Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1j9z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ GLU 53.A O no hydrogen 2.986 N/A LYS 3.A NZ TYR 55.A O no hydrogen 3.354 N/A LYS 3.A NZ ASP 89.A OD2 no hydrogen 2.808 N/A GLU 4.A N GLU 54.A O no hydrogen 2.451 N/A GLU 9.A N SER 6.A OG no hydrogen 3.099 N/A LYS 10.A N SER 6.A O no hydrogen 3.161 N/A LYS 10.A NZ TYR 55.A OH no hydrogen 3.419 N/A MET 11.A N PHE 7.A O no hydrogen 2.921 N/A LYS 12.A N VAL 8.A O no hydrogen 2.894 N/A LYS 12.A NZ GLU 65.A OE2 no hydrogen 2.675 N/A LYS 13.A N GLU 9.A O no hydrogen 2.993 N/A THR 14.A N MET 11.A O no hydrogen 3.147 N/A THR 14.A OG1 LYS 10.A O no hydrogen 2.650 N/A THR 14.A OG1 MET 11.A O no hydrogen 3.440 N/A GLY 15.A N LYS 12.A O no hydrogen 3.039 N/A ARG 16.A N MET 11.A O no hydrogen 2.914 N/A ASN 17.A N ARG 46.A O no hydrogen 2.738 N/A ASN 17.A ND2 LYS 68.A O no hydrogen 3.141 N/A ILE 18.A N ARG 46.A O no hydrogen 3.369 N/A ILE 19.A N LEU 70.A O no hydrogen 3.455 N/A VAL 20.A N MET 48.A O no hydrogen 2.813 N/A PHE 21.A N VAL 72.A O no hydrogen 2.925 N/A TYR 22.A N ALA 50.A O no hydrogen 3.215 N/A GLY 23.A N CYS 74.A O no hydrogen 2.864 N/A GLU 31.A N GLY 27.A O no hydrogen 2.939 N/A PHE 32.A N THR 28.A O no hydrogen 3.115 N/A ALA 33.A N ALA 29.A O no hydrogen 3.077 N/A ASN 34.A N GLU 30.A O no hydrogen 3.049 N/A ARG 35.A N GLU 31.A O no hydrogen 3.021 N/A ARG 35.A NH1 GLU 151.A OE1 no hydrogen 3.222 N/A LEU 36.A N PHE 32.A O no hydrogen 2.712 N/A SER 37.A N ALA 33.A O no hydrogen 2.629 N/A LYS 38.A N ASN 34.A O no hydrogen 2.915 N/A ASP 39.A N ARG 35.A O no hydrogen 2.874 N/A ALA 40.A N LEU 36.A O no hydrogen 3.161 N/A HIS 41.A N LYS 38.A O no hydrogen 3.143 N/A ARG 42.A N ASP 39.A O no hydrogen 2.912 N/A TYR 43.A N ALA 40.A O no hydrogen 3.024 N/A TYR 43.A OH GLU 176.A OE2 no hydrogen 3.397 N/A GLY 44.A N HIS 41.A O no hydrogen 3.133 N/A ARG 46.A N ASN 17.A OD1 no hydrogen 2.880 N/A MET 48.A N ILE 18.A O no hydrogen 3.019 N/A SER 49.A OG ASN 34.A OD1 no hydrogen 3.150 N/A ALA 50.A N VAL 20.A O no hydrogen 3.230 N/A GLU 53.A N ASP 51.A OD1 no hydrogen 2.570 N/A GLU 54.A N ASP 51.A O no hydrogen 2.845 N/A TYR 55.A N PRO 52.A O no hydrogen 3.058 N/A ALA 58.A N ASP 56.A OD1 no hydrogen 3.207 N/A ASP 59.A N ASP 56.A O no hydrogen 3.104 N/A LEU 60.A N LEU 57.A O no hydrogen 3.176 N/A SER 61.A N ALA 58.A O no hydrogen 3.440 N/A SER 62.A N ASP 59.A O no hydrogen 2.668 N/A SER 62.A OG ASP 59.A O no hydrogen 3.421 N/A LEU 63.A N ASP 59.A O no hydrogen 3.299 N/A LEU 63.A N LEU 60.A O no hydrogen 3.053 N/A GLU 65.A N SER 62.A O no hydrogen 2.882 N/A ILE 66.A N LEU 63.A O no hydrogen 3.172 N/A SER 69.A OG LEU 63.A O no hydrogen 2.990 N/A SER 69.A OG ILE 66.A O no hydrogen 3.188 N/A LEU 70.A N ASN 17.A O no hydrogen 3.304 N/A VAL 71.A N LYS 105.A O no hydrogen 2.898 N/A VAL 72.A N ILE 19.A O no hydrogen 2.997 N/A PHE 73.A N ALA 107.A O no hydrogen 3.007 N/A CYS 74.A N PHE 21.A O no hydrogen 2.896 N/A MET 75.A N PHE 109.A O no hydrogen 3.121 N/A ALA 76.A N GLY 23.A O no hydrogen 3.158 N/A THR 77.A N LEU 111.A O no hydrogen 3.324 N/A TYR 78.A N ASP 82.A O no hydrogen 2.839 N/A GLU 80.A N ASP 82.A OD2 no hydrogen 2.669 N/A ASP 82.A N TYR 78.A O no hydrogen 2.725 N/A THR 84.A OG1 ASN 86.A OD1 no hydrogen 3.435 N/A ALA 87.A N THR 84.A O no hydrogen 2.824 N/A GLN 88.A N ASP 85.A O no hydrogen 2.977 N/A TYR 91.A N ALA 87.A O no hydrogen 3.009 N/A ASP 92.A N GLN 88.A O no hydrogen 2.952 N/A TRP 93.A N ASP 89.A O no hydrogen 2.922 N/A LEU 94.A N PHE 90.A O no hydrogen 2.876 N/A GLN 95.A N TYR 91.A O no hydrogen 3.118 N/A GLN 95.A N ASP 92.A O no hydrogen 3.256 N/A GLU 96.A N ASP 92.A O no hydrogen 3.108 N/A THR 97.A N TRP 93.A O no hydrogen 2.830 N/A VAL 99.A N THR 97.A OG1 no hydrogen 3.307 N/A LEU 101.A N LEU 133.A O no hydrogen 3.401 N/A THR 102.A OG1 ASP 100.A OD1 no hydrogen 3.029 N/A THR 102.A OG1 ASP 100.A OD2 no hydrogen 3.155 N/A VAL 104.A N LEU 101.A O no hydrogen 2.933 N/A PHE 106.A N GLN 136.A O no hydrogen 3.137 N/A ALA 107.A N VAL 71.A O no hydrogen 3.066 N/A PHE 109.A N PHE 73.A O no hydrogen 2.897 N/A GLY 110.A N GLY 142.A O no hydrogen 2.606 N/A LEU 111.A N MET 75.A O no hydrogen 2.708 N/A GLY 112.A N GLY 144.A O no hydrogen 2.847 N/A LYS 114.A N ASP 145.A OD1 no hydrogen 2.692 N/A THR 115.A N ASN 113.A OD1 no hydrogen 3.200 N/A THR 115.A OG1 ASN 113.A OD1 no hydrogen 3.560 N/A TYR 116.A N ASN 113.A O no hydrogen 3.163 N/A TYR 116.A OH VAL 611.A O no hydrogen 3.421 N/A MET 122.A N THR 77.A OG1 no hydrogen 3.335 N/A LYS 124.A N ASN 120.A O no hydrogen 2.790 N/A TYR 125.A N ALA 121.A O no hydrogen 2.656 N/A VAL 126.A N MET 122.A O no hydrogen 2.796 N/A ASP 127.A N GLY 123.A O no hydrogen 3.113 N/A GLN 128.A N LYS 124.A O no hydrogen 3.126 N/A ARG 129.A N TYR 125.A O no hydrogen 2.596 N/A ARG 129.A NE LEU 94.A O no hydrogen 2.549 N/A ARG 129.A NH1 GLN 132.A OE1 no hydrogen 3.105 N/A ARG 129.A NH2 LEU 94.A O no hydrogen 2.881 N/A LEU 130.A N VAL 126.A O no hydrogen 2.892 N/A GLN 132.A N GLN 128.A O no hydrogen 3.375 N/A LEU 133.A N ARG 129.A O no hydrogen 3.060 N/A GLY 134.A N GLU 131.A O no hydrogen 2.637 N/A GLN 136.A N VAL 104.A O no hydrogen 2.590 N/A ARG 137.A NH1 ASP 127.A OD2 no hydrogen 2.832 N/A ARG 137.A NH2 GLU 131.A OE2 no hydrogen 2.959 N/A ILE 138.A N PHE 106.A O no hydrogen 2.867 N/A GLY 142.A N VAL 108.A O no hydrogen 2.773 N/A GLY 144.A N GLY 110.A O no hydrogen 2.842 N/A ASP 145.A N ASP 153.A OD2 no hydrogen 2.999 N/A ASP 146.A N GLY 112.A O no hydrogen 3.300 N/A GLY 148.A N ASP 145.A O no hydrogen 3.220 N/A GLU 152.A N ASN 149.A OD1 no hydrogen 3.155 N/A ASP 153.A N ASN 149.A O no hydrogen 2.986 N/A PHE 154.A N LEU 150.A O no hydrogen 2.708 N/A ILE 155.A N GLU 151.A O no hydrogen 2.881 N/A THR 156.A N GLU 152.A O no hydrogen 2.879 N/A THR 156.A OG1 GLU 152.A O no hydrogen 3.025 N/A TRP 157.A N ASP 153.A O no hydrogen 3.128 N/A TRP 157.A NE1 GLU 140.A O no hydrogen 3.181 N/A ARG 158.A N PHE 154.A O no hydrogen 2.762 N/A GLU 159.A N ILE 155.A O no hydrogen 2.907 N/A GLN 160.A N TRP 157.A O no hydrogen 3.012 N/A PHE 161.A N TRP 157.A O no hydrogen 2.908 N/A TRP 162.A N ARG 158.A O no hydrogen 3.309 N/A TRP 162.A NE1 ASP 39.A OD1 no hydrogen 3.299 N/A ALA 164.A N GLN 160.A O no hydrogen 3.405 N/A VAL 165.A N PHE 161.A O no hydrogen 2.953 N/A CYS 166.A N TRP 162.A O no hydrogen 2.685 N/A CYS 166.A SG VAL 171.A O no hydrogen 3.580 N/A GLU 167.A N PRO 163.A O no hydrogen 2.711 N/A PHE 168.A N ALA 164.A O no hydrogen 2.842 N/A PHE 169.A N VAL 165.A O no hydrogen 3.056 N/A GLY 170.A N GLU 167.A O no hydrogen 3.122 N/A VAL 171.A N CYS 166.A O no hydrogen 2.842 N/A GLU 176.A N THR 174.A O no hydrogen 2.378 N/A SER 179.A OG GLU 326.A OE2 no hydrogen 3.501 N/A SER 179.A OG GLN 329.A OE1 no hydrogen 3.306 N/A ARG 181.A NE GLU 384.A OE2 no hydrogen 2.710 N/A ARG 181.A NH1 ASP 380.A OD2 no hydrogen 2.557 N/A ARG 181.A NH2 ASP 380.A O no hydrogen 3.273 N/A ARG 181.A NH2 ASP 380.A OD2 no hydrogen 3.352 N/A ARG 181.A NH2 GLU 384.A OE2 no hydrogen 2.652 N/A GLN 182.A N GLU 384.A OE1 no hydrogen 2.739 N/A GLN 182.A NE2 TYR 183.A OH no hydrogen 3.137 N/A GLU 184.A N ASN 287.A O no hydrogen 2.755 N/A VAL 186.A N SER 285.A O no hydrogen 3.089 N/A HIS 188.A N ILE 283.A O no hydrogen 2.798 N/A LYS 195.A N ASP 192.A O no hydrogen 2.843 N/A VAL 196.A N VAL 193.A O no hydrogen 3.012 N/A TYR 197.A N PRO 302.A O no hydrogen 2.881 N/A THR 198.A N GLU 200.A OE2 no hydrogen 2.752 N/A THR 198.A OG1 GLU 200.A OE1 no hydrogen 3.452 N/A GLU 200.A N GLU 200.A OE2 no hydrogen 2.754 N/A LYS 205.A N GLU 200.A OE1 no hydrogen 3.190 N/A SER 206.A N ARG 203.A O no hydrogen 2.901 N/A SER 206.A OG ARG 203.A O no hydrogen 2.532 N/A ASN 209.A N LYS 205.A O no hydrogen 2.972 N/A GLN 210.A NE2 SER 206.A O no hydrogen 2.905 N/A GLN 210.A NE2 PRO 219.A O no hydrogen 3.235 N/A ASN 218.A N ASP 215.A O no hydrogen 2.762 N/A ASN 218.A ND2 LYS 211.A O no hydrogen 2.785 N/A ASN 218.A ND2 PRO 213.A O no hydrogen 2.611 N/A PHE 220.A N MET 446.A O no hydrogen 2.801 N/A LEU 221.A N GLN 210.A OE1 no hydrogen 2.549 N/A ALA 222.A N VAL 444.A O no hydrogen 3.252 N/A VAL 224.A N ALA 442.A O no hydrogen 2.597 N/A THR 225.A N GLU 242.A O no hydrogen 2.794 N/A ARG 228.A N HIS 240.A O no hydrogen 2.903 N/A ARG 228.A NH2 GLU 513.A OE2 no hydrogen 2.726 N/A LYS 229.A NZ GLY 233.A O no hydrogen 3.509 N/A LEU 230.A N LEU 238.A O no hydrogen 2.675 N/A ASN 231.A ND2 GLY 233.A O no hydrogen 2.858 N/A GLY 233.A N GLU 506.A O no hydrogen 3.220 N/A GLU 235.A N GLU 506.A OE1 no hydrogen 2.950 N/A ARG 236.A NH2 ASP 507.A OD2 no hydrogen 3.567 N/A LEU 238.A N ASN 231.A OD1 no hydrogen 2.573 N/A MET 239.A N ALA 411.A O no hydrogen 2.942 N/A HIS 240.A N ARG 228.A O no hydrogen 2.803 N/A HIS 240.A ND1 TYR 510.A OH no hydrogen 2.813 N/A HIS 240.A NE2 GLU 242.A OE1 no hydrogen 2.838 N/A LEU 241.A N ILE 409.A O no hydrogen 2.873 N/A GLU 242.A N ALA 226.A O no hydrogen 2.899 N/A LEU 243.A N VAL 407.A O no hydrogen 2.728 N/A ASP 244.A N ALA 223.A O no hydrogen 2.917 N/A ILE 245.A N ASN 405.A O no hydrogen 3.238 N/A SER 246.A N ASP 244.A OD1 no hydrogen 3.188 N/A SER 246.A OG ASP 244.A OD1 no hydrogen 2.719 N/A SER 248.A OG ILE 245.A O no hydrogen 2.514 N/A ILE 250.A N SER 248.A OG no hydrogen 3.304 N/A TYR 252.A OH SER 398.A OG no hydrogen 2.750 N/A TYR 252.A OH HIS 403.A O no hydrogen 2.788 N/A TYR 252.A OH SER 406.A O no hydrogen 2.689 N/A GLU 253.A N ASP 256.A OD2 no hydrogen 2.886 N/A SER 254.A OG SER 398.A O no hydrogen 3.550 N/A SER 254.A OG GLU 481.A OE1 no hydrogen 3.515 N/A ASP 256.A N GLU 253.A O no hydrogen 2.937 N/A HIS 257.A N ARG 449.A O no hydrogen 3.117 N/A HIS 257.A NE2 ASP 610.A OD2 no hydrogen 3.326 N/A VAL 258.A N TYR 394.A O no hydrogen 2.803 N/A ALA 259.A N PHE 447.A O no hydrogen 2.728 N/A VAL 260.A N ARG 392.A O no hydrogen 2.967 N/A TYR 261.A N PRO 445.A O no hydrogen 3.026 N/A TYR 261.A OH ALA 216.A O no hydrogen 2.934 N/A ASN 264.A N THR 310.A O no hydrogen 2.842 N/A ASN 264.A ND2 LEU 309.A O no hydrogen 2.750 N/A ASN 264.A ND2 THR 310.A O no hydrogen 3.416 N/A ASN 264.A ND2 LEU 313.A O no hydrogen 2.976 N/A LEU 268.A N ASP 265.A OD1 no hydrogen 2.755 N/A VAL 269.A N ASP 265.A O no hydrogen 2.851 N/A ASN 270.A N SER 266.A O no hydrogen 2.766 N/A GLN 271.A N ALA 267.A O no hydrogen 3.061 N/A ILE 272.A N LEU 268.A O no hydrogen 3.313 N/A GLY 273.A N VAL 269.A O no hydrogen 3.144 N/A GLU 274.A N ASN 270.A O no hydrogen 2.739 N/A ILE 275.A N GLN 271.A O no hydrogen 2.743 N/A LEU 276.A N GLY 273.A O no hydrogen 2.956 N/A GLY 277.A N GLU 274.A O no hydrogen 2.954 N/A ALA 278.A N GLY 273.A O no hydrogen 3.338 N/A ASP 281.A N ASP 279.A OD2 no hydrogen 2.966 N/A VAL 282.A N ASP 279.A O no hydrogen 2.973 N/A MET 284.A N THR 303.A O no hydrogen 2.823 N/A SER 285.A N VAL 186.A O no hydrogen 3.092 N/A ASN 287.A N GLU 184.A O no hydrogen 3.219 N/A ASN 288.A N LYS 296.A O no hydrogen 2.961 N/A LEU 289.A N GLN 182.A O no hydrogen 2.903 N/A GLU 292.A N ASP 290.A OD2 no hydrogen 2.593 N/A SER 293.A N ASP 290.A OD2 no hydrogen 3.234 N/A LYS 295.A N SER 293.A OG no hydrogen 3.213 N/A LYS 296.A N ASN 294.A O no hydrogen 2.837 N/A LYS 296.A NZ GLU 291.A O no hydrogen 3.264 N/A HIS 297.A ND1 LEU 286.A O no hydrogen 3.227 N/A CYS 301.A SG PHE 299.A O no hydrogen 3.152 N/A CYS 301.A SG PRO 300.A O no hydrogen 2.862 N/A THR 303.A N MET 284.A O no hydrogen 3.005 N/A THR 303.A OG1 TYR 197.A O no hydrogen 2.861 N/A THR 304.A OG1 THR 307.A OG1 no hydrogen 2.786 N/A ARG 306.A N LEU 280.A O no hydrogen 3.152 N/A ARG 306.A NE ASP 281.A OD2 no hydrogen 3.048 N/A ARG 306.A NH2 ASP 281.A OD1 no hydrogen 3.189 N/A THR 307.A OG1 THR 304.A OG1 no hydrogen 2.786 N/A ALA 308.A N THR 304.A O no hydrogen 2.966 N/A LEU 309.A N TYR 305.A O no hydrogen 2.776 N/A THR 310.A N ARG 306.A O no hydrogen 2.733 N/A THR 310.A OG1 ARG 306.A O no hydrogen 2.659 N/A TYR 311.A N THR 307.A O no hydrogen 2.722 N/A TYR 312.A N ALA 308.A O no hydrogen 2.875 N/A TYR 312.A OH GLU 200.A O no hydrogen 2.649 N/A LEU 313.A N ALA 308.A O no hydrogen 2.667 N/A ASP 314.A N PRO 387.A O no hydrogen 2.929 N/A THR 316.A N ASP 314.A OD2 no hydrogen 3.269 N/A THR 316.A OG1 ASP 314.A OD2 no hydrogen 3.515 N/A ASN 317.A N ASP 314.A OD2 no hydrogen 3.021 N/A ASN 317.A ND2 ASP 314.A OD1 no hydrogen 2.373 N/A ARG 320.A NE GLU 151.A OE1 no hydrogen 3.193 N/A THR 321.A N GLU 151.A OE2 no hydrogen 3.063 N/A THR 321.A OG1 GLU 151.A OE2 no hydrogen 2.474 N/A VAL 323.A N ARG 320.A O no hydrogen 2.680 N/A LEU 324.A N ARG 320.A O no hydrogen 3.207 N/A TYR 325.A N THR 321.A O no hydrogen 2.899 N/A GLU 326.A N ASN 322.A O no hydrogen 3.179 N/A LEU 327.A N VAL 323.A O no hydrogen 3.240 N/A LEU 327.A N LEU 324.A O no hydrogen 3.220 N/A ALA 328.A N LEU 324.A O no hydrogen 3.065 N/A ALA 328.A N TYR 325.A O no hydrogen 3.210 N/A TYR 330.A N LEU 327.A O no hydrogen 2.545 N/A TYR 330.A OH HIS 381.A ND1 no hydrogen 2.851 N/A ALA 331.A N ALA 328.A O no hydrogen 3.442 N/A SER 332.A N SER 374.A O no hydrogen 3.022 N/A SER 332.A OG SER 374.A O no hydrogen 3.419 N/A SER 335.A OG GLU 333.A OE2 no hydrogen 3.228 N/A GLN 337.A N GLU 333.A O no hydrogen 3.099 N/A GLU 338.A N PRO 334.A O no hydrogen 2.930 N/A HIS 339.A N SER 335.A O no hydrogen 3.419 N/A LEU 340.A N GLU 336.A O no hydrogen 3.238 N/A HIS 341.A N GLN 337.A O no hydrogen 3.119 N/A LYS 342.A N GLU 338.A O no hydrogen 2.797 N/A MET 343.A N HIS 339.A O no hydrogen 2.904 N/A MET 343.A N LEU 340.A O no hydrogen 3.233 N/A ALA 344.A N HIS 341.A O no hydrogen 3.279 N/A SER 345.A N LYS 342.A O no hydrogen 2.927 N/A SER 345.A OG LYS 342.A O no hydrogen 2.522 N/A SER 346.A OG GLU 159.A OE1 no hydrogen 2.629 N/A SER 346.A OG GLU 159.A OE2 no hydrogen 3.219 N/A LYS 351.A NZ SER 346.A O no hydrogen 2.788 N/A LEU 353.A N GLU 349.A O no hydrogen 2.865 N/A TYR 354.A N GLY 350.A O no hydrogen 3.063 N/A LEU 355.A N LYS 351.A O no hydrogen 2.868 N/A SER 356.A N GLU 352.A O no hydrogen 2.870 N/A SER 356.A OG GLU 352.A O no hydrogen 3.250 N/A TRP 357.A N LEU 353.A O no hydrogen 2.777 N/A VAL 359.A N TYR 354.A O no hydrogen 3.141 N/A GLU 360.A N LEU 355.A O no hydrogen 2.924 N/A ARG 362.A N VAL 359.A O no hydrogen 2.796 N/A ARG 362.A NE TYR 416.A OH no hydrogen 3.375 N/A ARG 362.A NH1 ASN 317.A OD1 no hydrogen 3.345 N/A ARG 363.A N VAL 358.A O no hydrogen 3.037 N/A ARG 363.A NE ASP 371.A OD1 no hydrogen 2.593 N/A ARG 363.A NH1 TRP 357.A O no hydrogen 2.817 N/A ARG 363.A NH2 ASP 371.A OD1 no hydrogen 2.924 N/A ALA 367.A N HIS 364.A ND1 no hydrogen 3.197 N/A ILE 368.A N HIS 364.A O no hydrogen 2.984 N/A LEU 369.A N ILE 365.A O no hydrogen 2.863 N/A GLN 370.A N LEU 366.A O no hydrogen 2.893 N/A ASP 371.A N ALA 367.A O no hydrogen 2.806 N/A TYR 372.A N ILE 368.A O no hydrogen 2.869 N/A SER 374.A N GLU 336.A OE2 no hydrogen 2.909 N/A SER 374.A OG GLU 336.A OE2 no hydrogen 2.430 N/A LEU 375.A N TYR 372.A O no hydrogen 2.627 N/A ARG 376.A N TYR 330.A O no hydrogen 2.845 N/A ARG 376.A NH1 LEU 369.A O no hydrogen 3.257 N/A ARG 376.A NH1 LEU 375.A O no hydrogen 2.374 N/A ARG 376.A NH2 LEU 369.A O no hydrogen 3.513 N/A HIS 381.A N PRO 378.A O no hydrogen 3.137 N/A HIS 381.A ND1 TYR 330.A OH no hydrogen 2.851 N/A LEU 382.A N PRO 378.A O no hydrogen 3.194 N/A CYS 383.A N ILE 379.A O no hydrogen 3.357 N/A CYS 383.A SG ILE 379.A O no hydrogen 3.364 N/A GLU 384.A N HIS 381.A O no hydrogen 3.268 N/A LEU 385.A N LEU 382.A O no hydrogen 2.803 N/A LEU 386.A N LEU 382.A O no hydrogen 2.887 N/A ARG 388.A NH1 TYR 312.A O no hydrogen 2.960 N/A LEU 389.A N TYR 312.A O no hydrogen 3.092 N/A GLN 390.A NE2 GLN 25.A O no hydrogen 3.482 N/A ARG 392.A N VAL 260.A O no hydrogen 3.009 N/A ARG 392.A NH2 GLN 390.A O no hydrogen 2.974 N/A TYR 394.A N VAL 258.A O no hydrogen 2.732 N/A SER 395.A OG ASP 610.A OD2 no hydrogen 3.163 N/A ILE 396.A N ASP 256.A O no hydrogen 2.992 N/A ALA 397.A N HIS 408.A O no hydrogen 2.822 N/A SER 398.A OG TYR 252.A OH no hydrogen 2.750 N/A SER 398.A OG SER 406.A O no hydrogen 3.261 N/A SER 399.A N GLN 480.A OE1 no hydrogen 2.750 N/A SER 399.A OG GLU 481.A OE1 no hydrogen 2.781 N/A SER 400.A OG GLU 253.A OE1 no hydrogen 3.151 N/A LYS 401.A N SER 399.A OG no hydrogen 3.280 N/A LYS 401.A NZ GLU 481.A OE2 no hydrogen 3.447 N/A VAL 402.A N SER 399.A O no hydrogen 3.028 N/A HIS 403.A N SER 399.A O no hydrogen 2.660 N/A SER 406.A N HIS 403.A O no hydrogen 3.030 N/A SER 406.A OG LEU 243.A O no hydrogen 3.019 N/A VAL 407.A N LEU 243.A O no hydrogen 2.803 N/A HIS 408.A N SER 398.A OG no hydrogen 3.343 N/A ILE 409.A N LEU 241.A O no hydrogen 2.751 N/A ALA 411.A N MET 239.A O no hydrogen 3.120 N/A ALA 413.A N HIS 237.A O no hydrogen 3.016 N/A VAL 414.A N THR 429.A OG1 no hydrogen 3.126 N/A TYR 416.A N ASN 424.A O no hydrogen 3.376 N/A TYR 416.A OH ASN 424.A OD1 no hydrogen 3.178 N/A ALA 418.A N ARG 422.A O no hydrogen 2.953 N/A GLY 421.A N ALA 418.A O no hydrogen 3.025 N/A ARG 422.A N SER 420.A OG no hydrogen 3.285 N/A ARG 422.A NH1 GLN 370.A OE1 no hydrogen 2.497 N/A ARG 422.A NH2 ASP 371.A OD1 no hydrogen 3.333 N/A ARG 422.A NH2 SER 420.A O no hydrogen 3.266 N/A ASN 424.A N TYR 416.A O no hydrogen 3.171 N/A GLY 426.A N VAL 414.A O no hydrogen 3.064 N/A THR 429.A OG1 GLY 426.A O no hydrogen 3.482 N/A SER 430.A N GLY 426.A O no hydrogen 3.087 N/A SER 430.A OG GLY 426.A O no hydrogen 2.975 N/A TRP 431.A N VAL 427.A O no hydrogen 3.232 N/A LEU 432.A N ALA 428.A O no hydrogen 2.697 N/A ARG 433.A N THR 429.A O no hydrogen 2.848 N/A ALA 434.A N SER 430.A O no hydrogen 3.139 N/A LYS 435.A N LEU 432.A O no hydrogen 2.887 N/A LYS 435.A NZ LEU 443.A O no hydrogen 2.890 N/A VAL 444.A N ALA 222.A O no hydrogen 2.694 N/A MET 446.A N PHE 220.A O no hydrogen 3.189 N/A PHE 447.A N ALA 259.A O no hydrogen 3.107 N/A ARG 449.A N HIS 257.A O no hydrogen 2.751 N/A SER 451.A N ASP 256.A OD1 no hydrogen 2.607 N/A SER 451.A OG GLY 255.A O no hydrogen 2.414 N/A PHE 453.A N SER 451.A OG no hydrogen 3.152 N/A ARG 454.A NH1 ASP 256.A OD1 no hydrogen 2.983 N/A ARG 454.A NH1 PHE 453.A O no hydrogen 3.053 N/A ARG 454.A NH2 ASP 256.A OD1 no hydrogen 3.029 N/A SER 459.A OG GLU 491.A O no hydrogen 2.808 N/A THR 461.A N LYS 458.A O no hydrogen 3.260 N/A THR 461.A OG1 LYS 458.A O no hydrogen 3.497 N/A VAL 463.A N GLU 494.A O no hydrogen 2.956 N/A ILE 464.A N HIS 561.A O no hydrogen 2.750 N/A MET 465.A N LEU 496.A O no hydrogen 2.957 N/A VAL 466.A N TYR 563.A O no hydrogen 2.828 N/A GLY 467.A N TYR 498.A O no hydrogen 2.853 N/A GLY 469.A N GLY 500.A O no hydrogen 2.858 N/A GLY 471.A N PRO 468.A O no hydrogen 2.589 N/A ALA 473.A N THR 470.A O no hydrogen 2.955 N/A MET 476.A N ILE 472.A O no hydrogen 3.057 N/A MET 476.A N ALA 473.A O no hydrogen 2.940 N/A PHE 478.A N PRO 474.A O no hydrogen 3.234 N/A ILE 479.A N PHE 475.A O no hydrogen 2.963 N/A GLN 480.A N MET 476.A O no hydrogen 3.006 N/A GLU 481.A N GLY 477.A O no hydrogen 2.955 N/A ARG 482.A N PHE 478.A O no hydrogen 2.826 N/A ARG 482.A NH1 GLU 494.A O no hydrogen 2.784 N/A ARG 482.A NH2 SER 459.A O no hydrogen 2.969 N/A ARG 482.A NH2 THR 461.A O no hydrogen 2.819 N/A ALA 483.A N ILE 479.A O no hydrogen 2.738 N/A ALA 483.A N GLN 480.A O no hydrogen 3.166 N/A TRP 484.A N GLN 480.A O no hydrogen 2.942 N/A LEU 485.A N GLU 481.A O no hydrogen 2.990 N/A ARG 486.A N ALA 483.A O no hydrogen 3.177 N/A ARG 486.A NH2 ASP 520.A O no hydrogen 2.781 N/A GLU 487.A N ALA 483.A O no hydrogen 3.142 N/A GLN 488.A N LEU 485.A O no hydrogen 3.157 N/A GLY 489.A N ARG 486.A O no hydrogen 3.020 N/A GLY 493.A N SER 459.A O no hydrogen 3.327 N/A THR 495.A N THR 524.A OG1 no hydrogen 2.681 N/A THR 495.A OG1 GLY 493.A O no hydrogen 3.549 N/A LEU 496.A N VAL 463.A O no hydrogen 3.013 N/A LEU 497.A N GLN 525.A O no hydrogen 3.228 N/A TYR 498.A N MET 465.A O no hydrogen 2.531 N/A TYR 498.A OH ASP 547.A OD1 no hydrogen 2.612 N/A TYR 499.A N ASN 527.A O no hydrogen 3.256 N/A TYR 499.A OH ASP 507.A O no hydrogen 2.802 N/A CYS 501.A N ALA 529.A O no hydrogen 3.245 N/A CYS 501.A SG ARG 503.A O no hydrogen 3.884 N/A ARG 502.A N ASP 507.A OD1 no hydrogen 2.623 N/A ARG 502.A NE GLU 235.A OE1 no hydrogen 2.670 N/A SER 504.A N GLU 533.A OE1 no hydrogen 2.673 N/A SER 504.A OG GLU 533.A OE1 no hydrogen 2.993 N/A GLU 506.A N ARG 503.A O no hydrogen 2.857 N/A LEU 509.A N TYR 499.A OH no hydrogen 2.866 N/A TYR 510.A OH HIS 240.A ND1 no hydrogen 2.813 N/A ARG 511.A NE GLU 512.A OE2 no hydrogen 2.968 N/A ARG 511.A NH1 SER 504.A O no hydrogen 2.459 N/A GLU 513.A N GLU 513.A OE1 no hydrogen 2.645 N/A LEU 514.A N TYR 510.A O no hydrogen 2.707 N/A ALA 515.A N ARG 511.A O no hydrogen 3.134 N/A ARG 516.A N GLU 512.A O no hydrogen 2.856 N/A PHE 517.A N GLU 513.A O no hydrogen 3.099 N/A HIS 518.A N LEU 514.A O no hydrogen 3.139 N/A LYS 519.A N ALA 515.A O no hydrogen 2.976 N/A ASP 520.A N ARG 516.A O no hydrogen 2.985 N/A GLY 521.A N HIS 518.A O no hydrogen 2.764 N/A LEU 523.A N PHE 517.A O no hydrogen 2.957 N/A THR 524.A OG1 THR 495.A O no hydrogen 3.275 N/A ALA 529.A N TYR 499.A O no hydrogen 2.886 N/A SER 531.A N CYS 501.A O no hydrogen 3.012 N/A SER 531.A OG CYS 501.A O no hydrogen 3.270 N/A ARG 532.A N ARG 502.A O no hydrogen 3.030 N/A GLN 534.A NE2 PHE 530.A O no hydrogen 2.924 N/A GLN 534.A NE2 HIS 536.A O no hydrogen 2.613 N/A GLN 541.A N GLN 541.A OE1 no hydrogen 2.558 N/A HIS 542.A N TYR 539.A O no hydrogen 3.267 N/A LEU 543.A N VAL 540.A O no hydrogen 2.855 N/A LEU 544.A N VAL 540.A O no hydrogen 3.088 N/A LYS 545.A N GLN 541.A O no hydrogen 2.622 N/A ARG 546.A N HIS 542.A O no hydrogen 2.923 N/A ARG 546.A NE ASP 547.A OD2 no hydrogen 2.842 N/A ARG 546.A NH2 ASP 547.A OD1 no hydrogen 3.211 N/A ARG 546.A NH2 ASP 547.A OD2 no hydrogen 3.517 N/A ASP 547.A N LEU 543.A O no hydrogen 2.921 N/A ASP 547.A N LEU 544.A O no hydrogen 3.039 N/A HIS 550.A NE2 GLU 494.A OE1 no hydrogen 2.605 N/A LEU 551.A N ASP 547.A O no hydrogen 2.951 N/A TRP 552.A N ARG 548.A O no hydrogen 3.044 N/A LYS 553.A N HIS 550.A O no hydrogen 2.734 N/A LEU 554.A N LEU 551.A O no hydrogen 2.768 N/A ILE 555.A N LEU 551.A O no hydrogen 2.840 N/A HIS 556.A N TRP 552.A O no hydrogen 2.855 N/A HIS 556.A ND1 TYR 597.A OH no hydrogen 3.246 N/A GLY 558.A N LYS 553.A O no hydrogen 3.107 N/A ALA 560.A N LEU 554.A O no hydrogen 2.589 N/A HIS 561.A N PRO 462.A O no hydrogen 2.590 N/A HIS 561.A ND1 TYR 563.A OH no hydrogen 3.290 N/A ILE 562.A N ARG 606.A O no hydrogen 2.711 N/A TYR 563.A N ILE 464.A O no hydrogen 2.684 N/A TYR 563.A OH ARG 454.A O no hydrogen 2.357 N/A TYR 563.A OH HIS 561.A ND1 no hydrogen 3.290 N/A VAL 564.A N SER 608.A O no hydrogen 2.790 N/A CYS 565.A N VAL 466.A O no hydrogen 3.078 N/A CYS 565.A SG GLY 471.A O no hydrogen 3.296 N/A CYS 565.A SG ASP 610.A O no hydrogen 3.490 N/A GLY 566.A N ASP 610.A O no hydrogen 3.265 N/A ALA 568.A N GLY 612.A O no hydrogen 2.987 N/A ARG 569.A N SER 613.A OG no hydrogen 3.097 N/A ASN 570.A N ASP 567.A OD1 no hydrogen 2.921 N/A MET 571.A N ASP 567.A OD1 no hydrogen 3.226 N/A ALA 572.A N ASP 567.A O no hydrogen 3.159 N/A LYS 573.A NZ ALA 568.A O no hydrogen 2.879 N/A ASP 574.A N ASN 570.A O no hydrogen 2.817 N/A VAL 575.A N MET 571.A O no hydrogen 3.013 N/A GLN 576.A N ALA 572.A O no hydrogen 2.887 N/A GLN 576.A NE2 GLU 117.A OE1 no hydrogen 2.455 N/A GLN 576.A NE2 TYR 580.A OH no hydrogen 2.902 N/A ASN 577.A N LYS 573.A O no hydrogen 3.134 N/A THR 578.A N ASP 574.A O no hydrogen 3.083 N/A THR 578.A OG1 ASP 574.A O no hydrogen 3.525 N/A PHE 579.A N VAL 575.A O no hydrogen 3.033 N/A TYR 580.A N GLN 576.A O no hydrogen 3.074 N/A ASP 581.A N ASN 577.A O no hydrogen 2.794 N/A ILE 582.A N THR 578.A O no hydrogen 2.906 N/A VAL 583.A N PHE 579.A O no hydrogen 2.954 N/A ALA 584.A N TYR 580.A O no hydrogen 2.682 N/A GLU 585.A N ASP 581.A O no hydrogen 2.935 N/A PHE 586.A N ILE 582.A O no hydrogen 3.006 N/A MET 589.A N ALA 584.A O no hydrogen 3.228 N/A ALA 594.A N GLU 590.A O no hydrogen 3.013 N/A VAL 595.A N HIS 591.A O no hydrogen 2.692 N/A ASP 596.A N THR 592.A O no hydrogen 3.047 N/A TYR 597.A N GLN 593.A O no hydrogen 2.993 N/A TYR 597.A OH HIS 556.A ND1 no hydrogen 3.246 N/A VAL 598.A N ALA 594.A O no hydrogen 2.932 N/A LYS 599.A N VAL 595.A O no hydrogen 3.015 N/A LYS 599.A NZ GLU 117.A OE2 no hydrogen 2.894 N/A LYS 600.A N ASP 596.A O no hydrogen 2.761 N/A LYS 600.A N TYR 597.A O no hydrogen 3.067 N/A LEU 601.A N TYR 597.A O no hydrogen 3.089 N/A MET 602.A N VAL 598.A O no hydrogen 2.900 N/A THR 603.A N LYS 599.A O no hydrogen 3.032 N/A THR 603.A OG1 LYS 600.A O no hydrogen 3.221 N/A LYS 604.A N LYS 600.A O no hydrogen 2.514 N/A ARG 606.A N LEU 601.A O no hydrogen 2.590 N/A ARG 606.A NE ALA 560.A O no hydrogen 2.954 N/A ARG 606.A NH1 ILE 555.A O no hydrogen 3.496 N/A ARG 606.A NH2 ILE 555.A O no hydrogen 2.770 N/A ARG 606.A NH2 ALA 560.A O no hydrogen 2.618 N/A SER 608.A N ILE 562.A O no hydrogen 2.815 N/A GLY 612.A N GLY 566.A O no hydrogen 3.164 N/A