Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2dup_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N LEU 222.A O no hydrogen 2.796 N/A ARG 5.A NH1 ARG 5.A O no hydrogen 2.998 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.928 N/A HIS 7.A N LYS 4.A O no hydrogen 3.142 N/A HIS 7.A ND1 ASN 52.A OD1 no hydrogen 2.737 N/A SER 8.A N ARG 5.A O no hydrogen 3.133 N/A SER 8.A OG LYS 4.A O no hydrogen 2.527 N/A LEU 9.A N MET 220.A O no hydrogen 2.620 N/A LYS 11.A NZ GLN 35.A O no hydrogen 2.559 N/A LYS 11.A NZ GLN 35.A OE1 no hydrogen 2.825 N/A TYR 13.A OH GLN 35.A O no hydrogen 3.414 N/A TYR 13.A OH ILE 218.A O no hydrogen 2.719 N/A GLN 14.A NE2 MET 21.A O no hydrogen 2.721 N/A SER 18.A OG SER 20.A OG no hydrogen 2.867 N/A SER 20.A N SER 18.A OG no hydrogen 3.296 N/A SER 20.A OG SER 18.A OG no hydrogen 2.867 N/A TRP 24.A NE1 SER 8.A O no hydrogen 2.770 N/A ASP 25.A N TRP 51.A O no hydrogen 2.828 N/A GLN 27.A N SER 49.A O no hydrogen 2.898 N/A SER 29.A N GLU 47.A O no hydrogen 2.946 N/A SER 29.A OG LEU 39.A O no hydrogen 2.923 N/A THR 30.A N GLN 27.A O no hydrogen 3.406 N/A THR 30.A OG1 GLN 27.A O no hydrogen 3.009 N/A THR 30.A OG1 SER 49.A O no hydrogen 3.125 N/A ILE 31.A N ARG 38.A O no hydrogen 2.959 N/A THR 33.A N TYR 36.A O no hydrogen 2.964 N/A THR 33.A OG1 TYR 36.A O no hydrogen 3.126 N/A GLN 35.A N THR 33.A OG1 no hydrogen 3.294 N/A TYR 36.A N THR 33.A OG1 no hydrogen 3.060 N/A VAL 37.A N ILE 217.A O no hydrogen 2.819 N/A ARG 38.A N ILE 31.A O no hydrogen 2.940 N/A ARG 38.A NE ASP 216.A OD1 no hydrogen 2.737 N/A ARG 38.A NH2 ASP 216.A OD2 no hydrogen 2.970 N/A LEU 39.A N HIS 215.A O no hydrogen 2.604 N/A THR 40.A OG1 PRO 41.A O no hydrogen 3.346 N/A THR 40.A OG1 ASP 213.A O no hydrogen 3.075 N/A THR 40.A OG1 HIS 215.A ND1 no hydrogen 2.672 N/A SER 45.A N GLY 209.A O no hydrogen 2.969 N/A LYS 46.A N THR 208.A OG1 no hydrogen 2.950 N/A GLY 48.A N ALA 206.A O no hydrogen 3.220 N/A SER 49.A N GLN 27.A O no hydrogen 2.982 N/A SER 49.A OG GLN 27.A OE1 no hydrogen 2.760 N/A ILE 50.A N ALA 204.A O no hydrogen 2.844 N/A TRP 51.A N ASP 25.A O no hydrogen 3.024 N/A ASN 52.A N PHE 202.A O no hydrogen 3.039 N/A ASN 52.A ND2 GLU 6.A O no hydrogen 3.032 N/A ASN 52.A ND2 LEU 23.A O no hydrogen 2.996 N/A HIS 53.A N LEU 23.A O no hydrogen 2.884 N/A CYS 56.A N TYR 200.A O no hydrogen 2.779 N/A TRP 61.A N TYR 168.A O no hydrogen 2.862 N/A GLU 62.A N PHE 223.A O no hydrogen 3.057 N/A MET 63.A N VAL 166.A O no hydrogen 2.854 N/A HIS 64.A N LYS 221.A O no hydrogen 2.827 N/A HIS 64.A NE2 GLU 62.A OE1 no hydrogen 2.547 N/A VAL 65.A N LEU 164.A O no hydrogen 2.797 N/A HIS 66.A N SER 219.A O no hydrogen 2.959 N/A PHE 67.A N THR 162.A O no hydrogen 3.193 N/A LYS 68.A N ASP 216.A O no hydrogen 2.917 N/A HIS 70.A N ASN 214.A O no hydrogen 3.072 N/A HIS 70.A NE2 ASP 216.A OD2 no hydrogen 2.694 N/A GLY 71.A N ASN 157.A OD1 no hydrogen 2.958 N/A THR 72.A OG1 ASP 42.A OD2 no hydrogen 3.497 N/A ASN 76.A ND2 ASN 76.A O no hydrogen 2.739 N/A LEU 77.A N LYS 74.A O no hydrogen 2.744 N/A HIS 78.A N ASN 76.A O no hydrogen 3.013 N/A HIS 78.A NE2 THR 112.A O no hydrogen 3.052 N/A GLY 79.A N SER 212.A O no hydrogen 3.225 N/A ASP 80.A N GLY 207.A O no hydrogen 2.856 N/A ILE 82.A N LEU 110.A O no hydrogen 3.176 N/A ALA 83.A N SER 205.A O no hydrogen 2.831 N/A LEU 84.A N ILE 108.A O no hydrogen 2.959 N/A TRP 85.A N GLY 203.A O no hydrogen 2.802 N/A TRP 85.A NE1 SER 205.A OG no hydrogen 2.894 N/A TYR 86.A N LEU 106.A O no hydrogen 3.101 N/A TYR 86.A OH CYS 56.A O no hydrogen 3.385 N/A TYR 86.A OH PRO 197.A O no hydrogen 2.730 N/A THR 87.A N TYR 201.A O no hydrogen 2.880 N/A THR 87.A OG1 ASP 89.A O no hydrogen 2.757 N/A ARG 88.A N HIS 104.A O no hydrogen 2.954 N/A ARG 88.A NE ASP 89.A OD1 no hydrogen 3.041 N/A ARG 88.A NH2 ASP 89.A OD1 no hydrogen 3.467 N/A ARG 88.A NH2 ASP 89.A OD2 no hydrogen 2.779 N/A ARG 90.A NH1 ASP 25.A OD2 no hydrogen 3.253 N/A ARG 90.A NH2 ASP 25.A OD2 no hydrogen 2.780 N/A ARG 90.A NH2 TRP 51.A O no hydrogen 3.010 N/A GLY 94.A N GLY 98.A O no hydrogen 3.188 N/A VAL 96.A N SER 99.A O no hydrogen 2.944 N/A SER 99.A N VAL 96.A O no hydrogen 2.998 N/A SER 99.A OG VAL 92.A O no hydrogen 3.360 N/A LYS 100.A N VAL 92.A O no hydrogen 3.008 N/A LYS 100.A NZ ASN 102.A O no hydrogen 3.494 N/A ASN 102.A N ASP 101.A OD1 no hydrogen 2.829 N/A ASN 102.A ND2 GLY 133.A O no hydrogen 2.975 N/A GLY 105.A N ASN 131.A O no hydrogen 2.833 N/A LEU 106.A N TYR 86.A O no hydrogen 3.013 N/A ALA 107.A N MET 129.A O no hydrogen 2.857 N/A ILE 108.A N LEU 84.A O no hydrogen 2.862 N/A PHE 109.A N SER 127.A O no hydrogen 2.755 N/A LEU 110.A N ILE 82.A O no hydrogen 2.804 N/A ASP 111.A N TYR 125.A O no hydrogen 2.965 N/A THR 112.A N ASP 80.A O no hydrogen 3.109 N/A THR 112.A OG1 ASP 80.A O no hydrogen 3.196 N/A TYR 113.A N ASP 111.A OD2 no hydrogen 3.286 N/A ASN 115.A N ASP 142.A OD2 no hydrogen 2.869 N/A ASP 116.A N ASP 142.A OD1 no hydrogen 2.794 N/A THR 118.A N ASP 116.A OD1 no hydrogen 2.860 N/A THR 118.A OG1 ASP 116.A OD1 no hydrogen 2.936 N/A THR 119.A N ASP 116.A O no hydrogen 3.178 N/A ARG 121.A N THR 119.A OG1 no hydrogen 3.164 N/A ARG 121.A NH2 ASP 142.A O no hydrogen 3.010 N/A TYR 125.A N ASP 111.A O no hydrogen 2.834 N/A TYR 125.A OH GLU 147.A OE2 no hydrogen 2.748 N/A ILE 126.A N CYS 151.A O no hydrogen 2.873 N/A SER 127.A N PHE 109.A O no hydrogen 2.966 N/A VAL 128.A N ALA 149.A O no hydrogen 3.097 N/A MET 129.A N ALA 107.A O no hydrogen 2.930 N/A ASN 131.A N GLY 105.A O no hydrogen 2.896 N/A ASN 131.A ND2 LEU 135.A O no hydrogen 2.876 N/A GLY 133.A N ASN 131.A OD1 no hydrogen 3.053 N/A SER 134.A N ASN 132.A OD1 no hydrogen 3.217 N/A LEU 135.A N ASN 131.A OD1 no hydrogen 3.113 N/A SER 136.A OG ASP 101.A OD2 no hydrogen 2.682 N/A TYR 137.A N ASP 101.A OD1 no hydrogen 2.995 N/A HIS 139.A NE2 PRO 95.A O no hydrogen 2.781 N/A SER 140.A OG ASP 138.A OD1 no hydrogen 3.518 N/A SER 140.A OG ASP 138.A OD2 no hydrogen 2.747 N/A LYS 141.A NZ ASP 116.A OD1 no hydrogen 2.798 N/A LYS 141.A NZ THR 118.A OG1 no hydrogen 3.097 N/A ASP 142.A N HIS 139.A O no hydrogen 2.706 N/A GLY 143.A N ASP 138.A O no hydrogen 2.642 N/A ARG 144.A N LYS 141.A O no hydrogen 3.133 N/A ARG 144.A NE ASP 116.A OD2 no hydrogen 3.274 N/A ARG 144.A NH2 ASP 116.A OD2 no hydrogen 2.572 N/A TRP 145.A NE1 ASP 138.A OD1 no hydrogen 2.648 N/A THR 146.A N GLY 143.A O no hydrogen 3.008 N/A THR 146.A OG1 GLY 143.A O no hydrogen 3.293 N/A LEU 148.A N VAL 128.A O no hydrogen 3.122 N/A CYS 151.A N ILE 126.A O no hydrogen 2.926 N/A CYS 151.A SG THR 152.A O no hydrogen 3.484 N/A ALA 153.A N PRO 124.A O no hydrogen 2.902 N/A ARG 156.A NE ASP 213.A OD2 no hydrogen 2.911 N/A ARG 156.A NH2 ASP 213.A OD1 no hydrogen 3.179 N/A ASN 157.A N VAL 69.A O no hydrogen 3.038 N/A ASN 157.A ND2 GLY 71.A O no hydrogen 3.150 N/A ARG 158.A NE ASP 154.A O no hydrogen 2.926 N/A ARG 158.A NH1 GLU 180.A OE1 no hydrogen 3.313 N/A ARG 158.A NH2 ASP 154.A O no hydrogen 3.143 N/A ARG 158.A NH2 GLU 180.A OE1 no hydrogen 3.089 N/A ARG 158.A NH2 GLU 180.A OE2 no hydrogen 2.552 N/A HIS 160.A NE2 LEU 179.A O no hydrogen 2.620 N/A THR 162.A OG1 PHE 67.A O no hydrogen 2.857 N/A PHE 163.A N ASP 178.A O no hydrogen 2.948 N/A LEU 164.A N VAL 65.A O no hydrogen 2.917 N/A ALA 165.A N MET 176.A O no hydrogen 2.773 N/A VAL 166.A N MET 63.A O no hydrogen 2.902 N/A ARG 167.A N THR 174.A O no hydrogen 2.803 N/A TYR 168.A N TRP 61.A O no hydrogen 2.755 N/A TYR 168.A OH VAL 194.A O no hydrogen 2.631 N/A SER 169.A N ARG 172.A O no hydrogen 3.137 N/A SER 169.A OG ASP 60.A OD1 no hydrogen 2.613 N/A ARG 172.A N SER 169.A O no hydrogen 3.088 N/A ARG 172.A NE ASP 190.A OD1 no hydrogen 2.799 N/A ARG 172.A NH2 ASP 190.A OD1 no hydrogen 3.432 N/A ARG 172.A NH2 ASP 190.A OD2 no hydrogen 2.431 N/A LEU 173.A N ILE 191.A O no hydrogen 2.695 N/A THR 174.A N ARG 167.A O no hydrogen 2.948 N/A THR 174.A OG1 ASP 190.A OD1 no hydrogen 2.987 N/A VAL 175.A N ILE 189.A O no hydrogen 2.868 N/A MET 176.A N ALA 165.A O no hydrogen 2.899 N/A THR 177.A N LYS 186.A O no hydrogen 2.839 N/A ASP 178.A N PHE 163.A O no hydrogen 2.909 N/A LYS 186.A N THR 177.A O no hydrogen 2.810 N/A ASN 187.A ND2 ILE 189.A O no hydrogen 3.166 N/A CYS 188.A N VAL 175.A O no hydrogen 3.188 N/A ILE 189.A N VAL 175.A O no hydrogen 3.050 N/A ILE 191.A N LEU 173.A O no hydrogen 3.049 N/A VAL 194.A N GLY 171.A O no hydrogen 2.959 N/A ARG 195.A N SER 239.A O no hydrogen 2.782 N/A THR 198.A N TRP 233.A O no hydrogen 3.000 N/A GLY 199.A N CYS 56.A O no hydrogen 2.673 N/A TYR 201.A N THR 87.A O no hydrogen 2.950 N/A GLY 203.A N TRP 85.A O no hydrogen 3.043 N/A ALA 204.A N ILE 50.A O no hydrogen 3.100 N/A SER 205.A N ALA 83.A O no hydrogen 2.820 N/A SER 205.A OG PHE 97.A O no hydrogen 2.505 N/A ALA 206.A N GLY 48.A O no hydrogen 2.980 N/A GLY 207.A N GLY 81.A O no hydrogen 3.314 N/A THR 208.A N LYS 46.A O no hydrogen 3.045 N/A THR 208.A OG1 GLU 43.A O no hydrogen 2.639 N/A GLY 209.A N LEU 211.A O no hydrogen 2.813 N/A SER 212.A OG ASP 42.A OD1 no hydrogen 2.640 N/A ASN 214.A N HIS 70.A O no hydrogen 2.812 N/A ASN 214.A ND2 HIS 70.A O no hydrogen 3.141 N/A HIS 215.A N THR 40.A O no hydrogen 3.192 N/A HIS 215.A ND1 THR 40.A OG1 no hydrogen 2.672 N/A ASP 216.A N LYS 68.A O no hydrogen 2.836 N/A ILE 217.A N VAL 37.A O no hydrogen 2.796 N/A ILE 218.A N HIS 66.A O no hydrogen 2.784 N/A SER 219.A N HIS 66.A O no hydrogen 3.318 N/A MET 220.A N LEU 9.A O no hydrogen 2.843 N/A LYS 221.A N HIS 64.A O no hydrogen 2.894 N/A LEU 222.A N SER 8.A OG no hydrogen 3.190 N/A PHE 223.A N GLU 62.A O no hydrogen 2.812 N/A GLN 224.A N HIS 2.A O no hydrogen 2.765 N/A LEU 225.A N ASP 60.A O no hydrogen 3.103 N/A HIS 229.A NE2 ASP 60.A OD2 no hydrogen 2.649 N/A THR 234.A N ASP 232.A OD1 no hydrogen 3.312 N/A THR 234.A OG1 ASP 232.A OD1 no hydrogen 2.932 N/A LYS 235.A N ASP 232.A O no hydrogen 3.267 N/A SER 239.A N ARG 195.A O no hydrogen 2.991 N/A ASN 241.A N GLY 193.A O no hydrogen 2.786 N/A