Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ci8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N LYS 13.A O no hydrogen 2.921 N/A SER 6.A N TYR 11.A O no hydrogen 2.836 N/A GLU 9.A N SER 6.A OG no hydrogen 3.154 N/A TYR 11.A N SER 6.A O no hydrogen 3.202 N/A VAL 12.A N MET 23.A O no hydrogen 3.060 N/A LYS 13.A N VAL 4.A O no hydrogen 2.771 N/A LYS 13.A NZ TYR 11.A OH no hydrogen 3.151 N/A MET 14.A N VAL 21.A O no hydrogen 3.223 N/A LEU 16.A N ARG 19.A O no hydrogen 2.874 N/A VAL 21.A N MET 14.A O no hydrogen 2.789 N/A MET 23.A N VAL 12.A O no hydrogen 3.120 N/A MET 25.A N GLY 10.A O no hydrogen 3.171 N/A LYS 27.A N ASP 540.A OD1 no hydrogen 2.864 N/A GLN 29.A N PRO 26.A O no hydrogen 2.961 N/A VAL 30.A N LYS 27.A O no hydrogen 3.298 N/A SER 32.A N GLN 29.A O no hydrogen 3.420 N/A SER 32.A OG ASP 31.A OD1 no hydrogen 3.207 N/A TYR 33.A OH SER 596.A O no hydrogen 2.577 N/A ALA 37.A N SER 34.A O no hydrogen 3.060 N/A ARG 45.A N ILE 640.A O no hydrogen 3.150 N/A LEU 46.A N TYR 605.A OH no hydrogen 2.717 N/A LYS 47.A N ARG 638.A O no hydrogen 3.096 N/A GLU 49.A N GLN 636.A O no hydrogen 2.876 N/A TRP 50.A N GLN 636.A O no hydrogen 3.175 N/A VAL 51.A N GLN 89.A OE1 no hydrogen 2.862 N/A TYR 52.A N ILE 634.A O no hydrogen 2.660 N/A TYR 52.A OH GLN 636.A OE1 no hydrogen 2.713 N/A TYR 54.A OH ASN 62.A OD1 no hydrogen 3.045 N/A ARG 55.A N PHE 74.A O no hydrogen 3.310 N/A ARG 55.A NE ASP 58.A OD1 no hydrogen 2.764 N/A ARG 55.A NH2 ASP 58.A OD1 no hydrogen 3.529 N/A ARG 55.A NH2 ASP 58.A OD2 no hydrogen 2.801 N/A GLY 56.A N ASN 349.A OD1 no hydrogen 3.045 N/A ARG 57.A N ASN 349.A OD1 no hydrogen 3.031 N/A CYS 59.A N GLY 56.A O no hydrogen 3.382 N/A CYS 59.A SG ASP 58.A O no hydrogen 3.479 N/A CYS 59.A SG LYS 100.A O no hydrogen 3.742 N/A ASN 62.A ND2 ARG 55.A O no hydrogen 2.746 N/A TYR 64.A N VAL 72.A O no hydrogen 2.920 N/A TYR 64.A OH LEU 102.A O no hydrogen 3.087 N/A LEU 66.A N GLU 70.A O no hydrogen 3.044 N/A THR 68.A OG1 GLU 70.A OE1 no hydrogen 2.811 N/A GLY 69.A N LEU 66.A O no hydrogen 3.079 N/A THR 71.A N TYR 82.A O no hydrogen 2.578 N/A VAL 72.A N TYR 64.A O no hydrogen 2.737 N/A TYR 73.A N VAL 80.A O no hydrogen 3.059 N/A ILE 75.A N VAL 78.A O no hydrogen 3.108 N/A SER 77.A N GLY 607.A O no hydrogen 3.104 N/A SER 77.A OG SER 609.A OG no hydrogen 2.898 N/A VAL 78.A N ILE 75.A O no hydrogen 3.076 N/A VAL 79.A N TYR 92.A O no hydrogen 2.982 N/A VAL 80.A N TYR 73.A O no hydrogen 2.704 N/A LEU 81.A N ARG 90.A O no hydrogen 2.862 N/A TYR 82.A N THR 71.A O no hydrogen 2.733 N/A TYR 82.A OH ILE 363.A O no hydrogen 3.174 N/A ASN 83.A N LEU 88.A O no hydrogen 2.834 N/A GLU 86.A N ASN 83.A OD1 no hydrogen 3.030 N/A GLN 87.A N VAL 84.A O no hydrogen 3.296 N/A GLN 87.A NE2 TYR 82.A OH no hydrogen 2.649 N/A GLN 87.A NE2 VAL 84.A O no hydrogen 2.952 N/A LEU 88.A N ASN 83.A O no hydrogen 3.327 N/A GLN 89.A NE2 VAL 51.A O no hydrogen 3.243 N/A ARG 90.A N LEU 81.A O no hydrogen 2.920 N/A ARG 90.A NH1 GLU 70.A OE2 no hydrogen 2.917 N/A ARG 90.A NH1 SER 135.A O no hydrogen 3.104 N/A ARG 90.A NH2 SER 135.A O no hydrogen 2.973 N/A HIS 91.A NE2 GLN 89.A OE1 no hydrogen 2.870 N/A TYR 92.A N VAL 79.A O no hydrogen 3.059 N/A TYR 92.A OH THR 140.A OG1 no hydrogen 2.941 N/A HIS 95.A ND1 GLN 115.A OE1 no hydrogen 2.807 N/A HIS 95.A NE2 THR 113.A OG1 no hydrogen 2.735 N/A ASN 96.A N GLN 115.A OE1 no hydrogen 3.244 N/A ASP 98.A N ASP 97.A OD1 no hydrogen 2.505 N/A VAL 99.A N ALA 76.A O no hydrogen 2.916 N/A LYS 100.A N GLY 114.A O no hydrogen 3.255 N/A CYS 101.A SG VAL 153.A O no hydrogen 2.982 N/A ALA 103.A N ALA 112.A O no hydrogen 2.905 N/A HIS 105.A N THR 110.A O no hydrogen 2.756 N/A ASP 107.A N HIS 105.A ND1 no hydrogen 2.895 N/A ARG 108.A N HIS 105.A O no hydrogen 2.847 N/A ILE 109.A N ASP 107.A OD1 no hydrogen 3.004 N/A THR 110.A N ASP 107.A OD1 no hydrogen 2.842 N/A THR 110.A OG1 ASP 107.A OD2 no hydrogen 2.608 N/A ILE 111.A N TRP 133.A O no hydrogen 2.878 N/A ALA 112.A N ALA 103.A O no hydrogen 2.876 N/A THR 113.A N ARG 131.A O no hydrogen 2.860 N/A THR 113.A OG1 HIS 95.A NE2 no hydrogen 2.735 N/A GLY 114.A N CYS 101.A O no hydrogen 3.006 N/A GLN 115.A NE2 ASN 96.A OD1 no hydrogen 3.170 N/A GLN 115.A NE2 VAL 116.A O no hydrogen 3.229 N/A VAL 116.A N ASP 98.A O no hydrogen 3.044 N/A ALA 117.A N ARG 151.A O no hydrogen 2.788 N/A GLY 118.A N LEU 126.A O no hydrogen 2.801 N/A SER 120.A N LYS 124.A O no hydrogen 3.334 N/A SER 120.A OG ASP 122.A OD2 no hydrogen 2.769 N/A ASP 122.A N SER 120.A OG no hydrogen 3.336 N/A HIS 129.A ND1 PRO 127.A O no hydrogen 3.322 N/A VAL 130.A N ILE 144.A O no hydrogen 3.535 N/A ARG 131.A N THR 113.A O no hydrogen 2.845 N/A ARG 131.A NE HIS 129.A NE2 no hydrogen 3.001 N/A ILE 132.A N HIS 142.A O no hydrogen 3.068 N/A TRP 133.A N ILE 111.A O no hydrogen 2.968 N/A TRP 133.A NE1 THR 113.A OG1 no hydrogen 2.919 N/A ASP 134.A N ASN 139.A O no hydrogen 3.060 N/A SER 135.A N ILE 109.A O no hydrogen 3.107 N/A SER 135.A OG ILE 109.A O no hydrogen 2.843 N/A THR 137.A N ASP 134.A OD2 no hydrogen 2.684 N/A THR 137.A OG1 ASP 134.A OD2 no hydrogen 3.082 N/A ASN 139.A N THR 137.A OG1 no hydrogen 3.170 N/A THR 140.A OG1 TYR 92.A OH no hydrogen 2.941 N/A LEU 141.A N ILE 132.A O no hydrogen 2.539 N/A HIS 142.A N ILE 132.A O no hydrogen 3.004 N/A ILE 144.A N VAL 130.A O no hydrogen 2.960 N/A PHE 148.A N GLY 145.A O no hydrogen 3.288 N/A ALA 152.A N ASP 150.A O no hydrogen 2.686 N/A VAL 153.A N GLN 115.A O no hydrogen 3.020 N/A THR 154.A N VAL 170.A O no hydrogen 2.808 N/A THR 154.A OG1 VAL 170.A O no hydrogen 2.921 N/A CYS 155.A N VAL 170.A O no hydrogen 3.431 N/A CYS 155.A SG VAL 199.A O no hydrogen 3.425 N/A ALA 157.A N CYS 168.A O no hydrogen 3.068 N/A SER 159.A N ASN 166.A O no hydrogen 3.027 N/A SER 159.A OG ASN 162.A OD1 no hydrogen 2.468 N/A LYS 160.A NZ ASP 203.A OD2 no hydrogen 3.390 N/A GLY 164.A N ASN 162.A OD1 no hydrogen 3.281 N/A LEU 167.A N TRP 181.A O no hydrogen 2.950 N/A CYS 168.A N ALA 157.A O no hydrogen 2.914 N/A CYS 168.A SG ALA 157.A O no hydrogen 3.944 N/A ALA 169.A N SER 179.A O no hydrogen 2.977 N/A VAL 170.A N CYS 155.A O no hydrogen 3.122 N/A ASP 171.A N VAL 177.A O no hydrogen 3.152 N/A ASP 172.A N ASP 150.A O no hydrogen 3.380 N/A SER 173.A N ASP 171.A OD1 no hydrogen 2.787 N/A SER 173.A OG ASP 171.A OD1 no hydrogen 2.466 N/A VAL 177.A N ASP 171.A OD1 no hydrogen 3.039 N/A LEU 178.A N VAL 192.A O no hydrogen 3.011 N/A SER 179.A N ALA 169.A O no hydrogen 2.963 N/A VAL 180.A N ALA 190.A O no hydrogen 2.951 N/A TRP 181.A N LEU 167.A O no hydrogen 2.777 N/A TRP 181.A NE1 SER 179.A OG no hydrogen 2.868 N/A ASP 182.A N GLU 187.A O no hydrogen 2.916 N/A TRP 183.A NE1 GLY 164.A O no hydrogen 2.593 N/A LYS 185.A N ASP 182.A O no hydrogen 2.793 N/A GLU 186.A N TRP 183.A O no hydrogen 3.164 N/A GLU 187.A N ASP 182.A O no hydrogen 3.500 N/A LYS 188.A NZ ASP 191.A OD1 no hydrogen 3.079 N/A LEU 189.A N VAL 180.A O no hydrogen 2.851 N/A ALA 190.A N VAL 180.A O no hydrogen 3.502 N/A VAL 192.A N LEU 178.A O no hydrogen 2.960 N/A LYS 193.A NZ ASP 175.A OD2 no hydrogen 2.902 N/A CYS 194.A N HIS 176.A O no hydrogen 3.012 N/A CYS 194.A SG THR 214.A OG1 no hydrogen 3.276 N/A SER 195.A OG GLU 197.A O no hydrogen 3.243 N/A GLU 197.A N SER 195.A OG no hydrogen 3.003 N/A PHE 200.A N CYS 215.A O no hydrogen 2.597 N/A ALA 201.A N CYS 215.A O no hydrogen 3.272 N/A ASP 203.A N VAL 213.A O no hydrogen 2.874 N/A HIS 205.A N ILE 211.A O no hydrogen 3.044 N/A HIS 205.A NE2 GLY 255.A O no hydrogen 2.951 N/A THR 207.A N HIS 205.A ND1 no hydrogen 3.107 N/A ASN 210.A N ASP 208.A OD1 no hydrogen 2.864 N/A ILE 211.A N ASP 208.A O no hydrogen 3.318 N/A ILE 212.A N TRP 223.A O no hydrogen 2.828 N/A VAL 213.A N ASP 203.A O no hydrogen 2.848 N/A THR 214.A N TYR 221.A O no hydrogen 3.219 N/A THR 214.A OG1 HIS 219.A NE2 no hydrogen 2.572 N/A CYS 215.A N ALA 201.A O no hydrogen 3.073 N/A CYS 215.A SG VAL 246.A O no hydrogen 3.527 N/A GLY 216.A N HIS 219.A O no hydrogen 3.027 N/A LYS 217.A N ALA 198.A O no hydrogen 3.036 N/A LYS 217.A NZ GLU 197.A OE2 no hydrogen 3.278 N/A SER 218.A N LYS 244.A O no hydrogen 2.944 N/A SER 218.A OG LYS 244.A O no hydrogen 3.525 N/A HIS 219.A NE2 THR 214.A OG1 no hydrogen 2.572 N/A TYR 221.A N THR 214.A O no hydrogen 3.056 N/A PHE 222.A N LYS 233.A O no hydrogen 2.915 N/A TRP 223.A N ILE 212.A O no hydrogen 2.757 N/A TRP 223.A NE1 THR 214.A OG1 no hydrogen 2.986 N/A THR 224.A N ASN 231.A O no hydrogen 2.935 N/A LEU 225.A N ASN 210.A O no hydrogen 2.519 N/A GLU 226.A N SER 229.A O no hydrogen 3.008 N/A SER 229.A N GLU 226.A O no hydrogen 2.938 N/A SER 229.A OG GLU 226.A O no hydrogen 3.001 N/A ASN 231.A N THR 224.A O no hydrogen 2.941 N/A LYS 233.A N PHE 222.A O no hydrogen 2.944 N/A GLY 235.A N LEU 220.A O no hydrogen 2.830 N/A LEU 236.A N ASN 274.A O no hydrogen 2.604 N/A GLN 240.A N PHE 237.A O no hydrogen 3.483 N/A GLN 240.A NE2 GLN 281.A OE1 no hydrogen 2.838 N/A VAL 246.A N GLY 216.A O no hydrogen 3.316 N/A CYS 248.A N GLY 260.A O no hydrogen 3.199 N/A CYS 248.A SG ILE 288.A O no hydrogen 3.373 N/A THR 250.A N ILE 258.A O no hydrogen 2.843 N/A PHE 251.A N THR 250.A OG1 no hydrogen 2.599 N/A SER 252.A N ASP 256.A O no hydrogen 3.029 N/A SER 252.A OG ASN 254.A OD1 no hydrogen 2.825 N/A GLY 255.A N SER 252.A O no hydrogen 2.972 N/A ASP 256.A N SER 252.A OG no hydrogen 2.909 N/A THR 257.A N TRP 269.A O no hydrogen 2.963 N/A ILE 258.A N THR 250.A O no hydrogen 2.887 N/A THR 259.A N LEU 267.A O no hydrogen 2.823 N/A GLY 260.A N CYS 248.A O no hydrogen 3.127 N/A SER 262.A N PHE 245.A O no hydrogen 2.743 N/A SER 263.A N ASP 261.A OD1 no hydrogen 2.892 N/A GLY 264.A N ASP 261.A O no hydrogen 3.220 N/A ASN 265.A N ASP 261.A OD1 no hydrogen 2.951 N/A ILE 266.A N VAL 280.A O no hydrogen 3.161 N/A LEU 267.A N THR 259.A O no hydrogen 2.756 N/A VAL 268.A N TYR 278.A O no hydrogen 2.981 N/A TRP 269.A N THR 257.A O no hydrogen 2.705 N/A LYS 271.A N ASP 256.A OD1 no hydrogen 2.631 N/A LYS 271.A NZ THR 207.A OG1 no hydrogen 3.357 N/A THR 273.A N GLY 270.A O no hydrogen 2.784 N/A THR 273.A OG1 GLY 270.A O no hydrogen 2.873 N/A THR 273.A OG1 ARG 275.A O no hydrogen 2.937 N/A ARG 275.A N THR 273.A OG1 no hydrogen 3.102 N/A SER 277.A N VAL 268.A O no hydrogen 2.820 N/A TYR 278.A N VAL 268.A O no hydrogen 3.246 N/A VAL 280.A N ILE 266.A O no hydrogen 2.790 N/A GLN 281.A NE2 GLN 240.A OE1 no hydrogen 2.371 N/A GLY 282.A N ASN 265.A OD1 no hydrogen 2.739 N/A HIS 284.A N GLY 264.A O no hydrogen 3.046 N/A HIS 284.A ND1 ASP 306.A OD2 no hydrogen 2.806 N/A HIS 284.A NE2 SER 301.A OG no hydrogen 2.652 N/A GLY 286.A N ASP 306.A OD1 no hydrogen 3.198 N/A ILE 288.A N ASP 261.A O no hydrogen 3.065 N/A PHE 289.A N GLY 302.A O no hydrogen 3.130 N/A CYS 292.A N VAL 300.A O no hydrogen 3.023 N/A CYS 292.A SG VAL 334.A O no hydrogen 3.952 N/A LEU 294.A N THR 298.A O no hydrogen 2.780 N/A ARG 295.A N GLU 336.A OE2 no hydrogen 3.051 N/A GLY 297.A N LEU 294.A O no hydrogen 3.477 N/A THR 298.A N ASP 296.A OD1 no hydrogen 2.923 N/A THR 298.A OG1 ASP 296.A OD1 no hydrogen 2.750 N/A LEU 299.A N TRP 312.A O no hydrogen 2.848 N/A VAL 300.A N CYS 292.A O no hydrogen 2.770 N/A SER 301.A N ILE 310.A O no hydrogen 2.789 N/A SER 301.A OG HIS 284.A NE2 no hydrogen 2.652 N/A GLY 302.A N ALA 290.A O no hydrogen 3.007 N/A GLY 303.A N LYS 308.A O no hydrogen 3.007 N/A GLY 304.A N GLY 287.A O no hydrogen 3.023 N/A ARG 307.A NE GLY 304.A O no hydrogen 2.970 N/A ARG 307.A NE LYS 305.A O no hydrogen 3.205 N/A LYS 308.A N ASP 306.A OD2 no hydrogen 3.355 N/A LYS 308.A NZ ASP 306.A OD2 no hydrogen 3.399 N/A LEU 309.A N THR 322.A O no hydrogen 2.745 N/A ILE 310.A N SER 301.A O no hydrogen 2.902 N/A SER 311.A N ARG 320.A O no hydrogen 2.868 N/A TRP 312.A N LEU 299.A O no hydrogen 2.707 N/A SER 313.A N GLN 317.A O no hydrogen 3.159 N/A SER 313.A OG GLN 317.A O no hydrogen 3.517 N/A ASN 315.A N SER 313.A OG no hydrogen 3.221 N/A TYR 316.A N SER 313.A O no hydrogen 2.968 N/A GLN 317.A N SER 313.A OG no hydrogen 3.046 N/A GLN 317.A NE2 ASN 315.A O no hydrogen 3.086 N/A LEU 319.A N SER 311.A O no hydrogen 2.740 N/A ARG 320.A N SER 311.A O no hydrogen 3.351 N/A THR 322.A N LEU 309.A O no hydrogen 3.249 N/A THR 322.A OG1 LEU 309.A O no hydrogen 3.448 N/A ILE 324.A N ARG 307.A O no hydrogen 2.892 N/A PHE 328.A N PRO 325.A O no hydrogen 2.999 N/A ARG 332.A N GLY 345.A O no hydrogen 2.783 N/A ARG 332.A NE CYS 59.A O no hydrogen 2.973 N/A THR 333.A N GLY 345.A O no hydrogen 3.074 N/A THR 333.A OG1 TYR 54.A OH no hydrogen 2.910 N/A ALA 335.A N LEU 343.A O no hydrogen 2.910 N/A GLY 337.A N VAL 341.A O no hydrogen 2.948 N/A VAL 341.A N LYS 338.A O no hydrogen 3.071 N/A ILE 342.A N GLY 354.A O no hydrogen 3.182 N/A LEU 343.A N ALA 335.A O no hydrogen 2.924 N/A ILE 344.A N LEU 352.A O no hydrogen 3.079 N/A GLY 345.A N THR 333.A O no hydrogen 2.979 N/A THR 346.A N PHE 350.A O no hydrogen 2.990 N/A THR 346.A OG1 PHE 328.A O no hydrogen 2.950 N/A THR 347.A N PRO 330.A O no hydrogen 2.972 N/A ARG 348.A N THR 346.A OG1 no hydrogen 3.222 N/A ASN 349.A N THR 346.A O no hydrogen 3.104 N/A ASN 349.A ND2 HIS 367.A O no hydrogen 2.988 N/A PHE 350.A N THR 346.A OG1 no hydrogen 3.264 N/A VAL 351.A N THR 364.A O no hydrogen 3.035 N/A LEU 352.A N ILE 344.A O no hydrogen 2.774 N/A GLN 353.A N THR 361.A O no hydrogen 2.876 N/A GLY 354.A N ILE 342.A O no hydrogen 3.003 N/A THR 355.A OG1 ASP 340.A O no hydrogen 2.767 N/A THR 361.A N GLN 353.A O no hydrogen 3.200 N/A THR 361.A OG1 GLN 353.A O no hydrogen 3.563 N/A ILE 363.A N VAL 351.A O no hydrogen 2.806 N/A THR 364.A OG1 TYR 73.A OH no hydrogen 3.137 N/A THR 364.A OG1 ILE 363.A O no hydrogen 2.860 N/A HIS 367.A ND1 ASP 389.A OD1 no hydrogen 3.145 N/A HIS 367.A NE2 THR 385.A OG1 no hydrogen 2.683 N/A THR 368.A N ASP 389.A OD2 no hydrogen 3.057 N/A GLU 370.A N ASP 369.A OD1 no hydrogen 2.591 N/A LEU 371.A N GLY 629.A O no hydrogen 2.973 N/A TRP 372.A NE1 GLU 370.A OE2 no hydrogen 2.993 N/A GLY 373.A N CYS 386.A O no hydrogen 3.016 N/A ALA 375.A N LEU 384.A O no hydrogen 2.928 N/A HIS 377.A N GLN 382.A O no hydrogen 3.119 N/A SER 379.A N HIS 377.A ND1 no hydrogen 2.913 N/A LYS 380.A N HIS 377.A ND1 no hydrogen 2.619 N/A PHE 383.A N TRP 395.A O no hydrogen 3.230 N/A LEU 384.A N ALA 375.A O no hydrogen 2.779 N/A THR 385.A N THR 393.A O no hydrogen 2.954 N/A THR 385.A OG1 HIS 367.A NE2 no hydrogen 2.683 N/A CYS 386.A N GLY 373.A O no hydrogen 3.189 N/A CYS 386.A SG SER 414.A O no hydrogen 3.535 N/A GLY 387.A N HIS 391.A O no hydrogen 3.296 N/A HIS 388.A N GLU 370.A O no hydrogen 2.904 N/A HIS 388.A NE2 GLN 413.A OE1 no hydrogen 2.973 N/A LYS 390.A N GLY 387.A O no hydrogen 3.119 N/A HIS 391.A N ASP 389.A OD1 no hydrogen 3.176 N/A HIS 391.A ND1 ASP 405.A OD2 no hydrogen 2.805 N/A ALA 392.A N LYS 406.A O no hydrogen 2.737 N/A THR 393.A N THR 385.A O no hydrogen 2.705 N/A THR 393.A OG1 ASP 405.A OD1 no hydrogen 2.704 N/A LEU 394.A N TRP 404.A O no hydrogen 2.897 N/A TRP 395.A N PHE 383.A O no hydrogen 2.748 N/A TRP 395.A NE1 THR 385.A OG1 no hydrogen 2.734 N/A ASP 396.A N ARG 401.A O no hydrogen 2.799 N/A ALA 397.A N SER 381.A O no hydrogen 2.994 N/A VAL 398.A N ASP 396.A OD1 no hydrogen 2.680 N/A GLY 399.A N ASP 396.A OD1 no hydrogen 2.853 N/A HIS 400.A N ASP 396.A O no hydrogen 2.801 N/A ARG 401.A N ASP 396.A O no hydrogen 3.359 N/A VAL 403.A N LEU 394.A O no hydrogen 2.424 N/A TRP 404.A N LEU 394.A O no hydrogen 3.389 N/A TRP 404.A NE1 THR 438.A O no hydrogen 2.946 N/A LYS 406.A N ALA 392.A O no hydrogen 2.788 N/A LYS 406.A NZ ILE 407.A O no hydrogen 3.018 N/A ILE 408.A N LYS 390.A O no hydrogen 2.861 N/A ALA 412.A N GLY 387.A O no hydrogen 2.955 N/A GLN 413.A N GLY 427.A O no hydrogen 2.855 N/A SER 414.A N GLY 427.A O no hydrogen 3.474 N/A SER 414.A OG LEU 454.A O no hydrogen 2.831 N/A GLY 416.A N ALA 425.A O no hydrogen 3.018 N/A HIS 418.A N VAL 423.A O no hydrogen 3.065 N/A HIS 418.A ND1 SER 420.A OG no hydrogen 2.614 N/A HIS 418.A NE2 GLY 463.A O no hydrogen 3.109 N/A SER 420.A N HIS 418.A ND1 no hydrogen 3.010 N/A SER 420.A OG HIS 418.A ND1 no hydrogen 2.614 N/A SER 420.A OG SER 422.A OG no hydrogen 2.753 N/A GLY 421.A N HIS 418.A O no hydrogen 2.541 N/A SER 422.A N SER 420.A OG no hydrogen 3.244 N/A SER 422.A OG SER 420.A OG no hydrogen 2.753 N/A SER 422.A OG ASN 483.A O no hydrogen 2.843 N/A VAL 424.A N PHE 436.A O no hydrogen 2.944 N/A ALA 425.A N GLY 416.A O no hydrogen 2.683 N/A VAL 426.A N PHE 434.A O no hydrogen 2.934 N/A GLY 427.A N SER 414.A O no hydrogen 2.698 N/A THR 428.A N ARG 432.A O no hydrogen 3.191 N/A THR 428.A OG1 THR 430.A OG1 no hydrogen 2.785 N/A THR 428.A OG1 ARG 432.A O no hydrogen 2.911 N/A LEU 429.A N PRO 411.A O no hydrogen 3.032 N/A THR 430.A N THR 428.A OG1 no hydrogen 3.196 N/A THR 430.A OG1 THR 428.A OG1 no hydrogen 2.785 N/A ARG 432.A N THR 430.A OG1 no hydrogen 3.133 N/A ARG 432.A NE ASP 410.A OD2 no hydrogen 3.149 N/A ARG 432.A NH2 ASP 410.A OD2 no hydrogen 2.831 N/A TRP 433.A N HIS 447.A O no hydrogen 2.756 N/A TRP 433.A NE1 ASP 449.A OD2 no hydrogen 2.655 N/A PHE 434.A N VAL 426.A O no hydrogen 2.985 N/A VAL 435.A N THR 445.A O no hydrogen 3.001 N/A PHE 436.A N VAL 424.A O no hydrogen 2.928 N/A ASP 437.A N ASP 442.A O no hydrogen 2.862 N/A THR 438.A N SER 422.A O no hydrogen 2.941 N/A THR 438.A OG1 GLY 421.A O no hydrogen 2.918 N/A GLU 439.A N ASP 437.A OD1 no hydrogen 2.966 N/A LYS 441.A N ASP 437.A O no hydrogen 2.679 N/A LYS 441.A NZ ASP 405.A O no hydrogen 3.035 N/A ASP 442.A N THR 440.A OG1 no hydrogen 3.074 N/A VAL 444.A N VAL 435.A O no hydrogen 2.636 N/A THR 445.A OG1 HIS 447.A NE2 no hydrogen 3.003 N/A HIS 447.A N TRP 433.A O no hydrogen 3.091 N/A ASP 449.A N GLY 431.A O no hydrogen 2.842 N/A LEU 454.A N THR 428.A O no hydrogen 2.959 N/A SER 455.A OG ILE 500.A O no hydrogen 2.477 N/A ARG 458.A N ALA 467.A O no hydrogen 2.957 N/A ARG 458.A NH1 THR 547.A OG1 no hydrogen 2.885 N/A ARG 458.A NH2 THR 547.A OG1 no hydrogen 2.867 N/A TYR 459.A OH TYR 487.A OH no hydrogen 2.621 N/A SER 460.A N PHE 465.A O no hydrogen 2.949 N/A SER 460.A OG ASP 462.A OD1 no hydrogen 2.751 N/A SER 460.A OG PHE 465.A O no hydrogen 3.322 N/A ASP 462.A N SER 509.A OG no hydrogen 3.078 N/A GLY 463.A N SER 460.A O no hydrogen 2.660 N/A ASN 464.A N ASP 462.A OD1 no hydrogen 2.729 N/A PHE 465.A N SER 460.A OG no hydrogen 2.997 N/A LEU 466.A N TYR 478.A O no hydrogen 2.735 N/A ALA 467.A N ARG 458.A O no hydrogen 2.813 N/A ILE 468.A N TYR 476.A O no hydrogen 2.897 N/A GLY 469.A N VAL 456.A O no hydrogen 2.815 N/A SER 470.A N CYS 474.A O no hydrogen 3.105 N/A HIS 471.A N GLN 453.A O no hydrogen 2.777 N/A ASP 472.A N SER 470.A OG no hydrogen 3.212 N/A ASN 473.A N SER 470.A O no hydrogen 3.330 N/A CYS 474.A N ASP 472.A OD1 no hydrogen 2.717 N/A ILE 475.A N CYS 493.A O no hydrogen 3.008 N/A TYR 476.A N ILE 468.A O no hydrogen 2.836 N/A TYR 476.A OH ASP 472.A OD2 no hydrogen 2.505 N/A ILE 477.A N GLY 491.A O no hydrogen 2.961 N/A TYR 478.A N LEU 466.A O no hydrogen 2.946 N/A TYR 478.A OH ASP 449.A OD1 no hydrogen 2.667 N/A TYR 478.A OH ASP 449.A OD2 no hydrogen 2.806 N/A GLY 479.A N THR 488.A O no hydrogen 2.877 N/A VAL 480.A N ASN 464.A O no hydrogen 2.748 N/A SER 481.A N LYS 486.A O no hydrogen 2.929 N/A ARG 485.A NH1 ASP 437.A OD2 no hydrogen 3.168 N/A ARG 485.A NH2 ASP 437.A OD2 no hydrogen 3.168 N/A LYS 486.A N SER 481.A O no hydrogen 2.879 N/A TYR 487.A OH TYR 459.A OH no hydrogen 2.621 N/A TYR 487.A OH GLY 484.A O no hydrogen 2.630 N/A THR 488.A N GLY 479.A O no hydrogen 3.107 N/A ARG 489.A NE ASP 449.A OD1 no hydrogen 3.051 N/A ARG 489.A NH2 ASP 449.A OD1 no hydrogen 3.101 N/A VAL 490.A N ILE 477.A O no hydrogen 2.831 N/A GLY 491.A N ILE 477.A O no hydrogen 3.338 N/A CYS 493.A N ILE 475.A O no hydrogen 2.819 N/A HIS 496.A ND1 GLU 520.A OE2 no hydrogen 3.011 N/A SER 497.A N GLU 520.A OE2 no hydrogen 3.042 N/A ILE 500.A N SER 470.A O no hydrogen 3.118 N/A THR 501.A N ASN 515.A O no hydrogen 2.914 N/A HIS 502.A N ASN 515.A O no hydrogen 3.432 N/A ASP 504.A N VAL 513.A O no hydrogen 3.275 N/A TRP 505.A NE1 ARG 458.A O no hydrogen 3.193 N/A SER 506.A N PHE 511.A O no hydrogen 3.002 N/A SER 506.A OG ASN 508.A OD1 no hydrogen 2.829 N/A SER 506.A OG PHE 511.A O no hydrogen 3.531 N/A VAL 507.A N GLU 542.A O no hydrogen 2.976 N/A SER 509.A N SER 506.A O no hydrogen 2.911 N/A GLN 510.A N SER 506.A OG no hydrogen 3.260 N/A GLN 510.A N ASN 508.A OD1 no hydrogen 3.020 N/A PHE 511.A N SER 506.A OG no hydrogen 2.900 N/A LEU 512.A N TRP 524.A O no hydrogen 2.989 N/A VAL 513.A N ASP 504.A O no hydrogen 2.732 N/A ASN 515.A N HIS 502.A O no hydrogen 2.952 N/A ASN 515.A ND2 SER 514.A O no hydrogen 2.734 N/A ASN 515.A ND2 LEU 550.A O no hydrogen 3.285 N/A SER 516.A OG HIS 496.A ND1 no hydrogen 3.309 N/A GLY 517.A N PHE 499.A O no hydrogen 2.948 N/A TYR 519.A N SER 516.A O no hydrogen 2.866 N/A LEU 522.A N SER 514.A O no hydrogen 3.274 N/A TRP 524.A N LEU 512.A O no hydrogen 2.872 N/A VAL 525.A N LYS 530.A O no hydrogen 2.920 N/A ALA 528.A N VAL 525.A O no hydrogen 2.790 N/A CYS 529.A N PRO 526.A O no hydrogen 2.879 N/A CYS 529.A SG PRO 526.A O no hydrogen 3.376 N/A VAL 532.A N TYR 523.A O no hydrogen 3.026 N/A THR 538.A N SER 534.A O no hydrogen 3.469 N/A THR 538.A OG1 SER 534.A O no hydrogen 3.062 N/A THR 538.A OG1 VAL 535.A O no hydrogen 3.313 N/A ARG 539.A N VAL 535.A O no hydrogen 2.919 N/A ARG 539.A NH1 GLY 10.A O no hydrogen 3.162 N/A ARG 539.A NH1 MET 25.A O no hydrogen 2.794 N/A ARG 539.A NH2 GLU 9.A O no hydrogen 2.895 N/A ILE 541.A N THR 538.A O no hydrogen 3.299 N/A ALA 544.A N TRP 505.A O no hydrogen 2.791 N/A THR 545.A OG1 ASP 504.A OD1 no hydrogen 2.595 N/A THR 547.A N ASP 504.A OD1 no hydrogen 3.043 N/A THR 547.A OG1 ASP 504.A OD1 no hydrogen 3.004 N/A CYS 548.A N ASP 504.A OD2 no hydrogen 2.899 N/A CYS 548.A SG ASP 504.A OD2 no hydrogen 3.334 N/A LEU 550.A N ASN 515.A OD1 no hydrogen 2.959 N/A VAL 554.A N GLY 551.A O no hydrogen 3.130 N/A PHE 555.A N GLY 551.A O no hydrogen 2.663 N/A VAL 557.A N VAL 554.A O no hydrogen 3.296 N/A TRP 558.A NE1 THR 549.A O no hydrogen 2.860 N/A SER 562.A N PRO 559.A O no hydrogen 2.973 N/A SER 562.A OG ASP 563.A O no hydrogen 3.383 N/A SER 562.A OG ASP 566.A OD2 no hydrogen 3.467 N/A ASP 563.A N ASP 566.A OD2 no hydrogen 2.786 N/A THR 565.A N ASP 563.A OD2 no hydrogen 3.166 N/A THR 565.A OG1 ASP 563.A OD2 no hydrogen 2.501 N/A ASP 566.A N ASP 563.A O no hydrogen 2.813 N/A ASN 568.A N GLY 582.A O no hydrogen 2.987 N/A ASN 568.A ND2 ASP 584.A OD1 no hydrogen 3.252 N/A ASN 568.A ND2 VAL 612.A O no hydrogen 2.658 N/A CYS 571.A N SER 580.A O no hydrogen 2.986 N/A ARG 572.A NH1 ALA 573.A O no hydrogen 2.634 N/A ALA 573.A N LEU 578.A O no hydrogen 2.990 N/A HIS 574.A N ASP 621.A OD1 no hydrogen 2.735 N/A HIS 574.A NE2 PHE 617.A O no hydrogen 3.090 N/A GLU 575.A N ASP 621.A OD2 no hydrogen 2.889 N/A LYS 576.A N ASP 621.A OD2 no hydrogen 3.406 N/A LEU 579.A N PHE 591.A O no hydrogen 2.835 N/A SER 580.A N CYS 571.A O no hydrogen 2.917 N/A SER 580.A OG HIS 589.A O no hydrogen 2.783 N/A THR 581.A N HIS 589.A O no hydrogen 3.162 N/A GLY 582.A N ALA 569.A O no hydrogen 3.119 N/A ASP 583.A N LYS 587.A O no hydrogen 3.057 N/A ASP 584.A N ASP 566.A O no hydrogen 2.862 N/A PHE 585.A N ASP 583.A OD1 no hydrogen 2.937 N/A LYS 587.A N ASP 583.A OD1 no hydrogen 2.800 N/A LYS 587.A NZ PHE 585.A O no hydrogen 3.300 N/A VAL 588.A N TYR 605.A O no hydrogen 3.038 N/A HIS 589.A N THR 581.A O no hydrogen 3.031 N/A HIS 589.A NE2 ASP 583.A OD2 no hydrogen 3.184 N/A LEU 590.A N HIS 603.A O no hydrogen 3.030 N/A PHE 591.A N LEU 579.A O no hydrogen 2.711 N/A SER 592.A OG GLU 40.A O no hydrogen 2.839 N/A TYR 593.A N LYS 577.A O no hydrogen 2.718 N/A CYS 595.A N HIS 553.A O no hydrogen 3.124 N/A SER 596.A OG PHE 552.A O no hydrogen 3.299 N/A ARG 599.A NE GLU 560.A OE1 no hydrogen 3.353 N/A ARG 599.A NH2 GLU 2.A OE2 no hydrogen 2.808 N/A ARG 599.A NH2 GLU 560.A OE1 no hydrogen 2.948 N/A ALA 600.A N GLY 556.A O no hydrogen 3.345 N/A SER 602.A OG HIS 589.A ND1 no hydrogen 3.415 N/A HIS 603.A N LEU 590.A O no hydrogen 3.099 N/A TYR 605.A N VAL 588.A O no hydrogen 2.813 N/A HIS 608.A ND1 ASP 631.A OD2 no hydrogen 2.810 N/A HIS 608.A NE2 SER 626.A OG no hydrogen 2.927 N/A SER 609.A N ASP 631.A OD2 no hydrogen 3.163 N/A SER 609.A OG SER 77.A OG no hydrogen 2.898 N/A VAL 612.A N ASP 583.A O no hydrogen 3.133 N/A THR 613.A N THR 627.A O no hydrogen 2.942 N/A THR 613.A OG1 LEU 371.A O no hydrogen 2.604 N/A THR 613.A OG1 THR 627.A O no hydrogen 3.390 N/A THR 613.A OG1 THR 627.A OG1 no hydrogen 2.615 N/A ASN 614.A ND2 TRP 372.A O no hydrogen 3.173 N/A VAL 615.A N ASN 614.A OD1 no hydrogen 2.782 N/A ASP 616.A N ILE 625.A O no hydrogen 3.087 N/A LEU 618.A N HIS 623.A O no hydrogen 2.927 N/A CYS 619.A SG LYS 380.A O no hydrogen 3.404 N/A ASP 621.A N LEU 618.A O no hydrogen 2.882 N/A SER 622.A OG HIS 623.A ND1 no hydrogen 3.022 N/A HIS 623.A ND1 SER 622.A OG no hydrogen 3.022 N/A HIS 623.A NE2 GLU 49.A OE1 no hydrogen 2.929 N/A LEU 624.A N TRP 637.A O no hydrogen 2.563 N/A ILE 625.A N ASP 616.A O no hydrogen 2.855 N/A SER 626.A N MET 635.A O no hydrogen 2.924 N/A SER 626.A OG HIS 608.A NE2 no hydrogen 2.927 N/A SER 626.A OG MET 635.A O no hydrogen 3.567 N/A THR 627.A N ASN 614.A O no hydrogen 2.980 N/A THR 627.A OG1 THR 613.A OG1 no hydrogen 2.615 N/A THR 627.A OG1 ASN 614.A O no hydrogen 3.403 N/A GLY 628.A N SER 633.A O no hydrogen 2.878 N/A ASP 631.A N GLY 628.A O no hydrogen 3.234 N/A THR 632.A N GLY 629.A O no hydrogen 3.086 N/A SER 633.A N ASP 631.A OD1 no hydrogen 2.611 N/A SER 633.A OG ASP 631.A OD1 no hydrogen 2.917 N/A ILE 634.A N TYR 52.A O no hydrogen 3.384 N/A MET 635.A N SER 626.A O no hydrogen 2.994 N/A GLN 636.A N TRP 50.A O no hydrogen 2.675 N/A GLN 636.A NE2 GLU 49.A OE2 no hydrogen 3.203 N/A GLN 636.A NE2 ALA 397.A O no hydrogen 2.926 N/A TRP 637.A N LEU 624.A O no hydrogen 2.723 N/A TRP 637.A NE1 SER 626.A OG no hydrogen 2.657 N/A ARG 638.A N LYS 47.A O no hydrogen 3.007 N/A VAL 639.A N SER 622.A O no hydrogen 3.152 N/A ILE 640.A N ARG 45.A O no hydrogen 2.991 N/A