Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xj3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N MET 32.A O no hydrogen 2.626 N/A ARG 4.A N VAL 34.A O no hydrogen 2.890 N/A ARG 4.A NE ASP 6.A OD1 no hydrogen 2.943 N/A ARG 4.A NH2 ASP 6.A OD2 no hydrogen 2.813 N/A TRP 7.A N ARG 4.A O no hydrogen 2.861 N/A ARG 8.A N SER 5.A O no hydrogen 3.051 N/A ARG 8.A NH1 SER 5.A O no hydrogen 2.740 N/A ARG 8.A NH1 SER 5.A OG no hydrogen 3.114 N/A LYS 9.A N ASP 6.A O no hydrogen 3.363 N/A PHE 10.A N TRP 7.A O no hydrogen 3.004 N/A SER 12.A N ARG 8.A O no hydrogen 2.822 N/A SER 12.A OG ARG 8.A O no hydrogen 3.298 N/A GLU 13.A N LYS 9.A O no hydrogen 2.777 N/A PHE 14.A N PHE 11.A O no hydrogen 3.256 N/A GLN 15.A N SER 12.A O no hydrogen 2.982 N/A ALA 16.A N PHE 11.A O no hydrogen 2.843 N/A THR 19.A N ASN 212.A O no hydrogen 2.872 N/A THR 19.A OG1 PHE 35.A O no hydrogen 2.616 N/A THR 19.A OG1 ASP 36.A O no hydrogen 3.182 N/A ILE 20.A N PHE 35.A O no hydrogen 3.359 N/A VAL 21.A N ALA 210.A O no hydrogen 2.942 N/A VAL 22.A N LEU 33.A O no hydrogen 2.840 N/A ALA 23.A N PHE 208.A O no hydrogen 2.855 N/A GLU 25.A N SER 206.A O no hydrogen 2.866 N/A ARG 26.A N ASP 24.A OD1 no hydrogen 2.884 N/A ARG 26.A NE ASP 24.A OD1 no hydrogen 2.938 N/A ARG 26.A NE ASP 24.A OD2 no hydrogen 3.222 N/A ARG 26.A NH1 ILE 236.A O no hydrogen 3.115 N/A ARG 26.A NH1 GLU 237.A O no hydrogen 2.848 N/A ARG 26.A NH2 ASP 24.A OD2 no hydrogen 2.675 N/A ARG 26.A NH2 ILE 236.A O no hydrogen 2.652 N/A ARG 30.A NE ARG 26.A O no hydrogen 3.066 N/A LEU 33.A N VAL 22.A O no hydrogen 2.906 N/A VAL 34.A N LEU 2.A O no hydrogen 3.015 N/A PHE 35.A N ILE 20.A O no hydrogen 2.964 N/A ARG 39.A N ASP 36.A OD1 no hydrogen 2.939 N/A ARG 39.A NE ASN 212.A OD1 no hydrogen 2.903 N/A ARG 39.A NH1 ASP 214.A OD1 no hydrogen 3.202 N/A ARG 39.A NH1 ASP 214.A OD2 no hydrogen 3.172 N/A ARG 39.A NH2 ASN 212.A OD1 no hydrogen 3.171 N/A ARG 39.A NH2 ASP 214.A OD1 no hydrogen 2.850 N/A SER 40.A N ASP 36.A O no hydrogen 2.869 N/A SER 40.A OG PRO 37.A O no hydrogen 2.636 N/A LYS 41.A N VAL 38.A O no hydrogen 3.070 N/A LYS 42.A N ARG 39.A O no hydrogen 2.926 N/A ARG 43.A NE GLU 146.A OE1 no hydrogen 2.949 N/A ARG 43.A NE GLU 146.A OE2 no hydrogen 3.210 N/A ARG 43.A NH2 GLU 146.A OE2 no hydrogen 2.634 N/A TYR 44.A N ILE 142.A O no hydrogen 2.900 N/A SER 45.A OG TRP 135.A O no hydrogen 2.853 N/A ALA 47.A N TRP 135.A O no hydrogen 3.008 N/A SER 48.A OG SER 96.A OG no hydrogen 3.091 N/A THR 49.A N PRO 46.A O no hydrogen 3.019 N/A THR 49.A OG1 PRO 46.A O no hydrogen 2.627 N/A PHE 50.A N ALA 47.A O no hydrogen 2.974 N/A LYS 51.A N SER 48.A O no hydrogen 3.197 N/A LYS 51.A NZ SER 96.A OG no hydrogen 2.752 N/A ILE 52.A N THR 49.A O no hydrogen 3.224 N/A HIS 54.A N PHE 50.A O no hydrogen 2.806 N/A THR 55.A N LYS 51.A O no hydrogen 2.985 N/A THR 55.A OG1 LYS 51.A O no hydrogen 2.488 N/A THR 55.A OG1 TYR 101.A OH no hydrogen 2.813 N/A LEU 56.A N ILE 52.A O no hydrogen 3.492 N/A PHE 57.A N PRO 53.A O no hydrogen 2.878 N/A ALA 58.A N HIS 54.A O no hydrogen 2.911 N/A LEU 59.A N THR 55.A O no hydrogen 2.906 N/A ASP 60.A N LEU 56.A O no hydrogen 2.895 N/A ALA 61.A N PHE 57.A O no hydrogen 2.955 N/A VAL 64.A N ALA 58.A O no hydrogen 3.433 N/A ARG 65.A N GLN 69.A OE1 no hydrogen 2.797 N/A GLU 67.A N GLU 67.A OE1 no hydrogen 2.496 N/A PHE 68.A N ASP 66.A OD1 no hydrogen 2.962 N/A GLN 69.A N ASP 66.A OD1 no hydrogen 3.308 N/A PHE 71.A N GLN 87.A O no hydrogen 2.710 N/A TRP 73.A N ASP 86.A OD1 no hydrogen 2.721 N/A TRP 73.A NE1 VAL 76.A O no hydrogen 3.084 N/A VAL 76.A N ASP 74.A OD1 no hydrogen 3.045 N/A ARG 78.A N ASN 84.A OD1 no hydrogen 3.134 N/A ARG 78.A NH1 ASP 74.A OD1 no hydrogen 2.871 N/A ARG 78.A NH2 ASP 74.A OD1 no hydrogen 3.017 N/A PHE 80.A N HIS 83.A ND1 no hydrogen 3.224 N/A HIS 83.A N PHE 80.A O no hydrogen 2.876 N/A HIS 83.A NE2 ASN 95.A O no hydrogen 2.877 N/A ASN 84.A N ALA 81.A O no hydrogen 3.138 N/A ASN 84.A ND2 ASN 77.A OD1 no hydrogen 2.771 N/A GLN 87.A N PHE 71.A O no hydrogen 3.072 N/A GLN 87.A NE2 GLY 82.A O no hydrogen 2.907 N/A GLN 87.A NE2 GLN 85.A O no hydrogen 3.059 N/A ASP 88.A N SER 91.A OG no hydrogen 3.043 N/A ARG 90.A NH1 ASP 171.A O.A no hydrogen 3.294 N/A ARG 90.A NH1 ASP 171.A O.B no hydrogen 3.318 N/A ARG 90.A NH1 ASP 171.A OD1.B no hydrogen 2.905 N/A ARG 90.A NH1 ASP 171.A OD2.A no hydrogen 2.456 N/A ARG 90.A NH2 ASP 171.A O.A no hydrogen 2.927 N/A ARG 90.A NH2 ASP 171.A O.B no hydrogen 2.982 N/A SER 91.A N ASP 88.A OD1 no hydrogen 2.875 N/A SER 91.A OG GLN 87.A OE1 no hydrogen 2.723 N/A SER 91.A OG ASP 88.A O no hydrogen 3.097 N/A SER 91.A OG ASP 88.A OD1 no hydrogen 3.362 N/A ALA 92.A N ASP 88.A O no hydrogen 2.901 N/A MET 93.A N LEU 89.A O no hydrogen 2.918 N/A ARG 94.A N ARG 90.A O no hydrogen 2.831 N/A ASN 95.A N SER 91.A O no hydrogen 2.804 N/A ASN 95.A ND2 SER 91.A O no hydrogen 2.813 N/A SER 96.A OG SER 48.A OG no hydrogen 3.091 N/A THR 97.A N ALA 92.A O no hydrogen 2.978 N/A THR 97.A OG1 GLN 87.A OE1 no hydrogen 2.796 N/A TRP 99.A NE1 HIS 83.A O no hydrogen 2.875 N/A TYR 101.A OH THR 55.A OG1 no hydrogen 2.813 N/A GLU 102.A N VAL 98.A O no hydrogen 2.953 N/A LEU 103.A N TRP 99.A O no hydrogen 3.076 N/A PHE 104.A N VAL 100.A O no hydrogen 2.918 N/A ALA 105.A N TYR 101.A O no hydrogen 2.701 N/A LYS 106.A N GLU 102.A O no hydrogen 3.142 N/A GLU 107.A N LEU 103.A O no hydrogen 3.278 N/A ILE 108.A N PHE 104.A O no hydrogen 2.932 N/A ALA 113.A N GLY 109.A O no hydrogen 2.896 N/A ARG 114.A NH2 SER 128.A OG no hydrogen 2.768 N/A ARG 115.A N ASP 111.A O no hydrogen 2.899 N/A TYR 116.A N LYS 112.A O no hydrogen 2.617 N/A TYR 116.A OH ASP 60.A OD2 no hydrogen 2.704 N/A LEU 117.A N ALA 113.A O no hydrogen 2.761 N/A LYS 118.A N ARG 114.A O no hydrogen 2.919 N/A LYS 119.A N ARG 115.A O no hydrogen 2.869 N/A ILE 120.A N TYR 116.A O no hydrogen 3.145 N/A ASP 121.A N LYS 118.A O no hydrogen 3.261 N/A TYR 122.A N LEU 117.A O no hydrogen 3.142 N/A ASN 124.A N ALA 141.A O no hydrogen 3.002 N/A ASN 124.A ND2 SER 139.A O no hydrogen 2.858 N/A ALA 125.A N TYR 122.A O no hydrogen 2.896 N/A ASP 126.A N ASN 124.A OD1 no hydrogen 3.178 N/A SER 128.A N ASP 126.A OD1 no hydrogen 3.070 N/A SER 128.A OG ASP 126.A OD1 no hydrogen 2.650 N/A THR 129.A OG1 GLY 132.A O no hydrogen 2.593 N/A THR 129.A OG1 GLU 137.A O no hydrogen 3.208 N/A ILE 136.A N ASP 133.A O no hydrogen 3.076 N/A GLU 137.A N ASP 133.A O no hydrogen 2.795 N/A SER 139.A N SER 128.A O no hydrogen 2.951 N/A SER 139.A OG SER 128.A O no hydrogen 3.174 N/A ALA 141.A N ASN 124.A OD1 no hydrogen 3.217 N/A ILE 142.A N TYR 44.A O no hydrogen 2.839 N/A SER 143.A N GLU 146.A OE1 no hydrogen 3.092 N/A GLN 145.A N SER 40.A O no hydrogen 3.103 N/A GLN 145.A NE2 SER 40.A OG no hydrogen 2.991 N/A GLU 146.A N SER 143.A OG no hydrogen 3.111 N/A GLN 147.A N SER 143.A O no hydrogen 2.851 N/A GLN 147.A NE2 THR 49.A OG1 no hydrogen 3.106 N/A ILE 148.A N ALA 144.A O no hydrogen 3.061 N/A ALA 149.A N GLN 145.A O no hydrogen 3.152 N/A PHE 150.A N GLU 146.A O no hydrogen 3.016 N/A LEU 151.A N GLN 147.A O no hydrogen 2.805 N/A ARG 152.A N ILE 148.A O no hydrogen 2.975 N/A ARG 152.A NE GLU 25.A OE2 no hydrogen 3.032 N/A ARG 152.A NH2 GLU 25.A OE2 no hydrogen 3.073 N/A LYS 153.A N ALA 149.A O no hydrogen 3.262 N/A LYS 153.A NZ ILE 120.A O no hydrogen 3.059 N/A LEU 154.A N PHE 150.A O no hydrogen 3.131 N/A TYR 155.A N LEU 151.A O no hydrogen 2.720 N/A TYR 155.A OH SER 206.A OG no hydrogen 3.022 N/A ARG 156.A N ARG 152.A O no hydrogen 2.893 N/A ARG 156.A NH2 GLU 25.A OE1 no hydrogen 2.815 N/A ASN 157.A N LEU 154.A O no hydrogen 3.145 N/A GLU 158.A N LYS 153.A O no hydrogen 2.872 N/A LEU 159.A N GLN 166.A OE1 no hydrogen 3.117 N/A PHE 161.A N LEU 159.A O no hydrogen 2.792 N/A HIS 165.A N ARG 162.A O no hydrogen 2.827 N/A GLN 166.A N ARG 162.A O no hydrogen 3.110 N/A GLN 166.A NE2 ASN 157.A O no hydrogen 3.445 N/A GLN 166.A NE2 PHE 161.A O no hydrogen 2.869 N/A ARG 167.A N VAL 163.A O no hydrogen 2.913 N/A LEU 168.A N GLU 164.A O no hydrogen 3.001 N/A VAL 169.A N HIS 165.A O no hydrogen 3.062 N/A LYS 170.A N GLN 166.A O no hydrogen 3.019 N/A LYS 170.A NZ LEU 154.A O no hydrogen 3.033 N/A LYS 170.A NZ TYR 155.A O no hydrogen 3.191 N/A LYS 170.A NZ ASN 157.A OD1 no hydrogen 2.767 N/A ASP 171.A N.A ARG 167.A O no hydrogen 2.907 N/A ASP 171.A N.B ARG 167.A O no hydrogen 2.885 N/A LEU 172.A N LEU 168.A O no hydrogen 2.883 N/A MET 173.A N VAL 169.A O no hydrogen 3.071 N/A ILE 174.A N ASP 171.A O.A no hydrogen 3.232 N/A ILE 174.A N ASP 171.A O.B no hydrogen 3.248 N/A VAL 175.A N LEU 183.A O no hydrogen 2.972 N/A GLY 178.A N TRP 181.A O no hydrogen 2.845 N/A TRP 181.A N GLY 178.A O no hydrogen 3.436 N/A ILE 182.A N GLU 201.A O no hydrogen 3.221 N/A LEU 183.A N GLU 176.A O no hydrogen 2.833 N/A ARG 184.A N TRP 199.A O no hydrogen 2.931 N/A ARG 184.A NE GLU 201.A OE2 no hydrogen 2.765 N/A ARG 184.A NH1 LYS 170.A O no hydrogen 2.908 N/A ARG 184.A NH2 GLU 201.A OE1 no hydrogen 3.323 N/A ARG 184.A NH2 GLU 201.A OE2 no hydrogen 3.262 N/A ALA 185.A N MET 173.A O no hydrogen 2.964 N/A LYS 186.A N VAL 197.A O no hydrogen 2.926 N/A LYS 186.A NZ SER 96.A OG no hydrogen 3.034 N/A LYS 186.A NZ THR 187.A O no hydrogen 3.097 N/A GLY 188.A N TRP 195.A O no hydrogen 3.139 N/A TRP 189.A NE1 THR 215.A OG1 no hydrogen 3.009 N/A GLU 190.A N MET 193.A O no hydrogen 2.909 N/A ARG 192.A N GLU 190.A OE1 no hydrogen 3.022 N/A ARG 192.A NH2 GLU 190.A OE2 no hydrogen 3.187 N/A GLY 194.A N ILE 213.A O no hydrogen 2.834 N/A TRP 195.A N GLY 188.A O no hydrogen 2.711 N/A TRP 195.A NE1 SER 45.A O no hydrogen 2.714 N/A TRP 196.A N LEU 211.A O no hydrogen 3.005 N/A VAL 197.A N LYS 186.A O no hydrogen 3.224 N/A GLY 198.A N PHE 209.A O no hydrogen 2.989 N/A TRP 199.A N ARG 184.A O no hydrogen 2.857 N/A TRP 199.A NE1 GLU 201.A OE2 no hydrogen 2.973 N/A VAL 200.A N VAL 207.A O no hydrogen 2.878 N/A GLU 201.A N ILE 182.A O no hydrogen 2.915 N/A TRP 202.A N GLY 205.A O no hydrogen 2.711 N/A TRP 202.A NE1 ALA 238.A O no hydrogen 2.757 N/A GLY 205.A N TRP 202.A O no hydrogen 3.085 N/A SER 206.A OG TYR 155.A OH no hydrogen 3.022 N/A VAL 207.A N VAL 200.A O no hydrogen 2.834 N/A PHE 208.A N ALA 23.A O no hydrogen 2.884 N/A PHE 209.A N GLY 198.A O no hydrogen 2.825 N/A ALA 210.A N VAL 21.A O no hydrogen 2.932 N/A LEU 211.A N TRP 196.A O no hydrogen 2.950 N/A ASN 212.A N THR 19.A O no hydrogen 3.191 N/A ILE 213.A N GLY 194.A O no hydrogen 3.009 N/A ASP 214.A N LYS 17.A O no hydrogen 2.949 N/A THR 215.A N ARG 192.A O no hydrogen 2.820 N/A THR 215.A OG1 GLY 191.A O no hydrogen 3.195 N/A ASN 217.A N ASP 221.A OD2 no hydrogen 2.955 N/A ASN 217.A ND2 ASP 221.A OD1 no hydrogen 2.886 N/A ARG 218.A N THR 215.A O no hydrogen 3.271 N/A ASP 220.A N ASN 217.A O no hydrogen 3.282 N/A ASP 221.A N ARG 218.A O no hydrogen 3.125 N/A LEU 222.A N MET 219.A O no hydrogen 3.037 N/A LYS 224.A N ASP 221.A O no hydrogen 3.072 N/A LYS 224.A NZ PHE 14.A O no hydrogen 2.953 N/A LYS 224.A NZ GLN 15.A O no hydrogen 3.226 N/A LYS 224.A NZ ASP 221.A OD1 no hydrogen 3.073 N/A ARG 225.A N LEU 222.A O no hydrogen 3.242 N/A ARG 225.A NE LEU 222.A O no hydrogen 2.935 N/A ARG 225.A NH1 GLY 188.A O no hydrogen 2.859 N/A ALA 227.A N PHE 223.A O no hydrogen 3.018 N/A ILE 228.A N LYS 224.A O no hydrogen 2.978 N/A ARG 230.A N GLU 226.A O no hydrogen 2.828 N/A ARG 230.A NE GLU 226.A OE1 no hydrogen 3.195 N/A ARG 230.A NH1 GLU 176.A OE1 no hydrogen 3.403 N/A ARG 230.A NH2 GLU 176.A OE1 no hydrogen 3.119 N/A ARG 230.A NH2 GLU 226.A OE1 no hydrogen 3.488 N/A ALA 231.A N ALA 227.A O no hydrogen 3.176 N/A ILE 232.A N ILE 228.A O no hydrogen 3.078 N/A LEU 233.A N VAL 229.A O no hydrogen 2.747 N/A ARG 234.A N ARG 230.A O no hydrogen 2.788 N/A ARG 234.A NE ARG 230.A O no hydrogen 3.255 N/A SER 235.A N ALA 231.A O no hydrogen 2.945 N/A SER 235.A OG ILE 232.A O no hydrogen 2.592 N/A ILE 236.A N ILE 232.A O no hydrogen 3.269 N/A ILE 236.A N LEU 233.A O no hydrogen 3.155 N/A GLU 237.A N ARG 234.A O no hydrogen 2.945 N/A ALA 238.A N LEU 233.A O no hydrogen 2.707 N/A