Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5x2a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N ASN 1.A O no hydrogen 3.170 N/A LEU 5.A N GLN 2.A O no hydrogen 3.117 N/A ARG 6.A N LEU 79.A O no hydrogen 3.049 N/A LEU 8.A N ILE 81.A O no hydrogen 2.713 N/A LYS 9.A N GLU 12.A OE2 no hydrogen 3.029 N/A GLU 12.A N LYS 9.A O no hydrogen 2.948 N/A LYS 14.A N LEU 31.A O no hydrogen 2.975 N/A LYS 15.A NZ GLN 88.A OE1 no hydrogen 2.957 N/A ILE 16.A N LYS 29.A O no hydrogen 2.762 N/A LYS 17.A N LYS 29.A O no hydrogen 3.348 N/A LEU 19.A N VAL 27.A O no hydrogen 2.819 N/A GLY 20.A N VAL 27.A O no hydrogen 3.456 N/A SER 21.A OG.B GLY 25.A O no hydrogen 3.062 N/A SER 21.A OG.B THR 26.A OG1 no hydrogen 3.358 N/A GLY 22.A N GLY 25.A O no hydrogen 2.910 N/A THR 26.A N GLU 47.A O no hydrogen 3.035 N/A THR 26.A OG1 SER 21.A OG.B no hydrogen 3.358 N/A VAL 27.A N GLY 20.A O no hydrogen 2.975 N/A TYR 28.A N ILE 45.A O no hydrogen 2.710 N/A LYS 29.A N LYS 17.A O no hydrogen 2.892 N/A GLY 30.A N VAL 43.A O no hydrogen 2.991 N/A LEU 31.A N LYS 14.A O no hydrogen 2.840 N/A TRP 32.A N ILE 41.A O no hydrogen 2.778 N/A TRP 32.A NE1 GLU 12.A OE1 no hydrogen 3.188 N/A ILE 33.A N GLU 12.A O no hydrogen 2.875 N/A GLU 37.A N PRO 34.A O no hydrogen 3.043 N/A ILE 41.A N TRP 32.A O no hydrogen 2.891 N/A VAL 43.A N GLY 30.A O no hydrogen 3.003 N/A ALA 44.A N MET 91.A O no hydrogen 2.968 N/A ILE 45.A N TYR 28.A O no hydrogen 2.725 N/A LYS 46.A N LEU 89.A O no hydrogen 2.885 N/A LYS 46.A NZ ASP 156.A OD1 no hydrogen 2.870 N/A LYS 46.A NZ ASP 156.A OD2 no hydrogen 3.129 N/A GLU 47.A N THR 26.A O no hydrogen 2.869 N/A LEU 48.A N VAL 87.A O no hydrogen 2.893 N/A ARG 49.A N PHE 24.A O no hydrogen 3.000 N/A ARG 49.A NH2.B ALA 23.A O no hydrogen 2.432 N/A THR 52.A N SER 85.A O no hydrogen 2.981 N/A THR 52.A OG1 ASN 57.A OD1 no hydrogen 2.625 N/A ALA 56.A N SER 53.A OG no hydrogen 3.275 N/A ASN 57.A N SER 53.A O no hydrogen 2.965 N/A LYS 58.A N LYS 55.A O no hydrogen 3.143 N/A ILE 60.A N ALA 56.A O no hydrogen 3.096 N/A LEU 61.A N ASN 57.A O no hydrogen 3.055 N/A ASP 62.A N LYS 58.A O no hydrogen 3.183 N/A GLU 63.A N GLU 59.A O no hydrogen 3.189 N/A ALA 64.A N ILE 60.A O no hydrogen 2.750 N/A TYR 65.A N LEU 61.A O no hydrogen 2.854 N/A MET 67.A N GLU 63.A O no hydrogen 2.951 N/A ALA 68.A N ALA 64.A O no hydrogen 2.891 N/A SER 69.A N VAL 66.A O no hydrogen 2.909 N/A SER 69.A OG VAL 66.A O no hydrogen 2.651 N/A ASP 71.A N TYR 128.A OH no hydrogen 2.892 N/A HIS 74.A N ASN 72.A OD1 no hydrogen 2.830 N/A HIS 74.A ND1 VAL 152.A O no hydrogen 3.135 N/A VAL 75.A N ASN 72.A O no hydrogen 3.258 N/A CYS 76.A N ILE 154.A O no hydrogen 2.721 N/A CYS 76.A SG ILE 154.A O no hydrogen 3.552 N/A ARG 77.A NH1 LEU 4.A O no hydrogen 2.797 N/A ARG 77.A NH1 ALA 68.A O no hydrogen 2.916 N/A LEU 78.A N MET 67.A O no hydrogen 3.331 N/A LEU 79.A N ILE 90.A O no hydrogen 3.090 N/A GLY 80.A N ILE 90.A O no hydrogen 3.264 N/A ILE 81.A N ARG 6.A O no hydrogen 2.945 N/A CYS 82.A N GLN 88.A O no hydrogen 2.983 N/A CYS 82.A SG LEU 8.A O no hydrogen 3.482 N/A THR 84.A OG1 CYS 82.A O no hydrogen 3.470 N/A THR 84.A OG1 THR 86.A O no hydrogen 2.301 N/A THR 86.A OG1 LEU 48.A O no hydrogen 3.331 N/A GLN 88.A N CYS 82.A O no hydrogen 3.007 N/A GLN 88.A NE2 THR 84.A OG1 no hydrogen 3.082 N/A LEU 89.A N LYS 46.A O no hydrogen 2.766 N/A ILE 90.A N GLY 80.A O no hydrogen 2.865 N/A MET 91.A N ALA 44.A O no hydrogen 2.922 N/A GLY 97.A N MET 94.A O no hydrogen 3.008 N/A LEU 99.A N VAL 144.A O no hydrogen 2.740 N/A LEU 100.A N ALA 141.A O no hydrogen 3.339 N/A TYR 102.A N CYS 98.A O no hydrogen 3.050 N/A VAL 103.A N LEU 99.A O no hydrogen 2.923 N/A ARG 104.A N LEU 100.A O no hydrogen 3.118 N/A ARG 104.A NE GLY 199.A O no hydrogen 2.893 N/A ARG 104.A NH2 GLY 199.A O no hydrogen 3.057 N/A GLU 105.A N ASP 101.A O no hydrogen 2.856 N/A HIS 106.A N TYR 102.A O no hydrogen 2.890 N/A ASN 109.A N HIS 106.A O no hydrogen 2.841 N/A SER 112.A N ASP 272.A OD1 no hydrogen 3.077 N/A SER 112.A OG ASP 272.A OD1 no hydrogen 3.485 N/A SER 112.A OG ASP 272.A OD2 no hydrogen 2.747 N/A TYR 114.A N GLY 111.A O no hydrogen 3.196 N/A TYR 114.A OH GLN 150.A OE1 no hydrogen 2.793 N/A LEU 115.A N GLY 111.A O no hydrogen 3.346 N/A LEU 116.A N SER 112.A O no hydrogen 2.946 N/A ASN 117.A N GLN 113.A O no hydrogen 2.986 N/A TRP 118.A N TYR 114.A O no hydrogen 2.897 N/A TRP 118.A NE1 PRO 149.A O no hydrogen 3.035 N/A CYS 119.A N LEU 115.A O no hydrogen 3.212 N/A CYS 119.A SG LEU 115.A O no hydrogen 3.463 N/A VAL 120.A N LEU 116.A O no hydrogen 3.096 N/A GLN 121.A N ASN 117.A O no hydrogen 2.925 N/A GLN 121.A NE2 GLN 150.A O no hydrogen 2.883 N/A ILE 122.A N TRP 118.A O no hydrogen 2.891 N/A ALA 123.A N CYS 119.A O no hydrogen 3.187 N/A LYS 124.A N VAL 120.A O no hydrogen 2.927 N/A GLY 125.A N GLN 121.A O no hydrogen 3.019 N/A MET 126.A N ILE 122.A O no hydrogen 2.982 N/A ASN 127.A N ALA 123.A O no hydrogen 2.830 N/A TYR 128.A N LYS 124.A O no hydrogen 2.946 N/A LEU 129.A N GLY 125.A O no hydrogen 3.109 N/A GLU 130.A N MET 126.A O no hydrogen 2.861 N/A ASP 131.A N ASN 127.A O no hydrogen 2.803 N/A ARG 132.A N TYR 128.A O no hydrogen 3.092 N/A ARG 132.A NH1 SER 69.A OG no hydrogen 3.007 N/A ARG 132.A NH1 TYR 128.A OH no hydrogen 3.219 N/A ARG 132.A NH2 SER 69.A OG no hydrogen 2.864 N/A ARG 133.A N GLU 130.A O no hydrogen 2.764 N/A LEU 134.A N LEU 129.A O no hydrogen 2.896 N/A HIS 136.A N ASP 184.A OD2 no hydrogen 2.788 N/A HIS 136.A NE2 THR 155.A O no hydrogen 2.752 N/A ARG 137.A N ASP 184.A OD1 no hydrogen 2.927 N/A ASP 138.A N HIS 136.A ND1 no hydrogen 2.900 N/A ALA 141.A N GLU 194.A OE2 no hydrogen 2.832 N/A ARG 142.A NH1 ASP 138.A OD1 no hydrogen 2.981 N/A ASN 143.A N ALA 140.A O no hydrogen 2.823 N/A ASN 143.A ND2 ASP 138.A O no hydrogen 2.792 N/A ASN 143.A ND2 ASP 138.A OD2 no hydrogen 2.996 N/A VAL 144.A N ALA 141.A O no hydrogen 3.284 N/A LEU 145.A N LYS 153.A O no hydrogen 2.741 N/A VAL 146.A N GLY 97.A O no hydrogen 2.837 N/A LYS 147.A N HIS 151.A O no hydrogen 2.927 N/A LYS 147.A NZ ASP 291.A OD2 no hydrogen 2.896 N/A LYS 147.A NZ GLU 293.A OE1 no hydrogen 2.801 N/A THR 148.A N HIS 151.A O no hydrogen 3.338 N/A GLN 150.A N THR 148.A OG1 no hydrogen 3.084 N/A HIS 151.A N THR 148.A O no hydrogen 2.857 N/A HIS 151.A ND1 ASP 291.A OD1 no hydrogen 2.549 N/A HIS 151.A NE2 PRO 73.A O no hydrogen 2.625 N/A VAL 152.A N GLN 121.A OE1 no hydrogen 2.887 N/A LYS 153.A N LEU 145.A O no hydrogen 2.974 N/A LYS 153.A NZ GLU 293.A OE1 no hydrogen 3.139 N/A ILE 154.A N HIS 74.A O no hydrogen 2.816 N/A THR 155.A N ASN 143.A O no hydrogen 2.873 N/A LEU 159.A N ASP 156.A O no hydrogen 3.326 N/A LYS 161.A NZ GLU 63.A OE2 no hydrogen 3.404 N/A LEU 162.A N GLY 158.A O no hydrogen 3.004 N/A LEU 163.A N LEU 159.A O no hydrogen 2.804 N/A LYS 167.A NZ TYR 203.A O no hydrogen 3.242 N/A LYS 167.A NZ ILE 206.A O no hydrogen 2.730 N/A TRP 168.A N PRO 165.A O no hydrogen 3.034 N/A TRP 168.A NE1 GLU 194.A OE2 no hydrogen 2.840 N/A MET 169.A N ILE 166.A O no hydrogen 3.118 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.811 N/A SER 173.A N ALA 170.A O no hydrogen 2.784 N/A SER 173.A OG ILE 178.A O no hydrogen 2.695 N/A ILE 174.A N ALA 170.A O no hydrogen 2.953 N/A LEU 175.A N LEU 171.A O no hydrogen 2.815 N/A HIS 176.A N GLU 172.A O no hydrogen 2.847 N/A ARG 177.A N SER 173.A O no hydrogen 3.045 N/A ARG 177.A NH2 ILE 174.A O no hydrogen 3.263 N/A ILE 178.A N GLU 172.A O no hydrogen 3.504 N/A THR 180.A N SER 183.A OG no hydrogen 2.731 N/A GLN 182.A NE2 ALA 243.A O no hydrogen 3.250 N/A GLN 182.A NE2 ARG 246.A O no hydrogen 3.330 N/A GLN 182.A NE2 PRO 247.A O no hydrogen 3.177 N/A SER 183.A N THR 180.A OG1 no hydrogen 3.093 N/A SER 183.A OG THR 180.A O no hydrogen 2.899 N/A ASP 184.A N THR 180.A O no hydrogen 3.045 N/A VAL 185.A N HIS 181.A O no hydrogen 3.044 N/A TRP 186.A N GLN 182.A O no hydrogen 3.323 N/A SER 187.A N SER 183.A O no hydrogen 3.165 N/A SER 187.A OG TRP 168.A O no hydrogen 2.615 N/A SER 187.A OG SER 183.A O no hydrogen 3.547 N/A TYR 188.A N ASP 184.A O no hydrogen 2.781 N/A TYR 188.A OH CYS 119.A O no hydrogen 2.749 N/A GLY 189.A N VAL 185.A O no hydrogen 2.905 N/A VAL 190.A N TRP 186.A O no hydrogen 2.986 N/A THR 191.A N SER 187.A O no hydrogen 2.903 N/A THR 191.A OG1 SER 187.A O no hydrogen 2.895 N/A VAL 192.A N TYR 188.A O no hydrogen 2.839 N/A TRP 193.A N GLY 189.A O no hydrogen 3.091 N/A TRP 193.A NE1 PRO 222.A O no hydrogen 2.733 N/A GLU 194.A N VAL 190.A O no hydrogen 2.726 N/A LEU 195.A N THR 191.A O no hydrogen 3.050 N/A MET 196.A N VAL 192.A O no hydrogen 2.873 N/A THR 197.A N TRP 193.A O no hydrogen 3.141 N/A THR 197.A OG1 TRP 193.A O no hydrogen 2.970 N/A THR 197.A OG1 GLU 194.A O no hydrogen 3.042 N/A PHE 198.A N LEU 195.A O no hydrogen 2.931 N/A GLY 199.A N GLU 194.A O no hydrogen 2.743 N/A SER 200.A N THR 197.A OG1 no hydrogen 3.073 N/A SER 200.A OG THR 197.A O no hydrogen 3.515 N/A ILE 206.A N TYR 203.A O no hydrogen 2.931 N/A GLU 210.A N PRO 207.A O no hydrogen 2.937 N/A ILE 211.A N ALA 208.A O no hydrogen 3.175 N/A ILE 214.A N GLU 210.A O no hydrogen 3.233 N/A LEU 215.A N ILE 211.A O no hydrogen 2.967 N/A GLU 216.A N SER 212.A O no hydrogen 3.018 N/A LYS 217.A N SER 213.A O no hydrogen 3.152 N/A GLY 218.A N LEU 215.A O no hydrogen 2.750 N/A GLU 219.A N ILE 214.A O no hydrogen 2.980 N/A ARG 220.A NE TRP 239.A O no hydrogen 2.943 N/A ARG 220.A NH1 LEU 215.A O no hydrogen 2.894 N/A ARG 220.A NH1 GLU 219.A O no hydrogen 2.854 N/A ARG 220.A NH2 TRP 239.A O no hydrogen 2.974 N/A GLN 223.A NE2 CYS 227.A O no hydrogen 2.867 N/A CYS 227.A N PRO 224.A O no hydrogen 2.985 N/A THR 228.A N TYR 266.A O no hydrogen 3.277 N/A THR 228.A OG1 TYR 266.A O no hydrogen 2.740 N/A TYR 232.A N THR 228.A O no hydrogen 2.975 N/A TYR 232.A OH LEU 221.A O no hydrogen 2.608 N/A MET 233.A N ILE 229.A O no hydrogen 2.863 N/A ILE 234.A N VAL 231.A O no hydrogen 3.138 N/A MET 235.A N VAL 231.A O no hydrogen 3.274 N/A ARG 236.A N TYR 232.A O no hydrogen 2.896 N/A ARG 236.A NH2 TYR 232.A OH no hydrogen 2.900 N/A LYS 237.A N MET 233.A O no hydrogen 2.957 N/A LYS 237.A N ILE 234.A O no hydrogen 3.137 N/A CYS 238.A N ILE 234.A O no hydrogen 3.175 N/A CYS 238.A SG ILE 234.A O no hydrogen 3.428 N/A TRP 239.A N ARG 236.A O no hydrogen 3.104 N/A TRP 239.A NE1 TRP 186.A O no hydrogen 3.104 N/A MET 240.A N LYS 237.A O no hydrogen 3.321 N/A ASP 244.A N ASP 242.A OD1 no hydrogen 3.335 N/A SER 245.A N ASP 242.A O no hydrogen 2.838 N/A SER 245.A OG ASP 242.A OD2 no hydrogen 3.179 N/A ARG 246.A N ALA 243.A O no hydrogen 3.138 N/A ARG 246.A NE MET 240.A O no hydrogen 2.885 N/A ARG 246.A NH1 GLU 172.A OE2 no hydrogen 2.805 N/A ARG 246.A NH1 GLN 182.A O no hydrogen 2.855 N/A ARG 246.A NH2 GLU 172.A OE1 no hydrogen 2.808 N/A ARG 246.A NH2 GLU 172.A OE2 no hydrogen 3.399 N/A ARG 246.A NH2 MET 240.A O no hydrogen 3.151 N/A LYS 248.A NZ GLU 130.A OE1 no hydrogen 2.930 N/A LYS 248.A NZ GLN 182.A OE1 no hydrogen 3.013 N/A LEU 252.A N LYS 248.A O no hydrogen 2.966 N/A ILE 253.A N PHE 249.A O no hydrogen 2.953 N/A ILE 254.A N ARG 250.A O no hydrogen 3.343 N/A GLU 255.A N GLU 251.A O no hydrogen 2.940 N/A PHE 256.A N LEU 252.A O no hydrogen 2.910 N/A SER 257.A N ILE 253.A O no hydrogen 2.936 N/A SER 257.A OG ILE 253.A O no hydrogen 2.924 N/A LYS 258.A N ILE 254.A O no hydrogen 2.998 N/A MET 259.A N GLU 255.A O no hydrogen 3.108 N/A ALA 260.A N PHE 256.A O no hydrogen 2.890 N/A ARG 261.A N LYS 258.A O no hydrogen 3.193 N/A ASP 262.A N MET 259.A O no hydrogen 2.920 N/A ARG 265.A N ASP 262.A O no hydrogen 3.027 N/A TYR 266.A N PRO 263.A O no hydrogen 3.143 N/A LEU 267.A N PRO 263.A O no hydrogen 3.055 N/A VAL 268.A N ILE 226.A O no hydrogen 2.856 N/A ASP 272.A N ILE 269.A O no hydrogen 2.988 N/A GLU 273.A N GLU 273.A OE1 no hydrogen 2.614 N/A ARG 274.A N GLY 271.A O no hydrogen 3.031 N/A ARG 274.A NE GLU 273.A OE2 no hydrogen 2.733 N/A ARG 274.A NH2 GLU 273.A OE2 no hydrogen 2.653 N/A MET 275.A N ASP 272.A O no hydrogen 3.285 N/A SER 283.A N SER 279.A O no hydrogen 3.042 N/A ASN 284.A N PRO 280.A O no hydrogen 2.840 N/A PHE 285.A N THR 281.A O no hydrogen 3.178 N/A TYR 286.A N ASP 282.A O no hydrogen 3.048 N/A ARG 287.A N SER 283.A O no hydrogen 2.994 N/A ARG 287.A NH1 GLU 293.A O no hydrogen 3.435 N/A ARG 287.A NH2 GLU 293.A O no hydrogen 2.521 N/A ALA 288.A N ASN 284.A O no hydrogen 2.901 N/A LEU 289.A N PHE 285.A O no hydrogen 3.095 N/A MET 290.A N TYR 286.A O no hydrogen 2.712 N/A ASP 291.A N ARG 287.A O no hydrogen 2.955 N/A