Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8i6p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 ASP 6.A OD1 no hydrogen 2.748 N/A THR 2.A OG1 ASP 6.A OD2 no hydrogen 2.870 N/A ASP 6.A N THR 2.A O no hydrogen 2.872 N/A GLY 7.A N THR 3.A O no hydrogen 2.910 N/A ILE 8.A N MET 4.A O no hydrogen 2.933 N/A ARG 9.A N ILE 5.A O no hydrogen 2.864 N/A THR 10.A N ASP 6.A O no hydrogen 2.897 N/A THR 10.A OG1 ASP 6.A O no hydrogen 3.291 N/A THR 10.A OG1 GLY 7.A O no hydrogen 2.913 N/A ALA 11.A N GLY 7.A O no hydrogen 2.894 N/A LEU 12.A N ILE 8.A O no hydrogen 2.865 N/A ARG 13.A N ARG 9.A O no hydrogen 2.890 N/A SER 14.A N ALA 11.A O no hydrogen 3.287 N/A SER 14.A OG THR 10.A O no hydrogen 2.826 N/A SER 14.A OG ALA 11.A O no hydrogen 2.578 N/A SER 21.A N ARG 423.A O no hydrogen 2.731 N/A SER 21.A OG ARG 423.A O no hydrogen 2.248 N/A SER 23.A N VAL 229.A O no hydrogen 2.855 N/A TYR 25.A OH GLU 175.A OE2 no hydrogen 3.204 N/A THR 27.A OG1 SER 23.A O no hydrogen 3.250 N/A SER 28.A N ALA 24.A O no hydrogen 2.939 N/A SER 28.A N TYR 25.A O no hydrogen 3.068 N/A VAL 30.A N ASP 26.A O no hydrogen 2.927 N/A ALA 31.A N THR 27.A O no hydrogen 2.877 N/A LEU 32.A N SER 28.A O no hydrogen 3.190 N/A LEU 32.A N LEU 29.A O no hydrogen 2.937 N/A LEU 33.A N VAL 30.A O no hydrogen 3.325 N/A ARG 35.A N GLY 41.A O no hydrogen 3.052 N/A ARG 35.A NH2 ASP 40.A OD1 no hydrogen 2.914 N/A LEU 36.A N GLN 43.A OE1 no hydrogen 3.188 N/A GLN 43.A N LEU 33.A O no hydrogen 3.119 N/A THR 47.A OG1 PHE 44.A O no hydrogen 3.553 N/A ASP 49.A N PRO 45.A O no hydrogen 2.911 N/A TRP 50.A N SER 46.A O no hydrogen 2.950 N/A ILE 51.A N THR 47.A O no hydrogen 2.889 N/A VAL 52.A N ILE 48.A O no hydrogen 2.937 N/A GLN 53.A N ASP 49.A O no hydrogen 2.944 N/A GLN 53.A N TRP 50.A O no hydrogen 3.189 N/A ASN 54.A N ILE 51.A O no hydrogen 3.248 N/A GLN 55.A NE2 LYS 92.A O no hydrogen 3.514 N/A LEU 56.A N SER 60.A O no hydrogen 3.122 N/A GLY 59.A N LEU 56.A O no hydrogen 2.579 N/A SER 60.A N ASP 58.A OD1 no hydrogen 3.206 N/A TRP 61.A N SER 60.A OG no hydrogen 2.732 N/A SER 65.A OG ASP 63.A OD2 no hydrogen 2.497 N/A GLY 70.A N GLU 110.A OE2 no hydrogen 2.932 N/A ARG 72.A N MET 68.A O no hydrogen 2.976 N/A ARG 72.A NH1 PHE 66.A O no hydrogen 2.960 N/A ARG 72.A NH2 PHE 66.A O no hydrogen 2.294 N/A ILE 73.A N MET 69.A O no hydrogen 2.903 N/A SER 75.A N ASP 71.A O no hydrogen 2.957 N/A SER 75.A OG TRP 61.A O no hydrogen 2.765 N/A SER 75.A OG ASP 71.A O no hydrogen 2.709 N/A SER 75.A OG ARG 72.A O no hydrogen 2.616 N/A THR 76.A N ARG 72.A O no hydrogen 2.926 N/A THR 76.A OG1 ARG 72.A O no hydrogen 2.900 N/A THR 76.A OG1 ILE 73.A O no hydrogen 2.597 N/A LEU 77.A N ILE 73.A O no hydrogen 2.863 N/A ALA 78.A N MET 74.A O no hydrogen 2.919 N/A CYS 79.A N SER 75.A O no hydrogen 2.944 N/A CYS 79.A SG THR 76.A O no hydrogen 3.140 N/A VAL 80.A N THR 76.A O no hydrogen 2.906 N/A VAL 81.A N LEU 77.A O no hydrogen 2.925 N/A ALA 82.A N ALA 78.A O no hydrogen 2.953 N/A LEU 83.A N CYS 79.A O no hydrogen 2.974 N/A LYS 84.A N VAL 80.A O no hydrogen 3.088 N/A LYS 84.A NZ ASN 87.A OD1 no hydrogen 2.935 N/A SER 85.A N VAL 81.A O no hydrogen 2.873 N/A SER 85.A OG VAL 81.A O no hydrogen 3.107 N/A SER 85.A OG ALA 82.A O no hydrogen 2.614 N/A TRP 86.A N ALA 82.A O no hydrogen 3.115 N/A TRP 86.A NE1 ALA 31.A O no hydrogen 2.915 N/A ASN 87.A N LYS 84.A O no hydrogen 2.787 N/A ILE 88.A N LEU 83.A O no hydrogen 3.118 N/A LYS 92.A N HIS 89.A O no hydrogen 3.237 N/A LYS 92.A NZ HIS 89.A ND1 no hydrogen 3.302 N/A LYS 92.A NZ ASP 91.A OD1 no hydrogen 3.068 N/A LYS 92.A NZ ASP 91.A OD2 no hydrogen 2.499 N/A GLU 94.A N THR 90.A O no hydrogen 2.938 N/A ARG 95.A N ASP 91.A O no hydrogen 2.848 N/A ARG 95.A NH1 PRO 57.A O no hydrogen 3.093 N/A ARG 95.A NH2 PRO 57.A O no hydrogen 2.344 N/A GLY 96.A N LYS 92.A O no hydrogen 2.947 N/A LEU 97.A N CYS 93.A O no hydrogen 2.861 N/A LEU 97.A N GLU 94.A O no hydrogen 3.225 N/A ILE 100.A N GLY 96.A O no hydrogen 2.940 N/A GLN 101.A N LEU 97.A O no hydrogen 2.854 N/A GLU 102.A N LEU 98.A O no hydrogen 2.955 N/A ASN 103.A N PHE 99.A O no hydrogen 2.902 N/A ASN 103.A N ILE 100.A O no hydrogen 3.155 N/A ASN 103.A ND2 PHE 99.A O no hydrogen 2.391 N/A MET 104.A N GLN 101.A O no hydrogen 3.296 N/A ARG 106.A N ASN 103.A O no hydrogen 2.963 N/A ALA 108.A N TRP 105.A O no hydrogen 3.526 N/A HIS 109.A N ARG 106.A O no hydrogen 3.232 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.181 N/A MET 115.A N ASP 113.A O no hydrogen 2.695 N/A PHE 119.A N LEU 116.A O no hydrogen 3.160 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 2.473 N/A ILE 121.A N GLY 118.A O no hydrogen 2.603 N/A ALA 122.A N GLY 118.A O no hydrogen 2.991 N/A LEU 123.A N PHE 119.A O no hydrogen 3.382 N/A SER 125.A OG ILE 121.A O no hydrogen 3.411 N/A SER 125.A OG ALA 122.A O no hydrogen 2.450 N/A SER 125.A OG GLU 175.A OE1 no hydrogen 3.452 N/A LEU 126.A N ALA 122.A O no hydrogen 2.555 N/A LEU 127.A N LEU 123.A O no hydrogen 2.913 N/A ASP 128.A N PRO 124.A O no hydrogen 2.906 N/A MET 129.A N SER 125.A O no hydrogen 2.902 N/A ALA 130.A N LEU 126.A O no hydrogen 2.894 N/A LYS 131.A N LEU 127.A O no hydrogen 2.914 N/A LYS 131.A NZ ASP 128.A OD1 no hydrogen 3.540 N/A ASP 132.A N MET 129.A O no hydrogen 3.361 N/A ASP 134.A N ALA 130.A O no hydrogen 2.345 N/A TYR 139.A N ILE 137.A O no hydrogen 2.694 N/A TYR 139.A OH ASP 134.A OD1 no hydrogen 3.400 N/A LYS 145.A N GLU 141.A O no hydrogen 3.311 N/A LYS 145.A NZ TYR 139.A O no hydrogen 3.557 N/A LYS 145.A NZ GLU 141.A O no hydrogen 2.300 N/A ALA 146.A N PRO 142.A O no hydrogen 2.931 N/A ILE 147.A N ALA 143.A O no hydrogen 3.075 N/A TYR 148.A N LEU 144.A O no hydrogen 2.909 N/A ALA 149.A N LYS 145.A O no hydrogen 2.886 N/A GLU 150.A N ALA 146.A O no hydrogen 2.978 N/A ARG 151.A N ILE 147.A O no hydrogen 2.841 N/A GLU 152.A N TYR 148.A O no hydrogen 2.954 N/A ARG 153.A N ALA 149.A O no hydrogen 2.905 N/A LYS 154.A N GLU 150.A O no hydrogen 2.932 N/A LYS 154.A NZ GLU 150.A O no hydrogen 2.626 N/A LEU 155.A N ARG 151.A O no hydrogen 2.852 N/A ALA 156.A N GLU 152.A O no hydrogen 2.905 N/A LYS 157.A N LYS 154.A O no hydrogen 2.956 N/A ARG 160.A NE PRO 159.A O no hydrogen 2.750 N/A ARG 160.A NH2 ILE 158.A O no hydrogen 3.544 N/A HIS 164.A ND1 ARG 160.A O no hydrogen 2.262 N/A SER 165.A N VAL 162.A O no hydrogen 3.294 N/A SER 165.A OG ASP 161.A O no hydrogen 2.763 N/A SER 165.A OG VAL 162.A O no hydrogen 3.466 N/A MET 166.A N VAL 162.A O no hydrogen 2.756 N/A LEU 171.A N THR 168.A O no hydrogen 3.101 N/A HIS 172.A N THR 169.A O no hydrogen 2.711 N/A MET 177.A N LEU 174.A O no hydrogen 3.062 N/A TRP 182.A N GLU 183.A OE1 no hydrogen 3.136 N/A GLU 183.A N ASP 181.A OD2 no hydrogen 2.427 N/A LYS 184.A N ASP 181.A OD2 no hydrogen 2.503 N/A LEU 186.A N GLU 183.A O no hydrogen 3.006 N/A LEU 188.A N LEU 185.A O no hydrogen 3.357 N/A ARG 189.A NH1 LEU 186.A O no hydrogen 2.301 N/A CYS 190.A N SER 194.A O no hydrogen 2.317 N/A GLY 193.A N CYS 190.A O no hydrogen 3.308 N/A CYS 197.A SG HIS 278.A NE2 no hydrogen 3.982 N/A SER 198.A N PHE 195.A O no hydrogen 3.202 N/A SER 198.A OG HIS 172.A O no hydrogen 3.196 N/A SER 198.A OG PHE 195.A O no hydrogen 3.238 N/A SER 198.A OG SER 201.A OG no hydrogen 2.404 N/A SER 201.A OG HIS 172.A O no hydrogen 2.334 N/A SER 201.A OG SER 198.A OG no hydrogen 2.404 N/A THR 202.A OG1 PRO 199.A O no hydrogen 2.850 N/A ALA 203.A N PRO 199.A O no hydrogen 2.863 N/A THR 204.A N ALA 200.A O no hydrogen 2.961 N/A THR 204.A OG1 ALA 200.A O no hydrogen 3.321 N/A THR 204.A OG1 SER 201.A O no hydrogen 2.750 N/A ALA 205.A N SER 201.A O no hydrogen 2.891 N/A PHE 206.A N THR 202.A O no hydrogen 2.872 N/A GLN 207.A N ALA 203.A O no hydrogen 2.992 N/A GLN 208.A N ALA 205.A O no hydrogen 2.802 N/A THR 209.A N PHE 206.A O no hydrogen 3.137 N/A ASP 211.A N THR 209.A O no hydrogen 2.838 N/A LYS 213.A N ASP 211.A OD2 no hydrogen 2.980 N/A CYS 214.A N ASP 211.A O no hydrogen 2.963 N/A CYS 214.A SG GLY 193.A O no hydrogen 3.830 N/A CYS 214.A SG THR 202.A O no hydrogen 3.682 N/A GLU 216.A N GLN 212.A O no hydrogen 2.850 N/A TYR 217.A OH TYR 233.A O no hydrogen 2.802 N/A LEU 218.A N CYS 214.A O no hydrogen 2.959 N/A ASP 219.A N PHE 215.A O no hydrogen 2.831 N/A GLY 220.A N GLU 216.A O no hydrogen 2.868 N/A ILE 221.A N TYR 217.A O no hydrogen 2.994 N/A VAL 222.A N LEU 218.A O no hydrogen 2.875 N/A LYS 223.A N ASP 219.A O no hydrogen 2.674 N/A LYS 224.A N ILE 221.A O no hydrogen 3.333 N/A LYS 224.A NZ LYS 224.A O no hydrogen 3.565 N/A ASN 226.A N VAL 222.A O no hydrogen 2.719 N/A VAL 229.A N THR 27.A OG1 no hydrogen 3.104 N/A TYR 233.A N CYS 197.A O no hydrogen 2.852 N/A LEU 235.A N GLU 17.A O no hydrogen 3.165 N/A VAL 237.A N ASP 236.A OD1 no hydrogen 2.609 N/A TYR 238.A N HIS 278.A O no hydrogen 3.091 N/A GLU 239.A N LEU 235.A O no hydrogen 3.030 N/A ARG 240.A N ASP 236.A O no hydrogen 2.909 N/A LEU 241.A N VAL 237.A O no hydrogen 2.965 N/A TRP 242.A N TYR 238.A O no hydrogen 2.942 N/A ALA 243.A N GLU 239.A O no hydrogen 2.891 N/A ASP 245.A N LEU 241.A O no hydrogen 2.957 N/A ARG 246.A NH1 ASP 245.A OD2 no hydrogen 3.160 N/A LEU 247.A N ALA 243.A O no hydrogen 2.947 N/A THR 248.A N VAL 244.A O no hydrogen 2.902 N/A THR 248.A OG1 VAL 244.A O no hydrogen 2.706 N/A THR 248.A OG1 ASP 245.A O no hydrogen 2.356 N/A ARG 249.A N ASP 245.A O no hydrogen 2.928 N/A ARG 249.A NH2 ASP 245.A OD1 no hydrogen 2.773 N/A LEU 250.A N ARG 246.A O no hydrogen 2.475 N/A GLY 251.A N THR 248.A O no hydrogen 3.345 N/A SER 253.A OG LEU 247.A O no hydrogen 2.785 N/A HIS 255.A N ILE 252.A O no hydrogen 3.350 N/A ILE 260.A N PHE 256.A O no hydrogen 2.916 N/A GLU 261.A N THR 257.A O no hydrogen 2.923 N/A ASP 262.A N SER 258.A O no hydrogen 2.885 N/A CYS 263.A N GLU 259.A O no hydrogen 3.011 N/A CYS 263.A SG GLU 259.A O no hydrogen 2.947 N/A CYS 263.A SG ILE 260.A O no hydrogen 2.989 N/A LEU 264.A N ILE 260.A O no hydrogen 2.937 N/A ASP 265.A N GLU 261.A O no hydrogen 2.871 N/A TYR 266.A N ASP 262.A O no hydrogen 2.967 N/A TYR 266.A OH ASP 236.A OD2 no hydrogen 3.405 N/A ILE 267.A N CYS 263.A O no hydrogen 2.960 N/A PHE 268.A N LEU 264.A O no hydrogen 2.904 N/A ARG 269.A N ASP 265.A O no hydrogen 2.874 N/A ASN 270.A N TYR 266.A O no hydrogen 2.991 N/A ASN 270.A ND2 TYR 266.A O no hydrogen 2.284 N/A TRP 271.A N PHE 268.A O no hydrogen 2.835 N/A THR 272.A OG1 GLY 275.A O no hydrogen 2.584 N/A ASP 274.A N THR 272.A OG1 no hydrogen 2.828 N/A GLY 275.A N THR 272.A OG1 no hydrogen 2.763 N/A LEU 276.A N THR 290.A OG1 no hydrogen 3.043 N/A THR 279.A OG1 ASP 236.A OD1 no hydrogen 3.294 N/A THR 279.A OG1 ASN 281.A OD1 no hydrogen 3.111 N/A LYS 280.A N THR 279.A OG1 no hydrogen 2.677 N/A CYS 282.A SG VAL 284.A O no hydrogen 3.562 N/A LYS 285.A NZ CYS 282.A O no hydrogen 2.975 N/A LYS 285.A NZ PRO 283.A O no hydrogen 2.516 N/A ASP 286.A N LEU 276.A O no hydrogen 3.260 N/A ILE 287.A N ASP 286.A OD1 no hydrogen 2.088 N/A ASP 288.A N ASP 286.A OD1 no hydrogen 3.014 N/A ASP 289.A N ASP 288.A OD1 no hydrogen 2.334 N/A THR 290.A N ASP 289.A OD1 no hydrogen 2.654 N/A THR 290.A OG1 ASP 286.A O no hydrogen 2.775 N/A ALA 291.A N ILE 287.A O no hydrogen 2.856 N/A MET 292.A N ASP 288.A O no hydrogen 2.940 N/A GLY 293.A N ASP 289.A O no hydrogen 2.912 N/A PHE 294.A N THR 290.A O no hydrogen 2.885 N/A ARG 295.A N ALA 291.A O no hydrogen 2.909 N/A LEU 296.A N MET 292.A O no hydrogen 2.975 N/A LEU 297.A N GLY 293.A O no hydrogen 2.861 N/A ARG 298.A N PHE 294.A O no hydrogen 2.951 N/A ARG 298.A NH1 LEU 342.A O no hydrogen 2.478 N/A ARG 298.A NH2 ASP 347.A OD2 no hydrogen 3.392 N/A LEU 299.A N ARG 295.A O no hydrogen 2.920 N/A TYR 300.A N LEU 297.A O no hydrogen 3.256 N/A GLY 301.A N ARG 298.A O no hydrogen 3.143 N/A CYS 307.A N ASP 305.A OD1 no hydrogen 3.415 N/A CYS 307.A SG ASP 305.A OD1 no hydrogen 2.964 N/A LEU 309.A N PRO 306.A O no hydrogen 2.833 N/A LYS 310.A N CYS 307.A O no hydrogen 2.856 N/A LYS 311.A N VAL 308.A O no hydrogen 3.422 N/A PHE 312.A N LEU 309.A O no hydrogen 3.171 N/A LYS 314.A N LYS 317.A O no hydrogen 2.519 N/A LYS 314.A NZ PHE 319.A O no hydrogen 3.256 N/A LYS 314.A NZ LEU 321.A O no hydrogen 2.494 N/A LYS 317.A N LYS 314.A O no hydrogen 2.541 N/A PHE 319.A N PHE 312.A O no hydrogen 3.156 N/A CYS 320.A SG ASP 286.A OD1 no hydrogen 3.791 N/A VAL 330.A N SER 329.A OG no hydrogen 2.549 N/A THR 331.A OG1 ASP 373.A OD2 no hydrogen 3.047 N/A TYR 334.A N VAL 330.A O no hydrogen 2.875 N/A ASN 335.A N THR 331.A O no hydrogen 2.956 N/A THR 336.A N PRO 332.A O no hydrogen 2.897 N/A THR 336.A OG1 PRO 332.A O no hydrogen 2.318 N/A TYR 337.A N MET 333.A O no hydrogen 2.849 N/A ARG 338.A N TYR 334.A O no hydrogen 2.953 N/A ALA 339.A N ASN 335.A O no hydrogen 2.887 N/A SER 340.A N THR 336.A O no hydrogen 2.888 N/A SER 340.A N TYR 337.A O no hydrogen 3.101 N/A GLN 341.A N ARG 338.A O no hydrogen 3.093 N/A LYS 343.A N GLN 341.A O no hydrogen 2.650 N/A LYS 343.A NZ SER 340.A O no hydrogen 2.361 N/A LYS 343.A NZ GLN 341.A O no hydrogen 2.656 N/A PHE 344.A N ASP 347.A OD2 no hydrogen 3.136 N/A ASP 347.A N PHE 344.A O no hydrogen 3.195 N/A VAL 350.A N ASP 348.A OD1 no hydrogen 3.060 N/A ARG 353.A N GLY 349.A O no hydrogen 2.932 N/A ARG 353.A NH2 GLU 313.A OE1 no hydrogen 3.400 N/A ALA 354.A N VAL 350.A O no hydrogen 2.894 N/A GLU 355.A N LEU 351.A O no hydrogen 2.845 N/A VAL 356.A N GLY 352.A O no hydrogen 2.937 N/A PHE 357.A N ARG 353.A O no hydrogen 2.967 N/A CYS 358.A N ALA 354.A O no hydrogen 2.839 N/A CYS 358.A SG MET 333.A O no hydrogen 2.959 N/A ARG 359.A N GLU 355.A O no hydrogen 2.888 N/A SER 360.A N VAL 356.A O no hydrogen 2.950 N/A SER 360.A OG VAL 356.A O no hydrogen 2.817 N/A SER 360.A OG PHE 357.A O no hydrogen 2.384 N/A PHE 361.A N PHE 357.A O no hydrogen 2.911 N/A LEU 362.A N CYS 358.A O no hydrogen 2.870 N/A LEU 362.A N ARG 359.A O no hydrogen 3.238 N/A GLN 363.A N ARG 359.A O no hydrogen 2.916 N/A ARG 366.A N GLN 363.A O no hydrogen 3.283 N/A ARG 366.A NH1 ASP 390.A OD1 no hydrogen 3.338 N/A GLY 367.A N ASP 364.A O no hydrogen 3.404 N/A SER 368.A N ARG 365.A O no hydrogen 3.363 N/A SER 368.A OG ARG 365.A O no hydrogen 3.009 N/A ARG 370.A NH1 SER 368.A OG no hydrogen 2.430 N/A LYS 374.A NZ PRO 327.A O no hydrogen 2.935 N/A LYS 374.A NZ SER 328.A O no hydrogen 2.633 N/A TRP 375.A N ASP 373.A OD1 no hydrogen 2.357 N/A ILE 377.A N VAL 415.A O no hydrogen 3.228 N/A LYS 379.A NZ TYR 409.A O no hydrogen 2.724 N/A GLY 383.A N ASP 380.A OD1 no hydrogen 3.005 N/A VAL 385.A N ILE 381.A O no hydrogen 2.955 N/A GLU 386.A N PRO 382.A O no hydrogen 2.845 N/A TYR 387.A N GLY 383.A O no hydrogen 2.946 N/A TYR 387.A OH GLU 401.A OE2 no hydrogen 2.872 N/A ALA 388.A N GLU 384.A O no hydrogen 2.937 N/A MET 389.A N VAL 385.A O no hydrogen 2.899 N/A ASP 390.A N TYR 387.A O no hydrogen 2.934 N/A TYR 391.A N TYR 387.A O no hydrogen 2.925 N/A ALA 395.A N PRO 392.A O no hydrogen 2.994 N/A SER 396.A OG PRO 392.A O no hydrogen 2.838 N/A SER 396.A OG TRP 393.A O no hydrogen 2.354 N/A GLU 401.A N LEU 397.A O no hydrogen 3.322 N/A THR 402.A N PRO 398.A O no hydrogen 2.920 N/A THR 402.A OG1 ARG 249.A O no hydrogen 3.383 N/A ARG 403.A N ARG 399.A O no hydrogen 2.878 N/A ARG 403.A NH1 ARG 403.A O no hydrogen 3.318 N/A LEU 404.A N ILE 400.A O no hydrogen 2.908 N/A TYR 405.A N GLU 401.A O no hydrogen 2.872 N/A LEU 406.A N THR 402.A O no hydrogen 2.916 N/A LEU 406.A N ARG 403.A O no hydrogen 3.173 N/A ASP 407.A N LEU 404.A O no hydrogen 3.201 N/A GLN 408.A N TYR 405.A O no hydrogen 2.841 N/A TYR 409.A N TYR 405.A O no hydrogen 2.947 N/A TYR 409.A OH PHE 427.A O no hydrogen 3.027 N/A TYR 409.A OH ASN 429.A O no hydrogen 2.970 N/A SER 412.A OG ASP 430.A OD2 no hydrogen 2.593 N/A VAL 415.A N ILE 377.A O no hydrogen 3.417 N/A TRP 416.A N HIS 422.A O no hydrogen 2.802 N/A ILE 417.A N TRP 375.A O no hydrogen 3.047 N/A LYS 419.A NZ HIS 172.A O no hydrogen 3.174 N/A LYS 419.A NZ SER 173.A OG no hydrogen 3.332 N/A LEU 421.A N ASP 71.A OD2 no hydrogen 2.448 N/A HIS 422.A N TRP 416.A O no hydrogen 3.007 N/A ARG 423.A N SER 21.A OG no hydrogen 2.582 N/A ARG 423.A NH1 ASP 63.A OD2 no hydrogen 3.304 N/A THR 425.A N GLU 19.A OE1 no hydrogen 2.705 N/A THR 425.A OG1 GLU 19.A OE2 no hydrogen 2.407 N/A LEU 426.A N GLU 19.A OE1 no hydrogen 2.285 N/A CYS 428.A SG ASP 414.A OD1 no hydrogen 3.673 N/A LEU 431.A N ASN 429.A OD1 no hydrogen 2.429 N/A TYR 432.A OH LEU 426.A O no hydrogen 2.535 N/A LEU 433.A N ASP 430.A O no hydrogen 2.965 N/A LYS 434.A NZ ASP 430.A O no hydrogen 2.374 N/A ALA 435.A N LEU 431.A O no hydrogen 2.983 N/A ALA 436.A N TYR 432.A O no hydrogen 2.963 N/A LYS 437.A N LEU 433.A O no hydrogen 2.871 N/A ALA 438.A N LYS 434.A O no hydrogen 2.945 N/A ASP 439.A N ALA 435.A O no hydrogen 2.974 N/A PHE 440.A N ALA 436.A O no hydrogen 2.898 N/A SER 441.A N LYS 437.A O no hydrogen 2.882 N/A SER 441.A OG LYS 437.A O no hydrogen 2.339 N/A SER 441.A OG ALA 438.A O no hydrogen 2.742 N/A ASN 442.A N ALA 438.A O no hydrogen 3.035 N/A PHE 443.A N ASP 439.A O no hydrogen 2.952 N/A GLN 444.A N PHE 440.A O no hydrogen 2.885 N/A GLN 444.A NE2 VAL 682.A O no hydrogen 2.341 N/A GLN 444.A NE2 GLN 685.A O no hydrogen 3.170 N/A LYS 445.A N SER 441.A O no hydrogen 2.962 N/A GLU 446.A N ASN 442.A O no hydrogen 2.945 N/A CYS 447.A N PHE 443.A O no hydrogen 2.987 N/A CYS 447.A SG PHE 443.A O no hydrogen 3.033 N/A ARG 448.A N GLN 444.A O no hydrogen 2.939 N/A GLU 450.A N GLU 446.A O no hydrogen 3.064 N/A LEU 451.A N CYS 447.A O no hydrogen 2.919 N/A GLY 453.A N VAL 449.A O no hydrogen 3.037 N/A LEU 454.A N GLU 450.A O no hydrogen 2.939 N/A ARG 455.A N LEU 451.A O no hydrogen 2.871 N/A ARG 456.A N ASN 452.A O no hydrogen 2.966 N/A TRP 457.A N GLY 453.A O no hydrogen 3.020 N/A TYR 458.A N LEU 454.A O no hydrogen 2.889 N/A LEU 459.A N ARG 455.A O no hydrogen 2.947 N/A ARG 460.A N ARG 456.A O no hydrogen 2.929 N/A SER 461.A N TRP 457.A O no hydrogen 3.306 N/A SER 461.A OG TRP 457.A O no hydrogen 2.804 N/A ASN 462.A N LEU 459.A O no hydrogen 3.236 N/A GLU 464.A N GLU 464.A OE1 no hydrogen 2.294 N/A LYS 465.A N ASN 462.A O no hydrogen 2.994 N/A LYS 465.A NZ SER 461.A O no hydrogen 2.998 N/A LYS 465.A NZ ASN 462.A O no hydrogen 2.531 N/A PHE 466.A N LEU 463.A O no hydrogen 3.274 N/A THR 469.A OG1 ASP 470.A OD2 no hydrogen 3.429 N/A THR 473.A N ASP 470.A OD1 no hydrogen 3.072 N/A THR 473.A OG1 ASP 470.A OD2 no hydrogen 3.110 N/A LEU 475.A N PRO 471.A O no hydrogen 2.884 N/A MET 476.A N GLN 472.A O no hydrogen 2.921 N/A THR 477.A N THR 473.A O no hydrogen 2.889 N/A THR 477.A OG1 THR 473.A O no hydrogen 3.411 N/A THR 477.A OG1 THR 474.A O no hydrogen 2.505 N/A SER 478.A N THR 474.A O no hydrogen 2.883 N/A SER 478.A OG THR 474.A O no hydrogen 2.979 N/A SER 478.A OG LEU 475.A O no hydrogen 2.544 N/A TYR 479.A N LEU 475.A O no hydrogen 2.949 N/A TYR 479.A OH GLU 450.A OE2 no hydrogen 2.256 N/A PHE 480.A N MET 476.A O no hydrogen 2.861 N/A LEU 481.A N THR 477.A O no hydrogen 2.923 N/A ALA 482.A N SER 478.A O no hydrogen 3.277 N/A SER 483.A N TYR 479.A O no hydrogen 2.923 N/A SER 483.A OG TYR 479.A O no hydrogen 2.811 N/A SER 483.A OG PHE 480.A O no hydrogen 2.873 N/A ALA 484.A N PHE 480.A O no hydrogen 2.904 N/A ASN 485.A N ALA 482.A O no hydrogen 3.012 N/A ASN 485.A ND2 LEU 481.A O no hydrogen 3.020 N/A ILE 486.A N ALA 482.A O no hydrogen 3.313 N/A PHE 487.A N GLU 488.A OE2 no hydrogen 2.670 N/A GLU 488.A N GLU 488.A OE2 no hydrogen 2.454 N/A ARG 491.A N GLU 488.A O no hydrogen 3.248 N/A ALA 492.A N ALA 489.A O no hydrogen 3.245 N/A ARG 495.A N ARG 491.A O no hydrogen 2.972 N/A ARG 495.A NH1 GLU 450.A OE2 no hydrogen 2.974 N/A LEU 496.A N ALA 492.A O no hydrogen 2.861 N/A GLY 497.A N ALA 493.A O no hydrogen 2.962 N/A TRP 498.A N GLU 494.A O no hydrogen 2.884 N/A ALA 499.A N ARG 495.A O no hydrogen 2.994 N/A ARG 500.A N LEU 496.A O no hydrogen 2.867 N/A VAL 501.A N GLY 497.A O no hydrogen 2.988 N/A ALA 502.A N TRP 498.A O no hydrogen 2.943 N/A LEU 503.A N ALA 499.A O no hydrogen 2.971 N/A LEU 504.A N ARG 500.A O no hydrogen 2.916 N/A ALA 505.A N VAL 501.A O no hydrogen 2.922 N/A ASP 506.A N ALA 502.A O no hydrogen 2.965 N/A ALA 507.A N LEU 503.A O no hydrogen 2.950 N/A VAL 508.A N LEU 504.A O no hydrogen 2.990 N/A SER 509.A N ALA 505.A O no hydrogen 2.911 N/A SER 509.A OG ALA 505.A O no hydrogen 2.966 N/A SER 509.A OG ASP 506.A O no hydrogen 2.461 N/A SER 510.A N ASP 506.A O no hydrogen 2.956 N/A SER 510.A OG GLY 467.A O no hydrogen 3.300 N/A SER 510.A OG ALA 507.A O no hydrogen 3.153 N/A HIS 511.A N ALA 507.A O no hydrogen 2.929 N/A PHE 512.A N VAL 508.A O no hydrogen 2.879 N/A ARG 513.A N SER 509.A O no hydrogen 2.950 N/A ARG 514.A N SER 510.A O no hydrogen 2.939 N/A ARG 514.A NH2 GLY 467.A O no hydrogen 3.436 N/A ILE 515.A N HIS 511.A O no hydrogen 3.132 N/A GLY 516.A N PHE 512.A O no hydrogen 3.020 N/A GLY 516.A N ARG 513.A O no hydrogen 3.284 N/A LYS 519.A NZ GLU 557.A OE2 no hydrogen 2.418 N/A ASN 520.A N GLY 517.A O no hydrogen 3.039 N/A ASN 520.A ND2 ILE 515.A O no hydrogen 2.267 N/A SER 521.A N PRO 518.A O no hydrogen 3.197 N/A GLU 527.A N ASN 524.A O no hydrogen 3.337 N/A LEU 528.A N LEU 525.A O no hydrogen 2.769 N/A SER 530.A N GLU 527.A O no hydrogen 2.896 N/A LEU 531.A N LEU 528.A O no hydrogen 3.276 N/A VAL 532.A N ILE 529.A O no hydrogen 3.185 N/A ARG 543.A N SER 539.A O no hydrogen 3.233 N/A GLU 544.A N GLY 540.A O no hydrogen 2.945 N/A ALA 545.A N SER 541.A O no hydrogen 2.955 N/A TRP 546.A N LEU 542.A O no hydrogen 2.849 N/A TRP 546.A NE1 LEU 525.A O no hydrogen 2.981 N/A LYS 547.A N ARG 543.A O no hydrogen 2.941 N/A GLN 548.A N GLU 544.A O no hydrogen 2.953 N/A TRP 549.A N ALA 545.A O no hydrogen 2.929 N/A LEU 550.A N TRP 546.A O no hydrogen 2.933 N/A MET 551.A N LYS 547.A O no hydrogen 2.917 N/A ALA 552.A N GLN 548.A O no hydrogen 2.949 N/A TRP 553.A N TRP 549.A O no hydrogen 2.917 N/A THR 554.A N LEU 550.A O no hydrogen 2.919 N/A THR 554.A OG1 MET 551.A O no hydrogen 2.213 N/A ALA 555.A N MET 551.A O no hydrogen 2.937 N/A LYS 556.A N ALA 552.A O no hydrogen 2.888 N/A LYS 556.A NZ ASP 566.A OD2 no hydrogen 2.617 N/A GLU 557.A N THR 554.A O no hydrogen 3.291 N/A SER 558.A OG GLU 557.A O no hydrogen 2.515 N/A SER 559.A OG LYS 556.A O no hydrogen 2.812 N/A SER 559.A OG GLU 561.A OE1 no hydrogen 2.403 N/A GLU 561.A N SER 559.A OG no hydrogen 3.373 N/A SER 562.A OG SER 609.A OG no hydrogen 3.140 N/A THR 567.A OG1 GLU 564.A O no hydrogen 2.228 N/A ALA 568.A N GLU 564.A O no hydrogen 2.939 N/A ILE 569.A N GLY 565.A O no hydrogen 2.862 N/A LEU 570.A N ASP 566.A O no hydrogen 2.913 N/A LEU 571.A N THR 567.A O no hydrogen 2.873 N/A VAL 572.A N ALA 568.A O no hydrogen 2.943 N/A ARG 573.A N ILE 569.A O no hydrogen 2.973 N/A ALA 574.A N LEU 570.A O no hydrogen 2.917 N/A ILE 575.A N LEU 571.A O no hydrogen 2.880 N/A GLU 576.A N VAL 572.A O no hydrogen 2.917 N/A ILE 577.A N ARG 573.A O no hydrogen 2.929 N/A PHE 578.A N ALA 574.A O no hydrogen 2.916 N/A GLY 579.A N ILE 575.A O no hydrogen 2.870 N/A GLY 580.A N ILE 577.A O no hydrogen 2.810 N/A THR 585.A OG1 GLN 587.A OE1 no hydrogen 2.987 N/A GLN 587.A N GLN 587.A OE1 no hydrogen 2.498 N/A ASP 590.A N GLN 587.A O no hydrogen 2.768 N/A TRP 592.A N ARG 588.A O no hydrogen 2.982 N/A GLU 593.A N PRO 589.A O no hydrogen 2.908 N/A TYR 594.A N ASP 590.A O no hydrogen 2.941 N/A SER 595.A N LEU 591.A O no hydrogen 2.901 N/A GLN 596.A N TRP 592.A O no hydrogen 2.946 N/A LEU 597.A N GLU 593.A O no hydrogen 2.952 N/A GLU 598.A N TYR 594.A O no hydrogen 3.004 N/A GLN 599.A N SER 595.A O no hydrogen 2.906 N/A LEU 600.A N GLN 596.A O no hydrogen 2.988 N/A THR 601.A N LEU 597.A O no hydrogen 2.983 N/A THR 601.A OG1 LEU 597.A O no hydrogen 2.960 N/A THR 601.A OG1 GLU 598.A O no hydrogen 2.408 N/A SER 602.A N GLU 598.A O no hydrogen 3.008 N/A SER 602.A OG GLU 598.A O no hydrogen 2.715 N/A SER 602.A OG GLN 599.A O no hydrogen 2.790 N/A SER 603.A N GLN 599.A O no hydrogen 2.981 N/A SER 603.A OG GLN 599.A O no hydrogen 2.957 N/A SER 603.A OG LEU 600.A O no hydrogen 2.560 N/A ILE 604.A N LEU 600.A O no hydrogen 2.966 N/A CYS 605.A N THR 601.A O no hydrogen 2.983 N/A CYS 605.A SG THR 601.A O no hydrogen 3.212 N/A CYS 606.A N SER 602.A O no hydrogen 3.030 N/A LYS 607.A N SER 603.A O no hydrogen 2.960 N/A LEU 608.A N ILE 604.A O no hydrogen 2.991 N/A SER 609.A N CYS 605.A O no hydrogen 2.965 N/A SER 609.A OG SER 562.A OG no hydrogen 3.140 N/A SER 609.A OG CYS 606.A O no hydrogen 3.059 N/A ARG 610.A N CYS 606.A O no hydrogen 2.988 N/A ARG 611.A N LYS 607.A O no hydrogen 2.953 N/A VAL 612.A N LEU 608.A O no hydrogen 2.937 N/A LEU 613.A N SER 609.A O no hydrogen 2.918 N/A ALA 614.A N ARG 610.A O no hydrogen 2.946 N/A GLN 615.A N ARG 611.A O no hydrogen 2.820 N/A GLN 615.A NE2 GLN 615.A O no hydrogen 2.602 N/A GLU 616.A N VAL 612.A O no hydrogen 3.040 N/A ASN 617.A N ALA 614.A O no hydrogen 2.961 N/A LYS 623.A N SER 620.A O no hydrogen 3.013 N/A LYS 623.A NZ GLU 622.A OE2 no hydrogen 3.232 N/A GLU 625.A N THR 621.A O no hydrogen 2.908 N/A GLU 626.A N GLU 622.A O no hydrogen 2.893 N/A ILE 627.A N LYS 623.A O no hydrogen 2.913 N/A ASP 628.A N VAL 624.A O no hydrogen 2.850 N/A GLN 629.A N GLU 625.A O no hydrogen 2.937 N/A GLN 630.A N GLU 626.A O no hydrogen 2.950 N/A VAL 631.A N ILE 627.A O no hydrogen 2.897 N/A ASP 632.A N ASP 628.A O no hydrogen 2.888 N/A LEU 633.A N GLN 629.A O no hydrogen 3.057 N/A GLU 634.A N GLU 634.A OE2 no hydrogen 2.290 N/A MET 635.A N VAL 631.A O no hydrogen 2.865 N/A GLN 636.A N ASP 632.A O no hydrogen 2.947 N/A GLN 636.A NE2 ASP 632.A O no hydrogen 3.096 N/A GLU 637.A N LEU 633.A O no hydrogen 3.002 N/A LEU 638.A N GLU 634.A O no hydrogen 2.850 N/A THR 639.A N MET 635.A O no hydrogen 2.966 N/A THR 639.A OG1 MET 635.A O no hydrogen 3.268 N/A THR 639.A OG1 GLN 636.A O no hydrogen 2.289 N/A ARG 640.A N GLN 636.A O no hydrogen 2.940 N/A ARG 640.A NH1 GLU 637.A OE1 no hydrogen 3.258 N/A ARG 641.A N GLU 637.A O no hydrogen 2.994 N/A VAL 642.A N LEU 638.A O no hydrogen 2.917 N/A LEU 643.A N THR 639.A O no hydrogen 2.952 N/A LEU 643.A N ARG 640.A O no hydrogen 3.315 N/A GLN 644.A NE2 ARG 640.A O no hydrogen 3.588 N/A CYS 646.A SG GLN 644.A OE1 no hydrogen 3.178 N/A SER 647.A N GLN 644.A O no hydrogen 3.116 N/A SER 647.A OG GLU 593.A OE2 no hydrogen 3.550 N/A SER 647.A OG ILE 649.A O no hydrogen 3.317 N/A ILE 649.A N SER 647.A OG no hydrogen 2.885 N/A ARG 651.A N ASN 650.A OD1 no hydrogen 2.300 N/A THR 653.A OG1 ASN 650.A O no hydrogen 2.654 N/A ARG 654.A N ARG 651.A O no hydrogen 2.605 N/A ARG 654.A NE VAL 642.A O no hydrogen 3.282 N/A ARG 654.A NH1 ILE 649.A O no hydrogen 2.424 N/A GLU 655.A N ARG 651.A O no hydrogen 2.930 N/A THR 656.A N LEU 652.A O no hydrogen 2.989 N/A THR 656.A OG1 LEU 652.A O no hydrogen 2.978 N/A PHE 657.A N ARG 654.A O no hydrogen 3.022 N/A HIS 659.A N GLU 655.A O no hydrogen 2.915 N/A VAL 660.A N THR 656.A O no hydrogen 3.021 N/A VAL 661.A N PHE 657.A O no hydrogen 2.960 N/A LYS 662.A N LEU 658.A O no hydrogen 2.881 N/A SER 663.A N HIS 659.A O no hydrogen 2.961 N/A PHE 664.A N VAL 660.A O no hydrogen 2.994 N/A CYS 665.A N VAL 661.A O no hydrogen 2.909 N/A CYS 665.A SG VAL 661.A O no hydrogen 2.983 N/A TYR 666.A N LYS 662.A O no hydrogen 2.907 N/A TYR 666.A OH HIS 678.A ND1 no hydrogen 3.104 N/A VAL 667.A N SER 663.A O no hydrogen 2.962 N/A ALA 668.A N PHE 664.A O no hydrogen 2.937 N/A TYR 669.A N TYR 666.A O no hydrogen 2.761 N/A CYS 670.A SG TYR 666.A O no hydrogen 3.047 N/A GLU 673.A N GLU 673.A OE1 no hydrogen 2.370 N/A THR 674.A N SER 671.A O no hydrogen 3.016 N/A THR 674.A OG1 SER 671.A O no hydrogen 2.892 N/A ILE 675.A N SER 671.A O no hydrogen 3.345 N/A ASP 676.A N PRO 672.A O no hydrogen 2.892 N/A SER 677.A N ASP 676.A OD1 no hydrogen 2.508 N/A SER 677.A OG THR 674.A O no hydrogen 2.249 N/A HIS 678.A N THR 674.A O no hydrogen 2.921 N/A HIS 678.A ND1 TYR 666.A OH no hydrogen 3.104 N/A ILE 679.A N ILE 675.A O no hydrogen 2.856 N/A ASP 680.A N ASP 676.A O no hydrogen 2.922 N/A LYS 681.A N SER 677.A O no hydrogen 2.960 N/A LYS 681.A NZ GLN 685.A OE1 no hydrogen 3.502 N/A VAL 682.A N HIS 678.A O no hydrogen 2.878 N/A ILE 683.A N ILE 679.A O no hydrogen 2.935 N/A GLN 685.A N ASP 680.A O no hydrogen 2.719 N/A