Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xd3_J.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 TYR 3.A OH no hydrogen 2.429 N/A TYR 3.A OH ASP 65.A OD2 no hydrogen 3.085 N/A GLU 4.A N ARG 21.A O no hydrogen 2.955 N/A LEU 6.A N LYS 19.A O no hydrogen 2.857 N/A ASP 7.A N LYS 19.A O no hydrogen 3.471 N/A LEU 9.A N VAL 17.A O no hydrogen 2.979 N/A GLY 10.A N VAL 17.A O no hydrogen 2.922 N/A ALA 15.A N GLY 12.A O no hydrogen 2.917 N/A THR 16.A N LYS 33.A O no hydrogen 2.902 N/A VAL 17.A N GLY 10.A O no hydrogen 2.898 N/A TYR 18.A N ILE 31.A O no hydrogen 2.873 N/A LYS 19.A N ASP 7.A O no hydrogen 2.642 N/A ALA 20.A N VAL 29.A O no hydrogen 2.891 N/A ARG 21.A N GLU 4.A O no hydrogen 2.894 N/A ASP 22.A N ASP 22.A OD1 no hydrogen 2.474 N/A THR 25.A OG1 ASP 22.A OD2 no hydrogen 2.233 N/A VAL 29.A N ALA 20.A O no hydrogen 2.863 N/A ALA 30.A N PHE 77.A O no hydrogen 2.842 N/A ILE 31.A N TYR 18.A O no hydrogen 2.858 N/A LYS 32.A N LEU 75.A O no hydrogen 2.862 N/A LYS 33.A N THR 16.A O no hydrogen 2.923 N/A ILE 34.A N ILE 73.A O no hydrogen 2.970 N/A LYS 35.A N PHE 14.A O no hydrogen 3.512 N/A LYS 35.A NZ GLU 11.A OE2 no hydrogen 2.419 N/A LYS 35.A NZ GLY 12.A O no hydrogen 3.525 N/A LYS 35.A NZ GLN 13.A O no hydrogen 3.383 N/A LEU 46.A N ASN 42.A O no hydrogen 3.274 N/A ARG 47.A N ARG 43.A O no hydrogen 2.905 N/A GLU 48.A N THR 44.A O no hydrogen 2.988 N/A ILE 49.A N ALA 45.A O no hydrogen 2.902 N/A LYS 50.A N LEU 46.A O no hydrogen 2.800 N/A LEU 51.A N ARG 47.A O no hydrogen 2.964 N/A LEU 52.A N GLU 48.A O no hydrogen 2.939 N/A SER 56.A N TYR 113.A OH no hydrogen 3.215 N/A ASN 59.A N HIS 57.A ND1 no hydrogen 3.136 N/A ASN 59.A ND2 MET 106.A O no hydrogen 2.866 N/A ASP 65.A N VAL 76.A O no hydrogen 2.948 N/A ALA 66.A N ASP 65.A OD1 no hydrogen 2.333 N/A PHE 67.A N SER 74.A O no hydrogen 2.991 N/A HIS 69.A N ASN 72.A O no hydrogen 2.752 N/A SER 71.A OG ASN 72.A OD1 no hydrogen 3.393 N/A SER 74.A N PHE 67.A O no hydrogen 2.845 N/A LEU 75.A N LYS 32.A O no hydrogen 2.901 N/A VAL 76.A N ASP 65.A O no hydrogen 2.861 N/A PHE 77.A N ALA 30.A O no hydrogen 2.954 N/A PHE 79.A N ILE 28.A O no hydrogen 3.027 N/A THR 82.A N LEU 131.A O no hydrogen 2.863 N/A THR 82.A OG1 LEU 131.A O no hydrogen 3.486 N/A LEU 84.A N LEU 129.A O no hydrogen 2.956 N/A VAL 86.A N ASP 83.A O no hydrogen 3.223 N/A ILE 87.A N ASP 83.A O no hydrogen 3.455 N/A ILE 88.A N LEU 84.A O no hydrogen 2.844 N/A LYS 89.A N GLU 85.A O no hydrogen 2.910 N/A ASP 90.A N VAL 86.A O no hydrogen 2.794 N/A SER 92.A N ASP 90.A OD2 no hydrogen 2.717 N/A SER 92.A OG ASP 90.A OD2 no hydrogen 2.722 N/A LEU 93.A N ASP 90.A OD2 no hydrogen 3.202 N/A HIS 99.A ND1 THR 287.A OG1 no hydrogen 3.320 N/A ILE 100.A N THR 96.A O no hydrogen 3.221 N/A LYS 101.A N PRO 97.A O no hydrogen 2.910 N/A LYS 101.A NZ TYR 279.A O no hydrogen 2.692 N/A LYS 101.A NZ PRO 284.A O no hydrogen 2.799 N/A ALA 102.A N SER 98.A O no hydrogen 2.907 N/A TYR 103.A N HIS 99.A O no hydrogen 2.965 N/A MET 104.A N ILE 100.A O no hydrogen 2.911 N/A LEU 105.A N LYS 101.A O no hydrogen 2.833 N/A MET 106.A N ALA 102.A O no hydrogen 2.940 N/A THR 107.A N TYR 103.A O no hydrogen 2.961 N/A THR 107.A OG1 TYR 103.A O no hydrogen 2.733 N/A LEU 108.A N MET 104.A O no hydrogen 2.895 N/A GLN 109.A N LEU 105.A O no hydrogen 2.893 N/A GLY 110.A N MET 106.A O no hydrogen 2.999 N/A LEU 111.A N THR 107.A O no hydrogen 2.885 N/A GLU 112.A N LEU 108.A O no hydrogen 2.867 N/A TYR 113.A N GLN 109.A O no hydrogen 3.028 N/A LEU 114.A N GLY 110.A O no hydrogen 2.940 N/A HIS 115.A N LEU 111.A O no hydrogen 2.848 N/A HIS 115.A NE2 ASP 180.A OD2 no hydrogen 2.828 N/A GLN 116.A N GLU 112.A O no hydrogen 2.901 N/A HIS 117.A N TYR 113.A O no hydrogen 3.388 N/A TRP 118.A N HIS 115.A O no hydrogen 3.222 N/A ILE 119.A N LEU 114.A O no hydrogen 3.165 N/A LEU 120.A N LYS 146.A O no hydrogen 2.833 N/A HIS 121.A N ASP 180.A OD2 no hydrogen 2.910 N/A ARG 122.A NE LEU 144.A O no hydrogen 3.527 N/A ARG 122.A NH1 TYR 175.A OH no hydrogen 3.332 N/A LYS 125.A NZ ASP 123.A OD1 no hydrogen 3.096 N/A LYS 125.A NZ ASN 128.A OD1 no hydrogen 3.270 N/A ASN 127.A ND2 ASN 127.A O no hydrogen 2.669 N/A ASN 128.A N LYS 125.A O no hydrogen 2.778 N/A LEU 130.A N LYS 138.A O no hydrogen 2.930 N/A LEU 131.A N THR 82.A O no hydrogen 2.911 N/A GLY 135.A N ASP 132.A O no hydrogen 2.874 N/A VAL 136.A N ASP 132.A OD1 no hydrogen 3.083 N/A LYS 138.A N LEU 130.A O no hydrogen 2.870 N/A LYS 138.A NZ PRO 58.A O no hydrogen 2.527 N/A LEU 139.A N ASN 59.A O no hydrogen 3.199 N/A ALA 140.A N ASN 128.A O no hydrogen 2.898 N/A LYS 146.A N LEU 120.A O no hydrogen 2.991 N/A PHE 148.A N TRP 118.A O no hydrogen 3.313 N/A TYR 154.A N ARG 173.A O no hydrogen 3.264 N/A TYR 154.A OH SER 147.A O no hydrogen 2.336 N/A VAL 159.A N GLN 157.A O no hydrogen 2.983 N/A TRP 162.A NE1 GLY 200.A O no hydrogen 3.217 N/A TYR 163.A N THR 160.A O no hydrogen 3.253 N/A TYR 163.A OH GLU 190.A OE1 no hydrogen 2.404 N/A TYR 163.A OH GLU 190.A OE2 no hydrogen 3.340 N/A ARG 164.A N ARG 161.A O no hydrogen 3.224 N/A ARG 164.A NE VAL 159.A O no hydrogen 3.230 N/A ARG 164.A NH2 VAL 159.A O no hydrogen 2.253 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 3.093 N/A LEU 169.A N ALA 165.A O no hydrogen 3.035 N/A PHE 170.A N PRO 166.A O no hydrogen 2.889 N/A GLY 171.A N LEU 168.A O no hydrogen 2.898 N/A MET 181.A N VAL 177.A O no hydrogen 3.141 N/A TRP 182.A N GLY 178.A O no hydrogen 2.889 N/A ALA 183.A N VAL 179.A O no hydrogen 2.966 N/A VAL 184.A N ASP 180.A O no hydrogen 2.847 N/A GLY 185.A N MET 181.A O no hydrogen 2.870 N/A CYS 186.A N TRP 182.A O no hydrogen 2.891 N/A CYS 186.A SG TRP 162.A O no hydrogen 3.847 N/A CYS 186.A SG TRP 182.A O no hydrogen 3.501 N/A ILE 187.A N ALA 183.A O no hydrogen 2.911 N/A LEU 188.A N VAL 184.A O no hydrogen 2.838 N/A ALA 189.A N GLY 185.A O no hydrogen 2.905 N/A GLU 190.A N CYS 186.A O no hydrogen 2.903 N/A LEU 191.A N ILE 187.A O no hydrogen 2.872 N/A LEU 192.A N LEU 188.A O no hydrogen 2.896 N/A LEU 193.A N ALA 189.A O no hydrogen 2.922 N/A ARG 194.A NE ILE 88.A O no hydrogen 3.266 N/A ARG 194.A NH2 ASP 90.A O no hydrogen 2.675 N/A ARG 194.A NH2 LEU 93.A O no hydrogen 2.431 N/A GLN 206.A N SER 202.A O no hydrogen 2.878 N/A GLN 206.A NE2 LEU 198.A O no hydrogen 3.043 N/A LEU 207.A N ASP 203.A O no hydrogen 2.918 N/A THR 208.A N LEU 204.A O no hydrogen 2.964 N/A THR 208.A OG1 LEU 204.A O no hydrogen 3.046 N/A THR 208.A OG1 ASP 205.A O no hydrogen 2.558 N/A THR 208.A OG1 ASP 205.A OD1 no hydrogen 3.275 N/A ARG 209.A N ASP 205.A O no hydrogen 2.892 N/A ILE 210.A N GLN 206.A O no hydrogen 2.888 N/A PHE 211.A N LEU 207.A O no hydrogen 2.965 N/A GLU 212.A N THR 208.A O no hydrogen 2.868 N/A THR 213.A N ARG 209.A O no hydrogen 2.949 N/A THR 213.A N ILE 210.A O no hydrogen 3.287 N/A THR 213.A OG1 ARG 209.A O no hydrogen 3.036 N/A LEU 214.A N ILE 210.A O no hydrogen 2.909 N/A GLY 215.A N PHE 211.A O no hydrogen 2.813 N/A THR 216.A N PHE 237.A O no hydrogen 3.347 N/A THR 216.A OG1 LYS 235.A O no hydrogen 3.404 N/A GLN 221.A N THR 218.A OG1 no hydrogen 3.229 N/A SER 227.A N ASP 224.A O no hydrogen 3.467 N/A LEU 228.A N MET 225.A O no hydrogen 3.243 N/A ASP 230.A N PHE 170.A O no hydrogen 2.958 N/A THR 233.A OG1 TYR 231.A OH no hydrogen 3.016 N/A HIS 244.A N PRO 241.A O no hydrogen 3.357 N/A ILE 245.A N LEU 242.A O no hydrogen 3.085 N/A PHE 246.A N LEU 242.A O no hydrogen 3.240 N/A ALA 249.A N PHE 246.A O no hydrogen 2.993 N/A LEU 253.A N ASP 252.A OD1 no hydrogen 2.539 N/A LEU 254.A N GLY 250.A O no hydrogen 2.993 N/A ASP 255.A N ASP 251.A O no hydrogen 2.931 N/A LEU 256.A N ASP 252.A O no hydrogen 2.930 N/A ILE 257.A N LEU 253.A O no hydrogen 2.871 N/A GLN 258.A N LEU 254.A O no hydrogen 2.875 N/A GLY 259.A N ASP 255.A O no hydrogen 2.929 N/A LEU 260.A N LEU 256.A O no hydrogen 2.918 N/A PHE 261.A N GLN 258.A O no hydrogen 3.070 N/A CYS 266.A N ASN 264.A OD1 no hydrogen 2.677 N/A ALA 267.A N ASN 264.A OD1 no hydrogen 3.027 N/A ARG 268.A N ASN 264.A O no hydrogen 2.816 N/A ARG 268.A NE LEU 262.A O no hydrogen 2.913 N/A ARG 268.A NH1 GLU 167.A OE1 no hydrogen 3.047 N/A ARG 268.A NH1 GLY 178.A O no hydrogen 2.655 N/A ARG 268.A NH2 GLU 167.A OE1 no hydrogen 2.536 N/A ARG 268.A NH2 PHE 263.A O no hydrogen 3.515 N/A ILE 269.A N GLY 259.A O no hydrogen 3.459 N/A THR 270.A N GLN 273.A OE1 no hydrogen 3.341 N/A ALA 274.A N THR 270.A O no hydrogen 2.720 N/A LEU 275.A N ALA 271.A O no hydrogen 3.303 N/A SER 281.A N LYS 278.A O no hydrogen 3.114 N/A SER 281.A OG LYS 278.A O no hydrogen 3.186 N/A ASN 282.A ND2 ASP 252.A OD2 no hydrogen 2.636 N/A THR 287.A OG1 HIS 99.A ND1 no hydrogen 3.320 N/A GLN 291.A N PRO 288.A O no hydrogen 2.798 N/A