Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8qdj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N GLU 6.A OE2 no hydrogen 3.192 N/A GLU 6.A N MET 3.A O no hydrogen 2.946 N/A TRP 8.A N LEU 4.A O no hydrogen 3.003 N/A TRP 8.A NE1 TYR 23.A OH no hydrogen 3.138 N/A LYS 9.A N GLY 5.A O no hydrogen 2.938 N/A LYS 9.A NZ SER 147.A O no hydrogen 2.859 N/A LYS 9.A NZ GLU 153.A OE1 no hydrogen 3.387 N/A LYS 9.A NZ GLU 153.A OE2 no hydrogen 3.479 N/A ALA 10.A N GLU 6.A O no hydrogen 3.056 N/A GLN 11.A N MET 7.A O no hydrogen 2.961 N/A GLN 11.A NE2 ASN 241.A OD1 no hydrogen 2.789 N/A LEU 12.A N TRP 8.A O no hydrogen 2.751 N/A ASN 13.A N LYS 9.A O no hydrogen 2.953 N/A ASN 13.A ND2 PRO 148.A O no hydrogen 2.918 N/A GLN 14.A N ALA 10.A O no hydrogen 3.269 N/A GLN 14.A N GLN 11.A O no hydrogen 3.083 N/A LEU 15.A N LEU 12.A O no hydrogen 3.108 N/A THR 16.A N GLU 19.A OE1 no hydrogen 3.051 N/A GLU 19.A N THR 16.A OG1 no hydrogen 3.107 N/A PHE 20.A N THR 16.A O no hydrogen 2.787 N/A MET 21.A N ARG 17.A O no hydrogen 2.905 N/A GLU 22.A N GLN 18.A O no hydrogen 2.953 N/A TYR 23.A N GLU 19.A O no hydrogen 2.869 N/A TYR 23.A OH ASN 210.A O no hydrogen 3.279 N/A TYR 23.A OH LEU 236.A O no hydrogen 2.825 N/A ARG 24.A N PHE 20.A O no hydrogen 2.929 N/A ARG 25.A NE GLU 30.A OE1 no hydrogen 2.738 N/A ARG 25.A NH2 GLU 30.A OE2 no hydrogen 3.025 N/A ASP 26.A N TYR 23.A O no hydrogen 3.068 N/A GLY 27.A N GLY 247.A O no hydrogen 2.852 N/A ILE 28.A N ARG 25.A O no hydrogen 3.499 N/A ILE 29.A N PRO 206.A O no hydrogen 3.136 N/A GLU 30.A N LYS 249.A O no hydrogen 2.831 N/A ASP 32.A N GLU 251.A O no hydrogen 3.046 N/A ARG 33.A NH1 PRO 50.A O no hydrogen 2.921 N/A ARG 33.A NH1 ASP 253.A OD2 no hydrogen 2.744 N/A ARG 33.A NH2 PRO 50.A O no hydrogen 3.058 N/A SER 34.A N ASP 32.A OD1 no hydrogen 2.952 N/A SER 34.A OG ASP 32.A OD1 no hydrogen 2.852 N/A SER 34.A OG ASP 32.A OD2 no hydrogen 3.544 N/A ARG 37.A N ARG 33.A O no hydrogen 2.822 N/A LYS 38.A N SER 34.A O no hydrogen 3.204 N/A LYS 38.A NZ GLU 42.A OE1 no hydrogen 3.278 N/A LYS 38.A NZ GLU 42.A OE2 no hydrogen 2.629 N/A ALA 39.A N ALA 35.A O no hydrogen 2.899 N/A ARG 40.A N ALA 36.A O no hydrogen 3.030 N/A ARG 41.A N ARG 37.A O no hydrogen 3.274 N/A GLU 42.A N LYS 38.A O no hydrogen 2.982 N/A GLY 43.A N ARG 40.A O no hydrogen 3.364 N/A ASN 44.A N ALA 39.A O no hydrogen 2.941 N/A THR 46.A N ASN 44.A OD1 no hydrogen 3.276 N/A ARG 53.A NH1 VAL 31.A O no hydrogen 2.795 N/A GLY 54.A N SER 52.A OG no hydrogen 2.993 N/A THR 55.A OG1 GLY 82.A O no hydrogen 2.852 N/A LYS 57.A NZ GLU 214.A OE2 no hydrogen 2.617 N/A LYS 57.A NZ TYR 216.A OH no hydrogen 3.045 N/A LEU 58.A N GLY 54.A O no hydrogen 3.046 N/A ARG 59.A N THR 55.A O no hydrogen 2.886 N/A TRP 60.A N ALA 56.A O no hydrogen 3.038 N/A MET 61.A N LYS 57.A O no hydrogen 3.333 N/A VAL 62.A N LEU 58.A O no hydrogen 2.831 N/A GLU 63.A N ARG 59.A O no hydrogen 2.866 N/A ARG 64.A N MET 61.A O no hydrogen 3.264 N/A ARG 64.A NH1 TRP 60.A O no hydrogen 3.065 N/A GLY 65.A N VAL 62.A O no hydrogen 3.005 N/A PHE 66.A N MET 61.A O no hydrogen 3.031 N/A LYS 68.A N ASP 174.A OD2 no hydrogen 2.869 N/A HIS 70.A N THR 138.A OG1 no hydrogen 2.968 N/A HIS 70.A ND1 LYS 68.A O no hydrogen 2.889 N/A GLY 71.A N LEU 92.A O no hydrogen 2.925 N/A LYS 72.A N ASP 137.A OD2 no hydrogen 2.730 N/A LYS 72.A NZ GLN 135.A O no hydrogen 2.872 N/A VAL 73.A N GLU 95.A O no hydrogen 2.789 N/A ILE 74.A N THR 138.A O no hydrogen 2.912 N/A ASP 75.A N LYS 97.A O no hydrogen 2.788 N/A LEU 76.A N LEU 140.A O no hydrogen 2.786 N/A CYS 78.A N TYR 99.A O no hydrogen 2.808 N/A CYS 78.A SG GLY 79.A O no hydrogen 3.686 N/A GLY 79.A N THR 100.A OG1 no hydrogen 2.919 N/A ARG 80.A NH1 VAL 51.A O no hydrogen 2.868 N/A SER 84.A OG ASP 75.A OD2 no hydrogen 2.681 N/A TYR 85.A N GLY 81.A O no hydrogen 2.843 N/A TYR 85.A OH VAL 110.A O no hydrogen 2.635 N/A TYR 86.A N GLY 82.A O no hydrogen 3.172 N/A CYS 87.A N TRP 83.A O no hydrogen 3.033 N/A CYS 87.A SG TRP 83.A O no hydrogen 3.408 N/A ALA 88.A N SER 84.A O no hydrogen 3.162 N/A THR 89.A N TYR 86.A O no hydrogen 2.959 N/A THR 89.A OG1 TYR 86.A O no hydrogen 2.691 N/A LEU 90.A N CYS 87.A O no hydrogen 2.955 N/A VAL 93.A N LEU 90.A O no hydrogen 2.976 N/A GLN 94.A N GLY 71.A O no hydrogen 2.974 N/A GLU 95.A N GLY 71.A O no hydrogen 3.364 N/A VAL 96.A N LEU 119.A O no hydrogen 2.947 N/A LYS 97.A N VAL 73.A O no hydrogen 2.806 N/A GLY 98.A N SER 121.A O no hydrogen 3.001 N/A TYR 99.A N ASP 75.A O no hydrogen 2.991 N/A TYR 99.A OH GLU 134.A OE1 no hydrogen 2.701 N/A THR 100.A N LYS 123.A O no hydrogen 3.057 N/A GLY 103.A N GLU 108.A OE2 no hydrogen 2.717 N/A HIS 106.A N GLY 103.A O no hydrogen 3.037 N/A GLU 107.A N GLU 107.A OE1 no hydrogen 2.619 N/A VAL 110.A N ARG 80.A O no hydrogen 2.990 N/A MET 112.A N TYR 85.A OH no hydrogen 3.096 N/A GLN 113.A N VAL 45.A O no hydrogen 2.973 N/A TYR 115.A N LEU 256.A O no hydrogen 2.938 N/A GLY 116.A N GLY 259.A O no hydrogen 2.916 N/A TRP 117.A N SER 114.A O no hydrogen 2.855 N/A ASN 118.A ND2 ARG 261.A O no hydrogen 3.157 N/A LEU 119.A N GLY 116.A O no hydrogen 2.835 N/A VAL 120.A N TRP 117.A O no hydrogen 3.025 N/A SER 121.A N VAL 96.A O no hydrogen 2.955 N/A LYS 123.A N GLY 98.A O no hydrogen 2.910 N/A SER 124.A OG GLU 108.A OE1 no hydrogen 2.585 N/A GLY 125.A N LYS 101.A O no hydrogen 3.008 N/A VAL 126.A N THR 100.A O no hydrogen 3.086 N/A PHE 129.A N ASP 127.A OD1 no hydrogen 3.119 N/A TYR 130.A N ASP 127.A O no hydrogen 3.143 N/A ARG 131.A N VAL 128.A O no hydrogen 3.161 N/A ARG 131.A NE GLU 134.A OE2 no hydrogen 2.772 N/A ARG 131.A NH2 GLU 134.A OE2 no hydrogen 3.150 N/A ASP 137.A N LYS 72.A O no hydrogen 2.888 N/A THR 138.A N LYS 72.A O no hydrogen 3.061 N/A THR 138.A OG1 HIS 70.A O no hydrogen 2.875 N/A LEU 139.A N ASP 174.A O no hydrogen 2.915 N/A LEU 140.A N ILE 74.A O no hydrogen 2.836 N/A CYS 141.A N CYS 176.A O no hydrogen 2.955 N/A CYS 141.A SG LEU 76.A O no hydrogen 3.892 N/A ASP 142.A N LEU 76.A O no hydrogen 3.380 N/A SER 147.A N GLU 153.A OE2 no hydrogen 2.960 N/A VAL 149.A N SER 147.A OG no hydrogen 3.049 N/A GLU 151.A N GLU 151.A OE1 no hydrogen 2.761 N/A ILE 152.A N VAL 149.A O no hydrogen 3.042 N/A GLU 153.A N VAL 149.A O no hydrogen 3.190 N/A GLU 154.A N PRO 150.A O no hydrogen 2.783 N/A ALA 155.A N GLU 151.A O no hydrogen 3.042 N/A ARG 156.A N ILE 152.A O no hydrogen 3.003 N/A ARG 156.A NH1 GLU 145.A O no hydrogen 2.780 N/A ARG 156.A NH1 ALA 146.A O no hydrogen 3.262 N/A THR 157.A N GLU 153.A O no hydrogen 2.945 N/A THR 157.A OG1 GLU 153.A O no hydrogen 2.803 N/A VAL 158.A N GLU 154.A O no hydrogen 2.978 N/A LYS 159.A N ALA 155.A O no hydrogen 3.000 N/A VAL 160.A N ARG 156.A O no hydrogen 3.232 N/A LEU 161.A N THR 157.A O no hydrogen 3.006 N/A GLN 162.A N VAL 158.A O no hydrogen 2.883 N/A MET 163.A N LYS 159.A O no hydrogen 3.036 N/A VAL 164.A N VAL 160.A O no hydrogen 2.868 N/A GLU 165.A N LEU 161.A O no hydrogen 2.925 N/A TRP 167.A N MET 163.A O no hydrogen 3.376 N/A LEU 168.A N VAL 164.A O no hydrogen 2.760 N/A SER 169.A N GLU 165.A O no hydrogen 3.152 N/A SER 169.A OG GLU 166.A O no hydrogen 2.670 N/A ARG 170.A N TRP 167.A O no hydrogen 3.351 N/A ARG 170.A NH1 SER 133.A OG no hydrogen 3.085 N/A GLY 171.A N LEU 168.A O no hydrogen 3.013 N/A GLU 173.A N ASP 137.A O no hydrogen 3.048 N/A ASP 174.A N ASP 137.A O no hydrogen 3.170 N/A PHE 175.A N SER 219.A OG no hydrogen 3.055 N/A CYS 176.A N LEU 139.A O no hydrogen 3.033 N/A VAL 177.A N TRP 217.A O no hydrogen 2.889 N/A LYS 178.A N CYS 141.A O no hydrogen 2.781 N/A LYS 178.A NZ GLY 144.A O no hydrogen 2.745 N/A ILE 179.A N MET 215.A O no hydrogen 2.680 N/A CYS 181.A N THR 157.A OG1 no hydrogen 3.261 N/A LYS 186.A N GLU 154.A OE2 no hydrogen 2.816 N/A LEU 188.A N MET 184.A O no hydrogen 3.047 N/A LYS 189.A N PRO 185.A O no hydrogen 2.933 N/A GLU 190.A N LYS 186.A O no hydrogen 3.209 N/A LEU 191.A N VAL 187.A O no hydrogen 2.819 N/A GLU 192.A N LEU 188.A O no hydrogen 3.001 N/A LYS 193.A N LYS 189.A O no hydrogen 3.411 N/A MET 194.A N GLU 190.A O no hydrogen 3.053 N/A GLN 195.A N LEU 191.A O no hydrogen 2.708 N/A GLN 195.A NE2 GLY 200.A O no hydrogen 2.896 N/A GLN 195.A NE2 GLY 223.A O no hydrogen 3.038 N/A LEU 196.A N GLU 192.A O no hydrogen 3.048 N/A ARG 197.A N LYS 193.A O no hydrogen 3.211 N/A ARG 197.A NH1 ARG 197.A O no hydrogen 2.963 N/A TRP 198.A N MET 194.A O no hydrogen 2.807 N/A TRP 198.A NE1 GLU 165.A OE1 no hydrogen 2.916 N/A GLY 199.A N GLN 195.A O no hydrogen 2.816 N/A GLY 201.A N VAL 218.A O no hydrogen 3.021 N/A ILE 203.A N TYR 216.A O no hydrogen 2.901 N/A ARG 204.A NH1 ASN 212.A O no hydrogen 2.905 N/A ARG 204.A NH1 GLU 214.A O no hydrogen 2.866 N/A ARG 204.A NH2 ARG 209.A O no hydrogen 2.935 N/A ARG 204.A NH2 ASN 212.A O no hydrogen 3.055 N/A SER 208.A N VAL 205.A O no hydrogen 2.963 N/A SER 208.A OG VAL 205.A O no hydrogen 3.378 N/A SER 208.A OG GLU 214.A OE2 no hydrogen 2.559 N/A ASN 210.A N ARG 24.A O no hydrogen 2.863 N/A ASN 210.A ND2 TYR 23.A O no hydrogen 2.961 N/A ASN 210.A ND2 ASP 26.A O no hydrogen 2.742 N/A ASN 212.A N ARG 209.A O no hydrogen 3.148 N/A HIS 213.A ND1 HIS 213.A O no hydrogen 2.682 N/A HIS 213.A NE2 SER 233.A OG no hydrogen 2.752 N/A GLU 214.A N ASN 212.A OD1 no hydrogen 3.012 N/A MET 215.A N ILE 179.A O no hydrogen 3.089 N/A TYR 216.A N ILE 203.A O no hydrogen 2.870 N/A TYR 216.A OH ASP 142.A OD1 no hydrogen 2.813 N/A TRP 217.A N VAL 177.A O no hydrogen 2.823 N/A TRP 217.A NE1 GLY 199.A O no hydrogen 2.935 N/A VAL 218.A N GLY 201.A O no hydrogen 2.897 N/A SER 219.A N PHE 175.A O no hydrogen 3.025 N/A SER 219.A OG PHE 175.A O no hydrogen 3.499 N/A GLY 220.A N PHE 66.A O no hydrogen 2.746 N/A ALA 221.A N VAL 218.A O no hydrogen 3.485 N/A ASN 227.A N ASN 224.A OD1 no hydrogen 2.977 N/A SER 228.A N ASN 224.A O no hydrogen 2.979 N/A SER 228.A OG ASN 224.A O no hydrogen 3.049 N/A VAL 229.A N ILE 225.A O no hydrogen 2.950 N/A ASN 230.A N THR 226.A O no hydrogen 2.998 N/A THR 231.A N ASN 227.A O no hydrogen 3.007 N/A THR 231.A OG1 ASN 227.A O no hydrogen 2.874 N/A VAL 232.A N SER 228.A O no hydrogen 3.353 N/A SER 233.A N VAL 229.A O no hydrogen 2.921 N/A SER 233.A OG HIS 213.A NE2 no hydrogen 2.752 N/A SER 233.A OG VAL 229.A O no hydrogen 3.121 N/A GLN 234.A N ASN 230.A O no hydrogen 2.922 N/A GLN 234.A NE2 GLN 234.A O no hydrogen 3.361 N/A GLN 234.A NE2 ASN 238.A OD1 no hydrogen 2.868 N/A MET 235.A N THR 231.A O no hydrogen 3.127 N/A LEU 236.A N VAL 232.A O no hydrogen 2.877 N/A ILE 237.A N SER 233.A O no hydrogen 2.913 N/A ASN 238.A N GLN 234.A O no hydrogen 2.805 N/A ARG 239.A N MET 235.A O no hydrogen 2.988 N/A ARG 239.A NH1 ASN 210.A OD1 no hydrogen 2.919 N/A MET 240.A N LEU 236.A O no hydrogen 2.982 N/A ASN 241.A N ILE 237.A O no hydrogen 3.061 N/A ARG 242.A N ARG 239.A O no hydrogen 3.390 N/A ARG 245.A NH1 ASP 26.A OD2 no hydrogen 2.988 N/A ARG 245.A NH1 ARG 239.A O no hydrogen 2.776 N/A ARG 245.A NH2 MET 240.A O no hydrogen 2.914 N/A ASN 246.A N ASP 26.A OD1 no hydrogen 2.910 N/A LYS 249.A N ILE 28.A O no hydrogen 2.660 N/A GLU 251.A N GLU 30.A O no hydrogen 3.012 N/A VAL 254.A N ASP 253.A OD1 no hydrogen 2.760 N/A LEU 256.A N GLY 48.A O no hydrogen 2.849 N/A ARG 261.A N ASN 118.A OD1 no hydrogen 2.898 N/A ARG 261.A NH1 ALA 88.A O no hydrogen 2.848 N/A ARG 261.A NH1 LEU 90.A O no hydrogen 2.814 N/A ARG 261.A NH1 VAL 93.A O no hydrogen 3.316 N/A ARG 261.A NH2 LYS 91.A O no hydrogen 3.085 N/A ARG 261.A NH2 VAL 93.A O no hydrogen 3.366 N/A