Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mwy_W.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 37.A OD2 no hydrogen 2.402 N/A ASP 6.A N LYS 34.A O no hydrogen 3.076 N/A ILE 7.A N LYS 34.A O no hydrogen 3.344 N/A ILE 9.A N LEU 32.A O no hydrogen 2.944 N/A ASN 10.A ND2 HIS 11.A ND1 no hydrogen 3.044 N/A ARG 12.A N GLU 30.A O no hydrogen 3.036 N/A LYS 14.A NZ GLU 27.A O no hydrogen 3.207 N/A SER 16.A N LYS 14.A O no hydrogen 2.865 N/A SER 16.A OG THR 15.A O no hydrogen 3.178 N/A ASN 23.A N ASP 21.A OD2 no hydrogen 2.654 N/A CYS 25.A N ASP 21.A O no hydrogen 3.460 N/A CYS 25.A SG ASP 21.A O no hydrogen 3.956 N/A LYS 26.A N LEU 22.A O no hydrogen 2.844 N/A GLU 27.A N ASN 23.A O no hydrogen 2.975 N/A GLU 27.A N ASN 24.A O no hydrogen 2.760 N/A ASN 28.A N ASN 24.A O no hydrogen 2.873 N/A ASN 28.A N CYS 25.A O no hydrogen 3.214 N/A GLU 30.A N ARG 12.A O no hydrogen 3.206 N/A PHE 31.A N GLU 46.A O no hydrogen 2.812 N/A LEU 32.A N ASN 10.A O no hydrogen 2.870 N/A ILE 33.A N THR 44.A O no hydrogen 3.323 N/A LYS 34.A N ILE 7.A O no hydrogen 3.169 N/A LYS 34.A NZ TRP 35.A O no hydrogen 2.752 N/A THR 36.A OG1 PHE 2.A O no hydrogen 2.802 N/A SER 39.A OG GLU 140.A OE2 no hydrogen 3.487 N/A HIS 42.A N SER 39.A O no hydrogen 2.926 N/A THR 44.A N ILE 33.A O no hydrogen 3.373 N/A THR 44.A OG1 GLU 46.A OE2 no hydrogen 3.289 N/A GLU 46.A N PHE 31.A O no hydrogen 3.134 N/A THR 47.A N SER 50.A OG no hydrogen 2.450 N/A TYR 48.A OH ASP 61.A OD1 no hydrogen 2.861 N/A SER 50.A N THR 47.A O no hydrogen 2.849 N/A SER 50.A OG GLU 46.A OE1 no hydrogen 3.245 N/A SER 50.A OG THR 47.A O no hydrogen 2.812 N/A ILE 51.A N TYR 48.A O no hydrogen 3.342 N/A GLY 52.A N TYR 48.A O no hydrogen 2.982 N/A ARG 59.A N GLY 56.A O no hydrogen 3.212 N/A ARG 59.A NH1 ILE 5.A O no hydrogen 2.851 N/A ARG 59.A NH1 GLY 56.A O no hydrogen 3.388 N/A ARG 59.A NH2 ILE 5.A O no hydrogen 3.373 N/A ARG 59.A NH2 ASP 6.A O no hydrogen 2.736 N/A LEU 60.A N LEU 57.A O no hydrogen 2.987 N/A ASN 62.A N LYS 58.A O no hydrogen 2.991 N/A TYR 63.A N LEU 60.A O no hydrogen 2.500 N/A TYR 63.A OH HIS 11.A ND1 no hydrogen 2.437 N/A CYS 64.A SG TYR 48.A OH no hydrogen 3.341 N/A CYS 64.A SG LEU 60.A O no hydrogen 3.678 N/A CYS 64.A SG ASP 61.A O no hydrogen 3.139 N/A LYS 65.A N ASP 61.A O no hydrogen 3.085 N/A GLN 66.A N TYR 63.A O no hydrogen 3.097 N/A PHE 67.A N TYR 63.A O no hydrogen 2.750 N/A ILE 68.A N CYS 64.A O no hydrogen 3.181 N/A ILE 69.A N CYS 64.A O no hydrogen 2.838 N/A GLN 72.A N ILE 68.A O no hydrogen 2.989 N/A GLN 73.A N ILE 69.A O no hydrogen 2.830 N/A VAL 74.A N GLU 70.A O no hydrogen 3.104 N/A ARG 75.A N ASP 71.A O no hydrogen 3.287 N/A ARG 75.A NH1 ASP 71.A OD1 no hydrogen 2.821 N/A LEU 76.A N GLN 73.A O no hydrogen 2.795 N/A TYR 79.A N ASP 77.A OD1 no hydrogen 2.669 N/A VAL 80.A N ASP 77.A O no hydrogen 3.185 N/A ILE 85.A N THR 81.A O no hydrogen 3.159 N/A ILE 85.A N ALA 82.A O no hydrogen 2.732 N/A GLU 86.A N ALA 82.A O no hydrogen 3.295 N/A MET 88.A N ASP 84.A O no hydrogen 3.306 N/A ASP 89.A N ILE 85.A O no hydrogen 2.837 N/A ASP 89.A N GLU 86.A O no hydrogen 3.171 N/A MET 90.A N GLU 86.A O no hydrogen 2.791 N/A ARG 92.A N MET 88.A O no hydrogen 3.404 N/A ARG 92.A NH1 ASP 71.A OD2 no hydrogen 2.541 N/A ARG 92.A NH2 PHE 67.A O no hydrogen 2.636 N/A GLU 93.A N ASP 89.A O no hydrogen 3.266 N/A ARG 94.A N MET 90.A O no hydrogen 3.090 N/A ARG 94.A NE GLU 91.A OE2 no hydrogen 3.021 N/A ARG 95.A N GLU 91.A O no hydrogen 3.148 N/A ARG 95.A NH1 ILE 9.A O no hydrogen 3.192 N/A ARG 95.A NH2 VAL 8.A O no hydrogen 3.549 N/A LEU 96.A N ARG 92.A O no hydrogen 3.070 N/A ASP 97.A N GLU 93.A O no hydrogen 2.734 N/A GLU 98.A N ARG 94.A O no hydrogen 3.146 N/A GLU 98.A N ARG 95.A O no hydrogen 2.949 N/A PHE 99.A N ARG 95.A O no hydrogen 3.272 N/A GLU 100.A N LEU 96.A O no hydrogen 3.277 N/A GLU 101.A N GLU 98.A O no hydrogen 3.049 N/A PHE 102.A N PHE 99.A O no hydrogen 3.060 N/A VAL 104.A N GLU 101.A O no hydrogen 3.232 N/A GLU 106.A N LYS 128.A O no hydrogen 2.965 N/A ARG 107.A NE CYS 271.A O no hydrogen 3.280 N/A ARG 107.A NH2 CYS 271.A O no hydrogen 3.244 N/A ILE 109.A N LEU 126.A O no hydrogen 2.983 N/A SER 111.A OG SER 111.A O no hydrogen 2.579 N/A GLN 112.A N GLN 124.A O no hydrogen 3.279 N/A GLN 112.A NE2 ASP 110.A OD2 no hydrogen 2.692 N/A ALA 114.A N GLN 122.A O no hydrogen 3.178 N/A LEU 116.A N THR 120.A O no hydrogen 2.709 N/A GLU 117.A N GLU 117.A OE1 no hydrogen 2.632 N/A ASP 118.A N LEU 116.A O no hydrogen 2.751 N/A TYR 125.A N GLU 140.A O no hydrogen 2.831 N/A VAL 127.A N THR 138.A O no hydrogen 2.804 N/A LYS 128.A NZ GLU 106.A OE2 no hydrogen 2.701 N/A LYS 128.A NZ TRP 129.A O no hydrogen 2.751 N/A LYS 128.A NZ LEU 132.A O no hydrogen 2.897 N/A TRP 129.A NE1 THR 138.A OG1 no hydrogen 2.525 N/A ARG 130.A N VAL 104.A O no hydrogen 3.135 N/A ARG 130.A NH2 GLU 101.A OE2 no hydrogen 2.992 N/A LEU 132.A N TRP 129.A O no hydrogen 2.917 N/A THR 138.A N VAL 127.A O no hydrogen 3.284 N/A THR 138.A OG1 GLU 140.A OE2 no hydrogen 2.705 N/A ASN 141.A ND2 GLN 122.A OE1 no hydrogen 2.899 N/A ALA 142.A N LEU 123.A O no hydrogen 2.960 N/A ASP 144.A N ASN 141.A O no hydrogen 3.149 N/A ILE 145.A N ASN 141.A O no hydrogen 3.494 N/A VAL 146.A N ALA 142.A O no hydrogen 3.316 N/A LEU 148.A N ILE 145.A O no hydrogen 2.722 N/A ALA 149.A N ILE 145.A O no hydrogen 2.640 N/A VAL 153.A N ALA 149.A O no hydrogen 3.282 N/A LYS 154.A N PRO 150.A O no hydrogen 2.551 N/A HIS 155.A N GLU 151.A O no hydrogen 2.359 N/A PHE 156.A N GLN 152.A O no hydrogen 3.203 N/A GLN 157.A N VAL 153.A O no hydrogen 3.393 N/A GLN 157.A N GLN 157.A OE1 no hydrogen 2.917 N/A ARG 159.A N HIS 155.A O no hydrogen 2.751 N/A ARG 159.A N PHE 156.A O no hydrogen 3.102 N/A ARG 159.A NH2 ASN 270.A OD1 no hydrogen 3.518 N/A GLU 160.A N GLN 157.A O no hydrogen 3.323 N/A ASN 161.A N ASN 158.A O no hydrogen 2.768 N/A ASN 161.A ND2 GLN 157.A O no hydrogen 3.597 N/A SER 162.A N ASN 158.A O no hydrogen 2.569 N/A LEU 165.A N LYS 163.A O no hydrogen 2.875 N/A SER 169.A N PRO 166.A O no hydrogen 3.231 N/A SER 169.A OG PRO 166.A O no hydrogen 2.891 N/A SER 170.A N ARG 241.A O no hydrogen 3.161 N/A SER 170.A OG TYR 172.A OH no hydrogen 3.060 N/A SER 170.A OG ARG 240.A O no hydrogen 3.530 N/A TYR 172.A OH SER 170.A OG no hydrogen 3.060 N/A TYR 172.A OH ARG 240.A O no hydrogen 3.369 N/A THR 173.A OG1 ASN 171.A O no hydrogen 3.473 N/A ARG 176.A N GLN 175.A OE1 no hydrogen 2.434 N/A LEU 182.A N ASN 203.A OD1 no hydrogen 2.952 N/A ILE 189.A N PRO 186.A O no hydrogen 3.132 N/A LYS 190.A N TRP 265.A O no hydrogen 3.071 N/A GLN 198.A N ARG 195.A O no hydrogen 2.276 N/A THR 200.A N ASP 196.A O no hydrogen 2.884 N/A THR 200.A OG1 ASP 196.A O no hydrogen 2.515 N/A GLY 201.A N PHE 197.A O no hydrogen 3.316 N/A ILE 202.A N GLN 198.A O no hydrogen 3.175 N/A ASN 203.A N LEU 199.A O no hydrogen 2.813 N/A ASN 203.A ND2 LEU 182.A O no hydrogen 3.435 N/A TRP 204.A N THR 200.A O no hydrogen 3.103 N/A TRP 204.A N GLY 201.A O no hydrogen 2.854 N/A MET 205.A N GLY 201.A O no hydrogen 3.159 N/A ALA 206.A N ILE 202.A O no hydrogen 2.728 N/A PHE 207.A N ASN 203.A O no hydrogen 2.775 N/A LEU 208.A N TRP 204.A O no hydrogen 2.914 N/A TRP 209.A N MET 205.A O no hydrogen 3.015 N/A SER 210.A N ALA 206.A O no hydrogen 3.263 N/A SER 210.A OG ALA 206.A O no hydrogen 3.492 N/A SER 210.A OG PHE 207.A O no hydrogen 3.237 N/A LYS 211.A N LEU 208.A O no hydrogen 2.684 N/A GLY 212.A N TRP 209.A O no hydrogen 2.477 N/A ASP 213.A N LEU 208.A O no hydrogen 3.358 N/A ILE 216.A N PHE 397.A O no hydrogen 2.765 N/A LEU 217.A N LEU 352.A O no hydrogen 2.700 N/A ALA 218.A N LEU 399.A O no hydrogen 2.865 N/A GLU 220.A N ARG 401.A O no hydrogen 3.399 N/A LYS 225.A NZ ASP 219.A O no hydrogen 2.841 N/A GLN 228.A N GLY 224.A O no hydrogen 2.967 N/A GLN 228.A NE2 PHE 197.A O no hydrogen 3.256 N/A THR 229.A N THR 226.A O no hydrogen 2.469 N/A THR 229.A OG1 LYS 225.A O no hydrogen 2.855 N/A THR 229.A OG1 THR 226.A O no hydrogen 3.522 N/A VAL 230.A N THR 226.A O no hydrogen 2.882 N/A ALA 231.A N VAL 227.A O no hydrogen 2.779 N/A ILE 233.A N THR 229.A O no hydrogen 2.878 N/A ILE 233.A N VAL 230.A O no hydrogen 2.747 N/A SER 234.A N VAL 230.A O no hydrogen 3.165 N/A TRP 235.A N ALA 231.A O no hydrogen 3.100 N/A LEU 236.A N PHE 232.A O no hydrogen 3.317 N/A ILE 237.A N ILE 233.A O no hydrogen 3.030 N/A PHE 238.A N SER 234.A O no hydrogen 2.600 N/A ARG 240.A N TRP 235.A O no hydrogen 3.361 N/A ARG 240.A N LEU 236.A O no hydrogen 3.261 N/A ARG 240.A NH1 ALA 239.A O no hydrogen 3.073 N/A ASN 243.A N SER 169.A OG no hydrogen 2.847 N/A ASN 243.A ND2 LEU 165.A O no hydrogen 2.756 N/A GLY 244.A N GLN 321.A OE1 no hydrogen 2.352 N/A HIS 246.A N ASN 299.A O no hydrogen 2.850 N/A ILE 247.A N PHE 322.A O no hydrogen 3.211 N/A ILE 248.A N LEU 301.A O no hydrogen 2.940 N/A VAL 249.A N ALA 324.A O no hydrogen 3.407 N/A VAL 250.A N THR 303.A O no hydrogen 2.788 N/A THR 254.A N PRO 251.A O no hydrogen 2.538 N/A THR 254.A OG1 PRO 251.A O no hydrogen 2.918 N/A TRP 258.A N THR 254.A O no hydrogen 3.001 N/A LEU 259.A N MET 255.A O no hydrogen 3.035 N/A THR 261.A N ALA 257.A O no hydrogen 3.312 N/A THR 261.A OG1 ALA 257.A O no hydrogen 3.060 N/A THR 261.A OG1 TRP 258.A O no hydrogen 2.815 N/A PHE 262.A N TRP 258.A O no hydrogen 2.894 N/A PHE 262.A N LEU 259.A O no hydrogen 3.168 N/A GLU 263.A N LEU 259.A O no hydrogen 3.376 N/A TRP 265.A N THR 261.A O no hydrogen 3.110 N/A ALA 266.A N PHE 262.A O no hydrogen 2.696 N/A LEU 269.A N ALA 266.A O no hydrogen 2.980 N/A ASN 270.A N ASN 299.A OD1 no hydrogen 2.671 N/A CYS 271.A SG LEU 269.A O no hydrogen 3.901 N/A ILE 272.A N VAL 300.A O no hydrogen 2.523 N/A SER 280.A OG GLY 276.A O no hydrogen 2.723 N/A ARG 281.A NH1 LYS 310.A O no hydrogen 3.306 N/A ARG 281.A NH1 ASP 311.A OD1 no hydrogen 3.206 N/A THR 283.A N LYS 279.A O no hydrogen 3.007 N/A THR 283.A OG1 LYS 279.A O no hydrogen 1.970 N/A ILE 284.A N SER 280.A O no hydrogen 2.660 N/A ARG 285.A N ARG 281.A O no hydrogen 3.313 N/A ARG 285.A NE GLU 314.A OE2 no hydrogen 3.032 N/A ARG 285.A NH2 GLU 314.A OE2 no hydrogen 2.638 N/A GLU 286.A N THR 283.A O no hydrogen 2.940 N/A TYR 287.A N ILE 284.A O no hydrogen 2.449 N/A GLU 288.A N ILE 284.A O no hydrogen 2.800 N/A LYS 297.A N GLU 288.A O no hydrogen 2.833 N/A ASN 299.A N ASN 270.A O no hydrogen 2.616 N/A ASN 299.A ND2 ILE 164.A O no hydrogen 2.956 N/A VAL 300.A N ASN 270.A O no hydrogen 3.133 N/A LEU 301.A N HIS 246.A O no hydrogen 2.694 N/A LEU 302.A N ILE 272.A O no hydrogen 2.831 N/A THR 303.A N ILE 248.A O no hydrogen 3.333 N/A THR 304.A OG1 VAL 250.A O no hydrogen 2.962 N/A TYR 307.A N THR 304.A O no hydrogen 2.869 N/A ILE 308.A N TYR 305.A O no hydrogen 2.755 N/A LEU 309.A N GLU 306.A O no hydrogen 3.255 N/A LYS 310.A N GLU 306.A O no hydrogen 3.380 N/A ARG 312.A N LEU 309.A O no hydrogen 3.146 N/A LEU 315.A N ASP 311.A O no hydrogen 3.044 N/A GLY 316.A N ARG 312.A O no hydrogen 2.591 N/A SER 317.A OG ALA 313.A O no hydrogen 3.534 N/A SER 317.A OG GLU 314.A O no hydrogen 3.235 N/A ILE 318.A N LEU 315.A O no hydrogen 3.096 N/A TRP 320.A N LYS 346.A O no hydrogen 3.099 N/A GLN 321.A N PRO 245.A O no hydrogen 3.046 N/A PHE 322.A N HIS 246.A ND1 no hydrogen 3.350 N/A MET 323.A N ASN 349.A O no hydrogen 2.885 N/A ALA 324.A N ILE 247.A O no hydrogen 3.405 N/A ASP 326.A N VAL 249.A O no hydrogen 3.111 N/A GLU 327.A N ASP 326.A OD2 no hydrogen 2.595 N/A ALA 328.A N ILE 353.A O no hydrogen 2.767 N/A LYS 332.A N HIS 329.A O no hydrogen 3.262 N/A GLU 335.A N ASN 333.A OD1 no hydrogen 3.103 N/A TYR 339.A OH ALA 367.A O no hydrogen 3.182 N/A SER 341.A N SER 337.A O no hydrogen 2.828 N/A SER 341.A OG ILE 308.A O no hydrogen 3.213 N/A LEU 342.A N LEU 338.A O no hydrogen 2.465 N/A ASN 343.A N TYR 339.A O no hydrogen 2.887 N/A PHE 345.A N LEU 342.A O no hydrogen 3.219 N/A ASN 349.A N GLN 321.A O no hydrogen 2.975 N/A ARG 350.A N ASN 214.A OD1 no hydrogen 3.103 N/A ARG 350.A NH2 ASN 343.A OD1 no hydrogen 2.755 N/A MET 351.A N MET 323.A O no hydrogen 3.003 N/A LEU 352.A N GLY 215.A O no hydrogen 3.278 N/A ILE 353.A N VAL 325.A O no hydrogen 2.938 N/A THR 354.A N LEU 217.A O no hydrogen 3.294 N/A THR 356.A OG1 PRO 357.A O no hydrogen 3.540 N/A GLN 359.A NE2 PRO 357.A O no hydrogen 3.653 N/A GLU 364.A N ASN 361.A OD1 no hydrogen 3.257 N/A ALA 366.A N ILE 362.A O no hydrogen 3.108 N/A ALA 367.A N LYS 363.A O no hydrogen 2.789 N/A LEU 368.A N GLU 364.A O no hydrogen 2.911 N/A VAL 369.A N LEU 365.A O no hydrogen 3.335 N/A ASN 370.A N ALA 366.A O no hydrogen 2.608 N/A PHE 371.A N LEU 368.A O no hydrogen 3.213 N/A LEU 372.A N LEU 368.A O no hydrogen 3.150 N/A MET 373.A N VAL 369.A O no hydrogen 2.795 N/A GLY 375.A N MET 373.A O no hydrogen 2.518 N/A GLN 379.A N GLU 382.A OE2 no hydrogen 3.150 N/A GLU 382.A N GLN 379.A O no hydrogen 2.781 N/A GLN 383.A N GLN 379.A O no hydrogen 3.423 N/A GLN 383.A NE2 ASN 378.A O no hydrogen 3.679 N/A GLN 383.A NE2 ASN 378.A OD1 no hydrogen 2.623 N/A GLU 384.A N GLU 381.A O no hydrogen 3.212 N/A GLU 385.A N GLU 381.A O no hydrogen 3.108 N/A TYR 386.A N GLU 382.A O no hydrogen 3.397 N/A HIS 388.A N GLU 384.A O no hydrogen 3.205 N/A ASP 389.A N GLU 385.A O no hydrogen 2.550 N/A LEU 390.A N TYR 386.A O no hydrogen 3.070 N/A HIS 391.A N HIS 388.A O no hydrogen 3.265 N/A ARG 392.A N HIS 388.A O no hydrogen 3.426 N/A ARG 393.A N ASP 389.A O no hydrogen 2.756 N/A ILE 394.A N HIS 391.A O no hydrogen 3.035 N/A GLN 395.A N ARG 392.A O no hydrogen 2.728 N/A GLN 395.A NE2 HIS 685.A ND1 no hydrogen 3.522 N/A PHE 397.A N ILE 394.A O no hydrogen 3.349 N/A ILE 398.A N GLN 395.A O no hydrogen 3.198 N/A LEU 399.A N ILE 216.A O no hydrogen 3.149 N/A ARG 400.A N HIS 685.A O no hydrogen 2.718 N/A ARG 400.A NE LEU 681.A O no hydrogen 3.401 N/A ARG 400.A NH2 LEU 681.A O no hydrogen 3.256 N/A ARG 401.A N ASP 219.A OD1 no hydrogen 2.583 N/A LEU 402.A N ASP 405.A OD2 no hydrogen 2.808 N/A ASP 405.A N LEU 402.A O no hydrogen 2.552 N/A VAL 406.A N LYS 403.A O no hydrogen 3.125 N/A GLU 407.A N LYS 404.A O no hydrogen 3.436 N/A SER 409.A OG ASP 196.A OD1 no hydrogen 3.463 N/A SER 409.A OG ASP 196.A OD2 no hydrogen 3.255 N/A SER 412.A OG LEU 410.A O no hydrogen 3.353 N/A ARG 416.A N VAL 606.A O no hydrogen 2.827 N/A ILE 417.A N GLU 673.A O no hydrogen 3.502 N/A LEU 418.A N ARG 608.A O no hydrogen 3.082 N/A ARG 419.A NH2 GLU 617.A OE1 no hydrogen 3.218 N/A ARG 419.A NH2 GLU 617.A OE2 no hydrogen 3.366 N/A VAL 420.A N VAL 610.A O no hydrogen 2.606 N/A SER 423.A N GLN 426.A OE1 no hydrogen 3.278 N/A SER 423.A OG SER 483.A O no hydrogen 2.447 N/A ASP 424.A N GLN 657.A OE1 no hydrogen 2.904 N/A VAL 425.A N ASP 424.A OD1 no hydrogen 2.748 N/A GLN 426.A N SER 423.A OG no hydrogen 2.845 N/A GLN 426.A NE2 SER 453.A O no hydrogen 3.227 N/A THR 427.A N SER 423.A O no hydrogen 2.862 N/A THR 427.A OG1 LEU 422.A O no hydrogen 3.441 N/A THR 427.A OG1 SER 423.A O no hydrogen 3.053 N/A GLU 428.A N ASP 424.A O no hydrogen 3.280 N/A TYR 429.A N VAL 425.A O no hydrogen 2.952 N/A TYR 430.A N GLN 426.A O no hydrogen 2.806 N/A LYS 431.A N THR 427.A O no hydrogen 2.776 N/A LYS 431.A NZ ALA 647.A O no hydrogen 3.339 N/A ASN 432.A N GLU 428.A O no hydrogen 2.865 N/A ILE 433.A N TYR 429.A O no hydrogen 2.895 N/A LEU 434.A N TYR 430.A O no hydrogen 2.953 N/A THR 435.A N LYS 431.A O no hydrogen 3.294 N/A THR 435.A OG1 LYS 431.A O no hydrogen 2.927 N/A THR 435.A OG1 ASN 432.A O no hydrogen 3.285 N/A LYS 436.A N ASN 432.A O no hydrogen 3.212 N/A ASN 437.A N LEU 434.A O no hydrogen 2.915 N/A ASN 437.A ND2 LEU 434.A O no hydrogen 3.592 N/A LEU 443.A N PHE 440.A O no hydrogen 3.207 N/A ASN 444.A N SER 441.A O no hydrogen 2.913 N/A MET 446.A N LEU 442.A O no hydrogen 2.785 N/A ASN 447.A N LEU 443.A O no hydrogen 2.730 N/A ASN 447.A ND2 LEU 443.A O no hydrogen 3.676 N/A GLU 448.A N ASN 444.A O no hydrogen 2.490 N/A LEU 449.A N ILE 445.A O no hydrogen 3.071 N/A LYS 450.A N MET 446.A O no hydrogen 2.705 N/A LYS 451.A N ASN 447.A O no hydrogen 2.677 N/A LYS 451.A NZ GLU 448.A OE1 no hydrogen 3.037 N/A ALA 452.A N GLU 448.A O no hydrogen 2.778 N/A SER 453.A N LEU 449.A O no hydrogen 2.774 N/A SER 453.A OG LEU 449.A O no hydrogen 2.944 N/A ASN 454.A N LYS 450.A O no hydrogen 3.016 N/A ASN 454.A N LYS 451.A O no hydrogen 2.721 N/A ASN 454.A ND2 GLU 616.A OE2 no hydrogen 2.930 N/A HIS 455.A N LYS 451.A O no hydrogen 2.936 N/A HIS 455.A NE2 LEU 480.A O no hydrogen 2.843 N/A TYR 457.A N HIS 455.A ND1 no hydrogen 2.743 N/A LEU 458.A N HIS 455.A O no hydrogen 3.294 N/A PHE 459.A N PRO 456.A O no hydrogen 2.976 N/A ARG 465.A N ASN 461.A O no hydrogen 3.109 N/A ARG 465.A N ALA 462.A O no hydrogen 2.499 N/A VAL 466.A N ALA 462.A O no hydrogen 2.881 N/A LEU 467.A N GLU 463.A O no hydrogen 3.221 N/A GLN 468.A N VAL 466.A O no hydrogen 2.719 N/A GLN 468.A NE2 GLU 464.A O no hydrogen 3.611 N/A LYS 469.A NZ GLN 468.A O no hydrogen 3.038 N/A ASN 475.A N THR 472.A OG1 no hydrogen 3.008 N/A VAL 476.A N ARG 473.A O no hydrogen 3.180 N/A LEU 477.A N GLU 474.A O no hydrogen 3.106 N/A ARG 478.A N GLU 474.A O no hydrogen 2.961 N/A GLY 479.A N ASN 475.A O no hydrogen 3.071 N/A LEU 480.A N VAL 476.A O no hydrogen 3.359 N/A ILE 481.A N LEU 477.A O no hydrogen 2.716 N/A SER 483.A N GLY 479.A O no hydrogen 2.991 N/A SER 483.A OG GLY 479.A O no hydrogen 2.535 N/A SER 484.A N ILE 481.A O no hydrogen 3.068 N/A SER 484.A OG ASN 454.A O no hydrogen 3.002 N/A GLY 485.A N GLN 426.A OE1 no hydrogen 2.741 N/A LYS 486.A NZ PHE 579.A O no hydrogen 2.544 N/A LYS 486.A NZ GLU 616.A OE2 no hydrogen 3.378 N/A MET 487.A N SER 484.A OG no hydrogen 3.268 N/A VAL 488.A N SER 484.A O no hydrogen 2.748 N/A LEU 489.A N GLY 485.A O no hydrogen 3.356 N/A LEU 490.A N LYS 486.A O no hydrogen 2.862 N/A ASP 491.A N MET 487.A O no hydrogen 2.566 N/A GLN 492.A NE2 LEU 489.A O no hydrogen 3.314 N/A LEU 493.A N LEU 489.A O no hydrogen 3.050 N/A LEU 494.A N LEU 490.A O no hydrogen 2.767 N/A THR 495.A N ASP 491.A O no hydrogen 3.092 N/A THR 495.A OG1 ASP 491.A O no hydrogen 3.180 N/A ARG 496.A N GLN 492.A O no hydrogen 2.684 N/A LEU 497.A N LEU 493.A O no hydrogen 2.884 N/A LYS 498.A N LEU 494.A O no hydrogen 2.658 N/A LYS 499.A N ARG 496.A O no hydrogen 3.057 N/A ASP 500.A N LEU 497.A O no hydrogen 3.293 N/A ARG 503.A NH1 PHE 547.A O no hydrogen 3.181 N/A ARG 503.A NH2 PHE 547.A O no hydrogen 3.016 N/A ARG 503.A NH2 SER 552.A O no hydrogen 3.285 N/A ARG 503.A NH2 SER 552.A OG no hydrogen 2.484 N/A LEU 505.A N THR 575.A O no hydrogen 2.722 N/A ILE 506.A N PHE 557.A O no hydrogen 3.318 N/A PHE 507.A N VAL 577.A O no hydrogen 2.880 N/A SER 508.A N LEU 559.A O no hydrogen 3.169 N/A SER 508.A OG MET 510.A O no hydrogen 3.308 N/A SER 508.A OG ASP 580.A OD1 no hydrogen 3.519 N/A SER 508.A OG ASP 580.A OD2 no hydrogen 2.955 N/A GLN 509.A N ASP 580.A OD1 no hydrogen 3.418 N/A MET 510.A N SER 508.A OG no hydrogen 2.962 N/A VAL 511.A N GLU 83.A OE2 no hydrogen 3.083 N/A LEU 514.A N MET 510.A O no hydrogen 3.171 N/A ASP 515.A N VAL 511.A O no hydrogen 2.940 N/A ILE 516.A N ARG 512.A O no hydrogen 3.172 N/A LEU 517.A N MET 513.A O no hydrogen 3.039 N/A GLY 518.A N LEU 514.A O no hydrogen 2.669 N/A ASP 519.A N ASP 515.A O no hydrogen 2.624 N/A TYR 520.A N ILE 516.A O no hydrogen 2.815 N/A TYR 520.A OH ASP 491.A OD1 no hydrogen 2.628 N/A LEU 521.A N LEU 517.A O no hydrogen 2.761 N/A SER 522.A N GLY 518.A O no hydrogen 3.529 N/A SER 522.A OG GLY 518.A O no hydrogen 3.344 N/A SER 522.A OG ASP 519.A O no hydrogen 2.726 N/A ILE 523.A N ASP 519.A O no hydrogen 3.240 N/A LYS 524.A N TYR 520.A O no hydrogen 3.008 N/A GLY 525.A N LEU 521.A O no hydrogen 2.696 N/A ILE 526.A N LEU 521.A O no hydrogen 3.101 N/A ASN 527.A ND2 ASN 553.A O no hydrogen 2.881 N/A GLN 529.A NE2 HIS 546.A ND1 no hydrogen 3.335 N/A GLN 529.A NE2 ASP 554.A OD1 no hydrogen 2.685 N/A ARG 530.A NH1 ASP 532.A OD1 no hydrogen 3.187 N/A ARG 530.A NH2 VAL 511.A O no hydrogen 3.338 N/A GLY 533.A N GLU 86.A OE1 no hydrogen 2.542 N/A THR 534.A N ASP 532.A OD2 no hydrogen 2.881 N/A THR 534.A OG1 ASP 532.A OD2 no hydrogen 2.516 N/A VAL 535.A N ASP 532.A O no hydrogen 2.922 N/A ARG 540.A N PRO 536.A O no hydrogen 2.934 N/A ARG 541.A N SER 537.A O no hydrogen 3.401 N/A ILE 542.A N GLN 539.A O no hydrogen 2.671 N/A SER 543.A OG GLN 539.A OE1 no hydrogen 2.669 N/A ILE 544.A N ARG 540.A O no hydrogen 2.821 N/A ASP 545.A N ARG 541.A O no hydrogen 2.759 N/A HIS 546.A N ILE 542.A O no hydrogen 3.196 N/A PHE 547.A N ILE 544.A O no hydrogen 2.537 N/A ASN 548.A N ILE 544.A O no hydrogen 3.074 N/A ASN 548.A ND2 ASN 569.A O no hydrogen 2.974 N/A SER 552.A N SER 549.A O no hydrogen 2.715 N/A SER 552.A OG PHE 547.A O no hydrogen 2.282 N/A SER 552.A OG SER 549.A O no hydrogen 2.730 N/A PHE 555.A N ASN 527.A O no hydrogen 3.035 N/A LEU 558.A N GLN 529.A O no hydrogen 2.682 N/A LEU 559.A N ILE 506.A O no hydrogen 2.810 N/A SER 560.A OG GLU 86.A OE2 no hydrogen 2.988 N/A THR 561.A N SER 508.A O no hydrogen 2.767 N/A ALA 563.A N SER 560.A OG no hydrogen 2.515 N/A GLY 564.A N THR 561.A O no hydrogen 3.008 N/A LEU 566.A N GLY 564.A O no hydrogen 2.285 N/A ASN 569.A ND2 ARG 594.A O no hydrogen 3.244 N/A LEU 570.A N ARG 594.A O no hydrogen 2.788 N/A THR 572.A OG1 ASN 548.A OD1 no hydrogen 3.041 N/A ALA 573.A N LEU 570.A O no hydrogen 2.984 N/A ASP 574.A N ARG 503.A O no hydrogen 2.882 N/A THR 575.A OG1 ARG 503.A O no hydrogen 2.960 N/A THR 575.A OG1 ASP 574.A OD1 no hydrogen 2.603 N/A VAL 576.A N MET 605.A O no hydrogen 2.801 N/A VAL 577.A N LEU 505.A O no hydrogen 2.911 N/A ILE 578.A N TYR 607.A O no hydrogen 2.793 N/A PHE 579.A N PHE 507.A O no hydrogen 3.023 N/A ASP 582.A N ASP 588.A OD2 no hydrogen 3.444 N/A GLN 586.A N ASN 584.A OD1 no hydrogen 2.781 N/A ASP 588.A N PRO 585.A O no hydrogen 2.700 N/A LEU 589.A N PRO 585.A O no hydrogen 3.015 N/A GLN 590.A N GLN 586.A O no hydrogen 2.713 N/A MET 592.A N ASP 588.A O no hydrogen 2.713 N/A ALA 593.A N LEU 589.A O no hydrogen 2.731 N/A ARG 594.A N MET 592.A O no hydrogen 2.572 N/A ARG 594.A NE GLN 590.A O no hydrogen 2.609 N/A ALA 595.A N MET 592.A O no hydrogen 3.034 N/A ARG 597.A NE ALA 593.A O no hydrogen 3.383 N/A ILE 598.A N HIS 596.A O no hydrogen 3.165 N/A GLN 600.A NE2 MET 571.A O no hydrogen 2.910 N/A GLN 600.A NE2 ALA 573.A O no hydrogen 3.418 N/A GLN 600.A NE2 ALA 595.A O no hydrogen 2.891 N/A ASN 602.A N GLN 600.A OE1 no hydrogen 2.939 N/A ASN 602.A ND2 GLN 600.A OE1 no hydrogen 3.150 N/A VAL 604.A N SER 412.A O no hydrogen 3.206 N/A MET 605.A N ASP 574.A O no hydrogen 3.057 N/A VAL 606.A N THR 414.A O no hydrogen 2.967 N/A TYR 607.A N VAL 576.A O no hydrogen 2.894 N/A ARG 608.A N ARG 416.A O no hydrogen 2.816 N/A ARG 608.A NE GLU 415.A OE2 no hydrogen 2.917 N/A ARG 608.A NH1 SER 581.A OG no hydrogen 3.327 N/A ARG 608.A NH2 GLU 415.A OE2 no hydrogen 3.489 N/A LEU 609.A N ILE 578.A O no hydrogen 2.736 N/A VAL 610.A N LEU 418.A O no hydrogen 3.082 N/A SER 611.A N GLU 616.A OE1 no hydrogen 3.187 N/A SER 611.A OG SER 453.A O no hydrogen 3.037 N/A SER 611.A OG GLU 616.A OE1 no hydrogen 2.834 N/A LYS 612.A N VAL 420.A O no hydrogen 2.438 N/A ASP 613.A N GLU 617.A OE2 no hydrogen 3.033 N/A THR 614.A N SER 611.A O no hydrogen 3.268 N/A THR 614.A OG1 SER 611.A O no hydrogen 2.642 N/A VAL 615.A N TYR 430.A OH no hydrogen 2.688 N/A GLU 617.A N THR 614.A O no hydrogen 3.415 N/A VAL 619.A N VAL 615.A O no hydrogen 3.247 N/A LEU 620.A N GLU 616.A O no hydrogen 3.235 N/A GLU 621.A N GLU 617.A O no hydrogen 2.753 N/A ARG 622.A N GLU 618.A O no hydrogen 2.928 N/A ALA 623.A N VAL 619.A O no hydrogen 3.141 N/A ARG 624.A N LEU 620.A O no hydrogen 3.089 N/A ARG 624.A NE GLU 621.A OE2 no hydrogen 2.603 N/A ARG 624.A NH1 VAL 676.A O no hydrogen 2.796 N/A ARG 624.A NH2 GLU 621.A OE1 no hydrogen 3.072 N/A ARG 624.A NH2 GLU 621.A OE2 no hydrogen 3.087 N/A LYS 626.A N ARG 622.A O no hydrogen 3.086 N/A LYS 626.A N ALA 623.A O no hydrogen 3.052 N/A LYS 626.A NZ TRP 583.A O no hydrogen 3.316 N/A MET 627.A N ALA 623.A O no hydrogen 2.764 N/A LEU 629.A N LYS 626.A O no hydrogen 2.559 N/A ASN 635.A N GLU 638.A OE1 no hydrogen 2.803 N/A LEU 639.A N ASN 635.A O no hydrogen 2.991 N/A SER 640.A N GLY 637.A O no hydrogen 2.919 N/A ILE 642.A N GLU 638.A O no hydrogen 3.428 N/A LEU 643.A N LEU 639.A O no hydrogen 3.163 N/A LYS 644.A N SER 640.A O no hydrogen 2.781 N/A LYS 644.A NZ TYR 438.A OH no hydrogen 3.448 N/A GLN 657.A N ALA 653.A O no hydrogen 2.845 N/A LYS 658.A N THR 654.A O no hydrogen 2.988 N/A LYS 659.A N ASP 655.A O no hydrogen 2.826 N/A LYS 659.A NZ ASP 655.A OD2 no hydrogen 3.203 N/A LEU 660.A N ASN 656.A O no hydrogen 2.921 N/A GLU 661.A N GLN 657.A O no hydrogen 2.447 N/A LEU 663.A N LEU 660.A O no hydrogen 3.001 N/A ASP 666.A N ASN 664.A OD1 no hydrogen 2.744 N/A VAL 668.A N ASN 664.A O no hydrogen 3.335 N/A LEU 669.A N ASP 666.A O no hydrogen 2.767 N/A ASN 670.A N ASP 666.A O no hydrogen 2.893 N/A HIS 671.A N ASP 667.A O no hydrogen 2.721 N/A ALA 672.A N VAL 668.A O no hydrogen 3.049 N/A THR 677.A OG1 HIS 675.A O no hydrogen 3.411 N/A GLU 683.A N GLU 683.A OE1 no hydrogen 2.683 N/A SER 684.A OG ASP 405.A OD1 no hydrogen 3.424 N/A SER 684.A OG ASP 405.A OD2 no hydrogen 2.657 N/A LYS 693.A N GLU 690.A O no hydrogen 2.555 N/A LYS 693.A NZ GLU 690.A OE2 no hydrogen 2.939 N/A GLN 694.A N PHE 691.A O no hydrogen 2.843 N/A PHE 695.A N LEU 692.A O no hydrogen 3.020 N/A