Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4obt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 227.A OD1 no hydrogen 2.907 N/A ARG 2.A NH1 ALA 202.A O no hydrogen 2.920 N/A LYS 3.A NZ GLN 34.A O no hydrogen 2.942 N/A PHE 5.A N ASP 227.A O no hydrogen 2.927 N/A VAL 6.A N GLU 38.A O no hydrogen 2.867 N/A GLY 7.A N PHE 229.A O no hydrogen 2.868 N/A GLY 8.A N VAL 40.A O no hydrogen 2.773 N/A ASN 9.A N VAL 231.A O no hydrogen 2.779 N/A TRP 10.A N SER 42.A O no hydrogen 3.089 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 2.932 N/A LYS 11.A NZ GLU 97.A OE2 no hydrogen 2.764 N/A ASN 13.A ND2 TRP 10.A O no hydrogen 2.908 N/A GLU 18.A N.A THR 15.A OG1 no hydrogen 3.137 N/A GLU 18.A N.B THR 15.A OG1 no hydrogen 3.125 N/A VAL 19.A N THR 15.A O no hydrogen 2.825 N/A LYS 20.A N ALA 16.A O no hydrogen 3.031 N/A LYS 21.A N GLU 17.A O no hydrogen 3.141 N/A ILE 22.A N GLU 18.A O.A no hydrogen 2.912 N/A ILE 22.A N GLU 18.A O.B no hydrogen 2.899 N/A VAL 23.A N VAL 19.A O no hydrogen 2.864 N/A ASN 24.A N.A LYS 20.A O no hydrogen 2.947 N/A ASN 24.A N.B LYS 20.A O no hydrogen 2.954 N/A ASN 24.A ND2.B GLU 28.A OE2 no hydrogen 3.114 N/A THR 25.A N LYS 21.A O no hydrogen 3.083 N/A THR 25.A OG1 LYS 21.A O no hydrogen 3.110 N/A LEU 26.A N ILE 22.A O no hydrogen 2.999 N/A ASN 27.A N VAL 23.A O no hydrogen 2.799 N/A ASN 27.A ND2 THR 54.A O no hydrogen 2.939 N/A GLU 28.A N ASN 24.A O.A no hydrogen 3.100 N/A GLU 28.A N ASN 24.A O.B no hydrogen 3.120 N/A GLU 28.A N THR 25.A O no hydrogen 3.348 N/A ALA 29.A N LEU 26.A O no hydrogen 3.063 N/A ASP 35.A N SER 33.A OG no hydrogen 3.098 N/A VAL 36.A N SER 33.A O no hydrogen 2.891 N/A VAL 37.A N SER 33.A O no hydrogen 3.012 N/A GLU 38.A N PHE 4.A O no hydrogen 2.867 N/A VAL 40.A N VAL 6.A O no hydrogen 2.962 N/A VAL 41.A N PHE 60.A O no hydrogen 2.747 N/A SER 42.A N GLY 8.A O no hydrogen 2.784 N/A SER 42.A OG ALA 62.A O no hydrogen 2.806 N/A PHE 47.A N PRO 44.A O no hydrogen 2.966 N/A LEU 48.A N TYR 45.A O no hydrogen 3.076 N/A VAL 51.A N PHE 47.A O no hydrogen 2.939 N/A LYS 52.A N LEU 48.A O no hydrogen 2.842 N/A LYS 52.A NZ ASP 87.A O.A no hydrogen 2.874 N/A LYS 52.A NZ ASP 87.A O.B no hydrogen 2.826 N/A LYS 52.A NZ ASP 87.A OD2.B no hydrogen 2.842 N/A SER 53.A N PRO 49.A O no hydrogen 2.967 N/A SER 53.A OG PRO 49.A O no hydrogen 3.223 N/A SER 53.A OG LEU 50.A O no hydrogen 3.005 N/A THR 54.A N LEU 50.A O no hydrogen 3.191 N/A THR 54.A N VAL 51.A O no hydrogen 3.186 N/A THR 54.A OG1 LEU 50.A O no hydrogen 2.746 N/A LEU 55.A N VAL 51.A O no hydrogen 2.875 N/A ARG 56.A N ASN 27.A OD1 no hydrogen 2.818 N/A ARG 56.A NE ASP 58.A OD1 no hydrogen 2.788 N/A ARG 56.A NH1 LEU 26.A O no hydrogen 2.916 N/A ARG 56.A NH1 ALA 29.A O no hydrogen 2.892 N/A ARG 56.A NH2 ASP 58.A OD2 no hydrogen 2.922 N/A PHE 59.A N ARG 56.A O no hydrogen 3.107 N/A PHE 60.A N VAL 39.A O no hydrogen 2.858 N/A ALA 62.A N VAL 41.A O no hydrogen 2.889 N/A ALA 63.A N TRP 90.A O no hydrogen 2.967 N/A GLN 64.A NE2 LYS 11.A O no hydrogen 2.956 N/A GLN 64.A NE2 SER 42.A O no hydrogen 2.918 N/A CYS 66.A SG TRP 67.A O no hydrogen 3.661 N/A TRP 67.A N VAL 78.A O no hydrogen 2.854 N/A GLY 71.A N GLU 81.A OE2 no hydrogen 2.896 N/A PHE 74.A N GLY 72.A O no hydrogen 2.855 N/A GLU 77.A N PHE 74.A O no hydrogen 3.006 N/A GLU 81.A N GLU 81.A OE1 no hydrogen 2.804 N/A MET 82.A N.A SER 79.A OG no hydrogen 3.307 N/A MET 82.A N.B SER 79.A O no hydrogen 3.040 N/A MET 82.A N.B SER 79.A OG no hydrogen 3.314 N/A LEU 83.A N SER 79.A O no hydrogen 3.296 N/A VAL 84.A N ALA 80.A O no hydrogen 2.985 N/A ASN 85.A N GLU 81.A O no hydrogen 2.927 N/A LEU 86.A N MET 82.A O.A no hydrogen 3.028 N/A LEU 86.A N MET 82.A O.B no hydrogen 3.192 N/A ASP 87.A N.A VAL 84.A O no hydrogen 2.988 N/A ASP 87.A N.B VAL 84.A O no hydrogen 3.001 N/A ILE 88.A N LEU 83.A O no hydrogen 2.939 N/A TRP 90.A N VAL 61.A O no hydrogen 3.307 N/A VAL 91.A N LYS 122.A O no hydrogen 2.925 N/A ILE 92.A N ALA 63.A O no hydrogen 2.856 N/A LEU 93.A N ILE 124.A O no hydrogen 2.875 N/A SER 96.A N GLU 165.A OE1 no hydrogen 2.758 N/A SER 96.A OG GLU 165.A OE1 no hydrogen 3.508 N/A SER 96.A OG GLU 165.A OE2 no hydrogen 2.744 N/A GLU 97.A N HIS 95.A ND1 no hydrogen 3.056 N/A ARG 98.A N HIS 95.A O no hydrogen 2.875 N/A ARG 98.A NE GLU 104.A OE2 no hydrogen 2.972 N/A ARG 99.A N HIS 95.A O no hydrogen 3.013 N/A ARG 99.A NE GLY 94.A O no hydrogen 2.894 N/A ARG 99.A NH1 SER 106.A OG no hydrogen 3.037 N/A ARG 99.A NH2 CYS 126.A O no hydrogen 2.888 N/A ALA 100.A N SER 96.A O no hydrogen 2.904 N/A ILE 101.A N GLU 97.A O no hydrogen 2.819 N/A LEU 102.A N ARG 98.A O no hydrogen 3.154 N/A GLU 104.A N ARG 98.A O no hydrogen 3.085 N/A PHE 108.A N SER 105.A OG no hydrogen 3.020 N/A VAL 109.A N SER 105.A O no hydrogen 2.940 N/A GLY 110.A N SER 106.A O no hydrogen 2.900 N/A ASP 111.A N GLU 107.A O no hydrogen 2.873 N/A LYS 112.A N PHE 108.A O no hydrogen 2.926 N/A LYS 112.A NZ ASN 65.A OD1 no hydrogen 2.875 N/A LYS 112.A NZ CYS 66.A O no hydrogen 3.041 N/A LYS 112.A NZ GLU 104.A OE2 no hydrogen 2.789 N/A VAL 113.A N VAL 109.A O no hydrogen 2.858 N/A ALA 114.A N GLY 110.A O no hydrogen 3.007 N/A TYR 115.A N ASP 111.A O no hydrogen 2.977 N/A TYR 115.A OH GLU 81.A OE1 no hydrogen 2.720 N/A ALA 116.A N LYS 112.A O no hydrogen 2.897 N/A LEU 117.A N VAL 113.A O no hydrogen 2.976 N/A ALA 118.A N ALA 114.A O no hydrogen 2.961 N/A GLN 119.A N TYR 115.A O no hydrogen 3.067 N/A GLN 119.A N ALA 116.A O no hydrogen 3.166 N/A GLY 120.A N LEU 117.A O no hydrogen 3.083 N/A LEU 121.A N ALA 116.A O no hydrogen 3.008 N/A LYS 122.A N PRO 89.A O no hydrogen 2.909 N/A VAL 123.A N ASN 159.A O no hydrogen 2.891 N/A ILE 124.A N VAL 91.A O no hydrogen 2.870 N/A ALA 125.A N VAL 161.A O no hydrogen 2.811 N/A CYS 126.A N LEU 93.A O no hydrogen 2.932 N/A CYS 126.A SG LEU 93.A O no hydrogen 3.754 N/A VAL 127.A N ALA 163.A O no hydrogen 2.945 N/A GLY 128.A N GLN 146.A OE1 no hydrogen 2.776 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.837 N/A THR 130.A N GLU 133.A OE1 no hydrogen 2.883 N/A GLU 133.A N THR 130.A OG1 no hydrogen 3.162 N/A ARG 134.A N THR 130.A O no hydrogen 2.893 N/A ARG 134.A NE GLU 129.A OE2 no hydrogen 2.743 N/A ARG 134.A NH2 GLU 129.A OE2 no hydrogen 2.983 N/A ARG 134.A NH2 TYR 164.A OH no hydrogen 3.520 N/A GLU 135.A N LEU 131.A O no hydrogen 2.853 N/A ALA 136.A N GLU 132.A O no hydrogen 3.069 N/A GLY 137.A N ARG 134.A O no hydrogen 2.878 N/A SER 138.A N GLU 133.A O no hydrogen 2.839 N/A THR 139.A OG1 GLU 129.A OE2 no hydrogen 2.641 N/A VAL 142.A N SER 138.A O no hydrogen 2.802 N/A VAL 143.A N THR 139.A O no hydrogen 2.961 N/A ALA 144.A N MET 140.A O no hydrogen 2.869 N/A ALA 145.A N ASP 141.A O no hydrogen 3.014 N/A GLN 146.A N VAL 142.A O no hydrogen 2.939 N/A GLN 146.A NE2 GLY 128.A O no hydrogen 3.136 N/A THR 147.A N VAL 143.A O no hydrogen 2.905 N/A THR 147.A OG1 VAL 143.A O no hydrogen 2.763 N/A LYS 148.A N ALA 144.A O no hydrogen 2.725 N/A LYS 148.A NZ ASP 152.A OD2 no hydrogen 2.905 N/A ALA 149.A N ALA 145.A O no hydrogen 3.110 N/A ALA 151.A N THR 147.A O no hydrogen 2.792 N/A ASP 152.A N LYS 148.A O no hydrogen 2.817 N/A ARG 153.A N ILE 150.A O no hydrogen 2.919 N/A ARG 153.A NE ASP 111.A OD1 no hydrogen 2.848 N/A ARG 153.A NH1 ALA 149.A O no hydrogen 2.910 N/A VAL 154.A N ALA 151.A O no hydrogen 3.403 N/A SER 158.A N ASN 156.A OD1 no hydrogen 2.957 N/A SER 158.A OG ASN 156.A OD1 no hydrogen 2.989 N/A VAL 160.A N TRP 157.A O no hydrogen 3.094 N/A VAL 161.A N VAL 123.A O no hydrogen 2.879 N/A ILE 162.A N ARG 205.A O no hydrogen 2.946 N/A ALA 163.A N ALA 125.A O no hydrogen 2.789 N/A TYR 164.A N ILE 207.A O no hydrogen 2.890 N/A TYR 164.A OH GLU 129.A OE1 no hydrogen 2.602 N/A TYR 164.A OH GLU 129.A OE2 no hydrogen 3.367 N/A GLU 165.A N VAL 127.A O no hydrogen 2.740 N/A VAL 167.A N GLU 165.A O no hydrogen 2.824 N/A TRP 168.A N GLU 129.A O no hydrogen 3.078 N/A TRP 168.A NE1 TYR 164.A OH no hydrogen 3.005 N/A ALA 169.A N PRO 166.A O no hydrogen 2.831 N/A ILE 170.A N VAL 167.A O no hydrogen 2.898 N/A THR 172.A OG1 TRP 168.A O no hydrogen 2.444 N/A LYS 174.A N THR 172.A OG1 no hydrogen 3.215 N/A SER 177.A N GLN 180.A OE1 no hydrogen 2.875 N/A SER 177.A OG GLN 180.A OE1 no hydrogen 3.408 N/A GLN 180.A N SER 177.A OG no hydrogen 2.901 N/A ALA 181.A N SER 177.A O no hydrogen 3.027 N/A GLN 182.A N PRO 178.A O no hydrogen 2.921 N/A GLN 182.A NE2 ASP 225.A OD2 no hydrogen 2.857 N/A GLU 183.A N ALA 179.A O no hydrogen 2.994 N/A VAL 184.A N GLN 180.A O no hydrogen 3.325 N/A HIS 185.A N ALA 181.A O no hydrogen 2.960 N/A HIS 185.A ND1 ASP 225.A O no hydrogen 3.015 N/A ASP 186.A N GLN 182.A O no hydrogen 2.875 N/A GLU 187.A N GLU 183.A O no hydrogen 2.977 N/A LEU 188.A N VAL 184.A O no hydrogen 2.836 N/A ARG 189.A N HIS 185.A O no hydrogen 2.879 N/A ARG 189.A NE ASP 225.A OD1 no hydrogen 2.800 N/A ARG 189.A NH1 ALA 201.A O no hydrogen 2.839 N/A ARG 189.A NH1 THR 204.A O no hydrogen 2.907 N/A ARG 189.A NH2 ASP 225.A O no hydrogen 3.067 N/A ARG 189.A NH2 ASP 227.A OD2 no hydrogen 2.799 N/A LYS 190.A N ASP 186.A O no hydrogen 2.905 N/A LYS 190.A NZ GLU 187.A OE2 no hydrogen 2.864 N/A TRP 191.A N GLU 187.A O no hydrogen 2.925 N/A LEU 192.A N LEU 188.A O no hydrogen 2.974 N/A ALA 193.A N ARG 189.A O no hydrogen 2.948 N/A LYS 194.A N LYS 190.A O no hydrogen 3.065 N/A ASN 195.A N TRP 191.A O no hydrogen 2.893 N/A ASN 195.A ND2 TRP 191.A O no hydrogen 3.093 N/A VAL 196.A N LEU 192.A O no hydrogen 2.847 N/A SER 197.A N LEU 192.A O no hydrogen 2.964 N/A VAL 200.A N SER 197.A OG no hydrogen 3.009 N/A ALA 201.A N SER 197.A O no hydrogen 3.016 N/A ALA 202.A N ALA 198.A O no hydrogen 2.957 N/A THR 203.A N ASP 199.A O no hydrogen 3.022 N/A THR 203.A N VAL 200.A O no hydrogen 3.330 N/A THR 203.A OG1 ASP 199.A O no hydrogen 2.822 N/A THR 204.A N VAL 200.A O no hydrogen 2.993 N/A THR 204.A OG1 VAL 200.A O no hydrogen 2.655 N/A ARG 205.A NH1 LYS 3.A O no hydrogen 2.927 N/A ARG 205.A NH1 GLU 38.A OE1 no hydrogen 2.945 N/A ARG 205.A NH2 GLU 38.A OE1 no hydrogen 2.870 N/A ILE 206.A N ASP 227.A OD2 no hydrogen 2.833 N/A ILE 207.A N ILE 162.A O no hydrogen 2.763 N/A TYR 208.A N GLY 228.A O no hydrogen 2.838 N/A GLY 209.A N TYR 164.A O no hydrogen 2.763 N/A ASN 213.A N ASN 216.A OD1 no hydrogen 2.856 N/A GLY 214.A N GLU 239.A OE2 no hydrogen 2.475 N/A ASN 216.A N ASN 213.A O no hydrogen 3.290 N/A ASN 216.A N ASN 213.A OD1 no hydrogen 3.117 N/A ASN 216.A ND2 SER 211.A O no hydrogen 2.980 N/A CYS 217.A SG GLY 214.A O no hydrogen 3.580 N/A CYS 217.A SG ASP 242.A O no hydrogen 3.770 N/A LEU 220.A N ASN 216.A O no hydrogen 3.193 N/A GLY 221.A N CYS 217.A O no hydrogen 2.852 N/A GLY 222.A N LYS 218.A O no hydrogen 3.010 N/A GLN 223.A N LEU 220.A O no hydrogen 3.183 N/A GLN 223.A NE2 GLU 219.A O no hydrogen 2.913 N/A ASP 225.A N GLN 182.A OE1 no hydrogen 2.844 N/A VAL 226.A N GLN 223.A O no hydrogen 3.188 N/A ASP 227.A N ILE 206.A O no hydrogen 2.926 N/A PHE 229.A N PHE 5.A O no hydrogen 2.924 N/A LEU 230.A N TYR 208.A O no hydrogen 2.924 N/A VAL 231.A N GLY 7.A O no hydrogen 2.825 N/A SER 235.A N GLY 232.A O no hydrogen 2.813 N/A SER 235.A OG ASN 9.A O no hydrogen 3.198 N/A SER 235.A OG GLY 232.A O no hydrogen 2.674 N/A LEU 236.A N GLY 233.A O no hydrogen 3.162 N/A LYS 237.A N ALA 234.A O no hydrogen 3.002 N/A PHE 240.A N LYS 237.A O no hydrogen 2.986 N/A ILE 241.A N PRO 238.A O no hydrogen 2.972 N/A ILE 243.A N GLU 239.A O no hydrogen 3.162 N/A ILE 244.A N PHE 240.A O no hydrogen 2.977 N/A LYS 245.A N ILE 241.A O no hydrogen 2.980 N/A LYS 245.A NZ GLN 30.A O no hydrogen 2.871 N/A ALA 246.A N ILE 243.A O no hydrogen 3.097 N/A ALA 247.A N ILE 244.A O no hydrogen 3.144 N/A GLU 248.A N LYS 245.A O no hydrogen 3.254 N/A VAL 249.A N ALA 246.A O no hydrogen 2.940 N/A LYS 250.A N ALA 247.A O no hydrogen 3.279 N/A LYS 250.A NZ GLY 221.A O no hydrogen 2.618 N/A LYS 250.A NZ VAL 226.A O no hydrogen 2.573 N/A