Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6lr6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N THR 1.A O no hydrogen 3.412 N/A PHE 6.A N ALA 2.A O no hydrogen 2.894 N/A LEU 7.A N LYS 3.A O no hydrogen 2.941 N/A LYS 8.A N VAL 4.A O no hydrogen 2.932 N/A LYS 8.A NZ ASP 5.A OD1 no hydrogen 3.555 N/A LYS 8.A NZ ASP 689.A O no hydrogen 3.165 N/A LYS 9.A N ASP 5.A O no hydrogen 2.865 N/A ILE 10.A N PHE 6.A O no hydrogen 3.014 N/A GLU 11.A N LEU 7.A O no hydrogen 2.889 N/A LYS 12.A N LYS 8.A O no hydrogen 2.928 N/A GLU 13.A N LYS 9.A O no hydrogen 3.015 N/A ILE 14.A N ILE 10.A O no hydrogen 2.941 N/A GLN 15.A N GLU 11.A O no hydrogen 2.864 N/A GLN 15.A NE2 ARG 151.A O no hydrogen 2.414 N/A GLN 15.A NE2 HIS 822.A NE2 no hydrogen 3.489 N/A GLN 16.A N LYS 12.A O no hydrogen 3.009 N/A LYS 17.A N GLU 13.A O no hydrogen 3.005 N/A TRP 18.A N ILE 14.A O no hydrogen 2.885 N/A TRP 18.A NE1 GLU 825.A OE2 no hydrogen 3.260 N/A ASP 19.A N GLN 15.A O no hydrogen 2.924 N/A THR 20.A N GLN 16.A O no hydrogen 3.009 N/A THR 20.A OG1 GLN 16.A O no hydrogen 3.435 N/A THR 20.A OG1 LYS 17.A O no hydrogen 2.944 N/A GLU 21.A N LYS 17.A O no hydrogen 2.924 N/A ARG 22.A N TRP 18.A O no hydrogen 2.893 N/A ARG 22.A N ASP 19.A O no hydrogen 3.161 N/A VAL 26.A N ASP 157.A OD2 no hydrogen 3.292 N/A ALA 28.A N GLU 618.A OE1 no hydrogen 3.003 N/A ASN 30.A N ASN 27.A O no hydrogen 3.349 N/A LEU 31.A N ASN 27.A O no hydrogen 2.948 N/A GLU 32.A N ALA 28.A O no hydrogen 3.094 N/A LYS 33.A N ASN 30.A O no hydrogen 3.263 N/A LYS 33.A NZ SER 29.A O no hydrogen 2.276 N/A SER 36.A OG GLN 34.A O no hydrogen 3.380 N/A LYS 39.A NZ TRP 622.A O no hydrogen 3.106 N/A LYS 39.A NZ ASP 626.A OD1 no hydrogen 3.540 N/A LYS 39.A NZ ASP 626.A OD2 no hydrogen 3.221 N/A TYR 40.A N CYS 77.A O no hydrogen 2.886 N/A PHE 41.A N ASP 626.A OD2 no hydrogen 2.677 N/A VAL 42.A N LEU 79.A O no hydrogen 2.967 N/A THR 43.A N LEU 627.A O no hydrogen 3.132 N/A THR 43.A OG1 LEU 627.A O no hydrogen 3.554 N/A TYR 46.A N TYR 557.A OH no hydrogen 3.056 N/A TYR 46.A OH TYR 171.A OH no hydrogen 2.768 N/A TYR 48.A OH HIS 208.A ND1 no hydrogen 2.769 N/A TYR 48.A OH SER 550.A OG no hydrogen 3.065 N/A MET 49.A N HIS 85.A O no hydrogen 3.323 N/A HIS 54.A N HIS 57.A ND1 no hydrogen 3.370 N/A GLY 56.A N HIS 54.A ND1 no hydrogen 3.026 N/A THR 58.A N HIS 54.A O no hydrogen 3.478 N/A THR 58.A OG1 LEU 55.A O no hydrogen 2.717 N/A PHE 59.A N LEU 55.A O no hydrogen 2.883 N/A SER 60.A N GLY 56.A O no hydrogen 2.969 N/A LEU 61.A N HIS 57.A O no hydrogen 2.922 N/A SER 62.A N THR 58.A O no hydrogen 2.843 N/A SER 62.A OG PHE 59.A O no hydrogen 2.683 N/A LYS 63.A NZ GLY 704.A O no hydrogen 3.141 N/A CYS 64.A SG LEU 61.A O no hydrogen 3.188 N/A GLU 65.A N LEU 61.A O no hydrogen 2.961 N/A PHE 66.A N SER 62.A O no hydrogen 2.862 N/A ALA 67.A N LYS 63.A O no hydrogen 2.907 N/A VAL 68.A N CYS 64.A O no hydrogen 2.884 N/A GLY 69.A N GLU 65.A O no hydrogen 2.955 N/A TYR 70.A N PHE 66.A O no hydrogen 2.914 N/A GLN 71.A N ALA 67.A O no hydrogen 2.876 N/A ARG 72.A N VAL 68.A O no hydrogen 2.972 N/A ARG 72.A NE MET 838.A O no hydrogen 3.424 N/A ARG 72.A NH2 MET 838.A O no hydrogen 3.011 N/A LEU 73.A N TYR 70.A O no hydrogen 2.951 N/A LYS 74.A N GLN 71.A O no hydrogen 3.162 N/A GLY 75.A N ARG 72.A O no hydrogen 3.095 N/A CYS 77.A N GLY 38.A O no hydrogen 2.960 N/A CYS 77.A SG GLY 38.A O no hydrogen 3.349 N/A CYS 78.A SG VAL 68.A O no hydrogen 3.710 N/A LEU 79.A N TYR 40.A O no hydrogen 2.870 N/A HIS 85.A N PRO 47.A O no hydrogen 2.915 N/A CYS 86.A N THR 164.A OG1 no hydrogen 2.447 N/A THR 87.A N THR 164.A OG1 no hydrogen 3.054 N/A THR 87.A OG1 ASP 553.A OD2 no hydrogen 2.977 N/A GLY 88.A N LEU 536.A O no hydrogen 3.227 N/A ALA 93.A N MET 89.A O no hydrogen 2.780 N/A CYS 94.A N PRO 90.A O no hydrogen 2.899 N/A CYS 94.A SG PRO 90.A O no hydrogen 3.263 N/A ALA 95.A N ILE 91.A O no hydrogen 2.953 N/A ASP 96.A N LYS 92.A O no hydrogen 2.912 N/A LYS 97.A N ALA 93.A O no hydrogen 2.876 N/A LEU 98.A N CYS 94.A O no hydrogen 2.908 N/A LYS 99.A N ALA 95.A O no hydrogen 2.936 N/A LYS 99.A NZ GLU 133.A OE1 no hydrogen 3.260 N/A ARG 100.A N ASP 96.A O no hydrogen 2.878 N/A ILE 102.A N LEU 98.A O no hydrogen 2.941 N/A GLU 103.A N LYS 99.A O no hydrogen 2.910 N/A LEU 104.A N ARG 100.A O no hydrogen 2.914 N/A TYR 105.A N GLU 101.A O no hydrogen 3.330 N/A MET 118.A N GLN 114.A O no hydrogen 3.062 N/A LYS 119.A N TRP 115.A O no hydrogen 2.918 N/A SER 120.A N GLY 116.A O no hydrogen 2.904 N/A SER 120.A OG GLY 116.A O no hydrogen 2.576 N/A LEU 121.A N ILE 117.A O no hydrogen 3.334 N/A LEU 121.A N MET 118.A O no hydrogen 3.111 N/A GLY 122.A N LYS 119.A O no hydrogen 2.870 N/A GLU 127.A N SER 124.A O no hydrogen 3.227 N/A PHE 131.A N ILE 128.A O no hydrogen 3.014 N/A SER 132.A N VAL 129.A O no hydrogen 2.925 N/A SER 132.A OG VAL 129.A O no hydrogen 2.991 N/A GLU 135.A N GLU 135.A OE1 no hydrogen 2.687 N/A HIS 136.A N GLU 133.A O no hydrogen 3.258 N/A TRP 137.A NE1 PHE 131.A O no hydrogen 2.895 N/A LEU 138.A N ALA 134.A O no hydrogen 2.965 N/A ASP 139.A N GLU 135.A O no hydrogen 2.905 N/A TYR 140.A N TRP 137.A O no hydrogen 3.114 N/A PHE 141.A N TRP 137.A O no hydrogen 2.983 N/A ALA 145.A N PHE 141.A O no hydrogen 2.953 N/A ILE 146.A N PRO 142.A O no hydrogen 2.959 N/A GLN 147.A N PRO 143.A O no hydrogen 2.892 N/A ASP 148.A N LEU 144.A O no hydrogen 2.940 N/A LEU 149.A N ALA 145.A O no hydrogen 2.933 N/A LYS 150.A N ILE 146.A O no hydrogen 2.904 N/A ARG 151.A N GLN 147.A O no hydrogen 2.917 N/A ARG 151.A NH1 ASP 689.A OD1 no hydrogen 2.853 N/A ARG 151.A NH2 ASP 689.A OD1 no hydrogen 2.382 N/A MET 152.A N ASP 148.A O no hydrogen 2.930 N/A MET 152.A N LEU 149.A O no hydrogen 2.916 N/A GLY 153.A N LEU 149.A O no hydrogen 3.123 N/A GLY 153.A N LYS 150.A O no hydrogen 3.053 N/A LYS 155.A N GLU 65.A OE1 no hydrogen 3.050 N/A VAL 156.A N LEU 154.A O no hydrogen 2.782 N/A ASP 157.A N PHE 80.A O no hydrogen 3.324 N/A ARG 159.A N ASP 157.A OD1 no hydrogen 3.320 N/A ARG 159.A NE ASP 157.A OD1 no hydrogen 3.227 N/A ARG 159.A NH1 ASN 27.A OD1 no hydrogen 3.057 N/A ARG 159.A NH2 ASN 27.A OD1 no hydrogen 2.896 N/A ARG 159.A NH2 ASP 157.A OD2 no hydrogen 3.402 N/A ARG 160.A N ASP 157.A O no hydrogen 3.086 N/A ARG 160.A NE TYR 561.A O no hydrogen 3.314 N/A ARG 160.A NH1 VAL 26.A O no hydrogen 3.478 N/A ARG 160.A NH2 VAL 26.A O no hydrogen 2.993 N/A SER 161.A N TRP 158.A O no hydrogen 3.257 N/A SER 161.A OG PHE 82.A O no hydrogen 2.978 N/A SER 161.A OG TRP 158.A O no hydrogen 3.108 N/A THR 164.A OG1 LEU 84.A O no hydrogen 3.540 N/A ASP 166.A N GLY 537.A O no hydrogen 2.968 N/A VAL 167.A N THR 165.A OG1 no hydrogen 3.279 N/A ASN 168.A N THR 165.A O no hydrogen 3.061 N/A ASN 168.A ND2 GLN 568.A OE1 no hydrogen 3.011 N/A ASN 168.A ND2 LEU 572.A O no hydrogen 2.776 N/A TYR 170.A OH ILE 582.A O no hydrogen 3.282 N/A TYR 171.A N ASN 168.A OD1 no hydrogen 3.032 N/A ASP 172.A N ASN 168.A O no hydrogen 3.217 N/A SER 173.A N PRO 169.A O no hydrogen 2.907 N/A SER 173.A OG MET 587.A O no hydrogen 2.858 N/A PHE 174.A N TYR 170.A O no hydrogen 2.933 N/A VAL 175.A N TYR 171.A O no hydrogen 2.958 N/A ARG 176.A N ASP 172.A O no hydrogen 2.903 N/A ARG 176.A NE ASP 172.A OD1 no hydrogen 2.745 N/A TRP 177.A N SER 173.A O no hydrogen 2.925 N/A TRP 177.A NE1 ASP 593.A OD1 no hydrogen 2.571 N/A GLN 178.A N PHE 174.A O no hydrogen 2.925 N/A GLN 178.A NE2 THR 555.A OG1 no hydrogen 2.527 N/A GLN 178.A NE2 ASN 645.A OD1 no hydrogen 3.258 N/A PHE 179.A N VAL 175.A O no hydrogen 2.952 N/A LEU 180.A N ARG 176.A O no hydrogen 2.893 N/A THR 181.A N TRP 177.A O no hydrogen 2.944 N/A THR 181.A OG1 TRP 177.A O no hydrogen 3.019 N/A LEU 182.A N GLN 178.A O no hydrogen 2.913 N/A ARG 183.A N PHE 179.A O no hydrogen 2.915 N/A GLU 184.A N LEU 180.A O no hydrogen 2.897 N/A ARG 185.A N THR 181.A O no hydrogen 2.948 N/A ARG 185.A N LEU 182.A O no hydrogen 3.232 N/A ARG 185.A NH1 ALA 648.A O no hydrogen 2.966 N/A ARG 185.A NH1 MET 649.A O no hydrogen 3.055 N/A ASN 186.A N ARG 183.A O no hydrogen 3.230 N/A LYS 187.A N LEU 182.A O no hydrogen 2.904 N/A LYS 187.A NZ GLU 493.A OE1 no hydrogen 3.296 N/A LYS 189.A N TYR 488.A O no hydrogen 2.938 N/A LYS 189.A NZ ASN 186.A O no hydrogen 3.014 N/A GLY 191.A N GLN 486.A O no hydrogen 2.939 N/A ARG 193.A N CYS 484.A O no hydrogen 2.902 N/A ARG 193.A NH1 LYS 192.A O no hydrogen 3.208 N/A THR 195.A N ALA 482.A O no hydrogen 2.933 N/A THR 195.A OG1 ILE 196.A O no hydrogen 3.351 N/A TYR 197.A N VAL 480.A O no hydrogen 2.867 N/A SER 198.A N GLN 203.A O no hydrogen 3.028 N/A SER 198.A OG ASP 201.A OD2 no hydrogen 3.015 N/A SER 198.A OG ASP 477.A OD2 no hydrogen 3.123 N/A LYS 200.A N ASP 477.A OD2 no hydrogen 2.594 N/A LYS 200.A NZ SER 476.A O no hydrogen 3.313 N/A ASP 201.A N SER 198.A O no hydrogen 3.255 N/A ASP 201.A N SER 198.A OG no hydrogen 3.266 N/A GLY 202.A N SER 198.A O no hydrogen 2.611 N/A GLN 203.A NE2 TYR 534.A O no hydrogen 2.893 N/A CYS 205.A N ILE 196.A O no hydrogen 2.611 N/A CYS 205.A SG ASP 209.A O no hydrogen 3.492 N/A HIS 208.A ND1 TYR 48.A OH no hydrogen 2.769 N/A ARG 210.A NE CYS 205.A O no hydrogen 3.115 N/A ARG 210.A NE MET 206.A O no hydrogen 3.151 N/A ARG 210.A NH1 CYS 205.A O no hydrogen 3.503 N/A ARG 210.A NH1 VAL 216.A O no hydrogen 2.926 N/A ARG 210.A NH2 GLY 213.A O no hydrogen 2.844 N/A ARG 210.A NH2 VAL 216.A O no hydrogen 2.430 N/A GLN 211.A N MET 472.A O no hydrogen 2.473 N/A THR 212.A N MET 472.A O no hydrogen 3.169 N/A GLN 219.A N GLU 466.A O no hydrogen 2.864 N/A TYR 221.A N TYR 464.A O no hydrogen 2.824 N/A TYR 221.A OH GLN 219.A OE1 no hydrogen 3.304 N/A THR 222.A N THR 250.A O no hydrogen 2.919 N/A LEU 223.A N LEU 462.A O no hydrogen 2.889 N/A LEU 224.A N ALA 248.A O no hydrogen 2.865 N/A LYS 225.A N ASP 460.A O no hydrogen 3.458 N/A LYS 225.A NZ GLY 459.A O no hydrogen 3.384 N/A LEU 226.A N LEU 246.A O no hydrogen 2.936 N/A LYS 227.A N SER 320.A O no hydrogen 3.262 N/A LYS 227.A NZ ASN 243.A OD1 no hydrogen 3.131 N/A VAL 228.A N ILE 244.A O no hydrogen 2.781 N/A LEU 229.A N SER 318.A O no hydrogen 2.979 N/A TYR 232.A OH LYS 242.A O no hydrogen 3.023 N/A LYS 235.A NZ GLU 308.A O no hydrogen 3.456 N/A LYS 235.A NZ GLU 313.A OE1 no hydrogen 2.740 N/A LYS 235.A NZ GLU 313.A OE2 no hydrogen 3.444 N/A LEU 236.A N PRO 233.A O no hydrogen 3.218 N/A SER 237.A N SER 234.A O no hydrogen 2.915 N/A SER 237.A OG SER 234.A O no hydrogen 2.694 N/A LEU 239.A N LEU 236.A O no hydrogen 2.921 N/A PHE 245.A N ILE 280.A O no hydrogen 2.888 N/A LEU 246.A N LEU 226.A O no hydrogen 2.898 N/A ALA 248.A N LEU 224.A O no hydrogen 2.929 N/A ALA 249.A N VAL 345.A O no hydrogen 3.393 N/A THR 250.A N THR 222.A O no hydrogen 2.927 N/A ARG 252.A N THR 250.A OG1 no hydrogen 3.287 N/A ARG 252.A NE GLU 254.A OE2 no hydrogen 3.090 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 2.598 N/A THR 255.A N ARG 252.A O no hydrogen 3.452 N/A THR 255.A OG1 ARG 252.A O no hydrogen 2.688 N/A MET 256.A N PRO 253.A O no hydrogen 2.936 N/A GLY 258.A N THR 255.A O no hydrogen 2.934 N/A THR 260.A N SER 348.A O no hydrogen 3.329 N/A THR 260.A OG1 SER 348.A OG no hydrogen 3.059 N/A CYS 262.A N TYR 330.A O no hydrogen 2.919 N/A CYS 262.A SG VAL 346.A O no hydrogen 3.392 N/A TRP 263.A N VAL 346.A O no hydrogen 2.849 N/A VAL 264.A N LEU 332.A O no hydrogen 2.977 N/A ARG 265.A N TYR 270.A OH no hydrogen 2.765 N/A MET 268.A N ARG 265.A O no hydrogen 3.335 N/A TYR 270.A N LEU 309.A O no hydrogen 2.890 N/A TYR 270.A OH GLY 344.A O no hydrogen 2.782 N/A ILE 271.A N CYS 283.A O no hydrogen 2.864 N/A GLY 272.A N LYS 307.A O no hydrogen 2.873 N/A PHE 273.A N PHE 281.A O no hydrogen 2.899 N/A GLU 274.A N PRO 304.A O no hydrogen 2.874 N/A THR 275.A N ASP 279.A O no hydrogen 2.780 N/A THR 275.A OG1 ASN 277.A OD1 no hydrogen 3.183 N/A THR 275.A OG1 ASP 279.A O no hydrogen 3.277 N/A ASN 277.A ND2 ASP 279.A OD2 no hydrogen 3.422 N/A ILE 280.A N ASN 243.A O no hydrogen 2.971 N/A PHE 281.A N PHE 273.A O no hydrogen 2.876 N/A ILE 282.A N PHE 245.A O no hydrogen 3.134 N/A CYS 283.A N ILE 271.A O no hydrogen 2.923 N/A CYS 283.A SG THR 284.A O no hydrogen 3.131 N/A LYS 286.A NZ GLU 478.A OE1 no hydrogen 3.049 N/A ALA 287.A N THR 284.A OG1 no hydrogen 3.375 N/A ALA 288.A N THR 284.A O no hydrogen 2.909 N/A ARG 289.A N GLN 285.A O no hydrogen 2.903 N/A ARG 289.A NH2 ASP 477.A OD1 no hydrogen 3.176 N/A ASN 290.A N LYS 286.A O no hydrogen 2.967 N/A ASN 290.A ND2 LYS 286.A O no hydrogen 3.403 N/A MET 291.A N ALA 287.A O no hydrogen 2.915 N/A SER 292.A N ALA 288.A O no hydrogen 2.850 N/A SER 292.A OG ALA 288.A O no hydrogen 3.351 N/A SER 292.A OG ARG 289.A O no hydrogen 2.536 N/A TYR 293.A N ARG 289.A O no hydrogen 3.004 N/A GLN 294.A N MET 291.A O no hydrogen 2.943 N/A GLN 294.A NE2 MET 465.A O no hydrogen 2.211 N/A GLN 294.A NE2 VAL 481.A O no hydrogen 3.117 N/A PHE 296.A N MET 291.A O no hydrogen 2.851 N/A THR 297.A OG1 ASP 299.A O no hydrogen 2.536 N/A THR 297.A OG1 VAL 302.A O no hydrogen 3.306 N/A GLY 301.A N SER 292.A O no hydrogen 3.470 N/A VAL 302.A N ASP 299.A O no hydrogen 3.434 N/A VAL 306.A N GLY 272.A O no hydrogen 2.840 N/A LYS 307.A N GLY 272.A O no hydrogen 2.957 N/A LEU 309.A N TYR 270.A O no hydrogen 2.983 N/A GLY 311.A N MET 268.A O no hydrogen 3.243 N/A GLU 312.A N PRO 266.A O no hydrogen 3.075 N/A GLU 313.A N MET 310.A O no hydrogen 2.946 N/A ILE 314.A N GLY 311.A O no hydrogen 3.118 N/A LEU 315.A N GLU 312.A O no hydrogen 3.300 N/A GLY 316.A N VAL 331.A O no hydrogen 2.939 N/A ALA 317.A N ILE 314.A O no hydrogen 3.263 N/A LEU 319.A N ILE 329.A O no hydrogen 2.584 N/A SER 320.A N LYS 227.A O no hydrogen 3.005 N/A THR 324.A N PRO 322.A O no hydrogen 2.467 N/A THR 324.A OG1 GLN 259.A O no hydrogen 2.789 N/A TYR 326.A N THR 324.A OG1 no hydrogen 3.273 N/A TYR 326.A OH GLU 384.A O no hydrogen 3.124 N/A ILE 329.A N LEU 319.A O no hydrogen 2.851 N/A VAL 331.A N ALA 317.A O no hydrogen 3.067 N/A LEU 332.A N CYS 262.A O no hydrogen 2.853 N/A MET 334.A N VAL 264.A O no hydrogen 3.094 N/A LEU 335.A N GLN 411.A OE1 no hydrogen 3.011 N/A THR 336.A OG1 GLN 411.A O no hydrogen 3.392 N/A GLY 342.A N GLU 466.A OE2 no hydrogen 3.292 N/A THR 343.A OG1 VAL 247.A O no hydrogen 2.629 N/A VAL 346.A N TRP 263.A O no hydrogen 2.996 N/A SER 348.A OG THR 260.A OG1 no hydrogen 3.059 N/A VAL 349.A N ASP 356.A OD2 no hydrogen 2.418 N/A SER 351.A OG VAL 386.A O no hydrogen 2.596 N/A SER 353.A N VAL 349.A O no hydrogen 2.966 N/A SER 353.A OG ASP 355.A OD1 no hydrogen 3.276 N/A ILE 357.A N SER 353.A O no hydrogen 3.469 N/A ALA 358.A N PRO 354.A O no hydrogen 2.924 N/A ALA 359.A N ASP 355.A O no hydrogen 2.937 N/A LEU 360.A N ASP 356.A O no hydrogen 2.903 N/A ARG 361.A N ILE 357.A O no hydrogen 2.855 N/A ASP 362.A N ALA 358.A O no hydrogen 2.953 N/A LEU 363.A N ALA 359.A O no hydrogen 2.946 N/A LYS 364.A N LEU 360.A O no hydrogen 2.876 N/A LYS 364.A NZ PHE 383.A O no hydrogen 3.021 N/A ARG 370.A NE LYS 366.A O no hydrogen 3.402 N/A ALA 371.A N GLN 367.A O no hydrogen 2.873 N/A LYS 372.A N ALA 368.A O no hydrogen 2.895 N/A ILE 375.A N ARG 370.A O no hydrogen 2.524 N/A LEU 381.A N ASP 377.A O no hydrogen 3.333 N/A GLU 384.A N TYR 326.A OH no hydrogen 3.284 N/A GLU 390.A N ILE 433.A O no hydrogen 3.260 N/A ILE 391.A N GLY 395.A O no hydrogen 3.353 N/A PHE 394.A N ILE 391.A O no hydrogen 3.045 N/A GLY 395.A N ILE 391.A O no hydrogen 2.820 N/A ASN 396.A N ASN 396.A OD1 no hydrogen 2.279 N/A SER 398.A OG ASP 352.A OD2 no hydrogen 3.401 N/A SER 398.A OG GLY 395.A O no hydrogen 3.103 N/A ALA 399.A N SER 351.A O no hydrogen 2.987 N/A THR 401.A N LEU 397.A O no hydrogen 3.134 N/A THR 401.A OG1 LEU 397.A O no hydrogen 2.932 N/A ILE 402.A N SER 398.A O no hydrogen 2.955 N/A CYS 403.A N ALA 399.A O no hydrogen 2.919 N/A CYS 403.A SG ALA 399.A O no hydrogen 3.218 N/A ASP 404.A N VAL 400.A O no hydrogen 2.920 N/A GLU 405.A N THR 401.A O no hydrogen 2.914 N/A LEU 406.A N ILE 402.A O no hydrogen 3.133 N/A ILE 408.A N CYS 403.A O no hydrogen 3.420 N/A GLN 411.A NE2 ASP 362.A OD2 no hydrogen 3.227 N/A ASN 412.A N SER 410.A OG no hydrogen 3.180 N/A ASN 412.A ND2 SER 410.A OG no hydrogen 2.919 N/A LYS 416.A NZ ASP 413.A OD2 no hydrogen 3.243 N/A LEU 417.A N ASP 413.A O no hydrogen 2.877 N/A ALA 418.A N ARG 414.A O no hydrogen 2.908 N/A GLU 419.A N GLU 415.A O no hydrogen 2.915 N/A ALA 420.A N LYS 416.A O no hydrogen 2.923 N/A LYS 421.A N LEU 417.A O no hydrogen 2.857 N/A GLU 422.A N ALA 418.A O no hydrogen 2.919 N/A LYS 423.A N GLU 419.A O no hydrogen 2.904 N/A TYR 425.A N GLU 422.A O no hydrogen 3.260 N/A PHE 429.A N LEU 426.A O no hydrogen 2.893 N/A ILE 433.A N GLU 390.A O no hydrogen 3.308 N/A MET 434.A N GLN 442.A O no hydrogen 3.283 N/A PHE 439.A N VAL 436.A O no hydrogen 3.115 N/A GLY 441.A N MET 434.A O no hydrogen 3.301 N/A GLN 442.A NE2 GLY 441.A O no hydrogen 3.564 N/A VAL 444.A N GLY 432.A O no hydrogen 3.330 N/A ASP 446.A N LYS 443.A O no hydrogen 2.732 N/A VAL 447.A N VAL 444.A O no hydrogen 3.211 N/A LYS 448.A N VAL 444.A O no hydrogen 3.181 N/A LYS 448.A NZ LEU 251.A O no hydrogen 3.512 N/A THR 450.A OG1 VAL 447.A O no hydrogen 2.506 N/A ILE 451.A N VAL 447.A O no hydrogen 2.947 N/A GLN 452.A N LYS 448.A O no hydrogen 2.957 N/A GLN 452.A NE2 GLU 220.A OE2 no hydrogen 3.557 N/A GLN 452.A NE2 THR 222.A OG1 no hydrogen 2.971 N/A LYS 453.A N LYS 449.A O no hydrogen 2.911 N/A LYS 453.A NZ ASP 457.A OD2 no hydrogen 3.483 N/A LYS 454.A N THR 450.A O no hydrogen 2.878 N/A MET 455.A N ILE 451.A O no hydrogen 2.951 N/A ILE 456.A N GLN 452.A O no hydrogen 2.929 N/A ASP 457.A N LYS 453.A O no hydrogen 2.903 N/A ALA 458.A N LYS 454.A O no hydrogen 3.455 N/A GLY 459.A N ILE 456.A O no hydrogen 3.406 N/A ASP 460.A N MET 455.A O no hydrogen 3.055 N/A LEU 462.A N LEU 223.A O no hydrogen 2.889 N/A TYR 464.A N TYR 221.A O no hydrogen 2.940 N/A TYR 464.A OH GLU 466.A OE1 no hydrogen 2.827 N/A MET 465.A N GLN 294.A OE1 no hydrogen 2.967 N/A GLU 466.A N GLN 219.A O no hydrogen 2.963 N/A GLU 468.A N GLY 217.A O no hydrogen 3.360 N/A SER 473.A N ASP 477.A O no hydrogen 3.004 N/A SER 473.A OG SER 475.A OG no hydrogen 3.295 N/A SER 473.A OG ASP 477.A O no hydrogen 3.186 N/A ARG 474.A N ASP 209.A O no hydrogen 3.149 N/A SER 475.A OG ASP 201.A OD1 no hydrogen 3.143 N/A SER 475.A OG ASP 201.A OD2 no hydrogen 3.133 N/A SER 475.A OG SER 473.A OG no hydrogen 3.295 N/A SER 476.A N SER 473.A O no hydrogen 3.353 N/A ASP 477.A N SER 473.A OG no hydrogen 3.279 N/A CYS 479.A N VAL 471.A O no hydrogen 3.423 N/A CYS 479.A SG ASP 477.A O no hydrogen 3.999 N/A VAL 480.A N TYR 197.A O no hydrogen 2.914 N/A VAL 481.A N ASN 290.A OD1 no hydrogen 2.746 N/A ALA 482.A N THR 195.A O no hydrogen 2.926 N/A LEU 483.A N TYR 293.A O no hydrogen 3.290 N/A CYS 484.A N ARG 193.A O no hydrogen 2.953 N/A GLN 486.A N GLY 191.A O no hydrogen 2.879 N/A GLN 486.A NE2 CYS 484.A O no hydrogen 2.529 N/A TYR 488.A N LYS 189.A O no hydrogen 2.872 N/A LEU 489.A N HIS 528.A O no hydrogen 2.894 N/A ASP 490.A N LYS 187.A O no hydrogen 3.020 N/A GLU 493.A N ASP 490.A O no hydrogen 3.330 N/A TRP 496.A NE1 TYR 644.A O no hydrogen 2.811 N/A LYS 497.A N GLU 493.A O no hydrogen 2.820 N/A LYS 497.A NZ LEU 522.A O no hydrogen 3.255 N/A LYS 497.A NZ LEU 525.A O no hydrogen 2.783 N/A LYS 498.A N GLU 494.A O no hydrogen 2.900 N/A GLN 499.A N ASN 495.A O no hydrogen 2.949 N/A THR 500.A N TRP 496.A O no hydrogen 2.939 N/A THR 500.A OG1 TRP 496.A O no hydrogen 3.056 N/A THR 500.A OG1 LYS 497.A O no hydrogen 2.680 N/A SER 501.A N LYS 497.A O no hydrogen 2.851 N/A SER 501.A OG LYS 497.A O no hydrogen 2.846 N/A GLN 502.A N LYS 498.A O no hydrogen 2.968 N/A CYS 503.A N GLN 499.A O no hydrogen 2.955 N/A LEU 504.A N THR 500.A O no hydrogen 2.834 N/A LYS 505.A N SER 501.A O no hydrogen 2.907 N/A ASN 506.A N GLN 502.A O no hydrogen 2.958 N/A LEU 507.A N LEU 504.A O no hydrogen 3.178 N/A GLU 508.A N THR 659.A O no hydrogen 2.791 N/A THR 509.A OG1 CYS 511.A O no hydrogen 2.915 N/A CYS 511.A SG THR 514.A OG1 no hydrogen 3.485 N/A ARG 515.A NH2 LEU 504.A O no hydrogen 3.537 N/A ARG 516.A N GLU 512.A O no hydrogen 2.904 N/A ASN 517.A N GLU 513.A O no hydrogen 2.923 N/A PHE 518.A N THR 514.A O no hydrogen 2.908 N/A GLU 519.A N ARG 515.A O no hydrogen 2.872 N/A ALA 520.A N ARG 516.A O no hydrogen 2.915 N/A THR 521.A N ASN 517.A O no hydrogen 2.959 N/A THR 521.A OG1 PRO 636.A O no hydrogen 3.052 N/A LEU 522.A N PHE 518.A O no hydrogen 2.861 N/A GLY 523.A N GLU 519.A O no hydrogen 2.917 N/A TRP 524.A N ALA 520.A O no hydrogen 2.918 N/A LEU 525.A N THR 521.A O no hydrogen 3.192 N/A GLU 527.A N GLU 527.A OE2 no hydrogen 2.902 N/A HIS 528.A N LEU 489.A O no hydrogen 2.973 N/A HIS 528.A NE2 GLU 549.A OE2 no hydrogen 2.549 N/A CYS 530.A N TRP 487.A O no hydrogen 3.274 N/A CYS 530.A SG TRP 487.A O no hydrogen 3.341 N/A ARG 532.A N LEU 547.A O no hydrogen 3.039 N/A ARG 532.A NE SER 531.A O no hydrogen 2.755 N/A ARG 532.A NH1 GLU 549.A OE1 no hydrogen 3.041 N/A THR 533.A N GLN 203.A OE1 no hydrogen 2.560 N/A TYR 534.A N GLN 203.A OE1 no hydrogen 2.718 N/A TYR 534.A OH ASP 96.A OD2 no hydrogen 3.251 N/A LEU 536.A N GLY 88.A O no hydrogen 2.962 N/A THR 538.A OG1 ASP 172.A OD2 no hydrogen 3.412 N/A LEU 540.A N TRP 546.A O no hydrogen 2.954 N/A GLN 545.A N GLN 545.A OE1 no hydrogen 2.602 N/A TRP 546.A N ASP 543.A O no hydrogen 2.891 N/A LEU 547.A N ARG 532.A O no hydrogen 2.753 N/A ILE 548.A N THR 538.A O no hydrogen 2.754 N/A GLU 549.A N CYS 530.A O no hydrogen 3.165 N/A SER 550.A OG TYR 48.A OH no hydrogen 3.065 N/A SER 552.A OG GLU 549.A OE2 no hydrogen 3.363 N/A SER 554.A OG SER 550.A O no hydrogen 2.877 N/A ALA 559.A N ILE 556.A O no hydrogen 3.184 N/A TYR 561.A N TYR 557.A O no hydrogen 2.973 N/A THR 562.A N ALA 559.A O no hydrogen 3.156 N/A THR 562.A OG1 ALA 559.A O no hydrogen 2.907 N/A VAL 563.A N PHE 560.A O no hydrogen 3.325 N/A LEU 566.A N VAL 563.A O no hydrogen 2.981 N/A LEU 567.A N VAL 563.A O no hydrogen 3.012 N/A GLN 568.A N ALA 564.A O no hydrogen 3.324 N/A GLY 570.A N ARG 159.A O no hydrogen 3.228 N/A HIS 573.A NE2 LEU 138.A O no hydrogen 3.041 N/A GLY 574.A N ASN 571.A O no hydrogen 2.984 N/A GLN 575.A N ASN 571.A OD1 no hydrogen 3.223 N/A GLN 575.A NE2 HIS 573.A O no hydrogen 3.267 N/A SER 578.A OG LEU 567.A O no hydrogen 3.365 N/A SER 578.A OG ILE 582.A O no hydrogen 3.523 N/A GLY 581.A N SER 578.A O no hydrogen 3.166 N/A ILE 582.A N SER 578.A OG no hydrogen 3.178 N/A GLN 586.A N ARG 583.A O no hydrogen 3.331 N/A LYS 589.A NZ GLU 184.A OE1 no hydrogen 2.592 N/A TRP 592.A N THR 588.A O no hydrogen 3.078 N/A TRP 592.A NE1 SER 173.A OG no hydrogen 2.867 N/A ASP 593.A N LYS 589.A O no hydrogen 2.918 N/A TYR 594.A N GLU 590.A O no hydrogen 2.898 N/A TYR 594.A OH ASP 613.A OD1 no hydrogen 2.336 N/A VAL 595.A N VAL 591.A O no hydrogen 2.942 N/A PHE 596.A N TRP 592.A O no hydrogen 2.904 N/A PHE 597.A N ASP 593.A O no hydrogen 2.736 N/A ALA 600.A N PHE 597.A O no hydrogen 3.303 N/A LYS 604.A NZ LYS 604.A O no hydrogen 3.108 N/A LYS 609.A NZ ASP 613.A OD1 no hydrogen 3.399 N/A LYS 609.A NZ ASP 613.A OD2 no hydrogen 3.213 N/A ASP 613.A N LYS 609.A O no hydrogen 2.901 N/A GLN 614.A N GLU 610.A O no hydrogen 2.890 N/A LEU 615.A N LYS 611.A O no hydrogen 2.950 N/A LYS 616.A N LEU 612.A O no hydrogen 2.898 N/A LYS 616.A NZ TYR 594.A O no hydrogen 2.468 N/A LYS 616.A NZ PHE 597.A O no hydrogen 2.499 N/A GLN 617.A N ASP 613.A O no hydrogen 2.862 N/A GLN 617.A NE2 SER 29.A OG no hydrogen 2.919 N/A GLU 618.A N GLN 614.A O no hydrogen 2.922 N/A PHE 619.A N LEU 615.A O no hydrogen 2.964 N/A GLU 620.A N LYS 616.A O no hydrogen 2.894 N/A PHE 621.A N GLN 617.A O no hydrogen 2.892 N/A TRP 622.A N GLU 618.A O no hydrogen 2.959 N/A TYR 623.A N PHE 619.A O no hydrogen 2.916 N/A TYR 623.A OH HIS 646.A NE2 no hydrogen 2.950 N/A ASP 626.A N PHE 41.A O no hydrogen 2.995 N/A LEU 627.A N PHE 41.A O no hydrogen 3.108 N/A ARG 628.A N ALA 660.A O no hydrogen 3.275 N/A ARG 628.A NE HIS 638.A NE2 no hydrogen 3.417 N/A ARG 628.A NH1 THR 43.A OG1 no hydrogen 2.974 N/A ARG 628.A NH1 TYR 557.A OH no hydrogen 3.560 N/A ARG 628.A NH2 TYR 557.A OH no hydrogen 3.243 N/A ARG 628.A NH2 HIS 638.A NE2 no hydrogen 2.880 N/A SER 630.A N ARG 662.A O no hydrogen 3.082 N/A SER 630.A OG GLY 631.A O no hydrogen 3.324 N/A LYS 632.A N ASN 664.A O no hydrogen 3.009 N/A LEU 634.A N GLY 631.A O no hydrogen 3.033 N/A ASN 637.A ND2 ASP 633.A O no hydrogen 3.229 N/A HIS 638.A N ASN 637.A OD1 no hydrogen 2.717 N/A LEU 639.A N LEU 634.A O no hydrogen 3.049 N/A SER 640.A OG VAL 635.A O no hydrogen 3.237 N/A TYR 641.A N ASN 637.A O no hydrogen 3.186 N/A TYR 642.A N HIS 638.A O no hydrogen 2.897 N/A LEU 643.A N LEU 639.A O no hydrogen 2.959 N/A TYR 644.A N SER 640.A O no hydrogen 2.918 N/A ASN 645.A N TYR 641.A O no hydrogen 2.879 N/A ASN 645.A ND2 TYR 491.A OH no hydrogen 3.252 N/A ASN 645.A ND2 TYR 641.A O no hydrogen 2.665 N/A HIS 646.A N TYR 642.A O no hydrogen 2.985 N/A HIS 646.A ND1 TYR 642.A O no hydrogen 3.221 N/A HIS 646.A NE2 TYR 623.A OH no hydrogen 2.950 N/A VAL 647.A N LEU 643.A O no hydrogen 2.944 N/A ALA 648.A N TYR 644.A O no hydrogen 2.916 N/A MET 649.A N ASN 645.A O no hydrogen 2.883 N/A TRP 650.A N HIS 646.A O no hydrogen 3.213 N/A TRP 650.A NE1 PHE 596.A O no hydrogen 3.085 N/A GLN 653.A N TRP 650.A O no hydrogen 3.322 N/A LYS 656.A N GLN 653.A O no hydrogen 3.199 N/A LYS 656.A NZ GLU 620.A OE1 no hydrogen 3.073 N/A TRP 657.A N SER 654.A O no hydrogen 3.352 N/A TRP 657.A NE1 TRP 650.A O no hydrogen 2.716 N/A THR 659.A N VAL 625.A O no hydrogen 3.070 N/A THR 659.A OG1 VAL 625.A O no hydrogen 3.496 N/A VAL 661.A N GLU 508.A O no hydrogen 3.036 N/A ARG 662.A N ARG 628.A O no hydrogen 3.075 N/A ARG 662.A NH2 ASP 705.A O no hydrogen 3.290 N/A ASN 664.A N SER 630.A O no hydrogen 3.028 N/A ASN 664.A ND2 SER 60.A OG no hydrogen 3.004 N/A ASN 664.A ND2 GLY 665.A O no hydrogen 3.681 N/A HIS 666.A N ASP 709.A OD1 no hydrogen 3.179 N/A LEU 668.A N ALA 710.A O no hydrogen 2.654 N/A LEU 669.A N GLU 672.A O no hydrogen 2.910 N/A ASN 670.A N PHE 712.A O no hydrogen 2.694 N/A ASN 670.A ND2 GLU 714.A OE1 no hydrogen 3.279 N/A SER 671.A N ASN 711.A OD1 no hydrogen 2.980 N/A GLU 672.A N LEU 669.A O no hydrogen 3.044 N/A SER 675.A N ASN 680.A O no hydrogen 3.239 N/A SER 675.A OG SER 677.A OG no hydrogen 3.080 N/A SER 677.A N SER 675.A OG no hydrogen 3.286 N/A SER 677.A OG SER 675.A OG no hydrogen 3.080 N/A THR 678.A OG1 SER 675.A O no hydrogen 3.270 N/A THR 678.A OG1 ASN 680.A OD1 no hydrogen 2.885 N/A ASN 680.A ND2 LEU 669.A O no hydrogen 3.210 N/A ASN 680.A ND2 LYS 673.A O no hydrogen 3.492 N/A THR 683.A N GLN 686.A OE1 no hydrogen 2.749 N/A LEU 684.A N LEU 53.A O no hydrogen 2.836 N/A GLN 686.A N THR 683.A OG1 no hydrogen 3.331 N/A ALA 687.A N THR 683.A O no hydrogen 2.770 N/A ILE 688.A N LEU 684.A O no hydrogen 2.909 N/A ASP 689.A N THR 685.A O no hydrogen 2.936 N/A LYS 690.A N GLN 686.A O no hydrogen 2.922 N/A LYS 690.A NZ GLU 714.A OE2 no hydrogen 2.390 N/A PHE 691.A N ALA 687.A O no hydrogen 2.909 N/A SER 692.A N ILE 688.A O no hydrogen 2.844 N/A SER 692.A OG PHE 691.A O no hydrogen 2.361 N/A ALA 693.A N GLU 11.A OE1 no hydrogen 2.951 N/A ASP 694.A N GLU 11.A OE2 no hydrogen 2.765 N/A GLY 695.A N SER 692.A OG no hydrogen 3.228 N/A MET 696.A N SER 692.A O no hydrogen 2.940 N/A ARG 697.A N ALA 693.A O no hydrogen 2.898 N/A ARG 697.A NE PHE 819.A O no hydrogen 2.881 N/A ARG 697.A NH1 MET 152.A O no hydrogen 3.401 N/A ARG 697.A NH1 GLY 153.A O no hydrogen 3.431 N/A ARG 697.A NH2 GLU 65.A OE2 no hydrogen 2.915 N/A ARG 697.A NH2 PRO 818.A O no hydrogen 3.045 N/A LEU 698.A N ASP 694.A O no hydrogen 2.877 N/A ALA 699.A N GLY 695.A O no hydrogen 2.985 N/A LEU 700.A N MET 696.A O no hydrogen 2.865 N/A ALA 701.A N ARG 697.A O no hydrogen 2.886 N/A ASP 702.A N LEU 698.A O no hydrogen 3.332 N/A ALA 703.A N LEU 700.A O no hydrogen 3.215 N/A ASP 705.A N ASP 705.A OD1 no hydrogen 2.399 N/A ALA 710.A N HIS 666.A O no hydrogen 3.037 N/A ASN 711.A ND2 SER 671.A OG no hydrogen 3.246 N/A PHE 712.A N LEU 668.A O no hydrogen 2.823 N/A GLU 714.A N ASN 670.A OD1 no hydrogen 3.006 N/A ALA 717.A N VAL 713.A O no hydrogen 3.319 N/A ASP 718.A N GLU 714.A O no hydrogen 2.942 N/A ALA 719.A N ALA 715.A O no hydrogen 2.925 N/A GLY 720.A N MET 716.A O no hydrogen 2.886 N/A ILE 721.A N ALA 717.A O no hydrogen 2.905 N/A LEU 722.A N ASP 718.A O no hydrogen 2.978 N/A ARG 723.A N ALA 719.A O no hydrogen 2.926 N/A LEU 724.A N GLY 720.A O no hydrogen 2.888 N/A TYR 725.A N ILE 721.A O no hydrogen 2.952 N/A THR 726.A N LEU 722.A O no hydrogen 2.940 N/A THR 726.A OG1 LEU 722.A O no hydrogen 3.203 N/A THR 726.A OG1 ARG 723.A O no hydrogen 2.751 N/A TRP 727.A N ARG 723.A O no hydrogen 2.882 N/A VAL 728.A N LEU 724.A O no hydrogen 2.951 N/A GLU 729.A N TYR 725.A O no hydrogen 2.946 N/A TRP 730.A N THR 726.A O no hydrogen 2.877 N/A VAL 731.A N TRP 727.A O no hydrogen 2.943 N/A LYS 732.A N VAL 728.A O no hydrogen 2.934 N/A GLU 733.A N GLU 729.A O no hydrogen 2.899 N/A MET 734.A N TRP 730.A O no hydrogen 2.925 N/A VAL 735.A N VAL 731.A O no hydrogen 2.928 N/A ALA 736.A N LYS 732.A O no hydrogen 2.931 N/A ASN 737.A N GLU 733.A O no hydrogen 3.008 N/A SER 740.A N ASN 737.A O no hydrogen 3.143 N/A ARG 742.A NE GLU 798.A O no hydrogen 3.362 N/A ARG 742.A NE GLY 799.A O no hydrogen 3.289 N/A ARG 742.A NH1 ASP 751.A OD2 no hydrogen 3.061 N/A ARG 742.A NH2 ASP 751.A OD1 no hydrogen 3.487 N/A ARG 742.A NH2 GLY 799.A O no hydrogen 2.647 N/A ASN 750.A ND2 ASN 965.A OD1 no hydrogen 3.322 N/A ASP 751.A N THR 748.A OG1 no hydrogen 3.247 N/A ARG 752.A N THR 748.A O no hydrogen 3.199 N/A ARG 752.A NH2 SER 747.A O no hydrogen 3.262 N/A VAL 753.A N PHE 749.A O no hydrogen 2.972 N/A PHE 754.A N ASN 750.A O no hydrogen 2.852 N/A ALA 755.A N ASP 751.A O no hydrogen 2.912 N/A SER 756.A N ARG 752.A O no hydrogen 2.994 N/A GLU 757.A N VAL 753.A O no hydrogen 2.929 N/A LEU 758.A N PHE 754.A O no hydrogen 2.884 N/A ASN 759.A N ALA 755.A O no hydrogen 3.001 N/A ASN 759.A ND2 PRO 847.A O no hydrogen 2.960 N/A ALA 760.A N SER 756.A O no hydrogen 2.920 N/A GLY 761.A N GLU 757.A O no hydrogen 2.912 N/A ILE 762.A N LEU 758.A O no hydrogen 2.959 N/A ILE 763.A N ASN 759.A O no hydrogen 2.985 N/A LYS 764.A N ALA 760.A O no hydrogen 2.909 N/A LYS 764.A NZ GLU 784.A OE1 no hydrogen 3.243 N/A THR 765.A N GLY 761.A O no hydrogen 2.900 N/A THR 765.A OG1 GLY 761.A O no hydrogen 2.941 N/A THR 765.A OG1 THR 780.A OG1 no hydrogen 2.765 N/A ASP 766.A N ILE 762.A O no hydrogen 2.930 N/A GLN 767.A N ILE 763.A O no hydrogen 2.985 N/A ASN 768.A N LYS 764.A O no hydrogen 2.907 N/A TYR 769.A N THR 765.A O no hydrogen 2.903 N/A TYR 769.A OH LEU 815.A O no hydrogen 3.165 N/A GLU 770.A N ASP 766.A O no hydrogen 2.983 N/A LYS 771.A N GLN 767.A O no hydrogen 3.205 N/A MET 772.A N TYR 769.A O no hydrogen 2.987 N/A MET 773.A N ASN 768.A O no hydrogen 3.056 N/A LYS 775.A NZ ASP 702.A O no hydrogen 2.826 N/A LYS 775.A NZ ASP 702.A OD1 no hydrogen 3.062 N/A ALA 777.A N MET 773.A O no hydrogen 2.897 N/A LEU 778.A N PHE 774.A O no hydrogen 2.928 N/A LYS 779.A N LYS 775.A O no hydrogen 2.926 N/A THR 780.A N GLU 776.A O no hydrogen 2.908 N/A THR 780.A OG1 THR 765.A OG1 no hydrogen 2.765 N/A THR 780.A OG1 GLU 776.A O no hydrogen 3.261 N/A THR 780.A OG1 ALA 777.A O no hydrogen 3.532 N/A GLY 781.A N ALA 777.A O no hydrogen 2.858 N/A PHE 783.A N LEU 778.A O no hydrogen 3.477 N/A GLU 784.A N LYS 779.A O no hydrogen 3.050 N/A GLN 786.A N PHE 782.A O no hydrogen 2.718 N/A GLN 786.A NE2 GLN 812.A OE1 no hydrogen 2.688 N/A ALA 787.A N PHE 783.A O no hydrogen 2.907 N/A ALA 788.A N GLU 784.A O no hydrogen 2.913 N/A LYS 789.A N PHE 785.A O no hydrogen 2.984 N/A LYS 789.A NZ ASP 790.A OD1 no hydrogen 3.322 N/A ASP 790.A N GLN 786.A O no hydrogen 2.865 N/A LYS 791.A N ALA 787.A O no hydrogen 2.961 N/A LYS 791.A NZ GLU 757.A OE1 no hydrogen 3.337 N/A LYS 791.A NZ SER 856.A OG no hydrogen 3.233 N/A TYR 792.A N ALA 788.A O no hydrogen 2.898 N/A TYR 792.A OH ASP 751.A OD1 no hydrogen 2.716 N/A ARG 793.A N LYS 789.A O no hydrogen 2.911 N/A GLU 794.A N ASP 790.A O no hydrogen 2.932 N/A LEU 795.A N LYS 791.A O no hydrogen 2.913 N/A ALA 796.A N TYR 792.A O no hydrogen 3.009 N/A GLY 799.A N ALA 796.A O no hydrogen 3.141 N/A HIS 801.A N TYR 792.A OH no hydrogen 3.073 N/A ARG 802.A N ARG 742.A O no hydrogen 2.756 N/A LEU 804.A N HIS 801.A ND1 no hydrogen 3.140 N/A VAL 805.A N HIS 801.A O no hydrogen 3.018 N/A PHE 806.A N ARG 802.A O no hydrogen 2.939 N/A ARG 807.A N GLU 803.A O no hydrogen 2.900 N/A ARG 807.A NH1 ASN 759.A OD1 no hydrogen 3.189 N/A ARG 807.A NH2 ASN 759.A OD1 no hydrogen 2.848 N/A ARG 807.A NH2 VAL 844.A O no hydrogen 3.319 N/A PHE 808.A N LEU 804.A O no hydrogen 2.889 N/A ILE 809.A N VAL 805.A O no hydrogen 2.931 N/A GLU 810.A N PHE 806.A O no hydrogen 2.949 N/A VAL 811.A N ARG 807.A O no hydrogen 2.874 N/A GLN 812.A N PHE 808.A O no hydrogen 2.820 N/A GLN 812.A NE2 GLY 781.A O no hydrogen 2.806 N/A GLN 812.A NE2 GLN 812.A O no hydrogen 2.980 N/A THR 813.A N ILE 809.A O no hydrogen 2.951 N/A THR 813.A OG1 ILE 809.A O no hydrogen 2.935 N/A LEU 814.A N GLU 810.A O no hydrogen 2.929 N/A LEU 815.A N VAL 811.A O no hydrogen 2.836 N/A LEU 816.A N GLN 812.A O no hydrogen 2.909 N/A PHE 819.A N LEU 816.A O no hydrogen 2.938 N/A CYS 820.A N LEU 816.A O no hydrogen 2.905 N/A CYS 820.A SG ASP 694.A O no hydrogen 3.732 N/A HIS 822.A ND1 ASP 694.A OD1 no hydrogen 2.448 N/A LEU 823.A N ASP 694.A OD2 no hydrogen 2.810 N/A CYS 824.A N CYS 820.A O no hydrogen 3.094 N/A CYS 824.A SG THR 813.A O no hydrogen 3.168 N/A CYS 824.A SG CYS 820.A O no hydrogen 3.190 N/A GLU 825.A N PRO 821.A O no hydrogen 2.893 N/A HIS 826.A N HIS 822.A O no hydrogen 2.952 N/A ILE 827.A N LEU 823.A O no hydrogen 2.919 N/A TRP 828.A N CYS 824.A O no hydrogen 2.844 N/A THR 829.A N GLU 825.A O no hydrogen 2.978 N/A THR 829.A OG1 GLU 825.A O no hydrogen 3.457 N/A THR 829.A OG1 HIS 826.A O no hydrogen 2.779 N/A LEU 830.A N HIS 826.A O no hydrogen 2.892 N/A LEU 831.A N ILE 827.A O no hydrogen 2.991 N/A GLY 832.A N THR 829.A O no hydrogen 3.187 N/A LYS 833.A N TRP 828.A O no hydrogen 3.423 N/A LYS 833.A NZ GLU 810.A OE2 no hydrogen 2.884 N/A SER 836.A OG GLU 825.A OE1 no hydrogen 3.210 N/A SER 836.A OG GLU 825.A OE2 no hydrogen 2.194 N/A ILE 837.A N GLU 825.A OE1 no hydrogen 2.977 N/A MET 838.A N SER 836.A OG no hydrogen 3.143 N/A ASN 839.A N SER 836.A O no hydrogen 3.247 N/A ALA 840.A N ILE 837.A O no hydrogen 3.228 N/A TRP 842.A N LEU 73.A O no hydrogen 2.905 N/A ASN 849.A N SER 756.A OG no hydrogen 3.119 N/A LEU 852.A N ASN 849.A OD1 no hydrogen 3.292 N/A ILE 853.A N ASN 849.A O no hydrogen 3.386 N/A HIS 854.A N GLU 850.A O no hydrogen 2.934 N/A SER 855.A N VAL 851.A O no hydrogen 2.929 N/A SER 855.A OG VAL 851.A O no hydrogen 3.255 N/A SER 855.A OG LEU 852.A O no hydrogen 2.513 N/A SER 856.A N LEU 852.A O no hydrogen 2.895 N/A GLN 857.A N ILE 853.A O no hydrogen 2.947 N/A TYR 858.A N HIS 854.A O no hydrogen 2.920 N/A TYR 858.A OH GLU 958.A OE2 no hydrogen 2.997 N/A LEU 859.A N SER 855.A O no hydrogen 2.907 N/A MET 860.A N SER 856.A O no hydrogen 2.920 N/A GLU 861.A N GLN 857.A O no hydrogen 2.969 N/A VAL 862.A N TYR 858.A O no hydrogen 2.910 N/A THR 863.A N LEU 859.A O no hydrogen 2.914 N/A THR 863.A OG1 LEU 859.A O no hydrogen 2.865 N/A HIS 864.A N MET 860.A O no hydrogen 2.947 N/A ASP 865.A N GLU 861.A O no hydrogen 2.936 N/A LEU 866.A N VAL 862.A O no hydrogen 2.890 N/A ARG 867.A N THR 863.A O no hydrogen 2.928 N/A ARG 867.A NE SER 972.A OG no hydrogen 3.182 N/A ARG 867.A NH1 SER 972.A OG no hydrogen 2.581 N/A LEU 868.A N HIS 864.A O no hydrogen 2.960 N/A ARG 869.A N ASP 865.A O no hydrogen 2.947 N/A LEU 870.A N LEU 866.A O no hydrogen 2.896 N/A LYS 871.A N LEU 868.A O no hydrogen 3.227 N/A CYS 878.A N HIS 977.A O no hydrogen 2.947 N/A CYS 878.A SG VAL 1002.A O no hydrogen 3.761 N/A THR 879.A N VAL 1002.A O no hydrogen 2.894 N/A ILE 880.A N GLU 979.A O no hydrogen 2.867 N/A TYR 881.A N LEU 1000.A O no hydrogen 2.838 N/A VAL 882.A N LYS 981.A O no hydrogen 3.155 N/A HIS 891.A N PRO 887.A O no hydrogen 2.797 N/A THR 892.A N PRO 888.A O no hydrogen 2.911 N/A THR 892.A OG1 PRO 888.A O no hydrogen 3.023 N/A THR 893.A N TRP 889.A O no hydrogen 2.993 N/A THR 893.A OG1 TRP 889.A O no hydrogen 3.286 N/A THR 893.A OG1 GLN 890.A O no hydrogen 2.821 N/A LEU 894.A N GLN 890.A O no hydrogen 2.899 N/A SER 895.A N HIS 891.A O no hydrogen 2.856 N/A SER 895.A OG HIS 891.A O no hydrogen 2.973 N/A VAL 896.A N THR 892.A O no hydrogen 2.967 N/A LEU 897.A N THR 893.A O no hydrogen 2.961 N/A ARG 898.A N LEU 894.A O no hydrogen 2.848 N/A ARG 898.A NH1 LEU 950.A O no hydrogen 3.384 N/A LYS 899.A N SER 895.A O no hydrogen 2.874 N/A LYS 899.A NZ GLU 917.A OE2 no hydrogen 2.698 N/A HIS 900.A N VAL 896.A O no hydrogen 2.974 N/A HIS 900.A NE2 GLU 917.A OE1 no hydrogen 2.474 N/A PHE 901.A N LEU 897.A O no hydrogen 2.868 N/A GLU 902.A N ARG 898.A O no hydrogen 2.885 N/A ALA 903.A N LYS 899.A O no hydrogen 2.913 N/A ALA 903.A N HIS 900.A O no hydrogen 3.174 N/A GLY 906.A N PHE 901.A O no hydrogen 2.974 N/A ILE 914.A N ASP 910.A O no hydrogen 3.121 N/A ALA 915.A N ASN 911.A O no hydrogen 2.878 N/A SER 916.A N LYS 912.A O no hydrogen 2.954 N/A SER 916.A OG LYS 912.A O no hydrogen 2.614 N/A GLU 917.A N VAL 913.A O no hydrogen 2.949 N/A LEU 918.A N ILE 914.A O no hydrogen 2.927 N/A GLY 919.A N ALA 915.A O no hydrogen 2.885 N/A SER 920.A N SER 916.A O no hydrogen 3.003 N/A SER 920.A OG GLU 917.A O no hydrogen 2.673 N/A MET 921.A N LEU 918.A O no hydrogen 3.356 N/A LEU 924.A N MET 921.A O no hydrogen 3.202 N/A TYR 927.A OH GLU 992.A OE2 no hydrogen 2.742 N/A VAL 935.A N VAL 931.A O no hydrogen 3.125 N/A ALA 936.A N MET 932.A O no hydrogen 2.895 N/A MET 937.A N PRO 933.A O no hydrogen 2.917 N/A ILE 938.A N PHE 934.A O no hydrogen 2.914 N/A LYS 939.A N VAL 935.A O no hydrogen 2.900 N/A LYS 939.A NZ LEU 908.A O no hydrogen 3.539 N/A LYS 939.A NZ PRO 909.A O no hydrogen 3.346 N/A GLU 940.A N ALA 936.A O no hydrogen 2.913 N/A ASN 941.A N MET 937.A O no hydrogen 2.928 N/A LEU 942.A N ILE 938.A O no hydrogen 2.825 N/A GLU 943.A N LYS 939.A O no hydrogen 2.964 N/A LYS 944.A N GLU 940.A O no hydrogen 2.904 N/A MET 945.A N ASN 941.A O no hydrogen 2.881 N/A LEU 950.A N PRO 947.A O no hydrogen 2.914 N/A ASP 951.A N ARG 948.A O no hydrogen 3.250 N/A GLN 953.A NE2 ASN 885.A OD1 no hydrogen 2.354 N/A ALA 960.A N ASP 957.A OD1 no hydrogen 2.982 N/A VAL 961.A N ASP 957.A O no hydrogen 3.137 N/A LEU 962.A N GLU 958.A O no hydrogen 3.016 N/A MET 963.A N LYS 959.A O no hydrogen 2.902 N/A GLU 964.A N ALA 960.A O no hydrogen 2.932 N/A ASN 965.A N LEU 962.A O no hydrogen 3.249 N/A ASN 965.A ND2 VAL 961.A O no hydrogen 3.147 N/A TYR 968.A OH GLU 794.A OE1 no hydrogen 3.176 N/A LEU 969.A N ASN 965.A O no hydrogen 2.918 N/A THR 970.A N ILE 966.A O no hydrogen 2.885 N/A THR 970.A OG1 ILE 966.A O no hydrogen 2.645 N/A ASN 971.A N VAL 967.A O no hydrogen 2.973 N/A SER 972.A N TYR 968.A O no hydrogen 2.904 N/A LEU 973.A N LEU 969.A O no hydrogen 3.139 N/A GLU 974.A N ASN 971.A O no hydrogen 3.195 N/A LEU 975.A N THR 970.A O no hydrogen 3.204 N/A GLU 976.A N SER 876.A O no hydrogen 2.729 N/A HIS 977.A N SER 876.A O no hydrogen 3.265 N/A HIS 977.A NE2 GLU 979.A OE2 no hydrogen 3.120 N/A GLU 979.A N CYS 878.A O no hydrogen 2.892 N/A LYS 981.A N ILE 880.A O no hydrogen 2.929 N/A LYS 981.A NZ GLU 985.A OE2 no hydrogen 2.838 N/A SER 984.A N PHE 982.A O no hydrogen 2.395 N/A SER 984.A OG PHE 982.A O no hydrogen 3.290 N/A ALA 986.A N ALA 983.A O no hydrogen 3.165 N/A ARG 991.A N GLU 987.A O no hydrogen 3.178 N/A GLU 992.A N ASP 988.A O no hydrogen 2.910 N/A ASP 993.A N LYS 989.A O no hydrogen 2.928 N/A CYS 994.A N ILE 990.A O no hydrogen 2.790 N/A CYS 994.A SG TYR 881.A O no hydrogen 3.492 N/A CYS 994.A SG CYS 995.A O no hydrogen 4.038 N/A CYS 995.A SG ASP 993.A O no hydrogen 3.950 N/A GLY 997.A N GLU 958.A OE1 no hydrogen 3.355 N/A GLY 997.A N GLU 958.A OE2 no hydrogen 3.216 N/A LYS 998.A N CYS 995.A O no hydrogen 3.110 N/A LEU 1000.A N TYR 881.A O no hydrogen 3.011 N/A ASN 1001.A ND2 ASP 865.A OD2 no hydrogen 3.553 N/A VAL 1002.A N THR 879.A O no hydrogen 2.920 N/A