Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1oe6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG SER 5.A OG no hydrogen 3.130 N/A PHE 6.A N PRO 2.A O no hydrogen 2.708 N/A LEU 7.A N ALA 3.A O no hydrogen 3.096 N/A LYS 8.A N ASP 4.A O no hydrogen 3.094 N/A VAL 9.A N SER 5.A O no hydrogen 2.927 N/A GLU 10.A N PHE 6.A O no hydrogen 2.940 N/A LEU 11.A N LEU 7.A O no hydrogen 2.718 N/A GLU 12.A N LYS 8.A O no hydrogen 2.810 N/A LEU 13.A N VAL 9.A O no hydrogen 3.168 N/A ASN 14.A N GLU 10.A O no hydrogen 3.016 N/A LEU 15.A N LEU 11.A O no hydrogen 3.403 N/A LYS 16.A N GLU 12.A O no hydrogen 3.223 N/A LEU 17.A N LEU 13.A O no hydrogen 3.008 N/A SER 18.A N ASN 14.A O no hydrogen 2.553 N/A SER 18.A OG ASN 14.A O no hydrogen 3.451 N/A SER 18.A OG LEU 15.A O no hydrogen 2.582 N/A ASN 19.A N LYS 16.A O no hydrogen 2.998 N/A LEU 20.A N LEU 17.A O no hydrogen 3.231 N/A GLN 23.A N GLN 161.A OE1 no hydrogen 2.914 N/A VAL 26.A N GLN 23.A O no hydrogen 2.730 N/A GLN 27.A N MET 145.A O no hydrogen 2.742 N/A TYR 28.A N MET 145.A O no hydrogen 3.269 N/A TYR 30.A N ILE 143.A O no hydrogen 2.745 N/A TYR 30.A OH ARG 99.A O no hydrogen 2.777 N/A ASN 31.A ND2 ASN 14.A OD1 no hydrogen 2.880 N/A LEU 33.A N ASN 31.A OD1 no hydrogen 2.756 N/A VAL 34.A N ASN 31.A O no hydrogen 2.794 N/A TYR 35.A OH ALA 67.A O no hydrogen 2.800 N/A ALA 36.A N PRO 32.A O no hydrogen 2.971 N/A TRP 37.A N VAL 34.A O no hydrogen 3.283 N/A HIS 40.A N ALA 36.A O no hydrogen 3.254 N/A GLU 41.A N TRP 37.A O no hydrogen 2.750 N/A ASN 42.A N ALA 38.A O no hydrogen 2.862 N/A ASN 42.A ND2.A GLU 86.A O no hydrogen 3.369 N/A TYR 43.A N PRO 39.A O no hydrogen 3.076 N/A TYR 43.A OH VAL 136.A O no hydrogen 2.919 N/A VAL 44.A N HIS 40.A O no hydrogen 2.958 N/A GLN 45.A N GLU 41.A O no hydrogen 2.800 N/A GLN 45.A NE2 ASP 4.A OD1 no hydrogen 3.019 N/A GLN 45.A NE2 GLU 41.A OE2 no hydrogen 3.256 N/A THR 46.A N ASN 42.A O.A no hydrogen 2.767 N/A THR 46.A N ASN 42.A O.B no hydrogen 2.772 N/A THR 46.A N TYR 43.A O no hydrogen 3.155 N/A THR 46.A OG1 ASN 42.A O.A no hydrogen 2.674 N/A THR 46.A OG1 ASN 42.A O.B no hydrogen 2.665 N/A TYR 47.A N TYR 43.A O no hydrogen 2.929 N/A TYR 47.A OH LEU 83.A O no hydrogen 2.447 N/A CYS 48.A N VAL 44.A O no hydrogen 2.815 N/A SER 50.A OG LYS 51.A O no hydrogen 2.772 N/A LYS 52.A N LEU 180.A O no hydrogen 2.909 N/A LYS 52.A NZ TYR 47.A O no hydrogen 2.831 N/A LYS 52.A NZ PHE 131.A O no hydrogen 2.805 N/A LYS 52.A NZ CYS 134.A O no hydrogen 3.477 N/A GLU 53.A N HIS 133.A O no hydrogen 3.065 N/A VAL 54.A N HIS 133.A O no hydrogen 3.154 N/A LEU 55.A N LEU 184.A O no hydrogen 3.097 N/A PHE 56.A N PHE 135.A O no hydrogen 2.882 N/A LEU 57.A N ILE 186.A O no hydrogen 2.602 N/A GLY 58.A N HIS 137.A O no hydrogen 2.871 N/A ASN 60.A ND2 LEU 142.A O no hydrogen 3.029 N/A PHE 64.A N GLU 110.A OE1 no hydrogen 2.906 N/A GLY 65.A N GLY 62.A O no hydrogen 3.170 N/A ALA 67.A N GLY 62.A O no hydrogen 3.187 N/A GLN 68.A N GLY 65.A O no hydrogen 2.906 N/A GLN 68.A NE2 PRO 63.A O no hydrogen 3.070 N/A THR 69.A N GLY 65.A O no hydrogen 2.929 N/A THR 69.A OG1 GLY 65.A O no hydrogen 3.115 N/A THR 69.A OG1 GLY 74.A O no hydrogen 2.769 N/A GLY 70.A N MET 66.A O no hydrogen 2.938 N/A VAL 71.A N THR 69.A OG1 no hydrogen 3.295 N/A GLU 75.A N PHE 73.A O no hydrogen 2.968 N/A ASN 77.A ND2 GLU 75.A OE2 no hydrogen 3.325 N/A HIS 78.A N GLU 75.A OE1 no hydrogen 2.694 N/A HIS 78.A ND1 GLU 75.A OE1 no hydrogen 2.592 N/A VAL 79.A N GLU 75.A O no hydrogen 3.121 N/A ARG 80.A N VAL 76.A O no hydrogen 2.968 N/A ARG 80.A NH2 GLU 86.A OE1 no hydrogen 3.386 N/A ASP 81.A N ASN 77.A O no hydrogen 2.919 N/A TRP 82.A N HIS 78.A O no hydrogen 2.902 N/A TRP 82.A NE1 GLY 125.A O no hydrogen 3.043 N/A LEU 83.A N HIS 78.A O no hydrogen 3.142 N/A GLN 84.A N VAL 79.A O no hydrogen 2.742 N/A ILE 85.A N VAL 79.A O no hydrogen 3.340 N/A SER 90.A N TYR 35.A O no hydrogen 2.900 N/A HIS 96.A N TYR 30.A OH no hydrogen 3.051 N/A HIS 96.A NE2 HIS 147.A O no hydrogen 2.712 N/A LYS 98.A N HIS 96.A ND1 no hydrogen 3.015 N/A ARG 99.A N HIS 96.A O no hydrogen 3.203 N/A ARG 99.A NH1 LYS 98.A O no hydrogen 2.965 N/A ILE 101.A N GLU 95.A OE2 no hydrogen 3.041 N/A ARG 102.A N GLN 68.A OE1 no hydrogen 2.905 N/A ARG 102.A NH2 GLU 105.A OE1 no hydrogen 3.152 N/A GLU 105.A N ARG 102.A O no hydrogen 3.079 N/A CYS 106.A N GLY 103.A O no hydrogen 3.181 N/A CYS 106.A SG GLN 108.A O no hydrogen 3.853 N/A SER 109.A OG GLU 75.A OE2 no hydrogen 3.073 N/A ALA 114.A N GLU 110.A O no hydrogen 2.833 N/A ARG 115.A N VAL 111.A O no hydrogen 2.837 N/A ARG 115.A NH1 PRO 215.A O no hydrogen 2.702 N/A PHE 116.A N SER 112.A O no hydrogen 3.010 N/A TRP 117.A N GLY 113.A O no hydrogen 2.709 N/A TRP 117.A NE1 PRO 72.A O no hydrogen 3.272 N/A SER 118.A N ALA 114.A O no hydrogen 3.067 N/A LEU 119.A N ARG 115.A O no hydrogen 2.971 N/A PHE 120.A N PHE 116.A O no hydrogen 3.510 N/A LYS 121.A N TRP 117.A O no hydrogen 2.785 N/A SER 122.A N SER 118.A O no hydrogen 3.143 N/A SER 122.A N LEU 119.A O no hydrogen 3.185 N/A LEU 123.A N LEU 119.A O no hydrogen 2.996 N/A CYS 124.A N PHE 120.A O no hydrogen 2.751 N/A CYS 124.A SG PHE 120.A O no hydrogen 3.573 N/A CYS 124.A SG LEU 243.A O no hydrogen 3.694 N/A GLY 125.A N LYS 121.A O no hydrogen 2.927 N/A GLN 126.A N CYS 124.A O no hydrogen 2.956 N/A THR 129.A N GLN 126.A O no hydrogen 3.029 N/A PHE 131.A N PRO 127.A O no hydrogen 2.838 N/A CYS 134.A N PHE 130.A O no hydrogen 3.296 N/A PHE 135.A N VAL 54.A O no hydrogen 3.055 N/A HIS 137.A N PHE 56.A O no hydrogen 3.137 N/A HIS 139.A N GLY 58.A O no hydrogen 3.086 N/A HIS 139.A NE2 ASP 170.A OD1 no hydrogen 3.005 N/A CYS 140.A N MET 59.A O no hydrogen 3.120 N/A CYS 140.A SG LEU 142.A O no hydrogen 4.035 N/A ILE 143.A N TYR 30.A O no hydrogen 2.648 N/A MET 145.A N TYR 28.A O no hydrogen 2.913 N/A ASN 146.A N LYS 150.A O no hydrogen 3.040 N/A SER 148.A OG ASN 146.A OD1 no hydrogen 2.896 N/A GLY 149.A N ASN 146.A O no hydrogen 2.642 N/A LYS 150.A N ASN 146.A OD1 no hydrogen 2.988 N/A LEU 152.A N PHE 144.A O no hydrogen 2.813 N/A THR 153.A N ASP 156.A OD2 no hydrogen 3.273 N/A ASP 156.A N THR 153.A OG1 no hydrogen 3.401 N/A LEU 157.A N PRO 154.A O no hydrogen 3.104 N/A LYS 159.A NZ ASP 163.A OD2 no hydrogen 2.927 N/A GLN 161.A N PRO 158.A O no hydrogen 3.231 N/A GLN 161.A NE2 GLN 23.A O no hydrogen 3.099 N/A ARG 162.A N PRO 158.A O no hydrogen 3.259 N/A ASP 163.A N LYS 159.A O no hydrogen 3.099 N/A THR 164.A OG1 ALA 160.A O no hydrogen 2.929 N/A LEU 165.A N GLN 161.A O no hydrogen 3.285 N/A LEU 166.A N ARG 162.A O no hydrogen 2.932 N/A GLU 167.A N ASP 163.A O no hydrogen 3.038 N/A GLU 167.A N THR 164.A O no hydrogen 3.308 N/A ILE 168.A N THR 164.A O no hydrogen 3.050 N/A CYS 169.A N LEU 165.A O no hydrogen 2.694 N/A CYS 169.A SG HIS 139.A O no hydrogen 3.239 N/A CYS 169.A SG LEU 165.A O no hydrogen 3.635 N/A ASP 170.A N LEU 166.A O no hydrogen 3.064 N/A LEU 173.A N CYS 169.A O no hydrogen 2.913 N/A CYS 174.A N ASP 170.A O no hydrogen 2.926 N/A CYS 174.A SG ASP 170.A O no hydrogen 3.322 N/A CYS 174.A SG ALA 199.A O no hydrogen 3.614 N/A GLN 175.A N GLU 171.A O no hydrogen 2.743 N/A ALA 176.A N ALA 172.A O no hydrogen 2.810 N/A VAL 177.A N LEU 173.A O no hydrogen 2.804 N/A ARG 178.A N CYS 174.A O no hydrogen 3.072 N/A VAL 179.A N GLN 175.A O no hydrogen 2.584 N/A LEU 180.A N ALA 176.A O no hydrogen 2.955 N/A GLY 181.A N VAL 177.A O no hydrogen 3.169 N/A GLY 181.A N ARG 178.A O no hydrogen 3.426 N/A LYS 183.A N GLU 53.A O no hydrogen 3.013 N/A LYS 183.A NZ GLY 181.A O no hydrogen 3.022 N/A LEU 184.A N GLU 53.A O no hydrogen 2.774 N/A VAL 185.A N THR 208.A O no hydrogen 2.969 N/A ILE 186.A N LEU 55.A O no hydrogen 2.986 N/A GLY 187.A N LYS 210.A O no hydrogen 3.207 N/A VAL 188.A N LEU 57.A O no hydrogen 3.067 N/A GLY 189.A N ILE 212.A O no hydrogen 2.968 N/A ARG 190.A NH1 GLU 193.A OE1 no hydrogen 2.860 N/A SER 192.A OG LEU 57.A O no hydrogen 3.182 N/A SER 192.A OG VAL 188.A O no hydrogen 3.448 N/A GLU 193.A N GLY 189.A O no hydrogen 2.985 N/A GLN 194.A N ARG 190.A O no hydrogen 2.776 N/A GLN 194.A NE2 ARG 190.A O no hydrogen 3.533 N/A ARG 195.A N PHE 191.A O no hydrogen 2.920 N/A ARG 195.A NE ASP 170.A OD1 no hydrogen 2.859 N/A ARG 195.A NH1 LEU 166.A O no hydrogen 3.321 N/A ARG 195.A NH1 ASP 170.A OD1 no hydrogen 3.412 N/A ARG 195.A NH1 ASP 170.A OD2 no hydrogen 2.654 N/A ALA 196.A N SER 192.A O no hydrogen 2.866 N/A ARG 197.A N GLU 193.A O no hydrogen 2.998 N/A ARG 197.A NH1 GLU 193.A OE2 no hydrogen 3.225 N/A ARG 197.A NH2 GLU 193.A OE2 no hydrogen 2.576 N/A ARG 197.A NH2 VAL 209.A O no hydrogen 2.794 N/A LYS 198.A N GLN 194.A O no hydrogen 3.277 N/A LYS 198.A NZ GLN 194.A O no hydrogen 3.312 N/A ALA 199.A N ARG 195.A O no hydrogen 3.118 N/A LEU 200.A N ALA 196.A O no hydrogen 3.019 N/A LEU 200.A N ARG 197.A O no hydrogen 3.234 N/A MET 201.A N ARG 197.A O no hydrogen 2.970 N/A ALA 202.A N LYS 198.A O no hydrogen 3.168 N/A GLY 204.A N MET 201.A O no hydrogen 2.626 N/A ILE 205.A N LEU 200.A O no hydrogen 2.939 N/A THR 208.A N LYS 183.A O no hydrogen 3.284 N/A LYS 210.A N VAL 185.A O no hydrogen 2.926 N/A ILE 212.A N GLY 187.A O no hydrogen 2.923 N/A MET 213.A N GLN 233.A OE1 no hydrogen 2.880 N/A SER 216.A N HIS 214.A ND1 no hydrogen 2.905 N/A ARG 218.A N SER 216.A OG no hydrogen 3.089 N/A ASN 219.A N SER 216.A O no hydrogen 3.168 N/A ASN 219.A ND2 HIS 214.A O no hydrogen 3.360 N/A GLN 221.A N ASN 219.A OD1 no hydrogen 3.027 N/A ALA 222.A N ASN 219.A O no hydrogen 2.690 N/A ASN 223.A ND2 PRO 217.A O no hydrogen 3.541 N/A TRP 226.A NE1 MET 213.A O no hydrogen 2.956 N/A ILE 229.A N GLY 225.A O no hydrogen 2.908 N/A VAL 230.A N TRP 226.A O no hydrogen 2.745 N/A ARG 231.A N GLU 227.A O no hydrogen 2.849 N/A GLY 232.A N GLY 228.A O no hydrogen 3.349 N/A GLN 233.A N ILE 229.A O no hydrogen 2.906 N/A LEU 234.A N VAL 230.A O no hydrogen 2.959 N/A LEU 235.A N ARG 231.A O no hydrogen 3.191 N/A GLU 236.A N GLY 232.A O no hydrogen 3.059 N/A GLY 238.A N LEU 235.A O no hydrogen 2.639 N/A VAL 239.A N LEU 234.A O no hydrogen 3.319 N/A THR 244.A N SER 241.A O no hydrogen 3.004 N/A