Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xk1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 6.A N VAL 26.A O no hydrogen 2.771 N/A CYS 6.A SG VAL 26.A O no hydrogen 3.358 N/A MET 9.A N HIS 30.A O no hydrogen 2.833 N/A ILE 11.A N GLN 32.A O no hydrogen 2.876 N/A ARG 12.A NE ASP 10.A OD1 no hydrogen 3.261 N/A THR 16.A N ASN 14.A OD1 no hydrogen 2.862 N/A THR 16.A OG1 ASN 14.A OD1 no hydrogen 2.302 N/A ARG 17.A NE GLU 20.A OE2 no hydrogen 2.535 N/A ARG 17.A NH1 ASP 10.A O no hydrogen 2.633 N/A ARG 17.A NH2 ASP 10.A O no hydrogen 3.389 N/A ARG 17.A NH2 GLU 20.A OE1 no hydrogen 2.634 N/A LEU 18.A N LEU 15.A O no hydrogen 2.889 N/A HIS 19.A N THR 16.A O no hydrogen 2.911 N/A GLU 20.A N ARG 17.A O no hydrogen 2.917 N/A LEU 21.A N LEU 18.A O no hydrogen 3.290 N/A ASN 23.A ND2 GLU 22.A OE2 no hydrogen 2.385 N/A SER 25.A N GLU 4.A O no hydrogen 2.883 N/A SER 25.A OG LYS 51.A O no hydrogen 2.564 N/A ILE 27.A N MET 54.A O no hydrogen 3.015 N/A GLU 28.A N CYS 6.A O no hydrogen 2.729 N/A LEU 31.A N TYR 58.A O no hydrogen 3.104 N/A GLN 32.A N MET 9.A O no hydrogen 2.955 N/A GLN 32.A NE2 ASP 10.A OD2 no hydrogen 2.408 N/A ILE 33.A N LEU 60.A O no hydrogen 2.933 N/A LEU 34.A N ILE 11.A O no hydrogen 2.930 N/A LEU 35.A N PHE 62.A O no hydrogen 3.119 N/A MET 36.A N ARG 63.A O no hydrogen 2.798 N/A THR 39.A OG1 MET 36.A O no hydrogen 3.108 N/A THR 39.A OG1 PHE 37.A O no hydrogen 3.126 N/A ARG 40.A N ASP 43.A OD2 no hydrogen 2.640 N/A GLU 42.A N GLU 42.A OE1 no hydrogen 2.827 N/A ASP 43.A N ARG 40.A O no hydrogen 2.860 N/A PHE 44.A N PRO 41.A O no hydrogen 2.992 N/A ARG 45.A NE ARG 45.A O no hydrogen 3.120 N/A SER 48.A OG ASP 72.A O no hydrogen 2.566 N/A PHE 49.A N LEU 73.A O no hydrogen 3.091 N/A LYS 51.A NZ ASN 23.A OD1 no hydrogen 2.393 N/A ILE 53.A N SER 25.A O no hydrogen 2.800 N/A MET 54.A N SER 25.A O no hydrogen 3.219 N/A ILE 55.A N VAL 79.A O no hydrogen 3.237 N/A THR 56.A N ILE 27.A O no hydrogen 3.109 N/A THR 56.A OG1 ILE 27.A O no hydrogen 2.747 N/A THR 56.A OG1 GLY 29.A O no hydrogen 3.011 N/A THR 56.A OG1 ASP 57.A OD1 no hydrogen 3.210 N/A ASP 57.A N GLY 29.A O no hydrogen 2.792 N/A TYR 58.A OH GLN 32.A OE1 no hydrogen 2.415 N/A LEU 59.A N ALA 90.A O no hydrogen 2.925 N/A LEU 60.A N LEU 31.A O no hydrogen 2.910 N/A LEU 61.A N VAL 92.A O no hydrogen 2.924 N/A PHE 62.A N ILE 33.A O no hydrogen 2.961 N/A ARG 63.A N PHE 94.A O no hydrogen 3.461 N/A ARG 63.A NE GLU 95.A OE1 no hydrogen 2.617 N/A ARG 63.A NH2 GLU 95.A OE1 no hydrogen 2.575 N/A TYR 65.A N MET 36.A O no hydrogen 3.346 N/A LEU 70.A N LEU 102.A O no hydrogen 3.390 N/A LYS 71.A NZ GLU 101.A OE2 no hydrogen 3.456 N/A LYS 71.A NZ SER 175.A OG no hydrogen 3.391 N/A PHE 74.A N LEU 70.A O no hydrogen 3.076 N/A ASN 76.A ND2 PRO 50.A O no hydrogen 2.367 N/A THR 78.A N ILE 53.A O no hydrogen 2.509 N/A THR 78.A OG1 ILE 53.A O no hydrogen 3.376 N/A THR 78.A OG1 ASN 76.A O no hydrogen 3.095 N/A ILE 80.A N ASN 108.A O no hydrogen 3.259 N/A ARG 81.A N ILE 55.A O no hydrogen 3.143 N/A ARG 81.A NH2 CYS 217.A O no hydrogen 3.448 N/A ARG 81.A NH2 ASN 219.A O no hydrogen 3.463 N/A GLY 82.A N THR 56.A O no hydrogen 2.786 N/A SER 83.A N THR 56.A O no hydrogen 3.250 N/A ARG 84.A NE ASP 57.A OD2 no hydrogen 2.799 N/A ARG 84.A NH2 ASP 57.A OD2 no hydrogen 2.956 N/A PHE 86.A N TYR 89.A O no hydrogen 3.027 N/A ALA 90.A N SER 113.A O no hydrogen 2.706 N/A VAL 92.A N LEU 59.A O no hydrogen 2.919 N/A ILE 93.A N ARG 115.A O no hydrogen 3.160 N/A PHE 94.A N LEU 61.A O no hydrogen 2.928 N/A GLU 95.A N GLU 117.A O no hydrogen 3.224 N/A LYS 100.A N GLU 68.A O no hydrogen 2.571 N/A GLU 101.A N GLU 68.A O no hydrogen 3.304 N/A MET 107.A N THR 78.A O no hydrogen 2.848 N/A ILE 109.A N ILE 133.A O no hydrogen 2.762 N/A THR 110.A OG1 ARG 81.A O no hydrogen 2.517 N/A ARG 111.A N ARG 81.A O no hydrogen 3.103 N/A ARG 111.A NE GLU 342.A OE2 no hydrogen 2.691 N/A ARG 111.A NH1 GLN 317.A OE1 no hydrogen 3.105 N/A ARG 111.A NH2 GLN 317.A OE1 no hydrogen 2.360 N/A ARG 111.A NH2 GLU 342.A OE1 no hydrogen 3.460 N/A ARG 111.A NH2 GLU 342.A OE2 no hydrogen 3.035 N/A SER 113.A OG ASP 139.A OD1 no hydrogen 2.462 N/A VAL 114.A N ASN 140.A OD1 no hydrogen 2.616 N/A ARG 115.A N LEU 91.A O no hydrogen 3.066 N/A ARG 115.A NE GLU 117.A OE1 no hydrogen 2.726 N/A ARG 115.A NH1 TYR 89.A OH no hydrogen 3.287 N/A ARG 115.A NH2 GLU 117.A OE1 no hydrogen 2.638 N/A GLU 117.A N ILE 93.A O no hydrogen 3.266 N/A CYS 123.A N LYS 100.A O no hydrogen 2.321 N/A CYS 123.A SG GLU 121.A O no hydrogen 3.992 N/A LEU 125.A N ASP 147.A OD2 no hydrogen 2.698 N/A THR 127.A OG1 CYS 171.A O no hydrogen 2.462 N/A ILE 128.A N LEU 125.A O no hydrogen 3.353 N/A ILE 133.A N TRP 130.A O no hydrogen 3.211 N/A LEU 134.A N TRP 130.A O no hydrogen 2.900 N/A VAL 137.A N ASP 135.A O no hydrogen 3.061 N/A GLU 138.A N GLU 138.A OE1 no hydrogen 2.423 N/A ASP 139.A N SER 136.A O no hydrogen 3.290 N/A ASN 140.A N VAL 137.A O no hydrogen 2.924 N/A TYR 141.A N VAL 114.A O no hydrogen 3.267 N/A LEU 144.A N ASP 148.A OD2 no hydrogen 3.309 N/A LYS 146.A NZ GLU 151.A OE1 no hydrogen 2.825 N/A ASP 148.A N ASN 145.A O no hydrogen 3.353 N/A ASN 149.A N LYS 146.A O no hydrogen 2.931 N/A CYS 152.A SG LEU 122.A O no hydrogen 3.810 N/A ASP 154.A N ASP 154.A OD1 no hydrogen 2.362 N/A CYS 156.A SG GLU 169.A OE2 no hydrogen 3.410 N/A CYS 158.A SG PRO 157.A O no hydrogen 3.198 N/A THR 161.A N VAL 168.A O no hydrogen 2.910 N/A ILE 163.A N GLN 166.A O no hydrogen 2.892 N/A GLN 166.A N ILE 163.A O no hydrogen 2.915 N/A VAL 168.A N THR 161.A O no hydrogen 2.893 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 2.861 N/A ARG 170.A N PRO 159.A O no hydrogen 2.971 N/A ARG 170.A NE THR 161.A OG1 no hydrogen 3.073 N/A CYS 171.A N THR 127.A OG1 no hydrogen 2.618 N/A CYS 171.A SG THR 127.A OG1 no hydrogen 3.321 N/A CYS 171.A SG THR 173.A O no hydrogen 3.933 N/A TRP 172.A N HIS 176.A O no hydrogen 3.239 N/A THR 173.A N HIS 176.A O no hydrogen 3.407 N/A THR 173.A OG1 HIS 176.A ND1 no hydrogen 2.994 N/A HIS 174.A ND1 ILE 155.A O no hydrogen 2.941 N/A SER 175.A N THR 173.A OG1 no hydrogen 3.283 N/A SER 175.A OG HIS 176.A ND1 no hydrogen 3.100 N/A HIS 176.A ND1 THR 173.A OG1 no hydrogen 2.994 N/A GLN 178.A NE2 ASP 129.A O no hydrogen 3.368 N/A GLN 178.A NE2 ASP 129.A OD1 no hydrogen 2.685 N/A VAL 180.A N GLN 178.A O no hydrogen 2.739 N/A CYS 181.A SG CYS 190.A O no hydrogen 3.557 N/A CYS 185.A SG GLY 194.A O no hydrogen 3.623 N/A LYS 186.A N PRO 182.A O no hydrogen 3.122 N/A LYS 186.A NZ HIS 188.A NE2 no hydrogen 3.179 N/A HIS 188.A ND1 SER 199.A O no hydrogen 2.980 N/A GLY 189.A N CYS 185.A O no hydrogen 3.236 N/A GLY 189.A N LYS 186.A O no hydrogen 3.003 N/A CYS 190.A SG THR 191.A O no hydrogen 3.400 N/A THR 191.A N LEU 195.A O no hydrogen 3.085 N/A THR 191.A OG1 GLU 193.A OE1 no hydrogen 3.167 N/A GLU 193.A N GLU 193.A OE1 no hydrogen 2.745 N/A GLY 194.A N THR 191.A O no hydrogen 3.261 N/A CYS 197.A N GLY 189.A O no hydrogen 2.608 N/A SER 199.A OG GLU 200.A OE2 no hydrogen 2.848 N/A GLU 200.A N HIS 198.A ND1 no hydrogen 3.069 N/A CYS 201.A N HIS 198.A O no hydrogen 3.014 N/A CYS 201.A SG ASP 210.A O no hydrogen 3.691 N/A LEU 202.A N ALA 216.A O no hydrogen 2.630 N/A GLY 203.A N SER 187.A O no hydrogen 3.297 N/A CYS 205.A SG GLN 207.A O no hydrogen 3.204 N/A SER 206.A N LYS 213.A O no hydrogen 2.809 N/A SER 206.A OG GLN 207.A OE1 no hydrogen 2.351 N/A SER 206.A OG LYS 213.A O no hydrogen 3.243 N/A THR 212.A N ASP 210.A OD1 no hydrogen 2.955 N/A THR 212.A OG1 ASP 210.A OD1 no hydrogen 2.715 N/A LYS 213.A N ASP 210.A O no hydrogen 3.104 N/A CYS 214.A SG ASP 210.A O no hydrogen 3.381 N/A CYS 214.A SG PRO 211.A O no hydrogen 3.446 N/A VAL 215.A N ASN 204.A O no hydrogen 3.104 N/A CYS 217.A N TYR 1.A OH no hydrogen 2.605 N/A ARG 218.A N GLU 200.A O no hydrogen 2.917 N/A ARG 218.A NE ASN 219.A OD1 no hydrogen 2.318 N/A ARG 218.A NH2 ASN 219.A OD1 no hydrogen 3.025 N/A ASN 219.A ND2 GLU 228.A O no hydrogen 3.686 N/A ASN 219.A ND2 GLU 228.A OE2 no hydrogen 3.268 N/A PHE 220.A N VAL 227.A O no hydrogen 3.309 N/A TYR 221.A N TRP 240.A O no hydrogen 2.894 N/A CYS 226.A N PRO 211.A O no hydrogen 3.066 N/A CYS 226.A SG PRO 211.A O no hydrogen 3.604 N/A VAL 227.A N PHE 220.A O no hydrogen 3.019 N/A CYS 230.A SG HIS 236.A ND1 no hydrogen 2.732 N/A TYR 234.A N PRO 231.A O no hydrogen 2.650 N/A TYR 235.A N VAL 243.A O no hydrogen 2.872 N/A HIS 236.A N ASN 271.A O no hydrogen 2.794 N/A PHE 237.A N ARG 241.A O no hydrogen 2.769 N/A ARG 241.A N GLN 238.A O no hydrogen 2.818 N/A ARG 241.A NH1 GLU 28.A OE2 no hydrogen 2.518 N/A ARG 241.A NH2 GLU 28.A OE2 no hydrogen 2.911 N/A CYS 242.A N TYR 221.A O no hydrogen 2.955 N/A VAL 243.A N TYR 235.A O no hydrogen 2.934 N/A PHE 247.A N ASN 244.A OD1 no hydrogen 2.753 N/A GLN 249.A N PHE 245.A O no hydrogen 2.950 N/A ASP 250.A N SER 246.A O no hydrogen 2.851 N/A LEU 251.A N PHE 247.A O no hydrogen 2.949 N/A HIS 252.A N CYS 248.A O no hydrogen 2.911 N/A HIS 252.A ND1 TYR 266.A O no hydrogen 3.027 N/A HIS 253.A N GLN 249.A O no hydrogen 2.903 N/A LYS 254.A N ASP 250.A O no hydrogen 2.870 N/A CYS 255.A N LEU 251.A O no hydrogen 2.940 N/A CYS 255.A SG HIS 264.A O no hydrogen 3.148 N/A LYS 256.A N HIS 252.A O no hydrogen 2.895 N/A ASN 257.A N HIS 253.A O no hydrogen 2.898 N/A SER 258.A N LYS 254.A O no hydrogen 2.920 N/A SER 258.A OG ASN 257.A OD1 no hydrogen 2.770 N/A ARG 259.A NH1 LYS 256.A O no hydrogen 2.623 N/A CYS 263.A SG ARG 260.A O no hydrogen 3.569 N/A GLN 265.A NE2 HIS 252.A O no hydrogen 3.442 N/A VAL 267.A N ILE 274.A O no hydrogen 2.879 N/A ILE 268.A N LEU 288.A O no hydrogen 3.169 N/A HIS 269.A N LYS 272.A O no hydrogen 2.889 N/A LYS 272.A N HIS 269.A O no hydrogen 2.902 N/A CYS 273.A N HIS 236.A O no hydrogen 2.363 N/A CYS 273.A SG VAL 267.A O no hydrogen 3.909 N/A ILE 274.A N VAL 267.A O no hydrogen 2.905 N/A CYS 277.A SG GLU 276.A OE2 no hydrogen 3.495 N/A SER 279.A OG THR 323.A OG1 no hydrogen 3.361 N/A GLY 280.A N CYS 297.A O no hydrogen 3.421 N/A THR 282.A N THR 291.A O no hydrogen 3.169 N/A THR 282.A OG1 MET 283.A O no hydrogen 3.368 N/A SER 285.A OG ASN 284.A O no hydrogen 2.561 N/A SER 286.A N SER 285.A OG no hydrogen 2.604 N/A SER 286.A OG ASN 284.A OD1 no hydrogen 3.510 N/A SER 286.A OG SER 285.A O no hydrogen 2.498 N/A SER 286.A OG ASN 287.A OD1 no hydrogen 2.804 N/A ASN 287.A N SER 286.A OG no hydrogen 2.370 N/A LEU 288.A N SER 285.A O no hydrogen 3.000 N/A LEU 289.A N ASN 287.A OD1 no hydrogen 3.094 N/A CYS 290.A SG ILE 268.A O no hydrogen 3.980 N/A CYS 293.A N GLY 280.A O no hydrogen 3.315 N/A CYS 293.A SG GLY 295.A O no hydrogen 3.139 N/A CYS 297.A SG GLY 295.A O no hydrogen 3.896 N/A LYS 299.A N SER 279.A OG no hydrogen 2.399 N/A CYS 301.A N VAL 324.A O no hydrogen 3.291 N/A LEU 303.A N CYS 301.A O no hydrogen 2.686 N/A GLY 306.A N LEU 303.A O no hydrogen 3.439 N/A LYS 308.A N SER 328.A O no hydrogen 3.043 N/A LYS 308.A NZ GLU 318.A OE1 no hydrogen 2.350 N/A ILE 310.A N ILE 330.A O no hydrogen 2.698 N/A SER 312.A OG ASP 311.A OD1 no hydrogen 3.327 N/A SER 312.A OG SER 315.A OG no hydrogen 2.732 N/A VAL 313.A N ASN 88.A OD1 no hydrogen 2.826 N/A SER 315.A N SER 312.A OG no hydrogen 3.357 N/A SER 315.A OG ASP 311.A OD1 no hydrogen 3.124 N/A SER 315.A OG SER 312.A OG no hydrogen 2.732 N/A ALA 316.A N SER 312.A O no hydrogen 3.331 N/A GLN 317.A N VAL 313.A O no hydrogen 2.872 N/A GLN 317.A NE2 SER 83.A O no hydrogen 3.246 N/A GLU 318.A N THR 314.A O no hydrogen 2.927 N/A LEU 319.A N ALA 316.A O no hydrogen 2.844 N/A ARG 320.A N GLN 317.A O no hydrogen 3.034 N/A CYS 322.A N LEU 319.A O no hydrogen 3.348 N/A THR 323.A N LYS 299.A O no hydrogen 3.212 N/A THR 323.A OG1 SER 279.A OG no hydrogen 3.361 N/A THR 323.A OG1 LYS 299.A O no hydrogen 3.218 N/A VAL 324.A N LYS 299.A O no hydrogen 3.051 N/A ILE 325.A N GLU 352.A O no hydrogen 3.073 N/A ASN 326.A ND2 HIS 302.A ND1 no hydrogen 2.932 N/A SER 328.A N GLY 306.A O no hydrogen 3.415 N/A LEU 329.A N TYR 356.A O no hydrogen 3.205 N/A ILE 330.A N LYS 308.A O no hydrogen 2.955 N/A ILE 331.A N LYS 358.A O no hydrogen 2.870 N/A ASN 332.A N ILE 310.A O no hydrogen 2.996 N/A ALA 340.A N ASN 338.A OD1 no hydrogen 3.267 N/A LEU 343.A N LEU 339.A O no hydrogen 3.096 N/A GLU 344.A N ALA 340.A O no hydrogen 2.900 N/A ALA 345.A N ALA 341.A O no hydrogen 2.914 N/A ASN 346.A N GLU 342.A O no hydrogen 2.918 N/A ASN 346.A ND2 GLU 342.A O no hydrogen 2.320 N/A ASN 346.A ND2 GLU 342.A OE1 no hydrogen 2.562 N/A LEU 347.A N LEU 343.A O no hydrogen 2.878 N/A ILE 350.A N LEU 347.A O no hydrogen 3.262 N/A GLU 351.A N THR 323.A O no hydrogen 2.513 N/A SER 354.A N ILE 325.A O no hydrogen 2.636 N/A SER 354.A OG ILE 325.A O no hydrogen 3.273 N/A SER 354.A OG ASN 326.A OD1 no hydrogen 3.469 N/A GLY 355.A N GLY 327.A O no hydrogen 2.842 N/A TYR 356.A N SER 328.A OG no hydrogen 3.335 N/A TYR 356.A OH GLU 307.A OE1 no hydrogen 3.265 N/A LEU 357.A N SER 388.A O no hydrogen 2.905 N/A LYS 358.A N LEU 329.A O no hydrogen 2.942 N/A ILE 359.A N TYR 390.A O no hydrogen 2.881 N/A ARG 360.A N ILE 331.A O no hydrogen 2.948 N/A ARG 361.A N LEU 392.A O no hydrogen 2.794 N/A SER 362.A N ASN 394.A OD1 no hydrogen 3.452 N/A TYR 363.A N ILE 333.A O no hydrogen 3.178 N/A LEU 365.A N SER 362.A O no hydrogen 3.400 N/A SER 367.A OG SER 369.A OG no hydrogen 2.713 N/A SER 369.A N SER 367.A OG no hydrogen 3.355 N/A SER 369.A OG SER 367.A OG no hydrogen 2.713 N/A ARG 372.A N PHE 370.A O no hydrogen 2.607 N/A ARG 372.A NE GLU 344.A OE2 no hydrogen 2.830 N/A ARG 372.A NH2 GLU 344.A OE1 no hydrogen 3.155 N/A ARG 372.A NH2 GLU 344.A OE2 no hydrogen 2.628 N/A LYS 373.A NZ GLU 351.A OE2 no hydrogen 3.006 N/A LEU 374.A N PHE 371.A O no hydrogen 3.177 N/A ARG 375.A N GLU 351.A O no hydrogen 2.811 N/A ARG 375.A NH2 GLU 351.A OE1 no hydrogen 3.161 N/A LEU 376.A N GLU 351.A O no hydrogen 3.367 N/A ILE 377.A N THR 409.A O no hydrogen 2.932 N/A ARG 378.A N ILE 353.A O no hydrogen 3.079 N/A ARG 378.A NH1 GLU 380.A OE2 no hydrogen 3.390 N/A GLY 379.A N GLY 355.A O no hydrogen 3.406 N/A GLU 380.A N SER 354.A O no hydrogen 3.135 N/A GLU 383.A N TYR 387.A O no hydrogen 3.453 N/A ASN 386.A N GLU 383.A O no hydrogen 2.742 N/A SER 388.A N LYS 414.A O no hydrogen 3.101 N/A SER 388.A OG GLN 412.A O no hydrogen 2.493 N/A TYR 390.A N LEU 357.A O no hydrogen 2.932 N/A LEU 392.A N ILE 359.A O no hydrogen 2.918 N/A ASN 394.A ND2 ILE 359.A O no hydrogen 3.530 N/A ASN 394.A ND2 ASN 420.A OD1 no hydrogen 3.635 N/A LEU 397.A N ASN 394.A O no hydrogen 3.209 N/A ARG 398.A N VAL 366.A O no hydrogen 3.262 N/A GLN 399.A N VAL 366.A O no hydrogen 3.294 N/A GLN 399.A NE2 LEU 400.A O no hydrogen 2.297 N/A SER 404.A OG ASP 402.A OD1 no hydrogen 3.434 N/A SER 404.A OG ASP 402.A OD2 no hydrogen 2.755 N/A LYS 405.A NZ LYS 405.A O no hydrogen 2.612 N/A LYS 405.A NZ ASN 407.A OD1 no hydrogen 2.654 N/A HIS 406.A N ASP 402.A O no hydrogen 3.139 N/A THR 409.A N ARG 375.A O no hydrogen 2.985 N/A THR 409.A OG1 ARG 375.A O no hydrogen 2.736 N/A THR 411.A N ILE 377.A O no hydrogen 3.130 N/A LYS 414.A N ASN 386.A O no hydrogen 2.996 N/A PHE 416.A N PHE 389.A O no hydrogen 2.989 N/A HIS 418.A N ALA 391.A O no hydrogen 3.379 N/A TYR 419.A N THR 443.A OG1 no hydrogen 2.992 N/A ASN 420.A N THR 443.A O no hydrogen 3.122 N/A LEU 423.A N ASN 420.A O no hydrogen 3.028 N/A CYS 424.A SG ALA 448.A O no hydrogen 3.938 N/A HIS 429.A N LEU 425.A O no hydrogen 2.924 N/A LYS 430.A N SER 426.A O no hydrogen 2.873 N/A MET 431.A N GLU 427.A O no hydrogen 2.917 N/A SER 433.A OG MET 431.A O no hydrogen 2.366 N/A SER 433.A OG THR 435.A OG1 no hydrogen 3.297 N/A THR 435.A OG1 SER 433.A OG no hydrogen 3.297 N/A LYS 436.A NZ GLU 432.A OE1 no hydrogen 3.563 N/A ARG 438.A NH2 ILE 410.A O no hydrogen 3.131 N/A ARG 438.A NH2 THR 411.A O no hydrogen 2.621 N/A ALA 440.A N PHE 417.A O no hydrogen 3.036 N/A THR 443.A OG1 ALA 440.A O no hydrogen 3.075 N/A THR 443.A OG1 ASN 444.A OD1 no hydrogen 2.837 N/A ASN 444.A ND2 PHE 417.A O no hydrogen 3.611 N/A GLY 445.A N ASN 420.A O no hydrogen 3.105 N/A GLN 447.A N PRO 421.A O no hydrogen 2.951 N/A SER 449.A OG GLU 451.A OE1 no hydrogen 2.598 N/A CYS 450.A SG ALA 448.A O no hydrogen 3.691 N/A LEU 454.A N GLU 453.A OE2 no hydrogen 2.646 N/A SER 458.A N ARG 470.A O no hydrogen 2.655 N/A SER 458.A OG ARG 470.A O no hydrogen 2.342 N/A THR 462.A OG1 ARG 461.A O no hydrogen 2.468 N/A SER 463.A N LYS 466.A O no hydrogen 3.045 N/A ASP 465.A N SER 463.A OG no hydrogen 2.583 N/A TRP 471.A N PRO 522.A O no hydrogen 2.991 N/A TRP 475.A NE1 GLN 519.A OE1 no hydrogen 2.674 N/A ARG 480.A NE PHE 479.A O no hydrogen 3.178 N/A ARG 480.A NH1 GLU 635.A OE2 no hydrogen 2.414 N/A ARG 480.A NH2 ASP 478.A OD2 no hydrogen 3.385 N/A ARG 480.A NH2 ASP 636.A OD1 no hydrogen 3.526 N/A LEU 483.A N LEU 542.A O no hydrogen 2.863 N/A PHE 485.A N ILE 507.A O no hydrogen 2.791 N/A MET 486.A N LYS 540.A O no hydrogen 2.729 N/A LEU 487.A N VAL 505.A O no hydrogen 3.200 N/A PHE 488.A N PHE 538.A O no hydrogen 3.006 N/A TYR 489.A N THR 503.A O no hydrogen 2.843 N/A LYS 490.A N ALA 536.A O no hydrogen 3.205 N/A LYS 490.A NZ SER 501.A OG no hydrogen 2.660 N/A ALA 492.A N GLN 534.A O no hydrogen 3.047 N/A GLN 495.A NE2 GLN 534.A OE1 no hydrogen 2.701 N/A VAL 497.A N TYR 556.A OH no hydrogen 2.854 N/A GLU 499.A N THR 498.A OG1 no hydrogen 2.734 N/A GLU 499.A N GLU 499.A OE1 no hydrogen 2.617 N/A TRP 502.A NE1 THR 498.A O no hydrogen 3.061 N/A THR 503.A N TYR 489.A O no hydrogen 2.946 N/A THR 503.A OG1 TYR 489.A O no hydrogen 3.286 N/A VAL 505.A N LEU 487.A O no hydrogen 3.011 N/A ASP 506.A N ASP 506.A OD1 no hydrogen 2.448 N/A ILE 507.A N PHE 485.A O no hydrogen 3.095 N/A LYS 517.A NZ ASP 515.A O no hydrogen 2.579 N/A GLN 519.A N PRO 516.A O no hydrogen 2.828 N/A HIS 521.A ND1 SER 518.A O no hydrogen 3.006 N/A TRP 524.A N LEU 469.A O no hydrogen 3.363 N/A ARG 527.A NE LEU 525.A O no hydrogen 2.937 N/A ARG 527.A NH2 LEU 525.A O no hydrogen 2.683 N/A THR 533.A N LYS 530.A O no hydrogen 3.400 N/A THR 533.A OG1 LYS 530.A O no hydrogen 2.666 N/A GLN 534.A NE2 ALA 492.A O no hydrogen 2.858 N/A TYR 535.A N VAL 557.A O no hydrogen 2.703 N/A ALA 536.A N LYS 490.A O no hydrogen 3.002 N/A ILE 537.A N ILE 555.A O no hydrogen 2.907 N/A PHE 538.A N PHE 488.A O no hydrogen 3.209 N/A LYS 540.A N MET 486.A O no hydrogen 2.851 N/A LYS 540.A NZ THR 541.A O no hydrogen 3.225 N/A THR 541.A N ALA 550.A O no hydrogen 2.734 N/A THR 541.A OG1 ALA 550.A O no hydrogen 2.792 N/A THR 544.A OG1 THR 544.A O no hydrogen 2.428 N/A SER 546.A N THR 544.A O no hydrogen 2.664 N/A THR 547.A OG1 THR 547.A O no hydrogen 2.348 N/A ALA 550.A N THR 541.A OG1 no hydrogen 2.498 N/A LYS 551.A N GLU 453.A O no hydrogen 3.095 N/A LYS 551.A NZ SER 552.A O no hydrogen 3.360 N/A SER 552.A N VAL 539.A O no hydrogen 2.446 N/A SER 552.A OG LEU 455.A O no hydrogen 3.484 N/A SER 552.A OG ASP 553.A O no hydrogen 3.254 N/A ILE 555.A N ILE 537.A O no hydrogen 2.923 N/A VAL 557.A N TYR 535.A O no hydrogen 2.818 N/A GLN 558.A NE2 TRP 532.A O no hydrogen 2.428 N/A THR 559.A OG1 PRO 531.A O no hydrogen 2.454 N/A THR 559.A OG1 ASP 560.A O no hydrogen 3.098 N/A ALA 561.A N ASP 560.A OD1 no hydrogen 2.414 N/A ASN 563.A ND2 PRO 564.A O no hydrogen 3.361 N/A ASN 563.A ND2 CYS 683.A O no hydrogen 2.547 N/A VAL 566.A N SER 565.A OG no hydrogen 2.782 N/A ILE 571.A N LYS 583.A O no hydrogen 2.412 N/A SER 572.A OG SER 690.A O no hydrogen 3.400 N/A VAL 573.A N ILE 581.A O no hydrogen 2.855 N/A SER 574.A OG ARG 692.A O no hydrogen 3.037 N/A SER 576.A OG GLN 579.A OE1 no hydrogen 2.875 N/A SER 578.A OG LEU 662.A O no hydrogen 2.918 N/A GLN 579.A N SER 576.A O no hydrogen 3.146 N/A GLN 579.A NE2 SER 660.A OG no hydrogen 2.921 N/A ILE 580.A N ILE 659.A O no hydrogen 2.894 N/A LEU 582.A N LEU 657.A O no hydrogen 2.508 N/A LYS 583.A N ILE 571.A O no hydrogen 2.727 N/A LYS 583.A NZ SER 656.A OG no hydrogen 3.257 N/A TRP 584.A N GLU 655.A O no hydrogen 2.939 N/A LYS 585.A NZ PRO 586.A O no hydrogen 2.331 N/A THR 595.A N CYS 674.A O no hydrogen 3.188 N/A THR 595.A OG1 CYS 674.A O no hydrogen 2.406 N/A HIS 596.A N CYS 674.A O no hydrogen 3.038 N/A HIS 596.A ND1 TYR 597.A O no hydrogen 2.913 N/A TYR 597.A N VAL 651.A O no hydrogen 2.726 N/A LEU 598.A N GLN 672.A O no hydrogen 2.344 N/A VAL 599.A N GLU 649.A O no hydrogen 2.927 N/A PHE 600.A N GLU 670.A O no hydrogen 2.532 N/A TRP 601.A N PRO 647.A O no hydrogen 3.518 N/A GLU 602.A N ARG 668.A O no hydrogen 2.493 N/A GLN 604.A N GLY 666.A O no hydrogen 3.262 N/A GLN 604.A NE2 GLU 602.A O no hydrogen 3.149 N/A GLN 604.A NE2 GLU 602.A OE1 no hydrogen 2.494 N/A PHE 611.A N ASP 607.A O no hydrogen 3.296 N/A GLU 612.A N SER 608.A O no hydrogen 2.912 N/A TYR 615.A OH LEU 610.A O no hydrogen 3.121 N/A SER 619.A N ASP 618.A OD1 no hydrogen 2.684 N/A SER 619.A OG GLN 620.A OE1 no hydrogen 2.458 N/A GLN 620.A N GLN 620.A OE1 no hydrogen 2.798 N/A ILE 621.A N THR 617.A O no hydrogen 3.047 N/A LEU 622.A N ASP 618.A O no hydrogen 3.126 N/A LYS 623.A N SER 619.A O no hydrogen 3.328 N/A LEU 625.A N ILE 621.A O no hydrogen 2.926 N/A GLU 626.A N LEU 622.A O no hydrogen 3.169 N/A GLU 627.A N LYS 623.A O no hydrogen 2.713 N/A SER 628.A N GLU 624.A O no hydrogen 2.583 N/A SER 629.A N LEU 625.A O no hydrogen 2.949 N/A SER 629.A OG LEU 625.A O no hydrogen 2.859 N/A PHE 630.A N GLU 626.A O no hydrogen 2.850 N/A ARG 631.A N GLU 627.A O no hydrogen 2.732 N/A ARG 631.A NE GLU 627.A OE2 no hydrogen 2.927 N/A ARG 631.A NH2 GLU 627.A OE1 no hydrogen 2.585 N/A ARG 631.A NH2 GLU 627.A OE2 no hydrogen 3.224 N/A LYS 632.A N SER 628.A O no hydrogen 2.903 N/A LYS 632.A NZ ASP 481.A OD1 no hydrogen 2.706 N/A THR 633.A N SER 629.A O no hydrogen 2.827 N/A THR 633.A N PHE 630.A O no hydrogen 3.058 N/A THR 633.A OG1 SER 629.A O no hydrogen 2.454 N/A PHE 634.A N PHE 630.A O no hydrogen 3.284 N/A ASP 636.A N LYS 632.A O no hydrogen 3.057 N/A TYR 637.A N THR 633.A O no hydrogen 2.774 N/A LEU 638.A N PHE 634.A O no hydrogen 2.814 N/A HIS 639.A N GLU 635.A O no hydrogen 3.339 N/A HIS 639.A ND1 GLU 635.A O no hydrogen 2.314 N/A ASN 640.A N ASP 636.A O no hydrogen 3.071 N/A ASN 640.A ND2 ASP 636.A O no hydrogen 2.343 N/A VAL 641.A N TYR 637.A O no hydrogen 3.158 N/A VAL 642.A N LEU 638.A O no hydrogen 2.898 N/A PHE 643.A N HIS 639.A O no hydrogen 3.269 N/A GLU 649.A N VAL 599.A O no hydrogen 3.130 N/A VAL 651.A N TYR 597.A O no hydrogen 3.122 N/A GLU 655.A N GLU 655.A OE1 no hydrogen 2.765 N/A LEU 657.A N LEU 582.A O no hydrogen 2.779 N/A ILE 659.A N ILE 580.A O no hydrogen 2.871 N/A SER 660.A OG VAL 658.A O no hydrogen 3.522 N/A LEU 662.A N SER 578.A O no hydrogen 2.944 N/A ARG 663.A NE GLU 724.A OE1 no hydrogen 2.825 N/A ARG 663.A NH2 GLU 724.A OE1 no hydrogen 3.228 N/A THR 665.A OG1 GLU 606.A OE2 no hydrogen 3.105 N/A THR 665.A OG1 GLY 666.A O no hydrogen 3.332 N/A TYR 667.A OH TRP 601.A O no hydrogen 3.412 N/A ARG 668.A N GLU 602.A O no hydrogen 2.801 N/A ARG 668.A NH1 GLU 602.A OE1 no hydrogen 3.495 N/A ILE 669.A N VAL 689.A O no hydrogen 2.675 N/A GLU 670.A N PHE 600.A O no hydrogen 2.312 N/A LEU 671.A N ALA 687.A O no hydrogen 2.676 N/A GLN 672.A N LEU 598.A O no hydrogen 2.357 N/A CYS 674.A N HIS 596.A O no hydrogen 2.877 N/A ASN 675.A ND2 THR 562.A O no hydrogen 2.893 N/A ASN 675.A ND2 ASN 591.A O no hydrogen 3.120 N/A GLN 676.A NE2 THR 678.A OG1 no hydrogen 2.784 N/A GLU 680.A N GLU 680.A OE1 no hydrogen 2.547 N/A CYS 683.A N GLU 681.A OE1 no hydrogen 2.946 N/A CYS 683.A SG GLU 681.A OE1 no hydrogen 3.278 N/A SER 684.A OG SER 565.A O no hydrogen 2.908 N/A SER 684.A OG ALA 673.A O no hydrogen 3.229 N/A SER 684.A OG VAL 685.A O no hydrogen 3.512 N/A ALA 687.A N LEU 671.A O no hydrogen 2.568 N/A VAL 689.A N ILE 669.A O no hydrogen 2.721 N/A ALA 691.A N TYR 667.A O no hydrogen 3.322 N/A ARG 692.A NH2 GLU 606.A OE1 no hydrogen 3.415 N/A THR 693.A OG1 SER 577.A O no hydrogen 3.311 N/A THR 693.A OG1 MET 694.A O no hydrogen 3.515 N/A GLU 696.A N ASN 726.A OD1 no hydrogen 2.807 N/A LYS 698.A NZ GLU 696.A OE1 no hydrogen 3.348 N/A ALA 699.A N GLU 696.A O no hydrogen 3.045 N/A ASP 700.A N ALA 697.A O no hydrogen 3.092 N/A ASP 701.A N LYS 698.A O no hydrogen 3.171 N/A VAL 705.A N THR 788.A OG1 no hydrogen 3.005 N/A THR 706.A OG1 MET 718.A O no hydrogen 2.883 N/A HIS 707.A ND1 VAL 705.A O no hydrogen 3.010 N/A GLU 708.A N HIS 716.A O no hydrogen 3.232 N/A PHE 710.A N VAL 714.A O no hydrogen 3.034 N/A VAL 715.A N LEU 761.A O no hydrogen 3.408 N/A HIS 716.A N GLU 708.A O no hydrogen 3.032 N/A HIS 716.A NE2 ARG 757.A O no hydrogen 3.027 N/A LEU 717.A N CYS 759.A O no hydrogen 2.550 N/A MET 718.A N THR 706.A O no hydrogen 2.780 N/A GLN 720.A NE2 GLU 721.A O no hydrogen 2.410 N/A ASN 726.A N ASP 700.A OD1 no hydrogen 3.267 N/A ASN 726.A ND2 GLU 696.A O no hydrogen 3.006 N/A ASN 726.A ND2 ASP 700.A OD1 no hydrogen 2.544 N/A LEU 728.A N ASN 726.A O no hydrogen 2.921 N/A LEU 731.A N THR 776.A O no hydrogen 3.198 N/A TYR 732.A N VAL 748.A O no hydrogen 2.402 N/A GLU 733.A N ARG 774.A O no hydrogen 2.427 N/A VAL 734.A N LEU 746.A O no hydrogen 3.030 N/A SER 735.A N ARG 772.A O no hydrogen 2.560 N/A SER 735.A OG GLU 743.A OE2 no hydrogen 2.688 N/A TYR 736.A N LEU 744.A O no hydrogen 2.866 N/A ARG 737.A N SER 770.A O no hydrogen 2.771 N/A ARG 737.A NH2 GLU 743.A OE1 no hydrogen 2.475 N/A ARG 738.A NE ASP 741.A OD2 no hydrogen 2.351 N/A ARG 738.A NH1 PRO 766.A O no hydrogen 2.891 N/A ARG 738.A NH2 ASP 741.A OD2 no hydrogen 3.027 N/A TYR 739.A N ASN 768.A O no hydrogen 2.801 N/A ASP 741.A N ARG 738.A O no hydrogen 2.926 N/A LEU 744.A N TYR 736.A O no hydrogen 2.772 N/A HIS 745.A NE2 GLU 743.A OE2 no hydrogen 2.886 N/A LEU 746.A N VAL 734.A O no hydrogen 2.771 N/A VAL 748.A N TYR 732.A O no hydrogen 2.810 N/A SER 749.A OG ASP 614.A OD1 no hydrogen 3.060 N/A ARG 750.A N VAL 730.A O no hydrogen 3.048 N/A ARG 750.A NH1 GLU 721.A OE2 no hydrogen 2.867 N/A ARG 750.A NH2 GLU 721.A OE2 no hydrogen 3.046 N/A LYS 751.A NZ GLU 612.A O no hydrogen 3.033 N/A LYS 751.A NZ GLU 612.A OE1 no hydrogen 2.515 N/A HIS 752.A N SER 749.A OG no hydrogen 3.047 N/A HIS 752.A NE2 GLU 756.A OE1 no hydrogen 2.534 N/A PHE 753.A N SER 749.A O no hydrogen 2.484 N/A ALA 754.A N ARG 750.A O no hydrogen 2.918 N/A LEU 755.A N LYS 751.A O no hydrogen 2.921 N/A GLU 756.A N HIS 752.A O no hydrogen 3.131 N/A ARG 757.A N ALA 754.A O no hydrogen 3.475 N/A GLY 758.A N PHE 753.A O no hydrogen 2.637 N/A CYS 759.A N LEU 717.A O no hydrogen 3.189 N/A ARG 760.A NE GLU 756.A OE2 no hydrogen 2.575 N/A ARG 760.A NH2 GLU 756.A OE2 no hydrogen 2.768 N/A LEU 761.A N VAL 715.A O no hydrogen 2.932 N/A ARG 762.A NH2 GLU 756.A OE1 no hydrogen 3.495 N/A LEU 764.A N ASN 713.A O no hydrogen 3.168 N/A SER 765.A OG TYR 769.A OH no hydrogen 3.003 N/A GLY 767.A N VAL 792.A O no hydrogen 3.180 N/A TYR 769.A N PHE 790.A O no hydrogen 2.815 N/A TYR 769.A OH SER 765.A O no hydrogen 2.916 N/A TYR 769.A OH SER 765.A OG no hydrogen 3.003 N/A SER 770.A N ARG 737.A O no hydrogen 2.893 N/A SER 770.A OG ARG 737.A O no hydrogen 3.243 N/A VAL 771.A N THR 788.A O no hydrogen 2.810 N/A ARG 772.A N SER 735.A O no hydrogen 2.581 N/A ARG 772.A NE THR 785.A O no hydrogen 2.547 N/A ARG 772.A NH2 THR 785.A O no hydrogen 2.857 N/A ILE 773.A N THR 785.A OG1 no hydrogen 2.906 N/A ARG 774.A N GLU 733.A O no hydrogen 2.382 N/A ARG 774.A NE GLU 733.A OE1 no hydrogen 2.600 N/A THR 776.A N LEU 731.A O no hydrogen 2.820 N/A THR 776.A OG1 ASN 781.A OD1 no hydrogen 2.627 N/A SER 777.A N GLY 780.A O no hydrogen 2.905 N/A SER 777.A OG ASP 700.A OD2 no hydrogen 3.009 N/A LEU 778.A N LEU 728.A O no hydrogen 3.348 N/A ALA 779.A N SER 777.A OG no hydrogen 3.104 N/A GLY 782.A N ALA 775.A O no hydrogen 3.100 N/A SER 783.A N ASP 701.A OD1 no hydrogen 2.730 N/A SER 783.A OG ASP 701.A OD1 no hydrogen 2.806 N/A SER 783.A OG ASP 701.A OD2 no hydrogen 3.120 N/A THR 785.A N ILE 773.A O no hydrogen 3.057 N/A THR 788.A N VAL 771.A O no hydrogen 3.346 N/A THR 788.A OG1 GLU 786.A O no hydrogen 3.132 N/A PHE 790.A N TYR 769.A O no hydrogen 3.257 N/A VAL 792.A N GLY 767.A O no hydrogen 3.013 N/A