Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7bss_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N CYS 185.A O no hydrogen 2.743 N/A THR 1.A N GLU 186.A OE2 no hydrogen 2.688 N/A VAL 4.A N ILE 183.A O no hydrogen 2.856 N/A GLN 12.A NE2 PHE 14.A O no hydrogen 2.371 N/A CYS 15.A N GLU 241.A OE1 no hydrogen 3.403 N/A CYS 15.A SG ASP 16.A OD2 no hydrogen 3.064 N/A ASN 17.A ND2 ASN 17.A O no hydrogen 2.771 N/A LYS 23.A N ASP 84.A OD2 no hydrogen 2.937 N/A TYR 24.A OH GLU 36.A OE1 no hydrogen 2.977 N/A ASN 28.A N THR 25.A O no hydrogen 2.619 N/A ASN 28.A ND2 THR 25.A O no hydrogen 3.126 N/A ASN 28.A ND2 THR 25.A OG1 no hydrogen 2.589 N/A LYS 32.A N PHE 29.A O no hydrogen 3.145 N/A ASN 33.A N PHE 29.A O no hydrogen 2.836 N/A LEU 34.A N LEU 30.A O no hydrogen 2.971 N/A GLN 37.A N ASN 33.A O no hydrogen 2.997 N/A PHE 38.A N LEU 34.A O no hydrogen 3.227 N/A ARG 40.A N GLN 37.A O no hydrogen 3.160 N/A ASN 43.A N ARG 40.A O no hydrogen 3.309 N/A PHE 44.A N ARG 40.A O no hydrogen 2.858 N/A TYR 45.A N ILE 41.A O no hydrogen 2.724 N/A TYR 45.A OH ASN 326.A O no hydrogen 2.869 N/A LEU 47.A N PHE 44.A O no hydrogen 3.184 N/A ILE 48.A N PHE 44.A O no hydrogen 3.034 N/A ILE 49.A N TYR 45.A O no hydrogen 3.279 N/A PHE 50.A N PHE 46.A O no hydrogen 3.330 N/A LEU 51.A N LEU 47.A O no hydrogen 2.924 N/A VAL 52.A N ILE 48.A O no hydrogen 3.045 N/A GLN 53.A N ILE 49.A O no hydrogen 2.864 N/A GLN 53.A NE2 THR 60.A OG1 no hydrogen 3.077 N/A VAL 54.A N LEU 51.A O no hydrogen 3.279 N/A THR 55.A N LEU 51.A O no hydrogen 3.252 N/A THR 55.A OG1 LEU 51.A O no hydrogen 3.551 N/A VAL 56.A N VAL 52.A O no hydrogen 3.102 N/A THR 58.A OG1 THR 60.A O no hydrogen 3.548 N/A THR 64.A N SER 61.A O no hydrogen 3.189 N/A THR 64.A OG1 SER 61.A O no hydrogen 2.988 N/A SER 65.A N PRO 62.A O no hydrogen 3.338 N/A LEU 67.A N VAL 63.A O no hydrogen 3.102 N/A PHE 70.A N GLY 66.A O no hydrogen 3.147 N/A PHE 71.A N LEU 67.A O no hydrogen 2.968 N/A VAL 72.A N PRO 68.A O no hydrogen 3.260 N/A VAL 72.A N LEU 69.A O no hydrogen 3.241 N/A ILE 73.A N LEU 69.A O no hydrogen 2.912 N/A THR 74.A N PHE 70.A O no hydrogen 3.009 N/A THR 74.A OG1 PHE 70.A O no hydrogen 2.409 N/A VAL 75.A N PHE 71.A O no hydrogen 3.362 N/A THR 76.A N VAL 72.A O no hydrogen 3.215 N/A THR 76.A OG1 VAL 72.A O no hydrogen 2.364 N/A ALA 77.A N THR 74.A O no hydrogen 3.050 N/A ILE 78.A N THR 74.A O no hydrogen 2.980 N/A LYS 79.A N VAL 75.A O no hydrogen 3.175 N/A LYS 79.A NZ GLU 338.A OE1 no hydrogen 2.736 N/A LYS 79.A NZ GLU 338.A OE2 no hydrogen 3.287 N/A GLY 81.A N ALA 77.A O no hydrogen 2.375 N/A TYR 82.A N ILE 78.A O no hydrogen 3.132 N/A GLU 83.A N LYS 79.A O no hydrogen 2.773 N/A ASP 84.A N GLY 81.A O no hydrogen 2.724 N/A TRP 85.A N GLY 81.A O no hydrogen 2.656 N/A LEU 86.A N TYR 82.A O no hydrogen 3.248 N/A ARG 87.A NE SER 21.A OG no hydrogen 3.426 N/A ARG 89.A N TRP 85.A O no hydrogen 3.145 N/A ALA 90.A N LEU 86.A O no hydrogen 2.359 N/A ASP 91.A N ARG 87.A O no hydrogen 3.082 N/A ASP 91.A N HIS 88.A O no hydrogen 2.891 N/A ASN 92.A N HIS 88.A O no hydrogen 2.396 N/A VAL 94.A N ASP 91.A O no hydrogen 2.782 N/A ASN 95.A N ASP 91.A O no hydrogen 2.871 N/A SER 97.A OG GLU 93.A O no hydrogen 2.534 N/A VAL 99.A N LYS 110.A O no hydrogen 2.975 N/A ILE 101.A N VAL 108.A O no hydrogen 2.499 N/A ILE 102.A N VAL 120.A O no hydrogen 3.239 N/A GLU 103.A N LYS 106.A O no hydrogen 3.139 N/A VAL 108.A N ILE 101.A O no hydrogen 2.780 N/A LYS 114.A N GLU 111.A O no hydrogen 2.923 N/A LYS 116.A N ASP 119.A OD1 no hydrogen 3.322 N/A GLY 118.A N ALA 235.A O no hydrogen 3.029 N/A VAL 121.A N GLY 233.A O no hydrogen 3.139 N/A GLU 122.A N TYR 100.A O no hydrogen 3.286 N/A PHE 129.A N ALA 223.A O no hydrogen 3.409 N/A ASP 132.A N TYR 237.A O no hydrogen 2.990 N/A LEU 133.A N LEU 219.A O no hydrogen 2.770 N/A ILE 134.A N VAL 234.A O no hydrogen 2.637 N/A LEU 135.A N ASN 217.A O no hydrogen 3.373 N/A SER 137.A N TYR 232.A O no hydrogen 3.465 N/A SER 137.A OG LEU 136.A O no hydrogen 2.534 N/A SER 137.A OG THR 167.A O no hydrogen 2.111 N/A CYS 139.A SG LYS 230.A O no hydrogen 3.208 N/A THR 140.A OG1 THR 141.A O no hydrogen 3.438 N/A CYS 145.A N HIS 161.A O no hydrogen 3.204 N/A VAL 147.A N LYS 159.A O no hydrogen 3.402 N/A THR 148.A OG1 ASN 157.A O no hydrogen 2.700 N/A THR 149.A OG1 ASP 153.A OD1 no hydrogen 2.219 N/A GLU 155.A N ASP 153.A O no hydrogen 2.687 N/A LYS 159.A N ASN 157.A O no hydrogen 2.964 N/A LYS 159.A NZ THR 160.A O no hydrogen 3.018 N/A HIS 161.A N CYS 145.A O no hydrogen 3.227 N/A ALA 163.A N GLY 143.A O no hydrogen 2.585 N/A VAL 164.A N LEU 135.A O no hydrogen 3.180 N/A THR 167.A N VAL 164.A O no hydrogen 2.983 N/A LEU 170.A N THR 167.A O no hydrogen 3.039 N/A CYS 171.A SG SER 138.A O no hydrogen 4.010 N/A CYS 171.A SG CYS 139.A O no hydrogen 3.208 N/A CYS 171.A SG ILE 168.A O no hydrogen 3.690 N/A CYS 171.A SG ALA 169.A O no hydrogen 4.041 N/A THR 172.A OG1 CYS 171.A O no hydrogen 2.442 N/A ASP 177.A N GLU 174.A O no hydrogen 3.360 N/A THR 178.A N ILE 176.A O no hydrogen 2.730 N/A THR 178.A OG1 ASP 177.A O no hydrogen 2.581 N/A ARG 180.A NH1 PRO 10.A O no hydrogen 2.379 N/A ARG 180.A NH2 PRO 10.A O no hydrogen 2.928 N/A ARG 180.A NH2 VAL 11.A O no hydrogen 2.597 N/A ILE 183.A N VAL 4.A O no hydrogen 3.131 N/A GLU 184.A N ARG 198.A O no hydrogen 3.011 N/A CYS 185.A SG ILE 183.A O no hydrogen 3.873 N/A GLN 187.A NE2 THR 1.A OG1 no hydrogen 3.005 N/A ARG 198.A NE GLU 184.A OE1 no hydrogen 2.923 N/A ARG 198.A NE GLU 184.A OE2 no hydrogen 3.278 N/A ASN 200.A N ALA 182.A O no hydrogen 2.953 N/A TYR 202.A N ARG 180.A O no hydrogen 2.727 N/A LEU 206.A N SER 203.A OG no hydrogen 3.156 N/A ARG 211.A N VAL 209.A O no hydrogen 2.803 N/A LEU 213.A N ARG 211.A O no hydrogen 2.667 N/A GLY 214.A N GLU 216.A OE1 no hydrogen 2.972 N/A GLY 214.A N GLU 216.A OE2 no hydrogen 2.733 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 2.544 N/A ASN 217.A N GLY 214.A O no hydrogen 2.998 N/A ASN 217.A ND2 GLU 216.A OE2 no hydrogen 3.033 N/A LEU 218.A N GLY 214.A O no hydrogen 2.762 N/A LEU 219.A N LEU 133.A O no hydrogen 3.259 N/A LYS 221.A NZ PRO 130.A O no hydrogen 2.863 N/A GLY 222.A N PHE 129.A O no hydrogen 3.109 N/A LEU 225.A N GLU 127.A O no hydrogen 3.444 N/A LYS 226.A N TYR 146.A O no hydrogen 2.973 N/A LYS 226.A NZ ASP 126.A OD2 no hydrogen 3.492 N/A THR 228.A OG1 LYS 226.A O no hydrogen 3.498 N/A LYS 230.A NZ GLU 122.A OE1 no hydrogen 2.759 N/A LYS 230.A NZ GLU 122.A OE2 no hydrogen 3.030 N/A LYS 230.A NZ TYR 232.A OH no hydrogen 3.195 N/A ILE 231.A N VAL 123.A O no hydrogen 3.188 N/A GLY 233.A N VAL 121.A O no hydrogen 3.105 N/A VAL 234.A N ILE 134.A O no hydrogen 3.041 N/A VAL 236.A N ASP 132.A O no hydrogen 3.094 N/A TYR 237.A N ASP 132.A O no hydrogen 3.379 N/A TYR 237.A OH GLU 186.A O no hydrogen 2.180 N/A THR 238.A OG1 CYS 15.A O no hydrogen 3.457 N/A THR 242.A OG1 ASP 132.A OD2 no hydrogen 3.541 N/A LYS 243.A NZ GLN 189.A O no hydrogen 2.633 N/A LYS 243.A NZ LYS 194.A O no hydrogen 3.438 N/A MET 244.A N THR 242.A OG1 no hydrogen 3.430 N/A LEU 246.A N LYS 243.A O no hydrogen 3.328 N/A GLN 253.A N LYS 251.A O no hydrogen 3.253 N/A LYS 254.A NZ LYS 251.A O no hydrogen 3.452 N/A SER 256.A OG GLU 373.A OE2 no hydrogen 2.305 N/A ALA 257.A N GLU 373.A OE2 no hydrogen 3.178 N/A GLU 259.A N SER 256.A O no hydrogen 3.419 N/A SER 261.A OG ALA 257.A O no hydrogen 3.512 N/A PHE 265.A N SER 261.A O no hydrogen 2.893 N/A LEU 266.A N ILE 262.A O no hydrogen 3.129 N/A ILE 267.A N ASN 263.A O no hydrogen 3.191 N/A VAL 268.A N ALA 264.A O no hydrogen 3.301 N/A TYR 269.A N PHE 265.A O no hydrogen 2.723 N/A TYR 269.A OH PHE 603.A O no hydrogen 3.282 N/A PHE 271.A N VAL 268.A O no hydrogen 2.788 N/A ILE 272.A N VAL 268.A O no hydrogen 3.047 N/A LEU 274.A N LEU 270.A O no hydrogen 3.017 N/A THR 275.A N PHE 271.A O no hydrogen 2.980 N/A THR 275.A OG1 PHE 271.A O no hydrogen 2.860 N/A LYS 276.A N ILE 272.A O no hydrogen 2.963 N/A ALA 277.A N LEU 273.A O no hydrogen 3.134 N/A ALA 278.A N LEU 274.A O no hydrogen 3.180 N/A VAL 279.A N THR 275.A O no hydrogen 2.778 N/A CYS 280.A N LYS 276.A O no hydrogen 3.424 N/A THR 281.A N ALA 277.A O no hydrogen 3.212 N/A THR 281.A OG1 ALA 277.A O no hydrogen 2.449 N/A THR 282.A N ALA 278.A O no hydrogen 3.060 N/A THR 282.A OG1 ALA 278.A O no hydrogen 2.796 N/A LEU 283.A N VAL 279.A O no hydrogen 2.984 N/A TYR 285.A N THR 281.A O no hydrogen 3.222 N/A TYR 285.A OH ASP 317.A OD1 no hydrogen 2.356 N/A VAL 286.A N THR 282.A O no hydrogen 3.185 N/A TRP 287.A N LEU 283.A O no hydrogen 3.047 N/A GLN 288.A N LYS 284.A O no hydrogen 2.981 N/A SER 289.A N VAL 286.A O no hydrogen 3.405 N/A SER 289.A OG TYR 285.A O no hydrogen 3.094 N/A ASN 293.A N THR 290.A O no hydrogen 2.666 N/A ASN 293.A ND2 TRP 287.A O no hydrogen 3.230 N/A GLN 303.A NE2 GLN 303.A O no hydrogen 2.600 N/A ARG 306.A N THR 302.A O no hydrogen 2.848 N/A GLU 307.A N LYS 304.A O no hydrogen 3.270 N/A THR 308.A OG1 LYS 304.A O no hydrogen 3.252 N/A LEU 312.A N LEU 309.A O no hydrogen 3.052 N/A LYS 313.A N LEU 309.A O no hydrogen 2.939 N/A LYS 313.A NZ ASP 317.A OD2 no hydrogen 3.337 N/A MET 314.A N LYS 310.A O no hydrogen 2.986 N/A PHE 315.A N LEU 312.A O no hydrogen 2.930 N/A THR 316.A N LEU 312.A O no hydrogen 2.907 N/A ASP 317.A N LYS 313.A O no hydrogen 2.677 N/A LEU 319.A N PHE 315.A O no hydrogen 2.967 N/A SER 320.A N THR 316.A O no hydrogen 2.911 N/A SER 320.A OG THR 316.A O no hydrogen 2.887 N/A PHE 321.A N PHE 318.A O no hydrogen 3.189 N/A MET 322.A N PHE 318.A O no hydrogen 3.043 N/A VAL 323.A N LEU 319.A O no hydrogen 2.797 N/A LEU 324.A N SER 320.A O no hydrogen 3.225 N/A PHE 325.A N PHE 321.A O no hydrogen 3.149 N/A ASN 326.A N VAL 323.A O no hydrogen 3.286 N/A ASN 326.A ND2 VAL 323.A O no hydrogen 2.397 N/A ILE 328.A N PHE 325.A O no hydrogen 3.203 N/A SER 332.A OG ASN 637.A O no hydrogen 3.295 N/A THR 336.A OG1 SER 332.A O no hydrogen 2.932 N/A VAL 337.A N MET 333.A O no hydrogen 2.779 N/A GLU 338.A N TYR 334.A O no hydrogen 3.385 N/A MET 339.A N VAL 335.A O no hydrogen 2.985 N/A GLN 340.A N THR 336.A O no hydrogen 2.983 N/A LYS 341.A N VAL 337.A O no hydrogen 3.304 N/A LYS 341.A NZ GLU 372.A OE2 no hydrogen 3.125 N/A PHE 342.A N GLU 338.A O no hydrogen 3.386 N/A LEU 343.A N MET 339.A O no hydrogen 3.305 N/A SER 345.A N LYS 341.A O no hydrogen 3.130 N/A SER 345.A OG LYS 341.A O no hydrogen 3.076 N/A SER 345.A OG PHE 342.A O no hydrogen 3.007 N/A PHE 347.A N GLY 344.A O no hydrogen 3.318 N/A TRP 350.A N PHE 346.A O no hydrogen 2.839 N/A LYS 352.A NZ ASP 353.A OD1 no hydrogen 3.475 N/A ASP 353.A N ASP 351.A OD1 no hydrogen 3.279 N/A PHE 354.A N ASP 351.A O no hydrogen 3.139 N/A ASP 356.A N GLU 361.A O no hydrogen 3.203 N/A ASN 360.A N ASP 356.A O no hydrogen 2.784 N/A ASN 366.A N ASP 571.A O no hydrogen 2.581 N/A THR 367.A N ASP 571.A O no hydrogen 3.274 N/A SER 368.A OG ASP 369.A OD2 no hydrogen 3.513 N/A GLU 372.A N GLU 372.A OE1 no hydrogen 2.804 N/A GLU 373.A N LEU 370.A O no hydrogen 2.710 N/A LEU 374.A N ASN 371.A O no hydrogen 3.398 N/A GLN 376.A NE2 SER 671.A O no hydrogen 3.437 N/A ASP 378.A N ILE 535.A O no hydrogen 2.691 N/A TYR 379.A N ILE 535.A O no hydrogen 3.275 N/A VAL 380.A N LYS 410.A O no hydrogen 2.891 N/A PHE 381.A N LEU 537.A O no hydrogen 2.816 N/A THR 382.A N TRP 412.A O no hydrogen 2.892 N/A LYS 384.A NZ THR 425.A OG1 no hydrogen 2.849 N/A GLY 386.A N THR 389.A O no hydrogen 2.670 N/A THR 387.A OG1 ASP 383.A O no hydrogen 2.218 N/A LEU 388.A N LYS 384.A O no hydrogen 3.084 N/A THR 389.A N LYS 384.A O no hydrogen 3.114 N/A GLU 390.A N GLU 390.A OE1 no hydrogen 2.572 N/A THR 400.A N GLN 396.A O no hydrogen 3.307 N/A THR 400.A OG1 GLN 396.A O no hydrogen 3.025 N/A ALA 403.A N GLU 399.A O no hydrogen 3.261 N/A LEU 404.A N THR 400.A O no hydrogen 2.703 N/A HIS 405.A N ILE 401.A O no hydrogen 2.924 N/A HIS 405.A N GLU 402.A O no hydrogen 2.797 N/A ALA 406.A N GLU 402.A O no hydrogen 2.632 N/A GLY 408.A N HIS 405.A O no hydrogen 3.162 N/A LYS 410.A N ASP 378.A O no hydrogen 3.287 N/A TRP 412.A N VAL 380.A O no hydrogen 2.694 N/A VAL 413.A N VAL 510.A O no hydrogen 2.813 N/A THR 415.A N CYS 512.A O no hydrogen 3.008 N/A ASP 417.A N THR 415.A OG1 no hydrogen 3.201 N/A LYS 418.A N ASP 417.A OD1 no hydrogen 2.566 N/A THR 421.A OG1 ASP 417.A OD1 no hydrogen 3.376 N/A ALA 422.A N MET 419.A O no hydrogen 2.874 N/A LYS 423.A N MET 419.A O no hydrogen 2.468 N/A THR 425.A OG1 THR 421.A O no hydrogen 2.537 N/A THR 425.A OG1 ALA 422.A O no hydrogen 2.596 N/A CYS 426.A N ALA 422.A O no hydrogen 2.656 N/A CYS 426.A SG ALA 422.A O no hydrogen 3.438 N/A TYR 427.A N LYS 423.A O no hydrogen 2.867 N/A ALA 428.A N THR 425.A O no hydrogen 2.804 N/A CYS 429.A N THR 425.A O no hydrogen 2.890 N/A CYS 429.A SG THR 425.A O no hydrogen 3.195 N/A ARG 430.A N CYS 426.A O no hydrogen 3.289 N/A ARG 430.A NE GLN 433.A OE1 no hydrogen 2.609 N/A ARG 430.A NH2 PHE 432.A O no hydrogen 2.758 N/A THR 436.A OG1 GLN 433.A O no hydrogen 2.645 N/A LEU 439.A N GLY 473.A O no hydrogen 3.398 N/A LEU 441.A N ILE 475.A O no hydrogen 2.793 N/A THR 445.A N THR 442.A O no hydrogen 3.266 N/A THR 445.A OG1 THR 442.A O no hydrogen 3.183 N/A ILE 446.A N THR 443.A O no hydrogen 3.140 N/A GLU 448.A N ILE 446.A O no hydrogen 2.609 N/A GLU 450.A N GLU 450.A OE2 no hydrogen 2.918 N/A ARG 451.A NH1 THR 445.A O no hydrogen 2.395 N/A LYS 452.A NZ THR 480.A O no hydrogen 2.614 N/A GLU 453.A N SER 449.A O no hydrogen 3.401 N/A ASP 454.A N GLU 450.A O no hydrogen 2.902 N/A ARG 455.A N ARG 451.A O no hydrogen 2.239 N/A LEU 456.A N LYS 452.A O no hydrogen 2.473 N/A HIS 457.A N GLU 453.A O no hydrogen 3.246 N/A GLU 458.A N ASP 454.A O no hydrogen 2.365 N/A LEU 459.A N ARG 455.A O no hydrogen 2.934 N/A LEU 460.A N HIS 457.A O no hydrogen 3.074 N/A ILE 461.A N HIS 457.A O no hydrogen 2.597 N/A ARG 464.A NH1 ARG 464.A O no hydrogen 2.974 N/A LYS 465.A N LEU 460.A O no hydrogen 2.964 N/A GLN 470.A NE2 HIS 469.A ND1 no hydrogen 3.445 N/A GLU 471.A N GLU 468.A O no hydrogen 3.254 N/A TYR 472.A N GLU 468.A O no hydrogen 3.405 N/A GLY 473.A N GLU 437.A O no hydrogen 3.286 N/A ILE 475.A N LEU 439.A O no hydrogen 3.305 N/A ILE 476.A N LEU 511.A O no hydrogen 3.036 N/A SER 479.A N ASP 477.A OD2 no hydrogen 3.214 N/A THR 480.A N ASP 477.A OD1 no hydrogen 3.055 N/A THR 480.A N ASP 477.A OD2 no hydrogen 3.371 N/A THR 480.A OG1 LEU 441.A O no hydrogen 2.715 N/A THR 480.A OG1 ASP 477.A OD1 no hydrogen 2.229 N/A SER 482.A N SER 479.A O no hydrogen 2.816 N/A SER 482.A OG SER 479.A O no hydrogen 2.283 N/A ILE 484.A N LEU 481.A O no hydrogen 3.061 N/A LEU 485.A N SER 482.A O no hydrogen 3.140 N/A ASN 486.A N SER 482.A O no hydrogen 2.629 N/A SER 488.A OG ILE 484.A O no hydrogen 3.237 N/A SER 488.A OG LEU 485.A O no hydrogen 3.317 N/A LYS 497.A NZ SER 488.A OG no hydrogen 3.047 N/A PHE 500.A N TYR 496.A O no hydrogen 3.352 N/A LEU 501.A N LYS 497.A O no hydrogen 3.001 N/A GLN 502.A N ILE 499.A O no hydrogen 3.151 N/A GLN 502.A NE2 SER 498.A O no hydrogen 3.510 N/A CYS 504.A N PHE 500.A O no hydrogen 3.261 N/A CYS 504.A SG PHE 500.A O no hydrogen 3.856 N/A CYS 507.A N ILE 503.A O no hydrogen 2.966 N/A CYS 507.A SG TYR 472.A O no hydrogen 3.283 N/A CYS 507.A SG ALA 509.A O no hydrogen 3.595 N/A THR 508.A OG1 HIS 469.A O no hydrogen 3.132 N/A VAL 510.A N VAL 411.A O no hydrogen 3.411 N/A LEU 511.A N LEU 474.A O no hydrogen 3.211 N/A CYS 512.A N VAL 413.A O no hydrogen 3.239 N/A CYS 513.A N ILE 476.A O no hydrogen 3.180 N/A CYS 513.A SG LYS 418.A O no hydrogen 3.110 N/A ARG 514.A N ASP 417.A O no hydrogen 2.673 N/A MET 515.A N THR 415.A O no hydrogen 3.203 N/A GLN 519.A N ALA 516.A O no hydrogen 3.110 N/A GLN 519.A NE2 GLY 478.A O no hydrogen 3.346 N/A LYS 520.A NZ ASP 383.A OD2 no hydrogen 2.898 N/A LYS 520.A NZ ASP 545.A OD1 no hydrogen 2.678 N/A ILE 523.A N GLN 519.A O no hydrogen 2.931 N/A VAL 524.A N LYS 520.A O no hydrogen 3.490 N/A ARG 525.A N ALA 521.A O no hydrogen 3.250 N/A MET 526.A N GLN 522.A O no hydrogen 2.655 N/A VAL 527.A N ILE 523.A O no hydrogen 2.987 N/A LYS 528.A N VAL 524.A O no hydrogen 2.818 N/A ASN 529.A N MET 526.A O no hydrogen 3.290 N/A SER 533.A OG SER 533.A O no hydrogen 2.418 N/A THR 536.A N HIS 553.A ND1 no hydrogen 3.235 N/A THR 536.A OG1 HIS 553.A ND1 no hydrogen 3.288 N/A LEU 537.A N TYR 379.A O no hydrogen 2.947 N/A SER 538.A N VAL 554.A O no hydrogen 3.217 N/A SER 538.A OG MET 548.A O no hydrogen 2.569 N/A SER 538.A OG SER 552.A OG no hydrogen 2.169 N/A ILE 539.A N PHE 381.A O no hydrogen 2.830 N/A ASN 544.A N ASN 544.A OD1 no hydrogen 2.235 N/A SER 547.A OG PRO 517.A O no hydrogen 2.714 N/A LEU 550.A N VAL 546.A O no hydrogen 3.154 N/A GLU 551.A N MET 548.A O no hydrogen 3.297 N/A SER 552.A N MET 548.A O no hydrogen 3.129 N/A SER 552.A OG SER 538.A OG no hydrogen 2.169 N/A SER 552.A OG MET 548.A O no hydrogen 3.032 N/A SER 552.A OG VAL 554.A O no hydrogen 2.879 N/A HIS 553.A N THR 536.A O no hydrogen 2.887 N/A HIS 553.A ND1 THR 536.A OG1 no hydrogen 3.288 N/A VAL 554.A N THR 536.A O no hydrogen 3.433 N/A GLY 555.A N ASP 571.A OD2 no hydrogen 2.569 N/A ILE 556.A N SER 538.A O no hydrogen 3.027 N/A GLY 557.A N TYR 572.A O no hydrogen 3.100 N/A ILE 558.A N GLY 540.A O no hydrogen 2.823 N/A LYS 559.A NZ GLU 361.A OE1 no hydrogen 2.502 N/A LYS 559.A NZ GLY 362.A O no hydrogen 3.233 N/A ARG 568.A NH1 ASN 247.A O no hydrogen 3.284 N/A ASN 569.A ND2 GLN 565.A O no hydrogen 2.283 N/A SER 570.A OG ALA 567.A O no hydrogen 3.523 N/A SER 570.A OG TYR 572.A O no hydrogen 3.184 N/A ASP 571.A N GLY 555.A O no hydrogen 2.802 N/A SER 573.A N LEU 364.A O no hydrogen 3.014 N/A VAL 574.A N GLY 557.A O no hydrogen 3.218 N/A LYS 576.A N VAL 574.A O no hydrogen 2.859 N/A LYS 576.A NZ ASP 356.A OD1 no hydrogen 3.392 N/A LYS 576.A NZ ASP 356.A OD2 no hydrogen 2.733 N/A LYS 576.A NZ PRO 575.A O no hydrogen 3.234 N/A LEU 580.A N PHE 577.A O no hydrogen 2.734 N/A LYS 581.A N LYS 578.A O no hydrogen 3.459 N/A LYS 582.A NZ ASP 351.A OD2 no hydrogen 2.280 N/A LYS 582.A NZ ASP 353.A OD2 no hydrogen 3.570 N/A LEU 584.A N LEU 580.A O no hydrogen 3.131 N/A LEU 585.A N LYS 581.A O no hydrogen 2.831 N/A HIS 587.A N LYS 582.A O no hydrogen 3.110 N/A HIS 587.A ND1 LYS 582.A O no hydrogen 3.168 N/A GLY 588.A N LEU 583.A O no hydrogen 2.701 N/A HIS 589.A N LEU 584.A O no hydrogen 3.172 N/A TYR 591.A N HIS 587.A O no hydrogen 2.804 N/A TYR 591.A OH GLY 344.A O no hydrogen 2.499 N/A TYR 592.A N GLY 588.A O no hydrogen 3.071 N/A TYR 592.A OH ASN 673.A OD1 no hydrogen 3.291 N/A VAL 593.A N HIS 589.A O no hydrogen 3.312 N/A ARG 594.A N LEU 590.A O no hydrogen 3.227 N/A ARG 594.A NE GLU 652.A O no hydrogen 3.137 N/A ILE 595.A N TYR 592.A O no hydrogen 3.061 N/A ALA 596.A N TYR 592.A O no hydrogen 2.712 N/A HIS 597.A N VAL 593.A O no hydrogen 3.163 N/A HIS 597.A NE2 ASP 739.A OD2 no hydrogen 3.040 N/A VAL 599.A N ILE 595.A O no hydrogen 2.968 N/A GLN 600.A NE2 MET 675.A O no hydrogen 2.926 N/A TYR 601.A OH VAL 732.A O no hydrogen 2.695 N/A PHE 602.A N LEU 598.A O no hydrogen 3.188 N/A PHE 602.A N VAL 599.A O no hydrogen 3.239 N/A PHE 603.A N VAL 599.A O no hydrogen 3.388 N/A TYR 604.A N GLN 600.A O no hydrogen 2.969 N/A TYR 604.A OH GLU 691.A OE1 no hydrogen 2.243 N/A TYR 604.A OH GLU 691.A OE2 no hydrogen 3.191 N/A LYS 605.A N TYR 601.A O no hydrogen 3.081 N/A LYS 605.A NZ ASN 637.A OD1 no hydrogen 2.455 N/A LYS 605.A NZ THR 641.A OG1 no hydrogen 3.209 N/A ASN 606.A ND2 PHE 327.A O no hydrogen 2.900 N/A LEU 607.A N PHE 603.A O no hydrogen 3.322 N/A CYS 608.A N TYR 604.A O no hydrogen 3.139 N/A CYS 608.A SG TYR 604.A O no hydrogen 3.282 N/A CYS 608.A SG GLU 691.A OE1 no hydrogen 3.858 N/A PHE 609.A N ASN 606.A O no hydrogen 3.119 N/A ILE 610.A N ASN 606.A O no hydrogen 3.091 N/A LEU 611.A N LEU 607.A O no hydrogen 3.044 N/A GLN 613.A N ILE 610.A O no hydrogen 2.719 N/A PHE 614.A N ILE 610.A O no hydrogen 2.795 N/A LEU 615.A N LEU 611.A O no hydrogen 3.027 N/A GLN 617.A N PHE 614.A O no hydrogen 3.285 N/A GLN 617.A NE2 GLN 613.A O no hydrogen 2.997 N/A GLN 617.A NE2 GLN 625.A O no hydrogen 3.364 N/A PHE 618.A N LEU 615.A O no hydrogen 3.014 N/A PHE 619.A N TYR 616.A O no hydrogen 3.114 N/A CYS 620.A N TYR 616.A O no hydrogen 2.776 N/A CYS 620.A SG SER 623.A OG no hydrogen 2.749 N/A PHE 622.A N GLN 617.A O no hydrogen 2.929 N/A PHE 622.A N CYS 620.A O no hydrogen 2.603 N/A TYR 628.A OH PHE 609.A O no hydrogen 2.529 N/A ALA 630.A N ASP 629.A OD1 no hydrogen 2.426 N/A LEU 633.A N ALA 630.A O no hydrogen 3.154 N/A THR 634.A N ALA 630.A O no hydrogen 3.448 N/A TYR 636.A OH LYS 605.A O no hydrogen 2.267 N/A CYS 639.A N MET 635.A O no hydrogen 2.572 N/A PHE 640.A N MET 635.A O no hydrogen 3.047 N/A THR 641.A N TYR 636.A O no hydrogen 3.133 N/A THR 641.A OG1 TYR 636.A O no hydrogen 2.630 N/A SER 642.A OG ILE 638.A O no hydrogen 2.993 N/A ALA 647.A N LEU 643.A O no hydrogen 2.803 N/A TYR 648.A N PRO 644.A O no hydrogen 3.310 N/A SER 649.A N ILE 645.A O no hydrogen 3.165 N/A SER 649.A OG ILE 645.A O no hydrogen 2.979 N/A SER 649.A OG LEU 646.A O no hydrogen 2.811 N/A LEU 650.A N ALA 647.A O no hydrogen 3.332 N/A LEU 651.A N ALA 647.A O no hydrogen 2.989 N/A ILE 657.A N GLN 653.A OE1 no hydrogen 3.310 N/A THR 659.A N ASN 656.A O no hydrogen 2.729 N/A THR 659.A OG1 ASN 656.A O no hydrogen 3.241 N/A SER 662.A N ASP 658.A O no hydrogen 3.432 N/A SER 662.A OG ASP 658.A O no hydrogen 2.367 N/A ARG 665.A N ASP 663.A OD1 no hydrogen 2.959 N/A LYS 669.A NZ ALA 406.A O no hydrogen 3.455 N/A LYS 669.A NZ ARG 665.A O no hydrogen 3.116 N/A MET 675.A N TYR 592.A OH no hydrogen 2.981 N/A GLN 677.A N ALA 674.A O no hydrogen 3.143 N/A PHE 681.A N GLN 677.A O no hydrogen 3.237 N/A LEU 682.A N LEU 678.A O no hydrogen 3.474 N/A TYR 683.A N PRO 680.A O no hydrogen 3.292 N/A TYR 683.A OH GLU 806.A OE2 no hydrogen 2.797 N/A TRP 684.A N PRO 680.A O no hydrogen 3.368 N/A TRP 684.A N PHE 681.A O no hydrogen 3.249 N/A THR 685.A N PHE 681.A O no hydrogen 3.054 N/A THR 685.A OG1 PHE 681.A O no hydrogen 2.811 N/A ALA 688.A N TRP 684.A O no hydrogen 3.057 N/A ALA 689.A N THR 685.A O no hydrogen 2.901 N/A GLU 691.A N LEU 687.A O no hydrogen 3.003 N/A GLY 692.A N ALA 688.A O no hydrogen 3.109 N/A THR 693.A N ALA 689.A O no hydrogen 3.277 N/A THR 693.A OG1 ALA 689.A O no hydrogen 2.471 N/A VAL 694.A N PHE 690.A O no hydrogen 3.107 N/A PHE 695.A N GLU 691.A O no hydrogen 3.281 N/A PHE 696.A N GLY 692.A O no hydrogen 3.431 N/A PHE 697.A N THR 693.A O no hydrogen 3.038 N/A THR 699.A OG1 PHE 695.A O no hydrogen 2.561 N/A TYR 700.A N PHE 696.A O no hydrogen 2.640 N/A GLN 704.A NE2 TYR 700.A O no hydrogen 2.295 N/A THR 705.A OG1 LEU 702.A O no hydrogen 2.760 N/A SER 707.A OG LYS 713.A O no hydrogen 2.977 N/A TYR 715.A OH GLU 709.A OE2 no hydrogen 2.984 N/A ASN 717.A N ASN 717.A OD1 no hydrogen 2.446 N/A GLY 721.A N ASN 717.A O no hydrogen 3.237 N/A THR 722.A N TRP 718.A O no hydrogen 3.240 N/A THR 722.A OG1 TRP 718.A O no hydrogen 2.186 N/A VAL 724.A N PHE 720.A O no hydrogen 3.278 N/A PHE 725.A N GLY 721.A O no hydrogen 2.940 N/A THR 726.A N THR 722.A O no hydrogen 2.736 N/A THR 726.A OG1 THR 722.A O no hydrogen 2.777 N/A THR 726.A OG1 TYR 758.A OH no hydrogen 2.382 N/A VAL 727.A N ILE 723.A O no hydrogen 3.157 N/A LEU 728.A N VAL 724.A O no hydrogen 3.003 N/A VAL 729.A N PHE 725.A O no hydrogen 2.822 N/A PHE 730.A N THR 726.A O no hydrogen 3.222 N/A THR 731.A N VAL 727.A O no hydrogen 3.060 N/A THR 731.A OG1 VAL 727.A O no hydrogen 2.866 N/A VAL 732.A N LEU 728.A O no hydrogen 3.289 N/A THR 733.A N VAL 729.A O no hydrogen 3.131 N/A THR 733.A OG1 VAL 729.A O no hydrogen 2.893 N/A LEU 734.A N PHE 730.A O no hydrogen 3.042 N/A LYS 735.A NZ ASP 739.A OD2 no hydrogen 2.810 N/A LEU 736.A N THR 733.A O no hydrogen 3.151 N/A ALA 737.A N THR 733.A O no hydrogen 3.109 N/A ASP 739.A N LEU 736.A O no hydrogen 2.850 N/A THR 740.A N LEU 736.A O no hydrogen 3.073 N/A ARG 741.A N GLU 652.A OE2 no hydrogen 3.007 N/A ARG 741.A NH1 LEU 738.A O no hydrogen 2.755 N/A ASN 747.A ND2 LEU 651.A O no hydrogen 3.584 N/A PHE 749.A N ILE 746.A O no hydrogen 2.748 N/A VAL 750.A N ILE 746.A O no hydrogen 2.942 N/A TRP 752.A NE1 HIS 748.A ND1 no hydrogen 3.031 N/A SER 754.A N VAL 750.A O no hydrogen 3.072 N/A SER 754.A N ILE 751.A O no hydrogen 3.188 N/A SER 754.A OG VAL 750.A O no hydrogen 2.680 N/A LEU 755.A N ILE 751.A O no hydrogen 3.288 N/A PHE 757.A N GLY 753.A O no hydrogen 3.220 N/A TYR 758.A N SER 754.A O no hydrogen 3.357 N/A TYR 758.A OH THR 726.A OG1 no hydrogen 2.382 N/A PHE 760.A N ALA 756.A O no hydrogen 3.103 N/A PHE 761.A N PHE 757.A O no hydrogen 2.581 N/A SER 762.A N TYR 758.A O no hydrogen 3.163 N/A SER 762.A OG TYR 632.A OH no hydrogen 3.270 N/A SER 762.A OG TYR 758.A O no hydrogen 2.497 N/A PHE 763.A N VAL 759.A O no hydrogen 3.323 N/A PHE 764.A N PHE 760.A O no hydrogen 3.034 N/A PHE 764.A N PHE 761.A O no hydrogen 2.905 N/A TRP 765.A N PHE 761.A O no hydrogen 2.590 N/A GLY 767.A N PHE 764.A O no hydrogen 3.000 N/A TRP 770.A NE1 GLY 767.A O no hydrogen 2.426 N/A LEU 773.A N TRP 770.A O no hydrogen 2.845 N/A GLN 776.A NE2 TRP 770.A O no hydrogen 3.547 N/A GLN 784.A N PHE 780.A O no hydrogen 3.011 N/A MET 785.A N VAL 781.A O no hydrogen 3.199 N/A LEU 786.A N PHE 782.A O no hydrogen 3.275 N/A SER 787.A N GLN 784.A O no hydrogen 3.094 N/A SER 787.A OG GLN 784.A O no hydrogen 3.328 N/A SER 788.A OG MET 785.A O no hydrogen 3.295 N/A SER 788.A OG THR 791.A OG1 no hydrogen 2.205 N/A THR 791.A N SER 788.A O no hydrogen 3.003 N/A THR 791.A OG1 SER 788.A OG no hydrogen 2.205 N/A TRP 792.A NE1 LEU 786.A O no hydrogen 2.641 N/A LEU 793.A N VAL 789.A O no hydrogen 3.396 N/A ALA 794.A N SER 790.A O no hydrogen 3.271 N/A ILE 795.A N THR 791.A O no hydrogen 3.101 N/A ILE 796.A N TRP 792.A O no hydrogen 2.958 N/A LEU 797.A N LEU 793.A O no hydrogen 3.041 N/A LEU 798.A N ALA 794.A O no hydrogen 2.706 N/A ILE 799.A N ILE 795.A O no hydrogen 3.054 N/A ILE 801.A N LEU 797.A O no hydrogen 2.781 N/A SER 802.A N LEU 798.A O no hydrogen 3.280 N/A SER 802.A OG LEU 798.A O no hydrogen 2.730 N/A LEU 803.A N ILE 799.A O no hydrogen 3.079 N/A PHE 804.A N ILE 801.A O no hydrogen 3.458 N/A ILE 807.A N LEU 803.A O no hydrogen 3.355 N/A LEU 808.A N PHE 804.A O no hydrogen 2.776 N/A ILE 810.A N GLU 806.A O no hydrogen 3.268 N/A VAL 811.A N ILE 807.A O no hydrogen 3.190 N/A LEU 812.A N LEU 808.A O no hydrogen 3.237 N/A LYS 813.A N ILE 810.A O no hydrogen 3.295 N/A ASN 814.A N ILE 810.A O no hydrogen 2.874 N/A VAL 815.A N VAL 811.A O no hydrogen 2.999 N/A