Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8iso_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 4.A OD2 no hydrogen 2.998 N/A ALA 3.A N SER 1.A OG no hydrogen 3.235 N/A ASP 4.A N SER 1.A O no hydrogen 2.884 N/A PHE 5.A N ASP 2.A O no hydrogen 3.002 N/A THR 7.A N ALA 3.A O no hydrogen 3.048 N/A THR 7.A OG1 ALA 3.A O no hydrogen 3.321 N/A LEU 8.A N ASP 4.A O no hydrogen 2.922 N/A GLU 9.A N PHE 5.A O no hydrogen 2.837 N/A LYS 10.A N ALA 6.A O no hydrogen 3.063 N/A THR 11.A N LEU 8.A O no hydrogen 3.065 N/A THR 11.A OG1 LEU 8.A O no hydrogen 2.698 N/A SER 12.A N.A GLU 9.A O no hydrogen 3.058 N/A SER 12.A N.B GLU 9.A O no hydrogen 3.035 N/A SER 12.A OG.A GLY 13.A O no hydrogen 2.753 N/A SER 12.A OG.A SER 238.A OG no hydrogen 2.653 N/A SER 12.A OG.B GLU 9.A O no hydrogen 2.834 N/A SER 12.A OG.B GLY 13.A O no hydrogen 2.879 N/A GLY 13.A N GLU 9.A O no hydrogen 2.927 N/A ARG 15.A N GLN 236.A O no hydrogen 2.920 N/A ARG 15.A NE GLN 236.A OE1 no hydrogen 3.354 N/A ARG 15.A NH1 GLU 35.A OE1 no hydrogen 2.899 N/A ARG 15.A NH1 ARG 36.A O no hydrogen 3.007 N/A ARG 15.A NH2 ARG 36.A O no hydrogen 2.852 N/A ARG 15.A NH2 GLN 236.A OE1 no hydrogen 2.956 N/A LEU 16.A N GLU 9.A OE2 no hydrogen 2.825 N/A GLY 17.A N TYR 234.A O no hydrogen 2.724 N/A VAL 18.A N HIS 31.A O no hydrogen 2.912 N/A CYS 19.A N SER 232.A O no hydrogen 2.974 N/A LEU 20.A N TYR 29.A O no hydrogen 2.773 N/A TRP 21.A N LEU 230.A O no hydrogen 2.879 N/A TRP 21.A NE1 GLN 162.A OE1 no hydrogen 2.819 N/A HIS 22.A N ALA 27.A O no hydrogen 2.940 N/A HIS 22.A ND1 SER 25.A OG no hydrogen 2.725 N/A SER 25.A N HIS 22.A O no hydrogen 3.146 N/A SER 25.A OG HIS 22.A ND1 no hydrogen 2.725 N/A GLY 26.A N HIS 22.A O no hydrogen 2.849 N/A ALA 27.A N SER 25.A OG no hydrogen 3.361 N/A TYR 29.A N LEU 20.A O no hydrogen 2.886 N/A GLY 30.A N ASP 2.A OD2 no hydrogen 3.068 N/A HIS 31.A N VAL 18.A O no hydrogen 2.911 N/A HIS 31.A ND1 LEU 16.A O no hydrogen 2.912 N/A ARG 32.A NE GLU 9.A OE2 no hydrogen 2.678 N/A ARG 32.A NH1 GLU 35.A OE1 no hydrogen 3.408 N/A ARG 32.A NH1 GLU 35.A OE2 no hydrogen 2.838 N/A ARG 32.A NH2 GLU 9.A OE1 no hydrogen 2.966 N/A GLU 35.A N ARG 32.A O no hydrogen 3.164 N/A ARG 36.A NH1 ILE 130.A O no hydrogen 2.829 N/A ARG 36.A NH1 THR 151.A OG1 no hydrogen 2.856 N/A ARG 36.A NH2 ILE 130.A O no hydrogen 2.954 N/A PHE 37.A N THR 152.A O no hydrogen 2.856 N/A MET 39.A N ASP 150.A O no hydrogen 2.920 N/A SER 41.A OG SER 101.A OG no hydrogen 2.929 N/A THR 42.A N MET 39.A O no hydrogen 3.037 N/A THR 42.A OG1 MET 39.A O no hydrogen 2.740 N/A THR 42.A OG1 TYR 234.A OH no hydrogen 2.784 N/A VAL 43.A N CYS 40.A O no hydrogen 3.173 N/A LYS 44.A N SER 41.A O no hydrogen 2.987 N/A LYS 44.A NZ SER 41.A OG no hydrogen 2.784 N/A LYS 44.A NZ SER 101.A O no hydrogen 2.950 N/A LYS 44.A NZ SER 101.A OG no hydrogen 3.061 N/A LYS 44.A NZ ASN 103.A OD1 no hydrogen 2.694 N/A LYS 44.A NZ GLU 137.A OE2 no hydrogen 3.342 N/A PHE 45.A N THR 42.A O no hydrogen 3.082 N/A LEU 47.A N VAL 43.A O no hydrogen 3.130 N/A ALA 48.A N LYS 44.A O no hydrogen 3.043 N/A ALA 49.A N PHE 45.A O no hydrogen 3.074 N/A ALA 50.A N PRO 46.A O no hydrogen 2.855 N/A ILE 51.A N LEU 47.A O no hydrogen 2.998 N/A LEU 52.A N ALA 48.A O no hydrogen 2.982 N/A HIS 53.A N ALA 49.A O no hydrogen 2.863 N/A ARG 54.A N ALA 50.A O no hydrogen 2.982 N/A ARG 54.A NH1 ASP 114.A OD2 no hydrogen 2.839 N/A VAL 55.A N ILE 51.A O no hydrogen 2.957 N/A ASP 56.A N LEU 52.A O no hydrogen 2.818 N/A ALA 57.A N HIS 53.A O no hydrogen 3.026 N/A GLY 58.A N VAL 55.A O no hydrogen 2.899 N/A LYS 59.A N ARG 54.A O no hydrogen 3.093 N/A ASP 63.A N SER 61.A OG no hydrogen 3.000 N/A GLN 64.A N SER 61.A O no hydrogen 3.079 N/A GLN 64.A NE2 ARG 65.A O no hydrogen 3.065 N/A ARG 65.A NH1 ASP 87.A OD1 no hydrogen 2.900 N/A VAL 66.A N MET 88.A O no hydrogen 2.840 N/A VAL 68.A N LYS 86.A O no hydrogen 2.923 N/A ARG 69.A N ASP 72.A OD2 no hydrogen 2.842 N/A ARG 69.A NH2 VAL 68.A O no hydrogen 2.827 N/A ARG 69.A NH2 LYS 86.A O no hydrogen 3.197 N/A ASP 72.A N ARG 69.A O no hydrogen 2.906 N/A ILE 73.A N GLN 70.A O no hydrogen 3.021 N/A HIS 76.A NE2 ILE 100.A O no hydrogen 2.680 N/A SER 77.A OG ILE 74.A O no hydrogen 2.775 N/A PHE 79.A N ASP 102.A OD2 no hydrogen 2.858 N/A THR 80.A N ASP 102.A OD2 no hydrogen 2.940 N/A THR 80.A OG1 SER 77.A O no hydrogen 3.432 N/A THR 80.A OG1 ASP 102.A OD1 no hydrogen 2.823 N/A THR 80.A OG1 ASP 102.A OD2 no hydrogen 3.294 N/A GLU 81.A N SER 77.A O no hydrogen 3.028 N/A ARG 82.A N PHE 79.A O no hydrogen 3.032 N/A HIS 83.A N THR 80.A O no hydrogen 2.990 N/A GLY 85.A N VAL 68.A O no hydrogen 2.823 N/A LYS 86.A N HIS 83.A O no hydrogen 2.985 N/A LYS 86.A NZ HIS 83.A ND1 no hydrogen 2.850 N/A LYS 86.A NZ ASP 87.A O no hydrogen 2.824 N/A MET 88.A N VAL 66.A O no hydrogen 3.000 N/A VAL 90.A N GLN 64.A O no hydrogen 2.866 N/A ARG 91.A N LEU 62.A O no hydrogen 2.964 N/A ARG 91.A NH1 ASP 63.A OD1 no hydrogen 2.882 N/A ARG 91.A NH2 ASP 63.A OD1 no hydrogen 3.504 N/A ARG 91.A NH2 ASP 63.A OD2 no hydrogen 2.990 N/A ASP 92.A N THR 89.A OG1 no hydrogen 2.975 N/A LEU 93.A N THR 89.A O no hydrogen 2.931 N/A CYS 94.A N VAL 90.A O no hydrogen 2.915 N/A CYS 94.A SG VAL 90.A O no hydrogen 3.509 N/A ARG 95.A N ARG 91.A O no hydrogen 3.030 N/A ARG 95.A NH2 ASP 184.A OD2 no hydrogen 2.845 N/A ALA 96.A N ASP 92.A O no hydrogen 2.962 N/A THR 97.A N LEU 93.A O no hydrogen 2.951 N/A THR 97.A OG1 ASP 102.A O no hydrogen 2.964 N/A LEU 98.A N CYS 94.A O no hydrogen 3.059 N/A ILE 99.A N ARG 95.A O no hydrogen 2.873 N/A ILE 100.A N ALA 96.A O no hydrogen 3.362 N/A ASP 102.A N ALA 96.A O no hydrogen 3.189 N/A ASN 103.A N HIS 76.A O no hydrogen 2.965 N/A ASN 103.A ND2 SER 75.A O no hydrogen 2.943 N/A ASN 103.A ND2 HIS 76.A O no hydrogen 3.247 N/A ALA 104.A N SER 77.A OG no hydrogen 2.967 N/A ALA 105.A N ASP 102.A OD1 no hydrogen 2.944 N/A ALA 106.A N ASP 102.A O no hydrogen 3.403 N/A ASN 107.A N ASN 103.A O no hydrogen 3.129 N/A ASN 107.A ND2 GLU 137.A O no hydrogen 2.954 N/A LEU 108.A N ALA 104.A O no hydrogen 2.885 N/A LEU 109.A N ALA 105.A O no hydrogen 3.008 N/A LEU 109.A N ALA 106.A O no hydrogen 3.167 N/A LEU 110.A N ALA 106.A O no hydrogen 2.946 N/A LEU 112.A N LEU 109.A O no hydrogen 2.920 N/A ILE 113.A N LEU 110.A O no hydrogen 3.081 N/A ASP 114.A N PRO 111.A O no hydrogen 3.166 N/A GLY 115.A N LEU 110.A O no hydrogen 2.843 N/A GLY 118.A N ASP 114.A O no hydrogen 3.046 N/A LEU 119.A N GLY 115.A O no hydrogen 2.863 N/A THR 120.A N PRO 116.A O no hydrogen 2.924 N/A THR 120.A OG1 PRO 116.A O no hydrogen 3.064 N/A THR 120.A OG1 SER 133.A O no hydrogen 2.855 N/A ALA 121.A N ALA 117.A O no hydrogen 2.929 N/A PHE 122.A N GLY 118.A O no hydrogen 2.950 N/A LEU 123.A N LEU 119.A O no hydrogen 2.967 N/A GLN 124.A N THR 120.A O no hydrogen 2.892 N/A ALA 125.A N ALA 121.A O no hydrogen 2.906 N/A GLN 126.A N PHE 122.A O no hydrogen 3.042 N/A GLN 126.A N LEU 123.A O no hydrogen 3.186 N/A GLY 127.A N GLN 124.A O no hydrogen 3.037 N/A ASP 128.A N LEU 123.A O no hydrogen 2.862 N/A ILE 130.A N ASP 128.A OD1 no hydrogen 2.930 N/A THR 131.A N ASP 128.A OD1 no hydrogen 2.984 N/A THR 131.A OG1 ASP 128.A OD1 no hydrogen 3.381 N/A THR 131.A OG1 ASP 128.A OD2 no hydrogen 2.579 N/A THR 131.A OG1 THR 152.A OG1 no hydrogen 2.724 N/A VAL 132.A N THR 151.A O no hydrogen 3.026 N/A SER 133.A N THR 120.A OG1 no hydrogen 2.839 N/A ALA 134.A N ASP 150.A OD1 no hydrogen 2.821 N/A ARG 135.A N ASP 150.A OD1 no hydrogen 3.021 N/A ARG 135.A NE ASP 150.A OD2 no hydrogen 2.720 N/A ARG 135.A NH2 ASP 150.A OD2 no hydrogen 2.984 N/A GLU 137.A N ASN 107.A OD1 no hydrogen 2.875 N/A LEU 140.A N ASN 136.A O no hydrogen 2.975 N/A ASN 141.A N PRO 138.A O no hydrogen 3.115 N/A ASN 141.A ND2 GLU 137.A OE1 no hydrogen 2.872 N/A ASN 141.A ND2 PRO 138.A O no hydrogen 2.865 N/A HIS 142.A N GLU 139.A O no hydrogen 3.042 N/A ASP 147.A N ALA 144.A O no hydrogen 2.963 N/A ARG 149.A N ASP 147.A OD1 no hydrogen 3.113 N/A ARG 149.A NE ASP 147.A OD1 no hydrogen 3.060 N/A ARG 149.A NE ASP 147.A OD2 no hydrogen 3.306 N/A ARG 149.A NH2 ASP 147.A OD2 no hydrogen 2.818 N/A THR 151.A N PRO 148.A O no hydrogen 3.246 N/A THR 151.A OG1 PRO 148.A O no hydrogen 2.663 N/A THR 152.A N PHE 37.A O no hydrogen 2.957 N/A THR 152.A OG1 THR 131.A OG1 no hydrogen 2.724 N/A THR 152.A OG1 SER 153.A O no hydrogen 3.460 N/A SER 153.A OG MET 33.A O no hydrogen 3.522 N/A ALA 155.A N MET 33.A O no hydrogen 2.998 N/A ALA 156.A N SER 153.A OG no hydrogen 2.974 N/A MET 157.A N SER 153.A O no hydrogen 3.007 N/A ALA 158.A N PRO 154.A O no hydrogen 2.942 N/A GLY 159.A N ALA 155.A O no hydrogen 2.885 N/A ASN 160.A N ALA 156.A O no hydrogen 2.891 N/A ASN 160.A ND2 ASP 128.A OD2 no hydrogen 2.834 N/A LEU 161.A N MET 157.A O no hydrogen 2.948 N/A GLN 162.A N ALA 158.A O no hydrogen 3.084 N/A ARG 163.A N GLY 159.A O no hydrogen 2.816 N/A ARG 163.A NE GLN 126.A O no hydrogen 3.025 N/A ARG 163.A NH1 ASN 160.A OD1 no hydrogen 2.905 N/A PHE 164.A N ASN 160.A O no hydrogen 2.948 N/A LEU 165.A N LEU 161.A O no hydrogen 2.994 N/A LEU 166.A N GLN 162.A O no hydrogen 2.878 N/A GLY 167.A N GLN 162.A O no hydrogen 2.895 N/A SER 171.A N ASP 56.A OD2 no hydrogen 2.824 N/A SER 171.A OG ASP 56.A OD1 no hydrogen 2.979 N/A SER 171.A OG ASP 56.A OD2 no hydrogen 3.564 N/A SER 171.A OG SER 174.A OG no hydrogen 3.269 N/A SER 174.A N SER 171.A OG no hydrogen 3.090 N/A SER 174.A OG ASP 56.A OD1 no hydrogen 2.738 N/A SER 174.A OG SER 171.A OG no hydrogen 3.269 N/A ARG 175.A N SER 171.A O no hydrogen 2.799 N/A ARG 175.A NH2 GLY 167.A O no hydrogen 3.003 N/A ARG 175.A NH2 ASP 168.A OD1.B no hydrogen 3.021 N/A GLN 176.A N PRO 172.A O no hydrogen 3.009 N/A GLN 176.A NE2 GLN 176.A O no hydrogen 3.349 N/A GLN 176.A NE2 ASP 180.A OD1 no hydrogen 2.941 N/A GLN 177.A N ALA 173.A O no hydrogen 2.967 N/A GLN 177.A NE2 GLN 177.A O no hydrogen 3.212 N/A LEU 178.A N SER 174.A O no hydrogen 2.954 N/A ALA 179.A N ARG 175.A O no hydrogen 3.005 N/A ASP 180.A N GLN 176.A O no hydrogen 2.891 N/A TRP 181.A N GLN 177.A O no hydrogen 2.984 N/A LEU 182.A N LEU 178.A O no hydrogen 3.097 N/A ILE 183.A N ALA 179.A O no hydrogen 2.805 N/A ASP 184.A N ASP 180.A O no hydrogen 2.940 N/A ASN 185.A N LEU 182.A O no hydrogen 3.163 N/A ASN 185.A ND2 THR 187.A OG1 no hydrogen 3.139 N/A ASN 185.A ND2 ASP 204.A OD1 no hydrogen 2.974 N/A GLN 186.A N ILE 99.A O no hydrogen 2.850 N/A GLN 186.A NE2 ASP 184.A O no hydrogen 2.887 N/A THR 187.A OG1 ASN 185.A OD1 no hydrogen 3.291 N/A THR 187.A OG1 THR 206.A OG1 no hydrogen 2.610 N/A ARG 191.A N GLY 188.A O no hydrogen 3.116 N/A ARG 191.A NE ASP 246.A OD1 no hydrogen 2.835 N/A ARG 191.A NH1 THR 187.A O no hydrogen 2.873 N/A LEU 192.A N ASP 216.A OD2 no hydrogen 3.143 N/A ARG 193.A NE ASP 204.A OD1 no hydrogen 2.887 N/A ARG 193.A NH2 ILE 183.A O no hydrogen 3.398 N/A ARG 193.A NH2 ASP 204.A OD1 no hydrogen 2.989 N/A ALA 194.A N ARG 191.A O no hydrogen 2.958 N/A GLY 195.A N LEU 192.A O no hydrogen 3.002 N/A LEU 196.A N LEU 192.A O no hydrogen 3.129 N/A ARG 201.A N TRP 221.A O no hydrogen 2.764 N/A GLY 203.A N ALA 219.A O no hydrogen 3.036 N/A ASP 204.A N LEU 182.A O no hydrogen 3.082 N/A LYS 205.A N ILE 217.A O no hydrogen 2.895 N/A LYS 205.A NZ SER 101.A OG no hydrogen 3.050 N/A LYS 205.A NZ THR 206.A O no hydrogen 2.836 N/A THR 206.A OG1 THR 187.A OG1 no hydrogen 2.610 N/A GLY 207.A N ASN 215.A O no hydrogen 2.929 N/A SER 208.A OG THR 213.A O no hydrogen 3.333 N/A SER 208.A OG ASP 242.A OD2 no hydrogen 2.681 N/A ASN 209.A N THR 213.A O no hydrogen 3.093 N/A ASN 209.A ND2 ASP 212.A OD1 no hydrogen 2.860 N/A GLY 210.A N SER 208.A OG no hydrogen 2.920 N/A GLN 211.A N ASN 209.A OD1 no hydrogen 2.930 N/A ASP 212.A N ASN 209.A OD1 no hydrogen 2.904 N/A THR 213.A N ASN 209.A OD1 no hydrogen 3.072 N/A THR 213.A OG1 ASP 212.A OD1 no hydrogen 2.893 N/A SER 214.A N LEU 235.A O no hydrogen 2.945 N/A ASN 215.A N GLY 207.A O no hydrogen 2.778 N/A ASN 215.A ND2 PRO 38.A O no hydrogen 3.017 N/A ASN 215.A ND2 MET 39.A O no hydrogen 3.031 N/A ASP 216.A N CYS 233.A O no hydrogen 2.826 N/A ILE 217.A N LYS 205.A O no hydrogen 2.988 N/A ALA 218.A N LEU 231.A O no hydrogen 2.789 N/A ALA 219.A N GLY 203.A O no hydrogen 2.863 N/A LEU 220.A N TRP 229.A O no hydrogen 2.830 N/A TRP 221.A N ARG 201.A O no hydrogen 2.869 N/A LEU 223.A N GLY 199.A O no hydrogen 2.922 N/A GLY 225.A N PRO 222.A O no hydrogen 3.065 N/A TRP 229.A N LEU 220.A O no hydrogen 2.925 N/A LEU 230.A N TRP 21.A O no hydrogen 2.893 N/A LEU 231.A N ALA 218.A O no hydrogen 2.856 N/A SER 232.A N CYS 19.A O no hydrogen 2.868 N/A SER 232.A OG CYS 19.A O no hydrogen 3.508 N/A SER 232.A OG PRO 154.A O no hydrogen 2.692 N/A CYS 233.A N ASP 216.A O no hydrogen 2.901 N/A TYR 234.A N GLY 17.A O no hydrogen 2.800 N/A TYR 234.A OH THR 42.A OG1 no hydrogen 2.784 N/A LEU 235.A N SER 214.A O no hydrogen 2.945 N/A LEU 235.A N ASN 215.A OD1 no hydrogen 3.385 N/A GLN 236.A N ARG 15.A O no hydrogen 2.944 N/A GLY 237.A N THR 213.A OG1 no hydrogen 3.405 N/A SER 238.A N ASP 212.A O no hydrogen 2.864 N/A SER 238.A OG SER 12.A O.A no hydrogen 3.102 N/A SER 238.A OG SER 12.A O.B no hydrogen 2.759 N/A SER 238.A OG SER 12.A OG.A no hydrogen 2.653 N/A ALA 239.A N SER 12.A O.A no hydrogen 2.988 N/A ALA 239.A N SER 12.A O.B no hydrogen 2.982 N/A LEU 240.A N SER 238.A OG no hydrogen 2.958 N/A GLY 244.A N ASP 241.A OD1 no hydrogen 2.949 N/A ARG 245.A N ASP 241.A O no hydrogen 2.763 N/A ARG 245.A NE SER 214.A OG no hydrogen 2.781 N/A ARG 245.A NH1 LEU 240.A O no hydrogen 2.842 N/A ARG 245.A NH2 SER 208.A OG no hydrogen 3.133 N/A ARG 245.A NH2 THR 213.A O no hydrogen 3.305 N/A ARG 245.A NH2 SER 214.A OG no hydrogen 3.222 N/A ARG 245.A NH2 ASP 242.A OD1 no hydrogen 3.009 N/A ASP 246.A N ASP 242.A O no hydrogen 2.883 N/A GLY 247.A N ASP 243.A O no hydrogen 3.109 N/A ILE 248.A N GLY 244.A O no hydrogen 3.094 N/A LEU 249.A N ARG 245.A O no hydrogen 2.947 N/A ARG 250.A N.A ASP 246.A O no hydrogen 2.806 N/A ARG 250.A N.B ASP 246.A O no hydrogen 2.813 N/A ARG 250.A NH1.A ALA 190.A O no hydrogen 2.931 N/A ARG 250.A NH2.B GLU 254.A OE2 no hydrogen 2.963 N/A GLN 251.A N GLY 247.A O no hydrogen 2.936 N/A VAL 252.A N ILE 248.A O no hydrogen 2.852 N/A GLY 253.A N LEU 249.A O no hydrogen 2.994 N/A GLU 254.A N ARG 250.A O.A no hydrogen 2.907 N/A GLU 254.A N ARG 250.A O.B no hydrogen 2.965 N/A LEU 255.A N GLN 251.A O no hydrogen 2.859 N/A ALA 256.A N VAL 252.A O no hydrogen 2.830 N/A GLY 257.A N GLY 253.A O no hydrogen 2.871 N/A ALA 258.A N LEU 255.A O no hydrogen 3.217 N/A ARG 259.A N ALA 256.A O no hydrogen 2.866 N/A LEU 260.A N GLY 257.A O no hydrogen 3.076 N/A