Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xde_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 ARG 4.A O no hydrogen 3.547 N/A ARG 4.A NH1 GLY 51.A O no hydrogen 3.533 N/A HIS 7.A ND1 TYR 9.A OH no hydrogen 2.420 N/A HIS 7.A NE2 GLU 144.A OE1 no hydrogen 2.656 N/A ILE 10.A N HIS 7.A O no hydrogen 3.228 N/A ALA 11.A N GLY 22.A O no hydrogen 3.027 N/A ALA 12.A N VAL 49.A O no hydrogen 2.896 N/A LEU 13.A N CYS 20.A O no hydrogen 2.778 N/A TYR 14.A N THR 47.A O no hydrogen 2.891 N/A TYR 14.A OH GLN 52.A OE1 no hydrogen 2.547 N/A SER 18.A N TRP 15.A O no hydrogen 2.727 N/A CYS 20.A N LEU 13.A O no hydrogen 3.072 N/A CYS 20.A SG PHE 19.A O no hydrogen 3.234 N/A ALA 21.A N SER 186.A O no hydrogen 2.943 N/A GLY 22.A N ALA 11.A O no hydrogen 3.037 N/A SER 23.A N LEU 31.A O no hydrogen 2.733 N/A LEU 24.A N TYR 9.A O no hydrogen 2.743 N/A ILE 25.A N TRP 29.A O no hydrogen 2.993 N/A ALA 26.A N TRP 29.A O no hydrogen 3.395 N/A TRP 29.A N ALA 26.A O no hydrogen 3.057 N/A VAL 30.A N LEU 88.A O no hydrogen 3.056 N/A LEU 31.A N SER 23.A O no hydrogen 2.796 N/A THR 32.A N ALA 86.A O no hydrogen 3.073 N/A HIS 35.A N ASP 84.A OD1 no hydrogen 2.867 N/A HIS 35.A ND1 ASP 84.A OD2 no hydrogen 2.634 N/A HIS 35.A NE2 SER 186.A OG no hydrogen 2.514 N/A CYS 36.A N ALA 33.A O no hydrogen 3.212 N/A LEU 37.A N ALA 34.A O no hydrogen 2.707 N/A GLN 38.A NE2 HIS 35.A O no hydrogen 3.172 N/A ARG 40.A N LEU 37.A O no hydrogen 3.001 N/A ARG 40.A NE GLN 38.A O no hydrogen 3.284 N/A ASP 45.A N ALA 42.A O no hydrogen 2.916 N/A LEU 46.A N PRO 43.A O no hydrogen 3.162 N/A THR 47.A N TYR 14.A O no hydrogen 2.926 N/A VAL 48.A N LEU 65.A O no hydrogen 3.075 N/A VAL 49.A N ALA 12.A O no hydrogen 2.965 N/A LEU 50.A N GLN 63.A O no hydrogen 2.935 N/A GLN 52.A NE2 HIS 57.A O no hydrogen 2.798 N/A ARG 54.A NE ALA 139.A O no hydrogen 3.620 N/A ARG 54.A NH2 GLU 137.A O no hydrogen 3.337 N/A ARG 55.A NH1 GLY 129.A O no hydrogen 2.834 N/A ARG 55.A NH2 GLY 129.A O no hydrogen 2.994 N/A ARG 55.A NH2 GLN 131.A OE1 no hydrogen 2.820 N/A ASN 56.A N TYR 14.A OH no hydrogen 3.310 N/A HIS 57.A N ARG 54.A O no hydrogen 2.891 N/A HIS 57.A NE2 GLU 136.A O no hydrogen 2.995 N/A CYS 59.A SG GLY 51.A O no hydrogen 3.537 N/A CYS 62.A N CYS 59.A O no hydrogen 3.104 N/A CYS 62.A SG GLY 51.A O no hydrogen 3.882 N/A CYS 62.A SG HIS 57.A O no hydrogen 3.953 N/A GLN 63.A N LEU 50.A O no hydrogen 2.869 N/A GLN 63.A NE2 LEU 100.A O no hydrogen 2.641 N/A LEU 65.A N VAL 48.A O no hydrogen 2.804 N/A ARG 68.A N ARG 89.A O no hydrogen 2.795 N/A ARG 68.A NH2 GLU 92.A OE1 no hydrogen 3.468 N/A SER 69.A N ARG 89.A O no hydrogen 3.405 N/A TYR 70.A OH PRO 41.A O no hydrogen 2.538 N/A ARG 71.A N LEU 87.A O no hydrogen 2.910 N/A HIS 73.A N LEU 85.A O no hydrogen 3.035 N/A GLU 74.A N GLU 74.A OE1 no hydrogen 2.769 N/A ALA 75.A N HIS 73.A ND1 no hydrogen 3.105 N/A PHE 76.A N HIS 73.A O no hydrogen 3.092 N/A SER 77.A N GLN 82.A O no hydrogen 3.110 N/A SER 77.A OG SER 80.A OG no hydrogen 3.325 N/A VAL 79.A N SER 77.A OG no hydrogen 3.163 N/A SER 80.A N SER 77.A OG no hydrogen 3.165 N/A SER 80.A OG SER 77.A OG no hydrogen 3.325 N/A TYR 81.A N SER 77.A O no hydrogen 2.623 N/A GLN 82.A N SER 80.A OG no hydrogen 3.331 N/A GLN 82.A NE2 PRO 167.A O no hydrogen 3.118 N/A HIS 83.A ND1 TYR 228.A OH no hydrogen 2.557 N/A LEU 85.A N HIS 83.A O no hydrogen 2.916 N/A ALA 86.A N THR 32.A O no hydrogen 2.957 N/A LEU 87.A N ARG 71.A O no hydrogen 2.856 N/A LEU 88.A N VAL 30.A O no hydrogen 2.797 N/A ARG 89.A N SER 69.A O no hydrogen 2.780 N/A ARG 89.A NH1 LEU 90.A O no hydrogen 2.600 N/A ARG 89.A NH1 GLU 92.A OE1 no hydrogen 2.462 N/A LEU 90.A N CYS 28.A O no hydrogen 2.747 N/A GLN 91.A N ALA 66.A O no hydrogen 2.976 N/A ASP 93.A N SER 97.A O no hydrogen 2.928 N/A ASP 95.A N ASP 93.A OD1 no hydrogen 2.993 N/A GLY 96.A N ASP 93.A O no hydrogen 3.194 N/A SER 97.A N ASP 93.A OD1 no hydrogen 3.094 N/A CYS 98.A SG LEU 90.A O no hydrogen 3.843 N/A ALA 99.A N PRO 27.A O no hydrogen 2.872 N/A LEU 100.A N GLN 63.A OE1 no hydrogen 2.955 N/A SER 102.A N VAL 105.A O no hydrogen 2.740 N/A TYR 104.A N SER 102.A OG no hydrogen 3.032 N/A VAL 105.A N SER 102.A O no hydrogen 3.279 N/A GLN 106.A N PRO 8.A O no hydrogen 3.219 N/A GLN 106.A NE2 SER 102.A O no hydrogen 2.583 N/A VAL 108.A N LEU 24.A O no hydrogen 2.713 N/A SER 109.A OG LEU 201.A O no hydrogen 3.507 N/A SER 112.A N ASP 194.A OD2 no hydrogen 3.201 N/A SER 112.A OG ASP 194.A OD1 no hydrogen 2.483 N/A ARG 116.A NH2 ALA 115.A O no hydrogen 3.419 N/A SER 118.A N THR 121.A OG1 no hydrogen 2.857 N/A SER 118.A OG THR 120.A OG1 no hydrogen 3.276 N/A THR 120.A N SER 118.A OG no hydrogen 3.318 N/A THR 120.A OG1 SER 118.A OG no hydrogen 3.276 N/A THR 121.A N SER 118.A O no hydrogen 2.906 N/A THR 121.A OG1 SER 118.A O no hydrogen 2.688 N/A LEU 122.A N GLU 193.A OE1 no hydrogen 2.865 N/A CYS 123.A N VAL 147.A O no hydrogen 2.944 N/A GLN 124.A N VAL 191.A O no hydrogen 2.820 N/A VAL 125.A N ALA 145.A O no hydrogen 2.904 N/A ALA 126.A N PRO 189.A O no hydrogen 3.482 N/A GLY 127.A N GLN 143.A O no hydrogen 2.984 N/A TRP 128.A N ASP 185.A OD2 no hydrogen 2.858 N/A TRP 128.A NE1 GLU 53.A O no hydrogen 2.949 N/A GLY 129.A N ASP 185.A OD1 no hydrogen 2.869 N/A HIS 130.A N CYS 182.A O no hydrogen 2.986 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.783 N/A TYR 138.A N ALA 135.A O no hydrogen 3.126 N/A ALA 139.A N GLU 136.A O no hydrogen 2.773 N/A SER 140.A N GLN 131.A OE1 no hydrogen 3.035 N/A SER 140.A OG GLN 131.A OE1 no hydrogen 3.120 N/A GLN 143.A N GLY 127.A O no hydrogen 2.819 N/A GLN 143.A NE2 TRP 128.A O no hydrogen 2.839 N/A ALA 145.A N VAL 125.A O no hydrogen 2.860 N/A VAL 147.A N CYS 123.A O no hydrogen 2.912 N/A PHE 149.A N THR 121.A O no hydrogen 3.466 N/A LEU 150.A N CYS 171.A O no hydrogen 2.808 N/A SER 151.A N GLU 119.A OE2 no hydrogen 2.888 N/A ARG 154.A N SER 151.A OG no hydrogen 3.007 N/A ARG 154.A NH1 GLU 119.A OE1 no hydrogen 2.715 N/A CYS 155.A N SER 151.A O no hydrogen 2.942 N/A SER 156.A N LEU 152.A O no hydrogen 2.999 N/A SER 156.A OG LEU 152.A O no hydrogen 2.618 N/A SER 156.A OG GLU 153.A O no hydrogen 3.200 N/A ALA 157.A N ARG 154.A O no hydrogen 3.469 N/A VAL 160.A N ALA 157.A O no hydrogen 2.904 N/A HIS 161.A N CYS 155.A O no hydrogen 2.930 N/A HIS 161.A NE2 PRO 219.A O no hydrogen 2.644 N/A GLY 162.A N ALA 157.A O no hydrogen 2.947 N/A SER 164.A N HIS 161.A O no hydrogen 3.292 N/A MET 169.A N LEU 166.A O no hydrogen 2.961 N/A LEU 170.A N TYR 222.A O no hydrogen 2.791 N/A ALA 172.A N GLY 220.A O no hydrogen 3.219 N/A GLY 173.A N PRO 148.A O no hydrogen 2.918 N/A ASP 180.A N ASN 217.A OD1 no hydrogen 3.128 N/A ALA 181.A N ASN 217.A OD1 no hydrogen 3.036 N/A GLN 183.A N ASP 180.A O no hydrogen 2.929 N/A GLY 184.A N ASP 180.A O no hydrogen 3.076 N/A SER 186.A OG HIS 35.A NE2 no hydrogen 2.514 N/A GLY 187.A N ILE 207.A O no hydrogen 2.737 N/A GLY 188.A N ASP 185.A O no hydrogen 2.840 N/A LEU 190.A N GLY 205.A O no hydrogen 2.865 N/A VAL 191.A N GLN 124.A O no hydrogen 2.856 N/A CYS 192.A N THR 202.A O no hydrogen 2.873 N/A GLU 193.A N LEU 122.A O no hydrogen 3.139 N/A ASP 194.A N ARG 200.A O no hydrogen 2.995 N/A ALA 196.A N ASP 194.A O no hydrogen 2.744 N/A THR 202.A N CYS 192.A O no hydrogen 2.905 N/A THR 202.A OG1 ASP 194.A OD2 no hydrogen 2.566 N/A LEU 203.A N SER 109.A O no hydrogen 2.973 N/A GLN 204.A N LEU 190.A O no hydrogen 2.874 N/A GLN 204.A NE2 CYS 192.A O no hydrogen 3.248 N/A GLN 204.A NE2 GLU 193.A O no hydrogen 2.885 N/A GLN 204.A NE2 THR 202.A OG1 no hydrogen 3.245 N/A GLY 205.A N LEU 190.A O no hydrogen 3.009 N/A ILE 206.A N THR 223.A O no hydrogen 3.194 N/A ILE 207.A N GLY 188.A O no hydrogen 2.794 N/A SER 208.A N VAL 221.A O no hydrogen 3.168 N/A SER 208.A OG ASP 84.A OD2 no hydrogen 2.591 N/A TRP 209.A N VAL 221.A O no hydrogen 3.204 N/A SER 211.A OG ARG 216.A O no hydrogen 3.556 N/A ASP 215.A N GLY 212.A O no hydrogen 3.008 N/A LYS 218.A N SER 211.A OG no hydrogen 3.188 N/A LYS 218.A NZ VAL 160.A O no hydrogen 2.962 N/A GLY 220.A N ALA 172.A O no hydrogen 3.103 N/A VAL 221.A N TRP 209.A O no hydrogen 2.835 N/A TYR 222.A N LEU 170.A O no hydrogen 2.794 N/A THR 223.A N ILE 206.A O no hydrogen 2.784 N/A THR 223.A OG1 ASP 84.A O no hydrogen 2.549 N/A ASP 224.A N GLY 168.A O no hydrogen 2.769 N/A VAL 225.A N GLN 204.A O no hydrogen 3.243 N/A TYR 227.A N ASP 224.A O no hydrogen 3.125 N/A TYR 228.A N VAL 225.A O no hydrogen 3.033 N/A TYR 228.A OH HIS 83.A ND1 no hydrogen 2.557 N/A LEU 229.A N ALA 226.A O no hydrogen 3.254 N/A TRP 231.A NE1 GLU 74.A OE1 no hydrogen 2.839 N/A ILE 232.A N TYR 228.A O no hydrogen 3.015 N/A ARG 233.A N LEU 229.A O no hydrogen 3.060 N/A GLU 234.A N ALA 230.A O no hydrogen 2.876 N/A HIS 235.A N TRP 231.A O no hydrogen 3.153 N/A THR 236.A N ARG 233.A O no hydrogen 3.035 N/A THR 236.A OG1 ILE 232.A O no hydrogen 2.761 N/A THR 236.A OG1 ARG 233.A O no hydrogen 3.072 N/A THR 241.A OG1 HIS 239.A O no hydrogen 3.046 N/A