Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8a2b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N LEU 77.A O no hydrogen 3.162 N/A LEU 6.A N ILE 79.A O no hydrogen 2.721 N/A LYS 7.A N GLU 10.A OE1 no hydrogen 2.835 N/A GLU 10.A N LYS 7.A O no hydrogen 2.879 N/A LYS 12.A N LEU 29.A O no hydrogen 3.029 N/A LYS 13.A NZ GLN 86.A OE1 no hydrogen 2.720 N/A ILE 14.A N LYS 27.A O no hydrogen 2.868 N/A LYS 15.A N LYS 27.A O no hydrogen 3.353 N/A LEU 17.A N VAL 25.A O no hydrogen 2.753 N/A GLY 18.A N VAL 25.A O no hydrogen 3.339 N/A GLY 20.A N GLY 23.A O no hydrogen 2.887 N/A THR 24.A N GLU 45.A O no hydrogen 3.089 N/A VAL 25.A N GLY 18.A O no hydrogen 2.898 N/A TYR 26.A N ILE 43.A O no hydrogen 2.741 N/A LYS 27.A N LYS 15.A O no hydrogen 2.812 N/A GLY 28.A N VAL 41.A O no hydrogen 2.729 N/A LEU 29.A N LYS 12.A O no hydrogen 2.973 N/A TRP 30.A N ILE 39.A O no hydrogen 2.832 N/A TRP 30.A NE1 GLU 10.A OE2 no hydrogen 3.357 N/A ILE 31.A N GLU 10.A O no hydrogen 2.983 N/A GLU 33.A N GLU 10.A OE2 no hydrogen 3.326 N/A ILE 39.A N TRP 30.A O no hydrogen 2.677 N/A VAL 41.A N GLY 28.A O no hydrogen 2.994 N/A ALA 42.A N THR 89.A O no hydrogen 2.857 N/A ILE 43.A N TYR 26.A O no hydrogen 2.798 N/A LYS 44.A N LEU 87.A O no hydrogen 2.838 N/A GLU 45.A N THR 24.A O no hydrogen 2.925 N/A LEU 46.A N VAL 85.A O no hydrogen 2.962 N/A ARG 47.A N PHE 22.A O no hydrogen 2.913 N/A ARG 47.A NH1 GLY 20.A O no hydrogen 2.863 N/A ARG 47.A NH2 GLY 20.A O no hydrogen 2.797 N/A ALA 54.A N SER 51.A OG no hydrogen 3.067 N/A ASN 55.A N SER 51.A O no hydrogen 2.857 N/A ASN 55.A ND2 SER 51.A O no hydrogen 3.210 N/A LYS 56.A N PRO 52.A O no hydrogen 3.167 N/A LYS 56.A NZ ASP 60.A OD2 no hydrogen 2.943 N/A GLU 57.A N LYS 53.A O no hydrogen 3.150 N/A ILE 58.A N ALA 54.A O no hydrogen 2.676 N/A LEU 59.A N ASN 55.A O no hydrogen 3.085 N/A ASP 60.A N LYS 56.A O no hydrogen 2.928 N/A GLU 61.A N GLU 57.A O no hydrogen 2.956 N/A ALA 62.A N ILE 58.A O no hydrogen 2.840 N/A TYR 63.A N LEU 59.A O no hydrogen 3.197 N/A VAL 64.A N GLU 61.A O no hydrogen 2.982 N/A MET 65.A N GLU 61.A O no hydrogen 3.092 N/A ALA 66.A N ALA 62.A O no hydrogen 2.942 N/A SER 67.A N VAL 64.A O no hydrogen 3.018 N/A SER 67.A OG VAL 64.A O no hydrogen 2.787 N/A ASP 69.A N TYR 126.A OH no hydrogen 2.823 N/A HIS 72.A N ASN 70.A OD1 no hydrogen 2.920 N/A HIS 72.A ND1 VAL 150.A O no hydrogen 3.005 N/A VAL 73.A N ASN 70.A O no hydrogen 3.226 N/A CYS 74.A N ILE 152.A O no hydrogen 2.852 N/A CYS 74.A SG ILE 152.A O no hydrogen 3.641 N/A ARG 75.A NE ALA 66.A O no hydrogen 2.975 N/A ARG 75.A NH2 LEU 2.A O no hydrogen 2.718 N/A ARG 75.A NH2 ALA 66.A O no hydrogen 3.077 N/A LEU 76.A N MET 65.A O no hydrogen 3.019 N/A LEU 77.A N ILE 88.A O no hydrogen 2.792 N/A GLY 78.A N ILE 88.A O no hydrogen 3.208 N/A ILE 79.A N ARG 4.A O no hydrogen 2.954 N/A CYS 80.A N GLN 86.A O no hydrogen 2.826 N/A CYS 80.A SG LEU 6.A O no hydrogen 3.319 N/A THR 82.A N THR 84.A O no hydrogen 3.027 N/A THR 84.A N THR 82.A OG1 no hydrogen 3.282 N/A THR 84.A OG1 GLU 45.A OE2 no hydrogen 3.117 N/A GLN 86.A N CYS 80.A O no hydrogen 2.969 N/A LEU 87.A N LYS 44.A O no hydrogen 2.733 N/A ILE 88.A N GLY 78.A O no hydrogen 2.874 N/A THR 89.A N ALA 42.A O no hydrogen 3.084 N/A THR 89.A OG1 GLN 90.A O no hydrogen 3.372 N/A LEU 91.A N PRO 40.A O no hydrogen 3.176 N/A GLY 95.A N MET 92.A O no hydrogen 3.028 N/A LEU 97.A N VAL 142.A O no hydrogen 2.653 N/A LEU 98.A N ALA 139.A O no hydrogen 3.205 N/A TYR 100.A N CYS 96.A O no hydrogen 3.097 N/A VAL 101.A N LEU 97.A O no hydrogen 2.958 N/A ARG 102.A N LEU 98.A O no hydrogen 3.091 N/A ARG 102.A NE GLY 193.A O no hydrogen 2.903 N/A ARG 102.A NH2 GLY 193.A O no hydrogen 2.856 N/A GLU 103.A N ASP 99.A O no hydrogen 2.828 N/A HIS 104.A N TYR 100.A O no hydrogen 2.830 N/A LYS 105.A NZ ARG 102.A O no hydrogen 3.521 N/A ASN 107.A N HIS 104.A O no hydrogen 2.848 N/A ILE 108.A N HIS 104.A O no hydrogen 3.128 N/A GLN 111.A NE2 GLN 111.A O no hydrogen 3.480 N/A GLN 111.A NE2 ALA 254.A O no hydrogen 3.098 N/A TYR 112.A OH GLN 148.A OE1 no hydrogen 2.772 N/A LEU 113.A N GLY 109.A O no hydrogen 3.244 N/A LEU 114.A N SER 110.A O no hydrogen 3.092 N/A ASN 115.A N GLN 111.A O no hydrogen 3.019 N/A ASN 115.A ND2 GLN 111.A O no hydrogen 2.544 N/A TRP 116.A N TYR 112.A O no hydrogen 2.875 N/A TRP 116.A NE1 PRO 147.A O no hydrogen 2.692 N/A CYS 117.A N LEU 113.A O no hydrogen 3.128 N/A CYS 117.A SG LEU 113.A O no hydrogen 3.340 N/A VAL 118.A N LEU 114.A O no hydrogen 3.132 N/A GLN 119.A N ASN 115.A O no hydrogen 2.964 N/A GLN 119.A NE2 GLN 148.A O no hydrogen 2.893 N/A ILE 120.A N TRP 116.A O no hydrogen 2.937 N/A ALA 121.A N CYS 117.A O no hydrogen 3.046 N/A LYS 122.A N VAL 118.A O no hydrogen 2.748 N/A GLY 123.A N GLN 119.A O no hydrogen 2.964 N/A MET 124.A N ILE 120.A O no hydrogen 2.944 N/A ASN 125.A N ALA 121.A O no hydrogen 2.817 N/A TYR 126.A N LYS 122.A O no hydrogen 3.065 N/A LEU 127.A N GLY 123.A O no hydrogen 2.937 N/A GLU 128.A N MET 124.A O no hydrogen 2.841 N/A ASP 129.A N ASN 125.A O no hydrogen 2.916 N/A ARG 130.A N TYR 126.A O no hydrogen 2.968 N/A ARG 130.A NH1 SER 67.A O no hydrogen 3.109 N/A ARG 130.A NH1 SER 67.A OG no hydrogen 3.310 N/A ARG 130.A NH1 TYR 126.A OH no hydrogen 3.267 N/A ARG 130.A NH2 SER 67.A OG no hydrogen 2.883 N/A ARG 131.A N GLU 128.A O no hydrogen 2.841 N/A LEU 132.A N LEU 127.A O no hydrogen 2.847 N/A HIS 134.A N ASP 178.A OD2 no hydrogen 2.721 N/A HIS 134.A NE2 THR 153.A O no hydrogen 3.008 N/A ARG 135.A N ASP 178.A OD1 no hydrogen 3.122 N/A ARG 135.A NH2 GLY 156.A O no hydrogen 2.918 N/A ASP 136.A N HIS 134.A ND1 no hydrogen 3.056 N/A ALA 139.A N GLU 188.A OE1 no hydrogen 2.869 N/A ARG 140.A NH1 ASP 136.A OD1 no hydrogen 2.823 N/A ASN 141.A N ALA 138.A O no hydrogen 2.814 N/A ASN 141.A ND2 ASP 136.A O no hydrogen 2.695 N/A ASN 141.A ND2 ASP 136.A OD2 no hydrogen 3.159 N/A VAL 142.A N ALA 139.A O no hydrogen 3.241 N/A LEU 143.A N LYS 151.A O no hydrogen 2.817 N/A VAL 144.A N GLY 95.A O no hydrogen 2.844 N/A LYS 145.A N HIS 149.A O no hydrogen 2.833 N/A THR 146.A N HIS 149.A O no hydrogen 3.280 N/A GLN 148.A N THR 146.A OG1 no hydrogen 3.157 N/A HIS 149.A N THR 146.A O no hydrogen 2.840 N/A HIS 149.A NE2 PRO 71.A O no hydrogen 2.786 N/A VAL 150.A N GLN 119.A OE1 no hydrogen 2.930 N/A LYS 151.A N LEU 143.A O no hydrogen 2.911 N/A ILE 152.A N HIS 72.A O no hydrogen 2.818 N/A THR 153.A N ASN 141.A O no hydrogen 2.914 N/A THR 153.A OG1 ASP 154.A OD1 no hydrogen 3.529 N/A ASP 154.A N THR 153.A OG1 no hydrogen 2.716 N/A GLY 156.A N HIS 134.A O no hydrogen 3.179 N/A ARG 157.A N.A GLU 61.A OE2 no hydrogen 3.302 N/A ARG 157.A N.B GLU 61.A OE2 no hydrogen 3.250 N/A ARG 157.A NH1.A PHE 155.A O no hydrogen 2.949 N/A ARG 157.A NH2.A PHE 155.A O no hydrogen 3.052 N/A ILE 160.A N VAL 158.A O no hydrogen 2.916 N/A LYS 161.A NZ TYR 197.A O no hydrogen 2.946 N/A LYS 161.A NZ ILE 200.A O no hydrogen 2.664 N/A TRP 162.A N PRO 159.A O no hydrogen 2.949 N/A TRP 162.A NE1 GLU 188.A OE1 no hydrogen 2.777 N/A MET 163.A N ILE 160.A O no hydrogen 3.076 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.873 N/A SER 167.A N ALA 164.A O no hydrogen 2.802 N/A SER 167.A OG ILE 172.A O no hydrogen 2.630 N/A ILE 168.A N ALA 164.A O no hydrogen 3.017 N/A LEU 169.A N LEU 165.A O no hydrogen 2.817 N/A HIS 170.A N GLU 166.A O no hydrogen 2.807 N/A ARG 171.A N SER 167.A O no hydrogen 2.934 N/A ILE 172.A N GLU 166.A O no hydrogen 3.417 N/A THR 174.A N SER 177.A OG no hydrogen 2.779 N/A GLN 176.A NE2 ALA 237.A O no hydrogen 3.191 N/A GLN 176.A NE2 ARG 240.A O no hydrogen 3.580 N/A GLN 176.A NE2 PRO 241.A O no hydrogen 3.273 N/A SER 177.A N THR 174.A OG1 no hydrogen 3.088 N/A SER 177.A OG THR 174.A O no hydrogen 2.780 N/A ASP 178.A N THR 174.A O no hydrogen 3.013 N/A VAL 179.A N HIS 175.A O no hydrogen 3.015 N/A SER 181.A N SER 177.A O no hydrogen 3.275 N/A SER 181.A OG TRP 162.A O no hydrogen 2.609 N/A TYR 182.A N ASP 178.A O no hydrogen 2.922 N/A TYR 182.A OH CYS 117.A O no hydrogen 2.729 N/A GLY 183.A N VAL 179.A O no hydrogen 3.162 N/A VAL 184.A N TRP 180.A O no hydrogen 3.153 N/A THR 185.A N SER 181.A O no hydrogen 2.856 N/A THR 185.A OG1 SER 181.A O no hydrogen 2.799 N/A VAL 186.A N TYR 182.A O no hydrogen 2.841 N/A TRP 187.A N GLY 183.A O no hydrogen 3.039 N/A TRP 187.A NE1 PRO 216.A O no hydrogen 2.950 N/A GLU 188.A N VAL 184.A O no hydrogen 2.934 N/A LEU 189.A N THR 185.A O no hydrogen 3.135 N/A MET 190.A N VAL 186.A O no hydrogen 2.975 N/A THR 191.A N TRP 187.A O no hydrogen 3.041 N/A THR 191.A OG1 TRP 187.A O no hydrogen 2.575 N/A THR 191.A OG1 GLU 188.A O no hydrogen 3.148 N/A PHE 192.A N LEU 189.A O no hydrogen 2.772 N/A GLY 193.A N GLU 188.A O no hydrogen 2.645 N/A SER 194.A OG THR 191.A O no hydrogen 3.242 N/A ILE 200.A N TYR 197.A O no hydrogen 3.151 N/A GLU 204.A N PRO 201.A O no hydrogen 2.975 N/A ILE 205.A N ALA 202.A O no hydrogen 2.933 N/A ILE 208.A N GLU 204.A O no hydrogen 3.159 N/A LEU 209.A N ILE 205.A O no hydrogen 2.873 N/A GLU 210.A N SER 206.A O no hydrogen 2.684 N/A LYS 211.A N SER 207.A O no hydrogen 2.757 N/A GLY 212.A N LEU 209.A O no hydrogen 2.770 N/A GLU 213.A N ILE 208.A O no hydrogen 2.965 N/A ARG 214.A NE TRP 233.A O no hydrogen 2.697 N/A ARG 214.A NH1 LEU 209.A O no hydrogen 2.992 N/A ARG 214.A NH1 GLU 213.A O no hydrogen 2.916 N/A ARG 214.A NH2 TRP 233.A O no hydrogen 2.786 N/A GLN 217.A NE2 CYS 221.A O no hydrogen 2.887 N/A CYS 221.A N PRO 218.A O no hydrogen 2.738 N/A THR 222.A N TYR 260.A O no hydrogen 3.141 N/A THR 222.A OG1 ARG 259.A O no hydrogen 3.460 N/A VAL 225.A N THR 222.A O no hydrogen 3.102 N/A TYR 226.A N THR 222.A O no hydrogen 3.298 N/A TYR 226.A OH LEU 215.A O no hydrogen 2.595 N/A MET 227.A N ILE 223.A O no hydrogen 2.944 N/A MET 229.A N VAL 225.A O no hydrogen 3.315 N/A ARG 230.A N TYR 226.A O no hydrogen 2.797 N/A ARG 230.A NH1 TYR 226.A OH no hydrogen 2.900 N/A LYS 231.A N MET 227.A O no hydrogen 2.916 N/A LYS 231.A NZ SER 239.A O no hydrogen 3.532 N/A CYS 232.A N ILE 228.A O no hydrogen 3.180 N/A CYS 232.A N MET 229.A O no hydrogen 2.916 N/A CYS 232.A SG ILE 228.A O no hydrogen 3.389 N/A TRP 233.A N ARG 230.A O no hydrogen 3.037 N/A ASP 238.A N ASP 236.A OD1 no hydrogen 3.321 N/A SER 239.A N ASP 236.A O no hydrogen 2.699 N/A SER 239.A OG ASP 236.A OD2 no hydrogen 2.901 N/A ARG 240.A N ALA 237.A O no hydrogen 3.342 N/A ARG 240.A NE MET 234.A O no hydrogen 2.743 N/A ARG 240.A NH1 GLU 166.A OE2 no hydrogen 2.857 N/A ARG 240.A NH1 GLN 176.A O no hydrogen 2.905 N/A ARG 240.A NH2 GLU 166.A OE1 no hydrogen 2.768 N/A ARG 240.A NH2 MET 234.A O no hydrogen 2.933 N/A LYS 242.A N GLU 245.A OE1 no hydrogen 3.255 N/A GLU 245.A N LYS 242.A O no hydrogen 2.817 N/A LEU 246.A N LYS 242.A O no hydrogen 2.907 N/A ILE 247.A N PHE 243.A O no hydrogen 2.896 N/A ILE 248.A N ARG 244.A O no hydrogen 3.398 N/A GLU 249.A N GLU 245.A O no hydrogen 2.974 N/A PHE 250.A N LEU 246.A O no hydrogen 2.977 N/A SER 251.A N ILE 247.A O no hydrogen 2.740 N/A SER 251.A OG ILE 247.A O no hydrogen 2.755 N/A LYS 252.A N ILE 248.A O no hydrogen 2.965 N/A MET 253.A N GLU 249.A O no hydrogen 3.124 N/A ALA 254.A N PHE 250.A O no hydrogen 2.874 N/A ARG 255.A N SER 251.A O no hydrogen 3.338 N/A ARG 255.A N LYS 252.A O no hydrogen 3.184 N/A ASP 256.A N MET 253.A O no hydrogen 2.811 N/A ARG 259.A N ASP 256.A O no hydrogen 3.155 N/A TYR 260.A N PRO 257.A O no hydrogen 2.988 N/A LEU 261.A N PRO 257.A O no hydrogen 2.912 N/A VAL 262.A N ILE 220.A O no hydrogen 2.896 N/A ARG 268.A N ASP 266.A OD1 no hydrogen 3.238 N/A ARG 268.A NE ASP 266.A OD1 no hydrogen 3.143 N/A ARG 268.A NH1 ASP 266.A OD2 no hydrogen 3.100 N/A MET 269.A N ASP 266.A O no hydrogen 2.886 N/A HIS 270.A N GLU 267.A O no hydrogen 3.087 N/A