Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5f39_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 6.A N ASP 250.A OD2 no hydrogen 2.653 N/A PHE 9.A N LYS 38.A O no hydrogen 2.839 N/A THR 12.A N GLU 15.A OE1 no hydrogen 3.225 N/A THR 12.A OG1 GLU 15.A OE1 no hydrogen 3.249 N/A PHE 16.A N THR 12.A O no hydrogen 2.811 N/A ARG 17.A N MET 13.A O no hydrogen 3.113 N/A ARG 21.A N ASN 18.A OD1 no hydrogen 3.348 N/A ARG 21.A NH1 GLU 341.A OE2 no hydrogen 2.862 N/A TYR 22.A N ASN 18.A O no hydrogen 3.026 N/A ILE 23.A N PHE 19.A O no hydrogen 2.994 N/A ALA 24.A N SER 20.A O no hydrogen 3.056 N/A TYR 25.A N ARG 21.A O no hydrogen 2.862 N/A ILE 26.A N TYR 22.A O no hydrogen 2.921 N/A GLU 27.A N ILE 23.A O no hydrogen 3.269 N/A SER 28.A N ALA 24.A O no hydrogen 3.041 N/A SER 28.A OG TYR 25.A O no hydrogen 2.704 N/A GLY 30.A N GLU 27.A O no hydrogen 2.793 N/A ALA 31.A N ILE 26.A O no hydrogen 3.081 N/A HIS 32.A NE2 THR 333.A O no hydrogen 2.754 N/A ARG 33.A N GLY 30.A O no hydrogen 3.327 N/A ARG 33.A NE GLU 206.A OE2 no hydrogen 3.001 N/A ARG 33.A NH2 GLU 206.A OE1 no hydrogen 3.518 N/A ARG 33.A NH2 GLU 206.A OE2 no hydrogen 3.070 N/A ALA 34.A N ALA 31.A O no hydrogen 3.404 N/A GLY 35.A N HIS 32.A O no hydrogen 3.280 N/A ALA 37.A N ILE 261.A O no hydrogen 2.897 N/A LYS 38.A N MET 7.A O no hydrogen 2.917 N/A LYS 38.A NZ THR 253.A O no hydrogen 2.784 N/A LYS 38.A NZ GLU 258.A OE1 no hydrogen 2.735 N/A VAL 39.A N PHE 259.A O no hydrogen 2.912 N/A VAL 40.A N PHE 9.A O no hydrogen 2.773 N/A TRP 45.A N PRO 42.A O no hydrogen 2.975 N/A TRP 45.A NE1 GLU 139.A OE1 no hydrogen 3.028 N/A ARG 48.A NE SER 50.A O no hydrogen 2.985 N/A ARG 48.A NH1 LEU 132.A O no hydrogen 2.961 N/A ARG 48.A NH2 ASP 53.A OD1 no hydrogen 2.914 N/A ARG 48.A NH2 ASP 53.A OD2 no hydrogen 3.389 N/A ALA 49.A N GLU 134.A OE2 no hydrogen 3.089 N/A SER 50.A OG ASP 52.A OD2 no hydrogen 3.099 N/A TYR 51.A OH HIS 193.A ND1 no hydrogen 2.814 N/A LEU 57.A N ILE 54.A O no hydrogen 3.196 N/A ILE 59.A N MET 84.A O no hydrogen 2.766 N/A ILE 63.A N TYR 124.A O no hydrogen 2.918 N/A GLN 64.A N ILE 79.A O no hydrogen 2.737 N/A GLN 64.A NE2 PRO 121.A O no hydrogen 3.288 N/A GLN 65.A N PRO 122.A O no hydrogen 2.941 N/A GLN 65.A NE2 SER 176.A O no hydrogen 3.050 N/A LEU 66.A N TYR 77.A O no hydrogen 2.843 N/A THR 68.A N THR 75.A O no hydrogen 2.907 N/A GLN 70.A N LEU 73.A O no hydrogen 3.220 N/A LEU 73.A N GLN 70.A O no hydrogen 3.109 N/A PHE 74.A N LEU 236.A O no hydrogen 3.022 N/A THR 75.A N THR 68.A O no hydrogen 2.823 N/A GLN 76.A N MET 234.A O no hydrogen 2.803 N/A GLN 76.A NE2 SER 176.A O no hydrogen 3.682 N/A TYR 77.A N LEU 66.A O no hydrogen 2.716 N/A ILE 79.A N GLN 64.A O no hydrogen 2.985 N/A LYS 81.A N PRO 62.A O no hydrogen 2.776 N/A MET 84.A N ILE 59.A O no hydrogen 2.985 N/A THR 85.A N GLU 88.A OE1 no hydrogen 3.323 N/A ARG 87.A N ASP 55.A O no hydrogen 2.998 N/A ARG 87.A NH1 ASP 56.A OD1 no hydrogen 3.253 N/A ARG 87.A NH2 ASP 56.A OD1 no hydrogen 3.185 N/A ARG 87.A NH2 ASP 56.A OD2 no hydrogen 3.221 N/A PHE 89.A N THR 85.A O no hydrogen 3.314 N/A ARG 90.A N VAL 86.A O no hydrogen 2.841 N/A ARG 90.A NH1 ASP 55.A OD1 no hydrogen 2.745 N/A ARG 90.A NH2 ASP 55.A OD1 no hydrogen 3.271 N/A ARG 90.A NH2 ASP 55.A OD2 no hydrogen 3.534 N/A LYS 91.A N ARG 87.A O no hydrogen 3.241 N/A ILE 92.A N GLU 88.A O no hydrogen 3.271 N/A ALA 93.A N PHE 89.A O no hydrogen 2.828 N/A ASN 94.A N ARG 90.A O no hydrogen 2.939 N/A SER 95.A N ILE 92.A O no hydrogen 3.188 N/A SER 95.A OG ILE 92.A O no hydrogen 2.822 N/A TYR 98.A N SER 95.A OG no hydrogen 3.428 N/A CYS 99.A N SER 95.A O no hydrogen 2.883 N/A CYS 99.A SG ASP 96.A O no hydrogen 3.899 N/A CYS 99.A SG THR 100.A O no hydrogen 3.920 N/A THR 100.A OG1 HIS 273.A O no hydrogen 2.673 N/A SER 104.A N GLU 108.A OE1 no hydrogen 2.743 N/A LEU 109.A N GLU 105.A O no hydrogen 3.230 N/A GLU 110.A N PHE 106.A O no hydrogen 2.815 N/A ARG 111.A N GLU 107.A O no hydrogen 3.107 N/A LYS 112.A N GLU 108.A O no hydrogen 3.178 N/A TYR 113.A N LEU 109.A O no hydrogen 2.979 N/A TYR 113.A OH SER 176.A OG no hydrogen 3.011 N/A TRP 114.A N GLU 110.A O no hydrogen 3.289 N/A TRP 114.A NE1 TYR 201.A OH no hydrogen 3.056 N/A LYS 115.A N ARG 111.A O no hydrogen 3.037 N/A ASN 116.A N LYS 112.A O no hydrogen 2.904 N/A ASN 116.A N TYR 113.A O no hydrogen 3.197 N/A ASN 116.A ND2 LYS 112.A O no hydrogen 2.890 N/A PHE 119.A N ASN 116.A O no hydrogen 3.204 N/A ASN 120.A ND2 LYS 97.A O no hydrogen 2.943 N/A TYR 124.A N ILE 63.A O no hydrogen 2.706 N/A GLY 125.A N PHE 170.A O no hydrogen 2.820 N/A VAL 128.A N LEU 168.A O no hydrogen 3.137 N/A GLY 130.A N PRO 166.A O no hydrogen 3.223 N/A THR 131.A OG1 GLU 279.A OE1 no hydrogen 3.034 N/A THR 131.A OG1 GLU 279.A OE2 no hydrogen 2.693 N/A LEU 132.A N GLU 279.A OE1 no hydrogen 2.963 N/A TYR 133.A N THR 131.A OG1 no hydrogen 3.214 N/A GLU 134.A N PRO 47.A O no hydrogen 2.968 N/A VAL 137.A N GLU 134.A O no hydrogen 3.330 N/A ASN 141.A ND2 VAL 137.A O no hydrogen 2.713 N/A GLY 143.A N ASN 141.A OD1 no hydrogen 3.142 N/A ARG 144.A N ASN 141.A O no hydrogen 2.941 N/A ARG 144.A NH1 LYS 135.A O no hydrogen 2.946 N/A ARG 144.A NH2 LYS 135.A O no hydrogen 3.022 N/A ARG 144.A NH2 ASP 138.A OD1 no hydrogen 3.048 N/A ASP 150.A N THR 147.A O no hydrogen 3.304 N/A LEU 151.A N ILE 148.A O no hydrogen 3.120 N/A VAL 152.A N LEU 149.A O no hydrogen 3.130 N/A LYS 154.A N ASP 150.A O no hydrogen 2.885 N/A GLU 155.A N LEU 151.A O no hydrogen 2.916 N/A SER 156.A N VAL 152.A O no hydrogen 3.259 N/A ILE 158.A N SER 156.A OG no hydrogen 2.816 N/A THR 159.A OG1 GLU 153.A OE2 no hydrogen 2.781 N/A ILE 160.A N ASN 164.A OD1 no hydrogen 2.711 N/A GLY 162.A N THR 165.A OG1 no hydrogen 3.014 N/A VAL 163.A N ILE 160.A O no hydrogen 2.841 N/A ASN 164.A N ILE 160.A O no hydrogen 2.974 N/A ASN 164.A ND2 ILE 158.A O no hydrogen 3.389 N/A THR 165.A OG1 ASN 129.A OD1 no hydrogen 3.512 N/A TYR 167.A N SER 280.A O no hydrogen 2.842 N/A TYR 167.A OH GLU 161.A OE1 no hydrogen 3.115 N/A LEU 168.A N VAL 128.A O no hydrogen 2.740 N/A TYR 169.A N ALA 278.A O no hydrogen 2.866 N/A TYR 169.A OH ASP 127.A OD1 no hydrogen 3.215 N/A PHE 170.A N GLY 125.A O no hydrogen 2.802 N/A GLY 171.A N ASN 276.A O no hydrogen 3.143 N/A MET 172.A N THR 175.A OG1 no hydrogen 3.319 N/A LYS 174.A N ASN 272.A O no hydrogen 3.099 N/A LYS 174.A NZ ASN 116.A O no hydrogen 2.959 N/A LYS 174.A NZ PHE 119.A O no hydrogen 2.818 N/A THR 175.A N MET 172.A O no hydrogen 3.013 N/A THR 175.A OG1 MET 172.A O no hydrogen 2.735 N/A SER 176.A N GLN 65.A OE1 no hydrogen 2.810 N/A SER 176.A OG GLN 76.A OE1 no hydrogen 3.174 N/A SER 176.A OG TYR 113.A OH no hydrogen 3.011 N/A PHE 177.A N GLY 270.A O no hydrogen 3.037 N/A TRP 179.A N THR 235.A O no hydrogen 3.135 N/A TRP 179.A NE1 ILE 237.A O no hydrogen 3.107 N/A HIS 180.A N HIS 268.A O no hydrogen 2.981 N/A HIS 180.A ND1 ALA 178.A O no hydrogen 2.515 N/A THR 181.A OG1 ASP 185.A OD1 no hydrogen 3.131 N/A ASP 185.A N GLU 182.A O no hydrogen 3.000 N/A LEU 186.A N ASP 183.A O no hydrogen 3.311 N/A TYR 187.A N PHE 283.A O no hydrogen 3.154 N/A TYR 187.A OH GLU 27.A OE2 no hydrogen 2.805 N/A TYR 187.A OH THR 285.A OG1 no hydrogen 2.674 N/A SER 188.A N THR 262.A O no hydrogen 3.063 N/A SER 188.A OG THR 262.A OG1 no hydrogen 2.772 N/A ILE 189.A N THR 281.A O no hydrogen 2.976 N/A ASN 190.A N MET 260.A O no hydrogen 2.926 N/A TYR 191.A N GLU 279.A O no hydrogen 2.964 N/A LEU 192.A N GLU 258.A O no hydrogen 3.257 N/A HIS 193.A N CYS 277.A O no hydrogen 2.797 N/A HIS 193.A ND1 TYR 51.A OH no hydrogen 2.814 N/A HIS 193.A NE2 GLU 279.A OE1 no hydrogen 2.873 N/A GLU 196.A N PHE 275.A O no hydrogen 2.847 N/A LYS 198.A N GLN 254.A O no hydrogen 2.862 N/A LYS 198.A NZ ASN 272.A OD1 no hydrogen 2.868 N/A SER 199.A N PHE 271.A O no hydrogen 2.983 N/A SER 199.A OG THR 253.A OG1 no hydrogen 2.667 N/A SER 199.A OG HIS 273.A NE2 no hydrogen 2.750 N/A TRP 200.A N VAL 252.A O no hydrogen 2.748 N/A TRP 200.A NE1 GLN 254.A OE1 no hydrogen 2.929 N/A TYR 201.A N ALA 269.A O no hydrogen 2.777 N/A TYR 201.A OH GLU 110.A OE2 no hydrogen 2.810 N/A SER 202.A N ASP 250.A O no hydrogen 2.940 N/A VAL 203.A N TYR 267.A O no hydrogen 2.979 N/A HIS 207.A N PRO 204.A O no hydrogen 2.748 N/A GLY 208.A N PRO 205.A O no hydrogen 3.271 N/A ARG 210.A N HIS 207.A O no hydrogen 3.116 N/A LEU 211.A N HIS 207.A O no hydrogen 3.374 N/A GLU 212.A N GLY 208.A O no hydrogen 3.043 N/A ARG 213.A N LYS 209.A O no hydrogen 2.929 N/A LEU 214.A N ARG 210.A O no hydrogen 3.027 N/A ALA 215.A N LEU 211.A O no hydrogen 2.896 N/A LYS 216.A N GLU 212.A O no hydrogen 2.984 N/A GLY 217.A N ARG 213.A O no hydrogen 3.084 N/A PHE 218.A N LEU 214.A O no hydrogen 3.103 N/A PHE 218.A N ALA 215.A O no hydrogen 3.114 N/A PHE 219.A N ALA 215.A O no hydrogen 2.944 N/A ALA 223.A N PHE 219.A O no hydrogen 3.212 N/A GLN 224.A N PRO 220.A O no hydrogen 3.087 N/A SER 225.A N GLY 221.A O no hydrogen 3.258 N/A SER 225.A OG GLY 221.A O no hydrogen 2.925 N/A CYS 226.A N SER 222.A O no hydrogen 2.959 N/A CYS 226.A SG HIS 232.A NE2 no hydrogen 3.702 N/A CYS 226.A SG SER 299.A OG no hydrogen 3.769 N/A ARG 231.A N ALA 228.A O no hydrogen 3.082 N/A ARG 231.A NE VAL 296.A O no hydrogen 2.810 N/A ARG 231.A NH1 ASP 185.A OD1 no hydrogen 2.858 N/A ARG 231.A NH1 ASP 185.A OD2 no hydrogen 3.569 N/A ARG 231.A NH1 VAL 296.A O no hydrogen 3.029 N/A ARG 231.A NH2 GLU 182.A O no hydrogen 2.983 N/A ARG 231.A NH2 ASP 185.A OD1 no hydrogen 3.501 N/A HIS 232.A N PHE 229.A O no hydrogen 3.083 N/A LYS 233.A N LEU 230.A O no hydrogen 3.265 N/A LYS 233.A NZ ASP 183.A OD1 no hydrogen 3.565 N/A LYS 233.A NZ ARG 231.A O no hydrogen 3.050 N/A LEU 236.A N PHE 74.A O no hydrogen 2.975 N/A SER 238.A N GLY 72.A O no hydrogen 2.897 N/A LEU 240.A N SER 238.A OG no hydrogen 3.288 N/A MET 241.A N SER 238.A O no hydrogen 2.960 N/A LEU 242.A N SER 238.A O no hydrogen 3.218 N/A LYS 243.A N PRO 239.A O no hydrogen 2.957 N/A LYS 244.A N LEU 240.A O no hydrogen 2.876 N/A TYR 245.A N MET 241.A O no hydrogen 3.210 N/A TYR 245.A N LEU 242.A O no hydrogen 2.981 N/A GLY 246.A N LYS 243.A O no hydrogen 3.103 N/A ILE 247.A N LEU 242.A O no hydrogen 2.980 N/A ASP 250.A N SER 202.A O no hydrogen 3.010 N/A LYS 251.A N ASP 250.A OD1 no hydrogen 3.135 N/A LYS 251.A NZ GLU 110.A OE1 no hydrogen 3.522 N/A LYS 251.A NZ GLU 110.A OE2 no hydrogen 2.870 N/A VAL 252.A N TRP 200.A O no hydrogen 3.037 N/A THR 253.A OG1 SER 199.A OG no hydrogen 2.667 N/A GLN 254.A N LYS 198.A O no hydrogen 2.715 N/A GLN 254.A NE2 ASN 190.A O no hydrogen 3.195 N/A GLN 254.A NE2 ASN 190.A OD1 no hydrogen 3.334 N/A GLN 254.A NE2 GLU 258.A O no hydrogen 2.982 N/A GLU 255.A N GLU 258.A OE1 no hydrogen 3.003 N/A GLY 257.A N LEU 192.A O no hydrogen 2.753 N/A GLU 258.A N GLU 255.A O no hydrogen 3.204 N/A PHE 259.A N VAL 39.A O no hydrogen 2.933 N/A MET 260.A N ASN 190.A O no hydrogen 2.751 N/A ILE 261.A N ALA 37.A O no hydrogen 2.821 N/A THR 262.A N SER 188.A O no hydrogen 3.009 N/A THR 262.A OG1 SER 188.A OG no hydrogen 2.772 N/A PHE 263.A N GLY 35.A O no hydrogen 3.098 N/A TYR 265.A OH GLU 212.A OE2 no hydrogen 2.899 N/A GLY 266.A N PHE 263.A O no hydrogen 3.031 N/A TYR 267.A OH GLU 212.A OE2 no hydrogen 2.737 N/A HIS 268.A N HIS 180.A O no hydrogen 3.134 N/A HIS 268.A ND1 GLY 266.A O no hydrogen 2.886 N/A ALA 269.A N TYR 201.A O no hydrogen 3.162 N/A GLY 270.A N PHE 177.A O no hydrogen 3.034 N/A PHE 271.A N SER 199.A O no hydrogen 3.075 N/A ASN 272.A N THR 175.A O no hydrogen 2.944 N/A HIS 273.A N PRO 197.A O no hydrogen 2.913 N/A HIS 273.A NE2 SER 199.A OG no hydrogen 2.750 N/A ASN 276.A N GLY 171.A O no hydrogen 3.451 N/A ASN 276.A ND2 GLU 196.A O no hydrogen 2.872 N/A ASN 276.A ND2 ASN 272.A OD1 no hydrogen 2.996 N/A CYS 277.A N PHE 194.A O no hydrogen 3.153 N/A ALA 278.A N TYR 169.A O no hydrogen 2.936 N/A GLU 279.A N TYR 191.A O no hydrogen 2.839 N/A SER 280.A N TYR 167.A O no hydrogen 2.902 N/A SER 280.A OG ILE 189.A O no hydrogen 2.738 N/A THR 281.A N ILE 189.A O no hydrogen 3.321 N/A THR 281.A OG1 GLY 162.A O no hydrogen 3.545 N/A THR 281.A OG1 VAL 163.A O no hydrogen 3.282 N/A THR 281.A OG1 THR 165.A O no hydrogen 3.186 N/A ASN 282.A N VAL 163.A O no hydrogen 3.231 N/A ASN 282.A ND2 GLU 182.A OE1 no hydrogen 2.787 N/A ASN 282.A ND2 TYR 187.A O no hydrogen 2.763 N/A PHE 283.A N TYR 187.A O no hydrogen 3.151 N/A THR 285.A OG1 TYR 187.A OH no hydrogen 2.674 N/A THR 285.A OG1 THR 336.A OG1 no hydrogen 3.183 N/A ARG 286.A N GLU 338.A OE2 no hydrogen 3.294 N/A ARG 287.A N THR 336.A OG1 no hydrogen 3.248 N/A ARG 287.A NE GLU 27.A OE1 no hydrogen 3.096 N/A ARG 287.A NE GLU 27.A OE2 no hydrogen 3.140 N/A ARG 287.A NH1 GLU 27.A OE2 no hydrogen 2.800 N/A TRP 288.A N THR 285.A O no hydrogen 3.021 N/A TRP 288.A NE1 MET 184.A O no hydrogen 2.791 N/A ILE 289.A N ARG 286.A O no hydrogen 3.379 N/A TYR 291.A OH HIS 332.A ND1 no hydrogen 2.798 N/A GLY 292.A N TRP 288.A O no hydrogen 2.928 N/A LYS 293.A N ILE 289.A O no hydrogen 3.010 N/A LYS 293.A NZ GLU 290.A OE1 no hydrogen 2.942 N/A LYS 293.A NZ GLU 290.A OE2 no hydrogen 2.940 N/A LYS 293.A NZ GLN 314.A OE1 no hydrogen 3.186 N/A LYS 293.A NZ ASP 326.A OD2 no hydrogen 2.937 N/A GLN 294.A N GLU 290.A O no hydrogen 3.000 N/A GLN 294.A NE2 GLU 290.A OE2 no hydrogen 3.024 N/A GLN 294.A NE2 THR 328.A O no hydrogen 2.999 N/A CYS 298.A SG HIS 232.A NE2 no hydrogen 3.548 N/A CYS 300.A SG HIS 232.A NE2 no hydrogen 3.168 N/A VAL 310.A N MET 306.A O no hydrogen 3.086 N/A ARG 311.A N ASP 307.A O no hydrogen 2.936 N/A LYS 312.A N VAL 308.A O no hydrogen 3.156 N/A PHE 313.A N PHE 309.A O no hydrogen 2.829 N/A GLN 314.A N VAL 310.A O no hydrogen 2.725 N/A GLN 314.A NE2 GLU 290.A OE1 no hydrogen 3.559 N/A GLU 316.A N GLU 316.A OE1 no hydrogen 2.824 N/A TYR 318.A N PRO 315.A O no hydrogen 3.195 N/A TRP 321.A N ARG 317.A O no hydrogen 2.822 N/A LYS 322.A N TYR 318.A O no hydrogen 3.148 N/A ALA 323.A N LYS 319.A O no hydrogen 3.303 N/A GLY 324.A N TRP 321.A O no hydrogen 3.201 N/A LYS 325.A N LEU 320.A O no hydrogen 2.981 N/A THR 328.A N ASP 326.A OD1 no hydrogen 3.422 N/A THR 328.A OG1 ASP 326.A OD1 no hydrogen 2.661 N/A HIS 332.A ND1 TYR 291.A OH no hydrogen 2.798 N/A THR 333.A N ASP 331.A OD1 no hydrogen 3.485 N/A THR 333.A OG1 ASP 331.A OD1 no hydrogen 2.672 N/A LEU 334.A N ASP 331.A O no hydrogen 3.299 N/A THR 336.A N GLU 27.A OE1 no hydrogen 2.737 N/A THR 336.A OG1 THR 285.A OG1 no hydrogen 3.183 N/A THR 336.A OG1 GLU 338.A OE1 no hydrogen 2.673 N/A GLU 338.A N GLU 338.A OE1 no hydrogen 3.174 N/A ALA 339.A N THR 336.A O no hydrogen 2.996 N/A ALA 340.A N PRO 337.A O no hydrogen 3.183 N/A PHE 342.A N ALA 339.A O no hydrogen 3.083 N/A LEU 343.A N ALA 339.A O no hydrogen 3.022 N/A