Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6hd7_t.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A N LYS 3.A O no hydrogen 2.913 N/A PHE 8.A N GLU 4.A O no hydrogen 2.901 N/A LEU 9.A N ASN 5.A O no hydrogen 2.901 N/A GLU 10.A N ASP 6.A O no hydrogen 2.905 N/A ALA 11.A N GLN 7.A O no hydrogen 2.896 N/A LEU 12.A N PHE 8.A O no hydrogen 2.908 N/A LEU 14.A N ALA 11.A O no hydrogen 3.065 N/A GLU 16.A N LEU 12.A O no hydrogen 2.912 N/A GLY 17.A N LYS 13.A O no hydrogen 3.208 N/A LEU 24.A N TYR 20.A O no hydrogen 2.898 N/A LYS 25.A N LYS 21.A O no hydrogen 2.909 N/A LEU 26.A N LYS 22.A O no hydrogen 3.280 N/A LEU 27.A N SER 23.A O no hydrogen 2.908 N/A ASP 28.A N LEU 24.A O no hydrogen 2.895 N/A ALA 29.A N LYS 25.A O no hydrogen 2.909 N/A ILE 30.A N LEU 26.A O no hydrogen 2.908 N/A LEU 31.A N LEU 27.A O no hydrogen 2.898 N/A LYS 32.A N ASP 28.A O no hydrogen 2.902 N/A LYS 33.A N ILE 30.A O no hydrogen 3.203 N/A ASP 34.A N ILE 30.A O no hydrogen 3.130 N/A SER 36.A N ASP 34.A OD1 no hydrogen 3.315 N/A SER 40.A N HIS 37.A ND1 no hydrogen 2.970 N/A SER 40.A OG HIS 37.A ND1 no hydrogen 2.850 N/A LEU 41.A N HIS 37.A O no hydrogen 3.290 N/A ALA 42.A N VAL 38.A O no hydrogen 2.908 N/A LEU 43.A N ASP 39.A O no hydrogen 2.917 N/A LYS 44.A N SER 40.A O no hydrogen 2.881 N/A LYS 44.A NZ ASP 28.A OD1 no hydrogen 2.871 N/A LYS 44.A NZ TYR 60.A OH no hydrogen 2.809 N/A GLY 45.A N LEU 41.A O no hydrogen 2.921 N/A LEU 46.A N ALA 42.A O no hydrogen 3.490 N/A ASP 47.A N LEU 43.A O no hydrogen 2.913 N/A LEU 48.A N LYS 44.A O no hydrogen 2.888 N/A TYR 49.A N GLY 45.A O no hydrogen 2.913 N/A TYR 49.A OH ASN 87.A O no hydrogen 2.706 N/A SER 50.A N LEU 46.A O no hydrogen 2.906 N/A SER 50.A OG LEU 46.A O no hydrogen 2.941 N/A ALA 58.A N LYS 54.A O no hydrogen 2.897 N/A SER 59.A N ASP 55.A O no hydrogen 2.911 N/A TYR 60.A N ASP 56.A O no hydrogen 2.906 N/A VAL 61.A N ALA 57.A O no hydrogen 2.917 N/A ALA 62.A N ALA 58.A O no hydrogen 2.890 N/A ASN 63.A N SER 59.A O no hydrogen 2.911 N/A ALA 64.A N TYR 60.A O no hydrogen 2.900 N/A ILE 65.A N VAL 61.A O no hydrogen 2.908 N/A ARG 66.A N ALA 62.A O no hydrogen 2.897 N/A LYS 67.A N ASN 63.A O no hydrogen 2.915 N/A LYS 67.A NZ ASN 63.A OD1 no hydrogen 3.094 N/A ILE 68.A N ILE 65.A O no hydrogen 3.286 N/A CYS 78.A SG SER 74.A O no hydrogen 4.024 N/A HIS 79.A N PRO 75.A O no hydrogen 2.902 N/A VAL 80.A N ILE 76.A O no hydrogen 2.905 N/A LEU 81.A N CYS 77.A O no hydrogen 2.908 N/A GLY 82.A N CYS 78.A O no hydrogen 2.882 N/A ILE 83.A N HIS 79.A O no hydrogen 2.920 N/A TYR 84.A N VAL 80.A O no hydrogen 2.905 N/A MET 85.A N LEU 81.A O no hydrogen 2.900 N/A ARG 86.A N GLY 82.A O no hydrogen 2.893 N/A ASN 87.A N ILE 83.A O no hydrogen 2.914 N/A THR 88.A N MET 85.A O no hydrogen 3.283 N/A THR 88.A OG1 TYR 84.A O no hydrogen 2.767 N/A THR 88.A OG1 MET 85.A O no hydrogen 3.356 N/A GLU 90.A N MET 85.A O no hydrogen 2.714 N/A TYR 91.A OH ASP 554.A OD1 no hydrogen 3.377 N/A SER 94.A OG GLY 82.A O no hydrogen 2.988 N/A ILE 95.A N TYR 91.A O no hydrogen 2.896 N/A LYS 96.A N LYS 92.A O no hydrogen 2.924 N/A TRP 97.A N GLU 93.A O no hydrogen 2.902 N/A PHE 98.A N SER 94.A O no hydrogen 2.909 N/A THR 99.A N ILE 95.A O no hydrogen 2.897 N/A THR 99.A OG1 ILE 95.A O no hydrogen 2.771 N/A ALA 100.A N LYS 96.A O no hydrogen 2.913 N/A ALA 101.A N TRP 97.A O no hydrogen 2.899 N/A LEU 102.A N PHE 98.A O no hydrogen 2.905 N/A ASN 103.A N THR 99.A O no hydrogen 2.908 N/A ASN 104.A N ALA 101.A O no hydrogen 3.301 N/A GLN 110.A N ASN 108.A OD1 no hydrogen 3.255 N/A TYR 112.A N LYS 109.A O no hydrogen 2.916 N/A ASP 114.A N GLN 110.A O no hydrogen 3.355 N/A LEU 115.A N ILE 111.A O no hydrogen 3.351 N/A ALA 116.A N TYR 112.A O no hydrogen 2.989 N/A THR 117.A N ARG 113.A O no hydrogen 3.055 N/A THR 117.A N ASP 114.A O no hydrogen 2.930 N/A LEU 118.A N ASP 114.A O no hydrogen 2.851 N/A GLN 119.A N LEU 115.A O no hydrogen 3.051 N/A SER 120.A OG ALA 116.A O no hydrogen 2.345 N/A GLN 121.A N LEU 118.A O no hydrogen 2.918 N/A GLN 121.A NE2 GLU 553.A O no hydrogen 2.913 N/A ILE 122.A N GLN 119.A O no hydrogen 2.928 N/A GLY 123.A N GLN 119.A O no hydrogen 2.903 N/A LEU 129.A N PHE 125.A O no hydrogen 2.908 N/A SER 131.A N ASN 127.A O no hydrogen 2.913 N/A SER 131.A OG ASN 127.A O no hydrogen 3.036 N/A ARG 132.A N ALA 128.A O no hydrogen 2.880 N/A LYS 133.A N LEU 129.A O no hydrogen 2.913 N/A LYS 134.A N VAL 130.A O no hydrogen 2.904 N/A TYR 135.A N SER 131.A O no hydrogen 2.908 N/A TYR 135.A OH GLN 110.A OE1 no hydrogen 2.441 N/A TRP 136.A N ARG 132.A O no hydrogen 2.886 N/A GLU 137.A N LYS 133.A O no hydrogen 2.908 N/A ALA 138.A N LYS 134.A O no hydrogen 2.908 N/A ARG 143.A NH2 HIS 185.A ND1 no hydrogen 2.994 N/A THR 147.A N ARG 143.A O no hydrogen 2.914 N/A THR 147.A OG1 ARG 143.A O no hydrogen 3.055 N/A SER 148.A N ALA 144.A O no hydrogen 2.890 N/A SER 148.A OG ALA 144.A O no hydrogen 3.232 N/A SER 148.A OG ASN 145.A O no hydrogen 2.741 N/A LEU 149.A N ASN 145.A O no hydrogen 2.911 N/A ALA 150.A N TRP 146.A O no hydrogen 2.904 N/A VAL 151.A N THR 147.A O no hydrogen 2.917 N/A ALA 152.A N SER 148.A O no hydrogen 2.896 N/A GLN 153.A N LEU 149.A O no hydrogen 2.913 N/A ASP 154.A N ALA 150.A O no hydrogen 2.890 N/A VAL 155.A N VAL 151.A O no hydrogen 2.916 N/A ASN 156.A N ALA 152.A O no hydrogen 3.293 N/A GLY 157.A N GLN 153.A O no hydrogen 3.339 N/A ARG 159.A N GLY 157.A O no hydrogen 2.865 N/A GLN 160.A NE2 ASN 164.A OD1 no hydrogen 3.362 N/A ALA 162.A N GLU 158.A O no hydrogen 3.221 N/A ILE 163.A N ARG 159.A O no hydrogen 2.917 N/A ASN 164.A N GLN 160.A O no hydrogen 2.901 N/A THR 165.A N GLN 161.A O no hydrogen 2.895 N/A THR 165.A OG1 GLN 161.A O no hydrogen 2.835 N/A LEU 166.A N ALA 162.A O no hydrogen 2.910 N/A SER 167.A N ILE 163.A O no hydrogen 2.906 N/A SER 167.A OG ILE 163.A O no hydrogen 3.000 N/A GLN 168.A N ASN 164.A O no hydrogen 2.897 N/A PHE 169.A N THR 165.A O no hydrogen 2.912 N/A GLU 170.A N LEU 166.A O no hydrogen 2.907 N/A LYS 171.A N SER 167.A O no hydrogen 2.901 N/A LEU 172.A N GLN 168.A O no hydrogen 2.907 N/A ALA 173.A N PHE 169.A O no hydrogen 2.901 N/A LYS 182.A N ASP 179.A O no hydrogen 2.911 N/A LYS 182.A NZ SER 178.A O no hydrogen 3.289 N/A LYS 182.A NZ ASP 179.A OD1 no hydrogen 2.658 N/A HIS 185.A N GLU 181.A O no hydrogen 3.210 N/A SER 186.A N LYS 182.A O no hydrogen 2.768 N/A GLU 187.A N TYR 183.A O no hydrogen 2.804 N/A CYS 188.A N GLU 184.A O no hydrogen 2.758 N/A CYS 188.A SG GLU 184.A O no hydrogen 3.420 N/A LEU 189.A N HIS 185.A O no hydrogen 2.739 N/A MET 190.A N SER 186.A O no hydrogen 2.871 N/A TYR 191.A N GLU 187.A O no hydrogen 2.853 N/A LYS 192.A N CYS 188.A O no hydrogen 2.766 N/A LYS 192.A NZ GLU 170.A OE1 no hydrogen 2.775 N/A LYS 192.A NZ GLU 170.A OE2 no hydrogen 2.957 N/A LYS 192.A NZ HIS 213.A NE2 no hydrogen 3.358 N/A ASN 193.A N LEU 189.A O no hydrogen 2.800 N/A ASP 194.A N MET 190.A O no hydrogen 2.838 N/A ILE 195.A N TYR 191.A O no hydrogen 2.883 N/A MET 196.A N LYS 192.A O no hydrogen 2.738 N/A TYR 197.A N ASN 193.A O no hydrogen 2.687 N/A LYS 198.A N ASP 194.A O no hydrogen 3.077 N/A LYS 198.A NZ ASP 154.A O no hydrogen 3.379 N/A LYS 198.A NZ ASP 154.A OD1 no hydrogen 2.860 N/A ALA 199.A N ILE 195.A O no hydrogen 3.118 N/A ALA 199.A N MET 196.A O no hydrogen 2.920 N/A ALA 200.A N TYR 197.A O no hydrogen 2.919 N/A LEU 207.A N ASN 203.A O no hydrogen 3.267 N/A GLN 208.A N GLN 204.A O no hydrogen 2.907 N/A ASN 209.A N ASP 205.A O no hydrogen 2.899 N/A VAL 210.A N LYS 206.A O no hydrogen 2.916 N/A LEU 211.A N LEU 207.A O no hydrogen 2.890 N/A LYS 212.A N GLN 208.A O no hydrogen 2.906 N/A LYS 212.A NZ ASP 216.A OD1 no hydrogen 2.844 N/A LYS 212.A NZ ASP 216.A OD2 no hydrogen 2.823 N/A HIS 213.A N ASN 209.A O no hydrogen 2.907 N/A LEU 214.A N VAL 210.A O no hydrogen 2.895 N/A ASN 215.A N LEU 211.A O no hydrogen 2.902 N/A ASP 216.A N LYS 212.A O no hydrogen 2.910 N/A ILE 217.A N HIS 213.A O no hydrogen 2.914 N/A CYS 220.A N ILE 217.A O no hydrogen 2.897 N/A VAL 221.A N ILE 217.A O no hydrogen 2.820 N/A PHE 222.A N SER 186.A OG no hydrogen 2.651 N/A LYS 224.A NZ GLU 218.A O no hydrogen 3.136 N/A LYS 224.A NZ GLU 218.A OE2 no hydrogen 2.428 N/A LEU 228.A N LYS 224.A O no hydrogen 2.899 N/A GLU 229.A N PHE 225.A O no hydrogen 2.918 N/A ARG 230.A N GLY 226.A O no hydrogen 2.900 N/A ARG 230.A NH1 ASN 193.A O no hydrogen 3.094 N/A ARG 230.A NH2 ASP 194.A OD1 no hydrogen 2.384 N/A LYS 231.A N LEU 227.A O no hydrogen 2.901 N/A ALA 232.A N LEU 228.A O no hydrogen 2.890 N/A THR 233.A N GLU 229.A O no hydrogen 2.911 N/A THR 233.A OG1 GLU 229.A O no hydrogen 2.893 N/A ILE 234.A N ARG 230.A O no hydrogen 2.899 N/A TYR 235.A N LYS 231.A O no hydrogen 2.916 N/A MET 236.A N ALA 232.A O no hydrogen 2.888 N/A LYS 237.A N THR 233.A O no hydrogen 2.912 N/A LYS 237.A NZ SER 201.A O no hydrogen 3.192 N/A LEU 238.A N TYR 235.A O no hydrogen 3.376 N/A SER 245.A N LEU 241.A O no hydrogen 2.896 N/A SER 245.A OG LEU 241.A O no hydrogen 3.333 N/A SER 245.A OG LYS 242.A O no hydrogen 2.527 N/A ILE 246.A N LYS 242.A O no hydrogen 2.912 N/A VAL 247.A N ASP 243.A O no hydrogen 2.911 N/A TYR 248.A N ALA 244.A O no hydrogen 2.911 N/A ARG 249.A N SER 245.A O no hydrogen 2.883 N/A THR 250.A N ILE 246.A O no hydrogen 2.904 N/A THR 250.A OG1 ILE 246.A O no hydrogen 2.919 N/A LEU 251.A N VAL 247.A O no hydrogen 2.917 N/A ILE 252.A N TYR 248.A O no hydrogen 2.893 N/A LYS 253.A N ARG 249.A O no hydrogen 2.888 N/A ARG 254.A N THR 250.A O no hydrogen 2.908 N/A ASN 255.A N LEU 251.A O no hydrogen 2.859 N/A ASN 258.A N PRO 256.A O no hydrogen 2.770 N/A LYS 260.A N ASN 258.A OD1 no hydrogen 3.143 N/A TYR 261.A OH GLU 229.A OE2 no hydrogen 3.003 N/A LYS 263.A N PHE 259.A O no hydrogen 2.915 N/A LEU 264.A N LYS 260.A O no hydrogen 2.900 N/A LEU 265.A N TYR 261.A O no hydrogen 2.899 N/A GLU 266.A N TYR 262.A O no hydrogen 2.907 N/A VAL 267.A N LYS 263.A O no hydrogen 2.921 N/A SER 268.A N LEU 264.A O no hydrogen 2.880 N/A SER 268.A OG LEU 264.A O no hydrogen 3.304 N/A SER 268.A OG LEU 265.A O no hydrogen 2.803 N/A LEU 269.A N LEU 265.A O no hydrogen 2.910 N/A GLN 272.A N GLN 272.A OE1 no hydrogen 2.721 N/A LYS 276.A N ASP 274.A OD1 no hydrogen 3.275 N/A LYS 278.A NZ GLU 266.A OE2 no hydrogen 3.377 N/A LYS 278.A NZ GLN 272.A O no hydrogen 3.293 N/A LYS 279.A N ASN 275.A O no hydrogen 2.901 N/A ALA 280.A N LYS 276.A O no hydrogen 2.905 N/A LEU 281.A N LEU 277.A O no hydrogen 2.906 N/A TYR 282.A N LYS 278.A O no hydrogen 2.910 N/A GLY 283.A N LYS 279.A O no hydrogen 2.896 N/A LYS 284.A N ALA 280.A O no hydrogen 2.911 N/A LEU 285.A N LEU 281.A O no hydrogen 2.909 N/A GLU 286.A N TYR 282.A O no hydrogen 2.891 N/A PHE 288.A N LEU 285.A O no hydrogen 3.116 N/A TYR 289.A N GLU 286.A O no hydrogen 3.332 N/A CYS 292.A SG ASP 257.A OD1 no hydrogen 3.269 N/A LYS 296.A N GLU 293.A O no hydrogen 3.118 N/A LYS 296.A NZ PRO 290.A O no hydrogen 3.145 N/A PHE 297.A N PRO 294.A O no hydrogen 3.053 N/A ILE 298.A N PRO 294.A O no hydrogen 2.913 N/A LEU 300.A N PHE 297.A O no hydrogen 3.289 N/A THR 301.A OG1 ILE 298.A O no hydrogen 2.589 N/A GLU 308.A N ASP 305.A OD2 no hydrogen 2.880 N/A LEU 309.A N ASP 305.A O no hydrogen 3.121 N/A SER 310.A N LYS 306.A O no hydrogen 2.903 N/A LYS 311.A N GLU 307.A O no hydrogen 2.904 N/A LYS 311.A NZ GLU 315.A OE2 no hydrogen 2.398 N/A LYS 312.A N GLU 308.A O no hydrogen 2.909 N/A LEU 313.A N LEU 309.A O no hydrogen 2.899 N/A ARG 314.A N SER 310.A O no hydrogen 2.904 N/A GLU 315.A N LYS 311.A O no hydrogen 2.912 N/A TYR 316.A N LYS 312.A O no hydrogen 2.895 N/A TYR 316.A N LEU 313.A O no hydrogen 3.227 N/A VAL 317.A N LEU 313.A O no hydrogen 2.912 N/A LEU 318.A N ARG 314.A O no hydrogen 2.920 N/A GLN 320.A NE2 GLU 293.A OE1 no hydrogen 3.523 N/A LEU 321.A N VAL 317.A O no hydrogen 3.036 N/A GLU 322.A N LEU 318.A O no hydrogen 2.903 N/A ARG 323.A N PRO 319.A O no hydrogen 2.903 N/A GLY 324.A N GLN 320.A O no hydrogen 2.937 N/A THR 328.A OG1 VAL 325.A O no hydrogen 3.339 N/A ASN 331.A N ALA 327.A O no hydrogen 2.671 N/A VAL 332.A N THR 328.A O no hydrogen 3.256 N/A VAL 332.A N PHE 329.A O no hydrogen 2.923 N/A LYS 333.A N SER 330.A O no hydrogen 2.922 N/A TYR 336.A N VAL 332.A O no hydrogen 3.341 N/A TYR 336.A OH TYR 373.A OH no hydrogen 2.759 N/A TYR 336.A OH HIS 377.A ND1 no hydrogen 3.083 N/A GLN 337.A N PRO 334.A O no hydrogen 2.910 N/A ARG 338.A N LEU 335.A O no hydrogen 2.911 N/A ARG 339.A N LEU 335.A O no hydrogen 2.655 N/A VAL 343.A N LYS 340.A O no hydrogen 3.323 N/A SER 344.A N LYS 340.A O no hydrogen 2.900 N/A SER 344.A OG LYS 340.A O no hydrogen 2.324 N/A LEU 347.A N VAL 343.A O no hydrogen 3.036 N/A GLU 348.A N SER 344.A O no hydrogen 2.904 N/A LYS 349.A N PRO 345.A O no hydrogen 2.903 N/A LYS 349.A NZ ASP 353.A OD2 no hydrogen 3.281 N/A ILE 350.A N LEU 346.A O no hydrogen 2.910 N/A VAL 351.A N LEU 347.A O no hydrogen 2.908 N/A LEU 352.A N GLU 348.A O no hydrogen 2.903 N/A ASP 353.A N LYS 349.A O no hydrogen 2.900 N/A TYR 354.A N ILE 350.A O no hydrogen 2.908 N/A LEU 355.A N VAL 351.A O no hydrogen 2.889 N/A SER 356.A N LEU 352.A O no hydrogen 2.909 N/A SER 356.A OG LEU 352.A O no hydrogen 3.430 N/A SER 356.A OG ASP 353.A O no hydrogen 2.801 N/A GLY 357.A N TYR 354.A O no hydrogen 3.399 N/A LEU 358.A N LEU 355.A O no hydrogen 3.194 N/A THR 361.A N ASP 359.A OD2 no hydrogen 2.959 N/A THR 361.A OG1 ASP 359.A OD2 no hydrogen 2.334 N/A GLN 362.A N ASP 359.A OD2 no hydrogen 2.667 N/A ASP 363.A N ASP 359.A O no hydrogen 3.240 N/A PHE 367.A N ASP 363.A O no hydrogen 3.241 N/A ILE 368.A N PRO 364.A O no hydrogen 2.904 N/A TRP 369.A N ILE 365.A O no hydrogen 2.962 N/A THR 370.A N PRO 366.A O no hydrogen 2.869 N/A THR 370.A OG1 PRO 366.A O no hydrogen 2.791 N/A ASN 371.A N PHE 367.A O no hydrogen 2.934 N/A TYR 372.A N ILE 368.A O no hydrogen 2.909 N/A TYR 373.A N TRP 369.A O no hydrogen 2.900 N/A LEU 374.A N THR 370.A O no hydrogen 2.897 N/A SER 375.A N ASN 371.A O no hydrogen 2.909 N/A SER 375.A OG ALA 387.A O no hydrogen 3.463 N/A GLN 376.A N TYR 372.A O no hydrogen 2.915 N/A HIS 377.A N TYR 373.A O no hydrogen 2.897 N/A PHE 378.A N LEU 374.A O no hydrogen 2.910 N/A LEU 379.A N SER 375.A O no hydrogen 2.889 N/A PHE 380.A N GLN 376.A O no hydrogen 2.927 N/A LEU 381.A N HIS 377.A O no hydrogen 3.177 N/A LEU 381.A N PHE 378.A O no hydrogen 3.180 N/A LYS 382.A N LEU 379.A O no hydrogen 3.432 N/A ASP 383.A N PHE 378.A O no hydrogen 2.874 N/A GLN 388.A N PHE 384.A O no hydrogen 2.892 N/A GLU 389.A N PRO 385.A O no hydrogen 2.915 N/A TYR 390.A N LYS 386.A O no hydrogen 2.906 N/A ILE 391.A N ALA 387.A O no hydrogen 2.908 N/A ASP 392.A N GLN 388.A O no hydrogen 2.883 N/A ALA 393.A N GLU 389.A O no hydrogen 2.927 N/A ALA 394.A N TYR 390.A O no hydrogen 2.898 N/A LEU 395.A N ILE 391.A O no hydrogen 2.896 N/A ASP 396.A N ASP 392.A O no hydrogen 2.898 N/A HIS 397.A N ALA 393.A O no hydrogen 2.905 N/A HIS 397.A ND1 THR 398.A OG1 no hydrogen 3.098 N/A HIS 397.A NE2 PRO 360.A O no hydrogen 2.746 N/A THR 398.A N ALA 394.A O no hydrogen 2.810 N/A THR 398.A OG1 HIS 397.A ND1 no hydrogen 3.098 N/A GLU 403.A N GLU 403.A OE1 no hydrogen 2.822 N/A ILE 406.A N VAL 402.A O no hydrogen 2.917 N/A LEU 407.A N GLU 403.A O no hydrogen 2.893 N/A LYS 408.A N PHE 404.A O no hydrogen 2.909 N/A ALA 409.A N TYR 405.A O no hydrogen 2.901 N/A ARG 410.A N ILE 406.A O no hydrogen 2.904 N/A ARG 410.A NE HIS 414.A NE2 no hydrogen 3.591 N/A ILE 411.A N LEU 407.A O no hydrogen 2.902 N/A LEU 412.A N LYS 408.A O no hydrogen 2.924 N/A LYS 413.A N ALA 409.A O no hydrogen 2.883 N/A LYS 413.A NZ TYR 445.A OH no hydrogen 3.522 N/A HIS 414.A N ARG 410.A O no hydrogen 2.913 N/A LEU 415.A N ILE 411.A O no hydrogen 2.920 N/A GLY 416.A N LYS 413.A O no hydrogen 3.118 N/A LEU 417.A N LEU 412.A O no hydrogen 2.648 N/A ALA 421.A N LEU 417.A O no hydrogen 3.401 N/A ALA 422.A N MET 418.A O no hydrogen 2.900 N/A GLY 423.A N ASP 419.A O no hydrogen 2.908 N/A ILE 424.A N THR 420.A O no hydrogen 2.931 N/A LEU 425.A N ALA 421.A O no hydrogen 2.891 N/A GLU 426.A N ALA 422.A O no hydrogen 2.883 N/A GLU 427.A N GLY 423.A O no hydrogen 2.923 N/A GLY 428.A N ILE 424.A O no hydrogen 2.914 N/A ARG 429.A N LEU 425.A O no hydrogen 2.863 N/A ARG 429.A NE GLU 426.A OE1 no hydrogen 3.214 N/A ARG 429.A NH2 GLU 426.A OE1 no hydrogen 3.132 N/A ARG 429.A NH2 GLU 426.A OE2 no hydrogen 2.458 N/A GLN 430.A N GLU 426.A O no hydrogen 2.919 N/A GLN 430.A NE2 GLU 426.A OE2 no hydrogen 3.374 N/A LEU 431.A N GLY 428.A O no hydrogen 3.219 N/A ASP 432.A N ARG 429.A O no hydrogen 3.295 N/A ILE 438.A N ASP 435.A OD2 no hydrogen 2.836 N/A CYS 440.A N ARG 436.A O no hydrogen 2.898 N/A CYS 440.A SG ARG 436.A O no hydrogen 3.258 N/A LYS 441.A N PHE 437.A O no hydrogen 2.924 N/A THR 442.A N ILE 438.A O no hydrogen 2.894 N/A THR 442.A OG1 ILE 438.A O no hydrogen 2.796 N/A VAL 443.A N ASN 439.A O no hydrogen 2.914 N/A LYS 444.A N CYS 440.A O no hydrogen 2.905 N/A TYR 445.A N LYS 441.A O no hydrogen 2.911 N/A PHE 446.A N THR 442.A O no hydrogen 2.908 N/A LEU 447.A N VAL 443.A O no hydrogen 2.906 N/A ARG 448.A N LYS 444.A O no hydrogen 2.907 N/A ARG 448.A NE GLU 486.A OE1 no hydrogen 2.375 N/A ARG 448.A NH2 GLU 486.A OE2 no hydrogen 2.795 N/A ALA 449.A N PHE 446.A O no hydrogen 3.071 N/A ASN 451.A N PHE 446.A O no hydrogen 3.056 N/A LYS 454.A N ASN 451.A OD1 no hydrogen 3.434 N/A VAL 456.A N ILE 452.A O no hydrogen 2.902 N/A GLU 457.A N ASP 453.A O no hydrogen 2.915 N/A VAL 458.A N LYS 454.A O no hydrogen 2.894 N/A ALA 459.A N ALA 455.A O no hydrogen 2.902 N/A SER 460.A N VAL 456.A O no hydrogen 2.903 N/A SER 460.A OG VAL 456.A O no hydrogen 2.976 N/A LEU 461.A N ALA 459.A O no hydrogen 2.842 N/A SER 468.A OG ASN 470.A O no hydrogen 3.374 N/A SER 468.A OG ASN 470.A OD1 no hydrogen 3.025 N/A ASN 470.A N SER 468.A OG no hydrogen 3.418 N/A ASN 470.A ND2 SER 652.A O no hydrogen 2.418 N/A GLY 471.A N SER 460.A OG no hydrogen 3.112 N/A LYS 473.A NZ ASP 467.A O no hydrogen 3.474 N/A LEU 475.A N GLY 471.A O no hydrogen 2.941 N/A HIS 476.A N ILE 472.A O no hydrogen 2.919 N/A HIS 476.A ND1 ILE 472.A O no hydrogen 2.800 N/A LEU 477.A N LYS 473.A O no hydrogen 2.900 N/A LEU 477.A N ASP 474.A O no hydrogen 3.232 N/A VAL 478.A N ASP 474.A O no hydrogen 3.097 N/A SER 481.A OG ALA 480.A O no hydrogen 2.786 N/A VAL 485.A N SER 481.A O no hydrogen 2.922 N/A GLU 486.A N TRP 482.A O no hydrogen 2.893 N/A GLN 487.A N PHE 483.A O no hydrogen 2.912 N/A ALA 488.A N ILE 484.A O no hydrogen 2.899 N/A GLU 489.A N VAL 485.A O no hydrogen 3.193 N/A ALA 490.A N GLU 486.A O no hydrogen 3.388 N/A TYR 491.A N GLN 487.A O no hydrogen 2.936 N/A TYR 492.A N ALA 488.A O no hydrogen 2.894 N/A ARG 493.A N GLU 489.A O no hydrogen 2.902 N/A LEU 494.A N ALA 490.A O no hydrogen 2.923 N/A TYR 495.A N TYR 491.A O no hydrogen 2.901 N/A LEU 496.A N TYR 492.A O no hydrogen 2.892 N/A ASP 497.A N ARG 493.A O no hydrogen 2.927 N/A LYS 499.A N LEU 496.A O no hydrogen 3.136 N/A LYS 501.A N ASP 497.A O no hydrogen 2.927 N/A LEU 502.A N ARG 498.A O no hydrogen 2.878 N/A ASP 503.A N LYS 499.A O no hydrogen 2.916 N/A ASP 504.A N LYS 500.A O no hydrogen 2.900 N/A LEU 505.A N LYS 501.A O no hydrogen 2.914 N/A ALA 506.A N LEU 502.A O no hydrogen 2.885 N/A SER 507.A N ASP 503.A O no hydrogen 2.910 N/A SER 507.A OG ASP 503.A O no hydrogen 2.709 N/A GLU 518.A N ASP 515.A O no hydrogen 3.277 N/A GLN 519.A N ASP 515.A O no hydrogen 2.902 N/A LYS 525.A N ALA 521.A O no hydrogen 2.905 N/A GLU 526.A N ASN 522.A O no hydrogen 2.904 N/A ASN 527.A N ASP 523.A O no hydrogen 2.893 N/A GLN 528.A N ILE 524.A O no hydrogen 2.906 N/A TRP 529.A N LYS 525.A O no hydrogen 2.906 N/A LEU 530.A N GLU 526.A O no hydrogen 2.910 N/A VAL 531.A N ASN 527.A O no hydrogen 2.893 N/A ARG 532.A N GLN 528.A O no hydrogen 2.910 N/A LYS 533.A N TRP 529.A O no hydrogen 2.918 N/A LYS 533.A NZ LYS 646.A O no hydrogen 3.543 N/A LYS 533.A NZ GLU 649.A OE1 no hydrogen 2.626 N/A TYR 534.A N LEU 530.A O no hydrogen 2.902 N/A LYS 535.A N VAL 531.A O no hydrogen 2.877 N/A GLY 536.A N ARG 532.A O no hydrogen 2.921 N/A LEU 537.A N LYS 533.A O no hydrogen 2.902 N/A ALA 538.A N TYR 534.A O no hydrogen 2.889 N/A LEU 539.A N LYS 535.A O no hydrogen 3.151 N/A LYS 540.A N GLY 536.A O no hydrogen 2.919 N/A LYS 540.A NZ ASP 663.A O no hydrogen 2.683 N/A ARG 541.A N LEU 537.A O no hydrogen 2.880 N/A PHE 542.A N ALA 538.A O no hydrogen 2.914 N/A ASN 543.A N LYS 540.A O no hydrogen 3.184 N/A PHE 548.A N ALA 544.A O no hydrogen 2.490 N/A TYR 549.A N ILE 545.A O no hydrogen 2.915 N/A LYS 550.A N PRO 546.A O no hydrogen 2.898 N/A LYS 550.A NZ GLU 682.A OE1 no hydrogen 3.310 N/A GLN 551.A N LYS 547.A O no hydrogen 2.896 N/A GLN 551.A NE2 ASP 555.A OD1 no hydrogen 2.760 N/A GLN 551.A NE2 ASP 555.A OD2 no hydrogen 3.394 N/A PHE 552.A N PHE 548.A O no hydrogen 2.887 N/A GLU 553.A N TYR 549.A O no hydrogen 2.914 N/A ASP 554.A N LYS 550.A O no hydrogen 2.895 N/A ASP 555.A N GLN 551.A O no hydrogen 2.896 N/A HIS 560.A ND1 TYR 572.A OH no hydrogen 2.910 N/A SER 561.A N ASP 558.A O no hydrogen 3.282 N/A TYR 562.A N ASP 558.A O no hydrogen 2.905 N/A CYS 563.A N PHE 559.A O no hydrogen 2.899 N/A CYS 563.A SG PHE 559.A O no hydrogen 3.297 N/A ARG 565.A N SER 561.A O no hydrogen 2.905 N/A LYS 566.A N TYR 562.A O no hydrogen 2.899 N/A THR 568.A N CYS 563.A O no hydrogen 2.865 N/A ARG 570.A NH2 GLU 187.A OE1 no hydrogen 2.451 N/A ARG 570.A NH2 ASP 223.A OD2 no hydrogen 3.367 N/A TYR 572.A N THR 568.A O no hydrogen 3.051 N/A TYR 572.A OH HIS 560.A ND1 no hydrogen 2.910 N/A LEU 573.A N PRO 569.A O no hydrogen 2.914 N/A GLU 574.A N ARG 570.A O no hydrogen 2.908 N/A MET 575.A N ALA 571.A O no hydrogen 2.868 N/A LEU 576.A N TYR 572.A O no hydrogen 2.920 N/A GLU 577.A N LEU 573.A O no hydrogen 2.923 N/A TRP 578.A N GLU 574.A O no hydrogen 2.880 N/A GLY 579.A N MET 575.A O no hydrogen 2.880 N/A LYS 580.A N LEU 576.A O no hydrogen 2.926 N/A LYS 580.A NZ GLU 577.A OE2 no hydrogen 2.999 N/A ALA 581.A N GLU 577.A O no hydrogen 2.902 N/A THR 584.A N ALA 581.A O no hydrogen 3.000 N/A THR 584.A OG1 ALA 581.A O no hydrogen 2.353 N/A VAL 589.A N LYS 585.A O no hydrogen 3.037 N/A ARG 590.A N PRO 586.A O no hydrogen 2.911 N/A ALA 591.A N MET 587.A O no hydrogen 2.905 N/A MET 592.A N TYR 588.A O no hydrogen 2.890 N/A LYS 593.A N VAL 589.A O no hydrogen 2.889 N/A LYS 593.A NZ GLU 703.A OE1 no hydrogen 2.658 N/A GLU 594.A N ARG 590.A O no hydrogen 2.936 N/A ALA 595.A N ALA 591.A O no hydrogen 2.897 N/A SER 596.A N MET 592.A O no hydrogen 2.884 N/A SER 596.A OG MET 592.A O no hydrogen 3.313 N/A SER 596.A OG LYS 593.A O no hydrogen 2.570 N/A LYS 597.A N LYS 593.A O no hydrogen 2.914 N/A LEU 598.A N GLU 594.A O no hydrogen 2.931 N/A TYR 599.A N ALA 595.A O no hydrogen 2.894 N/A PHE 600.A N SER 596.A O no hydrogen 2.901 N/A GLN 601.A N LYS 597.A O no hydrogen 2.914 N/A MET 602.A N LEU 598.A O no hydrogen 2.904 N/A HIS 603.A N TYR 599.A O no hydrogen 2.904 N/A ASP 604.A N PHE 600.A O no hydrogen 2.890 N/A ASP 605.A N GLN 601.A O no hydrogen 2.931 N/A ARG 606.A N MET 602.A O no hydrogen 2.901 N/A ARG 606.A NH1 SER 673.A O no hydrogen 3.487 N/A LEU 607.A N HIS 603.A O no hydrogen 2.943 N/A LYS 608.A N ASP 604.A O no hydrogen 2.901 N/A ARG 609.A N ASP 605.A O no hydrogen 2.900 N/A ASP 619.A N GLU 616.A O no hydrogen 3.241 N/A GLU 620.A N GLU 616.A O no hydrogen 2.903 N/A LYS 634.A N SER 630.A O no hydrogen 3.346 N/A ALA 635.A N GLN 631.A O no hydrogen 2.895 N/A LYS 636.A N LYS 632.A O no hydrogen 2.909 N/A LYS 637.A N LYS 633.A O no hydrogen 2.904 N/A GLU 638.A N LYS 634.A O no hydrogen 2.904 N/A ALA 639.A N ALA 635.A O no hydrogen 2.894 N/A ALA 640.A N LYS 636.A O no hydrogen 2.906 N/A ALA 641.A N LYS 637.A O no hydrogen 2.914 N/A MET 642.A N GLU 638.A O no hydrogen 2.892 N/A ASN 643.A N ALA 639.A O no hydrogen 2.900 N/A LYS 644.A N ALA 640.A O no hydrogen 2.906 N/A ARG 645.A N ALA 641.A O no hydrogen 2.921 N/A LYS 646.A N MET 642.A O no hydrogen 2.876 N/A GLU 647.A N ASN 643.A O no hydrogen 2.914 N/A THR 648.A N LYS 644.A O no hydrogen 3.476 N/A GLU 649.A N ARG 645.A O no hydrogen 2.927 N/A ALA 650.A N LYS 646.A O no hydrogen 2.873 N/A LYS 651.A N GLU 647.A O no hydrogen 2.920 N/A SER 652.A N THR 648.A O no hydrogen 2.901 N/A SER 652.A OG THR 648.A O no hydrogen 3.447 N/A SER 652.A OG GLU 649.A O no hydrogen 2.446 N/A VAL 653.A N GLU 649.A O no hydrogen 2.916 N/A ASP 661.A N PRO 657.A O no hydrogen 3.278 N/A VAL 664.A N ASN 662.A O no hydrogen 2.914 N/A GLY 666.A N ASP 663.A OD1 no hydrogen 3.123 N/A LYS 668.A NZ ASN 662.A OD1 no hydrogen 3.509 N/A THR 672.A OG1 ASP 678.A OD2 no hydrogen 3.509 N/A THR 674.A OG1 THR 674.A O no hydrogen 2.614 N/A ASP 678.A N THR 674.A O no hydrogen 3.248 N/A PHE 679.A N PRO 675.A O no hydrogen 2.908 N/A ALA 680.A N MET 676.A O no hydrogen 2.900 N/A THR 681.A N GLU 677.A O no hydrogen 2.903 N/A THR 681.A OG1 GLU 677.A O no hydrogen 2.788 N/A THR 681.A OG1 ASP 678.A O no hydrogen 3.458 N/A PHE 683.A N PHE 679.A O no hydrogen 3.019 N/A TYR 684.A OH ASP 701.A OD1 no hydrogen 2.994 N/A ASN 685.A N ALA 680.A O no hydrogen 3.159 N/A SER 688.A N TYR 684.A O no hydrogen 2.906 N/A MET 689.A N ASN 685.A O no hydrogen 2.894 N/A GLN 690.A N ASN 686.A O no hydrogen 2.920 N/A ILE 699.A N ASP 697.A OD1 no hydrogen 3.351 N/A PHE 702.A N TYR 698.A O no hydrogen 2.898 N/A GLU 703.A N ILE 699.A O no hydrogen 2.912 N/A PHE 704.A N LEU 700.A O no hydrogen 2.894 N/A ASN 705.A N ASP 701.A O no hydrogen 2.905 N/A TYR 706.A OH ASP 806.A OD2 no hydrogen 3.332 N/A ARG 707.A NH1 TYR 803.A OH no hydrogen 3.169 N/A CYS 714.A SG PHE 702.A O no hydrogen 3.900 N/A CYS 714.A SG LYS 710.A O no hydrogen 3.730 N/A PHE 715.A N LEU 711.A O no hydrogen 2.909 N/A ALA 716.A N ALA 712.A O no hydrogen 2.905 N/A SER 717.A N LEU 713.A O no hydrogen 2.897 N/A SER 717.A OG ASP 701.A OD2 no hydrogen 3.334 N/A SER 717.A OG LEU 713.A O no hydrogen 3.054 N/A LEU 718.A N CYS 714.A O no hydrogen 2.904 N/A ASN 719.A N PHE 715.A O no hydrogen 2.901 N/A LYS 720.A N ALA 716.A O no hydrogen 2.914 N/A PHE 721.A N SER 717.A O no hydrogen 2.899 N/A ALA 722.A N LEU 718.A O no hydrogen 2.910 N/A LYS 723.A N ASN 719.A O no hydrogen 2.901 N/A ARG 724.A N LYS 720.A O no hydrogen 2.912 N/A ARG 724.A NH1 TYR 698.A OH no hydrogen 2.371 N/A PHE 725.A N PHE 721.A O no hydrogen 2.902 N/A SER 734.A N GLY 730.A O no hydrogen 2.909 N/A SER 734.A OG GLY 730.A O no hydrogen 3.384 N/A SER 734.A OG LEU 731.A O no hydrogen 2.665 N/A MET 735.A N LEU 731.A O no hydrogen 2.901 N/A ALA 736.A N PHE 732.A O no hydrogen 2.906 N/A ILE 737.A N GLY 733.A O no hydrogen 2.906 N/A VAL 738.A N SER 734.A O no hydrogen 2.917 N/A LEU 739.A N MET 735.A O no hydrogen 2.895 N/A LEU 740.A N ALA 736.A O no hydrogen 2.896 N/A HIS 741.A N ILE 737.A O no hydrogen 2.924 N/A HIS 741.A ND1 ILE 737.A O no hydrogen 2.820 N/A ALA 742.A N VAL 738.A O no hydrogen 2.888 N/A THR 743.A N LEU 739.A O no hydrogen 2.913 N/A THR 743.A OG1 LEU 739.A O no hydrogen 3.168 N/A THR 743.A OG1 LEU 740.A O no hydrogen 2.818 N/A THR 747.A N ARG 744.A O no hydrogen 3.287 N/A THR 747.A OG1 ALA 742.A O no hydrogen 2.789 N/A THR 747.A OG1 ARG 744.A O no hydrogen 2.856 N/A LYS 754.A N ASP 750.A O no hydrogen 3.147 N/A LYS 754.A NZ ARG 744.A O no hydrogen 2.408 N/A LYS 754.A NZ THR 747.A O no hydrogen 2.404 N/A LYS 754.A NZ THR 747.A OG1 no hydrogen 2.651 N/A LYS 755.A N PRO 751.A O no hydrogen 2.895 N/A VAL 756.A N ILE 752.A O no hydrogen 2.920 N/A VAL 757.A N LEU 753.A O no hydrogen 2.911 N/A THR 758.A N LYS 754.A O no hydrogen 2.903 N/A THR 758.A OG1 LYS 754.A O no hydrogen 2.831 N/A LYS 759.A N LYS 755.A O no hydrogen 2.914 N/A SER 760.A N VAL 756.A O no hydrogen 2.904 N/A SER 760.A OG VAL 756.A O no hydrogen 3.016 N/A LEU 761.A N VAL 757.A O no hydrogen 2.893 N/A GLU 762.A N THR 758.A O no hydrogen 2.909 N/A LYS 763.A N LYS 759.A O no hydrogen 2.906 N/A GLU 764.A N SER 760.A O no hydrogen 2.901 N/A SER 778.A N ASN 776.A OD1 no hydrogen 3.113 N/A LEU 782.A N ASP 780.A OD1 no hydrogen 3.174 N/A TYR 785.A N TRP 781.A O no hydrogen 2.900 N/A GLN 786.A N LEU 782.A O no hydrogen 2.907 N/A GLN 786.A NE2 ASN 783.A O no hydrogen 3.418 N/A GLN 786.A NE2 ASN 783.A OD1 no hydrogen 2.626 N/A GLU 787.A N ASN 783.A O no hydrogen 2.896 N/A LYS 788.A N PHE 784.A O no hydrogen 2.935 N/A GLY 790.A N TYR 785.A O no hydrogen 2.966 N/A ASN 795.A N ASP 793.A OD1 no hydrogen 3.281 N/A LEU 798.A N ILE 794.A O no hydrogen 2.910 N/A PHE 799.A N ASN 795.A O no hydrogen 2.899 N/A LEU 800.A N GLY 796.A O no hydrogen 2.909 N/A TYR 801.A N LEU 797.A O no hydrogen 2.902 N/A ARG 802.A N LEU 798.A O no hydrogen 2.894 N/A TYR 803.A N PHE 799.A O no hydrogen 2.916 N/A ARG 804.A NH1 TYR 801.A O no hydrogen 2.512 N/A LYS 815.A N SER 811.A O no hydrogen 2.901 N/A GLU 816.A N SER 812.A O no hydrogen 2.909 N/A MET 817.A N ASN 813.A O no hydrogen 2.906 N/A ILE 818.A N LEU 814.A O no hydrogen 2.904 N/A ILE 819.A N LYS 815.A O no hydrogen 2.909 N/A SER 820.A N GLU 816.A O no hydrogen 2.909 N/A SER 820.A OG GLU 816.A O no hydrogen 3.304 N/A SER 820.A OG MET 817.A O no hydrogen 2.742 N/A SER 821.A N MET 817.A O no hydrogen 2.887 N/A SER 821.A OG LYS 791.A O no hydrogen 2.968 N/A SER 821.A OG MET 817.A O no hydrogen 3.011 N/A LEU 822.A N ILE 818.A O no hydrogen 2.911 N/A SER 823.A OG SER 820.A O no hydrogen 3.043 N/A HIS 828.A NE2 GLU 826.A OE1 no hydrogen 2.295 N/A GLN 830.A N GLU 826.A O no hydrogen 3.140 N/A GLN 830.A NE2 LEU 822.A O no hydrogen 2.424 N/A GLN 830.A NE2 SER 823.A O no hydrogen 2.998 N/A ASN 831.A N PRO 827.A O no hydrogen 2.905 N/A GLU 832.A N HIS 828.A O no hydrogen 2.906 N/A ILE 833.A N SER 829.A O no hydrogen 2.913 N/A LEU 834.A N GLN 830.A O no hydrogen 2.908 N/A GLN 835.A N ASN 831.A O no hydrogen 2.902 N/A GLN 835.A NE2 ASP 497.A OD1 no hydrogen 3.345 N/A TYR 836.A N GLU 832.A O no hydrogen 2.903 N/A TYR 836.A OH ASP 497.A OD2 no hydrogen 2.874 N/A