Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a7e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLN 5.A OE1 no hydrogen 2.798 N/A LYS 3.A NZ TRP 36.A O no hydrogen 2.705 N/A GLN 5.A N THR 2.A O no hydrogen 2.995 N/A ARG 6.A N THR 2.A O no hydrogen 3.235 N/A ARG 6.A NE GLU 35.A OE2 no hydrogen 3.165 N/A ARG 6.A NH1 GLU 35.A OE1 no hydrogen 2.580 N/A ARG 6.A NH1 GLU 35.A OE2 no hydrogen 3.186 N/A ARG 6.A NH2 ASP 1.A OD1 no hydrogen 3.074 N/A ILE 7.A N LYS 3.A O no hydrogen 3.380 N/A ASN 9.A N GLN 5.A O no hydrogen 2.997 N/A HIS 10.A N ARG 6.A O no hydrogen 2.811 N/A VAL 11.A N ILE 7.A O no hydrogen 3.270 N/A LEU 12.A N LEU 8.A O no hydrogen 2.819 N/A GLN 13.A N HIS 10.A O no hydrogen 2.957 N/A HIS 14.A N HIS 10.A O no hydrogen 2.719 N/A HIS 14.A ND1 HIS 10.A O no hydrogen 2.971 N/A ALA 15.A N VAL 11.A O no hydrogen 2.961 N/A GLU 16.A N SER 22.A OG no hydrogen 3.212 N/A GLY 18.A N PHE 103.A O no hydrogen 2.822 N/A ASN 19.A N GLU 16.A O no hydrogen 3.323 N/A GLN 21.A NE2 GLU 25.A OE2 no hydrogen 3.357 N/A VAL 23.A N ASN 19.A O no hydrogen 3.381 N/A LEU 24.A N ALA 20.A O no hydrogen 3.299 N/A GLU 25.A N GLN 21.A O no hydrogen 3.236 N/A ALA 26.A N SER 22.A O no hydrogen 2.973 N/A ILE 27.A N VAL 23.A O no hydrogen 2.901 N/A ASP 28.A N LEU 24.A O no hydrogen 2.974 N/A THR 29.A N GLU 25.A O no hydrogen 3.020 N/A THR 29.A OG1 GLU 25.A O no hydrogen 3.168 N/A THR 29.A OG1 ALA 26.A O no hydrogen 3.507 N/A TYR 30.A N ALA 26.A O no hydrogen 3.076 N/A TYR 30.A OH GLU 35.A OE2 no hydrogen 2.513 N/A CYS 31.A N ILE 27.A O no hydrogen 3.173 N/A CYS 31.A SG ILE 27.A O no hydrogen 3.256 N/A GLU 32.A N ASP 28.A O no hydrogen 2.705 N/A GLN 33.A N THR 29.A O no hydrogen 3.073 N/A LYS 34.A N TYR 30.A O no hydrogen 2.729 N/A GLU 35.A N TYR 30.A O no hydrogen 3.340 N/A TRP 36.A NE1 GLU 197.A O no hydrogen 3.243 N/A ASN 39.A N ALA 37.A O no hydrogen 2.795 N/A ASN 39.A ND2 TYR 198.A OH no hydrogen 2.757 N/A LYS 44.A NZ ASP 167.A OD1 no hydrogen 2.597 N/A LYS 44.A NZ GLU 197.A OE1 no hydrogen 3.143 N/A LYS 44.A NZ ASP 203.A OD2 no hydrogen 2.787 N/A GLY 45.A N GLY 41.A O no hydrogen 3.180 N/A LYS 46.A N ASP 42.A O no hydrogen 2.821 N/A ILE 47.A N LYS 44.A O no hydrogen 2.987 N/A VAL 48.A N LYS 44.A O no hydrogen 3.000 N/A ASP 49.A N GLY 45.A O no hydrogen 2.886 N/A ALA 50.A N LYS 46.A O no hydrogen 3.168 N/A VAL 51.A N ILE 47.A O no hydrogen 2.813 N/A ILE 52.A N VAL 48.A O no hydrogen 2.736 N/A GLN 53.A N ASP 49.A O no hydrogen 2.864 N/A GLN 53.A NE2 ASP 49.A O no hydrogen 2.941 N/A GLU 54.A N ALA 50.A O no hydrogen 3.218 N/A HIS 55.A N VAL 51.A O no hydrogen 3.075 N/A GLN 56.A N ILE 52.A O no hydrogen 2.738 N/A VAL 59.A N ASP 134.A OD2 no hydrogen 2.861 N/A LEU 60.A N ARG 83.A O no hydrogen 3.018 N/A LEU 61.A N MET 135.A O no hydrogen 2.657 N/A GLU 62.A N ILE 85.A O no hydrogen 2.724 N/A LEU 63.A N PHE 137.A O no hydrogen 2.877 N/A GLY 64.A N ILE 87.A O no hydrogen 2.527 N/A TYR 66.A N GLU 88.A OE1 no hydrogen 3.003 N/A TYR 66.A OH GLU 4.A OE2 no hydrogen 2.535 N/A GLY 68.A N ALA 65.A O no hydrogen 3.224 N/A TYR 69.A OH ASP 28.A OD2 no hydrogen 2.802 N/A SER 70.A OG GLU 62.A OE1 no hydrogen 2.407 N/A VAL 72.A N GLY 68.A O no hydrogen 2.804 N/A ARG 73.A N TYR 69.A O no hydrogen 3.035 N/A ARG 73.A NE ASP 49.A OD1 no hydrogen 3.274 N/A ARG 73.A NE ASP 49.A OD2 no hydrogen 3.058 N/A ARG 73.A NH1 ASP 42.A OD1 no hydrogen 3.388 N/A ARG 73.A NH1 ASP 49.A OD2 no hydrogen 2.858 N/A ARG 73.A NH2 ASP 42.A OD1 no hydrogen 3.161 N/A MET 74.A N SER 70.A O no hydrogen 2.906 N/A ALA 75.A N ALA 71.A O no hydrogen 3.076 N/A ARG 76.A N VAL 72.A O no hydrogen 3.043 N/A ARG 76.A NE GLN 21.A OE1 no hydrogen 3.631 N/A ARG 76.A NH1 ASP 49.A OD1 no hydrogen 3.542 N/A ARG 76.A NH1 ASP 49.A OD2 no hydrogen 2.865 N/A ARG 76.A NH2 ASP 49.A OD1 no hydrogen 3.468 N/A LEU 77.A N MET 74.A O no hydrogen 3.113 N/A LEU 78.A N ALA 75.A O no hydrogen 3.505 N/A ALA 82.A N SER 79.A O no hydrogen 3.075 N/A ARG 83.A N SER 58.A O no hydrogen 2.805 N/A ARG 83.A NH1 TYR 128.A O no hydrogen 2.854 N/A LEU 84.A N LYS 109.A O no hydrogen 2.892 N/A ILE 85.A N LEU 60.A O no hydrogen 2.973 N/A THR 86.A N THR 111.A O no hydrogen 3.118 N/A THR 86.A OG1 GLU 62.A OE2 no hydrogen 2.550 N/A ILE 87.A N GLU 62.A O no hydrogen 2.950 N/A GLU 88.A N VAL 113.A O no hydrogen 3.002 N/A ASN 90.A N GLU 88.A OE2 no hydrogen 2.845 N/A ASP 92.A N ASN 90.A OD1 no hydrogen 2.653 N/A CYS 93.A N ASN 90.A OD1 no hydrogen 3.264 N/A ALA 94.A N ASN 90.A O no hydrogen 2.847 N/A ALA 95.A N PRO 91.A O no hydrogen 3.041 N/A ILE 96.A N CYS 93.A O no hydrogen 3.302 N/A THR 97.A N CYS 93.A O no hydrogen 2.953 N/A THR 97.A OG1 TYR 66.A O no hydrogen 2.873 N/A THR 97.A OG1 CYS 93.A O no hydrogen 3.162 N/A GLN 98.A NE2 GLN 98.A O no hydrogen 3.508 N/A GLN 98.A NE2 ASP 102.A OD2 no hydrogen 3.196 N/A ARG 99.A N ALA 95.A O no hydrogen 3.483 N/A MET 100.A N ILE 96.A O no hydrogen 2.992 N/A VAL 101.A N THR 97.A O no hydrogen 2.866 N/A ASP 102.A N GLN 98.A O no hydrogen 2.796 N/A PHE 103.A N ARG 99.A O no hydrogen 2.939 N/A ALA 104.A N MET 100.A O no hydrogen 3.133 N/A GLY 105.A N ASP 102.A O no hydrogen 2.998 N/A VAL 106.A N VAL 101.A O no hydrogen 3.094 N/A LYS 107.A NZ ASP 102.A O no hydrogen 3.447 N/A THR 111.A N LEU 84.A O no hydrogen 2.843 N/A VAL 113.A N THR 86.A O no hydrogen 3.143 N/A GLY 115.A N GLU 88.A O no hydrogen 3.165 N/A SER 117.A OG GLN 118.A OE1 no hydrogen 3.503 N/A SER 117.A OG ASP 148.A OD2 no hydrogen 2.404 N/A GLN 118.A N GLN 118.A OE1 no hydrogen 2.637 N/A ASP 119.A N ALA 116.A O no hydrogen 2.771 N/A ILE 120.A N ALA 116.A O no hydrogen 3.191 N/A ILE 121.A N SER 117.A O no hydrogen 3.116 N/A GLN 123.A N ILE 120.A O no hydrogen 2.966 N/A LEU 124.A N ILE 121.A O no hydrogen 3.224 N/A LYS 125.A NZ ASP 131.A O no hydrogen 3.028 N/A LYS 127.A N GLN 123.A O no hydrogen 3.216 N/A TYR 128.A N LEU 124.A O no hydrogen 3.339 N/A VAL 130.A N LYS 125.A O no hydrogen 2.968 N/A LEU 133.A N LEU 157.A O no hydrogen 3.058 N/A ASP 134.A N VAL 59.A O no hydrogen 2.941 N/A VAL 136.A N VAL 163.A O no hydrogen 2.909 N/A PHE 137.A N LEU 61.A O no hydrogen 2.578 N/A LEU 138.A N LEU 165.A O no hydrogen 2.897 N/A ASP 139.A N LEU 63.A O no hydrogen 3.281 N/A HIS 140.A N HIS 140.A ND1 no hydrogen 2.666 N/A HIS 140.A NE2 ASP 148.A OD2 no hydrogen 2.688 N/A LYS 142.A NZ ASP 139.A OD2 no hydrogen 3.172 N/A LYS 142.A NZ HIS 140.A O no hydrogen 2.905 N/A LYS 142.A NZ TYR 145.A OH no hydrogen 2.633 N/A LYS 142.A NZ ASN 168.A OD1 no hydrogen 3.115 N/A ARG 144.A N TRP 141.A O no hydrogen 3.057 N/A ARG 144.A NE ASP 148.A OD1 no hydrogen 3.412 N/A ARG 144.A NE ASP 148.A OD2 no hydrogen 3.355 N/A ARG 144.A NH1 ASP 148.A OD1 no hydrogen 3.029 N/A TYR 145.A OH ASP 167.A O no hydrogen 2.616 N/A ASP 148.A N ARG 144.A O no hydrogen 2.941 N/A THR 149.A N TYR 145.A O no hydrogen 3.028 N/A THR 149.A N LEU 146.A O no hydrogen 2.994 N/A THR 149.A OG1 TYR 145.A O no hydrogen 2.785 N/A LEU 150.A N LEU 146.A O no hydrogen 3.110 N/A LEU 151.A N PRO 147.A O no hydrogen 2.867 N/A LEU 152.A N ASP 148.A O no hydrogen 2.877 N/A GLU 153.A N THR 149.A O no hydrogen 2.957 N/A GLU 154.A N LEU 150.A O no hydrogen 2.792 N/A CYS 155.A N LEU 151.A O no hydrogen 3.176 N/A CYS 155.A SG LEU 151.A O no hydrogen 3.390 N/A GLY 156.A N GLU 153.A O no hydrogen 3.116 N/A LEU 157.A N LEU 152.A O no hydrogen 3.041 N/A ARG 159.A N THR 162.A OG1 no hydrogen 2.813 N/A ARG 159.A NH1 ASP 134.A OD1 no hydrogen 2.308 N/A ARG 159.A NH2 LYS 160.A O no hydrogen 3.549 N/A GLY 161.A N TYR 210.A O no hydrogen 2.849 N/A THR 162.A N ARG 159.A O no hydrogen 2.954 N/A THR 162.A OG1 LEU 133.A O no hydrogen 2.866 N/A THR 162.A OG1 ARG 159.A O no hydrogen 2.760 N/A VAL 163.A N ASP 134.A O no hydrogen 3.169 N/A LEU 164.A N ALA 208.A O no hydrogen 2.801 N/A LEU 165.A N VAL 136.A O no hydrogen 2.865 N/A ALA 166.A N GLU 206.A O no hydrogen 2.776 N/A ASP 167.A N LEU 138.A O no hydrogen 3.098 N/A ASN 168.A ND2 CYS 171.A O no hydrogen 3.141 N/A ASN 168.A ND2 ASP 203.A OD2 no hydrogen 3.009 N/A ILE 170.A N ASP 203.A OD1 no hydrogen 3.166 N/A CYS 171.A N ASP 203.A OD1 no hydrogen 3.243 N/A CYS 171.A SG VAL 202.A O no hydrogen 3.774 N/A GLY 173.A N ASN 168.A O no hydrogen 2.999 N/A LEU 178.A N ALA 174.A O no hydrogen 2.812 N/A ALA 179.A N PRO 175.A O no hydrogen 2.876 N/A HIS 180.A N ASP 176.A O no hydrogen 2.994 N/A VAL 181.A N PHE 177.A O no hydrogen 2.972 N/A ARG 182.A N LEU 178.A O no hydrogen 3.134 N/A ARG 182.A NE GLU 206.A OE2 no hydrogen 3.046 N/A ARG 182.A NH1 GLU 206.A OE1 no hydrogen 3.538 N/A GLY 183.A N ALA 179.A O no hydrogen 3.251 N/A SER 184.A N HIS 180.A O no hydrogen 2.883 N/A CYS 186.A N SER 184.A OG no hydrogen 3.361 N/A CYS 186.A SG SER 184.A OG no hydrogen 3.632 N/A CYS 186.A SG GLY 212.A OXT no hydrogen 3.666 N/A PHE 187.A N SER 184.A O no hydrogen 3.434 N/A GLU 188.A N ILE 209.A O no hydrogen 3.104 N/A THR 190.A N LYS 207.A O no hydrogen 2.895 N/A HIS 191.A ND1 GLU 206.A OE1 no hydrogen 2.887 N/A TYR 192.A N LEU 205.A O no hydrogen 2.925 N/A GLN 193.A NE2 HIS 191.A O no hydrogen 3.530 N/A SER 194.A N ASP 203.A O no hydrogen 2.860 N/A PHE 195.A N SER 194.A OG no hydrogen 2.511 N/A LEU 196.A N VAL 201.A O no hydrogen 2.871 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.832 N/A TYR 198.A OH ASP 28.A OD1 no hydrogen 3.320 N/A LEU 205.A N TYR 192.A O no hydrogen 3.017 N/A GLU 206.A N ALA 166.A O no hydrogen 3.054 N/A LYS 207.A N THR 190.A O no hydrogen 2.843 N/A LYS 207.A NZ TYR 192.A OH no hydrogen 2.841 N/A ALA 208.A N LEU 164.A O no hydrogen 2.681 N/A ILE 209.A N GLU 188.A O no hydrogen 3.083 N/A TYR 210.A N THR 162.A O no hydrogen 2.930 N/A TYR 210.A OH GLU 153.A OE1 no hydrogen 2.506 N/A LYS 211.A N CYS 186.A O no hydrogen 2.644 N/A