Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7mlk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N ASN 1.A O no hydrogen 3.229 N/A ILE 6.A N ARG 2.A O no hydrogen 3.130 N/A LEU 7.A N GLU 3.A O no hydrogen 3.025 N/A ASN 8.A N GLU 4.A O no hydrogen 2.925 N/A GLU 10.A N ILE 6.A O no hydrogen 3.335 N/A ILE 11.A N LEU 7.A O no hydrogen 2.748 N/A GLY 12.A N ASN 8.A O no hydrogen 3.164 N/A PHE 13.A N ARG 9.A O no hydrogen 3.046 N/A ALA 14.A N GLU 10.A O no hydrogen 3.218 N/A ILE 15.A N ILE 11.A O no hydrogen 2.883 N/A GLY 16.A N GLY 12.A O no hydrogen 3.195 N/A GLY 16.A N PHE 13.A O no hydrogen 3.346 N/A GLU 21.A N PRO 18.A O no hydrogen 2.994 N/A PHE 22.A N VAL 19.A O no hydrogen 2.926 N/A MET 24.A N CYS 20.A O no hydrogen 3.202 N/A VAL 25.A N PHE 22.A O no hydrogen 3.339 N/A GLN 31.A N ASP 27.A O no hydrogen 3.413 N/A GLN 31.A NE2 PHE 22.A O no hydrogen 2.755 N/A GLN 31.A NE2 VAL 25.A O no hydrogen 2.809 N/A ASP 32.A N PRO 28.A O no hydrogen 2.879 N/A PHE 33.A N GLU 29.A O no hydrogen 2.732 N/A ARG 34.A N VAL 30.A O no hydrogen 2.803 N/A ARG 34.A NE GLU 546.A OE1 no hydrogen 2.790 N/A ARG 34.A NE GLU 546.A OE2 no hydrogen 3.423 N/A ARG 34.A NH1 ASP 23.A OD1 no hydrogen 2.875 N/A ARG 34.A NH1 GLN 31.A OE1 no hydrogen 3.374 N/A ARG 34.A NH2 ASP 23.A OD1 no hydrogen 3.100 N/A ARG 34.A NH2 GLU 546.A OE2 no hydrogen 2.793 N/A ARG 35.A N GLN 31.A O no hydrogen 3.055 N/A ARG 35.A NH2 ASP 32.A OD1 no hydrogen 2.776 N/A ASN 36.A N ASP 32.A O no hydrogen 2.781 N/A ILE 37.A N PHE 33.A O no hydrogen 3.192 N/A LEU 38.A N ARG 35.A O no hydrogen 3.340 N/A ASN 39.A ND2 GLU 43.A OE2 no hydrogen 3.463 N/A VAL 40.A N ILE 37.A O no hydrogen 3.215 N/A CYS 41.A N ILE 37.A O no hydrogen 3.441 N/A CYS 41.A SG ILE 37.A O no hydrogen 3.640 N/A CYS 41.A SG SER 547.A O no hydrogen 3.473 N/A LYS 42.A N LEU 38.A O no hydrogen 2.875 N/A LYS 42.A NZ ASP 46.A OD2 no hydrogen 3.128 N/A GLU 43.A N ASN 39.A O no hydrogen 2.717 N/A ALA 44.A N VAL 40.A O no hydrogen 2.888 N/A VAL 45.A N CYS 41.A O no hydrogen 2.947 N/A ASP 46.A N LYS 42.A O no hydrogen 2.801 N/A LEU 47.A N GLU 43.A O no hydrogen 3.027 N/A ARG 48.A N ALA 44.A O no hydrogen 3.186 N/A ARG 48.A N VAL 45.A O no hydrogen 2.926 N/A ARG 48.A NE ASP 182.A OD2 no hydrogen 3.330 N/A ARG 48.A NH1 LEU 515.A O no hydrogen 2.809 N/A ARG 48.A NH1 ALA 551.A O no hydrogen 2.815 N/A ARG 48.A NH2 ASP 182.A OD1 no hydrogen 3.161 N/A ARG 48.A NH2 ALA 551.A O no hydrogen 2.809 N/A ASP 49.A N VAL 45.A O no hydrogen 2.915 N/A LEU 50.A N ASP 46.A O no hydrogen 2.800 N/A ASN 51.A N SER 55.A OG no hydrogen 3.089 N/A SER 52.A N ASP 49.A O no hydrogen 3.205 N/A SER 55.A N ASN 51.A O no hydrogen 3.482 N/A SER 55.A OG ARG 48.A O no hydrogen 2.645 N/A ARG 56.A N PRO 53.A O no hydrogen 3.047 N/A ARG 56.A NH1 PRO 180.A O no hydrogen 3.391 N/A ALA 57.A N PRO 53.A O no hydrogen 2.925 N/A MET 58.A N HIS 54.A O no hydrogen 2.926 N/A TYR 59.A N SER 55.A O no hydrogen 3.206 N/A TYR 59.A N ARG 56.A O no hydrogen 3.217 N/A TYR 59.A OH CYS 552.A O no hydrogen 2.715 N/A VAL 60.A N ARG 56.A O no hydrogen 3.198 N/A TYR 61.A N ALA 57.A O no hydrogen 2.749 N/A GLU 66.A N GLN 151.A O no hydrogen 2.764 N/A SER 67.A OG ASP 483.A OD2 no hydrogen 2.798 N/A ILE 75.A N PRO 72.A O no hydrogen 2.786 N/A TYR 76.A N PRO 72.A O no hydrogen 3.059 N/A ASN 77.A N LYS 73.A O no hydrogen 2.853 N/A LYS 78.A N ILE 75.A O no hydrogen 3.388 N/A LYS 78.A NZ HIS 74.A O no hydrogen 3.344 N/A LEU 79.A N TYR 76.A O no hydrogen 3.000 N/A ASP 80.A N GLN 83.A O no hydrogen 3.105 N/A GLN 83.A N ASP 80.A O no hydrogen 3.155 N/A ILE 84.A N ILE 105.A O no hydrogen 2.727 N/A VAL 86.A N LEU 103.A O no hydrogen 2.751 N/A VAL 87.A N PRO 165.A O no hydrogen 2.926 N/A ILE 88.A N TYR 101.A O no hydrogen 3.135 N/A TRP 89.A N LEU 167.A O no hydrogen 2.754 N/A TRP 89.A NE1 ASN 166.A OD1 no hydrogen 2.972 N/A VAL 90.A N GLN 99.A O no hydrogen 2.818 N/A VAL 92.A N ASP 97.A O no hydrogen 2.855 N/A SER 93.A OG VAL 92.A O no hydrogen 2.949 N/A ASP 97.A N VAL 92.A O no hydrogen 3.081 N/A LYS 98.A NZ ILE 645.A O no hydrogen 3.204 N/A LYS 98.A NZ GLU 648.A OE2 no hydrogen 3.428 N/A GLN 99.A N VAL 90.A O no hydrogen 2.903 N/A TYR 101.A N ILE 88.A O no hydrogen 2.827 N/A TYR 101.A OH GLN 99.A OE1 no hydrogen 2.757 N/A LEU 103.A N VAL 86.A O no hydrogen 2.735 N/A LYS 104.A NZ ASP 80.A OD2 no hydrogen 3.199 N/A ILE 105.A N ILE 84.A O no hydrogen 2.778 N/A HIS 107.A N GLY 82.A O no hydrogen 3.402 N/A HIS 107.A ND1 GLY 82.A O no hydrogen 3.266 N/A CYS 109.A N ASN 106.A O no hydrogen 3.031 N/A CYS 109.A SG GLN 113.A OE1 no hydrogen 3.820 N/A VAL 110.A N GLN 113.A OE1 no hydrogen 2.973 N/A GLN 113.A N VAL 110.A O no hydrogen 3.089 N/A VAL 114.A N VAL 110.A O no hydrogen 3.194 N/A ILE 115.A N PRO 111.A O no hydrogen 2.912 N/A ALA 116.A N GLU 112.A O no hydrogen 3.229 N/A GLU 117.A N GLN 113.A O no hydrogen 3.050 N/A ALA 118.A N VAL 114.A O no hydrogen 3.105 N/A ILE 119.A N ILE 115.A O no hydrogen 2.995 N/A ARG 120.A N ALA 116.A O no hydrogen 2.897 N/A LYS 121.A N GLU 117.A O no hydrogen 3.030 N/A THR 123.A N ILE 119.A O no hydrogen 3.203 N/A THR 123.A OG1 ILE 119.A O no hydrogen 3.409 N/A ARG 124.A N ARG 120.A O no hydrogen 3.158 N/A SER 125.A OG LYS 122.A O no hydrogen 2.725 N/A MET 126.A N THR 123.A O no hydrogen 3.126 N/A LEU 127.A N THR 123.A O no hydrogen 3.308 N/A ILE 133.A N MET 170.A O no hydrogen 2.767 N/A LYS 135.A N MET 168.A O no hydrogen 2.948 N/A LYS 135.A NZ VAL 136.A O no hydrogen 2.965 N/A LYS 135.A NZ CYS 139.A O no hydrogen 3.426 N/A LYS 135.A NZ ASP 644.A OD1 no hydrogen 3.484 N/A LYS 135.A NZ ASP 644.A OD2 no hydrogen 3.109 N/A VAL 136.A N GLU 141.A O no hydrogen 2.817 N/A CYS 137.A N ASN 166.A O no hydrogen 3.277 N/A CYS 139.A N VAL 136.A O no hydrogen 3.483 N/A ASP 140.A N ALA 615.A O no hydrogen 2.894 N/A GLU 141.A N CYS 139.A O no hydrogen 2.902 N/A PHE 143.A N LEU 134.A O no hydrogen 2.845 N/A GLU 145.A N TYR 152.A OH no hydrogen 3.179 N/A LYS 146.A N GLU 145.A OE2 no hydrogen 3.271 N/A LEU 149.A N CYS 109.A O no hydrogen 2.767 N/A SER 150.A N HIS 107.A O no hydrogen 2.938 N/A SER 150.A OG HIS 107.A O no hydrogen 3.256 N/A GLN 151.A N PRO 148.A O no hydrogen 2.882 N/A GLN 151.A NE2 GLU 66.A O no hydrogen 3.299 N/A TYR 152.A N LEU 149.A O no hydrogen 3.229 N/A TYR 152.A OH GLU 145.A O no hydrogen 2.788 N/A LYS 153.A N ASN 64.A O no hydrogen 2.954 N/A LYS 153.A NZ ASP 483.A OD1 no hydrogen 2.889 N/A TYR 154.A OH ASN 166.A O no hydrogen 3.191 N/A ARG 156.A N TYR 152.A O no hydrogen 2.877 N/A ARG 156.A NE SER 150.A O no hydrogen 3.004 N/A ARG 156.A NH1 SER 68.A O no hydrogen 2.799 N/A ARG 156.A NH2 SER 68.A O no hydrogen 3.322 N/A SER 157.A N LYS 153.A O no hydrogen 2.811 N/A CYS 158.A N TYR 154.A O no hydrogen 3.146 N/A CYS 158.A SG TYR 154.A O no hydrogen 3.363 N/A ILE 159.A N ILE 155.A O no hydrogen 3.138 N/A MET 160.A N ARG 156.A O no hydrogen 3.229 N/A LEU 161.A N SER 157.A O no hydrogen 2.967 N/A GLY 162.A N ILE 159.A O no hydrogen 3.160 N/A ARG 163.A N CYS 158.A O no hydrogen 2.814 N/A ASN 166.A N TYR 154.A OH no hydrogen 3.166 N/A LEU 167.A N VAL 87.A O no hydrogen 2.837 N/A MET 168.A N LYS 135.A O no hydrogen 2.771 N/A LEU 169.A N TRP 89.A O no hydrogen 2.843 N/A MET 170.A N ILE 133.A O no hydrogen 2.905 N/A LYS 172.A N LYS 131.A O no hydrogen 2.935 N/A LYS 172.A NZ GLY 130.A O no hydrogen 3.350 N/A LEU 175.A N LYS 172.A O no hydrogen 3.203 N/A TYR 176.A N LYS 172.A O no hydrogen 2.867 N/A SER 177.A N GLU 173.A O no hydrogen 2.927 N/A SER 177.A OG GLU 173.A O no hydrogen 3.295 N/A SER 177.A OG SER 174.A O no hydrogen 3.208 N/A SER 188.A N GLU 4.A OE1 no hydrogen 2.927 N/A SER 188.A OG GLU 4.A OE1 no hydrogen 2.868 N/A SER 188.A OG GLU 4.A OE2 no hydrogen 2.895 N/A SER 190.A N PRO 187.A O no hydrogen 3.361 N/A SER 190.A OG PRO 187.A O no hydrogen 2.636 N/A ARG 191.A N SER 188.A O no hydrogen 3.274 N/A SER 193.A N VAL 340.A O no hydrogen 2.898 N/A TRP 195.A NE1 PRO 257.A O no hydrogen 2.768 N/A LEU 201.A N ILE 254.A O no hydrogen 2.862 N/A ARG 202.A NE ASP 335.A OD2 no hydrogen 2.796 N/A ILE 203.A N LEU 250.A O no hydrogen 2.991 N/A LYS 204.A N GLU 333.A O no hydrogen 2.800 N/A LYS 204.A NZ GLU 333.A OE1 no hydrogen 3.451 N/A ILE 205.A N GLU 248.A O no hydrogen 3.043 N/A LEU 206.A N GLU 331.A O no hydrogen 3.158 N/A ALA 208.A N PRO 244.A O no hydrogen 3.210 N/A THR 209.A N CYS 329.A O no hydrogen 3.259 N/A ASN 212.A ND2 VAL 211.A O no hydrogen 3.178 N/A ILE 217.A N VAL 239.A O no hydrogen 2.767 N/A TYR 218.A N CYS 270.A O no hydrogen 3.096 N/A VAL 219.A N THR 236.A OG1 no hydrogen 2.796 N/A ARG 220.A N SER 268.A O no hydrogen 2.823 N/A THR 221.A N VAL 234.A O no hydrogen 2.868 N/A THR 221.A OG1 VAL 234.A O no hydrogen 2.676 N/A THR 221.A OG1 TYR 252.A OH no hydrogen 3.283 N/A TYR 224.A N ARG 264.A O no hydrogen 2.984 N/A HIS 225.A N GLU 228.A O no hydrogen 2.853 N/A GLU 228.A N HIS 225.A O no hydrogen 2.991 N/A LEU 230.A N ILE 223.A O no hydrogen 2.758 N/A CYS 231.A SG ASP 232.A O no hydrogen 3.447 N/A THR 236.A N VAL 219.A O no hydrogen 3.016 N/A THR 236.A OG1 VAL 219.A O no hydrogen 3.296 N/A GLN 237.A N GLU 248.A OE2 no hydrogen 2.856 N/A VAL 239.A N ILE 217.A O no hydrogen 3.017 N/A SER 242.A N PRO 240.A O no hydrogen 2.706 N/A ARG 245.A N ASN 243.A O no hydrogen 3.158 N/A ASN 247.A N LEU 206.A O no hydrogen 3.075 N/A LEU 250.A N ILE 203.A O no hydrogen 2.815 N/A TYR 252.A N LEU 201.A O no hydrogen 2.761 N/A TYR 252.A OH THR 221.A OG1 no hydrogen 3.283 N/A ILE 256.A N SER 199.A O no hydrogen 3.305 N/A ASP 258.A N TYR 255.A O no hydrogen 2.812 N/A LEU 259.A N ILE 256.A O no hydrogen 3.393 N/A ARG 261.A NE ASP 291.A OD1 no hydrogen 3.324 N/A ARG 261.A NH1 ARG 261.A O no hydrogen 2.900 N/A ARG 261.A NH1 TYR 501.A OH no hydrogen 2.785 N/A ARG 261.A NH2 ASP 288.A O no hydrogen 3.035 N/A ARG 261.A NH2 ASP 291.A OD1 no hydrogen 2.793 N/A ARG 261.A NH2 TYR 501.A OH no hydrogen 3.252 N/A ALA 263.A N PRO 260.A O no hydrogen 3.057 N/A ARG 264.A N TYR 224.A O no hydrogen 2.956 N/A ARG 264.A NE THR 319.A OG1 no hydrogen 3.104 N/A ARG 264.A NH1 PRO 315.A O no hydrogen 2.807 N/A ARG 264.A NH2 PRO 315.A O no hydrogen 2.811 N/A ARG 264.A NH2 THR 319.A OG1 no hydrogen 3.413 N/A LEU 265.A N ILE 284.A O no hydrogen 2.692 N/A CYS 266.A N GLY 222.A O no hydrogen 2.780 N/A CYS 266.A SG ASN 283.A OD1 no hydrogen 3.456 N/A LEU 267.A N GLY 282.A O no hydrogen 2.924 N/A SER 268.A N ARG 220.A O no hydrogen 2.919 N/A SER 268.A OG LEU 312.A O no hydrogen 2.972 N/A ILE 269.A N ALA 280.A O no hydrogen 2.914 N/A CYS 270.A N TYR 218.A O no hydrogen 2.813 N/A CYS 270.A SG SER 268.A OG no hydrogen 3.415 N/A CYS 270.A SG LEU 312.A O no hydrogen 3.872 N/A SER 271.A N CYS 277.A O no hydrogen 2.796 N/A VAL 272.A N LYS 216.A O no hydrogen 3.106 N/A LYS 273.A N GLU 275.A O no hydrogen 3.037 N/A LYS 273.A NZ GLU 275.A O no hydrogen 3.310 N/A CYS 277.A N SER 271.A O no hydrogen 3.119 N/A CYS 277.A SG HIS 276.A O no hydrogen 3.423 N/A LEU 279.A N ILE 269.A O no hydrogen 2.736 N/A TRP 281.A N TRP 303.A O no hydrogen 2.997 N/A TRP 281.A NE1 PRO 304.A O no hydrogen 2.941 N/A GLY 282.A N LEU 267.A O no hydrogen 3.147 N/A ASN 283.A ND2 ASN 314.A O no hydrogen 2.931 N/A ILE 284.A N LEU 265.A O no hydrogen 2.817 N/A ASN 285.A ND2 GLN 500.A O no hydrogen 3.194 N/A LEU 286.A N ALA 263.A O no hydrogen 3.186 N/A ASP 288.A N THR 292.A O no hydrogen 2.753 N/A TYR 289.A OH ASP 32.A OD2 no hydrogen 2.674 N/A THR 290.A N ASP 288.A OD1 no hydrogen 3.088 N/A THR 290.A OG1 ASP 288.A OD1 no hydrogen 2.815 N/A THR 290.A OG1 ASP 288.A OD2 no hydrogen 3.364 N/A THR 290.A OG1 THR 292.A OG1 no hydrogen 2.729 N/A ASP 291.A N ASP 288.A O no hydrogen 3.389 N/A THR 292.A N ASP 288.A OD1 no hydrogen 2.954 N/A THR 292.A OG1 ASP 288.A OD1 no hydrogen 3.008 N/A THR 292.A OG1 THR 290.A OG1 no hydrogen 2.729 N/A LEU 293.A N VAL 341.A O no hydrogen 2.720 N/A VAL 294.A N LEU 286.A O no hydrogen 3.256 N/A LYS 297.A NZ GLU 333.A OE1 no hydrogen 3.340 N/A MET 298.A N LEU 332.A O no hydrogen 2.868 N/A LEU 300.A N LEU 330.A O no hydrogen 2.918 N/A ASN 301.A N SER 321.A OG no hydrogen 3.360 N/A ASN 301.A ND2 LYS 325.A O no hydrogen 3.041 N/A ASN 301.A ND2 THR 327.A OG1 no hydrogen 2.757 N/A LEU 302.A N PRO 328.A O no hydrogen 2.901 N/A TRP 303.A N TRP 281.A O no hydrogen 2.718 N/A TRP 303.A NE1 GLY 320.A O no hydrogen 3.098 N/A GLY 317.A N ASN 314.A O no hydrogen 3.280 N/A GLY 320.A N ASN 283.A O no hydrogen 2.851 N/A ASN 322.A N ASN 301.A O no hydrogen 2.821 N/A ASN 322.A ND2 LEU 302.A O no hydrogen 2.998 N/A ASN 324.A N ASN 322.A OD1 no hydrogen 3.086 N/A LYS 325.A NZ SER 321.A OG no hydrogen 3.376 N/A LYS 325.A NZ ASN 322.A O no hydrogen 2.807 N/A GLU 326.A N ASN 324.A OD1 no hydrogen 3.352 N/A THR 327.A OG1 ASN 324.A O no hydrogen 2.728 N/A CYS 329.A SG GLU 331.A OE2 no hydrogen 3.661 N/A GLU 331.A N CYS 207.A O no hydrogen 2.817 N/A LEU 332.A N MET 298.A O no hydrogen 2.788 N/A GLU 333.A N LYS 204.A O no hydrogen 3.129 N/A PHE 334.A N GLY 296.A O no hydrogen 2.702 N/A LYS 342.A N SER 193.A O no hydrogen 3.371 N/A LYS 342.A NZ THR 290.A O no hydrogen 3.090 N/A LYS 342.A NZ THR 290.A OG1 no hydrogen 3.408 N/A PHE 343.A N ASP 291.A O no hydrogen 2.869 N/A MET 346.A N ASP 345.A OD1 no hydrogen 2.809 N/A SER 347.A OG ASP 345.A OD2 no hydrogen 2.837 N/A ILE 349.A N ASP 345.A O no hydrogen 3.078 N/A GLU 350.A N MET 346.A O no hydrogen 2.762 N/A GLU 351.A N SER 347.A O no hydrogen 2.941 N/A HIS 352.A N VAL 348.A O no hydrogen 3.128 N/A HIS 352.A NE2 ASP 435.A OD1 no hydrogen 2.829 N/A ALA 353.A N ILE 349.A O no hydrogen 2.744 N/A ASN 354.A N GLU 350.A O no hydrogen 2.779 N/A TRP 355.A N GLU 351.A O no hydrogen 3.257 N/A SER 356.A N HIS 352.A O no hydrogen 2.769 N/A SER 356.A OG HIS 352.A O no hydrogen 2.737 N/A SER 356.A OG ASP 435.A OD1 no hydrogen 3.020 N/A SER 358.A N ASN 354.A O no hydrogen 2.800 N/A ARG 359.A N TRP 355.A O no hydrogen 2.783 N/A ALA 361.A N VAL 357.A O no hydrogen 3.045 N/A PHE 363.A N GLU 360.A O no hydrogen 3.051 N/A ARG 373.A NE GLU 436.A OE1 no hydrogen 2.873 N/A ARG 373.A NE GLU 436.A OE2 no hydrogen 2.919 N/A ARG 373.A NH2 SER 428.A O no hydrogen 2.718 N/A ARG 373.A NH2 GLU 436.A OE1 no hydrogen 2.817 N/A LEU 374.A N SER 371.A O no hydrogen 3.242 N/A ASP 384.A N ARG 381.A O no hydrogen 3.271 N/A LYS 385.A NZ GLU 382.A OE2 no hydrogen 3.093 N/A GLN 387.A N ASP 384.A O no hydrogen 3.238 N/A LEU 388.A N ASP 384.A O no hydrogen 3.215 N/A ALA 390.A N GLU 386.A O no hydrogen 2.991 N/A ILE 391.A N GLN 387.A O no hydrogen 3.013 N/A ILE 391.A N LEU 388.A O no hydrogen 3.174 N/A SER 392.A N LEU 388.A O no hydrogen 2.843 N/A SER 392.A OG LYS 389.A O no hydrogen 2.741 N/A THR 393.A N LYS 389.A O no hydrogen 3.102 N/A THR 393.A OG1 LYS 389.A O no hydrogen 3.537 N/A THR 393.A OG1 ALA 390.A O no hydrogen 2.872 N/A ARG 394.A N ILE 391.A O no hydrogen 3.191 N/A ARG 394.A NH1 GLU 404.A OE2 no hydrogen 2.840 N/A ARG 394.A NH2 GLU 404.A OE1 no hydrogen 3.084 N/A SER 398.A N ASP 395.A O no hydrogen 3.051 N/A THR 401.A N GLU 404.A OE1 no hydrogen 3.197 N/A THR 401.A OG1 GLU 404.A OE1 no hydrogen 2.965 N/A GLU 404.A N THR 401.A OG1 no hydrogen 3.390 N/A LYS 405.A N THR 401.A O no hydrogen 2.806 N/A LYS 405.A NZ LEU 427.A O no hydrogen 2.817 N/A ASP 406.A N GLU 402.A O no hydrogen 2.966 N/A PHE 407.A N GLN 403.A O no hydrogen 3.192 N/A LEU 408.A N GLU 404.A O no hydrogen 2.988 N/A TRP 409.A N LYS 405.A O no hydrogen 3.288 N/A SER 410.A N ASP 406.A O no hydrogen 3.084 N/A SER 410.A OG ASP 406.A O no hydrogen 2.920 N/A HIS 411.A N PHE 407.A O no hydrogen 3.283 N/A ARG 412.A N TRP 409.A O no hydrogen 3.063 N/A ARG 412.A NE GLN 439.A OE1 no hydrogen 2.860 N/A ARG 412.A NH1 ARG 373.A O no hydrogen 2.791 N/A ARG 412.A NH1 TRP 409.A O no hydrogen 2.766 N/A ARG 412.A NH2 ARG 373.A O no hydrogen 3.555 N/A ARG 412.A NH2 GLN 439.A OE1 no hydrogen 2.846 N/A TYR 414.A N HIS 411.A O no hydrogen 3.071 N/A CYS 415.A N HIS 411.A O no hydrogen 3.155 N/A CYS 415.A SG HIS 411.A O no hydrogen 3.333 N/A THR 417.A N TYR 414.A O no hydrogen 2.949 N/A THR 417.A OG1 TYR 414.A O no hydrogen 2.691 N/A ILE 418.A N CYS 415.A O no hydrogen 3.205 N/A GLU 420.A N GLU 420.A OE1 no hydrogen 2.911 N/A ILE 421.A N ILE 418.A O no hydrogen 3.257 N/A LEU 422.A N PRO 419.A O no hydrogen 3.369 N/A LYS 424.A N ILE 421.A O no hydrogen 2.896 N/A LYS 424.A NZ ILE 391.A O no hydrogen 2.857 N/A LYS 424.A NZ ARG 394.A O no hydrogen 2.767 N/A LEU 425.A N ILE 421.A O no hydrogen 2.941 N/A LEU 426.A N LEU 422.A O no hydrogen 2.874 N/A SER 428.A N LEU 425.A O no hydrogen 3.188 N/A SER 428.A OG LYS 424.A O no hydrogen 2.719 N/A VAL 429.A N LEU 426.A O no hydrogen 3.384 N/A LYS 430.A N GLU 436.A OE1 no hydrogen 3.382 N/A TRP 431.A NE1 LEU 426.A O no hydrogen 2.806 N/A ASN 432.A ND2 LEU 230.A O no hydrogen 3.625 N/A SER 433.A N LYS 430.A O no hydrogen 3.169 N/A VAL 437.A N SER 433.A O no hydrogen 3.234 N/A ALA 438.A N ARG 434.A O no hydrogen 3.311 N/A GLN 439.A N ASP 435.A O no hydrogen 3.452 N/A GLN 439.A NE2 GLU 360.A OE2 no hydrogen 3.401 N/A MET 440.A N GLU 436.A O no hydrogen 3.110 N/A TYR 441.A N VAL 437.A O no hydrogen 2.895 N/A CYS 442.A SG ALA 438.A O no hydrogen 3.326 N/A LEU 443.A N GLN 439.A O no hydrogen 3.237 N/A VAL 444.A N MET 440.A O no hydrogen 2.983 N/A LYS 445.A N TYR 441.A O no hydrogen 2.975 N/A LYS 445.A NZ GLU 350.A OE1 no hydrogen 3.262 N/A LYS 445.A NZ GLU 350.A OE2 no hydrogen 2.919 N/A TRP 447.A N VAL 444.A O no hydrogen 3.380 N/A TRP 447.A NE1 PRO 419.A O no hydrogen 2.910 N/A LYS 451.A N GLN 454.A OE1 no hydrogen 3.053 N/A GLN 454.A N LYS 451.A O no hydrogen 3.144 N/A ALA 455.A N LYS 451.A O no hydrogen 3.107 N/A MET 456.A N GLU 453.A O no hydrogen 3.437 N/A GLU 457.A N GLN 454.A O no hydrogen 3.262 N/A LEU 459.A N MET 456.A O no hydrogen 2.839 N/A ASN 462.A N ASP 460.A OD1 no hydrogen 2.817 N/A ASN 462.A ND2 ASP 460.A OD1 no hydrogen 2.885 N/A ASN 462.A ND2 ASP 460.A OD2 no hydrogen 3.454 N/A TYR 463.A N ASP 460.A O no hydrogen 3.435 N/A TYR 463.A OH PRO 423.A O no hydrogen 3.160 N/A TYR 463.A OH GLU 457.A OE2 no hydrogen 3.258 N/A MET 467.A N ASP 465.A OD1 no hydrogen 2.964 N/A VAL 468.A N ASP 465.A OD1 no hydrogen 3.163 N/A ARG 469.A N ASP 465.A O no hydrogen 3.102 N/A ARG 469.A NE TYR 463.A O no hydrogen 3.057 N/A ARG 469.A NH1 GLU 499.A OE2 no hydrogen 2.774 N/A ARG 469.A NH2 ASP 460.A O no hydrogen 2.773 N/A GLY 470.A N PRO 466.A O no hydrogen 2.845 N/A PHE 471.A N MET 467.A O no hydrogen 3.142 N/A ALA 472.A N VAL 468.A O no hydrogen 3.300 N/A VAL 473.A N ARG 469.A O no hydrogen 3.027 N/A ARG 474.A N GLY 470.A O no hydrogen 3.051 N/A CYS 475.A N PHE 471.A O no hydrogen 3.049 N/A CYS 475.A SG ILE 450.A O no hydrogen 3.607 N/A CYS 475.A SG PHE 471.A O no hydrogen 3.490 N/A LEU 476.A N ALA 472.A O no hydrogen 3.237 N/A GLU 477.A N VAL 473.A O no hydrogen 2.758 N/A LYS 478.A N ARG 474.A O no hydrogen 3.130 N/A LYS 478.A NZ TYR 479.A OH no hydrogen 3.377 N/A TYR 479.A N CYS 475.A O no hydrogen 2.862 N/A LEU 480.A N LEU 476.A O no hydrogen 3.003 N/A THR 481.A OG1 SER 67.A OG no hydrogen 3.209 N/A LYS 484.A N THR 481.A OG1 no hydrogen 2.936 N/A LEU 485.A N THR 481.A O no hydrogen 3.018 N/A SER 486.A N ASP 482.A O no hydrogen 3.183 N/A SER 486.A OG ASP 482.A O no hydrogen 3.248 N/A GLN 487.A N ASP 483.A O no hydrogen 3.293 N/A TYR 488.A N LYS 484.A O no hydrogen 3.048 N/A GLN 491.A NE2 GLN 672.A OE1 no hydrogen 2.778 N/A GLN 491.A NE2 LEU 843.A O no hydrogen 3.656 N/A LEU 492.A N TYR 488.A O no hydrogen 2.888 N/A VAL 493.A N LEU 489.A O no hydrogen 2.975 N/A GLN 494.A N ILE 490.A O no hydrogen 3.203 N/A GLN 494.A NE2 GLU 531.A OE1 no hydrogen 2.808 N/A VAL 495.A N GLN 491.A O no hydrogen 2.948 N/A LYS 497.A N GLN 494.A O no hydrogen 3.205 N/A LYS 497.A NZ GLN 494.A OE1 no hydrogen 2.890 N/A LYS 497.A NZ GLU 531.A OE1 no hydrogen 3.427 N/A LYS 497.A NZ GLU 531.A OE2 no hydrogen 2.724 N/A TYR 498.A N VAL 495.A O no hydrogen 3.067 N/A TYR 498.A OH MET 846.A O no hydrogen 3.028 N/A GLU 499.A N LEU 496.A O no hydrogen 3.026 N/A GLN 500.A NE2 ASN 285.A OD1 no hydrogen 3.261 N/A TYR 501.A OH PHE 287.A O no hydrogen 2.676 N/A LEU 502.A N GLU 29.A OE2 no hydrogen 3.287 N/A ASN 504.A ND2 TYR 501.A O no hydrogen 2.918 N/A VAL 507.A N ASN 504.A OD1 no hydrogen 2.809 N/A ARG 508.A NE ASP 503.A OD1 no hydrogen 2.827 N/A ARG 508.A NH1 ASN 36.A O no hydrogen 3.498 N/A ARG 508.A NH2 ASN 36.A O no hydrogen 3.136 N/A ARG 508.A NH2 ASP 503.A OD2 no hydrogen 2.736 N/A PHE 509.A N LEU 505.A O no hydrogen 2.828 N/A LEU 510.A N LEU 506.A O no hydrogen 2.989 N/A LEU 511.A N VAL 507.A O no hydrogen 2.827 N/A LYS 512.A N ARG 508.A O no hydrogen 3.016 N/A LYS 513.A N PHE 509.A O no hydrogen 3.106 N/A LYS 513.A NZ ASP 482.A OD1 no hydrogen 2.811 N/A LYS 513.A NZ ASP 482.A OD2 no hydrogen 3.497 N/A ALA 514.A N LEU 510.A O no hydrogen 2.981 N/A LEU 515.A N LEU 511.A O no hydrogen 2.815 N/A LEU 515.A N LYS 512.A O no hydrogen 3.046 N/A THR 516.A N LYS 513.A O no hydrogen 3.247 N/A THR 516.A OG1 LYS 512.A O no hydrogen 2.897 N/A THR 516.A OG1 LYS 513.A O no hydrogen 3.199 N/A ASN 517.A ND2 ASP 482.A OD2 no hydrogen 3.221 N/A GLN 518.A N TYR 59.A O no hydrogen 2.928 N/A ARG 519.A NH1 PRO 62.A O no hydrogen 2.826 N/A ARG 519.A NH2 PRO 63.A O no hydrogen 3.149 N/A ILE 520.A N ASN 517.A OD1 no hydrogen 3.067 N/A GLY 521.A N ASN 517.A O no hydrogen 2.824 N/A HIS 522.A N GLN 518.A O no hydrogen 2.895 N/A HIS 522.A ND1 TYR 555.A OH no hydrogen 2.724 N/A HIS 522.A NE2 PRO 611.A O no hydrogen 2.691 N/A PHE 524.A N ILE 520.A O no hydrogen 2.934 N/A PHE 525.A N GLY 521.A O no hydrogen 2.797 N/A TRP 526.A N HIS 522.A O no hydrogen 3.126 N/A TRP 526.A NE1 GLN 562.A OE1 no hydrogen 2.764 N/A HIS 527.A N PHE 523.A O no hydrogen 2.724 N/A LEU 528.A N PHE 524.A O no hydrogen 3.106 N/A LYS 529.A N PHE 525.A O no hydrogen 2.780 N/A LYS 529.A NZ ALA 14.A O no hydrogen 2.792 N/A SER 530.A N TRP 526.A O no hydrogen 2.832 N/A SER 530.A OG HIS 527.A O no hydrogen 2.994 N/A GLU 531.A N LEU 528.A O no hydrogen 3.103 N/A MET 532.A N LYS 529.A O no hydrogen 3.167 N/A THR 536.A N ASN 534.A OD1 no hydrogen 3.423 N/A VAL 537.A N ASN 534.A O no hydrogen 3.325 N/A SER 538.A N ASN 534.A O no hydrogen 2.812 N/A SER 538.A OG LYS 535.A O no hydrogen 3.505 N/A ARG 540.A NH1 TYR 501.A O no hydrogen 3.358 N/A PHE 541.A N VAL 537.A O no hydrogen 3.257 N/A GLY 542.A N SER 538.A O no hydrogen 2.952 N/A LEU 543.A N GLN 539.A O no hydrogen 2.945 N/A LEU 544.A N ARG 540.A O no hydrogen 3.039 N/A LEU 545.A N PHE 541.A O no hydrogen 2.770 N/A GLU 546.A N GLY 542.A O no hydrogen 3.207 N/A GLU 546.A N LEU 543.A O no hydrogen 3.137 N/A SER 547.A N LEU 543.A O no hydrogen 3.047 N/A SER 547.A OG LEU 543.A O no hydrogen 3.349 N/A SER 547.A OG LEU 544.A O no hydrogen 2.759 N/A TYR 548.A N LEU 544.A O no hydrogen 2.940 N/A CYS 549.A N LEU 545.A O no hydrogen 2.848 N/A CYS 549.A SG LEU 545.A O no hydrogen 3.227 N/A ARG 550.A N GLU 546.A O no hydrogen 2.945 N/A ARG 550.A NE TYR 189.A OH no hydrogen 2.956 N/A ARG 550.A NH1 ASN 8.A OD1 no hydrogen 3.057 N/A ARG 550.A NH2 ASN 8.A OD1 no hydrogen 3.450 N/A ARG 550.A NH2 GLU 546.A OE2 no hydrogen 2.812 N/A CYS 552.A SG CYS 549.A O no hydrogen 3.781 N/A CYS 552.A SG GLY 553.A O no hydrogen 3.658 N/A TYR 555.A OH HIS 522.A ND1 no hydrogen 2.724 N/A LEU 556.A N GLY 553.A O no hydrogen 3.161 N/A LYS 557.A N MET 554.A O no hydrogen 3.374 N/A LEU 559.A N TYR 555.A O no hydrogen 2.908 N/A ASN 560.A N LEU 556.A O no hydrogen 2.880 N/A ARG 561.A N LYS 557.A O no hydrogen 3.130 N/A ARG 561.A NE GLY 607.A O no hydrogen 3.460 N/A ARG 561.A NH1 ALA 604.A O no hydrogen 2.795 N/A ARG 561.A NH2 ALA 604.A O no hydrogen 3.155 N/A ARG 561.A NH2 GLN 606.A O no hydrogen 2.806 N/A ARG 561.A NH2 GLY 607.A O no hydrogen 3.270 N/A GLN 562.A N HIS 558.A O no hydrogen 3.379 N/A VAL 563.A N LEU 559.A O no hydrogen 2.878 N/A GLU 564.A N ASN 560.A O no hydrogen 2.902 N/A ALA 565.A N ARG 561.A O no hydrogen 3.070 N/A MET 566.A N GLN 562.A O no hydrogen 2.930 N/A GLU 567.A N VAL 563.A O no hydrogen 2.835 N/A LYS 568.A N GLU 564.A O no hydrogen 3.031 N/A LEU 569.A N ALA 565.A O no hydrogen 2.995 N/A ILE 570.A N MET 566.A O no hydrogen 2.940 N/A ASN 571.A N GLU 567.A O no hydrogen 2.753 N/A LEU 572.A N LYS 568.A O no hydrogen 2.864 N/A THR 573.A N LEU 569.A O no hydrogen 2.945 N/A THR 573.A OG1 LEU 569.A O no hydrogen 2.918 N/A THR 573.A OG1 ILE 570.A O no hydrogen 2.999 N/A ASP 574.A N ILE 570.A O no hydrogen 2.721 N/A ILE 575.A N ASN 571.A O no hydrogen 3.047 N/A LEU 576.A N LEU 572.A O no hydrogen 3.041 N/A LYS 577.A N THR 573.A O no hydrogen 2.892 N/A LYS 577.A NZ ASN 660.A O no hydrogen 2.959 N/A GLU 579.A N ILE 575.A O no hydrogen 2.714 N/A LYS 580.A N LEU 576.A O no hydrogen 2.957 N/A LYS 580.A NZ GLU 579.A OE2 no hydrogen 3.553 N/A LYS 581.A NZ ASP 582.A OD1 no hydrogen 3.278 N/A LYS 581.A NZ ASP 582.A OD2 no hydrogen 2.923 N/A GLN 585.A NE2 ILE 628.A O no hydrogen 2.816 N/A LYS 586.A N THR 584.A OG1 no hydrogen 3.358 N/A GLN 588.A N THR 584.A O no hydrogen 3.027 N/A GLN 588.A NE2 LYS 580.A O no hydrogen 2.769 N/A MET 589.A N GLN 585.A O no hydrogen 2.975 N/A LYS 590.A N LYS 586.A O no hydrogen 2.972 N/A LYS 590.A NZ GLU 594.A OE1 no hydrogen 2.827 N/A PHE 591.A N VAL 587.A O no hydrogen 2.874 N/A LEU 592.A N GLN 588.A O no hydrogen 2.790 N/A VAL 593.A N MET 589.A O no hydrogen 2.905 N/A GLU 594.A N LYS 590.A O no hydrogen 3.202 N/A GLN 595.A N PHE 591.A O no hydrogen 2.889 N/A MET 596.A N LEU 592.A O no hydrogen 2.792 N/A ARG 597.A N VAL 593.A O no hydrogen 3.051 N/A ARG 598.A N GLN 595.A O no hydrogen 3.226 N/A ARG 598.A NH1 GLN 595.A OE1 no hydrogen 3.538 N/A MET 602.A N ARG 598.A O no hydrogen 2.890 N/A ASP 603.A N PRO 599.A O no hydrogen 3.315 N/A ALA 604.A N ASP 600.A O no hydrogen 3.401 N/A LEU 605.A N PHE 601.A O no hydrogen 3.322 N/A GLY 607.A N GLY 619.A O no hydrogen 3.128 N/A PHE 608.A N LEU 618.A O no hydrogen 2.955 N/A SER 610.A N HIS 616.A O no hydrogen 2.982 N/A SER 610.A OG ASN 613.A O no hydrogen 3.397 N/A LEU 612.A N SER 610.A OG no hydrogen 3.066 N/A ASN 613.A N SER 610.A O no hydrogen 3.318 N/A ASN 613.A N SER 610.A OG no hydrogen 3.334 N/A ALA 615.A N ASN 613.A OD1 no hydrogen 3.354 N/A HIS 616.A N ASN 613.A O no hydrogen 2.975 N/A LEU 618.A N PHE 608.A O no hydrogen 2.830 N/A GLY 619.A N GLU 641.A O no hydrogen 3.086 N/A ASN 620.A N GLU 641.A OE1 no hydrogen 2.820 N/A LEU 621.A N GLN 606.A OE1 no hydrogen 2.809 N/A ARG 622.A N ASN 639.A O no hydrogen 3.045 N/A ARG 622.A NH1 GLU 624.A OE2 no hydrogen 3.186 N/A GLU 624.A N GLU 624.A OE2 no hydrogen 3.042 N/A GLU 625.A N ARG 622.A O no hydrogen 2.865 N/A CYS 626.A N LEU 623.A O no hydrogen 3.118 N/A CYS 626.A SG ARG 622.A O no hydrogen 3.366 N/A CYS 626.A SG ASN 639.A O no hydrogen 3.697 N/A ARG 627.A N TRP 637.A O no hydrogen 2.952 N/A MET 629.A N PRO 635.A O no hydrogen 2.914 N/A ARG 634.A NH2 SER 630.A O no hydrogen 3.016 N/A LEU 636.A N PHE 658.A O no hydrogen 2.931 N/A TRP 637.A N ARG 627.A O no hydrogen 2.828 N/A TRP 637.A NE1 GLU 655.A OE1 no hydrogen 3.125 N/A LEU 638.A N ILE 656.A O no hydrogen 2.803 N/A ASN 639.A ND2 ASN 653.A OD1 no hydrogen 3.651 N/A ASN 639.A ND2 GLU 655.A OE1 no hydrogen 2.874 N/A TRP 640.A N ASN 654.A O no hydrogen 2.829 N/A TRP 640.A NE1 LEU 605.A O no hydrogen 2.684 N/A GLU 641.A N ASN 620.A O no hydrogen 2.755 N/A ASN 642.A N GLN 652.A O no hydrogen 2.835 N/A ASN 642.A ND2 GLY 138.A O no hydrogen 3.126 N/A ASN 642.A ND2 PHE 651.A O no hydrogen 2.800 N/A ASP 644.A N ASN 642.A OD1 no hydrogen 3.364 N/A MET 646.A N ASP 644.A OD1 no hydrogen 3.070 N/A SER 647.A N ASP 644.A O no hydrogen 3.229 N/A SER 647.A OG ASN 642.A O no hydrogen 3.424 N/A SER 647.A OG ASP 644.A O no hydrogen 3.006 N/A SER 647.A OG GLN 652.A OE1 no hydrogen 2.746 N/A LEU 649.A N MET 646.A O no hydrogen 3.303 N/A LEU 650.A N SER 647.A O no hydrogen 2.953 N/A PHE 651.A N SER 647.A O no hydrogen 2.933 N/A ASN 653.A ND2 GLN 652.A O no hydrogen 3.006 N/A ASN 654.A N TRP 640.A O no hydrogen 2.780 N/A ILE 656.A N LEU 638.A O no hydrogen 2.957 N/A ILE 657.A N ILE 705.A O no hydrogen 2.892 N/A PHE 658.A N LEU 636.A O no hydrogen 2.833 N/A LYS 659.A N GLY 703.A O no hydrogen 3.070 N/A ASN 660.A ND2 THR 573.A OG1 no hydrogen 2.775 N/A ASN 660.A ND2 ASP 574.A OD1 no hydrogen 3.078 N/A GLY 661.A N CYS 701.A O no hydrogen 2.773 N/A ARG 665.A N ASP 663.A OD1 no hydrogen 3.252 N/A ARG 665.A NE ASP 663.A OD1 no hydrogen 3.034 N/A ARG 665.A NH2 ASP 663.A OD2 no hydrogen 2.835 N/A ARG 665.A NH2 GLY 851.A O no hydrogen 2.801 N/A MET 668.A N LEU 664.A O no hydrogen 2.846 N/A LEU 669.A N ARG 665.A O no hydrogen 3.040 N/A THR 670.A N GLN 666.A O no hydrogen 3.068 N/A THR 670.A OG1 GLN 666.A O no hydrogen 2.688 N/A LEU 671.A N ASP 667.A O no hydrogen 3.052 N/A GLN 672.A N MET 668.A O no hydrogen 2.997 N/A GLN 672.A NE2 GLN 491.A OE1 no hydrogen 2.774 N/A ILE 673.A N LEU 669.A O no hydrogen 2.808 N/A ILE 674.A N THR 670.A O no hydrogen 2.784 N/A ARG 675.A N LEU 671.A O no hydrogen 3.167 N/A ARG 675.A NH2.B PRO 692.A O no hydrogen 3.332 N/A ILE 676.A N GLN 672.A O no hydrogen 3.143 N/A MET 677.A N ILE 673.A O no hydrogen 2.817 N/A GLU 678.A N ILE 674.A O no hydrogen 2.916 N/A ASN 679.A N ARG 675.A O no hydrogen 3.107 N/A ILE 680.A N ILE 676.A O no hydrogen 3.022 N/A TRP 681.A N MET 677.A O no hydrogen 3.085 N/A TRP 681.A NE1 ALA 829.A O no hydrogen 2.980 N/A GLN 682.A N GLU 678.A O no hydrogen 2.811 N/A ASN 683.A N ASN 679.A O no hydrogen 2.960 N/A GLN 684.A N ILE 680.A O no hydrogen 3.048 N/A GLN 684.A NE2 GLN 835.A OE1 no hydrogen 3.657 N/A GLY 685.A N GLN 682.A O no hydrogen 3.148 N/A LEU 686.A N TRP 681.A O no hydrogen 2.820 N/A MET 690.A N GLU 678.A OE1 no hydrogen 2.817 N/A LEU 691.A N TYR 761.A OH no hydrogen 3.106 N/A TYR 693.A N LEU 691.A O no hydrogen 3.006 N/A GLY 694.A N GLU 706.A OE2 no hydrogen 3.091 N/A CYS 695.A SG LEU 664.A O no hydrogen 3.951 N/A CYS 695.A SG LEU 704.A O no hydrogen 4.011 N/A LEU 696.A N LEU 704.A O no hydrogen 3.043 N/A ILE 698.A N VAL 702.A O no hydrogen 3.223 N/A GLY 703.A N LYS 659.A O no hydrogen 3.014 N/A LEU 704.A N LEU 696.A O no hydrogen 2.969 N/A ILE 705.A N ILE 657.A O no hydrogen 2.999 N/A GLU 706.A N GLY 694.A O no hydrogen 2.714 N/A VAL 707.A N GLU 655.A O no hydrogen 3.307 N/A SER 711.A OG VAL 708.A O no hydrogen 2.793 N/A HIS 712.A N VAL 780.A O no hydrogen 3.062 N/A HIS 712.A NE2 ASP 782.A OD1 no hydrogen 2.973 N/A THR 713.A N GLN 716.A OE1 no hydrogen 2.806 N/A THR 713.A OG1 GLN 716.A OE1 no hydrogen 3.500 N/A ILE 714.A N ILE 778.A O no hydrogen 3.153 N/A MET 715.A N ASN 775.A O no hydrogen 3.121 N/A ILE 717.A N ILE 714.A O no hydrogen 3.212 N/A GLN 718.A N ILE 714.A O no hydrogen 3.057 N/A CYS 719.A N MET 715.A O no hydrogen 3.020 N/A CYS 719.A SG MET 715.A O no hydrogen 3.324 N/A THR 733.A N ASN 730.A O no hydrogen 3.253 N/A THR 733.A OG1 ASN 730.A O no hydrogen 2.719 N/A GLN 736.A N HIS 732.A O no hydrogen 3.270 N/A TRP 737.A N THR 733.A O no hydrogen 3.202 N/A LEU 738.A N LEU 734.A O no hydrogen 3.280 N/A LYS 739.A N HIS 735.A O no hydrogen 2.816 N/A ASP 740.A N GLN 736.A O no hydrogen 2.895 N/A LYS 741.A N TRP 737.A O no hydrogen 3.093 N/A ASN 742.A N LEU 738.A O no hydrogen 2.955 N/A ASN 742.A ND2 LEU 738.A O no hydrogen 3.165 N/A ASN 742.A ND2 ASP 782.A O no hydrogen 3.228 N/A LYS 743.A NZ ASP 740.A O no hydrogen 3.515 N/A LYS 743.A NZ ASP 740.A OD1 no hydrogen 2.807 N/A TYR 747.A OH HIS 735.A NE2 no hydrogen 2.743 N/A ALA 750.A N ILE 746.A O no hydrogen 3.244 N/A ILE 751.A N TYR 747.A O no hydrogen 3.221 N/A ASP 752.A N ASP 748.A O no hydrogen 3.424 N/A LEU 753.A N ALA 749.A O no hydrogen 2.803 N/A PHE 754.A N ALA 750.A O no hydrogen 2.957 N/A THR 755.A N ILE 751.A O no hydrogen 2.940 N/A THR 755.A OG1 ILE 751.A O no hydrogen 2.944 N/A THR 755.A OG1 ASP 752.A O no hydrogen 2.728 N/A ARG 756.A N ASP 752.A O no hydrogen 2.987 N/A ARG 756.A NE ASP 752.A OD1 no hydrogen 2.918 N/A ARG 756.A NH1 ASP 687.A O no hydrogen 3.162 N/A SER 757.A N LEU 753.A O no hydrogen 3.122 N/A SER 757.A OG LEU 753.A O no hydrogen 2.844 N/A SER 757.A OG PHE 754.A O no hydrogen 3.049 N/A CYS 758.A N PHE 754.A O no hydrogen 2.799 N/A ALA 759.A N THR 755.A O no hydrogen 2.783 N/A GLY 760.A N ARG 756.A O no hydrogen 3.031 N/A TYR 761.A N SER 757.A O no hydrogen 3.116 N/A CYS 762.A N CYS 758.A O no hydrogen 3.034 N/A CYS 762.A SG CYS 758.A O no hydrogen 3.093 N/A VAL 763.A N ALA 759.A O no hydrogen 3.341 N/A ALA 764.A N GLY 760.A O no hydrogen 2.854 N/A THR 765.A N TYR 761.A O no hydrogen 2.969 N/A THR 765.A OG1 TYR 761.A O no hydrogen 2.660 N/A THR 765.A OG1 CYS 762.A O no hydrogen 3.247 N/A PHE 766.A N CYS 762.A O no hydrogen 3.122 N/A ILE 767.A N VAL 763.A O no hydrogen 3.056 N/A LEU 768.A N ALA 764.A O no hydrogen 3.087 N/A GLY 769.A N PHE 766.A O no hydrogen 3.339 N/A ILE 770.A N THR 765.A O no hydrogen 2.907 N/A ARG 773.A NE GLY 771.A O no hydrogen 3.432 N/A ARG 773.A NH1 ILE 789.A O no hydrogen 2.922 N/A ARG 773.A NH2 ASP 790.A O no hydrogen 2.745 N/A SER 776.A N HIS 774.A ND1 no hydrogen 3.218 N/A ASN 777.A N HIS 774.A O no hydrogen 3.136 N/A ILE 778.A N HIS 774.A O no hydrogen 3.111 N/A MET 779.A N PHE 787.A O no hydrogen 2.796 N/A VAL 780.A N HIS 712.A O no hydrogen 3.008 N/A LYS 781.A N GLN 785.A O no hydrogen 2.800 N/A LYS 781.A NZ ARG 709.A O no hydrogen 2.797 N/A ASP 782.A N ASN 710.A O no hydrogen 2.976 N/A GLY 784.A N LYS 781.A O no hydrogen 2.821 N/A GLN 785.A N ASP 783.A OD1 no hydrogen 3.190 N/A GLN 785.A NE2 ARG 689.A O no hydrogen 3.600 N/A LEU 786.A N SER 757.A OG no hydrogen 2.858 N/A PHE 787.A N MET 779.A O no hydrogen 3.002 N/A ILE 789.A N ASN 777.A O no hydrogen 2.798 N/A PHE 791.A N ASP 667.A OD1 no hydrogen 3.171 N/A GLY 792.A N ASP 790.A O no hydrogen 2.848 N/A LEU 795.A N GLY 769.A O no hydrogen 3.304 N/A PHE 806.A N THR 803.A O no hydrogen 3.071 N/A LEU 807.A N THR 803.A O no hydrogen 3.443 N/A ILE 808.A N GLN 804.A O no hydrogen 2.988 N/A ILE 810.A N PHE 806.A O no hydrogen 2.932 N/A SER 811.A N LEU 807.A O no hydrogen 3.280 N/A SER 811.A OG LEU 807.A O no hydrogen 3.382 N/A SER 811.A OG THR 816.A OG1 no hydrogen 2.957 N/A THR 816.A OG1 SER 811.A OG no hydrogen 2.957 N/A PHE 819.A N THR 816.A OG1 no hydrogen 3.178 N/A GLU 820.A N THR 816.A O no hydrogen 2.996 N/A ARG 821.A N ARG 817.A O no hydrogen 2.889 N/A PHE 822.A N GLU 818.A O no hydrogen 2.822 N/A GLN 823.A N PHE 819.A O no hydrogen 2.890 N/A GLU 824.A N GLU 820.A O no hydrogen 3.203 N/A MET 825.A N ARG 821.A O no hydrogen 3.253 N/A CYS 826.A N PHE 822.A O no hydrogen 3.247 N/A CYS 826.A SG ALA 759.A O no hydrogen 4.019 N/A CYS 826.A SG PHE 822.A O no hydrogen 3.470 N/A TYR 827.A N GLN 823.A O no hydrogen 3.036 N/A LYS 828.A N GLU 824.A O no hydrogen 2.818 N/A ALA 829.A N MET 825.A O no hydrogen 2.737 N/A TYR 830.A N CYS 826.A O no hydrogen 2.979 N/A TYR 830.A OH THR 867.A O no hydrogen 2.861 N/A LEU 831.A N TYR 827.A O no hydrogen 3.118 N/A ALA 832.A N LYS 828.A O no hydrogen 3.274 N/A ALA 832.A N ALA 829.A O no hydrogen 3.286 N/A ILE 833.A N ALA 829.A O no hydrogen 3.285 N/A ARG 834.A N TYR 830.A O no hydrogen 3.134 N/A ARG 834.A NE ALA 869.A O no hydrogen 3.387 N/A ARG 834.A NH2 ALA 869.A O no hydrogen 3.421 N/A GLN 835.A N LEU 831.A O no hydrogen 3.225 N/A GLN 835.A NE2 LEU 831.A O no hydrogen 3.179 N/A HIS 836.A N ILE 833.A O no hydrogen 2.878 N/A HIS 836.A ND1 ALA 832.A O no hydrogen 2.838 N/A ALA 837.A N ARG 834.A O no hydrogen 3.333 N/A LEU 839.A N HIS 836.A O no hydrogen 2.743 N/A ILE 841.A N ALA 837.A O no hydrogen 3.166 N/A ASN 842.A N ASN 838.A O no hydrogen 3.322 N/A LEU 843.A N LEU 839.A O no hydrogen 2.948 N/A PHE 844.A N PHE 840.A O no hydrogen 2.990 N/A SER 845.A N ILE 841.A O no hydrogen 2.768 N/A SER 845.A OG ASP 460.A OD2 no hydrogen 3.386 N/A MET 846.A N ASN 842.A O no hydrogen 2.944 N/A MET 847.A N PHE 844.A O no hydrogen 3.012 N/A LEU 848.A N SER 845.A O no hydrogen 3.421 N/A GLY 849.A N TYR 498.A OH no hydrogen 2.767 N/A SER 850.A N MET 847.A O no hydrogen 3.063 N/A MET 852.A N SER 850.A O no hydrogen 2.778 N/A GLN 856.A N ASP 860.A OD1 no hydrogen 2.983 N/A GLN 856.A NE2 HIS 307.A O no hydrogen 3.681 N/A SER 857.A N ASP 860.A OD1 no hydrogen 2.811 N/A SER 857.A OG ASP 859.A OD2 no hydrogen 3.264 N/A SER 857.A OG ASP 860.A OD1 no hydrogen 2.997 N/A ASP 860.A N SER 857.A O no hydrogen 3.131 N/A TYR 863.A N ASP 860.A O no hydrogen 3.424 N/A ILE 864.A N ILE 861.A O no hydrogen 3.125 N/A ARG 865.A N ALA 862.A O no hydrogen 2.941 N/A ARG 865.A NE ASP 395.A OD1 no hydrogen 2.838 N/A ARG 865.A NE ASP 395.A OD2 no hydrogen 3.348 N/A ARG 865.A NH1 ASP 871.A OD1 no hydrogen 3.474 N/A ARG 865.A NH1 ASP 871.A OD2 no hydrogen 3.456 N/A ARG 865.A NH2 ASP 395.A OD2 no hydrogen 2.764 N/A ARG 865.A NH2 ASP 871.A OD2 no hydrogen 3.271 N/A THR 867.A N TYR 863.A O no hydrogen 3.099 N/A THR 867.A OG1 ILE 767.A O no hydrogen 2.721 N/A THR 867.A OG1 TYR 863.A O no hydrogen 3.283 N/A THR 867.A OG1 ILE 864.A O no hydrogen 3.428 N/A LEU 868.A N ILE 864.A O no hydrogen 2.891 N/A LEU 870.A N ARG 865.A O no hydrogen 3.415 N/A THR 873.A N GLU 876.A OE1 no hydrogen 3.114 N/A THR 873.A OG1 GLU 876.A OE1 no hydrogen 2.747 N/A GLN 875.A NE2 GLU 879.A OE2 no hydrogen 3.245 N/A ALA 877.A N THR 873.A O no hydrogen 3.014 N/A TYR 880.A N GLU 876.A O no hydrogen 3.249 N/A PHE 881.A N ALA 877.A O no hydrogen 2.819 N/A MET 882.A N LEU 878.A O no hydrogen 2.809 N/A LYS 883.A N GLU 879.A O no hydrogen 3.157 N/A GLN 884.A N TYR 880.A O no hydrogen 3.181 N/A GLN 884.A NE2 TYR 880.A OH no hydrogen 3.029 N/A MET 885.A N PHE 881.A O no hydrogen 2.949 N/A ASN 886.A N MET 882.A O no hydrogen 2.766 N/A