Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k4a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG SER 1.A O no hydrogen 2.613 N/A THR 8.A N THR 10.A O no hydrogen 2.495 N/A THR 8.A OG1 THR 10.A O no hydrogen 3.454 N/A THR 8.A OG1 ILE 262.A O no hydrogen 3.244 N/A THR 10.A N THR 8.A OG1 no hydrogen 2.713 N/A THR 10.A OG1 THR 8.A OG1 no hydrogen 2.818 N/A ILE 13.A N LEU 174.A O no hydrogen 2.905 N/A LYS 15.A N VAL 173.A O no hydrogen 3.049 N/A LYS 15.A NZ LYS 15.A O no hydrogen 3.489 N/A TRP 20.A N ILE 46.A O no hydrogen 3.084 N/A ALA 21.A N GLN 71.A O no hydrogen 2.764 N/A PHE 22.A N ARG 44.A O no hydrogen 2.514 N/A SER 23.A N TRP 69.A O no hydrogen 3.317 N/A ASP 25.A N ASN 67.A O no hydrogen 3.219 N/A ARG 26.A NH1 ASP 60.A O no hydrogen 3.268 N/A CYS 29.A N ASP 25.A OD1 no hydrogen 2.947 N/A CYS 29.A N GLU 27.A O no hydrogen 3.172 N/A GLY 30.A N ASP 25.A OD1 no hydrogen 3.222 N/A GLN 33.A N CYS 29.A O no hydrogen 2.766 N/A ARG 34.A N ILE 31.A O no hydrogen 3.300 N/A TRP 35.A N GLY 30.A O no hydrogen 2.844 N/A TRP 35.A NE1 GLN 33.A OE1 no hydrogen 3.060 N/A SER 43.A OG LEU 40.A O no hydrogen 3.031 N/A ARG 44.A N PHE 22.A O no hydrogen 2.946 N/A ILE 46.A N TRP 20.A O no hydrogen 3.016 N/A ALA 47.A N GLN 55.A OE1 no hydrogen 2.768 N/A GLY 50.A N ILE 169.A O no hydrogen 2.782 N/A SER 51.A N ARG 300.A O no hydrogen 3.010 N/A SER 51.A OG HIS 170.A NE2 no hydrogen 2.539 N/A SER 51.A OG ARG 300.A O no hydrogen 3.114 N/A PHE 52.A N ALA 167.A O no hydrogen 3.434 N/A GLN 55.A NE2 ALA 47.A O no hydrogen 3.203 N/A GLN 55.A NE2 SER 51.A O no hydrogen 2.512 N/A ALA 57.A N ASP 54.A O no hydrogen 3.348 N/A ASP 60.A N ASP 58.A OD2 no hydrogen 2.914 N/A ILE 61.A N ASP 58.A O no hydrogen 3.301 N/A ARG 62.A N ASP 58.A O no hydrogen 3.205 N/A ARG 62.A N ALA 59.A O no hydrogen 3.022 N/A ARG 62.A NE ASP 54.A OD1 no hydrogen 3.095 N/A ASN 63.A N ALA 59.A O no hydrogen 3.099 N/A ASN 63.A ND2 GLN 540.A OE1 no hydrogen 3.667 N/A TYR 64.A OH ASP 25.A O no hydrogen 3.208 N/A TYR 64.A OH ASN 67.A O no hydrogen 2.417 N/A ASN 67.A N TYR 64.A OH no hydrogen 2.559 N/A VAL 68.A N VAL 134.A O no hydrogen 3.102 N/A TRP 69.A N SER 23.A O no hydrogen 2.915 N/A TRP 69.A NE1 ASP 25.A OD2 no hydrogen 2.481 N/A TYR 70.A N VAL 132.A O no hydrogen 2.961 N/A GLN 71.A N ALA 21.A O no hydrogen 3.017 N/A ARG 72.A N ILE 130.A O no hydrogen 3.198 N/A ARG 72.A NE LYS 15.A O no hydrogen 3.367 N/A VAL 74.A N VAL 128.A O no hydrogen 2.745 N/A ILE 76.A N LYS 126.A O no hydrogen 3.234 N/A GLN 83.A NE2 GLY 82.A O no hydrogen 2.554 N/A ARG 84.A N THR 177.A O no hydrogen 2.724 N/A VAL 86.A N TYR 175.A O no hydrogen 2.714 N/A ARG 88.A NE ASP 90.A OD1 no hydrogen 3.432 N/A ARG 88.A NH1 LEU 3.A O no hydrogen 2.979 N/A ARG 88.A NH1 GLU 115.A OE1 no hydrogen 3.132 N/A ARG 88.A NH2 ASP 90.A OD1 no hydrogen 3.301 N/A PHE 89.A N PHE 114.A O no hydrogen 3.067 N/A ASP 90.A N SER 172.A O no hydrogen 2.813 N/A THR 93.A OG1 GLY 168.A O no hydrogen 3.547 N/A HIS 94.A NE2 ASN 165.A OD1 no hydrogen 2.871 N/A TYR 95.A OH GLU 106.A OE1 no hydrogen 2.882 N/A LYS 97.A N CYS 133.A O no hydrogen 2.991 N/A LYS 97.A NZ TYR 95.A OH no hydrogen 2.786 N/A LYS 97.A NZ GLU 106.A OE1 no hydrogen 2.614 N/A TRP 99.A N THR 131.A O no hydrogen 2.793 N/A ASN 101.A N ARG 129.A O no hydrogen 2.918 N/A VAL 105.A N VAL 98.A O no hydrogen 2.889 N/A HIS 107.A N GLY 96.A O no hydrogen 2.863 N/A PHE 114.A N PHE 89.A O no hydrogen 3.075 N/A ALA 116.A N LEU 87.A O no hydrogen 3.258 N/A VAL 122.A N THR 119.A O no hydrogen 2.717 N/A SER 127.A OG VAL 74.A O no hydrogen 3.231 N/A VAL 128.A N VAL 74.A O no hydrogen 2.782 N/A ARG 129.A NE ARG 129.A O no hydrogen 3.453 N/A ILE 130.A N ARG 72.A O no hydrogen 2.937 N/A THR 131.A N TRP 99.A O no hydrogen 2.807 N/A THR 131.A OG1 TRP 36.A O no hydrogen 3.461 N/A THR 131.A OG1 GLN 71.A OE1 no hydrogen 2.340 N/A VAL 132.A N TYR 70.A O no hydrogen 2.974 N/A CYS 133.A N LYS 97.A O no hydrogen 2.971 N/A CYS 133.A SG ASN 67.A OD1 no hydrogen 3.369 N/A VAL 134.A N VAL 68.A O no hydrogen 3.028 N/A ASN 135.A N TYR 95.A O no hydrogen 2.966 N/A ASN 136.A ND2 VAL 65.A O no hydrogen 2.155 N/A LEU 138.A N GLN 157.A OE1 no hydrogen 2.781 N/A GLN 141.A N ASN 139.A OD1 no hydrogen 2.776 N/A THR 142.A N ASN 139.A O no hydrogen 3.169 N/A THR 142.A OG1 PRO 144.A O no hydrogen 3.409 N/A GLY 146.A N ASN 139.A O no hydrogen 2.929 N/A ILE 148.A N LYS 156.A O no hydrogen 2.914 N/A ASP 150.A N LYS 154.A O no hydrogen 2.643 N/A LYS 154.A NZ ASP 150.A OD1 no hydrogen 2.149 N/A LYS 154.A NZ ASN 152.A OD1 no hydrogen 3.557 N/A LYS 156.A N ILE 148.A O no hydrogen 2.626 N/A GLN 157.A NE2 LEU 138.A O no hydrogen 3.027 N/A GLN 157.A NE2 SER 158.A O no hydrogen 3.102 N/A PHE 164.A N ALA 537.A O no hydrogen 3.205 N/A ASN 165.A N TYR 159.A OH no hydrogen 3.209 N/A ASN 165.A ND2 ASN 136.A O no hydrogen 3.489 N/A TYR 166.A N PHE 164.A O no hydrogen 2.813 N/A TYR 166.A OH ASP 54.A OD2 no hydrogen 2.834 N/A GLY 168.A N THR 93.A OG1 no hydrogen 3.109 N/A ARG 171.A NH1 TYR 111.A O no hydrogen 2.577 N/A ARG 171.A NH2 GLU 295.A OE1 no hydrogen 3.092 N/A ARG 171.A NH2 PRO 328.A O no hydrogen 2.720 N/A LEU 174.A N ILE 13.A O no hydrogen 3.029 N/A TYR 175.A N VAL 86.A O no hydrogen 2.606 N/A THR 176.A N ARG 11.A O no hydrogen 3.015 N/A THR 176.A OG1 ARG 84.A O no hydrogen 2.642 N/A THR 177.A N ARG 84.A O no hydrogen 2.713 N/A THR 177.A OG1 PRO 178.A O no hydrogen 3.124 N/A ASN 179.A N GLU 259.A OE2 no hydrogen 2.783 N/A ASN 179.A ND2 GLY 82.A O no hydrogen 3.186 N/A ASN 179.A ND2 GLU 259.A OE2 no hydrogen 3.149 N/A THR 180.A OG1 ALA 206.A O no hydrogen 3.551 N/A THR 180.A OG1 ASN 207.A O no hydrogen 2.727 N/A THR 186.A OG1 ILE 185.A O no hydrogen 2.599 N/A VAL 188.A N VAL 200.A O no hydrogen 3.029 N/A THR 189.A OG1 THR 189.A O no hydrogen 2.489 N/A THR 189.A OG1 GLY 268.A O no hydrogen 3.296 N/A THR 189.A OG1 ARG 270.A O no hydrogen 3.518 N/A CYS 195.A SG GLN 193.A O no hydrogen 3.962 N/A SER 199.A N GLN 233.A O no hydrogen 2.916 N/A TRP 202.A N THR 186.A O no hydrogen 2.978 N/A VAL 204.A N GLN 203.A OE1 no hydrogen 2.411 N/A ALA 206.A N TRP 181.A O no hydrogen 2.972 N/A SER 211.A N THR 253.A O no hydrogen 2.816 N/A VAL 212.A N GLY 225.A O no hydrogen 3.504 N/A LEU 214.A N ALA 223.A O no hydrogen 3.143 N/A ARG 215.A N GLU 249.A O no hydrogen 2.770 N/A ARG 215.A NH1 GLU 213.A OE2 no hydrogen 3.231 N/A GLY 230.A N GLY 227.A O no hydrogen 3.208 N/A THR 231.A OG1 ASP 201.A OD1 no hydrogen 2.043 N/A THR 231.A OG1 GLY 230.A O no hydrogen 2.093 N/A TRP 240.A N ILE 269.A O no hydrogen 2.749 N/A TRP 240.A NE1 ASP 337.A O no hydrogen 3.082 N/A TYR 246.A OH HIS 238.A ND1 no hydrogen 3.418 N/A TYR 248.A N VAL 267.A O no hydrogen 2.854 N/A TYR 248.A OH HIS 238.A O no hydrogen 2.787 N/A LEU 250.A N LEU 265.A O no hydrogen 2.750 N/A CYS 251.A N GLU 213.A O no hydrogen 3.350 N/A CYS 251.A SG GLU 213.A O no hydrogen 3.650 N/A VAL 252.A N TYR 263.A O no hydrogen 2.455 N/A THR 253.A N SER 211.A O no hydrogen 3.100 N/A THR 253.A OG1 SER 211.A O no hydrogen 2.413 N/A ALA 254.A N ASP 261.A O no hydrogen 2.858 N/A GLU 259.A N SER 256.A OG no hydrogen 3.193 N/A CYS 260.A SG ALA 254.A O no hydrogen 3.402 N/A ASP 261.A N ALA 254.A O no hydrogen 3.474 N/A TYR 263.A N VAL 252.A O no hydrogen 2.600 N/A TYR 263.A OH ARG 4.A O no hydrogen 2.435 N/A LEU 265.A N LEU 250.A O no hydrogen 2.534 N/A ARG 266.A NH1 GLU 338.A OE2 no hydrogen 3.478 N/A ARG 266.A NH2 GLU 338.A OE2 no hydrogen 2.886 N/A VAL 267.A N TYR 248.A O no hydrogen 2.989 N/A ARG 270.A N THR 189.A OG1 no hydrogen 3.105 N/A ARG 270.A NE PRO 390.A O no hydrogen 2.891 N/A ARG 270.A NH1 ARG 270.A O no hydrogen 3.012 N/A ARG 270.A NH2 VAL 392.A O no hydrogen 2.994 N/A SER 271.A N ASN 282.A OD1 no hydrogen 2.718 N/A ALA 273.A N LEU 280.A O no hydrogen 3.041 N/A LYS 275.A N GLN 278.A O no hydrogen 3.187 N/A LEU 280.A N ALA 273.A O no hydrogen 2.750 N/A ILE 281.A N LYS 284.A O no hydrogen 2.997 N/A ASN 282.A N SER 271.A O no hydrogen 2.693 N/A ASN 282.A ND2 TRP 240.A O no hydrogen 2.701 N/A HIS 283.A NE2 VAL 191.A O no hydrogen 2.875 N/A LYS 284.A N ILE 281.A O no hydrogen 2.894 N/A LYS 284.A NZ GLN 241.A OE1 no hydrogen 3.292 N/A PHE 286.A N PHE 279.A O no hydrogen 2.961 N/A TYR 287.A OH GLU 528.A OE1 no hydrogen 2.189 N/A PHE 288.A N VAL 526.A O no hydrogen 3.073 N/A THR 289.A N ASN 320.A OD1 no hydrogen 3.236 N/A PHE 291.A N SER 321.A O no hydrogen 3.270 N/A GLY 292.A N VAL 530.A O no hydrogen 3.160 N/A ARG 293.A N SER 325.A OG no hydrogen 2.473 N/A HIS 294.A ND1 TYR 327.A OH no hydrogen 2.608 N/A GLU 295.A N TYR 327.A OH no hydrogen 2.777 N/A ALA 297.A N GLY 301.A O no hydrogen 3.073 N/A LYS 302.A NZ PHE 164.A O no hydrogen 3.147 N/A GLY 303.A N ARG 300.A O no hydrogen 2.580 N/A PHE 304.A N HIS 170.A O no hydrogen 2.980 N/A VAL 307.A N ASP 305.A OD1 no hydrogen 3.182 N/A HIS 310.A N VAL 307.A O no hydrogen 2.832 N/A ASP 311.A N LEU 308.A O no hydrogen 2.681 N/A ALA 313.A N VAL 309.A O no hydrogen 3.202 N/A LEU 314.A N HIS 310.A O no hydrogen 2.839 N/A TRP 316.A N ALA 313.A O no hydrogen 2.851 N/A ILE 317.A N LEU 314.A O no hydrogen 2.858 N/A GLY 318.A N ASP 315.A O no hydrogen 3.206 N/A ASN 320.A N THR 289.A OG1 no hydrogen 3.012 N/A ASN 320.A ND2 TYR 287.A O no hydrogen 2.944 N/A SER 321.A N THR 289.A O no hydrogen 2.786 N/A SER 321.A OG THR 289.A O no hydrogen 2.935 N/A SER 321.A OG GLN 529.A OE1 no hydrogen 2.937 N/A TYR 322.A N VAL 342.A O no hydrogen 3.399 N/A ARG 323.A N PHE 291.A O no hydrogen 3.271 N/A ARG 323.A NE GLU 346.A OE2 no hydrogen 2.864 N/A ARG 323.A NH2 GLU 346.A OE2 no hydrogen 3.482 N/A ARG 323.A NH2 GLU 489.A OE2 no hydrogen 3.555 N/A THR 324.A N ILE 344.A O no hydrogen 2.766 N/A THR 324.A OG1 ILE 344.A O no hydrogen 2.833 N/A SER 325.A N TYR 329.A OH no hydrogen 2.934 N/A SER 325.A OG ARG 293.A O no hydrogen 2.590 N/A TYR 327.A OH HIS 294.A ND1 no hydrogen 2.608 N/A ASP 337.A N LEU 333.A O no hydrogen 3.135 N/A GLY 340.A N ASP 337.A O no hydrogen 3.349 N/A ILE 341.A N ALA 336.A O no hydrogen 2.919 N/A VAL 342.A N ASN 320.A O no hydrogen 3.223 N/A VAL 343.A N SER 391.A O no hydrogen 2.842 N/A ILE 344.A N TYR 322.A O no hydrogen 2.848 N/A GLU 346.A N THR 324.A OG1 no hydrogen 3.013 N/A THR 347.A N SER 395.A O no hydrogen 3.212 N/A THR 347.A OG1 ILE 396.A O no hydrogen 2.970 N/A VAL 350.A N ALA 348.A O no hydrogen 3.216 N/A ASN 353.A ND2 GLU 399.A O no hydrogen 2.992 N/A SER 355.A N ASN 353.A OD1 no hydrogen 3.083 N/A ASN 368.A N THR 371.A OG1 no hydrogen 3.264 N/A THR 371.A OG1 TRP 140.A O no hydrogen 2.377 N/A GLN 372.A N ASN 368.A O no hydrogen 2.826 N/A GLN 372.A NE2 TYR 410.A O no hydrogen 3.071 N/A GLN 373.A N GLY 369.A O no hydrogen 3.154 N/A ALA 374.A N GLU 370.A O no hydrogen 2.963 N/A HIS 375.A N THR 371.A O no hydrogen 2.699 N/A HIS 375.A ND1 TYR 410.A OH no hydrogen 2.776 N/A HIS 375.A NE2 ILE 396.A O no hydrogen 2.725 N/A LEU 376.A N GLN 372.A O no hydrogen 2.925 N/A GLN 377.A N GLN 373.A O no hydrogen 2.852 N/A GLN 377.A NE2 GLU 381.A OE2 no hydrogen 3.088 N/A ALA 378.A N ALA 374.A O no hydrogen 2.767 N/A ILE 379.A N HIS 375.A O no hydrogen 2.890 N/A LYS 380.A N LEU 376.A O no hydrogen 3.004 N/A GLU 381.A N GLN 377.A O no hydrogen 2.921 N/A LEU 382.A N ILE 379.A O no hydrogen 2.882 N/A ILE 383.A N ILE 379.A O no hydrogen 3.123 N/A ALA 384.A N LYS 380.A O no hydrogen 3.118 N/A ARG 385.A N LEU 382.A O no hydrogen 3.072 N/A ARG 385.A NH1 ASP 386.A OD1 no hydrogen 2.540 N/A ASP 386.A N LEU 382.A O no hydrogen 2.751 N/A LYS 387.A NZ ASP 184.A OD1 no hydrogen 2.401 N/A LYS 387.A NZ ASP 184.A OD2 no hydrogen 2.884 N/A LYS 387.A NZ ILE 185.A O no hydrogen 3.069 N/A HIS 389.A N ASP 386.A O no hydrogen 3.153 N/A HIS 389.A ND1 ASP 386.A OD1 no hydrogen 3.118 N/A SER 391.A N ASP 337.A OD1 no hydrogen 3.062 N/A SER 391.A OG ASP 337.A OD1 no hydrogen 2.328 N/A VAL 393.A N VAL 343.A O no hydrogen 3.016 N/A TRP 394.A N PRO 426.A O no hydrogen 2.968 N/A TRP 394.A NE1 ASP 422.A OD1 no hydrogen 2.910 N/A SER 395.A N ASP 345.A O no hydrogen 3.263 N/A SER 395.A OG ALA 397.A O no hydrogen 3.398 N/A ILE 396.A N THR 428.A O no hydrogen 3.065 N/A ASN 398.A N ALA 349.A O no hydrogen 2.856 N/A ASN 398.A ND2 GLU 346.A OE2 no hydrogen 2.841 N/A GLU 399.A N VAL 430.A O no hydrogen 2.880 N/A ASP 401.A N PHE 352.A O no hydrogen 3.417 N/A ARG 403.A N ASP 401.A OD1 no hydrogen 2.961 N/A ARG 403.A NE ASP 401.A OD1 no hydrogen 2.915 N/A ARG 403.A NE ASP 401.A OD2 no hydrogen 3.347 N/A ARG 403.A NH2 SER 355.A OG no hydrogen 2.661 N/A ARG 403.A NH2 ASP 401.A OD2 no hydrogen 2.509 N/A ARG 408.A N ASP 439.A OD2 no hydrogen 3.223 N/A ARG 408.A NH2 ASP 443.A OD1 no hydrogen 2.831 N/A TYR 410.A N GLY 406.A O no hydrogen 2.614 N/A TYR 410.A OH HIS 375.A ND1 no hydrogen 2.776 N/A PHE 411.A N ALA 407.A O no hydrogen 2.976 N/A ALA 412.A N ARG 408.A O no hydrogen 3.176 N/A ALA 415.A N PHE 411.A O no hydrogen 2.614 N/A GLU 416.A N ALA 412.A O no hydrogen 2.762 N/A ALA 417.A N PRO 413.A O no hydrogen 2.678 N/A THR 418.A N LEU 414.A O no hydrogen 3.078 N/A THR 418.A OG1 LEU 414.A O no hydrogen 3.489 N/A THR 418.A OG1 ALA 415.A O no hydrogen 3.385 N/A ARG 419.A N ALA 415.A O no hydrogen 3.452 N/A LYS 420.A N GLU 416.A O no hydrogen 3.143 N/A LEU 421.A N ALA 417.A O no hydrogen 3.165 N/A LEU 421.A N THR 418.A O no hydrogen 3.281 N/A ASP 422.A N THR 418.A O no hydrogen 3.098 N/A THR 424.A OG1 ASP 422.A OD1 no hydrogen 2.972 N/A THR 424.A OG1 ASP 422.A OD2 no hydrogen 2.596 N/A ARG 425.A NE VAL 392.A O no hydrogen 2.745 N/A ARG 425.A NH2 LYS 387.A O no hydrogen 2.456 N/A THR 428.A N TRP 394.A O no hydrogen 2.608 N/A THR 428.A OG1 VAL 447.A O no hydrogen 2.777 N/A VAL 430.A N ALA 397.A O no hydrogen 3.030 N/A ASN 431.A N CYS 449.A O no hydrogen 2.903 N/A THR 438.A OG1 ALA 436.A O no hydrogen 2.368 N/A ILE 441.A N ASP 439.A O no hydrogen 2.887 N/A SER 442.A OG HIS 437.A NE2 no hydrogen 2.592 N/A PHE 445.A N SER 442.A O no hydrogen 3.213 N/A ASP 446.A N ILE 427.A O no hydrogen 2.947 N/A LEU 448.A N PRO 484.A O no hydrogen 2.658 N/A CYS 449.A SG THR 428.A OG1 no hydrogen 3.482 N/A LEU 450.A N ILE 486.A O no hydrogen 2.697 N/A ASN 451.A N ASN 431.A O no hydrogen 3.094 N/A ASN 451.A ND2 ASN 398.A OD1 no hydrogen 3.581 N/A ASN 451.A ND2 GLU 399.A OE1 no hydrogen 2.783 N/A ARG 452.A N GLU 489.A O no hydrogen 2.598 N/A TYR 453.A OH ASP 493.A OD2 no hydrogen 2.587 N/A TYR 457.A N TYR 454.A O no hydrogen 2.811 N/A VAL 458.A N TYR 454.A O no hydrogen 2.719 N/A ASP 462.A N GLN 459.A O no hydrogen 3.198 N/A GLU 464.A N GLU 464.A OE1 no hydrogen 2.298 N/A THR 465.A N ASP 462.A OD1 no hydrogen 2.670 N/A THR 465.A OG1 ASP 462.A OD2 no hydrogen 3.296 N/A ALA 466.A N ASP 462.A OD1 no hydrogen 3.323 N/A GLU 467.A N LEU 463.A O no hydrogen 2.932 N/A LYS 468.A N GLU 464.A O no hydrogen 3.328 N/A VAL 469.A N THR 465.A O no hydrogen 3.279 N/A LEU 470.A N ALA 466.A O no hydrogen 3.235 N/A GLU 471.A N GLU 467.A O no hydrogen 3.076 N/A LYS 472.A N LYS 468.A O no hydrogen 3.147 N/A GLU 473.A N VAL 469.A O no hydrogen 2.923 N/A GLU 473.A N LEU 470.A O no hydrogen 3.264 N/A LEU 474.A N LEU 470.A O no hydrogen 2.952 N/A LEU 475.A N GLU 471.A O no hydrogen 3.051 N/A ALA 476.A N LYS 472.A O no hydrogen 3.283 N/A TRP 477.A N GLU 473.A O no hydrogen 3.000 N/A GLN 478.A N LEU 474.A O no hydrogen 3.048 N/A GLU 479.A N LEU 475.A O no hydrogen 2.952 N/A LYS 480.A N ALA 476.A O no hydrogen 2.965 N/A LYS 480.A NZ CYS 434.A O no hydrogen 3.434 N/A LEU 481.A N TRP 477.A O no hydrogen 3.202 N/A HIS 482.A N GLN 478.A O no hydrogen 2.737 N/A GLN 483.A NE2 SER 442.A O no hydrogen 3.036 N/A GLN 483.A NE2 PHE 445.A O no hydrogen 3.188 N/A ILE 485.A N ALA 524.A O no hydrogen 2.713 N/A ILE 486.A N LEU 448.A O no hydrogen 2.550 N/A ILE 487.A N GLY 527.A O no hydrogen 2.821 N/A THR 488.A N LEU 450.A O no hydrogen 3.070 N/A THR 488.A OG1 ASN 451.A OD1 no hydrogen 2.685 N/A TYR 490.A OH HIS 516.A NE2 no hydrogen 2.732 N/A THR 494.A N LYS 549.A O no hydrogen 3.008 N/A THR 494.A OG1 VAL 492.A O no hydrogen 3.165 N/A SER 500.A N GLU 507.A OE2 no hydrogen 2.654 N/A SER 500.A OG ASP 503.A OD1 no hydrogen 3.011 N/A SER 505.A OG ASP 503.A O no hydrogen 2.729 N/A GLU 506.A N LEU 498.A O no hydrogen 2.871 N/A TYR 508.A N SER 505.A O no hydrogen 2.972 N/A TYR 508.A N SER 505.A OG no hydrogen 3.085 N/A GLN 509.A N SER 505.A O no hydrogen 3.117 N/A GLN 509.A NE2 GLY 551.A O no hydrogen 3.039 N/A CYS 510.A N GLU 506.A O no hydrogen 3.094 N/A CYS 510.A SG GLU 506.A O no hydrogen 3.683 N/A CYS 510.A SG SER 561.A OG no hydrogen 3.156 N/A ALA 511.A N GLU 507.A O no hydrogen 3.201 N/A TRP 512.A N TYR 508.A O no hydrogen 2.836 N/A LEU 513.A N GLN 509.A O no hydrogen 2.878 N/A ASP 514.A N CYS 510.A O no hydrogen 2.938 N/A HIS 516.A N LEU 513.A O no hydrogen 3.176 N/A HIS 516.A NE2 TYR 490.A OH no hydrogen 2.732 N/A ARG 517.A N ASP 514.A O no hydrogen 3.004 N/A ARG 517.A NH2 GLU 467.A OE1 no hydrogen 2.637 N/A VAL 518.A N TYR 515.A O no hydrogen 2.706 N/A PHE 519.A N TYR 515.A O no hydrogen 3.039 N/A ASP 520.A N HIS 516.A O no hydrogen 2.954 N/A ARG 521.A N VAL 518.A O no hydrogen 2.976 N/A ARG 521.A NE GLU 471.A OE1 no hydrogen 2.538 N/A VAL 522.A N PHE 519.A O no hydrogen 2.779 N/A SER 523.A OG GLN 478.A OE1 no hydrogen 2.669 N/A VAL 525.A N VAL 522.A O no hydrogen 2.993 N/A VAL 526.A N ILE 485.A O no hydrogen 2.671 N/A GLU 528.A N PHE 288.A O no hydrogen 2.976 N/A GLN 529.A N ILE 487.A O no hydrogen 2.747 N/A VAL 530.A N GLY 290.A O no hydrogen 2.861 N/A TRP 531.A N TYR 490.A O no hydrogen 3.472 N/A PHE 533.A N GLY 292.A O no hydrogen 3.215 N/A PHE 533.A N ASN 532.A OD1 no hydrogen 2.430 N/A ASP 535.A N PHE 553.A O no hydrogen 2.937 N/A ALA 537.A N ASP 296.A OD1 no hydrogen 2.969 N/A THR 538.A OG1 SER 539.A O no hydrogen 3.247 N/A SER 539.A N ASP 162.A O no hydrogen 2.981 N/A VAL 545.A N ASN 548.A OD1 no hydrogen 2.979 N/A ASN 548.A ND2 LEU 543.A O no hydrogen 2.511 N/A LYS 549.A NZ GLY 546.A O no hydrogen 3.118 N/A LYS 549.A NZ GLY 547.A O no hydrogen 3.456 N/A LYS 550.A N ASN 548.A O no hydrogen 2.961 N/A GLY 551.A N ASP 535.A OD1 no hydrogen 2.796 N/A ILE 552.A N ASN 532.A O no hydrogen 3.110 N/A ILE 552.A N PHE 533.A O no hydrogen 3.255 N/A PHE 553.A N PHE 533.A O no hydrogen 2.864 N/A THR 554.A N LYS 558.A O no hydrogen 2.855 N/A THR 554.A OG1 ASP 556.A OD1 no hydrogen 2.556 N/A THR 554.A OG1 LYS 558.A O no hydrogen 3.456 N/A ARG 555.A NE ASP 296.A OD2 no hydrogen 2.821 N/A ARG 555.A NH1 ASP 298.A OD1 no hydrogen 3.550 N/A ARG 555.A NH2 TYR 166.A OH no hydrogen 3.369 N/A ARG 555.A NH2 ASP 296.A OD1 no hydrogen 2.537 N/A ARG 555.A NH2 ASP 296.A OD2 no hydrogen 3.251 N/A ARG 557.A N THR 554.A O no hydrogen 2.812 N/A ARG 557.A NE ASP 311.A OD1 no hydrogen 2.815 N/A ARG 557.A NH2 ASP 296.A O no hydrogen 3.079 N/A LYS 558.A N THR 554.A OG1 no hydrogen 2.612 N/A LYS 558.A NZ ASP 556.A OD2 no hydrogen 3.307 N/A LYS 560.A N ILE 552.A O no hydrogen 2.855 N/A LYS 560.A NZ THR 494.A O no hydrogen 3.044 N/A LYS 560.A NZ ASP 535.A OD1 no hydrogen 2.866 N/A LYS 560.A NZ GLY 551.A O no hydrogen 2.794 N/A SER 561.A N GLU 506.A OE1 no hydrogen 2.644 N/A SER 561.A OG GLU 506.A OE1 no hydrogen 3.195 N/A ALA 563.A N LYS 560.A O no hydrogen 2.941 N/A PHE 564.A N SER 561.A O no hydrogen 3.050 N/A LEU 566.A N ALA 562.A O no hydrogen 3.382 N/A GLN 567.A N ALA 563.A O no hydrogen 2.818 N/A LYS 568.A N PHE 564.A O no hydrogen 3.140 N/A LYS 568.A NZ PHE 564.A O no hydrogen 3.516 N/A ARG 569.A N LEU 565.A O no hydrogen 3.181 N/A ARG 569.A NH2 ASP 520.A OD2 no hydrogen 2.839 N/A TRP 570.A N LEU 566.A O no hydrogen 2.859 N/A TRP 570.A NE1 GLU 528.A OE2 no hydrogen 3.007 N/A THR 571.A N GLN 567.A O no hydrogen 3.165 N/A THR 571.A OG1 GLN 567.A O no hydrogen 2.395 N/A GLY 572.A N LYS 568.A O no hydrogen 2.813 N/A GLU 576.A N ASN 573.A O no hydrogen 3.416 N/A LYS 577.A NZ PHE 519.A O no hydrogen 3.328 N/A LYS 577.A NZ SER 523.A O no hydrogen 3.415 N/A LYS 577.A NZ VAL 525.A O no hydrogen 2.964 N/A GLN 579.A N GLN 579.A OE1 no hydrogen 2.561 N/A