Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8v1r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 6.A ND1 TYR 8.A OH no hydrogen 2.797 N/A THR 7.A N ASN 435.A O no hydrogen 2.604 N/A TYR 8.A OH HIS 6.A ND1 no hydrogen 2.797 N/A TYR 9.A N TYR 431.A OH no hydrogen 3.114 N/A SER 10.A OG GLU 11.A OE1 no hydrogen 3.055 N/A CYS 12.A SG GLU 14.A O no hydrogen 3.372 N/A PHE 15.A N LEU 40.A O no hydrogen 2.895 N/A ARG 16.A NE ASP 37.A OD1 no hydrogen 3.432 N/A ARG 16.A NH1 ILE 423.A O no hydrogen 3.022 N/A PHE 17.A N GLY 38.A O no hydrogen 3.075 N/A ARG 21.A N GLY 34.A O no hydrogen 3.135 N/A ARG 21.A NH1 ALA 33.A O no hydrogen 3.482 N/A ASP 24.A N ARG 21.A O no hydrogen 3.198 N/A ALA 27.A N GLU 25.A O no hydrogen 3.124 N/A LYS 31.A N PRO 28.A O no hydrogen 3.016 N/A HIS 36.A N ALA 19.A O no hydrogen 2.593 N/A HIS 36.A NE2 ASP 24.A OD2 no hydrogen 2.878 N/A GLY 38.A N ASP 37.A OD1 no hydrogen 2.835 N/A LEU 40.A N PHE 15.A O no hydrogen 2.841 N/A LYS 41.A NZ.B GLU 14.A OE2 no hydrogen 3.212 N/A ARG 42.A NH1 ALA 43.A O no hydrogen 3.100 N/A ARG 42.A NH2 GLU 386.A OE1 no hydrogen 3.551 N/A ARG 42.A NH2 GLU 386.A OE2 no hydrogen 2.513 N/A LYS 45.A NZ.A ALA 43.A O no hydrogen 2.696 N/A LYS 45.A NZ.A ASP 54.A OD1 no hydrogen 2.596 N/A LYS 45.A NZ.B TYR 47.A OH no hydrogen 2.823 N/A LYS 45.A NZ.B GLU 52.A OE2 no hydrogen 3.182 N/A VAL 46.A N ARG 53.A O no hydrogen 2.878 N/A TYR 47.A N GLU 380.A O no hydrogen 2.900 N/A TYR 47.A OH ASP 382.A OD2 no hydrogen 2.989 N/A CYS 48.A SG VAL 378.A O no hydrogen 3.754 N/A GLU 52.A N ASP 51.A OD1 no hydrogen 2.707 N/A ARG 53.A N VAL 46.A O no hydrogen 3.063 N/A ARG 53.A NH1 ARG 57.A O no hydrogen 3.207 N/A ARG 53.A NH2 ARG 57.A O no hydrogen 2.995 N/A ARG 53.A NH2 VAL 58.A O no hydrogen 3.207 N/A VAL 55.A N PRO 44.A O no hydrogen 2.741 N/A ARG 57.A N ASP 54.A O no hydrogen 3.479 N/A TRP 64.A NE1 GLN 397.A OE1 no hydrogen 2.601 N/A ARG 66.A NH2 SER 60.A O no hydrogen 3.313 N/A ARG 67.A N GLN 397.A O no hydrogen 3.165 N/A ARG 67.A NE TYR 398.A O no hydrogen 2.914 N/A ARG 67.A NH1 GLU 401.A OE1 no hydrogen 3.490 N/A ARG 67.A NH1 GLU 401.A OE2 no hydrogen 3.079 N/A ARG 67.A NH2 TYR 398.A O no hydrogen 2.946 N/A ARG 67.A NH2 GLU 401.A OE1 no hydrogen 2.876 N/A ARG 67.A NH2 GLU 401.A OE2 no hydrogen 3.318 N/A TRP 71.A N VAL 74.A O no hydrogen 3.029 N/A GLY 72.A N TYR 8.A OH no hydrogen 3.398 N/A HIS 76.A N ARG 69.A O no hydrogen 2.906 N/A ALA 77.A N ASP 75.A OD1 no hydrogen 3.397 N/A PHE 88.A N TYR 257.A O no hydrogen 3.441 N/A HIS 89.A ND1 TYR 303.A OH no hydrogen 2.881 N/A VAL 90.A N GLY 255.A O no hydrogen 2.873 N/A TYR 91.A N LEU 126.A O no hydrogen 3.009 N/A TYR 91.A OH GLY 460.A O no hydrogen 2.788 N/A ILE 93.A N ASP 92.A OD1 no hydrogen 3.250 N/A LEU 94.A N THR 124.A O no hydrogen 2.766 N/A ASN 96.A N VAL 122.A O no hydrogen 3.143 N/A ASN 96.A ND2 VAL 97.A O no hydrogen 3.610 N/A GLU 98.A N GLY 120.A O no hydrogen 3.023 N/A HIS 99.A ND1 PRO 118.A O no hydrogen 3.316 N/A ALA 100.A N ILE 116.A O no hydrogen 3.193 N/A GLY 102.A N HIS 99.A O no hydrogen 2.883 N/A MET 103.A N HIS 99.A O no hydrogen 3.198 N/A ARG 111.A NH1 THR 287.A OG1 no hydrogen 3.014 N/A ARG 111.A NH2 LEU 267.A O no hydrogen 3.001 N/A ARG 111.A NH2 ASN 290.A OD1 no hydrogen 2.700 N/A MET 113.A N HIS 109.A O no hydrogen 3.449 N/A ASP 114.A N ALA 110.A O no hydrogen 2.853 N/A ILE 116.A N MET 113.A O no hydrogen 3.136 N/A THR 117.A OG1 ASP 114.A O no hydrogen 3.453 N/A THR 119.A OG1 HIS 99.A ND1 no hydrogen 2.906 N/A GLY 120.A N GLU 98.A O no hydrogen 3.115 N/A VAL 122.A N ASN 96.A O no hydrogen 3.084 N/A ILE 123.A N VAL 139.A O no hydrogen 3.044 N/A THR 124.A N LEU 94.A O no hydrogen 2.899 N/A THR 124.A OG1 ASN 96.A OD1 no hydrogen 3.220 N/A THR 124.A OG1 HIS 138.A ND1 no hydrogen 3.398 N/A LEU 125.A N VAL 137.A O no hydrogen 2.792 N/A LEU 126.A N ASP 92.A O no hydrogen 2.887 N/A GLY 127.A N VAL 135.A O no hydrogen 3.103 N/A LEU 128.A N HIS 89.A O no hydrogen 3.045 N/A THR 129.A N HIS 133.A O no hydrogen 2.938 N/A THR 129.A OG1 HIS 133.A O no hydrogen 3.463 N/A GLY 132.A N THR 129.A O no hydrogen 3.088 N/A HIS 133.A N THR 129.A OG1 no hydrogen 2.877 N/A ARG 134.A N ASP 281.A OD2 no hydrogen 2.855 N/A ARG 134.A NH1 SER 279.A O no hydrogen 3.105 N/A VAL 135.A N GLY 127.A O no hydrogen 2.768 N/A ALA 136.A N VAL 282.A O no hydrogen 3.261 N/A VAL 137.A N LEU 125.A O no hydrogen 2.937 N/A HIS 138.A N PHE 284.A O no hydrogen 2.838 N/A HIS 138.A NE2 GLU 283.A OE1 no hydrogen 2.829 N/A VAL 139.A N ILE 123.A O no hydrogen 2.871 N/A TYR 140.A N CYS 286.A O no hydrogen 3.193 N/A GLN 144.A NE2 VAL 238.A O no hydrogen 3.527 N/A TYR 145.A OH ASP 247.A OD1 no hydrogen 3.098 N/A PHE 146.A N VAL 212.A O no hydrogen 3.084 N/A MET 148.A N TYR 210.A O no hydrogen 3.013 N/A LYS 150.A N LEU 208.A O no hydrogen 2.670 N/A LYS 150.A NZ TYR 210.A OH no hydrogen 3.052 N/A GLU 151.A N ASN 149.A OD1 no hydrogen 3.241 N/A VAL 153.A N ASN 149.A O no hydrogen 2.987 N/A ASP 154.A N LYS 150.A O no hydrogen 2.865 N/A ARG 155.A N GLU 151.A O no hydrogen 2.907 N/A HIS 156.A N GLU 152.A O no hydrogen 3.025 N/A LEU 157.A N VAL 153.A O no hydrogen 3.131 N/A GLN 158.A N GLN 158.A OE1 no hydrogen 2.673 N/A CYS 159.A SG LEU 157.A O no hydrogen 3.176 N/A CYS 159.A SG ASP 164.A OD2 no hydrogen 3.604 N/A LEU 165.A N PRO 162.A O no hydrogen 2.713 N/A CYS 166.A N PRO 162.A O no hydrogen 2.872 N/A CYS 166.A SG PRO 162.A O no hydrogen 3.536 N/A CYS 166.A SG PHE 189.A O no hydrogen 2.913 N/A GLU 167.A N ARG 163.A O no hydrogen 2.896 N/A ARG 168.A N.A ASP 164.A O no hydrogen 2.986 N/A ARG 168.A N.B ASP 164.A O no hydrogen 2.982 N/A MET 169.A N LEU 165.A O no hydrogen 2.869 N/A ALA 170.A N CYS 166.A O no hydrogen 2.958 N/A ALA 171.A N GLU 167.A O no hydrogen 2.758 N/A ALA 172.A N ARG 168.A O.A no hydrogen 2.904 N/A ALA 172.A N ARG 168.A O.B no hydrogen 2.916 N/A LEU 173.A N MET 169.A O no hydrogen 3.083 N/A ARG 174.A N ALA 170.A O no hydrogen 2.931 N/A ARG 174.A NH1 ILE 184.A O no hydrogen 2.960 N/A SER 176.A N LEU 173.A O no hydrogen 3.207 N/A SER 176.A OG LEU 173.A O no hydrogen 3.331 N/A SER 176.A OG GLY 178.A O no hydrogen 3.135 N/A SER 180.A OG GLY 178.A O no hydrogen 3.067 N/A ILE 184.A N PHE 181.A O no hydrogen 3.291 N/A SER 185.A OG ASP 187.A OD1 no hydrogen 2.351 N/A GLU 192.A N ARG 211.A O no hydrogen 2.975 N/A VAL 194.A N PHE 209.A O no hydrogen 2.914 N/A THR 197.A N GLY 574.A O no hydrogen 3.312 N/A THR 197.A OG1 GLY 574.A O no hydrogen 3.237 N/A TYR 200.A N ASP 198.A OD1 no hydrogen 2.792 N/A TYR 200.A OH PRO 724.A O no hydrogen 2.435 N/A TYR 202.A N LEU 631.A O no hydrogen 2.783 N/A GLU 203.A N GLU 203.A OE1 no hydrogen 2.698 N/A THR 204.A OG1 TYR 200.A O no hydrogen 3.421 N/A PHE 209.A N VAL 194.A O no hydrogen 2.772 N/A TYR 210.A N MET 148.A O no hydrogen 2.823 N/A TYR 210.A OH ASP 154.A OD1 no hydrogen 2.516 N/A ARG 211.A N GLU 192.A O no hydrogen 2.793 N/A ARG 211.A NH2 GLU 192.A OE2 no hydrogen 3.089 N/A VAL 212.A N PHE 146.A O no hydrogen 2.904 N/A TYR 213.A N GLU 190.A O no hydrogen 2.816 N/A ARG 215.A NH1 THR 117.A OG1 no hydrogen 3.136 N/A VAL 219.A N SER 216.A O no hydrogen 2.668 N/A SER 221.A N GLY 217.A O no hydrogen 3.025 N/A SER 221.A OG ARG 218.A O no hydrogen 2.851 N/A TYR 222.A N ARG 218.A O no hydrogen 3.017 N/A LEU 223.A N VAL 219.A O no hydrogen 2.814 N/A ASP 225.A N SER 221.A O no hydrogen 3.027 N/A ASN 226.A N TYR 222.A O no hydrogen 2.690 N/A ILE 231.A N CYS 228.A O no hydrogen 2.866 N/A LYS 232.A NZ ASP 198.A OD2 no hydrogen 3.545 N/A LYS 232.A NZ TYR 234.A OH no hydrogen 3.376 N/A LYS 233.A NZ PHE 227.A O no hydrogen 3.368 N/A LYS 233.A NZ CYS 228.A O no hydrogen 3.291 N/A LYS 233.A NZ ILE 231.A O no hydrogen 2.921 N/A TYR 234.A N TYR 147.A O no hydrogen 2.851 N/A GLY 236.A N ASP 579.A OD2 no hydrogen 3.187 N/A THR 242.A N ASP 239.A OD1 no hydrogen 3.207 N/A THR 242.A OG1 ASP 239.A OD1 no hydrogen 2.822 N/A ARG 243.A N ASP 239.A O no hydrogen 3.211 N/A ARG 243.A NH1 GLU 235.A OE1 no hydrogen 3.331 N/A ARG 243.A NH2 TYR 145.A O no hydrogen 3.159 N/A ARG 243.A NH2 GLU 235.A OE1 no hydrogen 2.851 N/A PHE 244.A N ALA 240.A O no hydrogen 2.918 N/A PHE 244.A N THR 241.A O no hydrogen 3.000 N/A ILE 245.A N THR 241.A O no hydrogen 2.908 N/A LEU 246.A N THR 242.A O no hydrogen 2.899 N/A ASP 247.A N ARG 243.A O no hydrogen 2.953 N/A ASN 248.A ND2 PHE 244.A O no hydrogen 2.669 N/A PHE 251.A N ASN 248.A O no hydrogen 3.366 N/A VAL 252.A N TYR 257.A OH no hydrogen 2.985 N/A THR 253.A OG1 ALA 543.A O no hydrogen 3.184 N/A THR 253.A OG1 ILE 548.A O no hydrogen 2.425 N/A GLY 255.A N VAL 90.A O no hydrogen 2.967 N/A TRP 256.A NE1 ASP 299.A O no hydrogen 2.418 N/A TYR 257.A N PHE 88.A O no hydrogen 2.981 N/A TYR 257.A OH VAL 252.A O no hydrogen 2.433 N/A ARG 258.A NH2 GLU 294.A OE2 no hydrogen 2.472 N/A LEU 259.A N THR 86.A O no hydrogen 3.396 N/A LYS 260.A N ASN 290.A O no hydrogen 2.917 N/A ARG 263.A N ASP 289.A OD2 no hydrogen 2.965 N/A ARG 271.A N GLU 283.A O no hydrogen 2.982 N/A ARG 271.A NE ASN 285.A OD1 no hydrogen 2.740 N/A ARG 271.A NH1 ALA 275.A O no hydrogen 2.907 N/A ARG 271.A NH2 ASN 285.A OD1 no hydrogen 3.285 N/A ALA 275.A N ALA 272.A O no hydrogen 2.696 N/A GLY 277.A N GLU 283.A OE1 no hydrogen 3.337 N/A THR 278.A N GLU 283.A OE2 no hydrogen 3.088 N/A THR 278.A OG1 SER 280.A OG no hydrogen 3.089 N/A THR 278.A OG1 GLU 283.A OE2 no hydrogen 2.032 N/A SER 279.A N ARG 433.A O no hydrogen 2.837 N/A SER 279.A OG ARG 433.A O no hydrogen 3.170 N/A SER 280.A OG THR 278.A OG1 no hydrogen 3.089 N/A SER 280.A OG VAL 282.A O no hydrogen 3.410 N/A SER 280.A OG GLU 283.A OE2 no hydrogen 2.731 N/A ASP 281.A N ARG 134.A O no hydrogen 2.809 N/A VAL 282.A N ARG 134.A O no hydrogen 3.155 N/A PHE 284.A N ALA 136.A O no hydrogen 2.984 N/A ASN 285.A N ALA 268.A O no hydrogen 2.858 N/A CYS 286.A N HIS 138.A O no hydrogen 2.782 N/A CYS 286.A SG HIS 138.A O no hydrogen 3.868 N/A CYS 286.A SG THR 287.A O no hydrogen 3.665 N/A THR 287.A N ASN 290.A OD1 no hydrogen 2.757 N/A THR 287.A OG1 ASP 289.A OD1 no hydrogen 2.441 N/A THR 287.A OG1 ASN 290.A OD1 no hydrogen 3.504 N/A ASN 290.A N THR 287.A O no hydrogen 2.880 N/A ALA 292.A N ARG 258.A O no hydrogen 2.745 N/A TYR 303.A OH HIS 89.A ND1 no hydrogen 2.881 N/A LYS 304.A N GLU 401.A OE1 no hydrogen 3.006 N/A LYS 304.A NZ ALA 302.A O no hydrogen 3.150 N/A LYS 304.A NZ ASP 341.A OD2 no hydrogen 2.510 N/A LYS 304.A NZ GLU 348.A OE2 no hydrogen 3.391 N/A LEU 305.A N TYR 340.A O no hydrogen 3.028 N/A MET 306.A N PHE 402.A O no hydrogen 2.964 N/A CYS 307.A N LEU 338.A O no hydrogen 2.896 N/A CYS 307.A SG SER 523.A O no hydrogen 3.358 N/A PHE 308.A N THR 404.A O no hydrogen 3.145 N/A ASP 309.A N SER 336.A O no hydrogen 2.988 N/A GLU 311.A N GLN 334.A O no hydrogen 2.800 N/A LYS 313.A N LEU 331.A O no hydrogen 2.796 N/A GLY 315.A N ASP 330.A OD1 no hydrogen 2.780 N/A ALA 321.A N ASP 318.A O no hydrogen 3.174 N/A PHE 322.A N ARG 957.A O no hydrogen 2.795 N/A VAL 324.A N ASP 330.A OD2 no hydrogen 3.132 N/A HIS 327.A N VAL 324.A O no hydrogen 3.223 N/A GLU 329.A N GLU 329.A OE1 no hydrogen 2.657 N/A ASP 330.A N HIS 327.A O no hydrogen 3.285 N/A VAL 332.A N GLU 384.A OE2 no hydrogen 2.488 N/A ILE 333.A N GLU 311.A O no hydrogen 2.850 N/A GLN 334.A N GLU 311.A O no hydrogen 3.077 N/A GLN 334.A NE2 SER 354.A OG no hydrogen 3.398 N/A GLN 334.A NE2 ARG 512.A O no hydrogen 2.993 N/A ILE 335.A N PHE 353.A O no hydrogen 2.925 N/A SER 336.A OG SER 523.A OG no hydrogen 2.725 N/A CYS 337.A N LEU 351.A O no hydrogen 2.905 N/A LEU 338.A N CYS 307.A O no hydrogen 2.974 N/A LEU 339.A N HIS 349.A O no hydrogen 2.875 N/A ASP 341.A N ALA 346.A O no hydrogen 2.915 N/A LEU 342.A N TYR 303.A O no hydrogen 2.645 N/A SER 343.A N ASP 341.A OD1 no hydrogen 3.078 N/A SER 343.A OG ASP 341.A OD1 no hydrogen 2.591 N/A THR 344.A N ASP 341.A OD1 no hydrogen 3.279 N/A THR 345.A OG1 THR 344.A O no hydrogen 2.262 N/A ALA 346.A N THR 344.A OG1 no hydrogen 3.212 N/A GLU 348.A N LEU 339.A O no hydrogen 2.737 N/A HIS 349.A N LEU 339.A O no hydrogen 3.065 N/A LEU 351.A N CYS 337.A O no hydrogen 2.942 N/A LEU 352.A N VAL 377.A O no hydrogen 3.118 N/A PHE 353.A N ILE 335.A O no hydrogen 2.892 N/A SER 354.A N LEU 379.A O no hydrogen 2.884 N/A SER 354.A OG GLY 356.A O no hydrogen 3.449 N/A LEU 355.A N ILE 333.A O no hydrogen 2.827 N/A GLY 356.A N PHE 381.A O no hydrogen 2.596 N/A CYS 358.A SG ARG 512.A O no hydrogen 3.393 N/A ASP 359.A N PRO 509.A O no hydrogen 3.325 N/A LEU 365.A N PRO 361.A O no hydrogen 3.136 N/A ASN 366.A N GLU 362.A O no hydrogen 2.876 N/A GLU 367.A N SER 363.A O no hydrogen 2.930 N/A LEU 368.A N HIS 364.A O no hydrogen 3.017 N/A ALA 369.A N LEU 365.A O no hydrogen 2.971 N/A ALA 370.A N ASN 366.A O no hydrogen 2.855 N/A ARG 371.A N GLU 367.A O no hydrogen 3.088 N/A GLY 372.A N ALA 369.A O no hydrogen 3.206 N/A LEU 373.A N LEU 368.A O no hydrogen 3.078 N/A VAL 377.A N VAL 350.A O no hydrogen 2.852 N/A LEU 379.A N LEU 352.A O no hydrogen 2.759 N/A GLU 380.A N TYR 47.A O no hydrogen 2.785 N/A PHE 381.A N SER 354.A O no hydrogen 2.791 N/A SER 383.A OG ILE 18.A O no hydrogen 3.001 N/A GLU 384.A N ILE 18.A O no hydrogen 2.964 N/A PHE 385.A N SER 383.A OG no hydrogen 3.075 N/A MET 387.A N SER 383.A O no hydrogen 3.334 N/A LEU 388.A N GLU 384.A O no hydrogen 2.938 N/A LEU 389.A N PHE 385.A O no hydrogen 2.773 N/A ALA 390.A N GLU 386.A O no hydrogen 2.878 N/A PHE 391.A N MET 387.A O no hydrogen 2.956 N/A MET 392.A N LEU 388.A O no hydrogen 2.932 N/A THR 393.A N LEU 389.A O no hydrogen 2.830 N/A THR 393.A OG1 LEU 389.A O no hydrogen 2.576 N/A LEU 394.A N ALA 390.A O no hydrogen 2.922 N/A VAL 395.A N PHE 391.A O no hydrogen 2.966 N/A LYS 396.A N MET 392.A O no hydrogen 2.907 N/A LYS 396.A NZ GLY 430.A O no hydrogen 3.047 N/A LYS 396.A NZ GLY 432.A O no hydrogen 3.563 N/A LYS 396.A NZ MET 434.A O no hydrogen 3.157 N/A LYS 396.A NZ ASN 435.A OD1 no hydrogen 3.508 N/A GLN 397.A N THR 393.A O no hydrogen 2.816 N/A TYR 398.A N LEU 394.A O no hydrogen 2.820 N/A GLY 399.A N VAL 395.A O no hydrogen 3.096 N/A GLU 401.A N GLU 401.A OE1 no hydrogen 2.756 N/A PHE 402.A N LYS 304.A O no hydrogen 3.059 N/A VAL 403.A N VAL 462.A O no hydrogen 2.886 N/A THR 404.A N MET 306.A O no hydrogen 2.774 N/A THR 404.A OG1 ILE 464.A O no hydrogen 2.215 N/A TYR 406.A OH TYR 479.A O no hydrogen 2.672 N/A ASN 407.A N ASP 465.A OD1 no hydrogen 2.610 N/A ILE 408.A N ASP 465.A OD1 no hydrogen 3.350 N/A ILE 409.A N ASP 465.A OD2 no hydrogen 3.377 N/A ASN 410.A ND2 ASN 407.A OD1 no hydrogen 3.539 N/A PHE 411.A N ASN 407.A O no hydrogen 3.134 N/A TRP 413.A N ILE 408.A O no hydrogen 2.839 N/A TRP 413.A NE1 ASN 463.A OD1 no hydrogen 2.609 N/A PHE 415.A N PHE 411.A O no hydrogen 2.891 N/A LEU 416.A N ASP 412.A O no hydrogen 3.011 N/A LEU 417.A N TRP 413.A O no hydrogen 2.875 N/A ALA 418.A N PRO 414.A O no hydrogen 2.874 N/A LYS 419.A N PHE 415.A O no hydrogen 3.058 N/A LYS 419.A NZ ALA 325.A O no hydrogen 3.217 N/A LYS 419.A NZ ASP 330.A O no hydrogen 2.623 N/A LEU 420.A N LEU 416.A O no hydrogen 2.865 N/A THR 421.A N LEU 417.A O no hydrogen 2.908 N/A THR 421.A OG1 LEU 417.A O no hydrogen 2.713 N/A THR 421.A OG1 ASP 422.A OD1 no hydrogen 3.399 N/A ASP 422.A N ALA 418.A O no hydrogen 2.857 N/A ILE 423.A N LYS 419.A O no hydrogen 3.111 N/A TYR 424.A N LYS 419.A O no hydrogen 3.023 N/A TYR 424.A OH GLU 384.A OE1 no hydrogen 2.573 N/A LYS 425.A NZ ASP 422.A O no hydrogen 2.680 N/A LYS 425.A NZ ILE 423.A O no hydrogen 3.066 N/A VAL 426.A N LEU 420.A O no hydrogen 2.583 N/A TYR 431.A N LEU 428.A O no hydrogen 3.374 N/A ASN 435.A N GLY 277.A O no hydrogen 2.772 N/A ASN 435.A ND2 THR 278.A O no hydrogen 3.685 N/A ARG 437.A N ASP 429.A OD2 no hydrogen 2.826 N/A GLY 438.A N ASP 429.A O no hydrogen 2.789 N/A ARG 441.A N LYS 457.A O no hydrogen 2.954 N/A TRP 443.A N LYS 455.A O no hydrogen 3.154 N/A SER 448.A N ILE 445.A O no hydrogen 3.149 N/A GLN 451.A NE2 ARG 453.A O no hydrogen 2.805 N/A SER 454.A OG ASN 410.A OD1 no hydrogen 3.082 N/A LYS 455.A NZ TYR 555.A O no hydrogen 3.457 N/A LYS 455.A NZ ASP 556.A OD1 no hydrogen 3.448 N/A LYS 457.A N ARG 441.A O no hydrogen 2.938 N/A LYS 457.A NZ ASP 556.A OD1 no hydrogen 3.341 N/A ASN 459.A N VAL 439.A O no hydrogen 2.907 N/A ASN 459.A N ASN 459.A OD1 no hydrogen 2.550 N/A VAL 462.A N GLU 401.A O no hydrogen 2.806 N/A ILE 464.A N VAL 403.A O no hydrogen 2.720 N/A MET 466.A N GLY 405.A O no hydrogen 2.818 N/A TYR 467.A N ASP 465.A OD1 no hydrogen 3.023 N/A TYR 467.A OH ASP 965.A OD1 no hydrogen 3.060 N/A ILE 470.A N MET 466.A O no hydrogen 2.948 N/A ILE 470.A N TYR 467.A O no hydrogen 3.302 N/A THR 471.A N TYR 467.A O no hydrogen 3.000 N/A THR 471.A OG1 TYR 467.A O no hydrogen 3.324 N/A THR 471.A OG1 GLY 468.A O no hydrogen 3.302 N/A LYS 473.A N ILE 470.A O no hydrogen 3.065 N/A LYS 473.A NZ GLU 538.A OE1 no hydrogen 3.119 N/A LYS 473.A NZ GLU 538.A OE2 no hydrogen 3.365 N/A LEU 476.A N TYR 479.A OH no hydrogen 3.226 N/A SER 477.A OG LYS 855.A O no hydrogen 2.896 N/A TYR 479.A OH ILE 474.A O no hydrogen 2.504 N/A LYS 480.A N SER 478.A OG no hydrogen 3.286 N/A VAL 484.A N LYS 480.A O no hydrogen 2.982 N/A ALA 485.A N LEU 481.A O no hydrogen 2.827 N/A GLU 486.A N ASN 482.A O no hydrogen 2.983 N/A ALA 487.A N ALA 483.A O no hydrogen 2.943 N/A VAL 488.A N VAL 484.A O no hydrogen 2.925 N/A LEU 489.A N ALA 485.A O no hydrogen 2.835 N/A LYS 490.A N GLU 486.A O no hydrogen 3.175 N/A LYS 490.A NZ ALA 487.A O no hydrogen 3.437 N/A LYS 492.A NZ LYS 493.A O no hydrogen 3.563 N/A LYS 493.A NZ ASP 522.A OD1 no hydrogen 2.416 N/A LYS 494.A NZ LYS 492.A O no hydrogen 3.298 N/A ASP 500.A N SER 497.A O no hydrogen 2.948 N/A TYR 504.A N ILE 501.A O no hydrogen 3.261 N/A TYR 505.A N ILE 501.A O no hydrogen 2.897 N/A TYR 505.A OH LEU 355.A O no hydrogen 2.771 N/A ALA 506.A N PRO 502.A O no hydrogen 3.130 N/A THR 507.A N TYR 504.A O no hydrogen 2.917 N/A THR 507.A OG1 ALA 503.A O no hydrogen 3.093 N/A ARG 512.A N GLY 508.A O no hydrogen 3.464 N/A ARG 512.A NE SER 357.A O no hydrogen 2.756 N/A ARG 512.A NH1 TYR 505.A O no hydrogen 2.766 N/A GLY 513.A N PRO 509.A O no hydrogen 2.837 N/A VAL 514.A N ALA 510.A O no hydrogen 3.018 N/A ILE 515.A N GLN 511.A O no hydrogen 2.986 N/A GLY 516.A N ARG 512.A O no hydrogen 2.908 N/A GLU 517.A N GLY 513.A O no hydrogen 2.861 N/A TYR 518.A N VAL 514.A O no hydrogen 3.060 N/A CYS 519.A N ILE 515.A O no hydrogen 2.979 N/A CYS 519.A SG ASP 309.A O no hydrogen 3.242 N/A CYS 519.A SG ASP 309.A OD2 no hydrogen 3.360 N/A ILE 520.A N GLY 516.A O no hydrogen 2.964 N/A GLN 521.A N GLU 517.A O no hydrogen 2.932 N/A ASP 522.A N TYR 518.A O no hydrogen 3.013 N/A SER 523.A N CYS 519.A O no hydrogen 3.123 N/A SER 523.A OG SER 336.A OG no hydrogen 2.725 N/A SER 523.A OG CYS 519.A O no hydrogen 3.419 N/A LEU 524.A N ILE 520.A O no hydrogen 2.845 N/A LEU 525.A N GLN 521.A O no hydrogen 2.951 N/A VAL 526.A N ASP 522.A O no hydrogen 3.002 N/A GLY 527.A N SER 523.A O no hydrogen 2.946 N/A GLN 528.A N LEU 524.A O no hydrogen 2.992 N/A GLN 528.A NE2 LEU 524.A O no hydrogen 3.574 N/A LEU 529.A N LEU 525.A O no hydrogen 2.946 N/A PHE 530.A N VAL 526.A O no hydrogen 2.924 N/A PHE 531.A N GLY 527.A O no hydrogen 3.006 N/A LYS 532.A N GLN 528.A O no hydrogen 2.910 N/A LYS 532.A N LEU 529.A O no hydrogen 3.061 N/A LYS 532.A NZ VAL 488.A O no hydrogen 3.565 N/A PHE 533.A N LEU 529.A O no hydrogen 2.991 N/A LEU 534.A N PHE 530.A O no hydrogen 2.628 N/A LEU 537.A N LEU 534.A O no hydrogen 3.301 N/A LEU 539.A N PRO 535.A O no hydrogen 2.947 N/A SER 540.A N HIS 536.A O no hydrogen 2.932 N/A SER 540.A OG HIS 536.A O no hydrogen 2.459 N/A SER 540.A OG LEU 537.A O no hydrogen 2.895 N/A ALA 541.A N LEU 537.A O no hydrogen 2.954 N/A VAL 542.A N GLU 538.A O no hydrogen 3.054 N/A ALA 543.A N LEU 539.A O no hydrogen 2.875 N/A ARG 544.A N SER 540.A O no hydrogen 2.849 N/A ARG 544.A NE PHE 254.A O no hydrogen 3.141 N/A LEU 545.A N ALA 541.A O no hydrogen 3.031 N/A ALA 546.A N VAL 542.A O no hydrogen 2.867 N/A GLY 547.A N ALA 543.A O no hydrogen 3.194 N/A ARG 552.A N ASN 549.A OD1 no hydrogen 3.314 N/A ARG 552.A NE ASP 556.A OD2 no hydrogen 2.679 N/A THR 553.A N ASN 549.A O no hydrogen 3.190 N/A THR 553.A OG1 ASN 549.A O no hydrogen 3.052 N/A ILE 554.A N ILE 550.A O no hydrogen 2.957 N/A TYR 555.A N THR 551.A O no hydrogen 2.967 N/A TYR 555.A OH ASN 463.A O no hydrogen 2.560 N/A ASP 556.A N ARG 552.A O no hydrogen 2.766 N/A ARG 561.A NH2 THR 553.A O no hydrogen 2.859 N/A VAL 562.A N GLN 558.A O no hydrogen 3.411 N/A PHE 563.A N GLN 559.A O no hydrogen 2.821 N/A THR 564.A N ILE 560.A O no hydrogen 2.980 N/A THR 564.A OG1 ILE 560.A O no hydrogen 2.515 N/A CYS 565.A N ARG 561.A O no hydrogen 3.023 N/A CYS 565.A SG ALA 546.A O no hydrogen 3.736 N/A CYS 565.A SG ARG 561.A O no hydrogen 3.070 N/A LEU 566.A N VAL 562.A O no hydrogen 2.884 N/A LEU 567.A N PHE 563.A O no hydrogen 2.854 N/A ARG 568.A N THR 564.A O no hydrogen 2.985 N/A ARG 568.A NH1 ALA 546.A O no hydrogen 2.895 N/A LEU 569.A N CYS 565.A O no hydrogen 3.158 N/A ALA 570.A N LEU 566.A O no hydrogen 2.826 N/A ASP 571.A N LEU 567.A O no hydrogen 2.969 N/A GLN 572.A N ARG 568.A O no hydrogen 3.134 N/A LYS 573.A N LEU 569.A O no hydrogen 2.994 N/A GLY 574.A N ALA 570.A O no hydrogen 2.921 N/A PHE 575.A N ALA 570.A O no hydrogen 2.936 N/A LEU 577.A N GLU 235.A OE2 no hydrogen 3.290 N/A ASP 579.A N LYS 233.A O no hydrogen 3.124 N/A GLN 581.A NE2 HIS 720.A O no hydrogen 3.145 N/A ARG 583.A N THR 580.A O no hydrogen 3.185 N/A PHE 584.A N GLN 581.A O no hydrogen 2.564 N/A TYR 591.A OH TYR 713.A OH no hydrogen 2.761 N/A THR 600.A N ILE 778.A O no hydrogen 2.979 N/A THR 600.A OG1 THR 600.A O no hydrogen 2.508 N/A SER 601.A OG ILE 831.A O no hydrogen 3.430 N/A GLY 602.A N LEU 830.A O no hydrogen 2.991 N/A HIS 604.A N LEU 828.A O no hydrogen 2.785 N/A HIS 604.A NE2 THR 600.A O no hydrogen 2.687 N/A VAL 608.A N PHE 825.A O no hydrogen 3.063 N/A VAL 609.A N VAL 787.A O no hydrogen 2.926 N/A PHE 611.A N ILE 785.A O no hydrogen 2.954 N/A ASP 612.A N GLU 820.A O no hydrogen 2.885 N/A ALA 614.A N LYS 818.A O no hydrogen 2.944 N/A SER 619.A N SER 615.A O no hydrogen 2.873 N/A SER 619.A OG SER 615.A O no hydrogen 2.437 N/A SER 619.A OG LEU 616.A O no hydrogen 2.395 N/A ILE 620.A N LEU 616.A O no hydrogen 2.883 N/A ILE 621.A N TYR 617.A O no hydrogen 2.918 N/A GLN 622.A N PRO 618.A O no hydrogen 2.950 N/A GLN 622.A NE2 SER 670.A O no hydrogen 3.205 N/A ALA 623.A N SER 619.A O no hydrogen 2.787 N/A HIS 624.A N ILE 620.A O no hydrogen 2.913 N/A ASN 625.A ND2 VAL 660.A O no hydrogen 3.075 N/A ASN 625.A ND2 ARG 665.A O no hydrogen 2.771 N/A LEU 626.A N ILE 621.A O no hydrogen 2.996 N/A CYS 627.A SG SER 629.A OG no hydrogen 3.041 N/A THR 630.A OG1 ASN 625.A O no hydrogen 2.844 N/A SER 632.A N PHE 658.A O no hydrogen 2.778 N/A SER 632.A OG GLU 203.A OE1 no hydrogen 3.239 N/A ALA 639.A N ASP 636.A O no hydrogen 2.856 N/A LEU 641.A N VAL 638.A O no hydrogen 3.129 N/A GLU 642.A N ASP 646.A OD2 no hydrogen 3.358 N/A GLY 644.A N TYR 647.A O no hydrogen 2.987 N/A ASP 646.A N GLU 642.A O no hydrogen 3.068 N/A LEU 648.A N PHE 659.A O no hydrogen 2.898 N/A ILE 650.A N LEU 657.A O no hydrogen 2.903 N/A VAL 652.A N ARG 655.A O no hydrogen 2.888 N/A ARG 655.A N VAL 652.A O no hydrogen 2.928 N/A ARG 656.A NH1 GLU 649.A OE2 no hydrogen 3.509 N/A LEU 657.A N ILE 650.A O no hydrogen 2.895 N/A PHE 658.A N SER 632.A O no hydrogen 2.967 N/A PHE 659.A N LEU 648.A O no hydrogen 2.912 N/A VAL 660.A N THR 630.A O no hydrogen 3.230 N/A LYS 661.A N ASP 646.A O no hydrogen 2.874 N/A LYS 661.A NZ GLY 644.A O no hydrogen 3.272 N/A HIS 663.A NE2 ASP 646.A OD1 no hydrogen 2.466 N/A VAL 664.A N LYS 661.A O no hydrogen 3.085 N/A ARG 665.A N LYS 661.A O no hydrogen 3.273 N/A ARG 665.A NH1 TYR 201.A O no hydrogen 3.286 N/A ARG 665.A NH1 SER 629.A O no hydrogen 2.723 N/A SER 667.A N ASN 625.A OD1 no hydrogen 2.845 N/A SER 667.A OG LEU 626.A O no hydrogen 2.349 N/A SER 667.A OG SER 670.A OG no hydrogen 3.384 N/A SER 670.A N SER 667.A OG no hydrogen 3.204 N/A SER 670.A OG ILE 621.A O no hydrogen 3.239 N/A LEU 672.A N LEU 668.A O no hydrogen 3.198 N/A LEU 673.A N LEU 669.A O no hydrogen 2.983 N/A ARG 674.A N SER 670.A O no hydrogen 2.934 N/A ASP 675.A N ILE 671.A O no hydrogen 3.279 N/A TRP 676.A N LEU 672.A O no hydrogen 3.297 N/A LEU 677.A N LEU 673.A O no hydrogen 2.827 N/A ALA 678.A N ARG 674.A O no hydrogen 2.918 N/A MET 679.A N ASP 675.A O no hydrogen 3.140 N/A ARG 680.A N TRP 676.A O no hydrogen 3.004 N/A ARG 680.A NE GLN 702.A OE1 no hydrogen 2.975 N/A ARG 680.A NH2 GLN 702.A OE1 no hydrogen 2.809 N/A LYS 681.A N LEU 677.A O no hydrogen 2.919 N/A GLN 682.A N ALA 678.A O no hydrogen 2.957 N/A ILE 683.A N MET 679.A O no hydrogen 3.125 N/A ARG 684.A N ARG 680.A O no hydrogen 3.007 N/A SER 685.A N LYS 681.A O no hydrogen 2.912 N/A SER 685.A OG GLN 682.A O no hydrogen 3.098 N/A ARG 686.A N ILE 683.A O no hydrogen 3.379 N/A ILE 687.A N ARG 684.A O no hydrogen 3.159 N/A SER 690.A OG ARG 686.A O no hydrogen 2.748 N/A GLU 693.A N SER 691.A OG no hydrogen 3.353 N/A GLU 694.A N SER 691.A O no hydrogen 3.292 N/A ALA 695.A N SER 691.A O no hydrogen 2.836 N/A VAL 696.A N PRO 692.A O no hydrogen 3.169 N/A LEU 698.A N GLU 694.A O no hydrogen 2.863 N/A ASP 699.A N ALA 695.A O no hydrogen 2.871 N/A LYS 700.A N VAL 696.A O no hydrogen 3.105 N/A LYS 700.A NZ LYS 473.A O no hydrogen 2.435 N/A GLN 701.A N LEU 697.A O no hydrogen 2.973 N/A GLN 701.A NE2 LEU 697.A O no hydrogen 3.275 N/A GLN 702.A N LEU 698.A O no hydrogen 2.935 N/A GLN 702.A NE2 ASP 699.A O no hydrogen 2.994 N/A ALA 703.A N ASP 699.A O no hydrogen 2.990 N/A ALA 704.A N LYS 700.A O no hydrogen 3.003 N/A ILE 705.A N GLN 701.A O no hydrogen 3.077 N/A LYS 706.A N GLN 702.A O no hydrogen 2.859 N/A VAL 707.A N ALA 703.A O no hydrogen 3.032 N/A VAL 708.A N ALA 704.A O no hydrogen 3.101 N/A CYS 709.A N ILE 705.A O no hydrogen 2.984 N/A CYS 709.A N LYS 706.A O no hydrogen 3.101 N/A CYS 709.A SG ILE 705.A O no hydrogen 3.302 N/A ASN 710.A N LYS 706.A O no hydrogen 2.898 N/A SER 711.A N VAL 707.A O no hydrogen 2.894 N/A SER 711.A OG VAL 707.A O no hydrogen 2.615 N/A VAL 712.A N CYS 709.A O no hydrogen 3.165 N/A TYR 713.A OH TYR 591.A OH no hydrogen 2.761 N/A GLY 714.A N ASN 710.A O no hydrogen 2.942 N/A PHE 715.A N SER 711.A O no hydrogen 2.801 N/A PHE 715.A N VAL 712.A O no hydrogen 3.239 N/A THR 716.A N VAL 712.A O no hydrogen 3.306 N/A THR 716.A OG1 TYR 713.A O no hydrogen 2.194 N/A GLY 717.A N TYR 713.A O no hydrogen 3.346 N/A GLY 717.A N GLY 714.A O no hydrogen 3.241 N/A LEU 722.A N GLN 559.A OE1 no hydrogen 3.197 N/A CYS 725.A N THR 716.A O no hydrogen 2.826 N/A VAL 728.A N CYS 725.A O no hydrogen 3.201 N/A ALA 729.A N CYS 725.A O no hydrogen 3.297 N/A ALA 730.A N LEU 726.A O no hydrogen 2.921 N/A THR 731.A N HIS 727.A O no hydrogen 2.910 N/A THR 731.A OG1 HIS 727.A O no hydrogen 2.544 N/A VAL 732.A N VAL 728.A O no hydrogen 2.927 N/A THR 733.A N ALA 729.A O no hydrogen 3.094 N/A THR 733.A OG1 GLN 592.A O no hydrogen 2.541 N/A THR 733.A OG1 ALA 730.A O no hydrogen 3.107 N/A THR 734.A N ALA 730.A O no hydrogen 2.904 N/A THR 734.A OG1 ALA 730.A O no hydrogen 2.758 N/A ILE 735.A N THR 731.A O no hydrogen 2.972 N/A GLY 736.A N VAL 732.A O no hydrogen 2.944 N/A ARG 737.A N THR 733.A O no hydrogen 2.962 N/A ARG 737.A NH1 GLN 592.A O no hydrogen 3.271 N/A ARG 737.A NH1 GLY 593.A O no hydrogen 2.466 N/A GLU 738.A N THR 734.A O no hydrogen 3.006 N/A MET 739.A N ILE 735.A O no hydrogen 2.917 N/A LEU 740.A N GLY 736.A O no hydrogen 3.024 N/A LEU 741.A N ARG 737.A O no hydrogen 3.153 N/A ALA 742.A N GLU 738.A O no hydrogen 2.767 N/A THR 743.A N MET 739.A O no hydrogen 2.940 N/A THR 743.A OG1 MET 739.A O no hydrogen 2.579 N/A ARG 744.A N LEU 740.A O no hydrogen 3.076 N/A ARG 744.A NE GLU 745.A OE2 no hydrogen 3.498 N/A GLU 745.A N LEU 741.A O no hydrogen 2.948 N/A TYR 746.A N ALA 742.A O no hydrogen 2.925 N/A TYR 746.A OH HIS 807.A NE2 no hydrogen 3.284 N/A VAL 747.A N THR 743.A O no hydrogen 3.019 N/A HIS 748.A N ARG 744.A O no hydrogen 2.987 N/A ALA 749.A N GLU 745.A O no hydrogen 2.965 N/A ARG 750.A N TYR 746.A O no hydrogen 2.932 N/A ARG 750.A NE ASP 760.A OD1 no hydrogen 3.235 N/A ARG 750.A NE ASP 760.A OD2 no hydrogen 2.780 N/A ARG 750.A NH2 ASP 760.A OD1 no hydrogen 2.985 N/A TRP 751.A NE1 ASP 760.A OD2 no hydrogen 2.387 N/A ALA 753.A N GLN 756.A OE1 no hydrogen 3.192 N/A GLN 756.A N ALA 753.A O no hydrogen 3.218 N/A LEU 757.A N ALA 753.A O no hydrogen 3.361 N/A LEU 758.A N PHE 754.A O no hydrogen 2.866 N/A ALA 759.A N GLU 755.A O no hydrogen 2.882 N/A ASP 760.A N GLN 756.A O no hydrogen 3.033 N/A PHE 761.A N LEU 757.A O no hydrogen 2.873 N/A ALA 764.A N PHE 761.A O no hydrogen 2.954 N/A ALA 765.A N PRO 762.A O no hydrogen 2.919 N/A MET 767.A N ALA 764.A O no hydrogen 2.919 N/A ARG 768.A NH2 GLY 771.A O no hydrogen 3.201 N/A TYR 773.A OH TRP 751.A O no hydrogen 2.527 N/A SER 774.A N ARG 790.A O no hydrogen 3.194 N/A ILE 777.A N HIS 748.A NE2 no hydrogen 3.131 N/A ILE 778.A N PHE 786.A O no hydrogen 2.752 N/A TYR 779.A OH LYS 833.A O no hydrogen 2.108 N/A ASP 781.A N SER 784.A O no hydrogen 3.209 N/A THR 782.A N ASP 781.A OD2 no hydrogen 2.939 N/A THR 782.A OG1 ASP 781.A OD2 no hydrogen 3.288 N/A ILE 785.A N PHE 611.A O no hydrogen 2.950 N/A PHE 786.A N TYR 779.A O no hydrogen 2.861 N/A VAL 787.A N VAL 609.A O no hydrogen 2.800 N/A LEU 788.A N ARG 776.A O no hydrogen 2.927 N/A CYS 789.A N PRO 607.A O no hydrogen 2.969 N/A CYS 789.A SG VAL 787.A O no hydrogen 3.404 N/A ARG 790.A N LEU 788.A O no hydrogen 3.141 N/A THR 793.A N MET 767.A O no hydrogen 2.714 N/A THR 793.A OG1 MET 767.A O no hydrogen 3.291 N/A MET 800.A N GLY 796.A O no hydrogen 3.230 N/A GLY 801.A N LEU 797.A O no hydrogen 2.870 N/A ASP 802.A N THR 798.A O no hydrogen 2.940 N/A MET 804.A N MET 800.A O no hydrogen 2.812 N/A ALA 805.A N GLY 801.A O no hydrogen 2.904 N/A SER 806.A N ASP 802.A O no hydrogen 2.979 N/A SER 806.A OG ASP 802.A O no hydrogen 2.986 N/A HIS 807.A N LYS 803.A O no hydrogen 2.919 N/A ILE 808.A N MET 804.A O no hydrogen 2.865 N/A SER 809.A N ALA 805.A O no hydrogen 2.874 N/A SER 809.A OG ALA 805.A O no hydrogen 2.883 N/A SER 809.A OG LEU 819.A O no hydrogen 3.285 N/A ARG 810.A N SER 806.A O no hydrogen 2.901 N/A ALA 811.A N HIS 807.A O no hydrogen 2.950 N/A LEU 812.A N ILE 808.A O no hydrogen 2.914 N/A PHE 813.A N SER 809.A O no hydrogen 3.383 N/A ILE 817.A N LEU 814.A O no hydrogen 2.906 N/A LYS 818.A NZ GLU 820.A OE1 no hydrogen 2.792 N/A LEU 819.A N SER 809.A OG no hydrogen 2.654 N/A GLU 820.A N ASP 612.A O no hydrogen 2.949 N/A CYS 821.A SG THR 798.A O no hydrogen 4.041 N/A CYS 821.A SG THR 798.A OG1 no hydrogen 3.585 N/A CYS 821.A SG LYS 823.A O no hydrogen 3.434 N/A GLU 822.A N VAL 610.A O no hydrogen 2.891 N/A THR 824.A OG1 LYS 823.A O no hydrogen 2.728 N/A PHE 825.A N VAL 608.A O no hydrogen 3.047 N/A THR 826.A N VAL 839.A O no hydrogen 2.951 N/A THR 826.A OG1 VAL 839.A O no hydrogen 3.325 N/A LYS 827.A NZ PHE 873.A O no hydrogen 2.543 N/A LYS 827.A NZ SER 879.A OG no hydrogen 2.586 N/A LEU 828.A N HIS 604.A O no hydrogen 2.905 N/A LEU 829.A N ILE 837.A O no hydrogen 2.709 N/A LEU 830.A N GLY 602.A O no hydrogen 2.994 N/A ILE 831.A N LYS 835.A O no hydrogen 3.210 N/A ALA 832.A N LYS 835.A O no hydrogen 3.257 N/A LYS 833.A NZ VAL 596.A O no hydrogen 3.254 N/A LYS 834.A NZ ASP 781.A OD1 no hydrogen 3.179 N/A LYS 834.A NZ ASP 781.A OD2 no hydrogen 3.103 N/A LYS 835.A N ALA 832.A O no hydrogen 3.406 N/A TYR 836.A N LYS 848.A O no hydrogen 3.002 N/A ILE 837.A N LEU 829.A O no hydrogen 3.216 N/A GLY 838.A N LEU 846.A O no hydrogen 2.961 N/A VAL 839.A N LYS 827.A O no hydrogen 2.990 N/A ILE 840.A N LYS 844.A O.A no hydrogen 2.777 N/A ILE 840.A N LYS 844.A O.B no hydrogen 2.773 N/A TYR 841.A N THR 824.A O no hydrogen 2.667 N/A LEU 846.A N GLY 838.A O no hydrogen 2.866 N/A LYS 848.A N TYR 836.A O no hydrogen 2.877 N/A ARG 854.A NE ASN 856.A OD1 no hydrogen 3.211 N/A PHE 860.A N ASP 925.A O no hydrogen 2.952 N/A ASN 862.A N CYS 858.A O no hydrogen 3.096 N/A ARG 863.A N ALA 859.A O no hydrogen 2.879 N/A ARG 863.A NH1 ASP 925.A OD2 no hydrogen 3.484 N/A ARG 863.A NH2 ASP 925.A OD1 no hydrogen 2.674 N/A THR 864.A N PHE 860.A O no hydrogen 3.060 N/A SER 865.A N ILE 861.A O no hydrogen 2.834 N/A SER 865.A OG ILE 861.A O no hydrogen 2.766 N/A ARG 866.A N ASN 862.A O no hydrogen 2.963 N/A ARG 866.A NH1 ASP 870.A OD1 no hydrogen 2.380 N/A ALA 867.A N ARG 863.A O no hydrogen 3.000 N/A LEU 868.A N THR 864.A O no hydrogen 3.003 N/A VAL 869.A N SER 865.A O no hydrogen 2.965 N/A ASP 870.A N ARG 866.A O no hydrogen 2.916 N/A LEU 871.A N ALA 867.A O no hydrogen 3.002 N/A LEU 872.A N LEU 868.A O no hydrogen 2.944 N/A PHE 873.A N VAL 869.A O no hydrogen 2.963 N/A TYR 874.A N ASP 870.A O no hydrogen 2.937 N/A ASP 875.A N ASP 870.A O no hydrogen 3.307 N/A THR 877.A N ASP 876.A OD1 no hydrogen 2.399 N/A VAL 878.A N ASP 875.A O no hydrogen 3.215 N/A SER 879.A N ASP 875.A O no hydrogen 3.385 N/A SER 879.A OG LEU 872.A O no hydrogen 2.445 N/A SER 879.A OG PHE 873.A O no hydrogen 3.376 N/A ALA 882.A N VAL 878.A O no hydrogen 2.819 N/A ALA 883.A N SER 879.A O no hydrogen 2.894 N/A ALA 884.A N GLY 880.A O no hydrogen 2.870 N/A LEU 885.A N ALA 881.A O no hydrogen 3.000 N/A LEU 885.A N ALA 882.A O no hydrogen 3.210 N/A GLU 887.A N ALA 884.A O no hydrogen 3.194 N/A GLU 891.A N GLU 891.A OE1 no hydrogen 2.709 N/A GLU 892.A N PRO 889.A O no hydrogen 2.867 N/A TRP 893.A N ALA 890.A O no hydrogen 2.982 N/A TRP 893.A NE1 LEU 885.A O no hydrogen 2.941 N/A LEU 894.A N GLU 891.A O no hydrogen 2.990 N/A ALA 895.A N GLU 892.A O no hydrogen 3.288 N/A ARG 896.A N GLU 892.A O no hydrogen 3.072 N/A LEU 902.A N PRO 899.A O no hydrogen 3.053 N/A PHE 905.A N LEU 902.A O no hydrogen 2.902 N/A GLY 906.A N GLN 903.A O no hydrogen 2.956 N/A ALA 907.A N GLN 903.A O no hydrogen 3.011 N/A VAL 908.A N ALA 904.A O no hydrogen 3.375 N/A VAL 910.A N GLY 906.A O no hydrogen 2.774 N/A ASP 911.A N ALA 907.A O no hydrogen 2.748 N/A ALA 912.A N VAL 908.A O no hydrogen 2.828 N/A HIS 913.A N LEU 909.A O no hydrogen 2.858 N/A ARG 914.A N VAL 910.A O no hydrogen 3.065 N/A ARG 915.A N ASP 911.A O no hydrogen 2.768 N/A ARG 915.A NE ASP 911.A OD2 no hydrogen 3.065 N/A ARG 915.A NH2 ASP 911.A OD2 no hydrogen 3.483 N/A ILE 916.A N HIS 913.A O no hydrogen 3.122 N/A THR 917.A N ARG 914.A O no hydrogen 3.103 N/A THR 917.A OG1 ARG 914.A O no hydrogen 3.225 N/A ASP 925.A N ASP 922.A O no hydrogen 3.076 N/A PHE 926.A N ILE 923.A O no hydrogen 2.959 N/A LEU 928.A N TYR 969.A O no hydrogen 2.802 N/A THR 929.A N ASN 856.A O no hydrogen 3.317 N/A THR 929.A OG1 LYS 855.A O no hydrogen 2.882 N/A LEU 932.A N ASP 965.A O no hydrogen 3.106 N/A SER 933.A N ILE 963.A O no hydrogen 2.336 N/A SER 933.A OG LEU 932.A O no hydrogen 2.520 N/A SER 933.A OG TYR 939.A OH no hydrogen 3.279 N/A ALA 938.A N HIS 935.A O no hydrogen 2.650 N/A TYR 939.A OH LEU 932.A O no hydrogen 2.019 N/A LYS 942.A NZ ARG 937.A O no hydrogen 3.468 N/A LYS 942.A NZ TYR 939.A O no hydrogen 2.255 N/A ARG 943.A NH1 GLU 993.A OE2 no hydrogen 2.946 N/A ARG 943.A NH2 GLU 993.A OE2 no hydrogen 3.197 N/A THR 948.A N LEU 944.A O no hydrogen 2.871 N/A THR 948.A OG1 LEU 944.A O no hydrogen 3.073 N/A THR 948.A OG1 SER 992.A O no hydrogen 2.300 N/A VAL 949.A N ALA 945.A O no hydrogen 2.955 N/A TYR 950.A N HIS 946.A O no hydrogen 2.893 N/A TYR 951.A N LEU 947.A O no hydrogen 2.998 N/A LYS 952.A N THR 948.A O no hydrogen 2.978 N/A LYS 952.A NZ GLU 996.A OE1 no hydrogen 2.831 N/A LEU 953.A N VAL 949.A O no hydrogen 2.925 N/A MET 954.A N TYR 950.A O no hydrogen 2.995 N/A ALA 955.A N TYR 951.A O no hydrogen 2.871 N/A ARG 956.A N LYS 952.A O no hydrogen 3.295 N/A ARG 956.A NH1 GLU 996.A OE2 no hydrogen 2.393 N/A ARG 956.A NH2 GLU 996.A OE1 no hydrogen 3.183 N/A ALA 958.A N LEU 953.A O no hydrogen 2.984 N/A SER 962.A N ASP 965.A OD2 no hydrogen 3.129 N/A ASP 965.A N SER 962.A O no hydrogen 3.006 N/A ARG 966.A NE SER 477.A O no hydrogen 3.118 N/A ARG 966.A NH2 THR 929.A OG1 no hydrogen 2.741 N/A ILE 967.A N ALA 930.A O no hydrogen 2.872 N/A TYR 969.A N LEU 928.A O no hydrogen 2.792 N/A VAL 970.A N GLU 996.A O no hydrogen 2.764 N/A ILE 971.A N TYR 1013.A OH no hydrogen 3.125 N/A ALA 973.A N ALA 1007.A O no hydrogen 2.797 N/A GLU 979.A N THR 975.A O no hydrogen 2.796 N/A GLU 980.A N ARG 976.A O no hydrogen 2.984 N/A THR 981.A N GLU 977.A O no hydrogen 2.836 N/A THR 981.A OG1 GLU 977.A O no hydrogen 3.117 N/A VAL 982.A N VAL 978.A O no hydrogen 2.915 N/A ALA 983.A N GLU 979.A O no hydrogen 3.046 N/A ARG 984.A N GLU 980.A O no hydrogen 2.831 N/A LEU 985.A N THR 981.A O no hydrogen 2.848 N/A ALA 986.A N VAL 982.A O no hydrogen 2.581 N/A LEU 989.A N GLN 974.A OE1 no hydrogen 2.469 N/A LEU 994.A N LEU 990.A O no hydrogen 3.338 N/A TYR 1000.A N ASP 997.A OD2 no hydrogen 3.498 N/A ALA 1001.A N ASP 997.A O no hydrogen 3.043 N/A ILE 1002.A N PRO 998.A O no hydrogen 2.901 N/A ALA 1003.A N ALA 999.A O no hydrogen 2.972 N/A HIS 1004.A N TYR 1000.A O no hydrogen 2.863 N/A VAL 1006.A N HIS 1004.A O no hydrogen 2.528 N/A ASN 1009.A N ILE 971.A O no hydrogen 2.702 N/A ASN 1009.A ND2 VAL 972.A O no hydrogen 3.160 N/A TYR 1012.A N ASN 1009.A OD1 no hydrogen 3.213 N/A TYR 1013.A N ASN 1009.A O no hydrogen 3.131 N/A PHE 1014.A N THR 1010.A O no hydrogen 3.026 N/A SER 1015.A N ASP 1011.A O no hydrogen 2.966 N/A SER 1015.A OG ASP 1011.A O no hydrogen 2.911 N/A SER 1015.A OG TYR 1012.A O no hydrogen 2.835 N/A SER 1015.A OG HIS 1016.A ND1 no hydrogen 3.343 N/A HIS 1016.A N TYR 1012.A O no hydrogen 2.915 N/A HIS 1016.A ND1 TYR 1012.A O no hydrogen 2.799 N/A LEU 1017.A N TYR 1013.A O no hydrogen 2.904 N/A LEU 1018.A N PHE 1014.A O no hydrogen 2.915 N/A GLY 1019.A N SER 1015.A O no hydrogen 2.859 N/A ALA 1020.A N HIS 1016.A O no hydrogen 2.946 N/A ALA 1021.A N LEU 1017.A O no hydrogen 3.054 N/A CYS 1022.A N LEU 1018.A O no hydrogen 2.809 N/A CYS 1022.A SG LEU 1018.A O no hydrogen 2.911 N/A VAL 1023.A N GLY 1019.A O no hydrogen 2.915 N/A THR 1024.A N ALA 1020.A O no hydrogen 3.071 N/A THR 1024.A OG1 ALA 1020.A O no hydrogen 3.010 N/A PHE 1025.A N ALA 1021.A O no hydrogen 2.929 N/A LYS 1026.A NZ VAL 1023.A O no hydrogen 3.197 N/A LEU 1028.A N PHE 1025.A O no hydrogen 3.429 N/A PHE 1029.A N LYS 1026.A O no hydrogen 3.086 N/A ASN 1031.A N LYS 1026.A O no hydrogen 2.545 N/A ASN 1032.A N PHE 1029.A O no hydrogen 3.434 N/A ILE 1035.A N ASN 1032.A OD1 no hydrogen 3.297 N/A THR 1036.A N ASN 1032.A O no hydrogen 3.049 N/A THR 1036.A OG1 ASN 1032.A O no hydrogen 2.597 N/A GLU 1037.A N ALA 1033.A O no hydrogen 2.831 N/A SER 1038.A N LYS 1034.A O.A no hydrogen 3.003 N/A SER 1038.A N LYS 1034.A O.B no hydrogen 2.988 N/A SER 1038.A OG LYS 1034.A O.A no hydrogen 3.375 N/A SER 1038.A OG LYS 1034.A O.B no hydrogen 3.500 N/A LEU 1039.A N ILE 1035.A O no hydrogen 2.897 N/A LEU 1040.A N THR 1036.A O no hydrogen 2.866 N/A LEU 1040.A N GLU 1037.A O no hydrogen 3.253 N/A LYS 1041.A N GLU 1037.A O no hydrogen 2.977 N/A LYS 1041.A NZ GLU 1037.A OE1 no hydrogen 2.997 N/A ARG 1042.A N SER 1038.A O no hydrogen 3.139 N/A PHE 1043.A N LEU 1040.A O no hydrogen 3.084 N/A VAL 1054.A N PRO 1051.A O no hydrogen 2.677 N/A ALA 1055.A N PRO 1051.A O no hydrogen 2.498 N/A ARG 1057.A NH1 ASP 1053.A O no hydrogen 3.568 N/A ARG 1057.A NH2 ASP 1053.A O no hydrogen 3.242 N/A LEU 1058.A N VAL 1054.A O no hydrogen 3.177 N/A ARG 1059.A N ALA 1055.A O no hydrogen 2.907 N/A ALA 1060.A N ALA 1056.A O no hydrogen 2.850 N/A ALA 1061.A N ARG 1057.A O no hydrogen 2.868 N/A PHE 1063.A N LEU 1058.A O no hydrogen 3.123 N/A ALA 1070.A N ALA 1068.A O no hydrogen 2.717 N/A THR 1075.A N THR 1071.A O no hydrogen 2.968 N/A THR 1075.A OG1 ALA 1072.A O no hydrogen 2.692 N/A ARG 1076.A N ALA 1072.A O no hydrogen 2.940 N/A ARG 1076.A NH1 GLU 1073.A OE1 no hydrogen 3.142 N/A ARG 1077.A N GLU 1073.A O no hydrogen 2.830 N/A MET 1078.A N GLU 1074.A O no hydrogen 2.987 N/A LEU 1079.A N THR 1075.A O no hydrogen 2.873 N/A HIS 1080.A N ARG 1076.A O no hydrogen 2.860 N/A HIS 1080.A ND1 ARG 1076.A O no hydrogen 3.201 N/A ARG 1081.A N ARG 1077.A O no hydrogen 2.856 N/A ARG 1081.A NH1 GLU 1074.A OE2 no hydrogen 3.476 N/A ALA 1082.A N MET 1078.A O no hydrogen 2.803 N/A PHE 1083.A N LEU 1079.A O no hydrogen 2.903 N/A ASP 1084.A N HIS 1080.A O no hydrogen 2.961 N/A THR 1085.A N ARG 1081.A O no hydrogen 2.843 N/A THR 1085.A OG1 ARG 1081.A O no hydrogen 2.068 N/A LEU 1086.A N ALA 1082.A O no hydrogen 2.823 N/A ALA 1087.A N PHE 1083.A O no hydrogen 3.081 N/A