Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7jl2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLU 1.A O no hydrogen 2.729 N/A ARG 5.A N GLN 8.A OE1 no hydrogen 3.350 N/A MET 9.A N ARG 5.A O no hydrogen 3.220 N/A GLU 10.A N PRO 6.A O no hydrogen 2.851 N/A VAL 11.A N TYR 7.A O no hydrogen 2.902 N/A ALA 12.A N GLN 8.A O no hydrogen 2.883 N/A GLN 13.A N GLU 10.A O no hydrogen 3.141 N/A LEU 16.A N GLN 13.A O no hydrogen 3.308 N/A ILE 23.A N GLY 173.A O no hydrogen 3.438 N/A CYS 24.A SG CYS 24.A O no hydrogen 3.018 N/A CYS 24.A SG THR 207.A OG1 no hydrogen 2.605 N/A SER 29.A OG PRO 26.A O no hydrogen 2.957 N/A ARG 33.A N GLY 30.A O no hydrogen 2.918 N/A ALA 35.A N LYS 31.A O no hydrogen 3.031 N/A VAL 36.A N THR 32.A O no hydrogen 2.902 N/A TYR 37.A N ARG 33.A O no hydrogen 2.907 N/A ILE 38.A N VAL 34.A O no hydrogen 2.930 N/A ALA 39.A N ALA 35.A O no hydrogen 2.868 N/A LYS 40.A N VAL 36.A O no hydrogen 2.956 N/A LYS 40.A NZ ASP 44.A OD2 no hydrogen 2.571 N/A ASP 41.A N TYR 37.A O no hydrogen 3.076 N/A HIS 42.A N ILE 38.A O no hydrogen 2.901 N/A HIS 42.A NE2 SER 129.A OG no hydrogen 2.754 N/A LEU 43.A N ALA 39.A O no hydrogen 2.956 N/A ASP 44.A N LYS 40.A O no hydrogen 2.922 N/A LYS 45.A N ASP 41.A O no hydrogen 2.910 N/A LYS 46.A N HIS 42.A O no hydrogen 2.979 N/A LYS 47.A N LEU 43.A O no hydrogen 2.879 N/A LYS 48.A N ASP 44.A O no hydrogen 2.855 N/A ALA 49.A N LYS 45.A O no hydrogen 2.982 N/A SER 50.A N LYS 47.A O no hydrogen 3.088 N/A GLU 51.A N LYS 46.A O no hydrogen 3.109 N/A LYS 54.A N SER 129.A OG no hydrogen 3.190 N/A LYS 54.A NZ VAL 100.A O no hydrogen 2.352 N/A VAL 55.A N ASP 104.A O no hydrogen 3.076 N/A ILE 56.A N LEU 130.A O no hydrogen 3.062 N/A VAL 57.A N ILE 106.A O no hydrogen 2.819 N/A LEU 58.A N ILE 132.A O no hydrogen 2.873 N/A VAL 59.A N SER 108.A O no hydrogen 2.999 N/A LEU 64.A N LYS 61.A O no hydrogen 3.092 N/A VAL 65.A N VAL 62.A O no hydrogen 2.718 N/A GLN 67.A N LEU 63.A O no hydrogen 3.238 N/A GLN 67.A NE2 GLY 451.A O no hydrogen 2.966 N/A LEU 68.A N LEU 64.A O no hydrogen 2.840 N/A PHE 69.A N VAL 65.A O no hydrogen 2.946 N/A ARG 70.A N GLU 66.A O no hydrogen 3.017 N/A ARG 70.A NE GLU 66.A O no hydrogen 3.386 N/A GLN 74.A N PHE 69.A O no hydrogen 3.130 N/A LEU 77.A N GLN 74.A O no hydrogen 3.135 N/A TRP 80.A N LEU 77.A O no hydrogen 3.274 N/A TYR 81.A N LEU 77.A O no hydrogen 3.471 N/A TYR 81.A OH ASP 44.A OD1 no hydrogen 2.302 N/A ARG 82.A N ASP 104.A OD1 no hydrogen 3.139 N/A ILE 84.A N ILE 105.A O no hydrogen 3.022 N/A LEU 86.A N ILE 107.A O no hydrogen 2.922 N/A SER 87.A OG ASP 89.A OD1 no hydrogen 2.330 N/A THR 90.A N SER 87.A O no hydrogen 3.224 N/A THR 90.A OG1 SER 87.A O no hydrogen 2.736 N/A VAL 99.A N SER 95.A O no hydrogen 3.062 N/A VAL 100.A N PHE 96.A O no hydrogen 3.034 N/A LYS 101.A N PRO 97.A O no hydrogen 2.954 N/A SER 102.A N VAL 99.A O no hydrogen 3.274 N/A CYS 103.A N VAL 99.A O no hydrogen 3.376 N/A ASP 104.A N ARG 82.A O no hydrogen 3.282 N/A ILE 105.A N ARG 82.A O no hydrogen 3.316 N/A ILE 106.A N VAL 55.A O no hydrogen 3.096 N/A ILE 107.A N ILE 84.A O no hydrogen 3.057 N/A SER 108.A N VAL 57.A O no hydrogen 2.950 N/A SER 108.A OG THR 109.A O no hydrogen 3.097 N/A ALA 110.A N VAL 59.A O no hydrogen 3.314 N/A ILE 112.A N THR 109.A O no hydrogen 2.950 N/A GLU 114.A N ALA 110.A O no hydrogen 3.110 N/A ASN 115.A N GLN 111.A O no hydrogen 2.936 N/A SER 116.A N ILE 112.A O no hydrogen 2.971 N/A LEU 117.A N GLU 114.A O no hydrogen 3.069 N/A LEU 118.A N GLU 114.A O no hydrogen 3.266 N/A GLN 124.A N ASP 127.A OD2 no hydrogen 3.392 N/A ASP 127.A N GLN 124.A O no hydrogen 2.904 N/A PHE 128.A N LEU 125.A O no hydrogen 3.102 N/A SER 129.A OG HIS 42.A NE2 no hydrogen 2.754 N/A SER 129.A OG LYS 54.A O no hydrogen 2.245 N/A LEU 130.A N LYS 54.A O no hydrogen 3.056 N/A ILE 131.A N GLN 170.A O no hydrogen 2.976 N/A ILE 132.A N ILE 56.A O no hydrogen 2.879 N/A ILE 133.A N LEU 172.A O no hydrogen 2.893 N/A ASP 134.A N LEU 58.A O no hydrogen 3.081 N/A CYS 136.A N LEU 174.A O no hydrogen 3.050 N/A CYS 136.A SG LEU 174.A O no hydrogen 3.668 N/A THR 139.A N CYS 136.A O no hydrogen 3.086 N/A THR 139.A OG1 CYS 136.A O no hydrogen 2.574 N/A ASN 147.A N ALA 143.A O no hydrogen 3.251 N/A MET 149.A N TYR 145.A O no hydrogen 2.945 N/A ARG 150.A N ASN 146.A O no hydrogen 2.860 N/A ARG 150.A NE SER 536.A OG no hydrogen 2.854 N/A ARG 150.A NH2 SER 536.A OG no hydrogen 2.259 N/A HIS 151.A N ASN 147.A O no hydrogen 3.124 N/A TYR 152.A N ILE 148.A O no hydrogen 3.129 N/A LEU 153.A N MET 149.A O no hydrogen 2.772 N/A MET 154.A N ARG 150.A O no hydrogen 2.880 N/A GLN 155.A N HIS 151.A O no hydrogen 3.025 N/A LYS 156.A N TYR 152.A O no hydrogen 2.997 N/A LYS 156.A NZ ASP 201.A OD1 no hydrogen 3.182 N/A LYS 156.A NZ ASP 201.A OD2 no hydrogen 3.046 N/A LEU 157.A N LEU 153.A O no hydrogen 3.059 N/A LYS 158.A N MET 154.A O no hydrogen 3.001 N/A ASN 159.A N GLN 155.A O no hydrogen 2.837 N/A ASN 159.A ND2 ILE 166.A O no hydrogen 2.756 N/A ASN 160.A N LYS 156.A O no hydrogen 3.000 N/A ARG 161.A N LEU 157.A O no hydrogen 2.971 N/A LEU 162.A N LYS 158.A O no hydrogen 2.876 N/A LYS 163.A N ASN 159.A O no hydrogen 2.884 N/A LYS 164.A N ASN 160.A O no hydrogen 3.382 N/A ILE 166.A N ASN 159.A OD1 no hydrogen 3.459 N/A LEU 172.A N ILE 131.A O no hydrogen 2.950 N/A LEU 174.A N ILE 133.A O no hydrogen 2.981 N/A THR 175.A N ILE 23.A O no hydrogen 3.429 N/A SER 177.A OG SER 177.A O no hydrogen 2.489 N/A VAL 180.A N GLU 469.A OE2 no hydrogen 3.339 N/A LYS 185.A NZ THR 184.A O no hydrogen 3.466 N/A ALA 189.A N LYS 185.A O no hydrogen 3.257 N/A GLU 190.A N GLN 186.A O no hydrogen 3.086 N/A GLU 191.A N ALA 187.A O no hydrogen 2.803 N/A HIS 192.A N LYS 188.A O no hydrogen 2.845 N/A HIS 192.A ND1 GLY 179.A O no hydrogen 2.739 N/A ILE 193.A N ALA 189.A O no hydrogen 3.000 N/A LEU 194.A N GLU 190.A O no hydrogen 3.003 N/A LYS 195.A N GLU 191.A O no hydrogen 2.838 N/A LEU 196.A N HIS 192.A O no hydrogen 3.038 N/A CYS 197.A N ILE 193.A O no hydrogen 2.917 N/A CYS 197.A SG ILE 193.A O no hydrogen 3.235 N/A ALA 198.A N LEU 194.A O no hydrogen 2.814 N/A ASN 199.A N LYS 195.A O no hydrogen 2.954 N/A ASN 199.A ND2 LYS 195.A O no hydrogen 2.527 N/A LEU 200.A N LEU 196.A O no hydrogen 2.924 N/A ASP 201.A N ALA 198.A O no hydrogen 2.632 N/A ALA 202.A N CYS 197.A O no hydrogen 3.086 N/A THR 204.A OG1 PHE 203.A O no hydrogen 2.483 N/A LEU 215.A N ASN 211.A O no hydrogen 3.456 N/A LYS 216.A N LEU 212.A O no hydrogen 2.894 N/A ASN 217.A N ASP 213.A O no hydrogen 2.833 N/A ASN 217.A N GLN 214.A O no hydrogen 3.034 N/A GLN 218.A N GLN 214.A O no hydrogen 2.893 N/A ILE 219.A N LEU 215.A O no hydrogen 3.050 N/A GLN 220.A NE2 ASP 482.A OD2 no hydrogen 2.150 N/A CYS 223.A N SER 484.A O no hydrogen 2.956 N/A CYS 223.A SG LYS 224.A O no hydrogen 4.038 N/A LYS 225.A N TYR 486.A O no hydrogen 2.958 N/A ALA 227.A N LEU 488.A O no hydrogen 2.836 N/A ALA 229.A N ALA 490.A O no hydrogen 3.200 N/A ARG 231.A NH1 GLU 352.A O no hydrogen 2.441 N/A ARG 231.A NH2 GLU 352.A O no hydrogen 3.075 N/A PHE 235.A N ASP 233.A OD2 no hydrogen 3.097 N/A LYS 238.A N PRO 234.A O no hydrogen 2.281 N/A LEU 239.A N PHE 235.A O no hydrogen 2.898 N/A LEU 240.A N LYS 236.A O no hydrogen 2.973 N/A GLU 241.A N GLU 237.A O no hydrogen 3.071 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.387 N/A ILE 242.A N LYS 238.A O no hydrogen 3.393 N/A MET 243.A N LEU 239.A O no hydrogen 2.950 N/A THR 244.A N LEU 240.A O no hydrogen 2.825 N/A THR 244.A OG1 LEU 240.A O no hydrogen 3.027 N/A THR 244.A OG1 GLU 241.A O no hydrogen 2.735 N/A ARG 245.A N GLU 241.A O no hydrogen 2.926 N/A ILE 246.A N ILE 242.A O no hydrogen 2.974 N/A GLN 247.A N MET 243.A O no hydrogen 2.782 N/A GLN 247.A NE2 MET 252.A O no hydrogen 2.232 N/A THR 248.A N THR 244.A O no hydrogen 2.760 N/A THR 248.A OG1 THR 244.A O no hydrogen 2.398 N/A TYR 249.A N ARG 245.A O no hydrogen 2.930 N/A TYR 249.A OH THR 329.A OG1 no hydrogen 3.322 N/A CYS 250.A SG LYS 281.A O no hydrogen 3.334 N/A GLN 251.A N THR 248.A O no hydrogen 2.803 N/A MET 252.A N GLN 247.A O no hydrogen 3.084 N/A SER 256.A OG ASP 257.A OD2 no hydrogen 3.056 N/A GLU 264.A N THR 260.A O no hydrogen 3.047 N/A GLN 265.A N GLN 261.A O no hydrogen 2.920 N/A TRP 266.A N PRO 262.A O no hydrogen 2.878 N/A ALA 267.A N TYR 263.A O no hydrogen 2.812 N/A ILE 268.A N GLU 264.A O no hydrogen 2.936 N/A GLN 269.A N GLN 265.A O no hydrogen 3.000 N/A MET 270.A N TRP 266.A O no hydrogen 2.882 N/A GLU 271.A N ALA 267.A O no hydrogen 2.872 N/A LYS 272.A N ILE 268.A O no hydrogen 2.884 N/A LYS 273.A N GLN 269.A O no hydrogen 2.951 N/A ALA 274.A N MET 270.A O no hydrogen 2.828 N/A ALA 275.A N GLU 271.A O no hydrogen 2.971 N/A LYS 276.A N LYS 272.A O no hydrogen 2.882 N/A GLU 277.A N LYS 273.A O no hydrogen 2.977 N/A GLY 278.A N ALA 275.A O no hydrogen 3.086 N/A ASN 279.A N ALA 274.A O no hydrogen 2.968 N/A ARG 283.A N ASN 279.A O no hydrogen 3.288 N/A CYS 285.A SG ILE 246.A O no hydrogen 3.650 N/A ALA 286.A N GLU 282.A O no hydrogen 2.792 N/A GLU 287.A N ARG 283.A O no hydrogen 2.997 N/A HIS 288.A N VAL 284.A O no hydrogen 2.981 N/A LEU 289.A N CYS 285.A O no hydrogen 2.973 N/A ARG 290.A N ALA 286.A O no hydrogen 2.976 N/A ARG 290.A NE GLU 294.A OE1 no hydrogen 3.320 N/A ARG 290.A NE GLU 294.A OE2 no hydrogen 3.559 N/A LYS 291.A N GLU 287.A O no hydrogen 2.914 N/A TYR 292.A N HIS 288.A O no hydrogen 3.008 N/A ASN 293.A N LEU 289.A O no hydrogen 2.977 N/A GLU 294.A N ARG 290.A O no hydrogen 3.007 N/A ALA 295.A N LYS 291.A O no hydrogen 2.910 N/A LEU 296.A N TYR 292.A O no hydrogen 2.862 N/A GLN 297.A N ASN 293.A O no hydrogen 2.969 N/A ILE 298.A N GLU 294.A O no hydrogen 2.945 N/A ASN 299.A N ALA 295.A O no hydrogen 2.774 N/A ASP 300.A N LEU 296.A O no hydrogen 2.871 N/A THR 301.A N GLN 297.A O no hydrogen 3.162 N/A THR 301.A OG1 GLN 297.A O no hydrogen 3.380 N/A THR 301.A OG1 ILE 298.A O no hydrogen 2.474 N/A ILE 302.A N ILE 298.A O no hydrogen 2.766 N/A ARG 303.A NH1 ALA 390.A O no hydrogen 2.988 N/A TYR 308.A N MET 304.A O no hydrogen 3.001 N/A TYR 308.A OH GLU 312.A OE1 no hydrogen 2.796 N/A THR 309.A N ILE 305.A O no hydrogen 2.873 N/A THR 309.A OG1 ILE 305.A O no hydrogen 3.469 N/A THR 309.A OG1 ASP 306.A O no hydrogen 2.443 N/A HIS 310.A N ASP 306.A O no hydrogen 2.889 N/A LEU 311.A N ALA 307.A O no hydrogen 3.376 N/A GLU 312.A N TYR 308.A O no hydrogen 2.819 N/A THR 313.A N THR 309.A O no hydrogen 2.782 N/A THR 313.A OG1 THR 309.A O no hydrogen 2.480 N/A PHE 314.A N HIS 310.A O no hydrogen 3.074 N/A TYR 315.A N LEU 311.A O no hydrogen 3.022 N/A ASN 316.A N GLU 312.A O no hydrogen 2.880 N/A GLU 317.A N THR 313.A O no hydrogen 3.060 N/A GLU 318.A N PHE 314.A O no hydrogen 2.869 N/A LYS 319.A N TYR 315.A O no hydrogen 2.978 N/A ASP 320.A N ASN 316.A O no hydrogen 2.951 N/A LYS 321.A N GLU 317.A O no hydrogen 2.836 N/A LYS 322.A N GLU 318.A O no hydrogen 2.995 N/A LYS 322.A NZ CYS 609.A O no hydrogen 2.295 N/A PHE 323.A N LYS 319.A O no hydrogen 2.962 N/A ALA 324.A N LYS 321.A O no hydrogen 3.233 N/A ILE 326.A N PHE 323.A O no hydrogen 3.245 N/A GLU 327.A N ALA 324.A O no hydrogen 3.022 N/A THR 329.A OG1 TYR 249.A OH no hydrogen 3.322 N/A THR 329.A OG1 GLU 328.A OE2 no hydrogen 2.399 N/A PHE 332.A N GLU 328.A O no hydrogen 3.471 N/A LEU 333.A N ASP 330.A O no hydrogen 3.012 N/A THR 335.A N ARG 331.A O no hydrogen 3.022 N/A THR 335.A OG1 ARG 331.A O no hydrogen 2.803 N/A PHE 337.A N LEU 333.A O no hydrogen 2.920 N/A PHE 338.A N MET 334.A O no hydrogen 2.830 N/A ASN 340.A N LEU 336.A O no hydrogen 3.048 N/A ASN 340.A ND2 GLU 339.A OE1 no hydrogen 2.510 N/A ASN 341.A N PHE 337.A O no hydrogen 2.683 N/A LYS 342.A N PHE 338.A O no hydrogen 2.998 N/A MET 343.A N GLU 339.A O no hydrogen 3.102 N/A LEU 344.A N ASN 340.A O no hydrogen 2.744 N/A LYS 345.A N ASN 341.A O no hydrogen 2.788 N/A ARG 346.A N LYS 342.A O no hydrogen 3.074 N/A LEU 347.A N MET 343.A O no hydrogen 2.784 N/A ALA 348.A N LEU 344.A O no hydrogen 2.297 N/A GLU 349.A N LYS 345.A O no hydrogen 3.038 N/A ASN 350.A N LEU 347.A O no hydrogen 3.233 N/A LYS 357.A N ASN 355.A OD1 no hydrogen 2.867 N/A LEU 358.A N ASN 355.A OD1 no hydrogen 3.366 N/A THR 359.A N ASN 355.A O no hydrogen 3.413 N/A THR 359.A OG1 ASN 355.A O no hydrogen 2.409 N/A LYS 360.A N GLU 356.A O no hydrogen 3.294 N/A LEU 361.A N LYS 357.A O no hydrogen 2.950 N/A ARG 362.A N LEU 358.A O no hydrogen 2.913 N/A ASN 363.A N THR 359.A O no hydrogen 3.014 N/A THR 364.A N LYS 360.A O no hydrogen 2.829 N/A THR 364.A OG1 LYS 360.A O no hydrogen 2.673 N/A ILE 365.A N LEU 361.A O no hydrogen 2.931 N/A MET 366.A N ARG 362.A O no hydrogen 3.060 N/A GLU 367.A N ASN 363.A O no hydrogen 2.935 N/A GLN 368.A N THR 364.A O no hydrogen 2.951 N/A TYR 369.A N ILE 365.A O no hydrogen 2.993 N/A THR 370.A N MET 366.A O no hydrogen 2.960 N/A THR 370.A OG1 MET 366.A O no hydrogen 3.090 N/A ARG 371.A N GLU 367.A O no hydrogen 2.985 N/A ARG 371.A NE GLN 368.A OE1 no hydrogen 3.471 N/A THR 372.A N GLN 368.A O no hydrogen 2.971 N/A THR 372.A OG1 GLN 368.A O no hydrogen 3.167 N/A THR 372.A OG1 TYR 369.A O no hydrogen 2.473 N/A GLU 373.A N TYR 369.A O no hydrogen 3.015 N/A SER 375.A OG THR 372.A O no hydrogen 3.048 N/A ILE 379.A N ILE 459.A O no hydrogen 2.953 N/A ILE 380.A N LEU 442.A O no hydrogen 2.953 N/A PHE 381.A N ILE 461.A O no hydrogen 2.839 N/A THR 382.A N ALA 444.A O no hydrogen 3.060 N/A LYS 383.A N THR 382.A OG1 no hydrogen 2.472 N/A THR 384.A OG1 SER 387.A OG no hydrogen 2.270 N/A GLN 386.A N GLN 386.A OE1 no hydrogen 2.371 N/A SER 387.A N THR 384.A OG1 no hydrogen 3.387 N/A SER 387.A OG THR 384.A OG1 no hydrogen 2.270 N/A ALA 388.A N THR 384.A O no hydrogen 3.189 N/A TYR 389.A N ARG 385.A O no hydrogen 3.006 N/A ALA 390.A N GLN 386.A O no hydrogen 2.824 N/A LEU 391.A N SER 387.A O no hydrogen 2.943 N/A SER 392.A N ALA 388.A O no hydrogen 3.008 N/A SER 392.A OG TYR 389.A O no hydrogen 2.378 N/A GLN 393.A N TYR 389.A O no hydrogen 3.065 N/A TRP 394.A N ALA 390.A O no hydrogen 2.824 N/A ILE 395.A N LEU 391.A O no hydrogen 2.932 N/A THR 396.A N SER 392.A O no hydrogen 2.939 N/A THR 396.A OG1 SER 392.A O no hydrogen 2.841 N/A GLU 397.A N GLN 393.A O no hydrogen 2.952 N/A LYS 400.A NZ GLU 403.A OE2 no hydrogen 2.473 N/A PHE 401.A N ASN 398.A O no hydrogen 3.140 N/A GLU 403.A N GLU 399.A O no hydrogen 3.344 N/A VAL 404.A N PHE 401.A O no hydrogen 3.005 N/A GLY 405.A N ALA 402.A O no hydrogen 2.768 N/A HIS 409.A N LEU 441.A O no hydrogen 2.977 N/A HIS 409.A ND1 HIS 410.A O no hydrogen 2.879 N/A HIS 410.A N HIS 410.A ND1 no hydrogen 2.835 N/A LEU 411.A N ILE 443.A O no hydrogen 2.852 N/A SER 417.A OG SER 416.A O no hydrogen 2.624 N/A THR 423.A OG1 GLN 424.A OE1 no hydrogen 2.571 N/A GLN 424.A N GLN 424.A OE1 no hydrogen 2.455 N/A GLN 427.A N THR 423.A O no hydrogen 3.215 N/A LYS 428.A N GLN 424.A O no hydrogen 2.988 N/A GLU 429.A N ASN 425.A O no hydrogen 3.082 N/A VAL 430.A N GLU 426.A O no hydrogen 2.864 N/A ILE 431.A N GLN 427.A O no hydrogen 2.939 N/A SER 432.A N LYS 428.A O no hydrogen 3.116 N/A LYS 433.A N GLU 429.A O no hydrogen 2.836 N/A PHE 434.A N VAL 430.A O no hydrogen 2.875 N/A ARG 435.A N ILE 431.A O no hydrogen 2.980 N/A THR 436.A N SER 432.A O no hydrogen 3.184 N/A THR 436.A OG1 LYS 433.A O no hydrogen 2.267 N/A GLY 437.A N LYS 433.A O no hydrogen 2.975 N/A ASN 440.A ND2 ALA 376.A O no hydrogen 2.502 N/A ASN 440.A ND2 ASN 440.A O no hydrogen 2.455 N/A LEU 441.A N LYS 407.A O no hydrogen 2.379 N/A LEU 442.A N GLY 378.A O no hydrogen 3.008 N/A ILE 443.A N HIS 409.A O no hydrogen 2.934 N/A ALA 444.A N ILE 380.A O no hydrogen 2.868 N/A THR 446.A N THR 445.A OG1 no hydrogen 2.671 N/A ALA 448.A N THR 445.A O no hydrogen 3.168 N/A GLU 449.A N THR 446.A O no hydrogen 3.356 N/A CYS 457.A SG ILE 454.A O no hydrogen 3.264 N/A CYS 457.A SG ARG 478.A O no hydrogen 3.580 N/A ASN 458.A ND2 ASP 482.A O no hydrogen 3.605 N/A ILE 459.A N ARG 377.A O no hydrogen 3.099 N/A VAL 460.A N THR 485.A O no hydrogen 3.041 N/A ILE 461.A N ILE 379.A O no hydrogen 2.839 N/A ARG 462.A N VAL 487.A O no hydrogen 3.017 N/A ARG 462.A NE TYR 486.A OH no hydrogen 3.188 N/A ARG 462.A NH2 ALA 471.A O no hydrogen 3.558 N/A TYR 463.A N PHE 381.A O no hydrogen 3.025 N/A GLY 464.A N VAL 489.A O no hydrogen 2.976 N/A THR 467.A OG1 ASN 468.A OD1 no hydrogen 2.758 N/A GLU 469.A N GLU 469.A OE1 no hydrogen 2.561 N/A ALA 471.A N ASN 468.A OD1 no hydrogen 3.415 N/A MET 472.A N GLU 469.A O no hydrogen 3.061 N/A VAL 473.A N GLU 469.A O no hydrogen 2.930 N/A GLN 474.A N ILE 470.A O no hydrogen 2.984 N/A ARG 476.A N MET 472.A O no hydrogen 3.020 N/A GLY 477.A N VAL 473.A O no hydrogen 2.945 N/A ARG 478.A N GLN 474.A O no hydrogen 3.047 N/A ARG 478.A N ALA 475.A O no hydrogen 3.129 N/A ARG 478.A NE LEU 452.A O no hydrogen 2.948 N/A ARG 478.A NH1 GLU 449.A O no hydrogen 3.349 N/A ARG 478.A NH2 LEU 452.A O no hydrogen 2.647 N/A ARG 480.A N ARG 478.A O no hydrogen 2.508 N/A ALA 481.A N ALA 479.A O no hydrogen 2.798 N/A GLU 483.A N ASP 482.A OD2 no hydrogen 2.473 N/A THR 485.A N ASN 458.A O no hydrogen 2.829 N/A THR 485.A OG1 GLN 368.A OE1 no hydrogen 3.405 N/A THR 485.A OG1 ASN 458.A O no hydrogen 2.947 N/A TYR 486.A N CYS 223.A O no hydrogen 2.944 N/A VAL 487.A N VAL 460.A O no hydrogen 2.974 N/A LEU 488.A N LYS 225.A O no hydrogen 3.066 N/A VAL 489.A N ARG 462.A O no hydrogen 2.999 N/A ALA 490.A N ALA 227.A O no hydrogen 3.029 N/A SER 492.A OG ASP 230.A OD2 no hydrogen 2.903 N/A GLY 493.A N HIS 491.A ND1 no hydrogen 2.949 N/A VAL 496.A N SER 494.A O no hydrogen 3.118 N/A GLU 498.A N GLU 498.A OE1 no hydrogen 2.521 N/A GLU 500.A N VAL 496.A O no hydrogen 2.902 N/A THR 501.A N ILE 497.A O no hydrogen 2.840 N/A THR 501.A OG1 ILE 497.A O no hydrogen 2.976 N/A VAL 502.A N GLU 498.A O no hydrogen 2.965 N/A ASN 503.A N ARG 499.A O no hydrogen 2.890 N/A ASN 503.A ND2 ASN 468.A O no hydrogen 3.417 N/A ASP 504.A N GLU 500.A O no hydrogen 2.893 N/A PHE 505.A N THR 501.A O no hydrogen 3.066 N/A ARG 506.A N VAL 502.A O no hydrogen 2.906 N/A ARG 506.A NH1 GLU 469.A OE1 no hydrogen 3.166 N/A GLU 507.A N ASN 503.A O no hydrogen 2.875 N/A LYS 508.A N ASP 504.A O no hydrogen 3.111 N/A LYS 508.A NZ ASP 504.A OD2 no hydrogen 3.263 N/A MET 509.A N PHE 505.A O no hydrogen 2.979 N/A MET 510.A N ARG 506.A O no hydrogen 2.999 N/A TYR 511.A N GLU 507.A O no hydrogen 3.103 N/A LYS 512.A N LYS 508.A O no hydrogen 3.058 N/A ALA 513.A N MET 509.A O no hydrogen 2.937 N/A ILE 514.A N MET 510.A O no hydrogen 2.928 N/A HIS 515.A N TYR 511.A O no hydrogen 3.046 N/A CYS 516.A N LYS 512.A O no hydrogen 2.909 N/A CYS 516.A SG GLU 190.A OE1 no hydrogen 3.380 N/A VAL 517.A N ALA 513.A O no hydrogen 2.916 N/A GLN 518.A N ILE 514.A O no hydrogen 2.882 N/A ASN 519.A N CYS 516.A O no hydrogen 3.102 N/A MET 520.A N VAL 517.A O no hydrogen 3.154 N/A GLU 523.A N GLU 523.A OE1 no hydrogen 2.383 N/A TYR 525.A N LYS 521.A O no hydrogen 2.852 N/A ALA 526.A N PRO 522.A O no hydrogen 2.838 N/A HIS 527.A N GLU 523.A O no hydrogen 2.917 N/A LYS 528.A N GLU 524.A O no hydrogen 2.934 N/A ILE 529.A N TYR 525.A O no hydrogen 2.905 N/A LEU 530.A N ALA 526.A O no hydrogen 2.920 N/A GLU 531.A N HIS 527.A O no hydrogen 3.010 N/A LEU 532.A N LYS 528.A O no hydrogen 3.001 N/A GLN 533.A N ILE 529.A O no hydrogen 2.943 N/A MET 534.A N LEU 530.A O no hydrogen 3.048 N/A GLN 535.A N GLU 531.A O no hydrogen 3.010 N/A SER 536.A N LEU 532.A O no hydrogen 3.203 N/A MET 538.A N MET 534.A O no hydrogen 3.098 N/A GLU 539.A N GLN 535.A O no hydrogen 3.039 N/A LYS 540.A N SER 536.A O no hydrogen 2.922 N/A LYS 541.A N ILE 537.A O no hydrogen 2.996 N/A MET 542.A N MET 538.A O no hydrogen 2.965 N/A LYS 543.A N GLU 539.A O no hydrogen 2.916 N/A LYS 543.A NZ GLU 142.A OE1 no hydrogen 3.548 N/A THR 544.A N LYS 540.A O no hydrogen 2.901 N/A THR 544.A OG1 LYS 540.A O no hydrogen 2.626 N/A LYS 545.A N LYS 541.A O no hydrogen 3.081 N/A ARG 546.A N MET 542.A O no hydrogen 3.001 N/A ASN 547.A N LYS 543.A O no hydrogen 2.874 N/A ILE 548.A N THR 544.A O no hydrogen 2.987 N/A ALA 549.A N LYS 545.A O no hydrogen 2.992 N/A LYS 550.A N ARG 546.A O no hydrogen 2.898 N/A SER 556.A N ASN 554.A OD1 no hydrogen 2.683 N/A SER 556.A OG ASN 554.A OD1 no hydrogen 2.477 N/A THR 559.A N VAL 635.A O no hydrogen 2.855 N/A THR 559.A OG1 VAL 635.A O no hydrogen 3.548 N/A PHE 560.A N CYS 570.A O no hydrogen 2.893 N/A LEU 561.A N VAL 633.A O no hydrogen 2.946 N/A CYS 562.A N VAL 567.A O no hydrogen 3.400 N/A CYS 562.A SG GLN 611.A OE1 no hydrogen 3.142 N/A LYS 563.A NZ ARG 630.A O no hydrogen 2.477 N/A ASN 564.A N GLN 611.A OE1 no hydrogen 3.461 N/A ALA 569.A N PHE 560.A O no hydrogen 2.610 N/A CYS 570.A SG SER 571.A O no hydrogen 3.879 N/A SER 571.A N ASP 574.A OD2 no hydrogen 3.105 N/A SER 571.A OG ILE 558.A O no hydrogen 3.432 N/A GLY 572.A N SER 571.A OG no hydrogen 2.593 N/A ASP 574.A N SER 571.A O no hydrogen 3.388 N/A HIS 576.A N VAL 584.A O no hydrogen 2.913 N/A ILE 578.A N HIS 582.A O no hydrogen 2.859 N/A MET 581.A N ILE 578.A O no hydrogen 2.664 N/A HIS 582.A N ILE 578.A O no hydrogen 3.096 N/A VAL 584.A N HIS 576.A O no hydrogen 2.917 N/A THR 587.A N ASN 585.A OD1 no hydrogen 2.858 N/A THR 587.A OG1 ASN 585.A OD1 no hydrogen 3.212 N/A GLU 589.A N GLU 589.A OE1 no hydrogen 2.538 N/A LYS 591.A N THR 587.A O no hydrogen 2.964 N/A GLU 592.A N PRO 588.A O no hydrogen 3.083 N/A LEU 593.A N GLU 589.A O no hydrogen 3.036 N/A LEU 593.A N PHE 590.A O no hydrogen 3.264 N/A ILE 595.A N ILE 606.A O no hydrogen 3.055 N/A GLU 604.A N ARG 597.A O no hydrogen 2.917 N/A ILE 605.A N GLY 614.A O no hydrogen 2.801 N/A ILE 606.A N ILE 595.A O no hydrogen 2.797 N/A CYS 607.A N GLN 611.A O no hydrogen 2.673 N/A GLY 610.A N CYS 607.A O no hydrogen 3.289 N/A GLN 611.A NE2 ASN 631.A O no hydrogen 3.197 N/A TRP 613.A N ILE 605.A O no hydrogen 3.125 N/A MET 616.A N GLY 603.A O no hydrogen 2.764 N/A MET 617.A N LEU 624.A O no hydrogen 2.872 N/A HIS 619.A N LEU 622.A O no hydrogen 3.058 N/A LEU 622.A N HIS 619.A O no hydrogen 2.840 N/A LEU 624.A N MET 617.A O no hydrogen 3.131 N/A CYS 626.A N THR 615.A O no hydrogen 2.901 N/A CYS 626.A SG THR 615.A O no hydrogen 3.001 N/A LYS 628.A N TRP 613.A O no hydrogen 3.201 N/A ASN 631.A N LYS 628.A O no hydrogen 2.811 N/A ASN 631.A ND2 TRP 613.A O no hydrogen 2.268 N/A PHE 632.A N ILE 629.A O no hydrogen 3.308 N/A VAL 634.A N LYS 643.A O no hydrogen 3.130 N/A VAL 635.A N THR 559.A O no hydrogen 2.876 N/A LYS 643.A N VAL 634.A O no hydrogen 3.501 N/A LYS 647.A N GLU 650.A OE2 no hydrogen 2.946 N/A GLU 650.A N GLU 650.A OE1 no hydrogen 2.013 N/A LEU 651.A N TRP 648.A O no hydrogen 3.309 N/A TYR 660.A OH LYS 620.A O no hydrogen 2.655 N/A SER 661.A N ASP 659.A OD1 no hydrogen 2.950 N/A SER 661.A OG ASP 659.A OD1 no hydrogen 2.877 N/A SER 661.A OG ASP 659.A OD2 no hydrogen 2.733 N/A SER 661.A OG GLU 662.A OE1 no hydrogen 2.969 N/A