Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7xkd_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N TYR 232.A OH no hydrogen 2.625 N/A LEU 5.A N GLN 1.A O no hydrogen 3.341 N/A THR 6.A N MET 2.A O no hydrogen 3.282 N/A THR 6.A OG1 MET 3.A O no hydrogen 2.483 N/A PHE 7.A N MET 3.A O no hydrogen 3.428 N/A ILE 8.A N ALA 4.A O no hydrogen 2.942 N/A THR 9.A N LEU 5.A O no hydrogen 2.898 N/A THR 9.A OG1 LEU 5.A O no hydrogen 2.532 N/A TYR 10.A N THR 6.A O no hydrogen 2.901 N/A ILE 11.A N PHE 7.A O no hydrogen 2.958 N/A GLY 12.A N ILE 8.A O no hydrogen 2.903 N/A CYS 13.A N THR 9.A O no hydrogen 2.894 N/A GLY 14.A N TYR 10.A O no hydrogen 2.925 N/A LEU 15.A N ILE 11.A O no hydrogen 2.952 N/A SER 16.A N GLY 12.A O no hydrogen 2.899 N/A SER 16.A OG GLY 12.A O no hydrogen 3.484 N/A SER 16.A OG THR 239.A O no hydrogen 3.109 N/A SER 17.A N CYS 13.A O no hydrogen 2.879 N/A SER 17.A OG CYS 13.A O no hydrogen 3.205 N/A SER 17.A OG GLY 14.A O no hydrogen 2.705 N/A ILE 18.A N GLY 14.A O no hydrogen 2.977 N/A PHE 19.A N LEU 15.A O no hydrogen 2.961 N/A LEU 20.A N SER 16.A O no hydrogen 2.816 N/A SER 21.A N SER 17.A O no hydrogen 2.950 N/A SER 21.A OG SER 17.A O no hydrogen 3.288 N/A SER 21.A OG ILE 18.A O no hydrogen 2.415 N/A VAL 22.A N ILE 18.A O no hydrogen 2.991 N/A THR 23.A N PHE 19.A O no hydrogen 2.888 N/A THR 23.A OG1 PHE 19.A O no hydrogen 2.853 N/A LEU 24.A N LEU 20.A O no hydrogen 2.867 N/A VAL 25.A N SER 21.A O no hydrogen 2.954 N/A THR 26.A N VAL 22.A O no hydrogen 2.933 N/A THR 26.A OG1 VAL 22.A O no hydrogen 2.845 N/A TYR 27.A N THR 23.A O no hydrogen 2.894 N/A TYR 27.A OH TYR 249.A O no hydrogen 2.805 N/A ILE 28.A N LEU 24.A O no hydrogen 2.910 N/A ALA 29.A N VAL 25.A O no hydrogen 2.910 N/A PHE 30.A N THR 26.A O no hydrogen 3.409 N/A ARG 34.A N GLU 31.A O no hydrogen 3.316 N/A ARG 34.A NE TYR 27.A O no hydrogen 3.200 N/A ARG 34.A NH2 ILE 28.A O no hydrogen 3.051 N/A ARG 35.A NE GLU 31.A OE1 no hydrogen 2.925 N/A ARG 35.A NH2 GLU 31.A OE1 no hydrogen 3.458 N/A ASP 36.A N ASP 36.A OD1 no hydrogen 2.399 N/A SER 39.A OG ILE 33.A O no hydrogen 3.134 N/A SER 39.A OG ASP 36.A OD1 no hydrogen 2.866 N/A SER 39.A OG ASP 36.A OD2 no hydrogen 3.169 N/A LYS 40.A N ASP 36.A O no hydrogen 3.412 N/A LYS 40.A NZ ARG 34.A O no hydrogen 2.898 N/A LYS 40.A NZ ARG 35.A O no hydrogen 2.797 N/A ILE 41.A N TYR 37.A O no hydrogen 2.944 N/A LEU 42.A N PRO 38.A O no hydrogen 2.857 N/A ILE 43.A N SER 39.A O no hydrogen 2.899 N/A GLN 44.A N LYS 40.A O no hydrogen 2.991 N/A LEU 45.A N ILE 41.A O no hydrogen 2.902 N/A CYS 46.A N LEU 42.A O no hydrogen 2.860 N/A CYS 46.A SG LEU 42.A O no hydrogen 3.214 N/A ALA 47.A N ILE 43.A O no hydrogen 2.950 N/A ALA 48.A N GLN 44.A O no hydrogen 2.967 N/A LEU 49.A N LEU 45.A O no hydrogen 2.884 N/A LEU 50.A N CYS 46.A O no hydrogen 2.884 N/A LEU 51.A N ALA 47.A O no hydrogen 2.979 N/A LEU 52.A N ALA 48.A O no hydrogen 2.925 N/A ASN 53.A N LEU 49.A O no hydrogen 2.904 N/A LEU 54.A N LEU 50.A O no hydrogen 2.921 N/A ILE 55.A N LEU 51.A O no hydrogen 2.940 N/A PHE 56.A N LEU 52.A O no hydrogen 2.898 N/A LEU 57.A N ASN 53.A O no hydrogen 2.925 N/A LEU 58.A N LEU 54.A O no hydrogen 2.914 N/A ASP 59.A N ILE 55.A O no hydrogen 2.869 N/A SER 60.A N PHE 56.A O no hydrogen 2.925 N/A SER 60.A OG PHE 56.A O no hydrogen 3.187 N/A SER 60.A OG LEU 57.A O no hydrogen 2.919 N/A TRP 61.A N LEU 57.A O no hydrogen 2.905 N/A ILE 62.A N LEU 58.A O no hydrogen 2.984 N/A CYS 71.A N THR 67.A O no hydrogen 3.194 N/A ILE 72.A N ARG 68.A O no hydrogen 2.931 N/A ALA 73.A N GLY 69.A O no hydrogen 2.901 N/A VAL 74.A N PHE 70.A O no hydrogen 2.906 N/A ALA 75.A N CYS 71.A O no hydrogen 2.937 N/A VAL 76.A N ILE 72.A O no hydrogen 2.893 N/A PHE 77.A N ALA 73.A O no hydrogen 2.931 N/A LEU 78.A N VAL 74.A O no hydrogen 2.922 N/A HIS 79.A N ALA 75.A O no hydrogen 2.934 N/A HIS 79.A ND1 TYR 138.A OH no hydrogen 2.364 N/A TYR 80.A N VAL 76.A O no hydrogen 2.893 N/A TYR 80.A OH TRP 120.A O no hydrogen 3.064 N/A PHE 81.A N PHE 77.A O no hydrogen 2.913 N/A LEU 82.A N LEU 78.A O no hydrogen 2.962 N/A LEU 83.A N HIS 79.A O no hydrogen 2.948 N/A VAL 84.A N TYR 80.A O no hydrogen 2.874 N/A SER 85.A N PHE 81.A O no hydrogen 2.946 N/A PHE 86.A N LEU 82.A O no hydrogen 3.002 N/A THR 87.A N LEU 83.A O no hydrogen 2.875 N/A TRP 88.A N VAL 84.A O no hydrogen 2.894 N/A MET 89.A N SER 85.A O no hydrogen 3.010 N/A GLY 90.A N PHE 86.A O no hydrogen 2.960 N/A LEU 91.A N THR 87.A O no hydrogen 2.839 N/A GLU 92.A N TRP 88.A O no hydrogen 2.911 N/A ALA 93.A N MET 89.A O no hydrogen 3.020 N/A PHE 94.A N GLY 90.A O no hydrogen 2.887 N/A HIS 95.A N LEU 91.A O no hydrogen 2.895 N/A HIS 95.A ND1 TYR 111.A OH no hydrogen 2.840 N/A MET 96.A N GLU 92.A O no hydrogen 2.976 N/A TYR 97.A N ALA 93.A O no hydrogen 2.932 N/A LEU 98.A N PHE 94.A O no hydrogen 2.909 N/A ALA 99.A N MET 96.A O no hydrogen 3.167 N/A LEU 100.A N MET 96.A O no hydrogen 2.932 N/A VAL 101.A N TYR 97.A O no hydrogen 3.024 N/A LYS 102.A N TYR 97.A O no hydrogen 3.239 N/A TYR 111.A OH HIS 95.A ND1 no hydrogen 2.840 N/A LYS 114.A N LYS 110.A O no hydrogen 2.892 N/A LYS 114.A NZ ARG 109.A O no hydrogen 2.602 N/A PHE 115.A N TYR 111.A O no hydrogen 2.946 N/A CYS 116.A N ILE 112.A O no hydrogen 2.854 N/A CYS 116.A SG ILE 112.A O no hydrogen 3.370 N/A ILE 117.A N LEU 113.A O no hydrogen 2.894 N/A VAL 118.A N LYS 114.A O no hydrogen 2.966 N/A GLY 119.A N PHE 115.A O no hydrogen 2.878 N/A TRP 120.A N CYS 116.A O no hydrogen 2.918 N/A GLY 121.A N VAL 118.A O no hydrogen 3.199 N/A ILE 122.A N VAL 118.A O no hydrogen 2.976 N/A VAL 125.A N GLY 121.A O no hydrogen 2.735 N/A VAL 126.A N ILE 122.A O no hydrogen 2.944 N/A VAL 127.A N PRO 123.A O no hydrogen 2.923 N/A SER 128.A N ALA 124.A O no hydrogen 2.906 N/A SER 128.A OG ALA 124.A O no hydrogen 2.258 N/A ILE 129.A N VAL 125.A O no hydrogen 2.901 N/A VAL 130.A N VAL 126.A O no hydrogen 2.969 N/A LEU 131.A N VAL 127.A O no hydrogen 2.922 N/A THR 132.A N SER 128.A O no hydrogen 2.871 N/A THR 132.A OG1 SER 128.A O no hydrogen 2.695 N/A ILE 133.A N ILE 129.A O no hydrogen 2.960 N/A SER 134.A N VAL 130.A O no hydrogen 3.460 N/A ASP 136.A N SER 134.A OG no hydrogen 3.299 N/A ASN 137.A ND2 VAL 130.A O no hydrogen 3.439 N/A TYR 138.A OH HIS 79.A ND1 no hydrogen 2.364 N/A ASN 152.A N ASN 137.A O no hydrogen 3.021 N/A ASN 152.A ND2 ASP 136.A O no hydrogen 3.458 N/A VAL 155.A N SER 153.A OG no hydrogen 3.157 N/A VAL 156.A N SER 153.A OG no hydrogen 3.156 N/A ILE 159.A N VAL 155.A O no hydrogen 3.395 N/A THR 160.A N VAL 156.A O no hydrogen 2.877 N/A THR 160.A OG1 VAL 156.A O no hydrogen 2.363 N/A VAL 161.A N PHE 157.A O no hydrogen 3.218 N/A VAL 162.A N TYR 158.A O no hydrogen 3.242 N/A GLY 163.A N TYR 158.A O no hydrogen 2.697 N/A CYS 166.A N VAL 162.A O no hydrogen 2.580 N/A CYS 166.A SG VAL 162.A O no hydrogen 3.219 N/A VAL 167.A N GLY 163.A O no hydrogen 2.932 N/A ILE 168.A N TYR 164.A O no hydrogen 3.005 N/A PHE 169.A N PHE 165.A O no hydrogen 2.808 N/A LEU 170.A N CYS 166.A O no hydrogen 2.911 N/A LEU 171.A N VAL 167.A O no hydrogen 3.016 N/A ASN 172.A N ILE 168.A O no hydrogen 2.893 N/A ASN 172.A ND2 LEU 213.A O no hydrogen 2.280 N/A VAL 173.A N PHE 169.A O no hydrogen 2.859 N/A SER 174.A N LEU 170.A O no hydrogen 2.944 N/A SER 174.A OG LEU 170.A O no hydrogen 3.235 N/A SER 174.A OG LEU 171.A O no hydrogen 2.680 N/A MET 175.A N LEU 171.A O no hydrogen 2.972 N/A PHE 176.A N ASN 172.A O no hydrogen 2.857 N/A ILE 177.A N VAL 173.A O no hydrogen 2.902 N/A VAL 178.A N SER 174.A O no hydrogen 2.953 N/A VAL 179.A N MET 175.A O no hydrogen 2.896 N/A LEU 180.A N PHE 176.A O no hydrogen 2.931 N/A VAL 181.A N ILE 177.A O no hydrogen 2.870 N/A GLN 182.A N VAL 178.A O no hydrogen 2.971 N/A LEU 183.A N VAL 179.A O no hydrogen 2.889 N/A CYS 184.A N LEU 180.A O no hydrogen 2.896 N/A CYS 184.A SG LEU 180.A O no hydrogen 3.247 N/A ARG 185.A N VAL 181.A O no hydrogen 2.912 N/A ILE 186.A N GLN 182.A O no hydrogen 2.945 N/A LYS 187.A N LEU 183.A O no hydrogen 2.905 N/A LYS 188.A N CYS 184.A O no hydrogen 3.089 N/A LYS 188.A N ARG 185.A O no hydrogen 3.362 N/A LYS 189.A N ILE 186.A O no hydrogen 3.251 N/A LYS 190.A NZ GLN 195.A O no hydrogen 2.616 N/A SER 199.A N ASP 202.A OD2 no hydrogen 3.381 N/A ARG 204.A N ILE 200.A O no hydrogen 3.259 N/A SER 205.A N GLN 201.A O no hydrogen 2.921 N/A SER 205.A OG GLN 201.A O no hydrogen 2.845 N/A SER 205.A OG ASP 202.A O no hydrogen 2.576 N/A ILE 206.A N ASP 202.A O no hydrogen 2.907 N/A ALA 207.A N LEU 203.A O no hydrogen 2.889 N/A GLY 208.A N ARG 204.A O no hydrogen 2.931 N/A LEU 209.A N SER 205.A O no hydrogen 2.881 N/A THR 210.A N ILE 206.A O no hydrogen 2.893 N/A THR 210.A OG1 ILE 206.A O no hydrogen 3.415 N/A PHE 211.A N ALA 207.A O no hydrogen 2.968 N/A LEU 212.A N GLY 208.A O no hydrogen 2.876 N/A LEU 213.A N LEU 209.A O no hydrogen 2.856 N/A ILE 215.A N THR 210.A O no hydrogen 3.178 N/A THR 216.A OG1 ASN 238.A OD1 no hydrogen 3.011 N/A TRP 217.A N GLY 214.A O no hydrogen 3.337 N/A TRP 217.A NE1 GLN 241.A OE1 no hydrogen 2.908 N/A GLY 218.A N ILE 215.A O no hydrogen 2.914 N/A ALA 220.A N TRP 217.A O no hydrogen 2.922 N/A PHE 221.A N GLY 218.A O no hydrogen 2.937 N/A ALA 223.A N PHE 219.A O no hydrogen 3.002 N/A TRP 224.A N ALA 220.A O no hydrogen 2.806 N/A ASN 227.A ND2 PHE 222.A O no hydrogen 3.359 N/A MET 231.A N ASN 227.A O no hydrogen 2.919 N/A TYR 232.A N VAL 228.A O no hydrogen 3.030 N/A TYR 232.A OH GLN 1.A O no hydrogen 2.908 N/A LEU 233.A N THR 229.A O no hydrogen 2.915 N/A PHE 234.A N PHE 230.A O no hydrogen 2.875 N/A ALA 235.A N MET 231.A O no hydrogen 2.961 N/A ILE 236.A N TYR 232.A O no hydrogen 2.879 N/A PHE 237.A N LEU 233.A O no hydrogen 2.918 N/A ASN 238.A N PHE 234.A O no hydrogen 2.959 N/A ASN 238.A ND2 THR 216.A O no hydrogen 3.362 N/A THR 239.A N ALA 235.A O no hydrogen 2.907 N/A THR 239.A OG1 ALA 235.A O no hydrogen 2.588 N/A GLN 241.A NE2 PHE 211.A O no hydrogen 3.124 N/A PHE 243.A N SER 16.A OG no hydrogen 3.117 N/A PHE 244.A N LEU 240.A O no hydrogen 3.250 N/A ILE 245.A N GLN 241.A O no hydrogen 2.902 N/A PHE 246.A N GLY 242.A O no hydrogen 2.903 N/A ILE 247.A N PHE 243.A O no hydrogen 2.951 N/A PHE 248.A N PHE 244.A O no hydrogen 2.887 N/A TYR 249.A N ILE 245.A O no hydrogen 2.905 N/A CYS 250.A N PHE 246.A O no hydrogen 2.881 N/A ALA 251.A N PHE 246.A O no hydrogen 3.048 N/A ALA 252.A N ILE 247.A O no hydrogen 2.904 N/A ARG 257.A N LYS 253.A O no hydrogen 3.505 N/A LYS 258.A N GLU 254.A O no hydrogen 2.907 N/A GLN 259.A N ASN 255.A O no hydrogen 2.902 N/A TRP 260.A N VAL 256.A O no hydrogen 2.921 N/A TRP 260.A NE1 THR 26.A OG1 no hydrogen 3.212 N/A ARG 261.A N ARG 257.A O no hydrogen 3.157 N/A