Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3th6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 222.A OD1 no hydrogen 2.815 N/A ARG 2.A NE ASP 222.A OD2 no hydrogen 3.127 N/A ARG 2.A NH1 SER 197.A O no hydrogen 2.898 N/A ARG 2.A NH2 ASP 222.A OD1 no hydrogen 3.438 N/A ARG 3.A NE ASN 34.A O no hydrogen 2.752 N/A ARG 3.A NH2 PRO 33.A O no hydrogen 3.491 N/A ARG 3.A NH2 VAL 35.A O no hydrogen 3.309 N/A CYS 5.A N ASP 222.A O no hydrogen 2.954 N/A CYS 5.A SG GLU 36.A O no hydrogen 3.720 N/A VAL 6.A N GLU 36.A O no hydrogen 2.970 N/A GLY 7.A N PHE 224.A O no hydrogen 2.764 N/A GLY 8.A N ILE 38.A O no hydrogen 2.642 N/A ASN 9.A N VAL 226.A O no hydrogen 2.824 N/A TRP 10.A N ALA 40.A O no hydrogen 3.188 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 3.046 N/A LYS 11.A NZ GLU 95.A OE2 no hydrogen 2.893 N/A HIS 13.A ND1 TRP 10.A O no hydrogen 3.092 N/A SER 15.A N SER 18.A OG no hydrogen 2.810 N/A SER 15.A OG SER 18.A OG no hydrogen 3.179 N/A SER 18.A N SER 15.A OG no hydrogen 2.900 N/A SER 18.A OG SER 15.A O no hydrogen 3.279 N/A SER 18.A OG SER 15.A OG no hydrogen 3.179 N/A ILE 19.A N SER 15.A O no hydrogen 2.961 N/A ARG 20.A N LYS 16.A O no hydrogen 3.290 N/A ASP 21.A N ASN 17.A O no hydrogen 3.312 N/A ILE 22.A N SER 18.A O no hydrogen 3.346 N/A CYS 23.A N ILE 19.A O no hydrogen 3.131 N/A CYS 23.A SG ILE 19.A O no hydrogen 3.303 N/A ASN 24.A N ARG 20.A O no hydrogen 3.018 N/A THR 25.A N ASP 21.A O no hydrogen 2.901 N/A THR 25.A OG1 ASP 21.A O no hydrogen 3.275 N/A LEU 26.A N ILE 22.A O no hydrogen 3.009 N/A LYS 27.A N CYS 23.A O no hydrogen 2.675 N/A GLY 28.A N ASN 24.A O no hydrogen 2.758 N/A ALA 29.A N LEU 26.A O no hydrogen 3.327 N/A ASP 32.A N ASN 240.A OD1 no hydrogen 2.952 N/A ASN 34.A N ASP 32.A OD1 no hydrogen 2.859 N/A ASN 34.A ND2 ASP 32.A OD1 no hydrogen 3.227 N/A VAL 35.A N ASP 32.A O no hydrogen 3.098 N/A GLU 36.A N PHE 4.A O no hydrogen 3.026 N/A ILE 38.A N VAL 6.A O no hydrogen 2.964 N/A VAL 39.A N ALA 58.A O no hydrogen 3.027 N/A ALA 40.A N GLY 8.A O no hydrogen 2.615 N/A CYS 41.A N ALA 60.A O no hydrogen 3.230 N/A CYS 41.A SG PRO 42.A O no hydrogen 3.676 N/A TYR 45.A N PRO 42.A O no hydrogen 2.857 N/A TYR 45.A OH GLY 14.A O no hydrogen 3.410 N/A LEU 46.A N ALA 43.A O no hydrogen 3.429 N/A TYR 48.A OH LYS 16.A O no hydrogen 3.109 N/A CYS 49.A N TYR 45.A O no hydrogen 2.755 N/A CYS 49.A SG TYR 45.A O no hydrogen 3.622 N/A ARG 50.A N LEU 46.A O no hydrogen 3.046 N/A ARG 50.A NH1 ARG 50.A O no hydrogen 3.229 N/A ARG 50.A NH2 VAL 57.A O no hydrogen 2.416 N/A SER 51.A OG TYR 48.A O no hydrogen 3.061 N/A LEU 52.A N CYS 49.A O no hydrogen 3.067 N/A LEU 53.A N CYS 49.A O no hydrogen 2.857 N/A VAL 57.A N PRO 54.A O no hydrogen 3.053 N/A ALA 58.A N VAL 37.A O no hydrogen 2.834 N/A ALA 60.A N VAL 39.A O no hydrogen 2.817 N/A ALA 61.A N TRP 88.A O no hydrogen 2.988 N/A GLN 62.A NE2 LYS 11.A O no hydrogen 2.883 N/A GLN 62.A NE2 ALA 40.A O no hydrogen 3.033 N/A CYS 64.A SG TYR 65.A O no hydrogen 3.629 N/A TYR 65.A N ILE 76.A O no hydrogen 2.837 N/A LYS 66.A NZ GLU 109.A OE1 no hydrogen 3.021 N/A GLU 75.A N PHE 72.A O no hydrogen 3.028 N/A SER 77.A OG GLU 68.A O no hydrogen 3.078 N/A ILE 81.A N SER 77.A O no hydrogen 3.097 N/A LYS 82.A N PRO 78.A O no hydrogen 2.853 N/A ASP 83.A N GLY 79.A O no hydrogen 2.928 N/A CYS 84.A N ILE 81.A O no hydrogen 3.104 N/A CYS 84.A SG MET 80.A O no hydrogen 3.509 N/A GLY 85.A N LYS 82.A O no hydrogen 2.979 N/A GLY 86.A N ILE 81.A O no hydrogen 2.911 N/A GLN 87.A N LEU 59.A O no hydrogen 2.882 N/A TRP 88.A N LEU 59.A O no hydrogen 3.113 N/A VAL 89.A N ASN 120.A O no hydrogen 2.981 N/A ILE 90.A N ALA 61.A O no hydrogen 2.987 N/A LEU 91.A N ILE 122.A O no hydrogen 2.929 N/A SER 94.A N GLU 163.A OE1 no hydrogen 2.796 N/A SER 94.A OG GLU 163.A OE1 no hydrogen 3.333 N/A SER 94.A OG GLU 163.A OE2 no hydrogen 2.897 N/A GLU 95.A N HIS 93.A ND1 no hydrogen 2.990 N/A ARG 96.A NE GLU 102.A OE2 no hydrogen 2.705 N/A ARG 96.A NH2 GLU 102.A OE2 no hydrogen 3.165 N/A ARG 97.A N HIS 93.A O no hydrogen 2.998 N/A ARG 97.A NE GLY 92.A O no hydrogen 2.741 N/A ARG 97.A NH1 ASP 104.A OD1 no hydrogen 3.127 N/A ARG 97.A NH2 CYS 124.A O no hydrogen 2.887 N/A HIS 98.A N SER 94.A O no hydrogen 2.861 N/A VAL 99.A N GLU 95.A O no hydrogen 2.848 N/A PHE 100.A N GLU 95.A O no hydrogen 3.194 N/A GLU 102.A N ARG 96.A O no hydrogen 2.856 N/A VAL 105.A N ASP 103.A OD1 no hydrogen 3.209 N/A LEU 106.A N ASP 103.A OD2 no hydrogen 3.349 N/A ILE 107.A N ASP 103.A O no hydrogen 2.896 N/A GLY 108.A N ASP 104.A O no hydrogen 2.881 N/A GLU 109.A N VAL 105.A O no hydrogen 3.008 N/A LYS 110.A N LEU 106.A O no hydrogen 3.009 N/A LYS 110.A NZ ASN 63.A OD1 no hydrogen 3.211 N/A LYS 110.A NZ CYS 64.A O no hydrogen 3.160 N/A LYS 110.A NZ GLU 102.A OE1 no hydrogen 2.852 N/A LYS 110.A NZ GLU 102.A OE2 no hydrogen 3.343 N/A ILE 111.A N ILE 107.A O no hydrogen 2.983 N/A LYS 112.A N GLY 108.A O no hydrogen 3.131 N/A HIS 113.A N GLU 109.A O no hydrogen 3.075 N/A HIS 113.A ND1 GLU 116.A OE2 no hydrogen 3.078 N/A ALA 114.A N LYS 110.A O no hydrogen 2.793 N/A LEU 115.A N ILE 111.A O no hydrogen 3.086 N/A GLU 116.A N LYS 112.A O no hydrogen 3.158 N/A SER 117.A N HIS 113.A O no hydrogen 3.103 N/A SER 117.A N ALA 114.A O no hydrogen 3.271 N/A SER 117.A OG HIS 113.A O no hydrogen 2.653 N/A GLY 118.A N LEU 115.A O no hydrogen 2.874 N/A LEU 119.A N ALA 114.A O no hydrogen 3.004 N/A ASN 120.A N GLN 87.A O no hydrogen 2.809 N/A ASN 120.A ND2 GLN 87.A O no hydrogen 3.433 N/A VAL 121.A N LYS 157.A O no hydrogen 2.944 N/A ILE 122.A N VAL 89.A O no hydrogen 3.089 N/A ALA 123.A N VAL 159.A O no hydrogen 2.834 N/A CYS 124.A N LEU 91.A O no hydrogen 2.857 N/A CYS 124.A SG LEU 91.A O no hydrogen 3.809 N/A CYS 124.A SG ILE 122.A O no hydrogen 4.040 N/A ILE 125.A N ALA 161.A O no hydrogen 2.999 N/A GLY 126.A N GLN 144.A OE1 no hydrogen 2.893 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.672 N/A LEU 128.A N ASP 131.A OD2 no hydrogen 2.925 N/A ARG 132.A N LEU 128.A O no hydrogen 3.060 N/A ARG 132.A NH1 GLU 127.A OE2 no hydrogen 2.636 N/A GLU 133.A N LEU 129.A O no hydrogen 3.186 N/A ALA 134.A N ASP 131.A O no hydrogen 3.232 N/A GLY 135.A N ARG 132.A O no hydrogen 2.785 N/A ARG 136.A N ASP 131.A O no hydrogen 3.025 N/A ARG 136.A NE GLU 139.A OE1 no hydrogen 3.471 N/A ARG 136.A NH1 ASP 131.A OD1 no hydrogen 3.147 N/A THR 137.A OG1 GLU 127.A OE2 no hydrogen 2.707 N/A GLU 138.A N GLU 138.A OE2 no hydrogen 2.897 N/A VAL 140.A N ARG 136.A O no hydrogen 3.220 N/A CYS 141.A N THR 137.A O no hydrogen 3.059 N/A CYS 141.A SG THR 137.A O no hydrogen 3.283 N/A PHE 142.A N GLU 138.A O no hydrogen 2.700 N/A ARG 143.A N GLU 139.A O no hydrogen 3.286 N/A ARG 143.A NE GLU 139.A OE2 no hydrogen 2.894 N/A GLN 144.A N VAL 140.A O no hydrogen 3.180 N/A GLN 144.A NE2 GLY 126.A O no hydrogen 3.484 N/A ILE 145.A N CYS 141.A O no hydrogen 3.073 N/A LYS 146.A N PHE 142.A O no hydrogen 2.764 N/A HIS 147.A N ARG 143.A O no hydrogen 3.025 N/A ILE 148.A N GLN 144.A O no hydrogen 3.095 N/A ALA 149.A N ILE 145.A O no hydrogen 2.772 N/A SER 150.A N LYS 146.A O no hydrogen 2.984 N/A ASN 151.A N ILE 148.A O no hydrogen 2.923 N/A ASN 151.A ND2 HIS 147.A O no hydrogen 2.649 N/A VAL 152.A N ALA 149.A O no hydrogen 3.198 N/A LYS 153.A NZ ALA 149.A O no hydrogen 3.542 N/A LYS 153.A NZ VAL 152.A O no hydrogen 2.533 N/A SER 156.A OG ASP 154.A OD1 no hydrogen 3.025 N/A SER 156.A OG ASP 154.A OD2 no hydrogen 3.319 N/A LYS 157.A N ASP 154.A O no hydrogen 3.088 N/A LYS 157.A NZ LEU 119.A O no hydrogen 3.096 N/A VAL 158.A N TRP 155.A O no hydrogen 3.170 N/A VAL 159.A N VAL 121.A O no hydrogen 2.807 N/A ILE 160.A N ARG 200.A O no hydrogen 3.028 N/A ALA 161.A N ALA 123.A O no hydrogen 2.977 N/A TYR 162.A N GLN 202.A O no hydrogen 2.889 N/A TYR 162.A OH GLU 127.A OE1 no hydrogen 2.786 N/A TYR 162.A OH GLU 127.A OE2 no hydrogen 3.379 N/A GLU 163.A N ILE 125.A O no hydrogen 2.812 N/A VAL 165.A N GLU 163.A O no hydrogen 2.532 N/A TRP 166.A NE1 TYR 162.A OH no hydrogen 3.046 N/A ALA 167.A N PRO 164.A O no hydrogen 2.644 N/A ILE 168.A N PRO 164.A O no hydrogen 3.067 N/A THR 172.A N GLN 175.A OE1 no hydrogen 2.537 N/A GLN 175.A N THR 172.A OG1 no hydrogen 3.334 N/A ALA 176.A N THR 172.A O no hydrogen 3.181 N/A GLN 177.A N PRO 173.A O no hydrogen 2.993 N/A GLN 177.A NE2 ASP 220.A OD2 no hydrogen 2.559 N/A GLU 178.A N ASP 174.A O no hydrogen 3.085 N/A VAL 179.A N GLN 175.A O no hydrogen 3.262 N/A HIS 180.A N ALA 176.A O no hydrogen 3.034 N/A HIS 180.A ND1 ASP 220.A O no hydrogen 2.917 N/A SER 181.A N GLN 177.A O no hydrogen 2.877 N/A LYS 182.A N GLU 178.A O no hydrogen 3.074 N/A LYS 182.A NZ GLU 138.A OE1 no hydrogen 2.449 N/A VAL 183.A N VAL 179.A O no hydrogen 2.922 N/A ARG 184.A N HIS 180.A O no hydrogen 2.905 N/A ARG 184.A NE ASP 220.A OD1 no hydrogen 2.794 N/A ARG 184.A NH1 ALA 196.A O no hydrogen 2.755 N/A ARG 184.A NH1 VAL 199.A O no hydrogen 2.940 N/A ARG 184.A NH2 ASP 220.A O no hydrogen 3.375 N/A ARG 184.A NH2 ASP 222.A OD2 no hydrogen 2.695 N/A ASN 185.A N SER 181.A O no hydrogen 2.996 N/A TRP 186.A N LYS 182.A O no hydrogen 2.786 N/A LEU 187.A N VAL 183.A O no hydrogen 3.004 N/A SER 188.A N ARG 184.A O no hydrogen 2.787 N/A THR 189.A N ASN 185.A O no hydrogen 3.014 N/A ASN 190.A N TRP 186.A O no hydrogen 2.789 N/A ASN 190.A ND2 TRP 186.A O no hydrogen 3.018 N/A VAL 191.A N LEU 187.A O no hydrogen 2.716 N/A SER 192.A N LEU 187.A O no hydrogen 2.992 N/A VAL 195.A N SER 192.A OG no hydrogen 3.000 N/A ALA 196.A N SER 192.A O no hydrogen 3.118 N/A SER 197.A N ALA 193.A O no hydrogen 2.873 N/A LYS 198.A N ASP 194.A O no hydrogen 3.085 N/A LYS 198.A N VAL 195.A O no hydrogen 3.233 N/A LYS 198.A NZ ASP 194.A OD1 no hydrogen 2.589 N/A VAL 199.A N VAL 195.A O no hydrogen 2.915 N/A ARG 200.A NH1 ARG 3.A O no hydrogen 2.985 N/A ARG 200.A NH1 GLU 36.A OE1 no hydrogen 2.856 N/A ARG 200.A NH2 GLU 36.A OE1 no hydrogen 3.033 N/A ILE 201.A N ASP 222.A OD2 no hydrogen 2.858 N/A GLN 202.A N ILE 160.A O no hydrogen 2.652 N/A GLN 202.A NE2 CYS 5.A O no hydrogen 3.088 N/A TYR 203.A N GLY 223.A O no hydrogen 2.939 N/A GLY 204.A N TYR 162.A O no hydrogen 2.627 N/A ASN 208.A N ASN 211.A OD1 no hydrogen 3.009 N/A ASN 211.A N ASN 208.A O no hydrogen 3.202 N/A ASN 211.A N ASN 208.A OD1 no hydrogen 3.219 N/A ASN 211.A ND2 SER 206.A O no hydrogen 3.280 N/A CYS 212.A N ASN 208.A O no hydrogen 3.059 N/A CYS 212.A SG ALA 209.A O no hydrogen 3.777 N/A GLU 214.A N ASN 211.A O no hydrogen 3.041 N/A LEU 215.A N ASN 211.A O no hydrogen 2.945 N/A GLY 216.A N CYS 212.A O no hydrogen 2.944 N/A LYS 218.A N LEU 215.A O no hydrogen 3.271 N/A LYS 218.A NZ ASP 174.A OD1 no hydrogen 3.541 N/A ASP 220.A N GLN 177.A OE1 no hydrogen 2.941 N/A ILE 221.A N LYS 218.A O no hydrogen 3.094 N/A ASP 222.A N ILE 201.A O no hydrogen 3.015 N/A PHE 224.A N CYS 5.A O no hydrogen 3.131 N/A LEU 225.A N TYR 203.A O no hydrogen 3.090 N/A VAL 226.A N GLY 7.A O no hydrogen 2.781 N/A SER 230.A N GLY 227.A O no hydrogen 3.046 N/A SER 230.A OG GLY 227.A O no hydrogen 2.581 N/A LEU 231.A N GLY 228.A O no hydrogen 3.202 N/A LYS 232.A N ALA 229.A O no hydrogen 3.075 N/A LYS 232.A NZ GLU 234.A OE1 no hydrogen 3.399 N/A PHE 235.A N LYS 232.A O no hydrogen 3.096 N/A VAL 236.A N PRO 233.A O no hydrogen 3.027 N/A ILE 238.A N GLU 234.A O no hydrogen 2.910 N/A ILE 239.A N PHE 235.A O no hydrogen 2.923 N/A ASN 240.A N VAL 236.A O no hydrogen 3.053 N/A ASN 240.A ND2 SER 30.A O no hydrogen 3.082 N/A ALA 241.A N ILE 238.A O no hydrogen 3.180 N/A GLN 243.A N ASN 240.A O no hydrogen 2.709 N/A