Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2b76_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N LEU 181.A O no hydrogen 3.338 N/A PHE 4.A N GLN 183.A O no hydrogen 3.278 N/A ASP 7.A N LYS 32.A O no hydrogen 2.913 N/A ALA 9.A N ALA 188.A O no hydrogen 3.203 N/A ILE 10.A N ALA 34.A O no hydrogen 2.750 N/A VAL 11.A N VAL 190.A O no hydrogen 2.981 N/A GLY 12.A N ILE 36.A O no hydrogen 2.782 N/A LEU 18.A N GLY 15.A O no hydrogen 3.221 N/A ARG 19.A N GLY 15.A O no hydrogen 2.872 N/A ARG 19.A NE ARG 19.A O no hydrogen 3.190 N/A ALA 20.A N ALA 16.A O no hydrogen 2.549 N/A ALA 21.A N GLY 17.A O no hydrogen 3.320 N/A ILE 22.A N LEU 18.A O no hydrogen 3.366 N/A ALA 23.A N ARG 19.A O no hydrogen 3.186 N/A ALA 24.A N ALA 20.A O no hydrogen 3.062 N/A ALA 25.A N ALA 21.A O no hydrogen 2.939 N/A ALA 25.A N ILE 22.A O no hydrogen 2.994 N/A GLN 26.A N ALA 23.A O no hydrogen 2.841 N/A ALA 27.A N ALA 23.A O no hydrogen 2.974 N/A ALA 31.A N ASN 28.A O no hydrogen 2.886 N/A LYS 32.A N ASP 7.A OD2 no hydrogen 3.461 N/A LYS 32.A NZ GLN 151.A OE1 no hydrogen 3.363 N/A ILE 33.A N GLN 149.A O no hydrogen 2.804 N/A ALA 34.A N LEU 8.A O no hydrogen 2.960 N/A LEU 35.A N GLN 151.A O no hydrogen 3.296 N/A ILE 36.A N ILE 10.A O no hydrogen 2.953 N/A SER 37.A N PHE 153.A O no hydrogen 3.164 N/A SER 37.A OG VAL 39.A O no hydrogen 2.554 N/A LYS 38.A NZ ILE 208.A O no hydrogen 3.347 N/A LYS 38.A NZ ASP 212.A OD1 no hydrogen 2.986 N/A LYS 38.A NZ GLU 508.A OE2 no hydrogen 2.729 N/A VAL 39.A N SER 37.A OG no hydrogen 3.120 N/A TYR 40.A OH GLU 155.A OE2 no hydrogen 3.419 N/A ARG 43.A N TYR 40.A O no hydrogen 3.184 N/A SER 44.A N PRO 41.A O no hydrogen 3.125 N/A SER 44.A OG PRO 41.A O no hydrogen 2.685 N/A VAL 47.A N SER 44.A O no hydrogen 3.142 N/A ALA 48.A N HIS 45.A O no hydrogen 2.809 N/A GLN 50.A NE2 ALA 48.A O no hydrogen 3.107 N/A SER 53.A N TRP 126.A O no hydrogen 3.002 N/A ALA 54.A N SER 394.A O no hydrogen 2.913 N/A ALA 55.A N ARG 124.A O no hydrogen 2.711 N/A GLN 58.A NE2 GLU 123.A O no hydrogen 2.836 N/A ASP 61.A N GLN 58.A O no hydrogen 2.551 N/A SER 62.A N ASP 61.A OD1 no hydrogen 2.686 N/A GLU 64.A N SER 62.A OG no hydrogen 2.924 N/A HIS 66.A N SER 62.A O no hydrogen 3.016 N/A PHE 67.A N GLU 64.A O no hydrogen 2.784 N/A HIS 68.A N GLU 64.A O no hydrogen 3.060 N/A ASP 69.A N TYR 65.A O no hydrogen 3.007 N/A THR 70.A OG1 HIS 66.A O no hydrogen 3.250 N/A VAL 71.A N PHE 67.A O no hydrogen 3.093 N/A ALA 72.A N HIS 68.A O no hydrogen 3.108 N/A GLY 73.A N ASP 69.A O no hydrogen 2.849 N/A GLY 74.A N THR 70.A O no hydrogen 3.181 N/A ASP 75.A N ALA 72.A O no hydrogen 2.602 N/A TRP 76.A N VAL 71.A O no hydrogen 3.168 N/A TRP 76.A NE1 LEU 574.A O no hydrogen 2.530 N/A CYS 78.A SG THR 70.A O no hydrogen 3.926 N/A CYS 78.A SG LEU 386.A O no hydrogen 3.415 N/A GLU 79.A N GLY 385.A O no hydrogen 3.271 N/A GLN 80.A N LYS 570.A O no hydrogen 3.011 N/A GLN 80.A NE2 LEU 574.A O no hydrogen 3.624 N/A VAL 82.A N ASP 81.A OD2 no hydrogen 2.615 N/A VAL 83.A N GLU 79.A O no hydrogen 3.207 N/A ASP 84.A N GLN 80.A O no hydrogen 2.777 N/A TYR 85.A N ASP 81.A O no hydrogen 3.262 N/A PHE 86.A N VAL 82.A O no hydrogen 3.060 N/A VAL 87.A N VAL 83.A O no hydrogen 2.861 N/A HIS 88.A N ASP 84.A O no hydrogen 2.943 N/A HIS 88.A ND1 ASP 84.A O no hydrogen 3.025 N/A HIS 89.A N TYR 85.A O no hydrogen 3.115 N/A HIS 89.A N PHE 86.A O no hydrogen 3.204 N/A HIS 89.A ND1 TYR 85.A O no hydrogen 2.701 N/A CYS 90.A N VAL 87.A O no hydrogen 3.341 N/A CYS 90.A SG PHE 86.A O no hydrogen 3.303 N/A GLU 93.A N HIS 89.A O no hydrogen 3.321 N/A MET 94.A N CYS 90.A O no hydrogen 2.773 N/A THR 95.A N PRO 91.A O no hydrogen 3.305 N/A THR 95.A OG1 PRO 91.A O no hydrogen 2.660 N/A GLN 96.A N THR 92.A O no hydrogen 3.082 N/A LEU 97.A N GLU 93.A O no hydrogen 3.151 N/A GLU 98.A N MET 94.A O no hydrogen 2.883 N/A LEU 99.A N THR 95.A O no hydrogen 2.552 N/A TRP 100.A N GLN 96.A O no hydrogen 3.134 N/A GLY 101.A N GLU 98.A O no hydrogen 3.159 N/A CYS 102.A N LEU 97.A O no hydrogen 3.026 N/A CYS 102.A SG HIS 135.A O no hydrogen 3.602 N/A TRP 104.A N CYS 102.A O no hydrogen 2.946 N/A SER 105.A N PHE 127.A O no hydrogen 2.727 N/A SER 105.A OG PHE 127.A O no hydrogen 2.643 N/A ARG 106.A NH2 GLU 98.A OE1 no hydrogen 2.517 N/A ARG 107.A N SER 111.A O no hydrogen 2.831 N/A ARG 107.A NE ASN 113.A OD1 no hydrogen 3.443 N/A GLY 110.A N ARG 107.A O no hydrogen 2.702 N/A SER 111.A N ASP 109.A OD2 no hydrogen 2.764 N/A SER 111.A OG ASP 109.A OD2 no hydrogen 2.739 N/A ASN 113.A ND2 ARG 106.A O no hydrogen 3.590 N/A ARG 115.A N THR 125.A O no hydrogen 2.924 N/A MET 120.A N PHE 117.A O no hydrogen 3.410 N/A GLU 123.A N GLU 123.A OE2 no hydrogen 2.351 N/A ARG 124.A NE ASP 61.A OD1 no hydrogen 3.237 N/A ARG 124.A NE ASP 61.A OD2 no hydrogen 3.041 N/A ARG 124.A NH1 ASP 69.A OD2 no hydrogen 3.062 N/A ARG 124.A NH2 ASP 61.A OD1 no hydrogen 3.240 N/A ARG 124.A NH2 ASP 69.A OD2 no hydrogen 3.201 N/A THR 125.A N ARG 115.A O no hydrogen 3.416 N/A THR 125.A OG1 SER 394.A OG no hydrogen 2.928 N/A TRP 126.A N SER 53.A O no hydrogen 2.798 N/A TRP 126.A NE1 ALA 55.A O no hydrogen 2.652 N/A ALA 128.A N THR 132.A OG1 no hydrogen 3.009 N/A ALA 129.A N SER 105.A OG no hydrogen 2.666 N/A LYS 131.A N ALA 128.A O no hydrogen 3.042 N/A THR 132.A OG1 GLN 50.A O no hydrogen 3.329 N/A GLY 133.A N ALA 49.A O no hydrogen 2.799 N/A PHE 134.A N LYS 131.A O no hydrogen 2.921 N/A HIS 135.A N LYS 131.A O no hydrogen 3.130 N/A MET 136.A N THR 132.A O no hydrogen 3.107 N/A MET 136.A N GLY 133.A O no hydrogen 3.335 N/A LEU 137.A N GLY 133.A O no hydrogen 3.156 N/A LEU 137.A N PHE 134.A O no hydrogen 3.148 N/A HIS 138.A N PHE 134.A O no hydrogen 2.998 N/A THR 139.A N HIS 135.A O no hydrogen 2.886 N/A LEU 140.A N MET 136.A O no hydrogen 2.823 N/A PHE 141.A N LEU 137.A O no hydrogen 2.954 N/A GLN 142.A N HIS 138.A O no hydrogen 3.289 N/A THR 143.A N THR 139.A O no hydrogen 3.395 N/A THR 143.A OG1 THR 139.A O no hydrogen 2.730 N/A SER 144.A N LEU 140.A O no hydrogen 3.068 N/A SER 144.A OG LEU 140.A O no hydrogen 2.724 N/A SER 144.A OG PHE 141.A O no hydrogen 2.396 N/A LEU 145.A N GLN 142.A O no hydrogen 2.687 N/A GLN 146.A NE2 THR 143.A O no hydrogen 3.490 N/A PHE 147.A N SER 144.A O no hydrogen 3.272 N/A GLN 149.A N GLN 149.A OE1 no hydrogen 2.581 N/A ILE 150.A N PHE 147.A O no hydrogen 3.480 N/A GLN 151.A N ILE 33.A O no hydrogen 2.796 N/A ARG 152.A NH1 ASP 154.A OD1 no hydrogen 3.514 N/A PHE 153.A N LEU 35.A O no hydrogen 2.776 N/A HIS 156.A N SER 37.A O no hydrogen 2.736 N/A LEU 159.A N VAL 172.A O no hydrogen 2.958 N/A LEU 162.A N GLY 170.A O no hydrogen 2.590 N/A VAL 163.A N GLN 429.A OE1 no hydrogen 2.635 N/A ASP 164.A N HIS 167.A O no hydrogen 2.686 N/A HIS 167.A N ASP 164.A O no hydrogen 3.165 N/A HIS 167.A ND1 VAL 168.A O no hydrogen 2.569 N/A ARG 169.A N LEU 162.A O no hydrogen 3.071 N/A ARG 169.A NH1 ASN 187.A OD1 no hydrogen 3.212 N/A ARG 169.A NH1 GLY 419.A O no hydrogen 3.171 N/A LEU 171.A N ILE 184.A O no hydrogen 2.758 N/A VAL 172.A N ASP 160.A O no hydrogen 2.734 N/A ALA 173.A N VAL 182.A O no hydrogen 2.928 N/A MET 174.A N PHE 157.A O no hydrogen 2.859 N/A ASN 175.A N THR 180.A O no hydrogen 2.749 N/A MET 176.A N GLU 155.A O no hydrogen 3.065 N/A GLU 178.A N ASN 175.A OD1 no hydrogen 2.708 N/A GLY 179.A N ASN 175.A O no hydrogen 2.749 N/A GLN 183.A N GLN 2.A O no hydrogen 3.050 N/A GLN 183.A NE2 THR 3.A OG1 no hydrogen 2.474 N/A ILE 184.A N LEU 171.A O no hydrogen 2.793 N/A ARG 185.A N PHE 4.A O no hydrogen 2.715 N/A ALA 186.A N ARG 169.A O no hydrogen 3.300 N/A VAL 189.A N GLY 374.A O no hydrogen 3.014 N/A VAL 190.A N ALA 9.A O no hydrogen 3.140 N/A MET 191.A N PHE 376.A O no hydrogen 2.498 N/A ALA 192.A N VAL 11.A O no hydrogen 2.727 N/A THR 193.A OG1 GLY 194.A O no hydrogen 3.500 N/A VAL 199.A N ALA 196.A O no hydrogen 3.346 N/A TYR 200.A N GLY 197.A O no hydrogen 3.123 N/A TYR 200.A OH CYS 464.A O no hydrogen 2.568 N/A ARG 201.A N GLY 457.A O no hydrogen 2.860 N/A TYR 202.A N GLU 461.A OE2 no hydrogen 3.055 N/A THR 204.A N ALA 355.A O no hydrogen 3.026 N/A THR 204.A OG1 ALA 355.A O no hydrogen 3.198 N/A THR 204.A OG1 HIS 356.A ND1 no hydrogen 3.098 N/A ASN 205.A N ASN 203.A OD1 no hydrogen 3.100 N/A ASN 205.A ND2 HIS 45.A NE2 no hydrogen 3.673 N/A ASN 205.A ND2 HIS 356.A O no hydrogen 3.369 N/A VAL 209.A N GLY 206.A O no hydrogen 3.123 N/A THR 210.A OG1 ASP 212.A OD2 no hydrogen 3.082 N/A GLY 215.A N GLY 211.A O no hydrogen 2.897 N/A MET 216.A N ASP 212.A O no hydrogen 3.216 N/A ALA 217.A N GLY 213.A O no hydrogen 3.053 N/A ALA 217.A N MET 214.A O no hydrogen 3.101 N/A LEU 218.A N MET 214.A O no hydrogen 3.179 N/A SER 219.A N GLY 215.A O no hydrogen 3.244 N/A SER 219.A OG GLY 215.A O no hydrogen 2.920 N/A SER 219.A OG MET 216.A O no hydrogen 2.617 N/A HIS 220.A N ALA 217.A O no hydrogen 3.142 N/A HIS 220.A NE2 ASP 160.A OD1 no hydrogen 2.907 N/A VAL 222.A N ALA 217.A O no hydrogen 3.204 N/A LEU 224.A N ALA 554.A O no hydrogen 3.011 N/A ARG 225.A N GLY 361.A O no hydrogen 2.578 N/A ARG 225.A NE SER 383.A O no hydrogen 3.298 N/A ARG 225.A NE SER 383.A OG no hydrogen 3.073 N/A ARG 225.A NH2 SER 383.A O no hydrogen 2.687 N/A ASP 226.A N THR 552.A O no hydrogen 3.093 N/A GLU 228.A N GLU 228.A OE2 no hydrogen 2.579 N/A PHE 229.A N ASP 226.A O no hydrogen 3.403 N/A GLN 231.A N TYR 357.A O no hydrogen 2.908 N/A GLN 231.A NE2 ASN 390.A OD1 no hydrogen 2.812 N/A GLN 231.A NE2 ARG 391.A O no hydrogen 3.444 N/A HIS 233.A N THR 354.A O no hydrogen 2.574 N/A THR 235.A OG1 MET 244.A O no hydrogen 3.403 N/A GLY 236.A N ARG 352.A O no hydrogen 2.470 N/A LEU 237.A N ILE 242.A O no hydrogen 3.178 N/A SER 240.A N PRO 238.A O no hydrogen 2.898 N/A ILE 242.A N SER 240.A OG no hydrogen 2.768 N/A MET 244.A N THR 235.A O no hydrogen 3.121 N/A GLY 247.A N THR 245.A OG1 no hydrogen 2.916 N/A CYS 248.A N THR 245.A O no hydrogen 3.115 N/A CYS 248.A SG THR 245.A O no hydrogen 3.531 N/A GLY 250.A N GLU 246.A O no hydrogen 3.073 N/A GLU 251.A N CYS 248.A O no hydrogen 2.972 N/A GLY 252.A N ARG 249.A O no hydrogen 3.060 N/A GLY 253.A N CYS 248.A O no hydrogen 2.929 N/A GLY 253.A N ARG 249.A O no hydrogen 3.015 N/A ILE 254.A N ASP 316.A O no hydrogen 2.478 N/A LEU 255.A N GLU 284.A OE2 no hydrogen 2.667 N/A VAL 256.A N TYR 314.A O no hydrogen 2.714 N/A LYS 258.A N ASN 303.A O no hydrogen 3.152 N/A LYS 258.A NZ ASN 303.A OD1 no hydrogen 3.199 N/A GLY 260.A N ASN 257.A O no hydrogen 2.633 N/A TYR 261.A OH ASP 266.A OD1 no hydrogen 2.571 N/A ARG 262.A NH1 GLU 284.A OE1 no hydrogen 2.509 N/A ARG 262.A NH2 THR 273.A OG1 no hydrogen 3.076 N/A GLN 265.A NE2 ARG 262.A O no hydrogen 2.310 N/A TYR 267.A OH GLU 298.A OE1 no hydrogen 3.131 N/A LYS 281.A NZ GLY 119.A O no hydrogen 2.136 N/A MET 283.A N MET 269.A O no hydrogen 3.277 N/A LEU 285.A N TYR 282.A O no hydrogen 2.808 N/A GLY 286.A N MET 283.A O no hydrogen 3.153 N/A ARG 288.A NH2 GLN 231.A OE1 no hydrogen 2.655 N/A ASP 289.A N ASP 289.A OD2 no hydrogen 1.979 N/A LYS 290.A N ASP 289.A OD2 no hydrogen 3.300 N/A VAL 291.A N PRO 287.A O no hydrogen 3.347 N/A VAL 291.A N ARG 288.A O no hydrogen 2.771 N/A SER 292.A N ASP 289.A O no hydrogen 3.178 N/A SER 292.A OG ARG 288.A O no hydrogen 3.544 N/A GLN 293.A N ASP 289.A O no hydrogen 2.463 N/A ALA 294.A N LYS 290.A O no hydrogen 2.571 N/A PHE 295.A N SER 292.A O no hydrogen 2.900 N/A TRP 296.A N SER 292.A O no hydrogen 3.435 N/A HIS 297.A N GLN 293.A O no hydrogen 2.913 N/A GLU 298.A N ALA 294.A O no hydrogen 2.717 N/A TRP 299.A N PHE 295.A O no hydrogen 2.227 N/A ARG 300.A N TRP 296.A O no hydrogen 2.619 N/A LYS 301.A N HIS 297.A O no hydrogen 3.287 N/A LYS 301.A NZ TYR 267.A OH no hydrogen 2.677 N/A GLY 302.A N TRP 299.A O no hydrogen 3.079 N/A ASN 303.A N GLU 298.A O no hydrogen 3.377 N/A THR 304.A OG1 ASP 311.A OD1 no hydrogen 2.723 N/A ILE 305.A N VAL 312.A O no hydrogen 2.709 N/A SER 306.A OG THR 307.A O no hydrogen 3.386 N/A THR 307.A N GLY 310.A O no hydrogen 3.337 N/A THR 307.A OG1 GLY 310.A O no hydrogen 2.819 N/A ARG 309.A N THR 307.A OG1 no hydrogen 2.872 N/A ARG 309.A NH1 VAL 340.A O no hydrogen 3.443 N/A GLY 310.A N THR 307.A O no hydrogen 3.104 N/A VAL 313.A N VAL 351.A O no hydrogen 3.231 N/A TYR 314.A N VAL 256.A O no hydrogen 3.107 N/A LEU 315.A N ILE 349.A O no hydrogen 3.192 N/A ASP 316.A N ILE 254.A O no hydrogen 2.672 N/A HIS 319.A ND1 ASP 316.A OD2 no hydrogen 2.984 N/A LEU 320.A N LEU 317.A O no hydrogen 2.782 N/A GLU 322.A N GLU 322.A OE1 no hydrogen 1.502 N/A LYS 324.A NZ GLU 251.A O no hydrogen 3.568 N/A LEU 325.A N GLU 322.A O no hydrogen 2.266 N/A LEU 329.A N LEU 325.A O no hydrogen 2.194 N/A LEU 335.A N PHE 331.A O no hydrogen 2.636 N/A ALA 336.A N ILE 332.A O no hydrogen 2.792 N/A LYS 337.A N CYS 333.A O no hydrogen 3.221 N/A ALA 338.A N GLU 334.A O no hydrogen 3.082 N/A TYR 339.A N LEU 335.A O no hydrogen 3.045 N/A VAL 340.A N ALA 336.A O no hydrogen 3.319 N/A VAL 342.A N ALA 336.A O no hydrogen 3.127 N/A LYS 346.A N ASP 343.A O no hydrogen 3.210 N/A VAL 351.A N VAL 313.A O no hydrogen 3.207 N/A ARG 352.A N GLY 236.A O no hydrogen 2.863 N/A THR 354.A N HIS 233.A O no hydrogen 2.960 N/A ALA 355.A N TYR 202.A O no hydrogen 3.388 N/A HIS 356.A N GLN 231.A O no hydrogen 2.860 N/A TYR 357.A N GLN 231.A O no hydrogen 2.838 N/A THR 358.A N GLU 380.A OE1 no hydrogen 2.883 N/A GLY 361.A N ARG 225.A O no hydrogen 2.928 N/A ILE 362.A N CYS 381.A O no hydrogen 3.402 N/A GLU 363.A N PRO 223.A O no hydrogen 3.174 N/A ASP 365.A N GLU 369.A O no hydrogen 3.218 N/A GLN 366.A N GLN 366.A OE1 no hydrogen 2.784 N/A GLN 366.A NE2 ASP 81.A OD1 no hydrogen 2.706 N/A ASN 367.A N ASP 365.A OD1 no hydrogen 2.631 N/A CYS 368.A N ASP 365.A O no hydrogen 3.347 N/A CYS 368.A SG PHE 403.A O no hydrogen 3.652 N/A GLU 369.A N ASP 365.A OD1 no hydrogen 2.920 N/A THR 370.A N LEU 375.A O no hydrogen 2.719 N/A THR 370.A OG1 ILE 372.A O no hydrogen 2.960 N/A THR 370.A OG1 LEU 375.A O no hydrogen 3.037 N/A ILE 372.A N THR 370.A OG1 no hydrogen 2.903 N/A GLY 374.A N GLU 369.A OE2 no hydrogen 3.434 N/A LEU 375.A N ILE 372.A O no hydrogen 2.819 N/A PHE 376.A N VAL 189.A O no hydrogen 2.867 N/A ALA 377.A N CYS 368.A O no hydrogen 2.987 N/A VAL 378.A N MET 191.A O no hydrogen 2.835 N/A CYS 381.A SG MET 191.A O no hydrogen 3.251 N/A CYS 381.A SG VAL 378.A O no hydrogen 3.470 N/A SER 382.A N GLY 379.A O no hydrogen 2.708 N/A SER 382.A OG ALA 377.A O no hydrogen 3.299 N/A SER 382.A OG GLY 379.A O no hydrogen 2.704 N/A SER 383.A N ILE 362.A O no hydrogen 2.945 N/A SER 383.A OG ARG 225.A O no hydrogen 3.562 N/A HIS 387.A NE2 GLU 399.A OE1 no hydrogen 2.632 N/A ASN 390.A N HIS 387.A O no hydrogen 3.037 N/A ASN 390.A ND2 ASP 289.A OD1 no hydrogen 3.126 N/A SER 394.A OG THR 125.A OG1 no hydrogen 2.928 N/A SER 394.A OG GLY 393.A O no hydrogen 2.400 N/A ASN 395.A N LEU 392.A O no hydrogen 2.987 N/A ASN 395.A ND2 THR 70.A OG1 no hydrogen 3.356 N/A GLU 399.A N ASN 395.A O no hydrogen 2.999 N/A LEU 400.A N SER 396.A O no hydrogen 3.487 N/A VAL 401.A N LEU 397.A O no hydrogen 3.382 N/A VAL 402.A N ALA 398.A O no hydrogen 2.939 N/A PHE 403.A N GLU 399.A O no hydrogen 2.610 N/A GLY 404.A N LEU 400.A O no hydrogen 2.989 N/A ALA 407.A N PHE 403.A O no hydrogen 2.800 N/A GLY 408.A N GLY 404.A O no hydrogen 2.935 N/A GLU 409.A N ARG 405.A O no hydrogen 2.754 N/A GLN 410.A N LEU 406.A O no hydrogen 3.014 N/A ALA 411.A N ALA 407.A O no hydrogen 2.959 N/A THR 412.A N GLY 408.A O no hydrogen 3.054 N/A THR 412.A OG1 GLY 408.A O no hydrogen 3.381 N/A GLU 413.A N GLU 409.A O no hydrogen 3.120 N/A ARG 414.A N GLN 410.A O no hydrogen 3.045 N/A ARG 414.A NE GLU 369.A OE2 no hydrogen 2.549 N/A ALA 415.A N ALA 411.A O no hydrogen 3.174 N/A ALA 416.A N GLU 413.A O no hydrogen 2.819 N/A THR 417.A N ARG 414.A O no hydrogen 2.801 N/A ALA 425.A N ASN 422.A OD1 no hydrogen 3.271 N/A ILE 426.A N ASN 422.A O no hydrogen 3.504 N/A ALA 428.A N ALA 424.A O no hydrogen 3.263 N/A GLN 429.A N ILE 426.A O no hydrogen 2.535 N/A GLN 429.A NE2 VAL 163.A O no hydrogen 2.517 N/A ALA 430.A N ILE 426.A O no hydrogen 2.852 N/A ALA 431.A N GLU 427.A O no hydrogen 2.688 N/A GLY 432.A N ALA 428.A O no hydrogen 3.172 N/A VAL 433.A N GLN 429.A O no hydrogen 3.013 N/A GLU 434.A N ALA 430.A O no hydrogen 3.187 N/A GLU 434.A N ALA 431.A O no hydrogen 2.937 N/A GLN 435.A N ALA 431.A O no hydrogen 3.445 N/A ARG 436.A N GLY 432.A O no hydrogen 2.828 N/A LEU 437.A N VAL 433.A O no hydrogen 3.195 N/A LYS 438.A N GLU 434.A O no hydrogen 2.903 N/A ASP 439.A N GLN 435.A O no hydrogen 3.058 N/A LEU 440.A N ARG 436.A O no hydrogen 3.405 N/A LEU 440.A N LEU 437.A O no hydrogen 2.975 N/A VAL 441.A N LEU 437.A O no hydrogen 3.265 N/A ASN 442.A N LYS 438.A O no hydrogen 3.336 N/A GLN 443.A N LEU 440.A O no hydrogen 2.693 N/A GLN 443.A NE2 ASP 439.A O no hydrogen 3.546 N/A ALA 450.A N ASN 448.A OD1 no hydrogen 3.042 N/A LYS 451.A N ASN 448.A O no hydrogen 3.058 N/A LYS 451.A NZ ASP 454.A OD2 no hydrogen 3.251 N/A ARG 453.A N TRP 449.A O no hydrogen 2.842 N/A ARG 453.A NH2 ALA 450.A O no hydrogen 3.210 N/A ASP 454.A N ALA 450.A O no hydrogen 3.043 N/A GLU 455.A N LYS 451.A O no hydrogen 2.504 N/A MET 456.A N ILE 452.A O no hydrogen 2.790 N/A GLY 457.A N ARG 453.A O no hydrogen 3.383 N/A LEU 458.A N ASP 454.A O no hydrogen 3.299 N/A LEU 458.A N GLU 455.A O no hydrogen 3.246 N/A ALA 459.A N GLU 455.A O no hydrogen 3.274 N/A MET 460.A N MET 456.A O no hydrogen 2.990 N/A GLU 461.A N GLY 457.A O no hydrogen 3.375 N/A GLU 462.A N LEU 458.A O no hydrogen 3.041 N/A GLY 463.A N ALA 459.A O no hydrogen 3.275 N/A CYS 464.A N MET 460.A O no hydrogen 2.982 N/A ARG 468.A N GLN 534.A O no hydrogen 2.662 N/A ARG 468.A NE GLY 465.A O no hydrogen 2.696 N/A ARG 468.A NH1 GLU 228.A O no hydrogen 3.094 N/A ARG 468.A NH2 GLU 228.A O no hydrogen 3.437 N/A LEU 472.A N THR 469.A O no hydrogen 3.124 N/A MET 473.A N THR 469.A O no hydrogen 3.032 N/A GLN 474.A N PRO 470.A O no hydrogen 3.162 N/A GLN 474.A NE2 GLN 474.A O no hydrogen 2.833 N/A GLN 474.A NE2 ASP 478.A OD2 no hydrogen 3.078 N/A LYS 475.A N LEU 472.A O no hydrogen 2.771 N/A LYS 475.A NZ GLU 462.A OE1 no hydrogen 2.786 N/A LYS 475.A NZ GLU 462.A OE2 no hydrogen 2.898 N/A THR 476.A N LEU 472.A O no hydrogen 3.204 N/A THR 476.A N MET 473.A O no hydrogen 2.815 N/A THR 476.A OG1 ALA 459.A O no hydrogen 2.913 N/A ILE 477.A N MET 473.A O no hydrogen 2.828 N/A ASP 478.A N GLN 474.A O no hydrogen 2.976 N/A LYS 479.A N LYS 475.A O no hydrogen 2.637 N/A LYS 479.A NZ GLU 455.A OE1 no hydrogen 3.497 N/A LEU 480.A N THR 476.A O no hydrogen 3.113 N/A ALA 481.A N ILE 477.A O no hydrogen 2.764 N/A GLU 482.A N ASP 478.A O no hydrogen 3.262 N/A GLU 482.A N LYS 479.A O no hydrogen 2.611 N/A LEU 483.A N LYS 479.A O no hydrogen 2.946 N/A GLN 484.A N LEU 480.A O no hydrogen 2.707 N/A GLN 484.A NE2 LEU 513.A O no hydrogen 3.079 N/A GLN 484.A NE2 ASN 514.A OD1 no hydrogen 3.143 N/A GLU 485.A N GLU 482.A O no hydrogen 2.891 N/A ARG 486.A N GLU 482.A O no hydrogen 2.931 N/A ARG 486.A NH1 GLU 455.A OE2 no hydrogen 2.823 N/A ARG 486.A NH2 GLU 455.A OE1 no hydrogen 3.048 N/A ARG 486.A NH2 GLU 482.A OE2 no hydrogen 3.122 N/A LYS 488.A N GLU 485.A O no hydrogen 3.124 N/A ARG 489.A N ARG 486.A O no hydrogen 3.077 N/A SER 496.A N ASP 494.A OD1 no hydrogen 3.391 N/A SER 496.A OG ASP 494.A OD1 no hydrogen 2.587 N/A SER 496.A OG ASP 494.A OD2 no hydrogen 2.694 N/A PHE 499.A N MET 176.A O no hydrogen 2.914 N/A ASN 500.A ND2 ASP 494.A O no hydrogen 2.787 N/A ASN 500.A ND2 SER 496.A O no hydrogen 2.799 N/A ASN 500.A ND2 SER 496.A OG no hydrogen 2.838 N/A LEU 503.A N ASN 500.A OD1 no hydrogen 2.948 N/A TYR 505.A N THR 501.A O no hydrogen 2.833 N/A THR 506.A N ASP 502.A O no hydrogen 3.478 N/A THR 506.A OG1 ASP 502.A O no hydrogen 3.078 N/A ILE 507.A N LEU 503.A O no hydrogen 3.091 N/A GLU 508.A N LEU 504.A O no hydrogen 3.153 N/A LEU 509.A N TYR 505.A O no hydrogen 3.090 N/A LEU 509.A N THR 506.A O no hydrogen 2.795 N/A GLY 510.A N THR 506.A O no hydrogen 2.818 N/A HIS 511.A N ILE 507.A O no hydrogen 3.026 N/A GLY 512.A N GLU 508.A O no hydrogen 3.454 N/A LEU 513.A N LEU 509.A O no hydrogen 2.831 N/A ASN 514.A N GLY 510.A O no hydrogen 3.131 N/A ASN 514.A ND2 HIS 511.A O no hydrogen 3.637 N/A VAL 515.A N HIS 511.A O no hydrogen 2.998 N/A ALA 516.A N GLY 512.A O no hydrogen 2.807 N/A CYS 518.A N ASN 514.A O no hydrogen 3.345 N/A MET 519.A N VAL 515.A O no hydrogen 2.850 N/A MET 519.A N ALA 516.A O no hydrogen 2.744 N/A ALA 520.A N ALA 516.A O no hydrogen 2.950 N/A HIS 521.A N GLU 517.A O no hydrogen 3.111 N/A SER 522.A OG CYS 518.A O no hydrogen 2.859 N/A ALA 523.A N MET 519.A O no hydrogen 3.082 N/A MET 524.A N ALA 520.A O no hydrogen 2.943 N/A ALA 525.A N HIS 521.A O no hydrogen 3.254 N/A ALA 525.A N SER 522.A O no hydrogen 3.409 N/A ARG 526.A N ALA 523.A O no hydrogen 2.817 N/A ARG 526.A NE GLU 228.A OE1 no hydrogen 2.486 N/A ARG 526.A NE THR 552.A OG1 no hydrogen 3.318 N/A ARG 526.A NH1 PHE 548.A O no hydrogen 2.928 N/A ARG 526.A NH2 LYS 550.A O no hydrogen 2.597 N/A ARG 526.A NH2 THR 552.A OG1 no hydrogen 2.946 N/A LYS 527.A N ALA 525.A O no hydrogen 2.716 N/A LYS 527.A NZ MET 524.A O no hydrogen 2.222 N/A GLU 528.A N ARG 526.A O no hydrogen 2.422 N/A SER 529.A N GLU 542.A O no hydrogen 3.048 N/A SER 529.A OG CYS 540.A O no hydrogen 3.356 N/A ARG 530.A N HIS 533.A O no hydrogen 2.715 N/A ARG 530.A NE ASP 75.A O no hydrogen 3.334 N/A ARG 530.A NH1 ASP 544.A O no hydrogen 2.906 N/A GLY 531.A N ASP 75.A OD2 no hydrogen 3.395 N/A ALA 532.A N ALA 389.A O no hydrogen 3.059 N/A HIS 533.A N ARG 530.A O no hydrogen 2.604 N/A HIS 533.A NE2 ARG 526.A O no hydrogen 3.125 N/A GLN 534.A NE2 GLY 531.A O no hydrogen 3.193 N/A ARG 535.A N SER 529.A OG no hydrogen 2.786 N/A ARG 535.A NE ASP 537.A OD1 no hydrogen 3.178 N/A ARG 535.A NH1 MET 524.A O no hydrogen 3.075 N/A ARG 535.A NH2 ASP 537.A OD2 no hydrogen 2.620 N/A LEU 536.A N ARG 468.A O no hydrogen 3.176 N/A CYS 540.A N ASP 537.A O no hydrogen 2.688 N/A CYS 540.A SG ASP 537.A O no hydrogen 3.471 N/A CYS 540.A SG ASP 537.A OD2 no hydrogen 3.257 N/A THR 541.A OG1 GLU 542.A OE1 no hydrogen 3.364 N/A THR 541.A OG1 GLU 542.A OE2 no hydrogen 3.415 N/A ARG 543.A NE ASP 545.A OD2 no hydrogen 2.003 N/A ASN 547.A N ASP 544.A OD1 no hydrogen 2.407 N/A PHE 548.A N ASP 544.A OD1 no hydrogen 2.775 N/A LYS 550.A N PHE 548.A O no hydrogen 2.949 N/A HIS 551.A N SER 567.A O no hydrogen 2.579 N/A HIS 551.A ND1 ASP 226.A OD1 no hydrogen 3.066 N/A HIS 551.A ND1 ASP 226.A OD2 no hydrogen 2.978 N/A HIS 551.A NE2 GLU 79.A OE2 no hydrogen 3.122 N/A THR 552.A N ASP 226.A OD1 no hydrogen 3.291 N/A THR 552.A OG1 GLU 228.A OE1 no hydrogen 2.712 N/A THR 552.A OG1 GLU 228.A OE2 no hydrogen 3.476 N/A LEU 553.A N GLU 565.A O no hydrogen 2.743 N/A ALA 554.A N LEU 224.A O no hydrogen 2.864 N/A PHE 555.A N ARG 563.A O no hydrogen 2.909 N/A ASP 557.A N THR 561.A O no hydrogen 2.648 N/A GLY 560.A N ASP 557.A O no hydrogen 3.405 N/A THR 561.A N ASP 559.A OD2 no hydrogen 3.305 N/A THR 561.A OG1 ASP 559.A OD2 no hydrogen 2.320 N/A ARG 563.A N PHE 555.A O no hydrogen 2.944 N/A SER 567.A N HIS 551.A O no hydrogen 3.306 N/A LYS 570.A N GLU 79.A OE2 no hydrogen 2.683 N/A THR 572.A N GLN 80.A OE1 no hydrogen 3.137 N/A THR 573.A N GLN 80.A OE1 no hydrogen 3.315 N/A LEU 574.A N GLN 80.A OE1 no hydrogen 3.294 N/A