Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8hg1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 130.A OE2 no hydrogen 2.276 N/A VAL 4.A N TYR 126.A O no hydrogen 3.045 N/A ARG 5.A N ARG 24.A O no hydrogen 3.190 N/A ARG 5.A NH1 PHE 157.A O no hydrogen 2.867 N/A CYS 6.A N GLY 124.A O no hydrogen 3.410 N/A CYS 6.A SG GLY 124.A O no hydrogen 3.209 N/A ILE 7.A N LYS 22.A O no hydrogen 2.825 N/A ASN 8.A ND2 GLY 326.A O no hydrogen 3.285 N/A TRP 9.A N ASN 8.A OD1 no hydrogen 2.882 N/A TRP 9.A NE1 PRO 122.A O no hydrogen 3.191 N/A PHE 10.A N TYR 20.A O no hydrogen 3.300 N/A SER 12.A N PHE 18.A O no hydrogen 3.251 N/A SER 12.A OG ASN 16.A O no hydrogen 3.472 N/A GLU 15.A N GLU 15.A OE1 no hydrogen 2.875 N/A LEU 19.A N PHE 35.A O no hydrogen 2.766 N/A TYR 20.A N PHE 10.A O no hydrogen 2.890 N/A TYR 20.A OH ASP 291.A OD1 no hydrogen 3.140 N/A TYR 20.A OH ASP 291.A OD2 no hydrogen 2.878 N/A LEU 21.A N ILE 33.A O no hydrogen 2.979 N/A LYS 22.A N ASN 8.A O no hydrogen 3.016 N/A LYS 22.A NZ ASP 258.A OD1 no hydrogen 3.420 N/A SER 23.A N VAL 31.A O no hydrogen 3.026 N/A SER 23.A OG VAL 31.A O no hydrogen 3.272 N/A ARG 24.A N ARG 5.A O no hydrogen 3.281 N/A CYS 25.A N GLU 29.A O no hydrogen 2.972 N/A CYS 25.A SG SER 1.A O no hydrogen 3.694 N/A CYS 25.A SG ASP 3.A O no hydrogen 3.526 N/A CYS 25.A SG GLU 29.A OE2 no hydrogen 3.358 N/A ARG 26.A NE ASP 3.A OD2 no hydrogen 2.739 N/A ARG 26.A NH2 ASP 3.A OD2 no hydrogen 3.105 N/A GLU 29.A N ASN 27.A OD1 no hydrogen 2.885 N/A VAL 31.A N SER 23.A O no hydrogen 2.787 N/A PHE 32.A N GLY 139.A O no hydrogen 2.824 N/A ILE 33.A N LEU 21.A O no hydrogen 3.187 N/A ARG 34.A N TYR 141.A O no hydrogen 2.753 N/A ARG 34.A NE HIS 142.A ND1 no hydrogen 3.373 N/A ARG 34.A NH1 ASP 291.A OD2 no hydrogen 3.159 N/A ARG 34.A NH2 HIS 142.A ND1 no hydrogen 3.310 N/A PHE 35.A N LEU 19.A O no hydrogen 2.658 N/A PHE 39.A N GLU 94.A O no hydrogen 2.821 N/A TYR 40.A N ASN 110.A OD1 no hydrogen 3.371 N/A TYR 41.A N ILE 92.A O no hydrogen 3.092 N/A VAL 43.A N TRP 90.A O no hydrogen 3.194 N/A ASP 45.A N ASP 88.A O no hydrogen 3.106 N/A TYR 48.A N THR 44.A O no hydrogen 2.688 N/A GLN 49.A N ASP 45.A O no hydrogen 2.908 N/A SER 50.A N GLU 46.A O no hydrogen 2.929 N/A SER 50.A N ILE 47.A O no hydrogen 3.117 N/A SER 50.A OG SER 50.A O no hydrogen 2.537 N/A LEU 51.A N TYR 48.A O no hydrogen 3.517 N/A PHE 56.A N GLU 94.A OE2 no hydrogen 3.331 N/A ASN 57.A ND2 GLU 93.A OE1 no hydrogen 3.439 N/A ARG 59.A N LEU 91.A O no hydrogen 2.926 N/A ARG 59.A NH1 GLU 93.A OE2 no hydrogen 3.427 N/A MET 61.A N MET 89.A O no hydrogen 3.098 N/A MET 64.A N ALA 87.A O no hydrogen 3.226 N/A ARG 65.A NH2 THR 516.A OG1 no hydrogen 3.415 N/A THR 66.A N SER 85.A O no hydrogen 2.874 N/A ILE 67.A N ILE 517.A O no hydrogen 2.892 N/A ASP 68.A N LYS 83.A O no hydrogen 3.326 N/A ILE 69.A N VAL 519.A O no hydrogen 3.072 N/A ASP 70.A N ASP 68.A OD1 no hydrogen 3.108 N/A THR 72.A OG1 ILE 73.A O no hydrogen 3.390 N/A SER 74.A N VAL 572.A O no hydrogen 3.028 N/A SER 74.A OG ASN 76.A O no hydrogen 2.806 N/A ARG 82.A NE LEU 569.A O no hydrogen 3.471 N/A ARG 82.A NH1 ASP 68.A O no hydrogen 2.669 N/A ARG 82.A NH1 ASP 70.A O no hydrogen 3.039 N/A ARG 82.A NH2 LEU 569.A O no hydrogen 3.102 N/A SER 85.A N THR 66.A O no hydrogen 3.133 N/A ALA 87.A N MET 64.A O no hydrogen 3.244 N/A MET 89.A N GLY 62.A O no hydrogen 3.296 N/A TRP 90.A N VAL 43.A O no hydrogen 2.894 N/A TRP 90.A NE1 ASP 45.A OD2 no hydrogen 3.259 N/A LEU 91.A N ARG 59.A O no hydrogen 3.004 N/A ILE 92.A N TYR 41.A O no hydrogen 3.009 N/A GLU 93.A N ASN 57.A O no hydrogen 2.868 N/A GLU 94.A N PHE 39.A O no hydrogen 3.028 N/A ARG 98.A N TYR 41.A OH no hydrogen 3.015 N/A ARG 98.A NH1 PRO 53.A O no hydrogen 3.307 N/A ARG 98.A NH2 PRO 53.A O no hydrogen 2.939 N/A GLN 101.A N GLN 101.A OE1 no hydrogen 2.618 N/A THR 104.A N VAL 42.A O no hydrogen 3.338 N/A TRP 113.A N PHE 109.A O no hydrogen 3.347 N/A PHE 114.A N ASN 110.A O no hydrogen 2.911 N/A TYR 115.A N ILE 111.A O no hydrogen 2.943 N/A ILE 116.A N SER 112.A O no hydrogen 2.921 N/A SER 117.A N TRP 113.A O no hydrogen 2.876 N/A SER 117.A OG TRP 113.A O no hydrogen 2.754 N/A SER 117.A OG PHE 114.A O no hydrogen 3.422 N/A ASN 118.A N PHE 114.A O no hydrogen 2.984 N/A ASN 118.A ND2 PHE 114.A O no hydrogen 2.887 N/A GLY 119.A N ILE 116.A O no hydrogen 3.421 N/A ILE 120.A N TYR 115.A O no hydrogen 3.052 N/A SER 121.A N TYR 126.A OH no hydrogen 2.688 N/A SER 121.A OG ASP 123.A OD1 no hydrogen 3.285 N/A TYR 126.A N VAL 4.A O no hydrogen 3.039 N/A SER 127.A N LYS 152.A O no hydrogen 3.343 N/A LEU 128.A N MET 2.A O no hydrogen 3.103 N/A LEU 133.A N GLU 130.A O no hydrogen 3.177 N/A THR 134.A N HIS 142.A O no hydrogen 2.927 N/A LYS 135.A NZ ASN 137.A O no hydrogen 3.199 N/A ILE 136.A N CYS 140.A O no hydrogen 3.501 N/A CYS 140.A N ASN 137.A O no hydrogen 3.339 N/A CYS 140.A SG TYR 141.A O no hydrogen 4.033 N/A TYR 141.A N PHE 32.A O no hydrogen 2.818 N/A HIS 142.A N THR 134.A O no hydrogen 2.753 N/A HIS 142.A NE2 ASP 144.A OD1 no hydrogen 2.410 N/A CYS 143.A N ARG 34.A O no hydrogen 3.176 N/A CYS 143.A SG TYR 132.A O no hydrogen 3.864 N/A ASN 148.A N ASP 145.A O no hydrogen 3.292 N/A ASN 148.A ND2 ASP 145.A OD2 no hydrogen 2.577 N/A CYS 149.A N ASP 145.A O no hydrogen 3.269 N/A CYS 149.A SG ASP 129.A OD1 no hydrogen 3.888 N/A PHE 150.A N PRO 146.A O no hydrogen 3.295 N/A ILE 154.A N CYS 125.A O no hydrogen 3.001 N/A TYR 163.A N ILE 192.A O no hydrogen 3.225 N/A TYR 163.A OH GLU 477.A OE1 no hydrogen 3.345 N/A TYR 163.A OH GLU 477.A OE2 no hydrogen 3.170 N/A LEU 164.A N TYR 259.A O no hydrogen 3.052 N/A PHE 165.A N CYS 190.A O no hydrogen 3.075 N/A ASP 167.A N SER 188.A O no hydrogen 3.285 N/A GLU 169.A N HIS 186.A O no hydrogen 3.364 N/A HIS 171.A N PRO 183.A O no hydrogen 2.981 N/A LYS 174.A N ASP 173.A OD1 no hydrogen 2.580 N/A SER 178.A N ASN 182.A OD1 no hydrogen 3.161 N/A ILE 181.A N SER 178.A O no hydrogen 3.390 N/A ASN 182.A N SER 178.A O no hydrogen 2.862 N/A ILE 184.A N GLU 242.A OE2 no hydrogen 3.029 N/A SER 185.A N GLU 169.A O no hydrogen 3.070 N/A SER 185.A OG GLU 169.A O no hydrogen 2.959 N/A SER 185.A OG HIS 186.A ND1 no hydrogen 2.814 N/A SER 185.A OG TYR 445.A OH no hydrogen 2.834 N/A HIS 186.A N GLU 169.A O no hydrogen 3.348 N/A HIS 186.A ND1 SER 185.A OG no hydrogen 2.814 N/A HIS 186.A NE2 ALA 453.A O no hydrogen 3.057 N/A THR 187.A N LEU 203.A O no hydrogen 3.173 N/A THR 187.A OG1 HIS 186.A O no hydrogen 2.638 N/A SER 188.A N ASP 167.A O no hydrogen 2.974 N/A SER 188.A OG THR 202.A OG1 no hydrogen 3.100 N/A TYR 189.A N PHE 201.A O no hydrogen 3.121 N/A CYS 190.A N PHE 165.A O no hydrogen 2.670 N/A CYS 190.A SG GLN 468.A OE1 no hydrogen 3.642 N/A TYR 191.A N LEU 199.A O no hydrogen 2.999 N/A ILE 192.A N TYR 163.A O no hydrogen 3.363 N/A GLY 196.A N ASP 193.A O no hydrogen 3.294 N/A LYS 197.A N ASP 193.A OD1 no hydrogen 2.916 N/A ARG 198.A NE GLN 468.A OE1 no hydrogen 3.367 N/A LEU 199.A N TYR 191.A O no hydrogen 3.015 N/A THR 202.A N GLU 236.A O no hydrogen 2.774 N/A THR 202.A OG1 SER 188.A OG no hydrogen 3.100 N/A LEU 203.A N THR 187.A O no hydrogen 2.849 N/A ILE 204.A N VAL 238.A O no hydrogen 2.966 N/A ASN 205.A N SER 185.A O no hydrogen 3.011 N/A ASN 205.A ND2 ILE 184.A O no hydrogen 2.868 N/A GLU 206.A N CYS 240.A O no hydrogen 2.798 N/A GLU 207.A N ASN 205.A OD1 no hydrogen 3.041 N/A LEU 209.A N GLU 206.A O no hydrogen 3.187 N/A THR 210.A N GLU 213.A OE1 no hydrogen 2.932 N/A THR 210.A OG1 GLU 213.A OE1 no hydrogen 3.232 N/A ILE 214.A N THR 210.A O no hydrogen 2.922 N/A GLN 215.A N GLU 211.A O no hydrogen 2.921 N/A GLN 215.A NE2 ASP 219.A OD1 no hydrogen 3.265 N/A GLN 215.A NE2 ASP 219.A OD2 no hydrogen 3.131 N/A GLU 216.A N GLN 212.A O no hydrogen 2.924 N/A ALA 217.A N GLU 213.A O no hydrogen 2.891 N/A VAL 218.A N ILE 214.A O no hydrogen 2.929 N/A ASP 219.A N GLN 215.A O no hydrogen 2.919 N/A ARG 220.A N GLU 216.A O no hydrogen 2.916 N/A ARG 220.A N ALA 217.A O no hydrogen 3.088 N/A ARG 220.A NH2 GLU 216.A OE2 no hydrogen 3.106 N/A GLY 221.A N VAL 218.A O no hydrogen 3.265 N/A CYS 222.A N ALA 217.A O no hydrogen 3.206 N/A LEU 223.A N LEU 237.A O no hydrogen 3.406 N/A SER 227.A OG GLU 230.A OE1 no hydrogen 3.322 N/A VAL 238.A N THR 202.A O no hydrogen 3.139 N/A LEU 239.A N LEU 223.A O no hydrogen 2.994 N/A CYS 240.A N ILE 204.A O no hydrogen 2.913 N/A CYS 240.A SG SER 241.A O no hydrogen 3.829 N/A GLU 242.A N GLU 207.A OE2 no hydrogen 2.981 N/A LEU 245.A N SER 241.A O no hydrogen 3.179 N/A LEU 246.A N GLU 242.A O no hydrogen 2.923 N/A ARG 247.A N ILE 243.A O no hydrogen 2.907 N/A ILE 248.A N VAL 244.A O no hydrogen 2.911 N/A ALA 249.A N LEU 245.A O no hydrogen 2.948 N/A LYS 250.A N LEU 246.A O no hydrogen 2.884 N/A LYS 250.A NZ GLU 254.A OE2 no hydrogen 2.622 N/A LYS 250.A NZ LYS 284.A O no hydrogen 2.540 N/A GLN 251.A N ARG 247.A O no hydrogen 2.902 N/A GLN 251.A NE2 TYR 233.A OH no hydrogen 2.724 N/A LEU 252.A N ILE 248.A O no hydrogen 2.925 N/A LEU 253.A N ALA 249.A O no hydrogen 2.928 N/A GLU 254.A N GLN 251.A O no hydrogen 3.422 N/A ASP 258.A N SER 162.A OG no hydrogen 3.387 N/A VAL 260.A N ILE 328.A O no hydrogen 3.020 N/A VAL 261.A N LEU 164.A O no hydrogen 2.990 N/A THR 262.A N PHE 330.A O no hydrogen 3.034 N/A ASN 264.A N ASP 331.A OD1 no hydrogen 2.708 N/A HIS 266.A N ASP 331.A OD2 no hydrogen 3.477 N/A HIS 266.A ND1 PHE 319.A O no hydrogen 3.172 N/A LEU 270.A N GLY 265.A O no hydrogen 2.892 N/A ARG 271.A NH1 ASN 267.A O no hydrogen 3.415 N/A TYR 272.A N PHE 268.A O no hydrogen 2.897 N/A TYR 272.A OH SER 178.A O no hydrogen 3.194 N/A TYR 272.A OH ASN 182.A O no hydrogen 2.705 N/A ILE 273.A N ASP 269.A O no hydrogen 2.931 N/A THR 274.A N LEU 270.A O no hydrogen 2.905 N/A THR 274.A OG1 LEU 270.A O no hydrogen 2.683 N/A ASN 275.A N ARG 271.A O no hydrogen 2.940 N/A ARG 276.A N TYR 272.A O no hydrogen 2.899 N/A ARG 276.A NE GLU 242.A OE2 no hydrogen 2.986 N/A ARG 276.A NH1 VAL 179.A O no hydrogen 2.858 N/A ARG 276.A NH2 GLU 242.A OE1 no hydrogen 3.183 N/A LEU 277.A N ILE 273.A O no hydrogen 2.906 N/A GLU 278.A N THR 274.A O no hydrogen 2.936 N/A LEU 279.A N ASN 275.A O no hydrogen 2.891 N/A LEU 279.A N ARG 276.A O no hydrogen 3.262 N/A LEU 280.A N ARG 276.A O no hydrogen 2.919 N/A THR 281.A N LEU 277.A O no hydrogen 3.067 N/A LYS 284.A NZ GLU 278.A OE1 no hydrogen 3.132 N/A ILE 286.A N GLU 254.A OE2 no hydrogen 3.307 N/A PHE 287.A N VAL 296.A O no hydrogen 2.855 N/A SER 289.A N GLU 294.A O no hydrogen 3.243 N/A SER 289.A OG ASP 291.A OD1 no hydrogen 2.664 N/A LYS 292.A N SER 289.A O no hydrogen 2.889 N/A LYS 293.A N SER 289.A OG no hydrogen 3.314 N/A LYS 293.A NZ ASP 291.A OD2 no hydrogen 3.410 N/A GLU 294.A N SER 289.A OG no hydrogen 3.371 N/A VAL 296.A N PHE 287.A O no hydrogen 3.008 N/A LEU 298.A N ILE 285.A O no hydrogen 3.066 N/A CYS 299.A N ASN 322.A OD1 no hydrogen 2.843 N/A TYR 301.A N HIS 320.A O no hydrogen 3.250 N/A ARG 303.A N THR 318.A O no hydrogen 2.934 N/A ASN 304.A ND2 GLU 302.A OE2 no hydrogen 3.238 N/A GLN 305.A N ASN 316.A O no hydrogen 3.072 N/A SER 307.A N GLY 313.A O no hydrogen 2.689 N/A LYS 309.A N SER 307.A OG no hydrogen 3.348 N/A CYS 312.A N LYS 309.A O no hydrogen 3.348 N/A ALA 315.A N GLN 305.A O no hydrogen 3.024 N/A THR 317.A OG1 GLU 302.A OE2 no hydrogen 2.751 N/A THR 318.A N ARG 303.A O no hydrogen 3.183 N/A HIS 320.A N TYR 301.A O no hydrogen 3.106 N/A ASN 322.A ND2 HIS 297.A O no hydrogen 2.982 N/A ASN 323.A ND2 ASN 325.A OD1 no hydrogen 2.745 N/A ASN 323.A ND2 THR 327.A O no hydrogen 2.626 N/A ASN 324.A ND2 GLU 294.A OE1 no hydrogen 2.757 N/A THR 327.A N ASN 325.A OD1 no hydrogen 3.337 N/A THR 327.A OG1 PHE 257.A O no hydrogen 2.643 N/A ILE 328.A N ASP 258.A O no hydrogen 3.418 N/A PHE 330.A N VAL 260.A O no hydrogen 2.922 N/A LEU 332.A N THR 262.A O no hydrogen 3.103 N/A TYR 333.A N ASP 331.A OD1 no hydrogen 3.239 N/A ILE 336.A N LEU 332.A O no hydrogen 2.912 N/A GLN 337.A N TYR 333.A O no hydrogen 2.938 N/A LYS 338.A N SER 334.A O no hydrogen 2.903 N/A LYS 338.A NZ TYR 497.A O no hydrogen 3.501 N/A SER 339.A OG PHE 335.A O no hydrogen 2.767 N/A GLU 340.A N ILE 336.A O no hydrogen 3.281 N/A LEU 342.A N TYR 345.A OH no hydrogen 3.423 N/A TYR 345.A OH GLU 340.A O no hydrogen 2.732 N/A LYS 346.A N SER 344.A OG no hydrogen 3.412 N/A ILE 350.A N LYS 346.A O no hydrogen 3.192 N/A SER 351.A N LEU 347.A O no hydrogen 2.929 N/A SER 351.A OG LEU 347.A O no hydrogen 3.055 N/A LYS 352.A N ASP 348.A O no hydrogen 2.896 N/A LYS 352.A NZ GLU 400.A OE1 no hydrogen 2.228 N/A ASN 353.A N SER 349.A O no hydrogen 2.916 N/A ALA 354.A N ILE 350.A O no hydrogen 2.902 N/A PHE 355.A N SER 351.A O no hydrogen 2.943 N/A CYS 357.A N LEU 432.A O no hydrogen 3.000 N/A CYS 357.A SG MET 358.A O no hydrogen 3.340 N/A GLY 359.A N TYR 430.A O no hydrogen 2.617 N/A LYS 360.A N ILE 372.A O no hydrogen 3.003 N/A VAL 361.A N ASP 428.A O no hydrogen 2.851 N/A LEU 362.A N THR 370.A O no hydrogen 2.940 N/A ARG 364.A NH1 LEU 425.A O no hydrogen 2.344 N/A GLU 368.A N GLY 365.A O no hydrogen 3.443 N/A MET 369.A N LEU 420.A O no hydrogen 3.233 N/A THR 370.A N ASN 363.A O no hydrogen 3.454 N/A THR 370.A OG1 GLU 368.A OE1 no hydrogen 3.429 N/A PHE 371.A N VAL 418.A O no hydrogen 2.748 N/A ILE 372.A N LYS 360.A O no hydrogen 2.996 N/A GLY 373.A N PHE 416.A O no hydrogen 3.055 N/A ASP 375.A N ASP 374.A OD1 no hydrogen 2.412 N/A THR 377.A N ASP 374.A O no hydrogen 3.318 N/A THR 385.A N GLY 381.A O no hydrogen 3.136 N/A THR 385.A OG1 GLY 381.A O no hydrogen 3.392 N/A THR 385.A OG1 LYS 382.A O no hydrogen 2.633 N/A PHE 386.A N LYS 382.A O no hydrogen 2.943 N/A ALA 387.A N ALA 383.A O no hydrogen 2.892 N/A LYS 388.A N ASP 384.A O no hydrogen 2.901 N/A VAL 389.A N THR 385.A O no hydrogen 2.939 N/A LEU 390.A N PHE 386.A O no hydrogen 2.898 N/A THR 391.A OG1 ALA 387.A O no hydrogen 3.339 N/A THR 391.A OG1 LYS 388.A O no hydrogen 3.101 N/A THR 392.A N VAL 389.A O no hydrogen 3.352 N/A THR 392.A OG1 HIS 462.A ND1 no hydrogen 3.321 N/A THR 392.A OG1 TYR 469.A OH no hydrogen 3.358 N/A VAL 396.A N CYS 404.A O no hydrogen 3.035 N/A THR 397.A N SER 433.A O no hydrogen 2.709 N/A VAL 398.A N ILE 402.A O no hydrogen 2.752 N/A ASP 399.A N LYS 431.A O no hydrogen 3.077 N/A ILE 402.A N VAL 398.A O no hydrogen 3.139 N/A CYS 404.A N VAL 396.A O no hydrogen 2.884 N/A VAL 406.A N ASN 394.A O no hydrogen 3.055 N/A ILE 407.A N VAL 419.A O no hydrogen 3.096 N/A LYS 409.A NZ LEU 390.A O no hydrogen 3.069 N/A LYS 409.A NZ GLY 393.A O no hydrogen 3.013 N/A ASP 410.A N LYS 417.A O no hydrogen 2.773 N/A ASN 414.A ND2 ASP 374.A OD1 no hydrogen 2.262 N/A PHE 416.A N GLY 373.A O no hydrogen 3.140 N/A LYS 417.A N ASP 410.A O no hydrogen 2.733 N/A VAL 418.A N PHE 371.A O no hydrogen 3.121 N/A VAL 419.A N ARG 408.A O no hydrogen 3.193 N/A LEU 420.A N MET 369.A O no hydrogen 2.951 N/A SER 421.A OG SER 421.A O no hydrogen 2.554 N/A CYS 422.A SG PRO 423.A O no hydrogen 3.296 N/A ASN 427.A N LEU 425.A O no hydrogen 3.071 N/A TYR 430.A N GLY 359.A O no hydrogen 2.754 N/A LYS 431.A NZ GLU 400.A OE2 no hydrogen 2.256 N/A LEU 432.A N CYS 357.A O no hydrogen 2.808 N/A SER 433.A N THR 397.A O no hydrogen 2.990 N/A PHE 434.A N PHE 355.A O no hydrogen 3.456 N/A LYS 436.A NZ ASP 348.A OD2 no hydrogen 3.299 N/A GLN 443.A N ASP 440.A OD1 no hydrogen 2.489 N/A MET 444.A N ASP 440.A O no hydrogen 3.205 N/A TYR 445.A N LEU 441.A O no hydrogen 2.910 N/A TYR 445.A OH SER 185.A OG no hydrogen 2.834 N/A LYS 446.A N ALA 442.A O no hydrogen 2.928 N/A ASP 447.A N GLN 443.A O no hydrogen 3.387 N/A ALA 453.A N ASN 449.A O no hydrogen 3.007 N/A LEU 454.A N LEU 450.A O no hydrogen 2.963 N/A ASP 455.A N ASN 451.A O no hydrogen 2.922 N/A MET 456.A N ILE 452.A O no hydrogen 2.922 N/A ALA 457.A N ALA 453.A O no hydrogen 2.917 N/A ARG 458.A N LEU 454.A O no hydrogen 2.989 N/A TYR 459.A N ASP 455.A O no hydrogen 2.963 N/A CYS 460.A N MET 456.A O no hydrogen 2.877 N/A CYS 460.A SG ASP 167.A O no hydrogen 3.230 N/A CYS 460.A SG SER 188.A OG no hydrogen 3.096 N/A ILE 461.A N ALA 457.A O no hydrogen 2.974 N/A HIS 462.A N ARG 458.A O no hydrogen 2.994 N/A HIS 462.A ND1 THR 392.A OG1 no hydrogen 3.321 N/A ASP 463.A N TYR 459.A O no hydrogen 2.953 N/A ALA 464.A N CYS 460.A O no hydrogen 2.925 N/A CYS 465.A N ILE 461.A O no hydrogen 2.974 N/A CYS 465.A SG ILE 461.A O no hydrogen 3.701 N/A LEU 466.A N HIS 462.A O no hydrogen 2.945 N/A CYS 467.A N ALA 464.A O no hydrogen 3.308 N/A TYR 469.A N CYS 465.A O no hydrogen 3.010 N/A TYR 469.A OH THR 392.A OG1 no hydrogen 3.358 N/A LEU 470.A N LEU 466.A O no hydrogen 2.903 N/A TRP 471.A N CYS 467.A O no hydrogen 2.881 N/A GLU 472.A N GLN 468.A O no hydrogen 2.939 N/A TYR 473.A N TYR 469.A O no hydrogen 2.912 N/A TYR 474.A N LEU 470.A O no hydrogen 2.936 N/A THR 478.A OG1 GLY 475.A O no hydrogen 2.986 N/A LYS 479.A N GLY 475.A O no hydrogen 3.270 N/A LYS 479.A NZ TYR 474.A O no hydrogen 2.691 N/A THR 480.A N VAL 476.A O no hydrogen 2.876 N/A THR 480.A OG1 VAL 476.A O no hydrogen 2.813 N/A ASP 481.A N GLU 477.A O no hydrogen 2.959 N/A ALA 482.A N THR 478.A O no hydrogen 2.937 N/A GLY 483.A N LYS 479.A O no hydrogen 2.880 N/A ALA 484.A N THR 480.A O no hydrogen 2.929 N/A ALA 485.A N ASP 481.A O no hydrogen 2.951 N/A THR 486.A N ALA 482.A O no hydrogen 2.916 N/A THR 486.A OG1 ALA 482.A O no hydrogen 2.905 N/A THR 486.A OG1 TYR 661.A OH no hydrogen 3.186 N/A TYR 487.A N GLY 483.A O no hydrogen 2.887 N/A GLN 491.A N GLN 491.A OE1 no hydrogen 3.036 N/A GLN 491.A NE2 PRO 122.A O no hydrogen 3.171 N/A MET 493.A N PRO 490.A O no hydrogen 3.013 N/A THR 501.A N ARG 498.A O no hydrogen 3.240 N/A ILE 502.A N ARG 498.A O no hydrogen 3.367 N/A LYS 504.A N THR 501.A O no hydrogen 3.226 N/A LYS 504.A NZ GLU 107.A O no hydrogen 3.098 N/A LEU 507.A N ILE 503.A O no hydrogen 3.142 N/A LEU 508.A N LYS 504.A O no hydrogen 2.879 N/A LYS 509.A N GLY 505.A O no hydrogen 2.963 N/A LEU 510.A N PRO 506.A O no hydrogen 2.885 N/A LEU 511.A N LEU 507.A O no hydrogen 2.890 N/A LEU 512.A N LEU 508.A O no hydrogen 2.938 N/A GLU 513.A N LYS 509.A O no hydrogen 2.934 N/A THR 514.A N LEU 510.A O no hydrogen 2.892 N/A THR 514.A OG1 LEU 510.A O no hydrogen 2.919 N/A LYS 515.A NZ GLU 513.A O no hydrogen 3.453 N/A THR 516.A N LEU 511.A O no hydrogen 3.250 N/A THR 516.A OG1 THR 514.A O no hydrogen 3.553 N/A ILE 517.A N ARG 65.A O no hydrogen 2.684 N/A VAL 519.A N ILE 67.A O no hydrogen 3.030 N/A ARG 520.A NH2 TYR 680.A O no hydrogen 2.642 N/A SER 521.A N ASP 70.A OD2 no hydrogen 2.575 N/A SER 521.A OG ASP 68.A OD2 no hydrogen 3.098 N/A SER 521.A OG ASP 70.A OD2 no hydrogen 2.505 N/A LYS 526.A N GLN 525.A OE1 no hydrogen 3.350 N/A LYS 526.A NZ PHE 527.A O no hydrogen 3.530 N/A PHE 535.A N GLY 751.A O no hydrogen 3.005 N/A LYS 538.A NZ SER 748.A O no hydrogen 2.778 N/A GLN 539.A NE2 MET 541.A O no hydrogen 3.389 N/A SER 543.A OG PHE 542.A O no hydrogen 2.475 N/A ASN 544.A ND2 SER 762.A O no hydrogen 3.599 N/A ASN 545.A ND2 SER 768.A OG no hydrogen 3.148 N/A VAL 546.A N TYR 796.A O no hydrogen 3.055 N/A LEU 547.A N THR 758.A O no hydrogen 2.516 N/A ILE 548.A N ALA 794.A O no hydrogen 3.298 N/A PHE 549.A N VAL 756.A O no hydrogen 3.304 N/A ASP 550.A N GLU 791.A O no hydrogen 3.152 N/A TYR 551.A N ASP 754.A O no hydrogen 3.219 N/A ASN 552.A N LYS 789.A O no hydrogen 3.242 N/A ASN 557.A N SER 553.A O no hydrogen 3.089 N/A VAL 558.A N LEU 554.A O no hydrogen 2.878 N/A CYS 559.A N TYR 555.A O no hydrogen 2.944 N/A CYS 559.A SG TYR 555.A O no hydrogen 3.292 N/A ILE 560.A N PRO 556.A O no hydrogen 2.940 N/A PHE 561.A N ASN 557.A O no hydrogen 2.874 N/A GLY 562.A N VAL 558.A O no hydrogen 2.924 N/A ASN 563.A ND2 ASP 617.A O no hydrogen 2.846 N/A ASN 563.A ND2 ILE 620.A O no hydrogen 3.071 N/A LEU 564.A N CYS 559.A O no hydrogen 3.245 N/A SER 565.A N THR 568.A OG1 no hydrogen 3.277 N/A THR 568.A N SER 565.A O no hydrogen 3.160 N/A THR 568.A OG1 ASN 563.A O no hydrogen 2.952 N/A THR 568.A OG1 SER 565.A O no hydrogen 3.059 N/A VAL 570.A N ILE 615.A O no hydrogen 2.845 N/A VAL 573.A N ILE 613.A O no hydrogen 2.858 N/A VAL 574.A N SER 74.A O no hydrogen 3.003 N/A ASN 577.A ND2 GLU 580.A OE1 no hydrogen 3.011 N/A GLU 580.A N ASN 577.A OD1 no hydrogen 3.109 N/A GLU 581.A N ASN 577.A O no hydrogen 3.242 N/A ILE 583.A N LEU 579.A O no hydrogen 3.017 N/A ASN 584.A N GLU 580.A O no hydrogen 2.857 N/A ASN 584.A ND2 TYR 75.A O no hydrogen 3.583 N/A ASN 584.A ND2 SER 575.A OG no hydrogen 2.981 N/A ASN 585.A N GLU 581.A O no hydrogen 2.915 N/A ASN 585.A ND2 GLU 581.A O no hydrogen 2.766 N/A GLN 586.A N GLU 582.A O no hydrogen 2.965 N/A LEU 587.A N ILE 583.A O no hydrogen 2.996 N/A LEU 588.A N ASN 584.A O no hydrogen 2.815 N/A LEU 589.A N ASN 585.A O no hydrogen 2.983 N/A LYS 591.A N LEU 587.A O no hydrogen 2.937 N/A TYR 592.A N LEU 588.A O no hydrogen 3.192 N/A ARG 596.A NE ASP 617.A OD1 no hydrogen 3.547 N/A ARG 596.A NH2 ASP 617.A OD2 no hydrogen 3.570 N/A ILE 598.A N PHE 616.A O no hydrogen 3.056 N/A VAL 600.A N ALA 614.A O no hydrogen 3.021 N/A CYS 602.A N GLU 612.A O no hydrogen 3.121 N/A CYS 602.A SG VAL 600.A O no hydrogen 3.829 N/A ARG 605.A NH2 GLU 71.A OE2 no hydrogen 2.674 N/A LEU 609.A N LEU 606.A O no hydrogen 3.182 N/A ILE 610.A N SER 575.A O no hydrogen 3.258 N/A ILE 613.A N VAL 573.A O no hydrogen 2.976 N/A ALA 614.A N VAL 600.A O no hydrogen 3.148 N/A ILE 615.A N GLY 571.A O no hydrogen 3.160 N/A PHE 616.A N ILE 598.A O no hydrogen 2.899 N/A ASP 617.A N THR 568.A O no hydrogen 3.070 N/A ARG 618.A NH1 PHE 561.A O no hydrogen 2.480 N/A ARG 618.A NH2 TYR 724.A OH no hydrogen 2.600 N/A SER 619.A N ASP 617.A OD1 no hydrogen 2.744 N/A SER 619.A OG ASP 617.A OD1 no hydrogen 3.185 N/A LEU 627.A N THR 623.A O no hydrogen 2.992 N/A LEU 628.A N ILE 624.A O no hydrogen 2.942 N/A ARG 629.A N PRO 625.A O no hydrogen 2.873 N/A ARG 629.A NE GLU 621.A OE2 no hydrogen 3.112 N/A ARG 629.A NH2 GLU 621.A OE1 no hydrogen 3.024 N/A ARG 629.A NH2 GLU 621.A OE2 no hydrogen 2.789 N/A THR 630.A N ARG 626.A O no hydrogen 2.978 N/A THR 630.A OG1 ARG 626.A O no hydrogen 3.079 N/A PHE 631.A N LEU 627.A O no hydrogen 3.048 N/A LEU 632.A N LEU 628.A O no hydrogen 2.882 N/A ALA 633.A N ARG 629.A O no hydrogen 2.943 N/A GLU 634.A N THR 630.A O no hydrogen 3.041 N/A ARG 635.A N PHE 631.A O no hydrogen 2.954 N/A ARG 635.A NE GLN 658.A OE1 no hydrogen 3.318 N/A ALA 636.A N LEU 632.A O no hydrogen 2.921 N/A ARG 637.A N ALA 633.A O no hydrogen 2.991 N/A TYR 638.A N GLU 634.A O no hydrogen 3.038 N/A LYS 639.A N ARG 635.A O no hydrogen 2.855 N/A LYS 640.A N ALA 636.A O no hydrogen 2.999 N/A MET 641.A N ARG 637.A O no hydrogen 2.996 N/A LEU 642.A N TYR 638.A O no hydrogen 2.894 N/A LYS 643.A N LYS 639.A O no hydrogen 2.921 N/A GLN 644.A N LYS 640.A O no hydrogen 2.989 N/A GLN 644.A N MET 641.A O no hydrogen 3.239 N/A ALA 645.A N LEU 642.A O no hydrogen 2.972 N/A LYS 651.A N SER 647.A O no hydrogen 3.145 N/A ALA 652.A N SER 648.A O no hydrogen 2.922 N/A ILE 653.A N THR 649.A O no hydrogen 2.950 N/A TYR 654.A N GLU 650.A O no hydrogen 2.936 N/A ASP 655.A N LYS 651.A O no hydrogen 2.916 N/A SER 656.A N ALA 652.A O no hydrogen 2.939 N/A SER 656.A OG ALA 652.A O no hydrogen 3.024 N/A MET 657.A N ILE 653.A O no hydrogen 2.953 N/A GLN 658.A N TYR 654.A O no hydrogen 2.985 N/A GLN 658.A NE2 ASP 655.A O no hydrogen 2.994 N/A GLN 658.A NE2 ASP 655.A OD1 no hydrogen 3.101 N/A TYR 659.A N ASP 655.A O no hydrogen 2.950 N/A THR 660.A N SER 656.A O no hydrogen 2.920 N/A THR 660.A OG1 SER 656.A O no hydrogen 3.510 N/A THR 660.A OG1 MET 657.A O no hydrogen 2.489 N/A TYR 661.A N MET 657.A O no hydrogen 3.025 N/A TYR 661.A OH THR 486.A OG1 no hydrogen 3.186 N/A LYS 662.A N GLN 658.A O no hydrogen 3.005 N/A ILE 663.A N TYR 659.A O no hydrogen 2.924 N/A VAL 664.A N THR 660.A O no hydrogen 2.940 N/A ALA 665.A N TYR 661.A O no hydrogen 2.960 N/A ASN 666.A N LYS 662.A O no hydrogen 2.986 N/A SER 667.A N ILE 663.A O no hydrogen 2.829 N/A SER 667.A OG ILE 663.A O no hydrogen 2.763 N/A VAL 668.A N VAL 664.A O no hydrogen 3.000 N/A TYR 669.A OH ALA 685.A O no hydrogen 2.960 N/A GLY 670.A N ASN 666.A O no hydrogen 2.996 N/A LEU 671.A N SER 667.A O no hydrogen 2.845 N/A MET 672.A N VAL 668.A O no hydrogen 2.939 N/A GLY 673.A N TYR 669.A O no hydrogen 2.972 N/A GLY 673.A N GLY 670.A O no hydrogen 3.140 N/A PHE 674.A N LEU 671.A O no hydrogen 2.837 N/A ARG 675.A NE LYS 524.A O no hydrogen 3.235 N/A ARG 675.A NH2 LYS 524.A O no hydrogen 2.910 N/A SER 677.A N PHE 674.A O no hydrogen 3.408 N/A LEU 679.A N SER 677.A OG no hydrogen 3.405 N/A TYR 680.A OH GLN 525.A O no hydrogen 3.207 N/A SER 681.A N MET 672.A O no hydrogen 3.000 N/A SER 681.A OG SER 684.A OG no hydrogen 2.599 N/A TYR 682.A OH PRO 528.A O no hydrogen 2.833 N/A SER 684.A OG SER 681.A OG no hydrogen 2.599 N/A ALA 685.A N SER 681.A O no hydrogen 3.313 N/A LYS 686.A N TYR 682.A O no hydrogen 3.035 N/A LYS 686.A NZ GLU 603.A O no hydrogen 2.521 N/A LYS 686.A NZ GLU 612.A OE1 no hydrogen 2.400 N/A SER 687.A N ALA 683.A O no hydrogen 2.887 N/A SER 687.A OG ALA 683.A O no hydrogen 2.553 N/A CYS 688.A N SER 684.A O no hydrogen 2.937 N/A CYS 688.A SG TYR 555.A O no hydrogen 3.728 N/A THR 689.A N ALA 685.A O no hydrogen 3.022 N/A THR 689.A OG1 TYR 669.A OH no hydrogen 2.827 N/A THR 689.A OG1 ALA 685.A O no hydrogen 3.387 N/A SER 690.A N LYS 686.A O no hydrogen 2.927 N/A SER 690.A OG LYS 686.A O no hydrogen 2.812 N/A ILE 691.A N SER 687.A O no hydrogen 2.915 N/A GLY 692.A N CYS 688.A O no hydrogen 2.975 N/A ARG 693.A N THR 689.A O no hydrogen 2.967 N/A ARG 694.A N SER 690.A O no hydrogen 2.931 N/A MET 695.A N ILE 691.A O no hydrogen 2.930 N/A ILE 696.A N GLY 692.A O no hydrogen 2.981 N/A LEU 697.A N ARG 693.A O no hydrogen 2.981 N/A TYR 698.A N ARG 694.A O no hydrogen 2.902 N/A TYR 698.A OH VAL 783.A O no hydrogen 3.199 N/A LEU 699.A N MET 695.A O no hydrogen 2.973 N/A GLU 700.A N ILE 696.A O no hydrogen 2.943 N/A SER 701.A N LEU 697.A O no hydrogen 2.901 N/A SER 701.A OG LEU 697.A O no hydrogen 3.163 N/A SER 701.A OG TYR 698.A O no hydrogen 2.738 N/A VAL 702.A N TYR 698.A O no hydrogen 2.963 N/A LEU 703.A N LEU 699.A O no hydrogen 2.940 N/A ASN 704.A N GLU 700.A O no hydrogen 3.012 N/A ASN 704.A ND2 GLU 700.A OE2 no hydrogen 3.237 N/A LEU 708.A N PHE 744.A O no hydrogen 3.365 N/A SER 709.A N MET 712.A O no hydrogen 3.039 N/A MET 712.A N SER 709.A O no hydrogen 2.977 N/A LEU 713.A N VAL 734.A O no hydrogen 3.160 N/A ARG 714.A N GLU 707.A O no hydrogen 2.932 N/A ARG 714.A NH2 ALA 716.A O no hydrogen 3.527 N/A PHE 715.A N PRO 732.A O no hydrogen 3.237 N/A THR 718.A OG1 ILE 730.A O no hydrogen 3.132 N/A PHE 723.A N ASN 721.A OD1 no hydrogen 2.780 N/A TYR 724.A N ASN 721.A OD1 no hydrogen 2.818 N/A ARG 728.A NH1 ARG 782.A O no hydrogen 2.670 N/A ASN 731.A N ASP 729.A OD1 no hydrogen 2.965 N/A ILE 733.A N ASN 731.A OD1 no hydrogen 3.217 N/A VAL 734.A N LEU 713.A O no hydrogen 3.218 N/A THR 736.A N GLY 711.A O no hydrogen 3.261 N/A THR 736.A OG1 GLY 711.A O no hydrogen 2.553 N/A SER 737.A OG GLU 774.A OE1 no hydrogen 2.734 N/A ARG 745.A N ASP 761.A OD1 no hydrogen 3.478 N/A ARG 747.A N GLU 759.A O no hydrogen 3.091 N/A ARG 747.A NE GLU 759.A OE1 no hydrogen 3.055 N/A ARG 747.A NH2 GLN 539.A OE1 no hydrogen 2.924 N/A ARG 747.A NH2 GLU 759.A OE1 no hydrogen 2.605 N/A VAL 749.A N PHE 757.A O no hydrogen 3.021 N/A TYR 750.A OH LYS 804.A O no hydrogen 2.280 N/A ASP 752.A N SER 755.A O no hydrogen 3.317 N/A THR 753.A N LYS 533.A O no hydrogen 2.968 N/A THR 753.A OG1 ASP 752.A OD1 no hydrogen 3.128 N/A VAL 756.A N PHE 549.A O no hydrogen 3.078 N/A PHE 757.A N TYR 750.A O no hydrogen 2.678 N/A THR 758.A N LEU 547.A O no hydrogen 2.801 N/A GLU 759.A N ARG 747.A O no hydrogen 2.567 N/A ILE 760.A N ASN 545.A O no hydrogen 3.135 N/A SER 762.A N ILE 760.A O no hydrogen 2.901 N/A GLN 763.A NE2 SER 543.A O no hydrogen 2.884 N/A SER 768.A OG ASP 764.A O no hydrogen 2.815 N/A ILE 769.A N VAL 765.A O no hydrogen 2.878 N/A GLU 770.A N ASP 766.A O no hydrogen 2.981 N/A ILE 771.A N LYS 767.A O no hydrogen 2.885 N/A ALA 772.A N SER 768.A O no hydrogen 2.874 N/A LYS 773.A N ILE 769.A O no hydrogen 2.922 N/A GLU 774.A N GLU 770.A O no hydrogen 3.015 N/A LEU 775.A N ILE 771.A O no hydrogen 2.866 N/A GLU 776.A N ALA 772.A O no hydrogen 2.880 N/A ARG 777.A N LYS 773.A O no hydrogen 3.015 N/A ARG 777.A NH2 GLU 774.A OE1 no hydrogen 2.975 N/A LEU 778.A N GLU 774.A O no hydrogen 2.944 N/A ILE 779.A N LEU 775.A O no hydrogen 2.891 N/A ASN 780.A N GLU 776.A O no hydrogen 2.961 N/A SER 781.A N ARG 777.A O no hydrogen 2.934 N/A SER 781.A OG ARG 777.A O no hydrogen 3.129 N/A SER 781.A OG LEU 778.A O no hydrogen 3.099 N/A ARG 782.A N LEU 778.A O no hydrogen 2.903 N/A VAL 783.A N ILE 779.A O no hydrogen 2.905 N/A LEU 784.A N ILE 779.A O no hydrogen 2.975 N/A PHE 788.A N PHE 785.A O no hydrogen 3.258 N/A ILE 790.A N ASN 780.A OD1 no hydrogen 3.206 N/A GLU 791.A N ASP 550.A O no hydrogen 2.897 N/A GLU 793.A N ILE 548.A O no hydrogen 3.001 N/A VAL 795.A N TYR 812.A O no hydrogen 2.957 N/A TYR 796.A N VAL 546.A O no hydrogen 2.928 N/A LYS 797.A N MET 810.A O no hydrogen 3.168 N/A ILE 800.A N THR 808.A O no hydrogen 2.974 N/A MET 801.A N LYS 540.A O no hydrogen 2.897 N/A GLN 802.A N LYS 806.A O no hydrogen 3.013 N/A SER 803.A N LYS 806.A O no hydrogen 3.516 N/A LYS 805.A N SER 803.A OG no hydrogen 3.415 N/A LYS 805.A NZ ASP 752.A OD1 no hydrogen 3.509 N/A TYR 807.A N LYS 827.A O no hydrogen 3.222 N/A THR 808.A N ILE 800.A O no hydrogen 3.217 N/A THR 809.A N ILE 825.A O no hydrogen 3.261 N/A THR 809.A OG1 LYS 797.A O no hydrogen 2.669 N/A THR 809.A OG1 MET 810.A O no hydrogen 3.232 N/A MET 810.A N LYS 797.A O no hydrogen 3.120 N/A LYS 811.A N GLU 823.A O no hydrogen 2.789 N/A TYR 812.A N VAL 795.A O no hydrogen 3.066 N/A SER 815.A OG SER 815.A O no hydrogen 2.560 N/A SER 816.A OG ASN 817.A O no hydrogen 3.259 N/A SER 820.A OG SER 816.A OG no hydrogen 3.416 N/A SER 820.A OG ASN 817.A O no hydrogen 3.268 N/A SER 820.A OG ASN 817.A OD1 no hydrogen 2.333 N/A GLU 823.A N LYS 811.A O no hydrogen 3.346 N/A ARG 824.A NH1 GLU 831.A OE1 no hydrogen 3.236 N/A ILE 825.A N THR 809.A O no hydrogen 3.000 N/A LYS 827.A N TYR 807.A O no hydrogen 3.194 N/A SER 830.A OG HIS 840.A NE2 no hydrogen 3.356 N/A ARG 834.A NH1 LEU 342.A O no hydrogen 3.455 N/A SER 837.A OG LEU 890.A O no hydrogen 3.302 N/A LYS 838.A N LEU 890.A O no hydrogen 3.320 N/A PHE 839.A N SER 837.A OG no hydrogen 3.304 N/A PHE 839.A N LEU 890.A O no hydrogen 3.050 N/A LYS 841.A NZ SER 837.A O no hydrogen 2.681 N/A MET 843.A N PHE 839.A O no hydrogen 3.471 N/A ILE 844.A N HIS 840.A O no hydrogen 2.968 N/A LYS 845.A N LYS 841.A O no hydrogen 2.907 N/A THR 846.A N ASN 842.A O no hydrogen 2.983 N/A TYR 847.A N MET 843.A O no hydrogen 2.919 N/A LYS 848.A N ILE 844.A O no hydrogen 2.894 N/A LYS 848.A NZ GLN 802.A OE1 no hydrogen 2.970 N/A THR 849.A N LYS 845.A O no hydrogen 2.997 N/A THR 849.A OG1 LYS 845.A O no hydrogen 2.983 N/A ARG 850.A N THR 846.A O no hydrogen 2.909 N/A LEU 851.A N TYR 847.A O no hydrogen 2.866 N/A SER 852.A N LYS 848.A O no hydrogen 2.907 N/A SER 852.A OG LYS 848.A O no hydrogen 3.229 N/A SER 852.A OG THR 849.A O no hydrogen 2.567 N/A GLU 853.A N THR 849.A O no hydrogen 2.954 N/A MET 854.A N ARG 850.A O no hydrogen 2.873 N/A LEU 855.A N LEU 851.A O no hydrogen 2.885 N/A SER 856.A N SER 852.A O no hydrogen 2.909 N/A SER 856.A OG GLU 853.A O no hydrogen 2.355 N/A GLU 857.A N GLU 853.A O no hydrogen 2.928 N/A GLY 858.A N MET 854.A O no hydrogen 2.588 N/A ARG 859.A NH2 GLN 864.A OE1 no hydrogen 3.551 N/A SER 862.A N ASN 861.A OD1 no hydrogen 2.399 N/A CYS 866.A SG ASP 985.A OD1 no hydrogen 3.430 N/A ILE 867.A N ASN 863.A O no hydrogen 3.066 N/A ASP 868.A N GLN 864.A O no hydrogen 2.943 N/A ILE 869.A N VAL 865.A O no hydrogen 2.926 N/A LEU 870.A N CYS 866.A O no hydrogen 2.897 N/A ARG 871.A N ILE 867.A O no hydrogen 2.931 N/A SER 872.A N ASP 868.A O no hydrogen 2.942 N/A SER 872.A OG TYR 847.A OH no hydrogen 2.910 N/A LEU 873.A N ILE 869.A O no hydrogen 2.890 N/A GLU 874.A N LEU 870.A O no hydrogen 2.907 N/A THR 875.A N ARG 871.A O no hydrogen 2.957 N/A THR 875.A OG1 ARG 871.A O no hydrogen 3.185 N/A ASP 876.A N SER 872.A O no hydrogen 2.917 N/A LEU 877.A N LEU 873.A O no hydrogen 2.904 N/A ARG 878.A N GLU 874.A O no hydrogen 2.933 N/A SER 879.A N THR 875.A O no hydrogen 2.921 N/A GLU 880.A N ASP 876.A O no hydrogen 2.917 N/A PHE 881.A N LEU 877.A O no hydrogen 2.913 N/A ASP 882.A N ARG 878.A O no hydrogen 2.924 N/A SER 883.A N SER 879.A O no hydrogen 2.902 N/A ARG 884.A N GLU 880.A O no hydrogen 3.143 N/A SER 886.A OG GLU 880.A OE1 no hydrogen 2.843 N/A SER 886.A OG GLU 880.A OE2 no hydrogen 3.162 N/A GLU 889.A N GLU 889.A OE1 no hydrogen 2.509 N/A LEU 890.A N PRO 887.A O no hydrogen 3.316 N/A PHE 891.A N LEU 888.A O no hydrogen 3.113 N/A LEU 893.A N PHE 931.A O no hydrogen 2.873 N/A SER 894.A OG ASP 343.A OD1 no hydrogen 2.814 N/A SER 894.A OG ARG 834.A O no hydrogen 2.960 N/A ARG 895.A N TYR 929.A O no hydrogen 3.152 N/A ARG 895.A NE TYR 929.A OH no hydrogen 3.281 N/A ARG 895.A NH1 GLU 952.A OE2 no hydrogen 3.539 N/A ARG 895.A NH2 TYR 929.A OH no hydrogen 3.247 N/A ARG 895.A NH2 GLU 952.A OE1 no hydrogen 3.449 N/A HIS 897.A ND1 GLU 924.A O no hydrogen 2.672 N/A SER 899.A N MET 314.A O no hydrogen 2.808 N/A ASN 900.A N HIS 898.A ND1 no hydrogen 3.212 N/A SER 903.A OG LYS 902.A O no hydrogen 2.439 N/A MET 909.A N ASN 906.A OD1 no hydrogen 3.423 N/A TYR 910.A N ASN 906.A O no hydrogen 3.219 N/A LEU 911.A N PRO 907.A O no hydrogen 2.898 N/A VAL 912.A N ASN 908.A O no hydrogen 3.036 N/A THR 913.A N MET 909.A O no hydrogen 2.869 N/A THR 913.A OG1 MET 909.A O no hydrogen 2.893 N/A GLU 914.A N TYR 910.A O no hydrogen 2.905 N/A TYR 915.A N LEU 911.A O no hydrogen 2.989 N/A ASN 916.A N VAL 912.A O no hydrogen 2.933 N/A ASN 916.A ND2 ILE 923.A O no hydrogen 3.366 N/A LYS 917.A N THR 913.A O no hydrogen 2.881 N/A ASN 918.A N GLU 914.A O no hydrogen 2.963 N/A ILE 923.A N ASN 916.A OD1 no hydrogen 2.894 N/A GLU 924.A N GLU 927.A OE1 no hydrogen 3.474 N/A TYR 929.A N ARG 895.A O no hydrogen 3.046 N/A PHE 931.A N LEU 893.A O no hydrogen 2.844 N/A ALA 932.A N THR 953.A O no hydrogen 3.002 N/A TYR 933.A N TYR 972.A OH no hydrogen 3.467 N/A ILE 934.A N TYR 951.A O no hydrogen 3.048 N/A CYS 935.A N ARG 966.A O no hydrogen 3.023 N/A CYS 935.A SG PRO 936.A O no hydrogen 3.813 N/A CYS 935.A SG ARG 966.A O no hydrogen 3.838 N/A ALA 937.A N ASN 964.A O no hydrogen 3.137 N/A VAL 939.A N PRO 936.A O no hydrogen 3.406 N/A THR 942.A N GLU 970.A OE2 no hydrogen 3.463 N/A THR 942.A OG1 PRO 940.A O no hydrogen 3.343 N/A LYS 944.A NZ PHE 998.A O no hydrogen 3.520 N/A TYR 951.A N ILE 948.A O no hydrogen 3.160 N/A GLU 952.A N LYS 949.A O no hydrogen 3.490 N/A THR 953.A N ALA 932.A O no hydrogen 2.886 N/A THR 953.A OG1 ALA 932.A O no hydrogen 3.462 N/A ILE 955.A N TYR 930.A O no hydrogen 3.167 N/A PHE 959.A N ASP 956.A O no hydrogen 3.271 N/A ARG 966.A N CYS 935.A O no hydrogen 2.834 N/A ARG 966.A NH2 GLU 970.A OE1 no hydrogen 3.534 N/A PHE 968.A N TYR 933.A O no hydrogen 3.096 N/A TYR 972.A OH PHE 891.A O no hydrogen 2.939 N/A PHE 973.A N TYR 969.A O no hydrogen 2.924 N/A LYS 974.A N GLU 970.A O no hydrogen 2.882 N/A ARG 975.A N VAL 971.A O no hydrogen 2.973 N/A ARG 975.A NH2 TYR 933.A OH no hydrogen 3.367 N/A LEU 976.A N TYR 972.A O no hydrogen 2.934 N/A THR 977.A N PHE 973.A O no hydrogen 2.906 N/A SER 978.A N LYS 974.A O no hydrogen 2.923 N/A GLU 979.A N ARG 975.A O no hydrogen 2.969 N/A ILE 980.A N LEU 976.A O no hydrogen 2.906 N/A VAL 981.A N THR 977.A O no hydrogen 2.904 N/A LEU 983.A N ILE 980.A O no hydrogen 3.105 N/A LEU 984.A N VAL 981.A O no hydrogen 3.047 N/A LYS 987.A N ASN 986.A OD1 no hydrogen 2.632 N/A LYS 987.A NZ ASP 985.A O no hydrogen 3.041 N/A CYS 990.A SG ASN 986.A O no hydrogen 3.301 N/A ILE 991.A N LYS 987.A O no hydrogen 2.821 N/A SER 992.A N VAL 988.A O no hydrogen 2.920 N/A PHE 993.A N LEU 989.A O no hydrogen 2.921 N/A PHE 994.A N CYS 990.A O no hydrogen 2.918 N/A GLN 995.A N ILE 991.A O no hydrogen 2.929 N/A ARG 996.A N SER 992.A O no hydrogen 2.889 N/A MET 997.A N PHE 993.A O no hydrogen 2.962 N/A PHE 998.A N PHE 994.A O no hydrogen 2.907 N/A GLY 999.A N PHE 994.A O no hydrogen 3.161 N/A THR 1003.A OG1 PHE 1004.A O no hydrogen 3.539 N/A