no hydrogen 2.840 N/A VAL 9.A N GLY 91.A O no hydrogen 2.997 N/A VAL 10.A N ILE 35.A O no hydrogen 2.842 N/A THR 11.A N VAL 93.A O no hydrogen 3.029 N/A THR 11.A OG1 VAL 93.A O no hydrogen 2.753 N/A ALA 14.A N SER 18.A OG no hydrogen 2.944 N/A SER 15.A N SER 18.A OG no hydrogen 3.094 N/A LEU 17.A N SER 15.A OG no hydrogen 3.277 N/A SER 18.A N SER 15.A O no hydrogen 3.364 N/A TRP 21.A N SER 18.A O no hydrogen 3.017 N/A ALA 22.A N SER 18.A O no hydrogen 3.483 N/A ILE 23.A N ILE 19.A O no hydrogen 2.850 N/A ALA 24.A N ALA 20.A O no hydrogen 2.831 N/A GLU 25.A N TRP 21.A O no hydrogen 2.833 N/A SER 26.A N ALA 22.A O no hydrogen 2.951 N/A SER 26.A OG ALA 22.A O no hydrogen 3.483 N/A SER 26.A OG ASN 232.A OD1 no hydrogen 2.878 N/A LEU 27.A N ILE 23.A O no hydrogen 3.052 N/A HIS 28.A N ALA 24.A O no hydrogen 2.905 N/A ARG 29.A N GLU 25.A O no hydrogen 2.941 N/A ARG 29.A NH2 ASN 232.A OD1 no hydrogen 3.202 N/A GLU 30.A N LEU 27.A O no hydrogen 3.208 N/A GLY 31.A N HIS 28.A O no hydrogen 2.688 N/A ALA 32.A N LEU 27.A O no hydrogen 3.201 N/A GLN 33.A N GLN 6.A O no hydrogen 2.778 N/A ILE 35.A N PHE 8.A O no hydrogen 2.895 N/A LEU 36.A N ALA 58.A O no hydrogen 3.154 N/A THR 37.A N VAL 10.A O no hydrogen 3.162 N/A TYR 38.A N ILE 60.A O no hydrogen 2.996 N/A ILE 43.A N ASN 40.A OD1 no hydrogen 2.536 N/A LYS 44.A N ASP 41.A O no hydrogen 3.293 N/A LYS 44.A NZ ASP 48.A OD1 no hydrogen 2.971 N/A LYS 44.A NZ ASP 48.A OD2 no hydrogen 3.127 N/A ARG 46.A N ILE 43.A O no hydrogen 3.047 N/A VAL 47.A N ILE 43.A O no hydrogen 3.373 N/A ASP 48.A N LYS 44.A O no hydrogen 2.983 N/A MET 49.A N LYS 45.A O no hydrogen 3.278 N/A ALA 50.A N ARG 46.A O no hydrogen 3.224 N/A ALA 51.A N VAL 47.A O no hydrogen 2.798 N/A GLU 52.A N ASP 48.A O no hydrogen 2.754 N/A ALA 53.A N MET 49.A O no hydrogen 2.794 N/A PHE 54.A N ALA 51.A O no hydrogen 3.438 N/A ALA 56.A N ALA 51.A O no hydrogen 3.016 N/A ILE 60.A N LEU 36.A O no hydrogen 2.900 N/A CYS 62.A N TYR 38.A O no hydrogen 2.706 N/A ASP 63.A N SER 69.A OG no hydrogen 2.825 N/A GLY 65.A N ASP 63.A OD1 no hydrogen 2.620 N/A SER 66.A N ASP 63.A O no hydrogen 2.874 N/A SER 69.A N SER 66.A OG no hydrogen 2.748 N/A SER 69.A OG ASP 63.A O no hydrogen 3.559 N/A ILE 70.A N SER 66.A O no hydrogen 2.959 N/A GLN 71.A N ASP 67.A O no hydrogen 2.900 N/A GLN 71.A NE2 ASP 75.A OD1 no hydrogen 3.430 N/A VAL 72.A N GLU 68.A O no hydrogen 3.060 N/A CYS 73.A N SER 69.A O no hydrogen 3.124 N/A PHE 74.A N ILE 70.A O no hydrogen 3.019 N/A ASP 75.A N GLN 71.A O no hydrogen 2.926 N/A GLU 76.A N VAL 72.A O no hydrogen 2.825 N/A ILE 77.A N CYS 73.A O no hydrogen 2.907 N/A ALA 78.A N PHE 74.A O no hydrogen 2.911 N/A LYS 79.A N GLU 76.A O no hydrogen 3.081 N/A LYS 79.A NZ GLU 76.A OE2 no hydrogen 2.813 N/A HIS 80.A N ILE 77.A O no hydrogen 3.134 N/A HIS 80.A ND1 GLU 76.A O no hydrogen 3.162 N/A TRP 81.A N ILE 77.A O no hydrogen 2.863 N/A GLY 82.A N ALA 78.A O no hydrogen 2.574 N/A ASP 86.A N ASP 86.A OD1 no hydrogen 2.541 N/A GLY 88.A N TRP 81.A O no hydrogen 2.753 N/A ILE 89.A N LEU 138.A O no hydrogen 3.202 N/A ASP 90.A N ARG 7.A O no hydrogen 2.768 N/A GLY 91.A N ARG 7.A O no hydrogen 3.205 N/A ILE 92.A N SER 145.A O no hydrogen 2.922 N/A VAL 93.A N VAL 9.A O no hydrogen 2.837 N/A HIS 94.A N LEU 147.A O no hydrogen 2.740 N/A HIS 94.A ND1 THR 148.A OG1 no hydrogen 2.920 N/A HIS 94.A NE2 SER 127.A OG no hydrogen 2.919 N/A ALA 95.A N THR 11.A OG1 no hydrogen 3.305 N/A PHE 98.A N SER 124.A OG no hydrogen 3.058 N/A GLN 103.A N PRO 100.A O no hydrogen 2.714 N/A GLN 103.A NE2 THR 113.A OG1 no hydrogen 2.843 N/A LEU 104.A N ALA 101.A O no hydrogen 3.207 N/A GLY 106.A N ASN 160.A OD1 no hydrogen 2.523 N/A GLN 110.A N ASP 107.A OD2 no hydrogen 2.869 N/A ALA 111.A N ASP 107.A O no hydrogen 2.810 N/A THR 112.A N PHE 108.A O no hydrogen 3.006 N/A THR 112.A OG1 PHE 108.A O no hydrogen 2.589 N/A THR 113.A N GLN 103.A OE1 no hydrogen 2.813 N/A GLU 115.A N GLU 115.A OE2 no hydrogen 2.891 N/A GLY 116.A N THR 113.A OG1 no hydrogen 3.233 N/A SER 117.A N THR 113.A O no hydrogen 2.965 N/A GLN 118.A N ARG 114.A O no hydrogen 3.152 N/A ILE 119.A N GLU 115.A O no hydrogen 2.820 N/A ALA 120.A N GLY 116.A O no hydrogen 2.768 N/A HIS 121.A N SER 117.A O no hydrogen 3.003 N/A HIS 121.A ND1 SER 117.A O no hydrogen 2.719 N/A ASP 122.A N GLN 118.A O no hydrogen 3.034 N/A ILE 123.A N ILE 119.A O no hydrogen 2.960 N/A SER 124.A N ALA 120.A O no hydrogen 3.001 N/A SER 124.A OG PHE 98.A O no hydrogen 3.230 N/A SER 124.A OG ALA 120.A O no hydrogen 2.928 N/A SER 125.A N HIS 121.A O no hydrogen 2.876 N/A SER 125.A OG SER 170.A OG no hydrogen 2.872 N/A TYR 126.A N HIS 121.A O no hydrogen 2.904 N/A SER 127.A N ASP 122.A O no hydrogen 3.154 N/A SER 127.A OG HIS 94.A NE2 no hydrogen 2.919 N/A SER 127.A OG ILE 123.A O no hydrogen 2.318 N/A PHE 128.A N SER 125.A O no hydrogen 3.301 N/A ALA 130.A N TYR 126.A O no hydrogen 2.885 N/A LEU 131.A N SER 127.A O no hydrogen 2.908 N/A ALA 132.A N PHE 128.A O no hydrogen 2.957 N/A LYS 133.A N VAL 129.A O no hydrogen 2.843 N/A ALA 134.A N ALA 130.A O no hydrogen 3.097 N/A GLY 135.A N LEU 131.A O no hydrogen 2.860 N/A ARG 136.A N LYS 133.A O no hydrogen 3.423 N/A ARG 136.A NE GLU 185.A OE2 no hydrogen 2.917 N/A ARG 136.A NH2 GLU 185.A OE1 no hydrogen 2.786 N/A ARG 136.A NH2 GLU 185.A OE2 no hydrogen 3.433 N/A LEU 139.A N GLY 135.A O no hydrogen 2.906 N/A ALA 140.A N ARG 136.A O no hydrogen 2.655 N/A ALA 141.A N GLU 137.A O no hydrogen 2.992 N/A ALA 141.A N LEU 138.A O no hydrogen 2.999 N/A ARG 142.A N LEU 139.A O no hydrogen 3.038 N/A ARG 142.A NE ASP 86.A O no hydrogen 3.291 N/A ARG 142.A NH1 GLY 5.A O no hydrogen 3.130 N/A ARG 142.A NH1 ASP 90.A OD2 no hydrogen 2.846 N/A ARG 142.A NH2 ASP 86.A O no hydrogen 2.714 N/A GLN 143.A N ALA 140.A O no hydrogen 3.177 N/A GLY 144.A N LEU 139.A O no hydrogen 2.949 N/A SER 145.A N ASP 90.A O no hydrogen 2.785 N/A LEU 146.A N ARG 188.A O no hydrogen 2.950 N/A LEU 147.A N ILE 92.A O no hydrogen 2.945 N/A THR 148.A N ASN 190.A O no hydrogen 3.110 N/A THR 148.A OG1 HIS 94.A ND1 no hydrogen 2.920 N/A THR 148.A OG1 HIS 94.A O no hydrogen 3.391 N/A LEU 149.A N HIS 94.A O no hydrogen 3.192 N/A THR 150.A N ILE 192.A O no hydrogen 2.790 N/A THR 150.A OG1 GLU 172.A OE2 no hydrogen 2.913 N/A SER 154.A N TYR 151.A O no hydrogen 3.340 N/A SER 154.A OG TYR 151.A O no hydrogen 3.164 N/A SER 154.A OG GLU 172.A OE1 no hydrogen 3.513 N/A SER 154.A OG GLU 172.A OE2 no hydrogen 2.797 N/A ILE 155.A N GLU 152.A O no hydrogen 3.071 N/A SER 156.A N GLU 152.A O no hydrogen 3.007 N/A SER 156.A OG GLU 152.A OE2 no hydrogen 2.788 N/A TYR 161.A N LEU 158.A O no hydrogen 3.234 N/A ASN 162.A ND2 GLN 103.A O no hydrogen 2.711 N/A ASN 162.A ND2 GLY 106.A O no hydrogen 3.320 N/A MET 164.A N TYR 161.A O no hydrogen 3.163 N/A GLY 165.A N ASN 162.A O no hydrogen 3.169 N/A ALA 167.A N VAL 163.A O no hydrogen 2.950 N/A LYS 168.A N MET 164.A O no hydrogen 2.768 N/A LYS 168.A NZ LEU 149.A O no hydrogen 3.047 N/A ALA 169.A N GLY 165.A O no hydrogen 3.058 N/A SER 170.A N MET 166.A O no hydrogen 3.157 N/A SER 170.A OG SER 125.A OG no hydrogen 2.872 N/A LEU 171.A N ALA 167.A O no hydrogen 2.981 N/A GLU 172.A N LYS 168.A O no hydrogen 2.943 N/A ALA 173.A N ALA 169.A O no hydrogen 2.918 N/A SER 174.A N SER 170.A O no hydrogen 2.958 N/A SER 174.A OG LEU 171.A O no hydrogen 2.660 N/A VAL 175.A N LEU 171.A O no hydrogen 3.061 N/A ARG 176.A N GLU 172.A O no hydrogen 3.368 N/A TYR 177.A N ALA 173.A O no hydrogen 3.021 N/A LEU 178.A N SER 174.A O no hydrogen 2.734 N/A ALA 179.A N VAL 175.A O no hydrogen 3.006 N/A SER 180.A N ARG 176.A O no hydrogen 3.090 N/A SER 181.A N TYR 177.A O no hydrogen 2.837 N/A LEU 182.A N LEU 178.A O no hydrogen 2.826 N/A GLY 183.A N ALA 179.A O no hydrogen 3.131 N/A GLU 185.A N LEU 182.A O no hydrogen 2.990 N/A GLY 186.A N GLY 183.A O no hydrogen 2.854 N/A ARG 188.A NH1 LEU 237.A O no hydrogen 3.113 N/A ARG 188.A NH1 ILE 245.A O no hydrogen 2.939 N/A ARG 188.A NH2 LEU 237.A O no hydrogen 2.781 N/A VAL 189.A N THR 246.A OG1 no hydrogen 2.813 N/A ASN 190.A N LEU 146.A O no hydrogen 3.043 N/A ASN 190.A ND2 ILE 245.A O no hydrogen 2.957 N/A ALA 191.A N GLU 248.A O no hydrogen 2.912 N/A ILE 192.A N THR 148.A O no hydrogen 3.015 N/A SER 193.A N LEU 250.A O no hydrogen 2.833 N/A GLY 195.A N VAL 252.A O no hydrogen 2.883 N/A ARG 198.A NH2 ASP 213.A OD1 no hydrogen 2.613 N/A ARG 198.A NH2 GLU 216.A OE2 no hydrogen 3.192 N/A ALA 202.A N THR 199.A OG1 no hydrogen 3.173 N/A SER 203.A N THR 199.A O no hydrogen 2.977 N/A SER 203.A OG THR 199.A O no hydrogen 2.589 N/A GLY 204.A N ALA 201.A O no hydrogen 2.859 N/A ILE 205.A N ALA 202.A O no hydrogen 2.913 N/A ARG 209.A N ILE 205.A O no hydrogen 2.791 N/A ARG 209.A NH1 SER 203.A O no hydrogen 2.582 N/A ARG 210.A N LYS 206.A O no hydrogen 3.003 N/A ARG 210.A NH2 SER 207.A OG no hydrogen 3.022 N/A MET 211.A N SER 207.A O no hydrogen 3.234 N/A LEU 212.A N PHE 208.A O no hydrogen 2.919 N/A ASP 213.A N ARG 209.A O no hydrogen 3.117 N/A ASP 213.A N ARG 210.A O no hydrogen 3.082 N/A VAL 214.A N ARG 210.A O no hydrogen 3.047 N/A SER 215.A N MET 211.A O no hydrogen 3.056 N/A SER 215.A OG MET 211.A O no hydrogen 2.704 N/A GLU 216.A N LEU 212.A O no hydrogen 3.157 N/A LYS 217.A N ASP 213.A O no hydrogen 3.303 N/A LYS 217.A N VAL 214.A O no hydrogen 3.055 N/A ILE 218.A N SER 215.A O no hydrogen 2.785 N/A ALA 219.A N SER 215.A O no hydrogen 2.801 N/A GLN 222.A N ALA 219.A O no hydrogen 2.876 N/A ARG 223.A NH1 ASN 224.A O no hydrogen 3.372 N/A ARG 223.A NH1 GLU 229.A OE1 no hydrogen 2.692 N/A ARG 223.A NH1 GLU 229.A OE2 no hydrogen 3.311 N/A ARG 223.A NH2 GLU 229.A OE2 no hydrogen 2.825 N/A ASN 224.A ND2 LEU 212.A O no hydrogen 3.323 N/A SER 226.A N GLU 229.A OE1 no hydrogen 2.913 N/A GLN 227.A N GLN 227.A OE1 no hydrogen 2.851 N/A GLN 227.A NE2 LEU 17.A O no hydrogen 2.860 N/A GLU 229.A N SER 226.A OG no hydrogen 3.386 N/A VAL 230.A N SER 226.A O no hydrogen 3.302 N/A GLY 231.A N GLN 227.A O no hydrogen 2.796 N/A ASN 232.A N GLU 228.A O no hydrogen 2.890 N/A ALA 233.A N GLU 229.A O no hydrogen 3.110 N/A ALA 234.A N VAL 230.A O no hydrogen 2.865 N/A LEU 235.A N GLY 231.A O no hydrogen 2.743 N/A PHE 236.A N ASN 232.A O no hydrogen 2.964 N/A LEU 237.A N ALA 233.A O no hydrogen 3.062 N/A LEU 238.A N ALA 234.A O no hydrogen 2.911 N/A LEU 238.A N LEU 235.A O no hydrogen 3.197 N/A SER 239.A N PHE 236.A O no hydrogen 2.904 N/A SER 239.A OG PHE 236.A O no hydrogen 2.767 N/A TRP 241.A N SER 239.A OG no hydrogen 3.105 N/A ALA 242.A N SER 239.A O no hydrogen 2.877 N/A SER 243.A N PRO 240.A O no hydrogen 3.207 N/A SER 243.A OG PRO 240.A O no hydrogen 3.408 N/A ILE 245.A N ALA 242.A O no hydrogen 3.024 N/A THR 246.A OG1 VAL 189.A O no hydrogen 3.547 N/A GLY 247.A N VAL 189.A O no hydrogen 2.681 N/A GLU 248.A N ASN 190.A OD1 no hydrogen 2.895 N/A LEU 250.A N ALA 191.A O no hydrogen 2.934 N/A VAL 252.A N SER 193.A O no hydrogen 2.918 N/A GLY 255.A N ASP 253.A OD1 no hydrogen 2.842 N/A PHE 256.A N ASP 253.A O no hydrogen 3.257 N/A ASN 257.A N ASP 253.A OD2 no hydrogen 3.028 N/A ASN 257.A ND2 ASP 253.A OD1 no hydrogen 3.476 N/A ASN 257.A ND2 ASP 253.A OD2 no hydrogen 3.027 N/A THR 258.A N GLY 255.A O no hydrogen 3.073 N/A THR 258.A OG1 GLY 255.A O no hydrogen 2.638 N/A VAL 259.A N PHE 256.A O no hydrogen 3.011 N/A SER 262.A OG LYS 217.A O no hydrogen 2.900 N/A ILE 265.A N SER 262.A O no hydrogen 3.196 N/A ILE 265.A N SER 262.A OG no hydrogen 3.005 N/A MET 266.A N SER 262.A O no hydrogen 3.278 N/A MET 266.A N GLU 263.A O no hydrogen 3.190 N/A