Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8oeu_S.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N GLN 2.A OE1 no hydrogen 2.670 N/A ASP 3.A N ASP 1.A OD1 no hydrogen 2.840 N/A ASN 4.A N ASP 1.A O no hydrogen 3.190 N/A ILE 6.A N GLN 2.A O no hydrogen 2.790 N/A ALA 8.A N ASN 4.A O no hydrogen 2.599 N/A THR 9.A N GLU 5.A O no hydrogen 3.012 N/A GLU 13.A N GLY 597.A O no hydrogen 3.205 N/A ARG 14.A NE GLU 70.A OE1 no hydrogen 2.944 N/A ARG 14.A NH1 GLN 593.A O no hydrogen 2.891 N/A PHE 15.A N PRO 12.A O no hydrogen 3.191 N/A GLN 16.A N GLU 13.A O no hydrogen 2.821 N/A GLN 16.A NE2 PRO 12.A O no hydrogen 2.839 N/A LEU 17.A N GLU 13.A O no hydrogen 3.223 N/A ARG 18.A NH1 ASP 98.A OD2 no hydrogen 2.863 N/A ARG 18.A NH2 ASP 98.A OD2 no hydrogen 2.809 N/A SER 19.A OG GLU 99.A OE2 no hydrogen 3.127 N/A ALA 25.A N ASN 66.A OD1 no hydrogen 2.808 N/A ASP 28.A N ASP 28.A OD1 no hydrogen 2.429 N/A GLU 29.A N ASP 28.A OD1 no hydrogen 2.760 N/A GLU 32.A N ASP 28.A O no hydrogen 2.722 N/A GLU 33.A N GLU 29.A O no hydrogen 2.691 N/A ASP 35.A N GLU 31.A O no hydrogen 3.195 N/A TRP 36.A NE1 GLN 140.A O no hydrogen 2.469 N/A ILE 37.A N GLU 33.A O no hydrogen 2.533 N/A TYR 38.A N ALA 34.A O no hydrogen 3.230 N/A ARG 39.A N ASP 35.A O no hydrogen 3.240 N/A ASN 40.A N TRP 36.A O no hydrogen 2.633 N/A ALA 41.A N ILE 37.A O no hydrogen 2.714 N/A THR 46.A OG1 SER 48.A O no hydrogen 2.237 N/A ILE 47.A N GLU 379.A OE2 no hydrogen 2.753 N/A SER 48.A N THR 46.A OG1 no hydrogen 3.346 N/A SER 48.A OG GLU 379.A OE1 no hydrogen 2.571 N/A LEU 49.A N LEU 299.A O no hydrogen 3.071 N/A LYS 56.A NZ GLU 80.A O no hydrogen 3.497 N/A LYS 56.A NZ GLU 83.A O no hydrogen 2.584 N/A ILE 57.A N THR 53.A O no hydrogen 2.826 N/A LYS 58.A N ILE 54.A O no hydrogen 2.763 N/A GLU 59.A N GLN 55.A O no hydrogen 2.691 N/A ALA 60.A N LYS 56.A O no hydrogen 2.759 N/A LEU 61.A N ILE 57.A O no hydrogen 2.977 N/A GLY 62.A N LYS 58.A O no hydrogen 3.219 N/A PHE 63.A N GLU 59.A O no hydrogen 3.175 N/A MET 64.A N ALA 60.A O no hydrogen 3.061 N/A ARG 65.A N LEU 61.A O no hydrogen 3.035 N/A ARG 65.A NE LYS 23.A O no hydrogen 2.777 N/A ARG 65.A NH1 GLU 29.A OE1 no hydrogen 2.412 N/A ARG 65.A NH1 GLU 33.A OE2 no hydrogen 2.427 N/A ARG 65.A NH2 LYS 23.A O no hydrogen 2.788 N/A ASN 66.A N GLY 62.A O no hydrogen 3.170 N/A ASN 66.A ND2 ALA 25.A O no hydrogen 3.406 N/A GLN 67.A N GLY 62.A O no hydrogen 3.163 N/A PHE 69.A N PHE 63.A O no hydrogen 2.536 N/A ILE 74.A N GLU 70.A O no hydrogen 3.200 N/A ILE 74.A N VAL 71.A O no hydrogen 3.336 N/A ALA 75.A N VAL 71.A O no hydrogen 3.026 N/A TYR 77.A OH GLY 639.A O no hydrogen 2.260 N/A ARG 78.A N ILE 74.A O no hydrogen 3.314 N/A ARG 78.A NH1 TYR 77.A O no hydrogen 3.307 N/A LYS 79.A NZ PHE 76.A O no hydrogen 2.355 N/A TYR 81.A N ARG 78.A O no hydrogen 3.162 N/A VAL 82.A N LYS 79.A O no hydrogen 3.236 N/A GLU 83.A N LYS 79.A O no hydrogen 2.675 N/A LEU 86.A N VAL 82.A O no hydrogen 3.306 N/A LEU 91.A N HIS 87.A O no hydrogen 3.048 N/A TRP 92.A N ILE 88.A O no hydrogen 3.213 N/A TRP 92.A NE1 ASN 570.A OD1 no hydrogen 2.662 N/A ARG 93.A N ASN 89.A O no hydrogen 2.726 N/A ARG 93.A NH2 GLU 382.A OE2 no hydrogen 3.253 N/A VAL 94.A N ASP 90.A O no hydrogen 2.740 N/A TRP 95.A N LEU 91.A O no hydrogen 3.220 N/A GLN 96.A N TRP 92.A O no hydrogen 3.240 N/A TRP 97.A N ARG 93.A O no hydrogen 3.060 N/A ASP 98.A N VAL 94.A O no hydrogen 2.876 N/A LYS 100.A NZ GLN 96.A O no hydrogen 3.487 N/A TRP 101.A N TRP 97.A O no hydrogen 2.776 N/A THR 102.A N ASP 98.A O no hydrogen 2.961 N/A THR 102.A OG1 ASP 98.A O no hydrogen 2.669 N/A GLN 103.A N GLU 99.A O no hydrogen 3.447 N/A GLN 103.A NE2 GLU 99.A OE2 no hydrogen 3.120 N/A LEU 104.A N LYS 100.A O no hydrogen 3.249 N/A ARG 105.A N TRP 101.A O no hydrogen 3.059 N/A ILE 106.A N THR 102.A O no hydrogen 2.824 N/A ARG 107.A N GLN 103.A O no hydrogen 3.065 N/A LYS 108.A N LEU 104.A O no hydrogen 2.836 N/A LYS 108.A NZ LYS 137.A O no hydrogen 3.275 N/A LYS 108.A NZ VAL 139.A O no hydrogen 2.929 N/A GLU 109.A N ARG 105.A O no hydrogen 2.572 N/A ASN 110.A N ILE 106.A O no hydrogen 3.213 N/A LEU 111.A N LYS 108.A O no hydrogen 2.903 N/A THR 112.A N LYS 108.A O no hydrogen 2.678 N/A THR 112.A OG1 LYS 108.A O no hydrogen 3.339 N/A THR 112.A OG1 GLU 109.A O no hydrogen 3.129 N/A ARG 113.A N GLU 109.A O no hydrogen 3.376 N/A ARG 113.A NE GLU 109.A OE2 no hydrogen 2.838 N/A ARG 113.A NH2 ASN 110.A OD1 no hydrogen 2.442 N/A LEU 114.A N LEU 111.A O no hydrogen 3.226 N/A PHE 115.A N LEU 111.A O no hydrogen 3.113 N/A GLU 116.A N THR 112.A O no hydrogen 3.149 N/A MET 118.A N LEU 114.A O no hydrogen 3.252 N/A MET 118.A N PHE 115.A O no hydrogen 2.911 N/A GLN 119.A N PHE 115.A O no hydrogen 2.924 N/A GLN 119.A NE2 LEU 128.A O no hydrogen 2.421 N/A ALA 120.A N GLU 116.A O no hydrogen 2.832 N/A TYR 121.A N MET 118.A O no hydrogen 2.916 N/A GLN 122.A N MET 118.A O no hydrogen 2.579 N/A TYR 123.A N GLN 119.A O no hydrogen 2.924 N/A GLN 125.A N GLN 122.A O no hydrogen 2.906 N/A THR 131.A OG1 ASP 129.A OD2 no hydrogen 3.074 N/A ASP 132.A N ASP 129.A OD1 no hydrogen 3.158 N/A ARG 135.A N THR 131.A O no hydrogen 2.885 N/A ARG 135.A NH1 GLU 250.A OE2 no hydrogen 3.366 N/A LYS 137.A N MET 133.A O no hydrogen 3.076 N/A ASP 138.A N GLU 134.A O no hydrogen 2.788 N/A GLN 140.A N GLU 144.A OE2 no hydrogen 3.157 N/A GLN 140.A NE2 VAL 139.A O no hydrogen 2.884 N/A GLU 144.A N SER 141.A OG no hydrogen 3.009 N/A LEU 145.A N SER 141.A O no hydrogen 3.141 N/A LYS 146.A N ASP 143.A O no hydrogen 3.112 N/A ASP 147.A N ASP 143.A O no hydrogen 3.305 N/A VAL 148.A N GLU 144.A O no hydrogen 3.090 N/A TYR 149.A N LEU 145.A O no hydrogen 3.304 N/A ASN 150.A N LYS 146.A O no hydrogen 2.812 N/A PHE 152.A N VAL 148.A O no hydrogen 2.848 N/A LEU 153.A N TYR 149.A O no hydrogen 2.997 N/A LEU 154.A N ASN 150.A O no hydrogen 2.937 N/A TYR 156.A N PHE 152.A O no hydrogen 2.961 N/A LYS 162.A NZ ASP 159.A O no hydrogen 2.329 N/A MET 163.A N ILE 160.A O no hydrogen 2.894 N/A ASN 165.A N PRO 161.A O no hydrogen 2.960 N/A THR 176.A OG1 ASP 173.A OD1 no hydrogen 3.385 N/A CYS 178.A N MET 174.A O no hydrogen 3.135 N/A CYS 178.A SG MET 174.A O no hydrogen 3.244 N/A CYS 178.A SG GLY 238.A O no hydrogen 3.869 N/A GLN 179.A N TYR 175.A O no hydrogen 2.886 N/A SER 180.A N THR 176.A O no hydrogen 2.973 N/A ALA 181.A N ILE 177.A O no hydrogen 3.032 N/A GLY 182.A N GLN 179.A O no hydrogen 3.249 N/A LEU 183.A N CYS 178.A O no hydrogen 3.132 N/A ALA 187.A N LEU 183.A O no hydrogen 2.981 N/A LYS 188.A N ASP 184.A O no hydrogen 2.559 N/A LYS 189.A N GLY 185.A O no hydrogen 2.516 N/A PHE 190.A N ALA 187.A O no hydrogen 3.259 N/A PHE 197.A N THR 193.A O no hydrogen 3.433 N/A GLY 198.A N PRO 194.A O no hydrogen 3.242 N/A GLU 199.A N GLU 195.A O no hydrogen 3.178 N/A ASN 200.A N GLN 196.A O no hydrogen 3.296 N/A ASN 200.A ND2 HIS 208.A O no hydrogen 3.369 N/A ASN 200.A ND2 PHE 335.A O no hydrogen 2.684 N/A LEU 201.A N PHE 197.A O no hydrogen 3.208 N/A LEU 201.A N GLY 198.A O no hydrogen 3.194 N/A ARG 202.A N GLY 198.A O no hydrogen 3.247 N/A SER 204.A N LEU 201.A O no hydrogen 3.262 N/A SER 204.A OG LEU 201.A O no hydrogen 3.544 N/A GLN 206.A NE2 TYR 337.A O no hydrogen 3.433 N/A ARG 207.A N TYR 205.A O no hydrogen 2.663 N/A ARG 207.A NE ASP 203.A OD2 no hydrogen 2.390 N/A HIS 208.A N ASN 200.A OD1 no hydrogen 3.259 N/A GLU 211.A N GLY 191.A O no hydrogen 2.485 N/A ALA 215.A N PHE 213.A O no hydrogen 2.640 N/A LEU 220.A N GLU 216.A O no hydrogen 2.950 N/A ALA 221.A N LEU 218.A O no hydrogen 2.904 N/A ASP 223.A N LEU 220.A O no hydrogen 3.400 N/A TYR 224.A N ALA 221.A O no hydrogen 3.395 N/A CYS 226.A N PHE 229.A O no hydrogen 2.545 N/A CYS 226.A SG TYR 224.A O no hydrogen 3.636 N/A CYS 226.A SG VAL 225.A O no hydrogen 3.285 N/A ALA 234.A N THR 231.A O no hydrogen 2.418 N/A LEU 236.A N GLU 233.A O no hydrogen 3.112 N/A GLU 237.A N GLU 233.A O no hydrogen 3.083 N/A GLY 238.A N ALA 234.A O no hydrogen 2.923 N/A ALA 239.A N LEU 236.A O no hydrogen 3.148 N/A ARG 240.A N LEU 236.A O no hydrogen 2.859 N/A TYR 241.A N GLU 237.A O no hydrogen 3.092 N/A VAL 243.A N ALA 239.A O no hydrogen 3.060 N/A ALA 244.A N ARG 240.A O no hydrogen 3.022 N/A LEU 245.A N TYR 241.A O no hydrogen 3.033 N/A GLN 246.A N MET 242.A O no hydrogen 2.685 N/A GLN 246.A NE2 TYR 175.A OH no hydrogen 2.837 N/A ILE 247.A N VAL 243.A O no hydrogen 2.956 N/A ALA 248.A N ALA 244.A O no hydrogen 2.837 N/A ARG 249.A N LEU 245.A O no hydrogen 2.981 N/A ARG 249.A NH1 GLN 367.A OE1 no hydrogen 3.274 N/A GLU 250.A N ILE 247.A O no hydrogen 3.312 N/A ARG 254.A N GLU 250.A O no hydrogen 2.883 N/A ARG 254.A NE ALA 248.A O no hydrogen 3.314 N/A GLN 255.A N PRO 251.A O no hydrogen 2.691 N/A LEU 257.A N VAL 253.A O no hydrogen 3.337 N/A ARG 258.A N ARG 254.A O no hydrogen 3.157 N/A ARG 258.A NH2 ASP 147.A OD1 no hydrogen 3.057 N/A ARG 258.A NH2 GLU 371.A OE1 no hydrogen 3.326 N/A GLN 259.A N GLN 255.A O no hydrogen 3.069 N/A THR 260.A N VAL 256.A O no hydrogen 3.217 N/A THR 260.A N LEU 257.A O no hydrogen 3.180 N/A THR 260.A OG1 LEU 257.A O no hydrogen 2.321 N/A PHE 261.A N LEU 257.A O no hydrogen 3.128 N/A GLN 262.A N ARG 258.A O no hydrogen 3.031 N/A GLN 262.A NE2 ARG 258.A O no hydrogen 3.626 N/A GLU 263.A N THR 260.A O no hydrogen 3.048 N/A ARG 264.A N THR 260.A O no hydrogen 2.680 N/A LYS 266.A N SER 321.A O no hydrogen 2.660 N/A LYS 266.A NZ ILE 322.A O no hydrogen 3.253 N/A LEU 267.A N LYS 294.A O no hydrogen 2.581 N/A ASN 268.A N ASP 319.A O no hydrogen 3.174 N/A ILE 269.A N LEU 291.A O no hydrogen 3.134 N/A THR 270.A N THR 317.A O no hydrogen 2.880 N/A THR 270.A OG1 THR 317.A O no hydrogen 3.148 N/A THR 270.A OG1 THR 317.A OG1 no hydrogen 2.821 N/A THR 272.A N LEU 315.A O no hydrogen 2.613 N/A THR 272.A OG1 GLY 314.A O no hydrogen 2.490 N/A THR 272.A OG1 LEU 315.A O no hydrogen 2.622 N/A GLY 275.A N THR 272.A O no hydrogen 2.839 N/A ARG 276.A N LYS 273.A O no hydrogen 3.269 N/A ALA 282.A N ASP 280.A OD2 no hydrogen 2.750 N/A HIS 283.A N ASP 280.A OD1 no hydrogen 3.134 N/A ALA 285.A N HIS 283.A ND1 no hydrogen 3.032 N/A TYR 286.A N HIS 283.A O no hydrogen 3.424 N/A LYS 289.A NZ ARG 276.A O no hydrogen 3.512 N/A LEU 291.A N ILE 269.A O no hydrogen 3.172 N/A ASN 293.A N ASN 268.A OD1 no hydrogen 2.617 N/A LYS 294.A NZ GLU 298.A O no hydrogen 3.502 N/A VAL 296.A N ALA 265.A O no hydrogen 2.913 N/A GLU 298.A N PRO 295.A O no hydrogen 2.899 N/A LEU 299.A N VAL 296.A O no hydrogen 3.208 N/A GLN 303.A N ARG 300.A O no hydrogen 3.463 N/A LYS 306.A NZ ASP 302.A OD1 no hydrogen 3.353 N/A LYS 306.A NZ ASP 302.A OD2 no hydrogen 3.354 N/A ILE 307.A N GLN 303.A O no hydrogen 3.114 N/A CYS 308.A N PHE 304.A O no hydrogen 3.242 N/A LEU 309.A N LEU 305.A O no hydrogen 2.849 N/A ALA 310.A N LYS 306.A O no hydrogen 2.722 N/A GLU 311.A N ILE 307.A O no hydrogen 2.941 N/A ASP 312.A N CYS 308.A O no hydrogen 3.186 N/A ASP 312.A N LEU 309.A O no hydrogen 3.273 N/A GLU 313.A N LEU 309.A O no hydrogen 3.377 N/A GLY 314.A N ALA 310.A O no hydrogen 3.173 N/A LEU 315.A N ALA 310.A O no hydrogen 3.023 N/A THR 317.A N THR 270.A O no hydrogen 2.690 N/A THR 317.A OG1 THR 270.A O no hydrogen 3.364 N/A THR 317.A OG1 THR 270.A OG1 no hydrogen 2.821 N/A THR 318.A OG1 ASN 268.A O no hydrogen 2.596 N/A THR 318.A OG1 ASP 319.A O no hydrogen 3.467 N/A ASP 319.A N ASN 268.A O no hydrogen 3.077 N/A SER 321.A N LYS 266.A O no hydrogen 3.105 N/A LYS 325.A N ASN 293.A OD1 no hydrogen 3.194 N/A LYS 325.A NZ SER 321.A OG no hydrogen 3.115 N/A LYS 325.A NZ ASP 323.A O no hydrogen 3.065 N/A TYR 328.A N ASP 323.A OD1 no hydrogen 2.513 N/A GLU 330.A N THR 327.A OG1 no hydrogen 3.363 N/A GLU 331.A N THR 327.A O no hydrogen 3.140 N/A ILE 332.A N TYR 328.A O no hydrogen 3.266 N/A ILE 332.A N PHE 329.A O no hydrogen 3.192 N/A LYS 333.A N PHE 329.A O no hydrogen 2.953 N/A LYS 333.A NZ GLU 330.A OE1 no hydrogen 3.242 N/A LYS 333.A NZ GLU 330.A OE2 no hydrogen 3.360 N/A PHE 335.A N ILE 332.A O no hydrogen 3.214 N/A TYR 336.A N LYS 333.A O no hydrogen 3.418 N/A ARG 338.A N ASN 349.A OD1 no hydrogen 3.201 N/A ARG 338.A NH1 THR 210.A O no hydrogen 3.013 N/A ARG 338.A NH2 GLU 340.A OE1 no hydrogen 3.410 N/A GLN 346.A N SER 342.A O no hydrogen 3.157 N/A GLN 346.A N HIS 343.A O no hydrogen 2.787 N/A GLU 347.A N HIS 343.A O no hydrogen 3.242 N/A GLU 347.A N GLU 347.A OE1 no hydrogen 3.142 N/A TRP 348.A N GLN 344.A O no hydrogen 3.250 N/A TRP 348.A NE1 ALA 215.A O no hydrogen 2.906 N/A ASN 349.A N VAL 345.A O no hydrogen 2.628 N/A ARG 350.A N GLN 346.A O no hydrogen 2.606 N/A GLN 351.A N GLU 347.A O no hydrogen 2.714 N/A ARG 352.A N TRP 348.A O no hydrogen 2.907 N/A ARG 352.A NE ASN 349.A OD1 no hydrogen 3.005 N/A ARG 352.A NH2 ASN 349.A OD1 no hydrogen 2.385 N/A THR 353.A N ASN 349.A O no hydrogen 2.901 N/A MET 354.A N ARG 350.A O no hydrogen 3.185 N/A ALA 355.A N GLN 351.A O no hydrogen 3.025 N/A ILE 356.A N ARG 352.A O no hydrogen 3.129 N/A ALA 359.A N ALA 355.A O no hydrogen 3.299 N/A LEU 360.A N ILE 356.A O no hydrogen 3.316 N/A GLN 361.A N GLU 357.A O no hydrogen 2.757 N/A GLN 362.A N ARG 358.A O no hydrogen 2.804 N/A PHE 363.A N ALA 359.A O no hydrogen 3.239 N/A LEU 364.A N ALA 359.A O no hydrogen 2.729 N/A TYR 365.A N LEU 360.A O no hydrogen 2.835 N/A TYR 365.A OH ASP 323.A OD2 no hydrogen 3.162 N/A GLN 367.A N PHE 363.A O no hydrogen 3.267 N/A MET 368.A N LEU 364.A O no hydrogen 2.824 N/A LYS 370.A N VAL 366.A O no hydrogen 3.204 N/A GLU 371.A N GLN 367.A O no hydrogen 3.091 N/A LEU 372.A N MET 368.A O no hydrogen 2.865 N/A LYS 373.A N ALA 369.A O no hydrogen 2.923 N/A ASN 374.A N LYS 370.A O no hydrogen 2.999 N/A LYS 375.A N GLU 371.A O no hydrogen 3.033 N/A LEU 376.A N LEU 372.A O no hydrogen 2.804 N/A LEU 377.A N LYS 373.A O no hydrogen 2.853 N/A ALA 378.A N ASN 374.A O no hydrogen 2.959 N/A GLU 379.A N LYS 375.A O no hydrogen 3.034 N/A ALA 380.A N LEU 376.A O no hydrogen 2.976 N/A LYS 381.A N LEU 377.A O no hydrogen 2.676 N/A GLU 382.A N ALA 378.A O no hydrogen 3.135 N/A TYR 383.A N GLU 379.A O no hydrogen 2.957 N/A VAL 384.A N ALA 380.A O no hydrogen 3.465 N/A ILE 385.A N LYS 381.A O no hydrogen 3.353 N/A LYS 386.A N GLU 382.A O no hydrogen 2.839 N/A ALA 387.A N TYR 383.A O no hydrogen 2.748 N/A CYS 388.A N VAL 384.A O no hydrogen 2.529 N/A CYS 388.A SG VAL 384.A O no hydrogen 3.151 N/A SER 389.A N LYS 386.A O no hydrogen 3.004 N/A SER 389.A OG ILE 385.A O no hydrogen 2.746 N/A SER 389.A OG ALA 563.A O no hydrogen 3.145 N/A ARG 390.A N LYS 386.A O no hydrogen 2.879 N/A LYS 391.A N ALA 387.A O no hydrogen 3.275 N/A TYR 393.A N SER 389.A O no hydrogen 2.880 N/A ASN 394.A N ARG 390.A O no hydrogen 3.038 N/A TRP 395.A N LYS 391.A O no hydrogen 3.062 N/A LEU 396.A N TYR 393.A O no hydrogen 3.311 N/A ARG 397.A N ASN 394.A O no hydrogen 3.315 N/A ALA 399.A N THR 727.A O no hydrogen 2.536 N/A TYR 401.A N ILE 526.A O no hydrogen 3.243 N/A ARG 405.A N HIS 461.A ND1 no hydrogen 3.059 N/A ARG 405.A NH2 THR 431.A OG1 no hydrogen 3.421 N/A GLY 408.A N ALA 422.A O no hydrogen 3.395 N/A ILE 409.A N THR 464.A O no hydrogen 2.409 N/A ALA 410.A N PHE 420.A O no hydrogen 3.362 N/A SER 412.A OG GLU 468.A OE1 no hydrogen 3.289 N/A ALA 414.A N HIS 417.A NE2 no hydrogen 3.049 N/A PHE 420.A N ALA 410.A O no hydrogen 3.228 N/A CYS 421.A N LEU 434.A O no hydrogen 3.125 N/A CYS 421.A SG LEU 434.A O no hydrogen 3.805 N/A LEU 423.A N ASP 432.A O no hydrogen 2.725 N/A ASN 425.A N GLU 429.A O no hydrogen 2.427 N/A GLY 426.A N ASN 425.A OD1 no hydrogen 2.880 N/A THR 431.A N LEU 423.A O no hydrogen 3.109 N/A LEU 434.A N CYS 421.A O no hydrogen 3.086 N/A LEU 436.A N VAL 419.A O no hydrogen 2.572 N/A HIS 438.A N LEU 436.A O no hydrogen 2.756 N/A HIS 438.A ND1 LEU 436.A O no hydrogen 3.297 N/A LYS 444.A N GLU 440.A O no hydrogen 3.113 N/A LYS 444.A N ARG 441.A O no hydrogen 3.093 N/A GLN 446.A N LYS 443.A O no hydrogen 3.108 N/A ASP 447.A N LYS 443.A O no hydrogen 3.305 N/A ILE 448.A N LYS 444.A O no hydrogen 2.872 N/A GLU 449.A N ALA 445.A O no hydrogen 3.137 N/A THR 450.A N GLN 446.A O no hydrogen 3.330 N/A LEU 451.A N ILE 448.A O no hydrogen 3.374 N/A PHE 454.A N THR 450.A O no hydrogen 3.257 N/A LEU 455.A N LEU 451.A O no hydrogen 3.112 N/A LEU 456.A N LYS 452.A O no hydrogen 2.936 N/A ASN 457.A N PHE 454.A O no hydrogen 3.170 N/A LYS 458.A N PHE 454.A O no hydrogen 3.310 N/A LYS 458.A NZ ASP 432.A OD2 no hydrogen 3.423 N/A LYS 458.A NZ ASN 457.A OD1 no hydrogen 3.073 N/A LYS 459.A NZ ASN 457.A O no hydrogen 3.165 N/A HIS 461.A N ARG 405.A O no hydrogen 2.687 N/A HIS 461.A ND1 ARG 405.A O no hydrogen 3.116 N/A VAL 463.A N GLY 487.A O no hydrogen 2.781 N/A THR 464.A N LEU 407.A O no hydrogen 3.014 N/A THR 464.A OG1 LEU 407.A O no hydrogen 3.413 N/A VAL 465.A N GLU 489.A O no hydrogen 2.931 N/A ALA 466.A N ILE 409.A O no hydrogen 2.542 N/A GLY 467.A N VAL 491.A O no hydrogen 3.332 N/A GLN 473.A N ARG 470.A O no hydrogen 3.160 N/A ILE 476.A N ALA 472.A O no hydrogen 3.174 N/A ASP 478.A N MET 474.A O no hydrogen 3.225 N/A VAL 479.A N LEU 475.A O no hydrogen 3.020 N/A LYS 480.A N ILE 476.A O no hydrogen 2.878 N/A ARG 481.A N GLU 477.A O no hydrogen 2.923 N/A ARG 481.A N ASP 478.A O no hydrogen 3.201 N/A ILE 482.A N ASP 478.A O no hydrogen 2.960 N/A VAL 483.A N VAL 479.A O no hydrogen 2.936 N/A HIS 484.A N LYS 480.A O no hydrogen 2.905 N/A HIS 484.A ND1 HIS 484.A O no hydrogen 3.224 N/A GLU 485.A N ARG 481.A O no hydrogen 2.955 N/A GLY 487.A N HIS 461.A O no hydrogen 3.393 N/A GLU 489.A N VAL 463.A O no hydrogen 2.883 N/A VAL 491.A N VAL 465.A O no hydrogen 3.059 N/A ASN 493.A N ASP 492.A OD1 no hydrogen 2.652 N/A ASN 493.A ND2 GLN 518.A OE1 no hydrogen 3.010 N/A GLU 494.A N GLU 494.A OE2 no hydrogen 2.712 N/A ILE 497.A N ASN 493.A O no hydrogen 2.911 N/A TYR 499.A N LEU 495.A O no hydrogen 2.558 N/A TYR 499.A OH GLU 508.A OE2 no hydrogen 2.437 N/A MET 500.A N ALA 496.A O no hydrogen 2.834 N/A ASN 501.A N ILE 497.A O no hydrogen 3.316 N/A SER 502.A OG TYR 499.A O no hydrogen 2.463 N/A SER 505.A OG TYR 499.A O no hydrogen 2.752 N/A SER 505.A OG SER 502.A O no hydrogen 3.161 N/A SER 505.A OG SER 502.A OG no hydrogen 3.282 N/A ALA 507.A N LYS 503.A O no hydrogen 3.254 N/A GLU 508.A N LYS 504.A O no hydrogen 3.318 N/A PHE 509.A N SER 505.A O no hydrogen 2.406 N/A ARG 510.A NH1 ARG 510.A O no hydrogen 3.269 N/A ARG 517.A N PRO 513.A O no hydrogen 2.967 N/A ARG 517.A NH1 TYR 512.A O no hydrogen 2.616 N/A GLN 518.A N PRO 514.A O no hydrogen 2.972 N/A ALA 519.A N VAL 515.A O no hydrogen 2.957 N/A VAL 520.A N LEU 516.A O no hydrogen 2.952 N/A VAL 520.A N ARG 517.A O no hydrogen 3.348 N/A SER 521.A N GLN 518.A O no hydrogen 3.213 N/A SER 521.A OG GLN 518.A O no hydrogen 3.385 N/A ARG 524.A N VAL 520.A O no hydrogen 3.015 N/A ARG 524.A NE GLY 428.A O no hydrogen 3.199 N/A ARG 524.A NH1 GLU 508.A OE2 no hydrogen 3.076 N/A ARG 524.A NH2 GLY 428.A O no hydrogen 3.437 N/A ARG 525.A N SER 521.A O no hydrogen 2.359 N/A ARG 525.A NH1 GLU 494.A OE1 no hydrogen 2.852 N/A ILE 526.A N LEU 522.A O no hydrogen 3.005 N/A GLN 527.A NE2 ILE 404.A O no hydrogen 3.616 N/A ASP 528.A N ARG 524.A O no hydrogen 3.095 N/A PHE 533.A N PRO 529.A O no hydrogen 3.286 N/A ALA 534.A N LEU 530.A O no hydrogen 3.216 N/A GLN 535.A N ILE 531.A O no hydrogen 3.356 N/A GLN 535.A NE2 GLN 535.A O no hydrogen 3.647 N/A VAL 536.A N GLU 532.A O no hydrogen 2.781 N/A CYS 537.A N PHE 533.A O no hydrogen 2.851 N/A SER 538.A OG GLN 535.A O no hydrogen 2.954 N/A ILE 543.A N SER 539.A O no hydrogen 3.125 N/A LEU 544.A N ASP 540.A O no hydrogen 3.369 N/A CYS 545.A N GLU 541.A O no hydrogen 3.094 N/A CYS 545.A N ASP 542.A O no hydrogen 3.120 N/A CYS 545.A SG GLU 541.A O no hydrogen 3.221 N/A LYS 547.A NZ HIS 549.A O no hydrogen 3.424 N/A PHE 548.A N GLN 552.A OE1 no hydrogen 3.181 N/A LEU 551.A N HIS 549.A ND1 no hydrogen 3.306 N/A GLN 552.A NE2 LEU 546.A O no hydrogen 2.766 N/A HIS 554.A N LEU 551.A O no hydrogen 2.798 N/A LEU 560.A N VAL 556.A O no hydrogen 3.015 N/A LEU 561.A N LYS 557.A O no hydrogen 2.865 N/A ASN 562.A N GLU 558.A O no hydrogen 3.193 N/A ALA 563.A N GLU 559.A O no hydrogen 3.055 N/A LEU 564.A N LEU 560.A O no hydrogen 3.121 N/A TYR 565.A N LEU 561.A O no hydrogen 2.725 N/A CYS 566.A N ASN 562.A O no hydrogen 2.788 N/A CYS 566.A SG ASN 562.A O no hydrogen 3.580 N/A CYS 566.A SG ALA 563.A O no hydrogen 3.165 N/A GLU 567.A N LEU 564.A O no hydrogen 3.202 N/A PHE 568.A N LEU 564.A O no hydrogen 3.354 N/A ILE 569.A N TYR 565.A O no hydrogen 3.175 N/A ASN 570.A N CYS 566.A O no hydrogen 2.724 N/A ASN 570.A ND2 ASN 89.A OD1 no hydrogen 3.156 N/A ARG 571.A N GLU 567.A O no hydrogen 3.105 N/A VAL 572.A N PHE 568.A O no hydrogen 2.702 N/A ASN 573.A ND2 ILE 569.A O no hydrogen 2.339 N/A ASN 573.A ND2 TYR 594.A O no hydrogen 3.175 N/A GLU 574.A N ASN 570.A O no hydrogen 3.232 N/A VAL 575.A N ARG 571.A O no hydrogen 2.750 N/A GLY 576.A N VAL 572.A O no hydrogen 2.504 N/A VAL 579.A N LYS 642.A O no hydrogen 3.344 N/A ARG 581.A N ASP 578.A OD2 no hydrogen 3.303 N/A ALA 582.A N VAL 579.A O no hydrogen 2.533 N/A ILE 583.A N VAL 579.A O no hydrogen 3.291 N/A HIS 585.A N ARG 581.A O no hydrogen 2.677 N/A TYR 587.A OH GLU 532.A OE1 no hydrogen 3.318 N/A SER 588.A N HIS 585.A O no hydrogen 3.436 N/A SER 588.A OG SER 588.A O no hydrogen 2.456 N/A GLN 589.A N PRO 586.A O no hydrogen 3.164 N/A TYR 594.A N LEU 591.A O no hydrogen 3.260 N/A VAL 595.A N ILE 592.A O no hydrogen 3.244 N/A CYS 596.A N ASN 573.A OD1 no hydrogen 3.184 N/A CYS 596.A SG ASN 636.A O no hydrogen 3.239 N/A GLY 597.A N GLU 70.A OE2 no hydrogen 3.066 N/A ARG 601.A N GLU 13.A OE1 no hydrogen 2.764 N/A LYS 602.A N GLU 13.A OE2 no hydrogen 3.099 N/A LYS 602.A NZ ILE 6.A O no hydrogen 2.538 N/A LYS 602.A NZ THR 9.A O no hydrogen 3.050 N/A GLY 603.A N GLY 599.A O no hydrogen 3.248 N/A THR 604.A OG1 PRO 600.A O no hydrogen 3.209 N/A THR 604.A OG1 ARG 601.A O no hydrogen 2.733 N/A HIS 605.A N ARG 601.A O no hydrogen 2.910 N/A LEU 606.A N LYS 602.A O no hydrogen 2.766 N/A LEU 607.A N GLY 603.A O no hydrogen 3.409 N/A LYS 608.A N THR 604.A O no hydrogen 3.177 N/A ILE 609.A N HIS 605.A O no hydrogen 2.975 N/A LEU 610.A N LEU 606.A O no hydrogen 3.170 N/A LYS 611.A N LEU 607.A O no hydrogen 3.174 N/A GLN 612.A N LYS 608.A O no hydrogen 3.007 N/A GLN 612.A N ILE 609.A O no hydrogen 3.017 N/A ASN 613.A N ILE 609.A O no hydrogen 3.130 N/A ASN 613.A ND2 MET 626.A O no hydrogen 3.681 N/A ASN 614.A N LEU 610.A O no hydrogen 2.510 N/A GLU 618.A N GLN 622.A OE1 no hydrogen 2.772 N/A ARG 620.A NH1 VAL 656.A O no hydrogen 2.394 N/A ARG 620.A NH2 SER 654.A O no hydrogen 2.456 N/A GLN 622.A N SER 619.A O no hydrogen 3.191 N/A GLN 622.A NE2 ARG 616.A O no hydrogen 2.813 N/A LEU 623.A N ARG 620.A O no hydrogen 3.069 N/A THR 625.A N THR 621.A O no hydrogen 3.457 N/A THR 625.A OG1 THR 621.A O no hydrogen 3.155 N/A CYS 627.A N GLN 622.A O no hydrogen 2.706 N/A HIS 628.A N THR 625.A O no hydrogen 2.949 N/A MET 629.A N LEU 623.A O no hydrogen 3.404 N/A MET 629.A N VAL 624.A O no hydrogen 3.249 N/A LYS 632.A N ASP 10.A OD2 no hydrogen 3.468 N/A LYS 632.A NZ GLN 67.A O no hydrogen 2.260 N/A LYS 632.A NZ HIS 68.A O no hydrogen 3.446 N/A VAL 633.A N ASP 10.A OD1 no hydrogen 3.344 N/A PHE 634.A N GLY 630.A O no hydrogen 2.784 N/A MET 635.A N PRO 631.A O no hydrogen 3.028 N/A MET 635.A N LYS 632.A O no hydrogen 3.295 N/A ASN 636.A N VAL 633.A O no hydrogen 2.933 N/A CYS 637.A N VAL 633.A O no hydrogen 2.922 N/A CYS 637.A SG CYS 596.A O no hydrogen 3.167 N/A CYS 637.A SG VAL 633.A O no hydrogen 3.184 N/A ALA 638.A N PHE 634.A O no hydrogen 3.202 N/A PHE 640.A N CYS 637.A O no hydrogen 3.153 N/A ASP 652.A N GLU 649.A O no hydrogen 3.244 N/A GLY 653.A N VAL 650.A O no hydrogen 3.183 N/A SER 654.A OG LEU 651.A O no hydrogen 2.489 N/A ARG 655.A NH1 LYS 723.A O no hydrogen 3.022 N/A GLU 659.A N HIS 657.A ND1 no hydrogen 3.267 N/A THR 660.A N HIS 657.A O no hydrogen 3.128 N/A THR 660.A OG1 THR 660.A O no hydrogen 2.544 N/A TYR 661.A N PRO 658.A O no hydrogen 3.293 N/A TYR 661.A OH ASP 652.A OD1 no hydrogen 2.222 N/A GLU 662.A N GLU 662.A OE1 no hydrogen 2.855 N/A ALA 664.A N TYR 661.A O no hydrogen 2.978 N/A ARG 665.A N TYR 661.A O no hydrogen 3.034 N/A ARG 665.A NH1 GLU 649.A OE2 no hydrogen 3.335 N/A ARG 665.A NH2 GLU 649.A OE2 no hydrogen 3.348 N/A LYS 666.A N GLU 662.A O no hydrogen 3.194 N/A MET 667.A N ALA 664.A O no hydrogen 3.129 N/A ALA 668.A N ARG 665.A O no hydrogen 2.804 N/A VAL 669.A N ARG 665.A O no hydrogen 2.487 N/A ALA 671.A N ALA 668.A O no hydrogen 3.123 N/A LEU 672.A N VAL 669.A O no hydrogen 3.336 N/A LEU 677.A N ALA 674.A O no hydrogen 3.357 N/A GLU 682.A N GLU 678.A O no hydrogen 3.042 N/A GLU 685.A N GLU 685.A OE1 no hydrogen 2.527 N/A PHE 695.A N ASP 691.A O no hydrogen 2.928 N/A ALA 696.A N ASP 693.A O no hydrogen 2.761 N/A GLU 697.A N GLU 697.A OE1 no hydrogen 2.813 N/A GLU 698.A N ALA 694.A O no hydrogen 3.416 N/A LEU 699.A N PHE 695.A O no hydrogen 2.450 N/A GLU 700.A N ALA 696.A O no hydrogen 2.549 N/A ARG 701.A N GLU 697.A O no hydrogen 2.928 N/A GLN 702.A N GLU 698.A O no hydrogen 2.887 N/A GLY 705.A N LEU 699.A O no hydrogen 3.489 N/A THR 710.A OG1 GLU 80.A OE2 no hydrogen 2.333 N/A LEU 711.A N LYS 707.A O no hydrogen 3.141 N/A ASP 713.A N ILE 709.A O no hydrogen 3.359 N/A ASP 713.A N THR 710.A O no hydrogen 3.092 N/A ILE 714.A N THR 710.A O no hydrogen 3.013 N/A ARG 715.A N LEU 711.A O no hydrogen 2.725 N/A ALA 716.A N TYR 712.A O no hydrogen 3.378 N/A GLU 717.A N ASP 713.A O no hydrogen 2.549 N/A LEU 718.A N ILE 714.A O no hydrogen 3.151 N/A SER 719.A OG ARG 715.A O no hydrogen 3.275 N/A CYS 720.A N ALA 716.A O no hydrogen 3.481 N/A ARG 721.A NE GLY 653.A O no hydrogen 3.133 N/A TYR 722.A N GLU 717.A OE2 no hydrogen 2.969 N/A ARG 726.A NH1 ASP 528.A OD1 no hydrogen 2.766 N/A ARG 726.A NH1 ASP 528.A OD2 no hydrogen 3.449 N/A ARG 726.A NH2 ASP 724.A OD2 no hydrogen 2.364 N/A THR 727.A OG1 ARG 397.A O no hydrogen 2.381 N/A SER 731.A OG GLU 489.A OE1 no hydrogen 2.753 N/A SER 731.A OG GLU 489.A OE2 no hydrogen 2.956 N/A THR 734.A OG1 ILE 803.A O no hydrogen 3.206 N/A GLU 736.A N GLU 736.A OE1 no hydrogen 2.724 N/A ILE 737.A N ASN 733.A O no hydrogen 2.977 N/A PHE 738.A N THR 734.A O no hydrogen 2.710 N/A ASN 739.A N GLU 735.A O no hydrogen 3.021 N/A ASN 739.A ND2 GLU 735.A O no hydrogen 2.510 N/A ASN 739.A ND2 GLU 735.A OE1 no hydrogen 2.551 N/A MET 740.A N GLU 736.A O no hydrogen 2.638 N/A LEU 741.A N ILE 737.A O no hydrogen 3.413 N/A THR 742.A N PHE 738.A O no hydrogen 3.361 N/A THR 742.A OG1 PHE 738.A O no hydrogen 2.523 N/A THR 742.A OG1 GLU 744.A O no hydrogen 3.301 N/A LYS 743.A NZ GLY 467.A O no hydrogen 3.183 N/A LYS 743.A NZ GLU 468.A O no hydrogen 2.890 N/A LYS 743.A NZ MET 740.A O no hydrogen 3.022 N/A THR 745.A N THR 748.A OG1 no hydrogen 3.012 N/A THR 748.A N THR 745.A O no hydrogen 2.546 N/A THR 748.A OG1 GLU 744.A OE1 no hydrogen 2.193 N/A THR 748.A OG1 THR 745.A O no hydrogen 2.929 N/A PHE 749.A N THR 745.A O no hydrogen 2.769 N/A LYS 753.A NZ THR 748.A O no hydrogen 2.938 N/A ILE 755.A N CYS 796.A O no hydrogen 2.539 N/A CYS 757.A SG VAL 794.A O no hydrogen 3.205 N/A ASN 758.A N ARG 769.A O no hydrogen 2.782 N/A THR 768.A N GLY 776.A O no hydrogen 2.729 N/A THR 768.A OG1 GLY 776.A O no hydrogen 2.663 N/A ARG 769.A N ASN 758.A O no hydrogen 2.459 N/A LEU 770.A N VAL 774.A O no hydrogen 3.212 N/A GLY 773.A N LEU 770.A O no hydrogen 3.029 N/A THR 775.A N PHE 806.A O no hydrogen 3.076 N/A THR 775.A OG1 PHE 806.A O no hydrogen 3.056 N/A GLY 776.A N THR 768.A O no hydrogen 2.445 N/A ILE 778.A N VAL 766.A O no hydrogen 2.723 N/A PHE 782.A N PRO 779.A O no hydrogen 3.006 N/A LEU 783.A N THR 780.A O no hydrogen 2.945 N/A GLU 785.A N GLU 785.A OE1 no hydrogen 2.812 N/A GLU 786.A N GLU 786.A OE1 no hydrogen 2.628 N/A THR 793.A OG1 CYS 757.A O no hydrogen 3.350 N/A CYS 796.A N ILE 755.A O no hydrogen 3.103 N/A CYS 796.A SG VAL 794.A O no hydrogen 3.503 N/A ARG 797.A NE GLY 752.A O no hydrogen 3.084 N/A ASP 802.A N SER 807.A O no hydrogen 3.283 N/A ILE 803.A N GLU 804.A OE1 no hydrogen 3.403 N/A GLU 804.A N GLU 804.A OE1 no hydrogen 2.726 N/A LYS 805.A N ASP 802.A OD1 no hydrogen 3.136 N/A SER 807.A N ASP 802.A OD1 no hydrogen 2.919 N/A ALA 808.A N THR 775.A O no hydrogen 3.020 N/A ASP 809.A N LYS 800.A O no hydrogen 3.138 N/A THR 811.A OG1 ASP 816.A OD2 no hydrogen 2.614 N/A ARG 813.A N THR 811.A OG1 no hydrogen 3.341 N/A ARG 813.A NH2 ASP 816.A OD1 no hydrogen 2.817 N/A ASP 816.A N ARG 813.A O no hydrogen 3.233 N/A