Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6nit_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N THR 704.A O no hydrogen 2.944 N/A ARG 7.A NH1 ASP 707.A OD1 no hydrogen 3.209 N/A GLY 11.A N ASP 697.A OD2 no hydrogen 3.388 N/A THR 12.A N ASP 737.A OD1 no hydrogen 2.716 N/A THR 12.A N ASP 737.A OD2 no hydrogen 3.385 N/A SER 13.A N ASP 737.A OD1 no hydrogen 2.682 N/A ARG 15.A N VAL 376.A O no hydrogen 3.251 N/A ARG 15.A NH1 GLU 682.A OE1 no hydrogen 3.413 N/A ARG 15.A NH1 GLU 682.A OE2 no hydrogen 2.866 N/A ILE 17.A N GLY 374.A O no hydrogen 3.290 N/A LEU 19.A N VAL 372.A O no hydrogen 2.902 N/A GLN 20.A N PHE 676.A O no hydrogen 2.885 N/A GLN 20.A NE2 ASP 371.A OD1 no hydrogen 3.151 N/A ALA 21.A N THR 370.A O no hydrogen 2.837 N/A ASN 22.A ND2 ILE 184.A O no hydrogen 2.732 N/A ASN 22.A ND2 HIS 672.A O no hydrogen 2.912 N/A PHE 24.A N LEU 182.A O no hydrogen 2.909 N/A MET 26.A N MET 180.A O no hydrogen 2.874 N/A ASP 27.A N MET 364.A O no hydrogen 2.561 N/A ILE 33.A N VAL 105.A O no hydrogen 2.925 N/A TYR 34.A N THR 75.A O no hydrogen 2.904 N/A HIS 35.A N SER 103.A O no hydrogen 2.861 N/A HIS 35.A ND1 LEU 73.A O no hydrogen 2.860 N/A TYR 36.A N LEU 73.A O no hydrogen 2.882 N/A GLU 37.A N LYS 100.A O no hydrogen 2.566 N/A LEU 38.A N LYS 71.A O no hydrogen 2.559 N/A ASP 39.A N SER 98.A O no hydrogen 2.635 N/A LYS 41.A N LYS 96.A O no hydrogen 3.319 N/A ASN 48.A N PRO 44.A O no hydrogen 3.043 N/A ASN 48.A ND2 GLY 69.A O no hydrogen 2.872 N/A ARG 49.A N ARG 45.A O no hydrogen 2.919 N/A ARG 49.A NH1 PHE 67.A O no hydrogen 2.852 N/A GLU 50.A N ARG 46.A O no hydrogen 2.943 N/A ILE 51.A N VAL 47.A O no hydrogen 2.864 N/A VAL 52.A N ASN 48.A O no hydrogen 2.904 N/A GLU 53.A N ARG 49.A O no hydrogen 2.937 N/A HIS 54.A N GLU 50.A O no hydrogen 2.948 N/A HIS 54.A ND1 GLU 50.A O no hydrogen 3.082 N/A MET 55.A N ILE 51.A O no hydrogen 2.866 N/A VAL 56.A N VAL 52.A O no hydrogen 2.858 N/A GLN 57.A N GLU 53.A O no hydrogen 3.027 N/A HIS 58.A N HIS 54.A O no hydrogen 2.874 N/A ILE 63.A N PHE 59.A O no hydrogen 2.694 N/A LYS 64.A NZ GLU 360.A OE1 no hydrogen 2.989 N/A VAL 66.A N TYR 74.A O no hydrogen 3.021 N/A PHE 67.A N HIS 135.A ND1 no hydrogen 2.837 N/A ASP 68.A N ASN 72.A O no hydrogen 3.231 N/A ASN 72.A N ARG 70.A O no hydrogen 2.540 N/A LEU 73.A N TYR 36.A O no hydrogen 2.919 N/A TYR 74.A N VAL 66.A O no hydrogen 3.213 N/A THR 75.A N TYR 34.A O no hydrogen 2.910 N/A THR 75.A OG1 TYR 34.A O no hydrogen 3.555 N/A THR 75.A OG1 MET 77.A O no hydrogen 3.131 N/A VAL 86.A N ILE 99.A O no hydrogen 2.877 N/A LEU 88.A N VAL 97.A O no hydrogen 2.863 N/A VAL 90.A N PHE 95.A O no hydrogen 2.911 N/A PHE 95.A N VAL 90.A O no hydrogen 2.900 N/A VAL 97.A N LEU 88.A O no hydrogen 2.921 N/A SER 98.A N ASP 39.A O no hydrogen 2.563 N/A SER 98.A OG ASP 39.A O no hydrogen 3.509 N/A ILE 99.A N VAL 86.A O no hydrogen 2.893 N/A LYS 100.A N GLU 37.A O no hydrogen 2.726 N/A VAL 102.A N HIS 35.A O no hydrogen 2.889 N/A SER 103.A N HIS 35.A O no hydrogen 3.017 N/A VAL 105.A N ILE 33.A O no hydrogen 2.904 N/A HIS 111.A N LEU 107.A O no hydrogen 3.135 N/A HIS 111.A ND1 LEU 107.A O no hydrogen 2.707 N/A ASP 112.A N GLN 108.A O no hydrogen 2.938 N/A ALA 113.A N ALA 109.A O no hydrogen 2.876 N/A ALA 113.A N LEU 110.A O no hydrogen 3.163 N/A LEU 114.A N LEU 110.A O no hydrogen 2.906 N/A SER 115.A N HIS 111.A O no hydrogen 2.951 N/A GLY 116.A N SER 115.A OG no hydrogen 2.689 N/A LEU 118.A N ASP 112.A O no hydrogen 2.791 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.648 N/A THR 125.A N PRO 122.A O no hydrogen 3.189 N/A ILE 126.A N PRO 122.A O no hydrogen 3.395 N/A GLN 127.A N PHE 123.A O no hydrogen 2.931 N/A ALA 128.A N GLU 124.A O no hydrogen 2.923 N/A LEU 129.A N THR 125.A O no hydrogen 2.891 N/A ASP 130.A N ILE 126.A O no hydrogen 2.943 N/A VAL 131.A N GLN 127.A O no hydrogen 2.907 N/A VAL 132.A N ALA 128.A O no hydrogen 2.908 N/A MET 133.A N LEU 129.A O no hydrogen 2.929 N/A ARG 134.A N ASP 130.A O no hydrogen 2.909 N/A ARG 134.A N VAL 131.A O no hydrogen 3.290 N/A ARG 134.A NE GLN 171.A O no hydrogen 3.296 N/A ARG 134.A NH2 GLN 171.A O no hydrogen 2.554 N/A HIS 135.A N VAL 132.A O no hydrogen 3.443 N/A HIS 135.A ND1 PHE 67.A O no hydrogen 3.364 N/A SER 138.A N ARG 134.A O no hydrogen 3.020 N/A SER 138.A OG ARG 134.A O no hydrogen 2.413 N/A MET 139.A N LEU 136.A O no hydrogen 3.014 N/A ARG 140.A N LEU 136.A O no hydrogen 2.759 N/A TYR 141.A N PRO 137.A O no hydrogen 2.868 N/A THR 142.A N PHE 149.A O no hydrogen 2.889 N/A VAL 144.A N SER 147.A O no hydrogen 2.895 N/A SER 147.A N VAL 144.A O no hydrogen 2.904 N/A PHE 148.A N PHE 169.A O no hydrogen 2.904 N/A PHE 149.A N THR 142.A O no hydrogen 2.894 N/A THR 150.A N PHE 167.A O no hydrogen 2.847 N/A LEU 159.A N ARG 163.A O no hydrogen 3.341 N/A ARG 163.A N GLY 160.A O no hydrogen 3.231 N/A ARG 163.A NH1 GLU 228.A OE2 no hydrogen 3.233 N/A GLU 164.A N PHE 191.A O no hydrogen 2.884 N/A VAL 165.A N ASN 157.A O no hydrogen 2.818 N/A TRP 166.A N THR 189.A O no hydrogen 2.911 N/A TRP 166.A NE1 GLU 164.A OE2 no hydrogen 3.265 N/A GLY 168.A N SER 187.A O no hydrogen 2.877 N/A PHE 169.A N PHE 148.A O no hydrogen 2.888 N/A HIS 170.A N ASP 185.A O no hydrogen 2.870 N/A SER 172.A N ASN 183.A O no hydrogen 2.898 N/A VAL 173.A N ASP 130.A OD1 no hydrogen 3.391 N/A ARG 174.A N MET 181.A O no hydrogen 2.892 N/A ARG 174.A NH2 GLU 633.A OE2 no hydrogen 3.509 N/A SER 176.A OG LYS 699.A O no hydrogen 2.051 N/A LEU 177.A N SER 176.A OG no hydrogen 2.510 N/A LYS 179.A NZ MET 26.A O no hydrogen 3.514 N/A LYS 179.A NZ ASP 27.A OD1 no hydrogen 3.300 N/A MET 181.A N ARG 174.A O no hydrogen 2.928 N/A LEU 182.A N PHE 24.A O no hydrogen 2.867 N/A ASN 183.A N SER 172.A O no hydrogen 2.885 N/A ASN 183.A ND2 ASN 22.A O no hydrogen 3.696 N/A ASN 183.A ND2 HIS 672.A O no hydrogen 2.907 N/A ILE 184.A N ASN 22.A O no hydrogen 3.231 N/A ASP 185.A N HIS 170.A O no hydrogen 2.958 N/A SER 187.A N GLY 168.A O no hydrogen 2.883 N/A THR 189.A N TRP 166.A O no hydrogen 2.946 N/A ALA 190.A N THR 189.A OG1 no hydrogen 2.482 N/A PHE 191.A N GLU 164.A O no hydrogen 2.935 N/A TYR 192.A N GLN 314.A O no hydrogen 2.626 N/A LYS 193.A N GLY 162.A O no hydrogen 2.498 N/A GLN 195.A NE2 GLU 203.A OE2 no hydrogen 3.374 N/A VAL 197.A N CYS 308.A O no hydrogen 2.928 N/A GLU 199.A N PRO 196.A O no hydrogen 2.862 N/A PHE 200.A N PRO 196.A O no hydrogen 2.989 N/A VAL 201.A N VAL 197.A O no hydrogen 2.856 N/A CYS 202.A N ILE 198.A O no hydrogen 3.012 N/A CYS 202.A SG ILE 198.A O no hydrogen 3.109 N/A GLU 203.A N GLU 199.A O no hydrogen 2.876 N/A VAL 204.A N PHE 200.A O no hydrogen 2.906 N/A LEU 205.A N VAL 201.A O no hydrogen 2.979 N/A PHE 207.A N CYS 202.A O no hydrogen 2.664 N/A LYS 208.A N GLU 212.A OE1 no hydrogen 3.370 N/A GLU 211.A N SER 209.A OG no hydrogen 3.190 N/A GLU 212.A N SER 209.A O no hydrogen 3.433 N/A GLN 214.A NE2 GLU 211.A OE2 no hydrogen 3.052 N/A GLN 221.A N THR 218.A O no hydrogen 2.865 N/A ARG 222.A N THR 218.A O no hydrogen 3.393 N/A VAL 223.A N ASP 219.A O no hydrogen 2.902 N/A LYS 224.A N SER 220.A O no hydrogen 2.874 N/A PHE 225.A N GLN 221.A O no hydrogen 2.888 N/A THR 226.A N ARG 222.A O no hydrogen 2.902 N/A THR 226.A OG1 ARG 222.A O no hydrogen 2.394 N/A LYS 227.A N VAL 223.A O no hydrogen 2.841 N/A GLU 228.A N LYS 224.A O no hydrogen 3.025 N/A GLU 228.A N PHE 225.A O no hydrogen 3.200 N/A ILE 229.A N PHE 225.A O no hydrogen 2.880 N/A LYS 230.A N THR 226.A O no hydrogen 2.743 N/A GLY 231.A N VAL 245.A O no hydrogen 3.186 N/A LEU 232.A N ILE 229.A O no hydrogen 2.935 N/A LYS 233.A N GLN 314.A OE1 no hydrogen 2.687 N/A VAL 234.A N TYR 243.A O no hydrogen 2.878 N/A GLU 235.A N ASN 309.A O no hydrogen 2.834 N/A ILE 236.A N ARG 241.A O no hydrogen 3.159 N/A THR 237.A N VAL 307.A O no hydrogen 3.019 N/A THR 237.A OG1 VAL 307.A O no hydrogen 2.968 N/A HIS 238.A ND1 HIS 238.A O no hydrogen 2.748 N/A CYS 239.A SG HIS 238.A ND1 no hydrogen 3.686 N/A CYS 239.A SG HIS 238.A O no hydrogen 3.219 N/A TYR 243.A N VAL 234.A O no hydrogen 2.818 N/A VAL 245.A N LEU 232.A O no hydrogen 3.105 N/A CYS 246.A N GLN 293.A O no hydrogen 2.715 N/A CYS 246.A SG GLN 293.A O no hydrogen 3.023 N/A CYS 246.A SG GLY 295.A O no hydrogen 3.516 N/A ASN 247.A N GLN 293.A O no hydrogen 2.973 N/A VAL 248.A N ASN 247.A OD1 no hydrogen 2.399 N/A THR 249.A N CYS 291.A O no hydrogen 2.874 N/A THR 249.A OG1 ARG 251.A O no hydrogen 3.073 N/A THR 249.A OG1 CYS 291.A O no hydrogen 3.081 N/A ARG 251.A NH2 ARG 250.A O no hydrogen 3.570 N/A ALA 253.A N LEU 289.A O no hydrogen 3.110 N/A SER 254.A OG HIS 255.A ND1 no hydrogen 2.730 N/A HIS 255.A N PRO 252.A O no hydrogen 3.187 N/A HIS 255.A ND1 SER 254.A OG no hydrogen 2.730 N/A GLN 256.A N PRO 252.A O no hydrogen 2.971 N/A PHE 258.A N CYS 270.A O no hydrogen 2.896 N/A LEU 260.A N VAL 268.A O no hydrogen 2.891 N/A CYS 270.A N PHE 258.A O no hydrogen 2.949 N/A CYS 270.A SG THR 271.A O no hydrogen 3.311 N/A VAL 272.A N GLN 256.A O no hydrogen 2.941 N/A ALA 273.A N ALA 253.A O no hydrogen 2.890 N/A GLN 274.A NE2 ASP 278.A OD2 no hydrogen 3.177 N/A TYR 275.A N THR 271.A O no hydrogen 2.959 N/A PHE 276.A N VAL 272.A O no hydrogen 2.942 N/A LYS 277.A N ALA 273.A O no hydrogen 2.913 N/A ASP 278.A N GLN 274.A O no hydrogen 2.906 N/A ARG 279.A N TYR 275.A O no hydrogen 2.707 N/A ARG 279.A NH1 ARG 279.A O no hydrogen 3.361 N/A LEU 282.A N PHE 276.A O no hydrogen 2.749 N/A ARG 285.A N GLU 306.A OE1 no hydrogen 3.286 N/A ARG 285.A N GLU 306.A OE2 no hydrogen 2.787 N/A CYS 291.A N THR 249.A OG1 no hydrogen 2.469 N/A LEU 292.A N LEU 303.A O no hydrogen 2.860 N/A GLN 293.A N ASN 247.A O no hydrogen 2.822 N/A VAL 294.A N THR 301.A O no hydrogen 2.895 N/A GLY 295.A N ARG 244.A O no hydrogen 3.462 N/A GLU 297.A N GLU 297.A OE2 no hydrogen 2.493 N/A GLN 298.A NE2 GLN 296.A OE1 no hydrogen 3.038 N/A LYS 299.A N GLN 296.A O no hydrogen 2.818 N/A HIS 300.A ND1 TYR 302.A OH no hydrogen 2.582 N/A TYR 302.A OH HIS 300.A ND1 no hydrogen 2.582 N/A LEU 303.A N LEU 292.A O no hydrogen 2.903 N/A VAL 307.A N PRO 304.A O no hydrogen 3.514 N/A CYS 308.A N LEU 305.A O no hydrogen 3.177 N/A CYS 308.A SG PRO 304.A O no hydrogen 3.507 N/A ASN 309.A N GLU 235.A O no hydrogen 2.913 N/A ILE 310.A N GLN 195.A O no hydrogen 2.794 N/A CYS 316.A N ALA 190.A O no hydrogen 2.857 N/A CYS 316.A SG TYR 192.A OH no hydrogen 3.401 N/A CYS 316.A SG LYS 318.A O no hydrogen 3.822 N/A LYS 318.A NZ LYS 227.A O no hydrogen 2.598 N/A THR 321.A N GLN 324.A OE1 no hydrogen 3.140 N/A GLN 324.A NE2 LEU 159.A O no hydrogen 3.434 N/A GLN 324.A NE2 GLY 160.A O no hydrogen 3.584 N/A THR 325.A N THR 321.A O no hydrogen 3.026 N/A THR 325.A OG1 THR 321.A O no hydrogen 3.188 N/A SER 326.A N ASP 322.A O no hydrogen 2.898 N/A THR 327.A N ASN 323.A O no hydrogen 2.900 N/A THR 327.A OG1 ASN 323.A O no hydrogen 2.535 N/A MET 328.A N GLN 324.A O no hydrogen 2.902 N/A ILE 329.A N THR 325.A O no hydrogen 2.926 N/A ARG 330.A N SER 326.A O no hydrogen 2.594 N/A ALA 331.A N MET 328.A O no hydrogen 3.036 N/A ARG 334.A NE ALA 331.A O no hydrogen 3.098 N/A ALA 336.A N SER 687.A O no hydrogen 2.886 N/A ARG 339.A N SER 335.A O no hydrogen 2.866 N/A ARG 339.A NH1 VAL 186.A O no hydrogen 3.396 N/A GLN 340.A N ALA 336.A O no hydrogen 2.903 N/A GLN 340.A NE2 GLN 20.A OE1 no hydrogen 3.072 N/A GLU 341.A N PRO 337.A O no hydrogen 2.897 N/A GLU 342.A N ASP 338.A O no hydrogen 2.904 N/A ILE 343.A N ARG 339.A O no hydrogen 2.885 N/A SER 344.A N GLN 340.A O no hydrogen 2.935 N/A SER 344.A OG GLN 340.A O no hydrogen 3.101 N/A LYS 345.A N GLU 341.A O no hydrogen 2.872 N/A LEU 346.A N GLU 342.A O no hydrogen 2.866 N/A MET 347.A N ILE 343.A O no hydrogen 2.912 N/A ARG 348.A N SER 344.A O no hydrogen 2.922 N/A SER 349.A N LYS 345.A O no hydrogen 2.872 N/A SER 349.A OG LYS 345.A O no hydrogen 3.245 N/A ALA 350.A N LEU 346.A O no hydrogen 2.895 N/A ASN 353.A ND2 VAL 365.A O no hydrogen 2.818 N/A THR 354.A OG1 ASP 351.A O no hydrogen 2.904 N/A THR 354.A OG1 ASP 351.A OD2 no hydrogen 2.648 N/A ARG 359.A N ASP 355.A O no hydrogen 2.865 N/A GLU 360.A N PRO 356.A O no hydrogen 2.916 N/A PHE 361.A N VAL 358.A O no hydrogen 3.319 N/A GLY 362.A N ARG 359.A O no hydrogen 3.083 N/A MET 364.A N ASP 27.A O no hydrogen 3.093 N/A LYS 366.A N GLU 25.A O no hydrogen 2.802 N/A ASP 367.A N ASP 367.A OD1 no hydrogen 2.547 N/A THR 370.A N ALA 21.A O no hydrogen 3.038 N/A THR 370.A OG1 PHE 23.A O no hydrogen 2.431 N/A VAL 372.A N LEU 19.A O no hydrogen 2.921 N/A ARG 375.A N THR 695.A O no hydrogen 2.983 N/A ARG 375.A NH1 GLN 740.A OE1 no hydrogen 2.930 N/A ARG 375.A NH2 ASP 697.A OD2 no hydrogen 2.310 N/A ARG 375.A NH2 GLN 740.A OE1 no hydrogen 2.642 N/A VAL 376.A N ARG 15.A O no hydrogen 2.762 N/A LEU 377.A N GLY 693.A O no hydrogen 2.897 N/A ILE 382.A N ALA 392.A O no hydrogen 2.925 N/A LEU 383.A N ILE 541.A O no hydrogen 2.897 N/A TYR 384.A N ALA 390.A O no hydrogen 2.930 N/A GLY 385.A N GLN 405.A O no hydrogen 2.606 N/A ALA 392.A N ILE 382.A O no hydrogen 2.868 N/A VAL 395.A N VAL 398.A O no hydrogen 2.876 N/A VAL 398.A N VAL 395.A O no hydrogen 3.048 N/A TRP 399.A N THR 754.A O no hydrogen 2.968 N/A TRP 399.A NE1 TYR 384.A OH no hydrogen 3.075 N/A ARG 402.A N ASP 400.A OD1 no hydrogen 3.465 N/A ARG 402.A NE ASP 400.A OD2 no hydrogen 3.213 N/A LYS 404.A N MET 401.A O no hydrogen 2.892 N/A LYS 404.A NZ ARG 402.A O no hydrogen 2.822 N/A PHE 406.A N ALA 445.A O no hydrogen 2.947 N/A HIS 407.A N ASN 539.A O no hydrogen 3.021 N/A THR 408.A N VAL 538.A O no hydrogen 2.885 N/A THR 408.A OG1 HIS 407.A ND1 no hydrogen 3.228 N/A ILE 412.A N PRO 448.A O no hydrogen 3.013 N/A LYS 413.A N GLN 480.A OE1 no hydrogen 2.825 N/A TRP 415.A NE1 GLY 451.A O no hydrogen 3.070 N/A ALA 416.A N LEU 481.A O no hydrogen 3.077 N/A ILE 417.A N PHE 455.A O no hydrogen 2.888 N/A ALA 418.A N VAL 483.A O no hydrogen 2.980 N/A CYS 419.A N LYS 457.A O no hydrogen 2.932 N/A CYS 419.A SG ALA 421.A O no hydrogen 3.517 N/A PHE 420.A N ILE 485.A O no hydrogen 2.872 N/A GLN 425.A N PRO 422.A O no hydrogen 3.118 N/A THR 427.A N HIS 430.A ND1 no hydrogen 3.258 N/A LYS 432.A N GLU 428.A O no hydrogen 2.918 N/A SER 433.A N VAL 429.A O no hydrogen 2.915 N/A PHE 434.A N HIS 430.A O no hydrogen 2.911 N/A THR 435.A N LEU 431.A O no hydrogen 2.904 N/A THR 435.A OG1 LEU 431.A O no hydrogen 2.473 N/A GLU 436.A N LYS 432.A O no hydrogen 2.907 N/A GLN 437.A N SER 433.A O no hydrogen 2.934 N/A LEU 438.A N PHE 434.A O no hydrogen 2.923 N/A ARG 439.A N THR 435.A O no hydrogen 2.884 N/A ARG 439.A NE ILE 449.A O no hydrogen 3.210 N/A ARG 439.A NH2 ILE 449.A O no hydrogen 2.996 N/A LYS 440.A N GLU 436.A O no hydrogen 2.948 N/A LYS 440.A NZ ASP 444.A OD2 no hydrogen 3.014 N/A ILE 441.A N GLN 437.A O no hydrogen 2.964 N/A SER 442.A N LEU 438.A O no hydrogen 2.883 N/A SER 442.A OG LEU 438.A O no hydrogen 3.219 N/A SER 442.A OG ARG 439.A O no hydrogen 2.436 N/A ARG 443.A N ARG 439.A O no hydrogen 2.913 N/A ASP 444.A N LYS 440.A O no hydrogen 2.932 N/A ALA 445.A N ILE 441.A O no hydrogen 2.914 N/A ALA 445.A N SER 442.A O no hydrogen 3.098 N/A GLY 446.A N SER 442.A O no hydrogen 3.243 N/A MET 447.A N SER 442.A O no hydrogen 3.003 N/A ILE 449.A N SER 442.A OG no hydrogen 3.214 N/A GLN 450.A N ILE 412.A O no hydrogen 2.868 N/A CYS 454.A N TRP 415.A O no hydrogen 3.033 N/A CYS 454.A SG TRP 415.A O no hydrogen 3.460 N/A LYS 457.A N ILE 417.A O no hydrogen 2.926 N/A TYR 458.A OH CYS 426.A O no hydrogen 2.488 N/A ALA 459.A N CYS 419.A O no hydrogen 2.724 N/A SER 464.A N GLY 461.A O no hydrogen 3.415 N/A SER 464.A OG GLN 460.A O no hydrogen 2.876 N/A VAL 465.A N ALA 462.A O no hydrogen 2.936 N/A PHE 469.A N VAL 465.A O no hydrogen 3.290 N/A HIS 471.A N PRO 467.A O no hydrogen 3.229 N/A LEU 472.A N MET 468.A O no hydrogen 2.690 N/A LYS 473.A N PHE 469.A O no hydrogen 2.666 N/A ASN 474.A N ARG 470.A O no hydrogen 2.935 N/A ASN 474.A N HIS 471.A O no hydrogen 2.962 N/A THR 475.A N HIS 471.A O no hydrogen 2.960 N/A THR 475.A OG1 HIS 471.A O no hydrogen 2.709 N/A GLN 480.A N VAL 414.A O no hydrogen 2.893 N/A VAL 482.A N ALA 507.A O no hydrogen 2.849 N/A VAL 483.A N ALA 416.A O no hydrogen 3.097 N/A VAL 484.A N GLN 509.A O no hydrogen 2.928 N/A LEU 486.A N VAL 511.A O no hydrogen 2.887 N/A VAL 492.A N THR 490.A OG1 no hydrogen 3.124 N/A TYR 493.A N THR 490.A O no hydrogen 3.255 N/A GLU 495.A N PRO 491.A O no hydrogen 3.012 N/A VAL 496.A N VAL 492.A O no hydrogen 2.854 N/A LYS 497.A N TYR 493.A O no hydrogen 2.912 N/A ARG 498.A N ALA 494.A O no hydrogen 2.921 N/A VAL 499.A N GLU 495.A O no hydrogen 2.888 N/A GLY 500.A N VAL 496.A O no hydrogen 2.891 N/A ASP 501.A N LYS 497.A O no hydrogen 2.910 N/A THR 502.A N ARG 498.A O no hydrogen 3.140 N/A THR 502.A OG1 ARG 498.A O no hydrogen 2.165 N/A LEU 504.A N VAL 499.A O no hydrogen 3.304 N/A GLN 509.A N VAL 482.A O no hydrogen 2.899 N/A GLN 509.A NE2 CYS 510.A O no hydrogen 2.880 N/A VAL 511.A N VAL 484.A O no hydrogen 2.893 N/A VAL 516.A N MET 513.A O no hydrogen 2.975 N/A GLN 517.A N MET 513.A O no hydrogen 3.267 N/A ARG 518.A N LYS 514.A O no hydrogen 2.893 N/A GLN 522.A NE2 GLN 522.A O no hydrogen 3.574 N/A GLN 522.A NE2 ASN 526.A OD1 no hydrogen 2.951 N/A THR 523.A OG1 THR 520.A OG1 no hydrogen 2.915 N/A LEU 524.A N THR 520.A O no hydrogen 3.252 N/A SER 525.A N PRO 521.A O no hydrogen 2.915 N/A ASN 526.A N GLN 522.A O no hydrogen 2.947 N/A ASN 526.A ND2 ARG 752.A O no hydrogen 3.372 N/A LEU 527.A N THR 523.A O no hydrogen 2.932 N/A CYS 528.A N LEU 524.A O no hydrogen 2.901 N/A CYS 528.A SG LEU 524.A O no hydrogen 3.069 N/A LEU 529.A N SER 525.A O no hydrogen 2.940 N/A LYS 530.A N ASN 526.A O no hydrogen 2.961 N/A LYS 530.A NZ GLN 509.A OE1 no hydrogen 2.859 N/A LYS 530.A NZ ALA 798.A O no hydrogen 3.114 N/A LYS 530.A NZ ALA 798.A OXT no hydrogen 3.002 N/A ILE 531.A N LEU 527.A O no hydrogen 2.903 N/A ASN 532.A N CYS 528.A O no hydrogen 2.893 N/A ASN 532.A ND2 THR 408.A O no hydrogen 3.637 N/A ASN 532.A ND2 ASN 539.A OD1 no hydrogen 2.484 N/A VAL 533.A N LEU 529.A O no hydrogen 2.960 N/A LYS 534.A N LYS 530.A O no hydrogen 2.913 N/A LYS 534.A NZ THR 508.A O no hydrogen 2.626 N/A LYS 534.A NZ GLN 509.A OE1 no hydrogen 3.003 N/A LEU 535.A N ILE 531.A O no hydrogen 3.108 N/A GLY 536.A N VAL 533.A O no hydrogen 3.171 N/A GLY 537.A N ASN 532.A O no hydrogen 3.030 N/A VAL 538.A N THR 408.A O no hydrogen 3.312 N/A ASN 539.A ND2 LEU 529.A O no hydrogen 3.200 N/A ASN 539.A ND2 VAL 751.A O no hydrogen 3.121 N/A ASN 540.A ND2 TYR 384.A OH no hydrogen 2.752 N/A ILE 541.A N LEU 383.A O no hydrogen 3.425 N/A LEU 543.A N SER 381.A O no hydrogen 3.065 N/A GLY 546.A N LEU 543.A O no hydrogen 2.792 N/A ARG 547.A NE PRO 544.A O no hydrogen 2.767 N/A ARG 547.A NH2 PRO 544.A O no hydrogen 3.364 N/A PHE 551.A N PRO 548.A O no hydrogen 3.078 N/A GLN 552.A N PRO 549.A O no hydrogen 2.918 N/A ILE 556.A N ARG 623.A O no hydrogen 3.113 N/A PHE 557.A N SER 577.A OG no hydrogen 2.925 N/A LEU 558.A N ILE 625.A O no hydrogen 2.751 N/A GLY 559.A N VAL 575.A O no hydrogen 2.931 N/A ALA 560.A N TYR 627.A O no hydrogen 3.037 N/A ASP 561.A N ALA 573.A O no hydrogen 2.949 N/A VAL 562.A N ASP 561.A OD1 no hydrogen 2.469 N/A THR 563.A N ILE 571.A O no hydrogen 2.916 N/A HIS 564.A ND1 SER 570.A OG no hydrogen 3.186 N/A SER 570.A N GLN 592.A O no hydrogen 2.945 N/A SER 570.A OG HIS 564.A ND1 no hydrogen 3.186 N/A SER 570.A OG GLN 593.A O no hydrogen 3.502 N/A ILE 571.A N THR 563.A O no hydrogen 2.926 N/A ALA 572.A N ARG 590.A O no hydrogen 2.941 N/A ALA 573.A N ASP 561.A O no hydrogen 2.866 N/A VAL 574.A N THR 588.A O no hydrogen 2.890 N/A VAL 575.A N GLY 559.A O no hydrogen 2.865 N/A GLY 576.A N CYS 586.A O no hydrogen 2.928 N/A SER 577.A N PHE 557.A O no hydrogen 2.902 N/A MET 578.A N ARG 584.A O no hydrogen 2.679 N/A ASN 583.A N ASP 579.A OD1 no hydrogen 2.796 N/A ARG 584.A N ASP 579.A OD1 no hydrogen 3.372 N/A ARG 584.A N ASP 579.A OD2 no hydrogen 3.123 N/A ARG 584.A NH1 VAL 533.A O no hydrogen 2.673 N/A ARG 584.A NH2 VAL 533.A O no hydrogen 2.482 N/A CYS 586.A N GLY 576.A O no hydrogen 2.871 N/A CYS 586.A SG LEU 792.A O no hydrogen 3.448 N/A THR 588.A N VAL 574.A O no hydrogen 2.910 N/A THR 588.A OG1 VAL 574.A O no hydrogen 2.516 N/A ARG 590.A N ALA 572.A O no hydrogen 2.879 N/A ARG 590.A NH1 VAL 589.A O no hydrogen 3.562 N/A ARG 590.A NH1 GLU 608.A OE2 no hydrogen 3.542 N/A ARG 590.A NH2 GLU 608.A OE2 no hydrogen 2.819 N/A GLN 592.A N SER 570.A O no hydrogen 2.837 N/A HIS 594.A ND1 LYS 568.A O no hydrogen 2.686 N/A ARG 595.A N SER 570.A OG no hydrogen 2.695 N/A GLN 596.A N GLN 593.A O no hydrogen 3.300 N/A ILE 599.A N GLU 643.A OE2 no hydrogen 3.059 N/A GLN 600.A N GLN 592.A OE1 no hydrogen 2.246 N/A MET 605.A N ASP 601.A O no hydrogen 3.263 N/A VAL 606.A N LEU 602.A O no hydrogen 2.750 N/A ARG 607.A N ALA 603.A O no hydrogen 2.849 N/A GLU 608.A N ALA 604.A O no hydrogen 3.009 N/A LEU 609.A N MET 605.A O no hydrogen 3.086 N/A LEU 610.A N VAL 606.A O no hydrogen 2.738 N/A ILE 611.A N ARG 607.A O no hydrogen 2.764 N/A GLN 612.A N GLU 608.A O no hydrogen 2.678 N/A PHE 613.A N LEU 609.A O no hydrogen 2.613 N/A TYR 614.A N LEU 610.A O no hydrogen 3.042 N/A LYS 615.A N ILE 611.A O no hydrogen 2.998 N/A SER 616.A N GLN 612.A O no hydrogen 2.865 N/A SER 616.A N PHE 613.A O no hydrogen 2.942 N/A SER 616.A OG GLN 612.A O no hydrogen 3.087 N/A THR 617.A N TYR 614.A O no hydrogen 3.000 N/A THR 617.A OG1 PHE 613.A O no hydrogen 2.798 N/A THR 617.A OG1 PHE 619.A O no hydrogen 3.073 N/A ARG 618.A N TYR 614.A O no hydrogen 2.584 N/A PHE 619.A N THR 617.A OG1 no hydrogen 3.093 N/A LYS 620.A NZ GLU 655.A OE1 no hydrogen 2.454 N/A LYS 620.A NZ GLU 655.A OE2 no hydrogen 2.547 N/A THR 622.A N PRO 554.A O no hydrogen 2.677 N/A THR 622.A OG1 GLN 553.A OE1 no hydrogen 3.379 N/A THR 622.A OG1 PRO 554.A O no hydrogen 2.925 N/A ILE 624.A N GLY 661.A O no hydrogen 2.752 N/A ILE 625.A N ILE 556.A O no hydrogen 3.008 N/A PHE 626.A N THR 663.A O no hydrogen 2.983 N/A TYR 627.A N LEU 558.A O no hydrogen 2.834 N/A TYR 627.A OH THR 743.A OG1 no hydrogen 2.534 N/A ARG 628.A N ILE 665.A O no hydrogen 2.756 N/A ARG 628.A NE GLU 643.A OE1 no hydrogen 2.672 N/A ARG 628.A NE GLU 643.A OE2 no hydrogen 2.861 N/A ARG 628.A NH1 ALA 629.A O no hydrogen 3.268 N/A ARG 628.A NH2 GLU 597.A O no hydrogen 2.497 N/A ARG 628.A NH2 GLU 643.A OE2 no hydrogen 2.657 N/A ALA 629.A N ALA 560.A O no hydrogen 2.736 N/A SER 632.A N GLN 635.A OE1 no hydrogen 3.088 N/A GLN 635.A N SER 632.A O no hydrogen 3.224 N/A GLN 635.A NE2 GLU 597.A OE1 no hydrogen 2.814 N/A PHE 636.A N GLU 633.A O no hydrogen 2.926 N/A VAL 639.A N GLN 635.A O no hydrogen 2.791 N/A LEU 640.A N PHE 636.A O no hydrogen 2.630 N/A HIS 641.A N GLN 637.A O no hydrogen 3.142 N/A HIS 642.A N GLN 638.A O no hydrogen 3.037 N/A HIS 642.A NE2 GLN 600.A O no hydrogen 3.194 N/A GLU 643.A N VAL 639.A O no hydrogen 2.766 N/A ALA 646.A N HIS 642.A O no hydrogen 2.643 N/A ILE 647.A N GLU 643.A O no hydrogen 2.595 N/A ARG 648.A N LEU 644.A O no hydrogen 2.703 N/A GLU 649.A N LEU 645.A O no hydrogen 2.449 N/A ALA 650.A N ALA 646.A O no hydrogen 3.100 N/A CYS 651.A N ILE 647.A O no hydrogen 3.089 N/A CYS 651.A N ARG 648.A O no hydrogen 2.925 N/A CYS 651.A SG ILE 647.A O no hydrogen 3.553 N/A ILE 652.A N GLU 649.A O no hydrogen 2.932 N/A LYS 653.A N GLU 649.A O no hydrogen 3.064 N/A TYR 658.A N GLU 655.A O no hydrogen 3.265 N/A TYR 658.A OH PRO 621.A O no hydrogen 2.210 N/A GLY 661.A N THR 622.A O no hydrogen 3.306 N/A ILE 662.A N ASP 731.A OD2 no hydrogen 3.466 N/A THR 663.A N ILE 624.A O no hydrogen 2.735 N/A THR 663.A OG1 ASP 730.A OD1 no hydrogen 2.934 N/A ILE 665.A N PHE 626.A O no hydrogen 2.921 N/A VAL 666.A N HIS 726.A O no hydrogen 2.850 N/A VAL 667.A N ARG 628.A O no hydrogen 2.807 N/A GLN 668.A N HIS 724.A O no hydrogen 2.890 N/A HIS 671.A NE2 PRO 722.A O no hydrogen 2.491 N/A THR 673.A N HIS 671.A ND1 no hydrogen 3.182 N/A THR 673.A OG1 TYR 709.A OH no hydrogen 2.851 N/A ARG 674.A N ASN 22.A OD1 no hydrogen 2.480 N/A PHE 676.A N GLN 20.A O no hydrogen 2.932 N/A CYS 677.A SG GLU 682.A O no hydrogen 3.521 N/A THR 678.A N LYS 18.A O no hydrogen 2.897 N/A GLU 682.A N ASP 679.A O no hydrogen 3.143 N/A ARG 683.A N LYS 680.A O no hydrogen 3.476 N/A VAL 684.A N ASN 689.A O no hydrogen 2.961 N/A SER 687.A OG ASN 689.A OD1 no hydrogen 3.412 N/A SER 687.A OG GLY 715.A O no hydrogen 2.977 N/A GLY 688.A N GLY 685.A O no hydrogen 3.117 N/A ASN 689.A N VAL 684.A O no hydrogen 3.222 N/A GLY 693.A N CYS 711.A O no hydrogen 2.469 N/A THR 694.A N CYS 711.A O no hydrogen 2.930 N/A THR 694.A OG1 PRO 691.A O no hydrogen 2.514 N/A THR 695.A N ARG 375.A O no hydrogen 2.711 N/A THR 695.A OG1 GLY 693.A O no hydrogen 3.326 N/A VAL 696.A N TYR 709.A O no hydrogen 2.916 N/A ILE 700.A N THR 698.A O no hydrogen 2.444 N/A HIS 702.A N ASP 707.A OD1 no hydrogen 3.128 N/A HIS 702.A N ASP 707.A OD2 no hydrogen 3.131 N/A THR 704.A N HIS 702.A ND1 no hydrogen 3.368 N/A THR 704.A OG1 PRO 119.A O no hydrogen 3.562 N/A GLU 705.A N HIS 702.A ND1 no hydrogen 2.994 N/A PHE 708.A N TYR 725.A O no hydrogen 2.902 N/A TYR 709.A N VAL 696.A O no hydrogen 2.876 N/A TYR 709.A OH THR 673.A OG1 no hydrogen 2.851 N/A LEU 710.A N SER 723.A O no hydrogen 2.877 N/A CYS 711.A N THR 694.A O no hydrogen 2.871 N/A CYS 711.A SG HIS 713.A O no hydrogen 3.596 N/A SER 712.A OG VAL 757.A O no hydrogen 2.782 N/A THR 719.A OG1 ARG 334.A O no hydrogen 3.320 N/A SER 723.A OG SER 758.A O no hydrogen 2.571 N/A HIS 724.A N GLN 668.A O no hydrogen 2.916 N/A TYR 725.A N PHE 708.A O no hydrogen 2.913 N/A HIS 726.A N VAL 666.A O no hydrogen 2.933 N/A HIS 726.A NE2 GLU 705.A OE1 no hydrogen 2.903 N/A VAL 727.A N PHE 706.A O no hydrogen 2.792 N/A LEU 728.A N PHE 664.A O no hydrogen 2.715 N/A TRP 729.A N PHE 664.A O no hydrogen 2.951 N/A ASP 731.A N ILE 662.A O no hydrogen 2.938 N/A ASN 732.A ND2 GLY 661.A O no hydrogen 2.986 N/A ASN 732.A ND2 THR 663.A OG1 no hydrogen 2.570 N/A PHE 734.A N ASP 730.A OD2 no hydrogen 2.609 N/A SER 736.A N ASP 9.A OD1 no hydrogen 2.810 N/A SER 736.A OG ASP 9.A O no hydrogen 2.645 N/A SER 736.A OG ASP 9.A OD1 no hydrogen 2.840 N/A GLU 738.A N SER 735.A OG no hydrogen 3.353 N/A LEU 739.A N SER 735.A O no hydrogen 3.109 N/A GLN 740.A N SER 736.A O no hydrogen 2.921 N/A GLN 740.A NE2 ASP 697.A OD2 no hydrogen 2.852 N/A ILE 741.A N ASP 737.A O no hydrogen 2.902 N/A LEU 742.A N GLU 738.A O no hydrogen 2.908 N/A THR 743.A N LEU 739.A O no hydrogen 2.900 N/A THR 743.A OG1 TYR 627.A OH no hydrogen 2.534 N/A THR 743.A OG1 LEU 739.A O no hydrogen 2.887 N/A TYR 744.A N GLN 740.A O no hydrogen 2.917 N/A GLN 745.A N ILE 741.A O no hydrogen 2.891 N/A GLN 745.A NE2 GLY 546.A O no hydrogen 2.620 N/A LEU 746.A N LEU 742.A O no hydrogen 2.893 N/A CYS 747.A N THR 743.A O no hydrogen 2.935 N/A CYS 747.A SG SER 712.A OG no hydrogen 3.638 N/A CYS 747.A SG THR 743.A O no hydrogen 3.335 N/A CYS 747.A SG VAL 757.A O no hydrogen 3.881 N/A HIS 748.A N GLN 745.A O no hydrogen 3.131 N/A HIS 748.A ND1 TYR 744.A O no hydrogen 2.662 N/A THR 749.A OG1 LEU 746.A O no hydrogen 2.908 N/A VAL 751.A N TYR 765.A OH no hydrogen 3.157 N/A ARG 752.A NH1 ALA 798.A OXT no hydrogen 2.933 N/A THR 754.A OG1 TRP 399.A O no hydrogen 2.663 N/A SER 756.A N GLY 397.A O no hydrogen 2.736 N/A SER 756.A OG SER 712.A O no hydrogen 2.442 N/A VAL 757.A N CYS 747.A O no hydrogen 3.292 N/A ALA 761.A N LEU 746.A O no hydrogen 3.180 N/A TYR 764.A N PRO 760.A O no hydrogen 3.205 N/A TYR 765.A N ALA 761.A O no hydrogen 2.879 N/A TYR 765.A OH THR 749.A O no hydrogen 3.120 N/A ALA 766.A N PRO 762.A O no hydrogen 2.897 N/A HIS 767.A N ALA 763.A O no hydrogen 2.927 N/A HIS 767.A ND1 ASP 561.A OD2 no hydrogen 3.250 N/A LEU 768.A N TYR 764.A O no hydrogen 2.911 N/A VAL 769.A N TYR 765.A O no hydrogen 2.868 N/A ALA 770.A N ALA 766.A O no hydrogen 2.933 N/A PHE 771.A N HIS 767.A O no hydrogen 2.907 N/A ARG 772.A N LEU 768.A O no hydrogen 2.888 N/A ARG 772.A NH1 ASP 501.A OD2 no hydrogen 3.151 N/A ARG 772.A NH1 TYR 796.A O no hydrogen 3.210 N/A ALA 773.A N VAL 769.A O no hydrogen 2.908 N/A ARG 774.A N ALA 770.A O no hydrogen 3.106 N/A TYR 775.A N ARG 772.A O no hydrogen 3.150 N/A HIS 776.A N ALA 773.A O no hydrogen 3.323 N/A LEU 781.A N ASP 777.A O no hydrogen 3.274 N/A ALA 782.A N HIS 778.A O no hydrogen 2.928 N/A ALA 784.A N LEU 781.A O no hydrogen 3.097 N/A GLN 786.A NE2 VAL 787.A O no hydrogen 3.609 N/A HIS 788.A N ASP 501.A O no hydrogen 2.771 N/A ASP 790.A N HIS 788.A ND1 no hydrogen 2.982 N/A THR 791.A OG1 ASP 501.A O no hydrogen 2.911 N/A LEU 792.A N HIS 788.A O no hydrogen 2.919 N/A THR 794.A N THR 791.A O no hydrogen 2.993 N/A THR 794.A OG1 THR 791.A O no hydrogen 2.479 N/A ALA 798.A N MET 795.A O no hydrogen 3.395 N/A