Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ml2_0.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 96.A OE1 no hydrogen 3.553 N/A MET 1.A N GLU 96.A OE2 no hydrogen 2.960 N/A ILE 5.A N LEU 8.A O no hydrogen 3.232 N/A VAL 10.A N PHE 3.A O no hydrogen 3.302 N/A PHE 12.A N MET 1.A O no hydrogen 3.173 N/A GLU 20.A N GLU 20.A OE1 no hydrogen 2.580 N/A GLN 21.A NE2 THR 46.A OG1 no hydrogen 3.346 N/A TYR 22.A N TYR 18.A O no hydrogen 3.357 N/A ASN 23.A N PRO 19.A O no hydrogen 3.148 N/A TYR 24.A N GLU 20.A O no hydrogen 2.999 N/A TYR 24.A OH THR 459.A OG1 no hydrogen 2.160 N/A MET 25.A N GLN 21.A O no hydrogen 2.673 N/A CYS 26.A N TYR 22.A O no hydrogen 2.638 N/A CYS 26.A SG ASP 27.A OD1 no hydrogen 3.405 N/A ASP 27.A N ASN 23.A O no hydrogen 2.925 N/A ILE 28.A N TYR 24.A O no hydrogen 2.681 N/A LYS 29.A N MET 25.A O no hydrogen 2.972 N/A LYS 29.A NZ ASP 33.A OD2 no hydrogen 3.555 N/A LYS 30.A N CYS 26.A O no hydrogen 2.711 N/A THR 31.A N ASP 27.A O no hydrogen 2.726 N/A THR 31.A OG1 ASP 27.A O no hydrogen 2.446 N/A LEU 32.A N ILE 28.A O no hydrogen 2.527 N/A ASP 33.A N LYS 29.A O no hydrogen 3.102 N/A SER 38.A OG THR 31.A OG1 no hydrogen 3.399 N/A LEU 40.A N ILE 458.A O no hydrogen 2.400 N/A SER 44.A OG GLY 667.A O no hydrogen 3.118 N/A THR 46.A N PRO 43.A O no hydrogen 3.134 N/A SER 51.A N GLY 47.A O no hydrogen 3.250 N/A SER 51.A OG GLY 47.A O no hydrogen 3.166 N/A SER 51.A OG LYS 48.A O no hydrogen 2.658 N/A LEU 52.A N LYS 48.A O no hydrogen 2.569 N/A LEU 53.A N THR 49.A O no hydrogen 2.843 N/A SER 54.A N VAL 50.A O no hydrogen 3.119 N/A SER 54.A OG VAL 50.A O no hydrogen 3.091 N/A SER 54.A OG SER 51.A O no hydrogen 3.517 N/A THR 56.A N LEU 52.A O no hydrogen 3.353 N/A THR 56.A OG1 LEU 52.A O no hydrogen 2.763 N/A THR 56.A OG1 LEU 53.A O no hydrogen 3.460 N/A ILE 57.A N LEU 53.A O no hydrogen 2.962 N/A ALA 58.A N SER 54.A O no hydrogen 3.170 N/A TYR 59.A N LEU 55.A O no hydrogen 2.413 N/A GLN 60.A N THR 56.A O no hydrogen 2.676 N/A MET 61.A N ILE 57.A O no hydrogen 3.176 N/A HIS 62.A N TYR 59.A O no hydrogen 3.211 N/A TYR 63.A N TYR 59.A O no hydrogen 2.548 N/A TYR 63.A OH ASP 7.A OD2 no hydrogen 3.273 N/A ARG 67.A N GLU 65.A O no hydrogen 2.720 N/A ARG 67.A NH1 GLN 60.A O no hydrogen 2.657 N/A ARG 67.A NH2 GLN 60.A O no hydrogen 2.375 N/A LYS 68.A NZ CYS 203.A O no hydrogen 2.551 N/A LYS 68.A NZ GLU 225.A OE2 no hydrogen 3.217 N/A ILE 69.A N ASN 204.A O no hydrogen 2.875 N/A ILE 70.A N ILE 231.A O no hydrogen 2.797 N/A TYR 71.A N ILE 206.A O no hydrogen 3.205 N/A CYS 72.A N ILE 233.A O no hydrogen 3.107 N/A SER 73.A OG THR 75.A O no hydrogen 3.292 N/A SER 77.A OG GLY 609.A O no hydrogen 3.323 N/A GLU 80.A N MET 76.A O no hydrogen 3.480 N/A LYS 81.A N SER 77.A O no hydrogen 3.390 N/A LYS 81.A NZ SER 77.A OG no hydrogen 3.206 N/A ALA 82.A N GLU 78.A O no hydrogen 3.163 N/A LEU 83.A N ILE 79.A O no hydrogen 2.962 N/A VAL 84.A N GLU 80.A O no hydrogen 2.701 N/A GLU 85.A N LYS 81.A O no hydrogen 3.247 N/A LEU 86.A N ALA 82.A O no hydrogen 2.803 N/A GLU 87.A N LEU 83.A O no hydrogen 3.020 N/A ASN 88.A N VAL 84.A O no hydrogen 3.093 N/A LEU 89.A N GLU 85.A O no hydrogen 2.870 N/A MET 90.A N LEU 86.A O no hydrogen 2.768 N/A ASP 91.A N GLU 87.A O no hydrogen 2.920 N/A TYR 92.A N ASN 88.A O no hydrogen 2.763 N/A ARG 93.A N LEU 89.A O no hydrogen 2.545 N/A THR 94.A N MET 90.A O no hydrogen 2.808 N/A THR 94.A OG1 MET 90.A O no hydrogen 3.236 N/A THR 94.A OG1 ASP 91.A O no hydrogen 2.295 N/A LYS 95.A N ASP 91.A O no hydrogen 2.486 N/A GLU 96.A N TYR 92.A O no hydrogen 2.840 N/A LEU 97.A N ARG 93.A O no hydrogen 2.559 N/A GLY 98.A N THR 94.A O no hydrogen 2.459 N/A GLN 100.A NE2 LEU 97.A O no hydrogen 2.426 N/A ARG 104.A N ASN 204.A OD1 no hydrogen 3.185 N/A LEU 108.A N ILE 207.A O no hydrogen 2.898 N/A LYS 112.A NZ GLU 123.A O no hydrogen 2.269 N/A LYS 112.A NZ ARG 124.A O no hydrogen 3.025 N/A ASN 113.A ND2 THR 109.A OG1 no hydrogen 3.270 N/A LEU 114.A N ARG 111.A O no hydrogen 2.693 N/A CYS 115.A N ARG 111.A O no hydrogen 2.356 N/A CYS 115.A SG HIS 117.A O no hydrogen 3.546 N/A CYS 115.A SG SER 121.A OG no hydrogen 3.209 N/A VAL 120.A N HIS 117.A ND1 no hydrogen 2.960 N/A SER 121.A N HIS 117.A O no hydrogen 2.600 N/A SER 121.A OG CYS 115.A O no hydrogen 2.072 N/A SER 121.A OG HIS 117.A O no hydrogen 2.706 N/A LYS 122.A N PRO 118.A O no hydrogen 2.418 N/A LYS 125.A N GLU 123.A OE2 no hydrogen 3.203 N/A ASP 130.A N GLY 126.A O no hydrogen 3.280 N/A GLU 131.A N THR 127.A O no hydrogen 3.015 N/A LYS 132.A N VAL 128.A O no hydrogen 2.583 N/A LYS 132.A NZ GLU 119.A O no hydrogen 3.138 N/A LYS 132.A NZ GLU 119.A OE2 no hydrogen 2.514 N/A CYS 133.A N VAL 129.A O no hydrogen 3.081 N/A CYS 133.A SG THR 137.A OG1 no hydrogen 2.741 N/A ARG 134.A N ASP 130.A O no hydrogen 2.872 N/A ARG 135.A N GLU 131.A O no hydrogen 2.699 N/A ARG 135.A NH2 THR 391.A O no hydrogen 2.630 N/A MET 136.A N LYS 132.A O no hydrogen 2.365 N/A THR 137.A N CYS 133.A O no hydrogen 2.047 N/A THR 137.A OG1 CYS 133.A O no hydrogen 2.479 N/A GLN 140.A N ASN 138.A OD1 no hydrogen 2.830 N/A LYS 142.A N ASN 138.A O no hydrogen 2.203 N/A LYS 142.A NZ GLU 146.A OE1 no hydrogen 3.309 N/A LYS 142.A NZ GLU 146.A OE2 no hydrogen 2.659 N/A ARG 143.A NE GLY 139.A O no hydrogen 2.977 N/A LYS 144.A N GLN 140.A O no hydrogen 2.476 N/A LEU 145.A N LYS 142.A O no hydrogen 2.329 N/A GLU 146.A N LYS 142.A O no hydrogen 2.708 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.798 N/A GLU 147.A N ARG 143.A O no hydrogen 3.033 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.609 N/A ASN 161.A N GLU 157.A O no hydrogen 3.030 N/A ASN 161.A ND2 THR 189.A O no hydrogen 2.142 N/A LEU 162.A N TYR 158.A O no hydrogen 2.693 N/A TYR 163.A N HIS 159.A O no hydrogen 2.990 N/A ASN 164.A N ASN 161.A O no hydrogen 3.369 N/A VAL 167.A N LEU 162.A O no hydrogen 2.877 N/A GLU 168.A N GLU 166.A O no hydrogen 2.725 N/A ASP 169.A N GLU 166.A O no hydrogen 3.029 N/A TYR 170.A N ASP 169.A OD1 no hydrogen 2.592 N/A LYS 173.A NZ TYR 99.A OH no hydrogen 2.527 N/A LYS 173.A NZ GLU 101.A OE1 no hydrogen 2.974 N/A SER 177.A OG GLU 87.A OE1 no hydrogen 3.159 N/A LEU 181.A N SER 177.A O no hydrogen 2.597 N/A LEU 182.A N PHE 178.A O no hydrogen 3.350 N/A TYR 184.A N LYS 180.A O no hydrogen 3.153 N/A CYS 185.A N LEU 181.A O no hydrogen 2.812 N/A CYS 185.A SG LEU 181.A O no hydrogen 3.020 N/A GLU 186.A N LEU 182.A O no hydrogen 2.456 N/A GLU 187.A N LYS 183.A O no hydrogen 2.618 N/A LYS 188.A N TYR 184.A O no hydrogen 2.575 N/A THR 189.A N GLU 186.A O no hydrogen 2.960 N/A LEU 190.A N CYS 185.A O no hydrogen 2.356 N/A CYS 191.A SG CYS 191.A O no hydrogen 2.776 N/A ILE 195.A N CYS 191.A O no hydrogen 2.937 N/A VAL 196.A N PRO 192.A O no hydrogen 2.700 N/A ARG 197.A N TYR 193.A O no hydrogen 2.983 N/A ARG 198.A N ILE 195.A O no hydrogen 3.005 N/A ARG 198.A NH1 ASP 169.A O no hydrogen 2.190 N/A ARG 198.A NH2 ASP 169.A O no hydrogen 2.639 N/A MET 199.A N ILE 195.A O no hydrogen 3.230 N/A MET 199.A N VAL 196.A O no hydrogen 3.228 N/A LEU 202.A N MET 199.A O no hydrogen 2.792 N/A CYS 203.A N MET 199.A O no hydrogen 2.971 N/A CYS 203.A SG MET 199.A O no hydrogen 3.132 N/A ASN 204.A N ARG 104.A O no hydrogen 2.827 N/A ILE 206.A N ILE 69.A O no hydrogen 2.932 N/A TYR 208.A N TYR 71.A O no hydrogen 3.465 N/A SER 209.A OG ARG 74.A O no hydrogen 2.770 N/A HIS 211.A NE2 GLU 246.A OE1 no hydrogen 2.759 N/A LEU 213.A N TYR 210.A O no hydrogen 2.996 N/A LEU 214.A N TYR 210.A O no hydrogen 2.511 N/A LYS 217.A NZ ASP 215.A OD1 no hydrogen 2.796 N/A ILE 218.A N ASP 215.A O no hydrogen 3.191 N/A ALA 219.A N ASP 215.A O no hydrogen 3.000 N/A SER 223.A OG ARG 221.A O no hydrogen 3.104 N/A SER 227.A N ASN 224.A O no hydrogen 3.055 N/A SER 227.A OG ASN 224.A OD1 no hydrogen 3.542 N/A LYS 228.A N ASN 224.A O no hydrogen 2.644 N/A SER 230.A N SER 227.A O no hydrogen 3.485 N/A SER 230.A OG VAL 226.A O no hydrogen 2.248 N/A ILE 231.A N LYS 68.A O no hydrogen 2.959 N/A VAL 232.A N SER 455.A O no hydrogen 3.147 N/A ILE 233.A N ILE 70.A O no hydrogen 2.761 N/A PHE 234.A N ILE 457.A O no hydrogen 2.692 N/A ALA 237.A N SER 460.A OG no hydrogen 2.449 N/A ASN 242.A N ASP 241.A OD1 no hydrogen 2.728 N/A CYS 244.A N ILE 240.A O no hydrogen 2.815 N/A CYS 244.A SG ILE 240.A O no hydrogen 3.055 N/A ILE 245.A N ASP 241.A O no hydrogen 2.615 N/A GLU 246.A N ASN 242.A O no hydrogen 2.638 N/A SER 247.A N VAL 243.A O no hydrogen 2.715 N/A SER 247.A OG VAL 243.A O no hydrogen 2.882 N/A SER 247.A OG CYS 244.A O no hydrogen 2.727 N/A LEU 248.A N ILE 245.A O no hydrogen 3.391 N/A SER 249.A OG ILE 245.A O no hydrogen 2.565 N/A SER 249.A OG THR 438.A OG1 no hydrogen 2.691 N/A LEU 250.A N PHE 437.A O no hydrogen 2.700 N/A LEU 257.A N THR 253.A O no hydrogen 2.906 N/A ARG 258.A N THR 254.A O no hydrogen 2.969 N/A ARG 259.A N ASP 255.A O no hydrogen 3.088 N/A ARG 259.A NH1 THR 397.A OG1 no hydrogen 2.290 N/A ARG 259.A NH2 GLU 394.A O no hydrogen 2.801 N/A ARG 259.A NH2 THR 397.A OG1 no hydrogen 2.655 N/A ALA 260.A N ALA 256.A O no hydrogen 3.116 N/A THR 261.A N LEU 257.A O no hydrogen 3.410 N/A THR 261.A OG1 ARG 258.A O no hydrogen 2.361 N/A ARG 262.A N ARG 258.A O no hydrogen 3.431 N/A GLY 263.A N ARG 259.A O no hydrogen 3.106 N/A ALA 264.A N ALA 260.A O no hydrogen 2.520 N/A ASN 265.A N THR 261.A O no hydrogen 2.694 N/A ALA 266.A N ARG 262.A O no hydrogen 2.467 N/A LEU 267.A N GLY 263.A O no hydrogen 2.201 N/A ASP 268.A N ALA 264.A O no hydrogen 2.455 N/A GLU 269.A N ASN 265.A O no hydrogen 2.300 N/A ARG 270.A N ALA 266.A O no hydrogen 2.289 N/A ARG 270.A NH2 LEU 388.A O no hydrogen 2.143 N/A ILE 271.A N LEU 267.A O no hydrogen 2.273 N/A GLU 273.A N GLU 269.A O no hydrogen 2.928 N/A VAL 274.A N ARG 270.A O no hydrogen 3.321 N/A ARG 275.A N ILE 271.A O no hydrogen 3.231 N/A LYS 276.A N SER 272.A O no hydrogen 3.284 N/A LYS 276.A NZ SER 272.A O no hydrogen 3.297 N/A VAL 277.A N GLU 273.A O no hydrogen 3.342 N/A ASP 278.A N VAL 274.A O no hydrogen 2.493 N/A SER 279.A OG GLN 283.A OE1 no hydrogen 2.683 N/A GLN 280.A NE2 ASP 278.A OD2 no hydrogen 2.978 N/A LYS 281.A N ASP 278.A OD1 no hydrogen 2.933 N/A LYS 281.A NZ ASP 278.A O no hydrogen 2.159 N/A GLN 283.A N SER 279.A O no hydrogen 2.708 N/A ASP 284.A N GLN 280.A O no hydrogen 3.106 N/A GLU 285.A N LYS 281.A O no hydrogen 2.924 N/A TYR 286.A N LEU 282.A O no hydrogen 3.289 N/A TYR 286.A N GLN 283.A O no hydrogen 2.501 N/A GLU 287.A N GLN 283.A O no hydrogen 3.101 N/A GLU 287.A N GLU 287.A OE1 no hydrogen 2.763 N/A LYS 288.A N ASP 284.A O no hydrogen 3.090 N/A LEU 289.A N TYR 286.A O no hydrogen 3.025 N/A VAL 290.A N TYR 286.A O no hydrogen 2.942 N/A GLN 291.A N GLU 287.A O no hydrogen 3.146 N/A GLN 291.A NE2 LYS 288.A O no hydrogen 2.683 N/A GLY 292.A N LEU 289.A O no hydrogen 2.731 N/A ASP 297.A N HIS 294.A O no hydrogen 3.185 N/A THR 300.A N SER 295.A O no hydrogen 3.288 N/A THR 300.A OG1 SER 295.A O no hydrogen 3.126 N/A GLN 302.A N GLN 302.A OE1 no hydrogen 2.581 N/A PHE 306.A N SER 382.A OG no hydrogen 2.836 N/A VAL 307.A N SER 382.A OG no hydrogen 2.865 N/A GLU 308.A N GLU 308.A OE1 no hydrogen 2.721 N/A THR 309.A OG1 THR 309.A O no hydrogen 2.578 N/A LEU 312.A N TYR 412.A OH no hydrogen 3.173 N/A GLN 314.A N LEU 312.A O no hydrogen 2.481 N/A GLY 323.A N ILE 321.A O no hydrogen 2.554 N/A ILE 325.A N PRO 322.A O no hydrogen 2.736 N/A ARG 326.A NH1 TYR 286.A O no hydrogen 2.864 N/A ARG 326.A NH2 TYR 286.A O no hydrogen 3.245 N/A ALA 328.A N TYR 286.A OH no hydrogen 2.761 N/A PHE 331.A N ARG 327.A O no hydrogen 2.861 N/A VAL 332.A N ALA 328.A O no hydrogen 2.547 N/A SER 333.A N GLU 329.A O no hydrogen 2.638 N/A SER 333.A OG GLU 329.A O no hydrogen 2.812 N/A SER 333.A OG HIS 330.A O no hydrogen 2.749 N/A PHE 334.A N HIS 330.A O no hydrogen 2.291 N/A LEU 335.A N PHE 331.A O no hydrogen 2.563 N/A LYS 336.A N VAL 332.A O no hydrogen 2.406 N/A ARG 337.A N PHE 334.A O no hydrogen 3.006 N/A LEU 338.A N PHE 334.A O no hydrogen 2.925 N/A ILE 339.A N LEU 335.A O no hydrogen 3.428 N/A TYR 341.A OH HIS 362.A ND1 no hydrogen 2.239 N/A ARG 345.A N TYR 341.A O no hydrogen 3.352 N/A LYS 347.A N LYS 343.A O no hydrogen 3.302 N/A LYS 347.A NZ LYS 343.A O no hydrogen 2.583 N/A VAL 348.A N ARG 345.A O no hydrogen 3.408 N/A ILE 352.A N ILE 420.A O no hydrogen 3.029 N/A GLU 354.A N LEU 418.A O no hydrogen 3.011 N/A SER 358.A N THR 355.A OG1 no hydrogen 3.035 N/A SER 358.A OG GLU 354.A OE1 no hydrogen 3.254 N/A PHE 359.A N THR 355.A O no hydrogen 3.030 N/A LEU 360.A N PRO 356.A O no hydrogen 2.863 N/A GLN 361.A N LYS 357.A O no hydrogen 2.415 N/A HIS 362.A N SER 358.A O no hydrogen 2.617 N/A HIS 362.A ND1 TYR 341.A OH no hydrogen 2.239 N/A LEU 363.A N PHE 359.A O no hydrogen 2.520 N/A LYS 364.A N LEU 360.A O no hydrogen 2.749 N/A LYS 364.A NZ GLU 370.A OE1 no hydrogen 2.284 N/A GLN 365.A N GLN 361.A O no hydrogen 2.507 N/A LEU 366.A N HIS 362.A O no hydrogen 3.085 N/A THR 367.A N LEU 363.A O no hydrogen 2.685 N/A ILE 369.A N THR 367.A O no hydrogen 2.855 N/A LEU 374.A N GLU 370.A O no hydrogen 3.007 N/A ARG 375.A N ARG 371.A O no hydrogen 2.884 N/A ARG 375.A N LYS 372.A O no hydrogen 3.134 N/A ARG 375.A NH2 SER 410.A O no hydrogen 3.446 N/A PHE 376.A N PRO 373.A O no hydrogen 3.067 N/A CYS 377.A N LEU 374.A O no hydrogen 3.356 N/A CYS 377.A SG LEU 374.A O no hydrogen 3.545 N/A CYS 377.A SG ALA 403.A O no hydrogen 3.219 N/A CYS 377.A SG THR 407.A OG1 no hydrogen 2.969 N/A SER 378.A OG ALA 403.A O no hydrogen 2.848 N/A SER 378.A OG THR 407.A OG1 no hydrogen 2.351 N/A GLU 379.A N GLU 379.A OE1 no hydrogen 2.608 N/A ARG 380.A N PHE 376.A O no hydrogen 3.220 N/A LEU 381.A N CYS 377.A O no hydrogen 2.863 N/A SER 382.A N SER 378.A O no hydrogen 3.067 N/A LEU 383.A N GLU 379.A O no hydrogen 3.012 N/A LEU 384.A N ARG 380.A O no hydrogen 3.393 N/A VAL 385.A N LEU 381.A O no hydrogen 3.140 N/A ARG 386.A N SER 382.A O no hydrogen 3.348 N/A ARG 386.A NH1 ASP 297.A O no hydrogen 2.451 N/A THR 387.A N LEU 383.A O no hydrogen 2.709 N/A THR 387.A OG1 LEU 384.A O no hydrogen 2.422 N/A LEU 388.A N LEU 384.A O no hydrogen 2.322 N/A VAL 390.A N VAL 385.A O no hydrogen 3.021 N/A PHE 396.A N VAL 393.A O no hydrogen 2.715 N/A THR 397.A N GLU 394.A O no hydrogen 3.236 N/A THR 397.A OG1 GLU 394.A O no hydrogen 3.016 N/A LEU 399.A N PHE 396.A O no hydrogen 3.131 N/A LYS 400.A N PHE 396.A O no hydrogen 3.355 N/A LYS 400.A NZ PHE 396.A O no hydrogen 2.661 N/A ASP 401.A N THR 397.A O no hydrogen 3.408 N/A ALA 403.A N LEU 399.A O no hydrogen 3.325 N/A THR 404.A N LYS 400.A O no hydrogen 3.094 N/A THR 404.A OG1 LYS 400.A O no hydrogen 3.224 N/A PHE 405.A N ASP 401.A O no hydrogen 3.222 N/A ALA 406.A N ILE 402.A O no hydrogen 2.782 N/A THR 407.A N ALA 403.A O no hydrogen 3.224 N/A THR 407.A OG1 SER 378.A OG no hydrogen 2.351 N/A THR 407.A OG1 ALA 403.A O no hydrogen 2.595 N/A LEU 408.A N THR 404.A O no hydrogen 3.114 N/A ILE 409.A N PHE 405.A O no hydrogen 2.813 N/A SER 410.A N ALA 406.A O no hydrogen 3.047 N/A SER 410.A OG ARG 371.A O no hydrogen 2.557 N/A THR 411.A N LEU 408.A O no hydrogen 3.182 N/A THR 411.A OG1 THR 407.A O no hydrogen 2.380 N/A TYR 412.A N LEU 408.A O no hydrogen 2.943 N/A LEU 417.A N THR 438.A O no hydrogen 3.133 N/A LEU 418.A N GLU 354.A O no hydrogen 2.647 N/A ILE 419.A N ARG 436.A O no hydrogen 2.807 N/A ILE 420.A N ILE 352.A O no hydrogen 2.391 N/A ASN 427.A N GLU 424.A O no hydrogen 2.765 N/A ILE 434.A N GLU 421.A O no hydrogen 2.552 N/A MET 435.A N LEU 252.A O no hydrogen 3.099 N/A ARG 436.A NH1 LEU 250.A O no hydrogen 3.349 N/A ARG 436.A NH1 ASP 251.A OD1 no hydrogen 2.600 N/A PHE 437.A N LEU 250.A O no hydrogen 2.944 N/A THR 438.A N LEU 417.A O no hydrogen 3.259 N/A THR 438.A OG1 SER 249.A OG no hydrogen 2.691 N/A THR 438.A OG1 CYS 439.A O no hydrogen 3.338 N/A CYS 439.A SG ASP 441.A O no hydrogen 3.104 N/A LEU 440.A N GLY 415.A O no hydrogen 3.277 N/A SER 443.A N ASP 441.A OD1 no hydrogen 3.084 N/A SER 443.A OG ASP 441.A OD1 no hydrogen 2.592 N/A SER 443.A OG TYR 646.A OH no hydrogen 3.307 N/A ILE 444.A N ASP 441.A O no hydrogen 3.287 N/A LYS 447.A N SER 443.A O no hydrogen 2.743 N/A LYS 447.A NZ GLU 451.A OE1 no hydrogen 3.552 N/A PHE 450.A N ILE 446.A O no hydrogen 2.756 N/A GLU 451.A N LYS 447.A O no hydrogen 2.284 N/A ARG 452.A N PRO 448.A O no hydrogen 2.262 N/A ARG 452.A NH2 SER 227.A OG no hydrogen 2.775 N/A PHE 453.A N VAL 449.A O no hydrogen 2.574 N/A VAL 456.A N GLY 36.A O no hydrogen 3.207 N/A THR 459.A N PHE 234.A O no hydrogen 2.674 N/A THR 459.A OG1 TYR 24.A OH no hydrogen 2.160 N/A THR 459.A OG1 LEU 40.A O no hydrogen 3.119 N/A GLY 461.A N GLU 236.A OE2 no hydrogen 3.503 N/A SER 464.A OG GLN 692.A O no hydrogen 3.403 N/A ARG 471.A N ASP 467.A O no hydrogen 3.184 N/A MET 472.A N MET 468.A O no hydrogen 3.021 N/A LEU 473.A N TYR 469.A O no hydrogen 2.715 N/A LYS 476.A NZ THR 477.A O no hydrogen 2.961 N/A THR 477.A OG1 GLN 480.A OE1 no hydrogen 2.192 N/A LEU 479.A N SER 38.A OG no hydrogen 2.343 N/A GLN 480.A NE2 ASP 467.A OD1 no hydrogen 2.737 N/A SER 482.A OG GLU 41.A OE1 no hydrogen 3.097 N/A THR 486.A N GLU 20.A OE2 no hydrogen 3.132 N/A THR 486.A OG1 GLU 20.A OE2 no hydrogen 3.392 N/A LYS 489.A NZ THR 728.A OG1 no hydrogen 2.773 N/A LYS 490.A NZ GLY 700.A O no hydrogen 3.221 N/A SER 491.A OG LYS 490.A O no hydrogen 2.448 N/A MET 495.A N MET 679.A O no hydrogen 3.359 N/A ILE 496.A N ASP 705.A O no hydrogen 3.088 N/A ILE 497.A N LEU 681.A O no hydrogen 2.319 N/A THR 498.A OG1 ASP 683.A O no hydrogen 3.232 N/A THR 498.A OG1 ARG 684.A O no hydrogen 3.449 N/A LYS 499.A N LEU 708.A O no hydrogen 3.247 N/A LYS 499.A NZ ASN 707.A OD1 no hydrogen 3.175 N/A GLY 500.A N VAL 504.A O no hydrogen 2.896 N/A GLN 503.A N GLY 500.A O no hydrogen 2.715 N/A GLN 503.A NE2 SER 501.A O no hydrogen 2.958 N/A VAL 504.A N ASP 502.A OD1 no hydrogen 3.317 N/A SER 507.A OG ASP 683.A OD1 no hydrogen 3.158 N/A ARG 509.A N SER 507.A OG no hydrogen 2.470 N/A SER 517.A OG ASP 515.A O no hydrogen 3.430 N/A VAL 519.A N ASP 515.A O no hydrogen 3.078 N/A ARG 520.A N PRO 516.A O no hydrogen 2.844 N/A ASN 521.A N SER 517.A O no hydrogen 2.813 N/A ASN 521.A ND2 VAL 504.A O no hydrogen 3.620 N/A TYR 522.A N ILE 518.A O no hydrogen 2.537 N/A GLY 523.A N VAL 519.A O no hydrogen 2.476 N/A SER 524.A N ARG 520.A O no hydrogen 2.651 N/A SER 524.A OG ARG 520.A O no hydrogen 3.065 N/A SER 524.A OG ASN 521.A O no hydrogen 2.388 N/A MET 525.A N ASN 521.A O no hydrogen 3.021 N/A LEU 526.A N TYR 522.A O no hydrogen 3.002 N/A VAL 527.A N GLY 523.A O no hydrogen 3.132 N/A GLU 528.A N SER 524.A O no hydrogen 3.144 N/A PHE 529.A N MET 525.A O no hydrogen 2.991 N/A ALA 530.A N LEU 526.A O no hydrogen 2.788 N/A LYS 531.A N VAL 527.A O no hydrogen 3.165 N/A LYS 531.A N GLU 528.A O no hydrogen 3.099 N/A ILE 532.A N PHE 529.A O no hydrogen 3.181 N/A THR 533.A N PHE 529.A O no hydrogen 3.096 N/A THR 533.A OG1 PRO 534.A O no hydrogen 3.461 N/A THR 533.A OG1 THR 619.A OG1 no hydrogen 3.020 N/A MET 537.A N ALA 596.A O no hydrogen 3.313 N/A VAL 539.A N LEU 598.A O no hydrogen 3.220 N/A PHE 541.A N SER 600.A O no hydrogen 2.957 N/A TYR 544.A OH GLU 572.A O no hydrogen 2.880 N/A MET 547.A N SER 543.A O no hydrogen 2.897 N/A GLU 548.A N TYR 544.A O no hydrogen 2.580 N/A SER 549.A N LEU 545.A O no hydrogen 3.363 N/A SER 549.A OG ILE 512.A O no hydrogen 2.878 N/A SER 549.A OG LEU 545.A O no hydrogen 3.227 N/A SER 549.A OG TYR 546.A O no hydrogen 3.115 N/A ILE 550.A N TYR 546.A O no hydrogen 3.081 N/A VAL 551.A N MET 547.A O no hydrogen 2.885 N/A SER 552.A N GLU 548.A O no hydrogen 3.119 N/A SER 552.A OG GLU 548.A O no hydrogen 2.948 N/A SER 552.A OG SER 549.A O no hydrogen 2.681 N/A MET 553.A N SER 549.A O no hydrogen 3.463 N/A TRP 554.A N VAL 551.A O no hydrogen 2.847 N/A GLN 555.A N VAL 551.A O no hydrogen 3.011 N/A THR 556.A N SER 552.A O no hydrogen 3.279 N/A MET 557.A N MET 553.A O no hydrogen 3.276 N/A TRP 564.A N LEU 560.A O no hydrogen 3.095 N/A LYS 565.A N ASP 561.A O no hydrogen 2.998 N/A LYS 565.A N GLU 562.A O no hydrogen 2.870 N/A LYS 565.A NZ GLU 562.A OE1 no hydrogen 3.454 N/A HIS 566.A N GLU 562.A O no hydrogen 3.283 N/A HIS 566.A NE2 GLU 562.A OE2 no hydrogen 2.595 N/A LYS 567.A N VAL 563.A O no hydrogen 2.871 N/A LYS 567.A NZ THR 533.A O no hydrogen 3.305 N/A LYS 567.A NZ PRO 534.A O no hydrogen 2.624 N/A LEU 568.A N GLY 595.A O no hydrogen 2.491 N/A LEU 570.A N ILE 597.A O no hydrogen 3.057 N/A THR 573.A OG1 ASP 575.A O no hydrogen 2.593 N/A THR 573.A OG1 ASP 575.A OD1 no hydrogen 2.929 N/A THR 573.A OG1 THR 579.A OG1 no hydrogen 3.099 N/A THR 579.A N ASP 575.A O no hydrogen 3.082 N/A THR 579.A OG1 GLU 572.A OE1 no hydrogen 3.254 N/A THR 579.A OG1 THR 573.A O no hydrogen 2.357 N/A THR 579.A OG1 THR 573.A OG1 no hydrogen 3.099 N/A THR 579.A OG1 ASP 575.A O no hydrogen 3.364 N/A SER 580.A N ALA 576.A O no hydrogen 2.240 N/A LEU 581.A N GLN 577.A O no hydrogen 2.705 N/A ALA 582.A N GLU 578.A O no hydrogen 2.622 N/A LEU 583.A N THR 579.A O no hydrogen 2.581 N/A GLU 584.A N SER 580.A O no hydrogen 2.951 N/A THR 585.A OG1 LEU 581.A O no hydrogen 2.711 N/A THR 585.A OG1 ALA 582.A O no hydrogen 2.612 N/A TYR 586.A N ALA 582.A O no hydrogen 2.725 N/A TYR 586.A OH TYR 616.A O no hydrogen 2.143 N/A ARG 587.A N LEU 583.A O no hydrogen 2.785 N/A ARG 587.A NH2 ASP 611.A O no hydrogen 2.343 N/A LYS 588.A N GLU 584.A O no hydrogen 2.530 N/A LYS 588.A NZ GLU 584.A OE1 no hydrogen 3.131 N/A ALA 589.A N THR 585.A O no hydrogen 2.919 N/A CYS 590.A N TYR 586.A O no hydrogen 2.611 N/A CYS 590.A SG TYR 586.A O no hydrogen 3.017 N/A CYS 590.A SG GLN 615.A O no hydrogen 3.491 N/A SER 591.A N ARG 587.A O no hydrogen 2.742 N/A SER 591.A OG ARG 587.A O no hydrogen 2.937 N/A SER 591.A OG LYS 588.A O no hydrogen 2.900 N/A GLY 593.A N ASN 592.A OD1 no hydrogen 2.390 N/A ARG 594.A NH2 LYS 567.A O no hydrogen 2.941 N/A ILE 597.A N LEU 568.A O no hydrogen 2.894 N/A LEU 598.A N MET 537.A O no hydrogen 3.009 N/A SER 600.A N VAL 539.A O no hydrogen 3.242 N/A SER 600.A OG VAL 539.A O no hydrogen 3.281 N/A ALA 602.A N PHE 541.A O no hydrogen 2.519 N/A ARG 603.A NH1 ASP 657.A OD2 no hydrogen 2.581 N/A ARG 603.A NH2 ASP 657.A O no hydrogen 3.123 N/A GLY 604.A N VAL 601.A O no hydrogen 2.862 N/A LYS 605.A NZ THR 573.A O no hydrogen 3.377 N/A LYS 605.A NZ PRO 574.A O no hydrogen 3.406 N/A SER 607.A OG ALA 602.A O no hydrogen 3.289 N/A SER 607.A OG GLY 604.A O no hydrogen 3.221 N/A GLU 608.A N LYS 605.A O no hydrogen 3.122 N/A ILE 610.A N VAL 606.A O no hydrogen 3.300 N/A PHE 612.A N ASP 611.A OD1 no hydrogen 2.708 N/A PHE 612.A N ARG 668.A O no hydrogen 3.241 N/A GLN 615.A N GLN 615.A OE1 no hydrogen 2.513 N/A GLY 617.A N ASP 613.A O no hydrogen 2.842 N/A ARG 618.A N GLY 536.A O no hydrogen 2.749 N/A THR 619.A OG1 THR 533.A OG1 no hydrogen 3.020 N/A LEU 621.A N VAL 538.A O no hydrogen 2.890 N/A GLY 624.A N ALA 682.A O no hydrogen 2.878 N/A GLU 631.A N GLN 628.A O no hydrogen 2.885 N/A SER 632.A OG GLU 421.A OE1 no hydrogen 2.994 N/A ARG 633.A N SER 632.A OG no hydrogen 2.505 N/A LYS 636.A NZ GLU 650.A OE2 no hydrogen 3.283 N/A ALA 637.A N ARG 633.A O no hydrogen 2.895 N/A ARG 638.A N ILE 634.A O no hydrogen 3.087 N/A ARG 638.A NH2 ASP 241.A OD2 no hydrogen 2.791 N/A LEU 639.A N LEU 635.A O no hydrogen 2.540 N/A GLU 640.A N LYS 636.A O no hydrogen 2.442 N/A PHE 641.A N ALA 637.A O no hydrogen 2.832 N/A MET 642.A N ARG 638.A O no hydrogen 2.343 N/A ARG 643.A N LEU 639.A O no hydrogen 2.375 N/A GLU 644.A N GLU 640.A O no hydrogen 2.490 N/A ASN 645.A N PHE 641.A O no hydrogen 2.603 N/A TYR 646.A OH ASP 441.A OD1 no hydrogen 2.748 N/A TYR 646.A OH MET 472.A O no hydrogen 3.213 N/A ARG 649.A NE ASP 652.A OD2 no hydrogen 3.530 N/A ARG 649.A NH2 ASP 652.A OD2 no hydrogen 3.281 N/A PHE 653.A N ARG 649.A O no hydrogen 3.237 N/A LEU 654.A N GLU 650.A O no hydrogen 2.870 N/A SER 655.A N ASN 651.A O no hydrogen 2.693 N/A SER 655.A OG ASN 651.A O no hydrogen 2.822 N/A SER 655.A OG ASP 652.A O no hydrogen 3.293 N/A PHE 656.A N ASP 652.A O no hydrogen 3.035 N/A ASP 657.A N PHE 653.A O no hydrogen 3.026 N/A ALA 658.A N LEU 654.A O no hydrogen 2.712 N/A MET 659.A N SER 655.A O no hydrogen 2.696 N/A ARG 660.A N PHE 656.A O no hydrogen 2.528 N/A ARG 660.A NH1 ASP 241.A OD1 no hydrogen 2.671 N/A ARG 660.A NH1 ASP 241.A OD2 no hydrogen 2.938 N/A ARG 660.A NH2 ASP 241.A OD2 no hydrogen 3.566 N/A ARG 660.A NH2 ASP 657.A OD1 no hydrogen 2.262 N/A HIS 661.A N ASP 657.A O no hydrogen 3.003 N/A ALA 662.A N ALA 658.A O no hydrogen 2.899 N/A ALA 663.A N MET 659.A O no hydrogen 2.891 N/A GLN 664.A N ARG 660.A O no hydrogen 3.046 N/A GLN 664.A NE2 SER 607.A O no hydrogen 3.297 N/A CYS 665.A N HIS 661.A O no hydrogen 3.067 N/A CYS 665.A SG ALA 602.A O no hydrogen 3.962 N/A CYS 665.A SG HIS 661.A O no hydrogen 3.077 N/A LEU 666.A N ALA 662.A O no hydrogen 3.376 N/A ARG 668.A NH1 ILE 610.A O no hydrogen 2.599 N/A ARG 668.A NH2 GLU 608.A O no hydrogen 2.749 N/A LEU 670.A N GLY 667.A O no hydrogen 3.447 N/A ARG 671.A N ASP 675.A OD2 no hydrogen 2.856 N/A ARG 671.A NH1 ASP 613.A OD1 no hydrogen 2.965 N/A LYS 673.A NZ GLU 20.A OE1 no hydrogen 3.194 N/A LYS 673.A NZ THR 486.A O no hydrogen 3.224 N/A LYS 673.A NZ SER 737.A O no hydrogen 2.912 N/A LYS 673.A NZ SER 737.A OG no hydrogen 3.003 N/A ASP 675.A N GLY 672.A O no hydrogen 3.189 N/A TYR 676.A N ASP 675.A OD1 no hydrogen 2.567 N/A MET 679.A N LEU 493.A O no hydrogen 2.683 N/A VAL 680.A N VAL 620.A O no hydrogen 3.078 N/A LEU 681.A N MET 495.A O no hydrogen 2.382 N/A ALA 682.A N MET 622.A O no hydrogen 3.030 N/A ARG 684.A N ILE 506.A O no hydrogen 3.066 N/A ARG 685.A NH1 SER 507.A OG no hydrogen 2.863 N/A ARG 685.A NH2 SER 507.A OG no hydrogen 2.561 N/A PHE 686.A N ASP 683.A O no hydrogen 3.238 N/A SER 687.A N ARG 684.A O no hydrogen 3.061 N/A ARG 688.A N ARG 685.A O no hydrogen 3.154 N/A LYS 689.A N ARG 685.A O no hydrogen 3.279 N/A ARG 690.A NE LEU 701.A O no hydrogen 2.460 N/A ARG 690.A NH2 LEU 701.A O no hydrogen 2.754 N/A LYS 695.A NZ GLN 699.A OE1 no hydrogen 2.962 N/A TRP 696.A NE1 GLY 461.A O no hydrogen 2.559 N/A ALA 698.A N PRO 694.A O no hydrogen 2.606 N/A GLN 699.A N LYS 695.A O no hydrogen 2.526 N/A GLY 700.A N ILE 697.A O no hydrogen 3.073 N/A LEU 701.A N ILE 697.A O no hydrogen 3.173 N/A LEU 701.A N ALA 698.A O no hydrogen 3.110 N/A ASP 705.A N SER 702.A O no hydrogen 3.070 N/A LEU 706.A N ASP 703.A O no hydrogen 3.095 N/A SER 709.A OG GLY 500.A O no hydrogen 2.196 N/A SER 709.A OG ASP 711.A OD1 no hydrogen 3.112 N/A THR 710.A OG1 GLU 528.A OE2 no hydrogen 2.443 N/A MET 712.A N ASP 711.A OD1 no hydrogen 2.589 N/A ILE 714.A N ASP 711.A O no hydrogen 3.284 N/A SER 715.A OG MET 712.A O no hydrogen 2.805 N/A SER 715.A OG ASN 716.A OD1 no hydrogen 3.427 N/A ASN 716.A N MET 712.A O no hydrogen 3.135 N/A THR 717.A N ALA 713.A O no hydrogen 3.100 N/A LYS 718.A N ILE 714.A O no hydrogen 2.867 N/A GLN 719.A N SER 715.A O no hydrogen 3.202 N/A PHE 720.A N ASN 716.A O no hydrogen 2.994 N/A LEU 721.A N THR 717.A O no hydrogen 2.895 N/A ARG 722.A N LYS 718.A O no hydrogen 3.211 N/A THR 723.A N GLN 719.A O no hydrogen 2.857 N/A THR 723.A OG1 GLN 719.A O no hydrogen 2.797 N/A THR 723.A OG1 PHE 720.A O no hydrogen 2.946 N/A MET 724.A N PHE 720.A O no hydrogen 2.746 N/A ALA 725.A N LEU 721.A O no hydrogen 2.813 N/A GLN 726.A N THR 723.A O no hydrogen 3.052 N/A THR 728.A N GLN 726.A O no hydrogen 3.077 N/A THR 728.A OG1 THR 728.A O no hydrogen 2.490 N/A LYS 731.A NZ ASP 729.A O no hydrogen 2.567 N/A LYS 731.A NZ PRO 730.A O no hydrogen 2.817 N/A GLN 733.A N ASP 732.A OD1 no hydrogen 2.687 N/A VAL 736.A N GLN 733.A O no hydrogen 3.036 N/A SER 737.A N GLN 733.A O no hydrogen 3.203 N/A SER 737.A OG THR 486.A O no hydrogen 2.938 N/A VAL 738.A N GLU 734.A O no hydrogen 2.445 N/A TRP 739.A N GLU 734.A O no hydrogen 3.324 N/A ASP 743.A N SER 740.A O no hydrogen 3.219 N/A LEU 744.A N SER 740.A O no hydrogen 3.040 N/A LYS 746.A NZ GLU 742.A OE2 no hydrogen 2.855 N/A HIS 747.A N ASP 743.A O no hydrogen 2.105 N/A GLN 748.A N LEU 744.A O no hydrogen 3.296 N/A ASN 749.A N ILE 745.A O no hydrogen 2.870 N/A ARG 751.A N HIS 747.A O no hydrogen 3.131 N/A ARG 751.A NH1 LYS 746.A O no hydrogen 3.250 N/A LYS 752.A N GLN 748.A O no hydrogen 2.869 N/A