Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jup_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N VAL 76.A O no hydrogen 3.245 N/A ARG 3.A NH2 TRP 80.A O no hydrogen 3.045 N/A PHE 4.A N TYR 78.A O no hydrogen 2.748 N/A SER 5.A N GLN 8.A OE1 no hydrogen 2.964 N/A TYR 6.A N GLU 81.A OE2 no hydrogen 3.267 N/A GLN 8.A N SER 5.A OG no hydrogen 2.874 N/A LEU 9.A N SER 5.A O no hydrogen 3.102 N/A ALA 10.A N TYR 6.A O no hydrogen 2.654 N/A ALA 11.A N GLY 7.A O no hydrogen 2.878 N/A ALA 12.A N GLN 8.A O no hydrogen 2.930 N/A THR 13.A N LEU 9.A O no hydrogen 3.050 N/A THR 13.A OG1 LEU 9.A O no hydrogen 2.796 N/A THR 13.A OG1 ALA 10.A O no hydrogen 3.288 N/A ASN 14.A N ALA 11.A O no hydrogen 3.194 N/A SER 15.A N ALA 10.A O no hydrogen 2.608 N/A PHE 16.A N THR 13.A OG1 no hydrogen 2.945 N/A ASP 17.A N THR 13.A O no hydrogen 3.213 N/A GLY 19.A N ASP 17.A OD2 no hydrogen 2.818 N/A ASN 20.A N ASP 17.A O no hydrogen 2.817 N/A ASN 20.A ND2 LYS 32.A O no hydrogen 2.992 N/A VAL 21.A N GLN 18.A O no hydrogen 3.175 N/A ILE 22.A N VAL 30.A O no hydrogen 2.855 N/A SER 25.A N SER 28.A O no hydrogen 2.910 N/A LEU 27.A N SER 25.A OG no hydrogen 2.985 N/A SER 28.A N SER 25.A OG no hydrogen 3.233 N/A THR 29.A N ARG 43.A O no hydrogen 3.013 N/A VAL 30.A N GLY 23.A O no hydrogen 2.762 N/A TYR 31.A N VAL 41.A O no hydrogen 2.788 N/A LYS 32.A N ASN 20.A O no hydrogen 2.714 N/A GLY 33.A N VAL 39.A O no hydrogen 2.755 N/A VAL 34.A N ALA 12.A O no hydrogen 3.108 N/A VAL 39.A N GLY 33.A O no hydrogen 2.798 N/A ALA 40.A N LEU 90.A O no hydrogen 2.831 N/A VAL 41.A N TYR 31.A O no hydrogen 2.765 N/A LYS 42.A N LEU 88.A O no hydrogen 2.866 N/A LYS 42.A NZ GLU 60.A OE1 no hydrogen 2.635 N/A ARG 43.A N THR 29.A O no hydrogen 2.837 N/A ARG 43.A NH2 LYS 84.A O no hydrogen 3.163 N/A LEU 44.A N LYS 86.A O no hydrogen 2.967 N/A ASN 45.A N LEU 27.A O no hydrogen 2.819 N/A ASN 45.A ND2 ASN 26.A O no hydrogen 3.172 N/A ASN 45.A ND2 GLN 48.A OE1 no hydrogen 2.923 N/A LEU 46.A N LEU 44.A O no hydrogen 3.002 N/A GLN 48.A N ASN 45.A OD1 no hydrogen 3.257 N/A PHE 49.A N ASN 45.A O no hydrogen 3.042 N/A SER 53.A N PHE 49.A O no hydrogen 2.959 N/A SER 53.A OG PHE 49.A O no hydrogen 2.828 N/A ASP 54.A N PRO 50.A O no hydrogen 3.017 N/A LYS 55.A N SER 51.A O no hydrogen 3.008 N/A CYS 56.A N LYS 52.A O no hydrogen 2.776 N/A CYS 56.A SG LYS 52.A O no hydrogen 3.441 N/A CYS 56.A SG GLY 157.A O no hydrogen 3.515 N/A PHE 57.A N SER 53.A O no hydrogen 2.718 N/A LEU 58.A N ASP 54.A O no hydrogen 2.953 N/A THR 59.A N LYS 55.A O no hydrogen 2.936 N/A THR 59.A OG1 LYS 55.A O no hydrogen 2.721 N/A GLU 60.A N CYS 56.A O no hydrogen 2.895 N/A LEU 61.A N PHE 57.A O no hydrogen 2.864 N/A ALA 62.A N LEU 58.A O no hydrogen 2.877 N/A THR 63.A N THR 59.A O no hydrogen 2.910 N/A THR 63.A OG1 THR 59.A O no hydrogen 2.845 N/A LEU 64.A N GLU 60.A O no hydrogen 2.820 N/A SER 65.A N LEU 61.A O no hydrogen 3.128 N/A SER 65.A OG LEU 61.A O no hydrogen 2.692 N/A SER 65.A OG ALA 62.A O no hydrogen 3.169 N/A ARG 66.A N THR 63.A O no hydrogen 3.052 N/A ARG 66.A NH1 ALA 62.A O no hydrogen 2.971 N/A LEU 67.A N LEU 64.A O no hydrogen 3.416 N/A ARG 68.A N TYR 124.A OH no hydrogen 3.091 N/A LYS 70.A NZ ASN 71.A OD1 no hydrogen 2.964 N/A ASN 71.A N HIS 69.A ND1 no hydrogen 2.768 N/A ASN 71.A ND2 GLU 150.A OE2 no hydrogen 2.992 N/A ASN 71.A ND2 ALA 151.A O no hydrogen 3.008 N/A LEU 72.A N HIS 69.A O no hydrogen 3.019 N/A ALA 73.A N VAL 153.A O no hydrogen 2.781 N/A ARG 74.A NH1 ASP 91.A OD2 no hydrogen 3.359 N/A VAL 76.A N VAL 89.A O no hydrogen 2.597 N/A GLY 77.A N VAL 89.A O no hydrogen 3.161 N/A TYR 78.A N ARG 2.A O no hydrogen 3.036 N/A ALA 79.A N ALA 87.A O no hydrogen 2.893 N/A GLU 81.A N ILE 85.A O no hydrogen 2.724 N/A LYS 84.A N GLU 81.A O no hydrogen 2.732 N/A ILE 85.A N GLU 81.A O no hydrogen 2.854 N/A LYS 86.A NZ ASP 54.A OD1 no hydrogen 2.708 N/A ALA 87.A N ALA 79.A O no hydrogen 2.938 N/A LEU 88.A N LYS 42.A O no hydrogen 2.920 N/A VAL 89.A N GLY 77.A O no hydrogen 2.791 N/A LEU 90.A N ALA 40.A O no hydrogen 2.758 N/A ASP 91.A N ARG 74.A O no hydrogen 2.860 N/A ASN 94.A N LEU 145.A O no hydrogen 3.019 N/A ASN 94.A ND2 ASP 146.A O no hydrogen 2.549 N/A LEU 97.A N PRO 140.A O no hydrogen 3.248 N/A LEU 97.A N VAL 143.A O no hydrogen 2.831 N/A GLY 99.A N ASP 96.A OD1 no hydrogen 2.651 N/A ALA 100.A N ASP 96.A O no hydrogen 3.158 N/A ILE 101.A N LEU 97.A O no hydrogen 2.892 N/A ILE 101.A N ASP 98.A O no hydrogen 3.277 N/A HIS 102.A N ASP 98.A O no hydrogen 2.926 N/A HIS 102.A NE2 GLU 195.A OE2 no hydrogen 2.693 N/A ARG 105.A NH1 GLU 110.A OE1 no hydrogen 3.159 N/A ARG 105.A NH2 GLU 110.A OE1 no hydrogen 2.938 N/A TRP 106.A N SER 104.A OG no hydrogen 3.010 N/A THR 107.A N ARG 105.A O no hydrogen 2.948 N/A GLU 110.A N THR 107.A OG1 no hydrogen 3.169 N/A ARG 111.A N THR 107.A O no hydrogen 2.965 N/A ARG 111.A NE TRP 106.A O no hydrogen 2.871 N/A ARG 111.A NH1 LEU 196.A O no hydrogen 2.740 N/A ARG 111.A NH1 ASP 235.A OD2 no hydrogen 2.858 N/A ARG 111.A NH2 TRP 106.A O no hydrogen 3.214 N/A ARG 111.A NH2 ASP 235.A OD2 no hydrogen 3.340 N/A LEU 112.A N VAL 108.A O no hydrogen 2.883 N/A ARG 113.A N ARG 109.A O no hydrogen 2.901 N/A ARG 113.A NH1 GLU 110.A OE1 no hydrogen 3.111 N/A ARG 113.A NH2 ASP 148.A O no hydrogen 3.131 N/A ARG 113.A NH2 GLU 150.A OE1 no hydrogen 2.795 N/A VAL 114.A N GLU 110.A O no hydrogen 3.115 N/A CYS 115.A N ARG 111.A O no hydrogen 3.077 N/A CYS 115.A SG ARG 111.A O no hydrogen 3.464 N/A VAL 116.A N LEU 112.A O no hydrogen 2.988 N/A SER 117.A N ARG 113.A O no hydrogen 2.981 N/A SER 117.A OG ARG 113.A O no hydrogen 3.108 N/A SER 117.A OG GLU 150.A OE2 no hydrogen 2.745 N/A VAL 118.A N VAL 114.A O no hydrogen 2.853 N/A ALA 119.A N CYS 115.A O no hydrogen 2.843 N/A HIS 120.A N VAL 116.A O no hydrogen 2.891 N/A GLY 121.A N SER 117.A O no hydrogen 3.042 N/A LEU 122.A N VAL 118.A O no hydrogen 2.883 N/A VAL 123.A N ALA 119.A O no hydrogen 2.754 N/A TYR 124.A N HIS 120.A O no hydrogen 3.035 N/A LEU 125.A N GLY 121.A O no hydrogen 2.964 N/A HIS 126.A N LEU 122.A O no hydrogen 2.945 N/A HIS 126.A NE2 ASP 186.A OD2 no hydrogen 2.844 N/A SER 127.A N VAL 123.A O no hydrogen 2.985 N/A SER 127.A OG VAL 123.A O no hydrogen 3.175 N/A GLY 128.A N TYR 124.A O no hydrogen 2.655 N/A VAL 133.A N LEU 125.A O no hydrogen 2.772 N/A VAL 134.A N ARG 160.A O no hydrogen 2.758 N/A HIS 135.A N ASP 186.A OD2 no hydrogen 2.762 N/A HIS 135.A NE2 SER 154.A O no hydrogen 2.774 N/A CYS 136.A N ASP 186.A OD1 no hydrogen 2.948 N/A CYS 136.A SG VAL 134.A O no hydrogen 3.807 N/A ALA 137.A N HIS 135.A ND1 no hydrogen 2.884 N/A LYS 139.A NZ SER 141.A OG no hydrogen 2.606 N/A ASN 142.A N LYS 139.A O no hydrogen 2.858 N/A ASN 142.A ND2 ALA 137.A O no hydrogen 2.806 N/A VAL 143.A N PRO 140.A O no hydrogen 3.032 N/A LEU 144.A N ARG 152.A O no hydrogen 2.777 N/A LEU 145.A N GLY 95.A O no hydrogen 2.847 N/A ASP 146.A N GLU 150.A O no hydrogen 2.995 N/A TRP 149.A N ASP 146.A O no hydrogen 2.990 N/A ARG 152.A N LEU 144.A O no hydrogen 2.740 N/A ARG 152.A NE LYS 70.A O no hydrogen 2.882 N/A ARG 152.A NH2 LYS 70.A O no hydrogen 3.158 N/A VAL 153.A N ASN 71.A O no hydrogen 2.710 N/A SER 154.A N ASN 142.A O no hydrogen 2.838 N/A PHE 156.A N GLU 60.A OE2 no hydrogen 2.942 N/A GLY 157.A N ASP 155.A OD1 no hydrogen 3.193 N/A THR 158.A OG1 HIS 135.A O no hydrogen 2.969 N/A ALA 159.A N PHE 156.A O no hydrogen 3.287 N/A ARG 160.A N VAL 134.A O no hydrogen 2.789 N/A ARG 160.A NH1 THR 158.A O no hydrogen 2.731 N/A SER 163.A OG SER 164.A OG no hydrogen 3.373 N/A SER 164.A N SER 163.A OG no hydrogen 2.649 N/A SER 164.A OG SER 163.A OG no hydrogen 3.373 N/A VAL 170.A N ARG 167.A O no hydrogen 3.139 N/A TYR 172.A N THR 169.A O no hydrogen 3.190 N/A TYR 172.A OH GLU 195.A OE1 no hydrogen 2.376 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.807 N/A ALA 177.A N ALA 173.A O no hydrogen 2.815 N/A TYR 178.A N PRO 174.A O no hydrogen 2.903 N/A THR 180.A N GLU 175.A O no hydrogen 3.121 N/A LYS 184.A N SER 182.A OG no hydrogen 3.001 N/A LYS 184.A NZ ARG 266.A O no hydrogen 2.750 N/A LYS 184.A NZ ASP 268.A OD1 no hydrogen 2.829 N/A VAL 185.A N SER 182.A O no hydrogen 3.077 N/A ASP 186.A N THR 183.A O no hydrogen 3.130 N/A VAL 187.A N THR 183.A O no hydrogen 3.328 N/A PHE 188.A N LYS 184.A O no hydrogen 3.069 N/A SER 189.A N VAL 185.A O no hydrogen 3.215 N/A SER 189.A OG TYR 172.A O no hydrogen 2.546 N/A SER 189.A OG VAL 185.A O no hydrogen 3.300 N/A PHE 190.A N ASP 186.A O no hydrogen 2.842 N/A GLY 191.A N VAL 187.A O no hydrogen 2.954 N/A VAL 192.A N PHE 188.A O no hydrogen 3.010 N/A LEU 193.A N SER 189.A O no hydrogen 2.774 N/A ALA 194.A N PHE 190.A O no hydrogen 2.872 N/A LEU 196.A N LEU 193.A O no hydrogen 2.798 N/A PHE 197.A N ALA 194.A O no hydrogen 3.082 N/A GLY 199.A N GLU 195.A O no hydrogen 2.773 N/A ARG 200.A N THR 198.A OG1 no hydrogen 3.155 N/A ARG 201.A NH2 ASP 98.A OD1 no hydrogen 3.483 N/A THR 205.A N LEU 213.A O no hydrogen 3.009 N/A ILE 206.A N SER 163.A O no hydrogen 2.995 N/A GLU 207.A N VAL 211.A O no hydrogen 3.013 N/A GLY 210.A N GLU 207.A O no hydrogen 2.850 N/A VAL 211.A N ASP 209.A OD1 no hydrogen 3.086 N/A LEU 213.A N THR 205.A O no hydrogen 2.661 N/A THR 214.A N GLN 217.A OE1 no hydrogen 2.935 N/A THR 214.A OG1 GLN 216.A OE1 no hydrogen 3.505 N/A GLN 216.A N GLN 216.A OE1 no hydrogen 2.633 N/A GLN 217.A N THR 214.A OG1 no hydrogen 3.052 N/A LEU 218.A N THR 214.A O no hydrogen 2.979 N/A VAL 219.A N LEU 215.A O no hydrogen 2.871 N/A ASP 220.A N GLN 216.A O no hydrogen 2.729 N/A ASN 221.A N GLN 217.A O no hydrogen 2.852 N/A ALA 222.A N LEU 218.A O no hydrogen 3.076 N/A VAL 223.A N VAL 219.A O no hydrogen 2.821 N/A SER 224.A N ASP 220.A O no hydrogen 2.984 N/A SER 224.A OG ASN 221.A O no hydrogen 2.797 N/A ARG 225.A N ASN 221.A O no hydrogen 3.226 N/A ARG 225.A N ALA 222.A O no hydrogen 3.001 N/A GLY 226.A N VAL 223.A O no hydrogen 3.111 N/A GLY 229.A N ARG 225.A O no hydrogen 3.383 N/A VAL 230.A N GLY 226.A O no hydrogen 2.917 N/A HIS 231.A N LEU 227.A O no hydrogen 2.981 N/A ALA 232.A N ASP 228.A O no hydrogen 3.238 N/A VAL 233.A N VAL 230.A O no hydrogen 2.879 N/A LEU 234.A N VAL 230.A O no hydrogen 3.114 N/A LEU 234.A N HIS 231.A O no hydrogen 3.256 N/A ASP 235.A N PHE 197.A O no hydrogen 2.803 N/A ARG 237.A N ASP 235.A OD1 no hydrogen 2.902 N/A ARG 237.A NH2 ILE 101.A O no hydrogen 2.732 N/A ASP 244.A N THR 241.A OG1 no hydrogen 3.032 N/A LEU 245.A N THR 241.A O no hydrogen 3.214 N/A SER 246.A N GLU 242.A O no hydrogen 2.776 N/A THR 247.A N ALA 243.A O no hydrogen 2.783 N/A THR 247.A OG1 ALA 243.A O no hydrogen 2.893 N/A ALA 248.A N ASP 244.A O no hydrogen 3.037 N/A ALA 249.A N LEU 245.A O no hydrogen 2.850 N/A ASP 250.A N SER 246.A O no hydrogen 2.988 N/A VAL 251.A N THR 247.A O no hydrogen 2.933 N/A LEU 252.A N ALA 248.A O no hydrogen 3.039 N/A ALA 253.A N ALA 249.A O no hydrogen 3.029 N/A VAL 254.A N ASP 250.A O no hydrogen 3.030 N/A ALA 255.A N VAL 251.A O no hydrogen 2.681 N/A LEU 256.A N LEU 252.A O no hydrogen 2.853 N/A SER 257.A N ALA 253.A O no hydrogen 3.260 N/A SER 257.A OG ALA 253.A O no hydrogen 3.114 N/A CYS 258.A N VAL 254.A O no hydrogen 2.981 N/A CYS 258.A SG VAL 254.A O no hydrogen 3.422 N/A ALA 259.A N ALA 255.A O no hydrogen 2.943 N/A ALA 260.A N SER 257.A O no hydrogen 3.231 N/A ASP 265.A N GLU 262.A O no hydrogen 2.894 N/A ARG 266.A N PRO 263.A O no hydrogen 3.051 N/A ARG 266.A NE ALA 260.A O no hydrogen 2.795 N/A ARG 266.A NH1 GLU 175.A OE2 no hydrogen 2.657 N/A ARG 266.A NH1 LYS 184.A O no hydrogen 3.059 N/A ARG 266.A NH2 GLU 175.A OE1 no hydrogen 2.847 N/A ARG 266.A NH2 ALA 260.A O no hydrogen 3.337 N/A ARG 266.A NH2 PHE 261.A O no hydrogen 2.882 N/A VAL 271.A N ASP 268.A O no hydrogen 3.113 N/A SER 273.A N GLY 269.A O no hydrogen 2.905 N/A SER 274.A N ALA 270.A O no hydrogen 2.912 N/A SER 274.A OG ALA 270.A O no hydrogen 3.118 N/A LEU 275.A N VAL 271.A O no hydrogen 2.960 N/A LEU 276.A N LEU 272.A O no hydrogen 2.772 N/A LYS 277.A N SER 273.A O no hydrogen 3.103 N/A SER 278.A N LEU 275.A O no hydrogen 2.821 N/A SER 278.A OG LEU 275.A O no hydrogen 3.091 N/A