Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6cq4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG THR 70.A OG1 no hydrogen 3.268 N/A THR 5.A N HIS 8.A O no hydrogen 2.645 N/A THR 5.A OG1 HIS 8.A O no hydrogen 3.557 N/A ASN 7.A ND2 GLU 67.A OE2 no hydrogen 2.645 N/A HIS 8.A ND1 GLU 67.A OE1 no hydrogen 2.929 N/A LEU 9.A N ARG 28.A O no hydrogen 3.074 N/A TRP 10.A N GLN 3.A O no hydrogen 3.321 N/A LEU 16.A N VAL 24.A O no hydrogen 2.853 N/A GLY 19.A N ALA 22.A O no hydrogen 2.991 N/A ASN 23.A N VAL 40.A O no hydrogen 3.514 N/A VAL 24.A N GLY 17.A O no hydrogen 2.942 N/A PHE 25.A N ILE 38.A O no hydrogen 2.730 N/A ARG 26.A N ASP 14.A O no hydrogen 2.848 N/A GLY 27.A N PHE 36.A O no hydrogen 3.042 N/A ARG 28.A N LEU 9.A O no hydrogen 2.954 N/A HIS 29.A N ASP 34.A O no hydrogen 3.063 N/A LYS 30.A N ASN 7.A O no hydrogen 2.554 N/A LYS 30.A NZ THR 5.A O no hydrogen 3.505 N/A LYS 30.A NZ SER 6.A O no hydrogen 3.321 N/A LYS 31.A N HIS 29.A ND1 no hydrogen 2.945 N/A LYS 31.A NZ SER 6.A O no hydrogen 3.484 N/A LYS 31.A NZ ASN 7.A OD1 no hydrogen 2.727 N/A THR 32.A N HIS 29.A ND1 no hydrogen 3.331 N/A THR 32.A OG1 ASP 34.A OD2 no hydrogen 3.310 N/A GLY 33.A N HIS 29.A O no hydrogen 3.238 N/A ASP 34.A N THR 32.A OG1 no hydrogen 3.132 N/A PHE 36.A N GLY 27.A O no hydrogen 2.807 N/A ALA 37.A N MET 79.A O no hydrogen 2.751 N/A ILE 38.A N PHE 25.A O no hydrogen 2.906 N/A LYS 39.A N LEU 77.A O no hydrogen 2.853 N/A LYS 39.A NZ ASP 150.A OD1 no hydrogen 3.442 N/A VAL 40.A N ASN 23.A O no hydrogen 3.128 N/A GLU 48.A N VAL 44.A O no hydrogen 3.398 N/A PHE 49.A N GLN 45.A O no hydrogen 2.944 N/A VAL 51.A N ARG 47.A O no hydrogen 3.130 N/A LEU 52.A N PHE 49.A O no hydrogen 2.974 N/A LYS 53.A N GLU 50.A O no hydrogen 3.307 N/A HIS 57.A NE2 GLY 114.A O no hydrogen 2.674 N/A ASN 59.A ND2 TYR 146.A O no hydrogen 3.527 N/A ILE 60.A N HIS 57.A O no hydrogen 3.403 N/A VAL 61.A N LEU 148.A O no hydrogen 2.780 N/A LYS 62.A N GLU 80.A OE2 no hydrogen 3.408 N/A PHE 64.A N ILE 78.A O no hydrogen 2.847 N/A ALA 65.A N ILE 78.A O no hydrogen 3.478 N/A GLU 67.A N VAL 76.A O no hydrogen 2.874 N/A GLU 69.A N HIS 74.A O no hydrogen 2.841 N/A THR 70.A N SER 4.A O no hydrogen 3.237 N/A THR 70.A OG1 SER 4.A O no hydrogen 3.273 N/A THR 70.A OG1 SER 4.A OG no hydrogen 3.268 N/A THR 70.A OG1 GLU 69.A OE2 no hydrogen 3.187 N/A THR 71.A N GLU 69.A OE2 no hydrogen 3.254 N/A THR 71.A OG1 GLU 69.A OE1 no hydrogen 2.622 N/A THR 71.A OG1 GLU 69.A OE2 no hydrogen 3.020 N/A THR 72.A N GLU 69.A OE1 no hydrogen 2.586 N/A THR 72.A OG1 GLU 69.A OE1 no hydrogen 3.008 N/A LYS 75.A NZ GLU 68.A OE2 no hydrogen 3.315 N/A VAL 76.A N GLU 67.A O no hydrogen 2.587 N/A LEU 77.A N LYS 39.A O no hydrogen 2.899 N/A ILE 78.A N ALA 65.A O no hydrogen 2.900 N/A MET 79.A N ALA 37.A O no hydrogen 2.688 N/A GLU 80.A N LYS 62.A O no hydrogen 3.187 N/A CYS 82.A SG GLU 80.A O no hydrogen 3.734 N/A GLY 85.A N CYS 82.A O no hydrogen 3.037 N/A LEU 87.A N ILE 134.A O no hydrogen 2.617 N/A TYR 88.A N PRO 131.A O no hydrogen 3.099 N/A VAL 90.A N SER 86.A O no hydrogen 3.169 N/A LEU 91.A N LEU 87.A O no hydrogen 2.959 N/A GLU 92.A N TYR 88.A O no hydrogen 3.021 N/A GLU 92.A N THR 89.A O no hydrogen 3.302 N/A GLU 93.A N VAL 90.A O no hydrogen 3.290 N/A SER 95.A OG ASN 96.A OD1 no hydrogen 3.321 N/A ASN 96.A N GLU 93.A O no hydrogen 3.177 N/A ASN 96.A ND2 VAL 90.A O no hydrogen 3.094 N/A ALA 97.A N PRO 94.A O no hydrogen 3.060 N/A GLY 99.A N ASN 96.A O no hydrogen 3.452 N/A LEU 100.A N ALA 175.A O no hydrogen 2.850 N/A PHE 105.A N PRO 101.A O no hydrogen 2.761 N/A LEU 106.A N GLU 102.A O no hydrogen 3.235 N/A ILE 107.A N SER 103.A O no hydrogen 3.286 N/A VAL 108.A N GLU 104.A O no hydrogen 3.199 N/A LEU 109.A N PHE 105.A O no hydrogen 3.159 N/A ARG 110.A N LEU 106.A O no hydrogen 2.973 N/A ASP 111.A N ILE 107.A O no hydrogen 3.013 N/A VAL 112.A N VAL 108.A O no hydrogen 2.884 N/A VAL 113.A N LEU 109.A O no hydrogen 3.081 N/A GLY 114.A N ARG 110.A O no hydrogen 2.866 N/A GLY 115.A N ASP 111.A O no hydrogen 2.761 N/A MET 116.A N VAL 112.A O no hydrogen 3.068 N/A ASN 117.A N VAL 113.A O no hydrogen 3.040 N/A ASN 117.A ND2 GLU 121.A OE2 no hydrogen 3.225 N/A LEU 119.A N GLY 115.A O no hydrogen 3.005 N/A ARG 120.A N MET 116.A O no hydrogen 2.700 N/A ARG 120.A NH1 ASN 117.A OD1 no hydrogen 3.363 N/A GLU 121.A N ASN 117.A O no hydrogen 2.967 N/A ASN 122.A N HIS 118.A O no hydrogen 3.329 N/A ASN 122.A N LEU 119.A O no hydrogen 3.252 N/A GLY 123.A N LEU 119.A O no hydrogen 2.629 N/A ILE 124.A N LEU 119.A O no hydrogen 2.873 N/A HIS 126.A NE2 ASP 150.A O no hydrogen 3.114 N/A ASP 128.A N HIS 126.A O no hydrogen 2.480 N/A ASN 133.A N LYS 130.A O no hydrogen 2.876 N/A ASN 133.A ND2 HIS 126.A NE2 no hydrogen 3.679 N/A ASN 133.A ND2 ASP 150.A O no hydrogen 2.973 N/A ASN 133.A ND2 ASP 150.A OD2 no hydrogen 3.473 N/A ILE 134.A N PRO 131.A O no hydrogen 3.461 N/A MET 135.A N LYS 147.A O no hydrogen 2.728 N/A ARG 136.A N GLY 85.A O no hydrogen 2.836 N/A ARG 136.A NE SER 144.A OG no hydrogen 2.956 N/A ARG 136.A NH2 SER 144.A OG no hydrogen 3.319 N/A VAL 137.A N VAL 145.A O no hydrogen 2.742 N/A GLY 139.A N GLN 143.A O no hydrogen 2.928 N/A GLY 142.A N GLY 139.A O no hydrogen 3.063 N/A GLN 143.A N ASP 141.A OD1 no hydrogen 3.166 N/A SER 144.A OG GLU 104.A OE1 no hydrogen 2.955 N/A SER 144.A OG GLU 104.A OE2 no hydrogen 3.529 N/A VAL 145.A N VAL 137.A O no hydrogen 2.593 N/A TYR 146.A N ASP 111.A OD2 no hydrogen 2.454 N/A TYR 146.A OH GLU 104.A OE1 no hydrogen 2.615 N/A LYS 147.A N MET 135.A O no hydrogen 2.934 N/A LYS 147.A NZ LYS 58.A O no hydrogen 2.507 N/A LEU 148.A N ASN 59.A O no hydrogen 2.947 N/A PHE 151.A N THR 149.A O no hydrogen 3.173 N/A THR 153.A OG1 ASP 128.A OD1 no hydrogen 2.764 N/A THR 153.A OG1 ASP 128.A OD2 no hydrogen 3.524 N/A TYR 156.A OH HIS 174.A ND1 no hydrogen 3.197 N/A ASP 160.A N HIS 158.A ND1 no hydrogen 3.132 N/A GLY 169.A N LEU 165.A O no hydrogen 3.372 N/A VAL 170.A N TRP 166.A O no hydrogen 3.117 N/A THR 171.A N SER 167.A O no hydrogen 2.974 N/A THR 171.A OG1 ILE 129.A O no hydrogen 3.211 N/A THR 171.A OG1 SER 167.A O no hydrogen 2.812 N/A PHE 172.A N ILE 168.A O no hydrogen 3.031 N/A TYR 173.A N GLY 169.A O no hydrogen 3.069 N/A TYR 173.A OH SER 208.A OG no hydrogen 2.400 N/A HIS 174.A N VAL 170.A O no hydrogen 2.962 N/A HIS 174.A ND1 TYR 156.A OH no hydrogen 3.197 N/A ALA 175.A N THR 171.A O no hydrogen 2.825 N/A ALA 176.A N PHE 172.A O no hydrogen 2.929 N/A ALA 176.A N TYR 173.A O no hydrogen 3.275 N/A THR 177.A N TYR 173.A O no hydrogen 2.894 N/A THR 177.A OG1 TYR 173.A O no hydrogen 3.006 N/A GLY 178.A N HIS 174.A O no hydrogen 2.921 N/A SER 179.A N THR 177.A OG1 no hydrogen 2.977 N/A ARG 183.A N GLY 209.A O no hydrogen 3.208 N/A ARG 183.A NH1 LEU 180.A O no hydrogen 3.436 N/A PHE 185.A N GLN 211.A OE1 no hydrogen 2.713 N/A ARG 189.A N GLY 187.A O no hydrogen 2.588 N/A LYS 192.A NZ PRO 188.A O no hydrogen 2.587 N/A GLU 193.A N GLU 193.A OE1 no hydrogen 2.644 N/A MET 195.A N ASN 191.A O no hydrogen 2.969 N/A TYR 196.A N LYS 192.A O no hydrogen 3.010 N/A LYS 197.A N GLU 193.A O no hydrogen 3.074 N/A ILE 198.A N VAL 194.A O no hydrogen 2.767 N/A ILE 199.A N MET 195.A O no hydrogen 3.174 N/A THR 200.A N TYR 196.A O no hydrogen 2.973 N/A THR 200.A OG1 TYR 196.A O no hydrogen 2.872 N/A THR 200.A OG1 LYS 197.A O no hydrogen 3.315 N/A LYS 202.A N ILE 199.A O no hydrogen 3.156 N/A SER 204.A OG GLU 247.A OE1 no hydrogen 3.101 N/A ALA 206.A N PRO 203.A O no hydrogen 3.513 N/A ILE 207.A N SER 221.A O no hydrogen 2.803 N/A SER 208.A N SER 221.A O no hydrogen 3.143 N/A SER 208.A OG TYR 173.A OH no hydrogen 2.400 N/A GLY 209.A N PRO 181.A O no hydrogen 2.832 N/A VAL 210.A N ASP 219.A O no hydrogen 3.172 N/A GLN 211.A N ARG 183.A O no hydrogen 3.165 N/A GLY 216.A N ALA 213.A O no hydrogen 2.972 N/A ASP 219.A N VAL 210.A O no hydrogen 2.922 N/A SER 221.A OG ASP 223.A O no hydrogen 3.345 N/A MET 224.A N ASP 223.A OD1 no hydrogen 2.396 N/A CYS 228.A N PRO 225.A O no hydrogen 3.292 N/A CYS 228.A SG ALA 176.A O no hydrogen 3.359 N/A SER 231.A N GLU 102.A OE2 no hydrogen 2.877 N/A SER 231.A OG GLU 102.A OE1 no hydrogen 2.532 N/A SER 231.A OG GLU 102.A OE2 no hydrogen 3.454 N/A ARG 232.A NH1 ASP 223.A OD2 no hydrogen 3.246 N/A LEU 234.A N SER 231.A O no hydrogen 3.031 N/A LEU 234.A N SER 231.A OG no hydrogen 3.371 N/A GLN 235.A N SER 231.A O no hydrogen 3.052 N/A GLN 235.A NE2 LEU 230.A O no hydrogen 3.045 N/A VAL 236.A N ARG 232.A O no hydrogen 3.243 N/A LEU 238.A N LEU 234.A O no hydrogen 2.827 N/A THR 239.A N GLN 235.A O no hydrogen 2.980 N/A THR 239.A OG1 GLN 235.A O no hydrogen 2.963 N/A LEU 242.A N LEU 238.A O no hydrogen 3.310 N/A ALA 243.A N THR 239.A O no hydrogen 3.037 N/A ASN 244.A N PRO 240.A O no hydrogen 3.276 N/A ILE 245.A N LEU 242.A O no hydrogen 3.017 N/A LYS 252.A N ASP 249.A O no hydrogen 3.021 N/A PHE 259.A N GLY 255.A O no hydrogen 3.003 N/A PHE 260.A N PHE 256.A O no hydrogen 2.534 N/A ALA 261.A N ASP 257.A O no hydrogen 2.950 N/A GLU 262.A N GLN 258.A O no hydrogen 3.062 N/A THR 263.A N PHE 259.A O no hydrogen 2.936 N/A THR 263.A OG1 PHE 259.A O no hydrogen 2.669 N/A THR 263.A OG1 PHE 260.A O no hydrogen 3.112 N/A SER 264.A N PHE 260.A O no hydrogen 3.013 N/A SER 264.A OG HIS 268.A NE2 no hydrogen 2.886 N/A ASP 265.A N ALA 261.A O no hydrogen 3.020 N/A ILE 266.A N GLU 262.A O no hydrogen 3.266 N/A ILE 266.A N THR 263.A O no hydrogen 3.080 N/A LEU 267.A N THR 263.A O no hydrogen 3.128 N/A HIS 268.A N SER 264.A O no hydrogen 3.179 N/A ARG 269.A N ILE 266.A O no hydrogen 3.309 N/A ARG 269.A NE ASP 265.A OD2 no hydrogen 3.551 N/A ARG 269.A NH1 TYR 286.A O no hydrogen 2.481 N/A MET 270.A N ILE 287.A O no hydrogen 2.861 N/A ILE 272.A N ILE 285.A O no hydrogen 3.121 N/A HIS 273.A N THR 334.A OG1 no hydrogen 3.010 N/A VAL 274.A N HIS 283.A O no hydrogen 3.246 N/A PHE 275.A N ILE 340.A O no hydrogen 3.366 N/A SER 276.A N THR 281.A O no hydrogen 2.694 N/A SER 276.A OG GLN 279.A OE1 no hydrogen 2.948 N/A LEU 277.A N VAL 342.A O no hydrogen 3.304 N/A GLN 278.A NE2 SER 344.A O no hydrogen 2.520 N/A THR 281.A N SER 276.A O no hydrogen 3.210 N/A THR 281.A OG1 HIS 283.A NE2 no hydrogen 2.489 N/A ALA 282.A N TYR 396.A OH no hydrogen 3.140 N/A HIS 283.A N VAL 274.A O no hydrogen 2.736 N/A HIS 283.A NE2 THR 281.A OG1 no hydrogen 2.489 N/A ILE 285.A N ILE 272.A O no hydrogen 3.062 N/A TYR 286.A OH GLU 102.A OE1 no hydrogen 2.357 N/A ILE 287.A N MET 270.A O no hydrogen 3.112 N/A HIS 288.A N ASN 291.A OD1 no hydrogen 3.250 N/A HIS 288.A NE2 ASP 265.A OD1 no hydrogen 2.485 N/A ASN 291.A N HIS 288.A O no hydrogen 3.318 N/A THR 294.A OG1 PRO 324.A O no hydrogen 2.958 N/A PHE 296.A N THR 292.A O no hydrogen 3.251 N/A HIS 297.A N ALA 293.A O no hydrogen 2.914 N/A HIS 297.A ND1 GLN 311.A OE1 no hydrogen 2.486 N/A GLU 298.A N THR 294.A O no hydrogen 3.053 N/A LEU 299.A N ILE 295.A O no hydrogen 3.008 N/A VAL 300.A N PHE 296.A O no hydrogen 3.005 N/A TYR 301.A N HIS 297.A O no hydrogen 2.999 N/A LYS 302.A N GLU 298.A O no hydrogen 2.990 N/A GLN 303.A N VAL 300.A O no hydrogen 3.365 N/A THR 304.A N VAL 300.A O no hydrogen 2.834 N/A THR 304.A N TYR 301.A O no hydrogen 3.310 N/A THR 304.A OG1 VAL 300.A O no hydrogen 2.317 N/A LYS 305.A N TYR 301.A O no hydrogen 2.627 N/A ASN 310.A N ILE 307.A O no hydrogen 3.041 N/A GLN 311.A N SER 308.A O no hydrogen 3.267 N/A GLN 311.A NE2 HIS 297.A O no hydrogen 3.049 N/A GLN 311.A NE2 ILE 306.A O no hydrogen 3.152 N/A GLU 312.A N VAL 343.A O no hydrogen 2.799 N/A ILE 314.A N PHE 341.A O no hydrogen 2.828 N/A TYR 315.A N ARG 318.A O no hydrogen 2.848 N/A TYR 315.A OH LYS 333.A O no hydrogen 3.087 N/A ARG 318.A N TYR 315.A O no hydrogen 3.197 N/A LEU 320.A N LEU 313.A O no hydrogen 2.729 N/A ARG 326.A N GLU 323.A O no hydrogen 2.992 N/A ALA 328.A N ASN 291.A O no hydrogen 2.925 N/A GLN 329.A N SER 289.A O no hydrogen 3.129 N/A HIS 330.A N LEU 327.A O no hydrogen 3.297 N/A PHE 331.A N ALA 328.A O no hydrogen 3.154 N/A THR 335.A N ASN 338.A O no hydrogen 3.403 N/A GLU 337.A N THR 335.A OG1 no hydrogen 3.310 N/A ASN 338.A N THR 335.A O no hydrogen 3.270 N/A ILE 340.A N HIS 273.A O no hydrogen 2.811 N/A PHE 341.A N ILE 314.A O no hydrogen 3.095 N/A VAL 342.A N PHE 275.A O no hydrogen 3.217 N/A VAL 343.A N GLU 312.A O no hydrogen 2.810 N/A SER 344.A OG ASN 310.A O no hydrogen 3.522 N/A GLU 346.A N SER 344.A OG no hydrogen 3.368 N/A ILE 351.A N GLN 279.A O no hydrogen 3.326 N/A GLY 352.A N GLN 279.A O no hydrogen 2.985 N/A LEU 353.A N TYR 556.A OH no hydrogen 2.927 N/A GLU 356.A N TYR 385.A OH no hydrogen 2.894 N/A ASP 370.A N ASP 368.A OD1 no hydrogen 3.295 N/A ASP 372.A N ASP 368.A O no hydrogen 2.750 N/A ALA 373.A N LEU 369.A O no hydrogen 3.238 N/A SER 374.A N ASP 370.A O no hydrogen 3.040 N/A SER 374.A OG ASP 370.A O no hydrogen 3.367 N/A MET 375.A N GLY 371.A O no hydrogen 2.820 N/A ALA 376.A N ASP 372.A O no hydrogen 2.840 N/A LYS 377.A N ALA 373.A O no hydrogen 3.034 N/A LYS 377.A NZ GLU 92.A OE1 no hydrogen 2.349 N/A ALA 378.A N SER 374.A O no hydrogen 3.413 N/A ILE 379.A N MET 375.A O no hydrogen 3.128 N/A THR 380.A N ALA 376.A O no hydrogen 3.164 N/A THR 380.A OG1 ALA 376.A O no hydrogen 2.504 N/A GLY 381.A N LYS 377.A O no hydrogen 3.112 N/A VAL 382.A N ALA 378.A O no hydrogen 3.008 N/A VAL 383.A N ILE 379.A O no hydrogen 3.312 N/A CYS 384.A N THR 380.A O no hydrogen 3.035 N/A CYS 384.A SG THR 380.A O no hydrogen 3.734 N/A TYR 385.A N GLY 381.A O no hydrogen 2.984 N/A ALA 386.A N VAL 382.A O no hydrogen 2.862 N/A CYS 387.A N VAL 383.A O no hydrogen 2.641 N/A CYS 387.A SG VAL 496.A O no hydrogen 3.865 N/A ARG 388.A N CYS 384.A O no hydrogen 2.689 N/A ARG 388.A NH2 SER 95.A O no hydrogen 3.115 N/A ILE 389.A N TYR 385.A O no hydrogen 2.813 N/A ALA 390.A N ALA 386.A O no hydrogen 3.036 N/A SER 391.A N CYS 387.A O no hydrogen 3.286 N/A SER 391.A OG ARG 388.A O no hydrogen 2.908 N/A THR 392.A N ARG 388.A O no hydrogen 3.062 N/A THR 392.A OG1 ARG 388.A O no hydrogen 2.772 N/A LEU 393.A N ILE 389.A O no hydrogen 2.785 N/A LEU 394.A N ALA 390.A O no hydrogen 2.969 N/A LEU 395.A N SER 391.A O no hydrogen 2.967 N/A TYR 396.A N THR 392.A O no hydrogen 2.944 N/A GLN 397.A N LEU 393.A O no hydrogen 3.134 N/A GLU 398.A N LEU 394.A O no hydrogen 2.976 N/A LEU 399.A N LEU 395.A O no hydrogen 2.743 N/A MET 400.A N TYR 396.A O no hydrogen 2.889 N/A ARG 401.A N GLN 397.A O no hydrogen 2.929 N/A ARG 401.A NE ALA 484.A O no hydrogen 2.801 N/A ARG 401.A NH2 GLN 397.A OE1 no hydrogen 3.283 N/A ARG 401.A NH2 THR 489.A O no hydrogen 2.632 N/A LYS 402.A N GLU 398.A O no hydrogen 3.277 N/A GLY 403.A N LEU 399.A O no hydrogen 3.009 N/A ILE 404.A N MET 400.A O no hydrogen 2.892 N/A ARG 405.A N ARG 401.A O no hydrogen 2.849 N/A TRP 406.A N LYS 402.A O no hydrogen 2.832 N/A LEU 407.A N GLY 403.A O no hydrogen 2.946 N/A ILE 408.A N ILE 404.A O no hydrogen 3.101 N/A LEU 410.A N TRP 406.A O no hydrogen 2.909 N/A ILE 411.A N LEU 407.A O no hydrogen 2.906 N/A LYS 412.A N ILE 408.A O no hydrogen 2.923 N/A ASP 413.A N GLU 409.A O no hydrogen 2.912 N/A ASP 413.A N LEU 410.A O no hydrogen 3.228 N/A ASP 414.A N LEU 410.A O no hydrogen 3.043 N/A TYR 415.A N ILE 411.A O no hydrogen 2.804 N/A ASN 416.A N LYS 412.A O no hydrogen 3.165 N/A GLU 417.A N ASP 413.A O no hydrogen 3.018 N/A THR 418.A N ASP 414.A O no hydrogen 3.210 N/A THR 418.A OG1 ASP 414.A O no hydrogen 2.895 N/A THR 418.A OG1 THR 581.A OG1 no hydrogen 2.833 N/A VAL 419.A N TYR 415.A O no hydrogen 3.169 N/A HIS 420.A N ASN 416.A O no hydrogen 3.262 N/A LYS 421.A N GLU 417.A O no hydrogen 3.206 N/A LYS 421.A NZ GLU 424.A OE1 no hydrogen 2.986 N/A LYS 421.A NZ GLU 588.A OE2 no hydrogen 3.169 N/A LYS 422.A N THR 418.A O no hydrogen 2.838 N/A THR 423.A N VAL 419.A O no hydrogen 2.899 N/A THR 423.A OG1 VAL 419.A O no hydrogen 3.315 N/A THR 423.A OG1 HIS 420.A O no hydrogen 2.717 N/A GLU 424.A N HIS 420.A O no hydrogen 3.165 N/A VAL 425.A N LYS 421.A O no hydrogen 3.202 N/A VAL 426.A N LYS 422.A O no hydrogen 2.771 N/A ILE 427.A N THR 423.A O no hydrogen 3.067 N/A THR 428.A N GLU 424.A O no hydrogen 3.222 N/A THR 428.A OG1 GLU 424.A O no hydrogen 2.918 N/A LEU 429.A N VAL 425.A O no hydrogen 2.753 N/A ASP 430.A N VAL 426.A O no hydrogen 2.963 N/A PHE 431.A N ILE 427.A O no hydrogen 3.052 N/A CYS 432.A N LEU 429.A O no hydrogen 3.226 N/A CYS 432.A SG THR 428.A O no hydrogen 3.184 N/A ILE 433.A N LEU 429.A O no hydrogen 2.735 N/A ARG 434.A N ASP 430.A O no hydrogen 3.092 N/A ARG 434.A NE ASP 430.A O no hydrogen 3.583 N/A LYS 438.A N ARG 434.A O no hydrogen 3.061 N/A THR 439.A OG1 ILE 436.A O no hydrogen 2.869 N/A VAL 440.A N ILE 436.A O no hydrogen 2.950 N/A ILE 445.A N LEU 442.A O no hydrogen 3.338 N/A SER 446.A N LEU 442.A O no hydrogen 2.824 N/A SER 446.A OG LEU 442.A O no hydrogen 2.795 N/A ASP 447.A N GLY 443.A O no hydrogen 3.134 N/A ILE 448.A N ILE 445.A O no hydrogen 3.100 N/A HIS 449.A N ILE 445.A O no hydrogen 3.265 N/A HIS 449.A NE2 GLU 437.A OE2 no hydrogen 2.284 N/A THR 450.A N SER 446.A O no hydrogen 3.089 N/A THR 450.A OG1 SER 446.A O no hydrogen 3.115 N/A THR 450.A OG1 ASP 447.A O no hydrogen 2.811 N/A LYS 451.A N ILE 448.A O no hydrogen 2.933 N/A LEU 452.A N ILE 448.A O no hydrogen 2.392 N/A LEU 453.A N HIS 449.A O no hydrogen 2.806 N/A ARG 454.A NE THR 450.A O no hydrogen 3.252 N/A LEU 455.A N LYS 451.A O no hydrogen 3.188 N/A SER 456.A N LEU 452.A O no hydrogen 2.994 N/A SER 456.A OG LEU 453.A O no hydrogen 3.285 N/A SER 457.A N LEU 453.A O no hydrogen 3.128 N/A SER 457.A OG LEU 453.A O no hydrogen 3.018 N/A SER 457.A OG ARG 454.A O no hydrogen 2.727 N/A SER 458.A N ARG 454.A O no hydrogen 3.090 N/A SER 458.A OG ARG 454.A O no hydrogen 3.147 N/A SER 458.A OG LEU 455.A O no hydrogen 3.169 N/A GLN 459.A N LEU 455.A O no hydrogen 2.675 N/A GLY 460.A N SER 456.A O no hydrogen 3.178 N/A THR 461.A N SER 457.A O no hydrogen 3.143 N/A THR 461.A OG1 SER 458.A O no hydrogen 2.555 N/A ILE 462.A N SER 458.A O no hydrogen 3.302 N/A GLU 463.A N GLN 459.A O no hydrogen 3.225 N/A THR 464.A N GLY 460.A O no hydrogen 2.899 N/A THR 464.A OG1 GLY 460.A O no hydrogen 3.496 N/A THR 464.A OG1 THR 461.A O no hydrogen 2.868 N/A SER 465.A N THR 461.A O no hydrogen 3.018 N/A SER 465.A OG THR 461.A O no hydrogen 2.559 N/A SER 465.A OG ILE 462.A O no hydrogen 3.107 N/A LEU 466.A N GLU 463.A O no hydrogen 3.265 N/A GLN 467.A N GLU 463.A O no hydrogen 2.966 N/A GLN 467.A NE2 GLU 463.A OE2 no hydrogen 2.682 N/A ASP 468.A N THR 464.A O no hydrogen 3.128 N/A ASP 470.A N LEU 466.A O no hydrogen 2.840 N/A SER 471.A N GLN 467.A O no hydrogen 2.886 N/A ARG 472.A N ILE 469.A O no hydrogen 2.910 N/A LEU 473.A N ILE 469.A O no hydrogen 2.825 N/A SER 474.A OG SER 471.A O no hydrogen 2.689 N/A GLY 477.A N SER 474.A O no hydrogen 3.087 N/A SER 478.A OG GLY 477.A O no hydrogen 2.545 N/A GLN 486.A N TRP 483.A O no hydrogen 2.991 N/A THR 489.A N GLN 397.A OE1 no hydrogen 2.607 N/A THR 489.A OG1 GLN 397.A OE1 no hydrogen 3.336 N/A HIS 490.A N ASP 493.A OD1 no hydrogen 3.125 N/A ASP 493.A N HIS 490.A O no hydrogen 3.006 N/A ARG 494.A N PRO 491.A O no hydrogen 3.209 N/A GLU 497.A N GLU 497.A OE1 no hydrogen 2.602 N/A LYS 498.A N ARG 494.A O no hydrogen 3.047 N/A LYS 498.A NZ ASP 493.A O no hydrogen 3.299 N/A LEU 499.A N ASN 495.A O no hydrogen 3.160 N/A GLN 500.A N VAL 496.A O no hydrogen 3.047 N/A VAL 501.A N GLU 497.A O no hydrogen 2.934 N/A LEU 503.A N LEU 499.A O no hydrogen 2.992 N/A ASN 504.A N GLN 500.A O no hydrogen 3.122 N/A CYS 505.A N VAL 501.A O no hydrogen 3.270 N/A CYS 505.A SG VAL 501.A O no hydrogen 3.330 N/A MET 506.A N LEU 502.A O no hydrogen 3.059 N/A THR 507.A N LEU 503.A O no hydrogen 2.862 N/A THR 507.A OG1 LEU 503.A O no hydrogen 2.737 N/A GLU 508.A N ASN 504.A O no hydrogen 2.877 N/A ILE 509.A N CYS 505.A O no hydrogen 3.122 N/A TYR 510.A N MET 506.A O no hydrogen 2.915 N/A TYR 510.A OH GLU 92.A O no hydrogen 3.085 N/A TYR 511.A N THR 507.A O no hydrogen 2.694 N/A GLN 512.A N GLU 508.A O no hydrogen 2.869 N/A GLN 512.A NE2 ASP 516.A OD1 no hydrogen 2.652 N/A PHE 513.A N ILE 509.A O no hydrogen 2.849 N/A LYS 514.A N TYR 510.A O no hydrogen 2.732 N/A LYS 515.A N TYR 511.A O no hydrogen 3.031 N/A ASP 516.A N GLN 512.A O no hydrogen 2.713 N/A LYS 517.A N PHE 513.A O no hydrogen 3.060 N/A GLU 519.A N LYS 515.A O no hydrogen 3.395 N/A GLU 526.A N GLU 526.A OE1 no hydrogen 2.485 N/A GLU 527.A N ALA 523.A O no hydrogen 2.627 N/A GLN 528.A N TYR 524.A O no hydrogen 3.423 N/A GLN 528.A NE2 TYR 524.A O no hydrogen 3.075 N/A ILE 529.A N ASN 525.A O no hydrogen 3.401 N/A HIS 530.A N GLU 526.A O no hydrogen 3.085 N/A HIS 530.A ND1 ASP 516.A OD2 no hydrogen 2.899 N/A HIS 530.A NE2 ASP 372.A OD2 no hydrogen 2.826 N/A LYS 531.A N GLU 527.A O no hydrogen 3.019 N/A LYS 531.A NZ GLU 527.A OE2 no hydrogen 3.354 N/A PHE 532.A N GLN 528.A O no hydrogen 2.711 N/A ASP 533.A N ILE 529.A O no hydrogen 2.912 N/A LYS 534.A N HIS 530.A O no hydrogen 3.132 N/A LYS 534.A NZ HIS 364.A O no hydrogen 2.758 N/A LYS 534.A NZ ASP 372.A OD1 no hydrogen 2.700 N/A LYS 534.A NZ ASP 372.A OD2 no hydrogen 3.223 N/A GLN 535.A N LYS 531.A O no hydrogen 3.184 N/A GLN 535.A NE2 TYR 539.A OH no hydrogen 3.092 N/A LYS 536.A N PHE 532.A O no hydrogen 3.144 N/A LEU 537.A N ASP 533.A O no hydrogen 2.920 N/A TYR 538.A N GLN 535.A O no hydrogen 3.166 N/A TYR 539.A N GLN 535.A O no hydrogen 3.176 N/A HIS 540.A N LYS 536.A O no hydrogen 2.960 N/A ALA 541.A N LEU 537.A O no hydrogen 3.289 N/A THR 542.A N TYR 538.A O no hydrogen 2.809 N/A THR 542.A OG1 TYR 538.A O no hydrogen 2.993 N/A LYS 543.A N TYR 539.A O no hydrogen 2.983 N/A ALA 544.A N HIS 540.A O no hydrogen 3.044 N/A MET 545.A N ALA 541.A O no hydrogen 3.030 N/A THR 546.A N THR 542.A O no hydrogen 3.092 N/A THR 546.A OG1 THR 542.A O no hydrogen 3.040 N/A HIS 547.A N LYS 543.A O no hydrogen 3.234 N/A PHE 548.A N ALA 544.A O no hydrogen 2.776 N/A THR 549.A N MET 545.A O no hydrogen 2.941 N/A THR 549.A OG1 MET 545.A O no hydrogen 3.011 N/A THR 549.A OG1 ASP 550.A OD1 no hydrogen 2.709 N/A ASP 550.A N THR 546.A O no hydrogen 2.929 N/A CYS 552.A SG HIS 547.A O no hydrogen 3.959 N/A VAL 553.A N PHE 548.A O no hydrogen 3.010 N/A LYS 554.A N THR 549.A O no hydrogen 3.395 N/A LYS 555.A N GLU 551.A O no hydrogen 3.279 N/A LYS 555.A NZ GLU 551.A OE2 no hydrogen 2.529 N/A TYR 556.A N CYS 552.A O no hydrogen 3.136 N/A GLU 557.A N VAL 553.A O no hydrogen 2.780 N/A ALA 558.A N LYS 554.A O no hydrogen 2.963 N/A PHE 559.A N LYS 555.A O no hydrogen 2.992 N/A LEU 560.A N TYR 556.A O no hydrogen 2.763 N/A ASN 561.A N GLU 557.A O no hydrogen 2.980 N/A LYS 562.A N ALA 558.A O no hydrogen 3.051 N/A SER 563.A N PHE 559.A O no hydrogen 2.847 N/A SER 563.A OG PHE 559.A O no hydrogen 2.632 N/A GLU 564.A N LEU 560.A O no hydrogen 2.963 N/A TRP 566.A N LYS 562.A O no hydrogen 3.236 N/A TRP 566.A NE1 LEU 479.A O no hydrogen 3.179 N/A ILE 567.A N SER 563.A O no hydrogen 3.022 N/A LYS 569.A N GLU 565.A O no hydrogen 3.162 N/A LYS 569.A NZ SER 478.A O no hydrogen 3.298 N/A MET 570.A N TRP 566.A O no hydrogen 2.877 N/A LEU 571.A N ILE 567.A O no hydrogen 2.769 N/A HIS 572.A N ARG 568.A O no hydrogen 2.869 N/A LEU 573.A N LYS 569.A O no hydrogen 3.225 N/A ARG 574.A N MET 570.A O no hydrogen 3.049 N/A ARG 574.A NH2 GLU 312.A OE1 no hydrogen 3.134 N/A LYS 575.A N LEU 571.A O no hydrogen 3.320 N/A GLN 576.A N HIS 572.A O no hydrogen 3.255 N/A LEU 577.A N LEU 573.A O no hydrogen 3.037 N/A LEU 578.A N ARG 574.A O no hydrogen 3.039 N/A SER 579.A N LYS 575.A O no hydrogen 3.094 N/A LEU 580.A N GLN 576.A O no hydrogen 2.751 N/A THR 581.A N LEU 577.A O no hydrogen 2.886 N/A THR 581.A OG1 THR 418.A OG1 no hydrogen 2.833 N/A THR 581.A OG1 LEU 577.A O no hydrogen 2.622 N/A ASN 582.A N LEU 578.A O no hydrogen 2.871 N/A GLN 583.A N SER 579.A O no hydrogen 2.788 N/A CYS 584.A N THR 581.A O no hydrogen 2.966 N/A CYS 584.A SG LEU 580.A O no hydrogen 3.355 N/A PHE 585.A N THR 581.A O no hydrogen 3.124 N/A PHE 585.A N ASN 582.A O no hydrogen 3.253 N/A ASP 586.A N ASN 582.A O no hydrogen 3.181 N/A GLU 588.A N CYS 584.A O no hydrogen 3.157 N/A GLU 589.A N PHE 585.A O no hydrogen 3.155 N/A GLU 590.A N ASP 586.A O no hydrogen 3.054 N/A VAL 591.A N ILE 587.A O no hydrogen 3.045 N/A SER 592.A N GLU 589.A O no hydrogen 3.128 N/A SER 592.A OG GLU 589.A O no hydrogen 2.362 N/A LYS 593.A N GLU 589.A O no hydrogen 3.255 N/A GLN 595.A N VAL 591.A O no hydrogen 3.119 N/A GLN 595.A NE2 GLU 596.A OE2 no hydrogen 3.280 N/A THR 598.A OG1 GLU 444.A OE2 no hydrogen 3.263 N/A ASN 599.A ND2 ASN 435.A OD1 no hydrogen 2.565 N/A GLU 603.A N GLN 602.A OE1 no hydrogen 3.059 N/A THR 604.A N GLU 603.A OE2 no hydrogen 2.960 N/A