Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ln6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N LEU 3.A O no hydrogen 3.010 N/A SER 7.A N LEU 4.A O no hydrogen 2.771 N/A SER 7.A OG HIS 8.A ND1 no hydrogen 2.870 N/A LEU 11.A N HIS 8.A O no hydrogen 3.188 N/A ILE 13.A N LEU 11.A O no hydrogen 3.234 N/A GLN 15.A N PRO 12.A O no hydrogen 3.125 N/A THR 17.A N GLY 145.A O no hydrogen 2.616 N/A THR 17.A OG1 GLY 145.A O no hydrogen 2.924 N/A PHE 18.A N ALA 68.A O no hydrogen 2.854 N/A GLY 19.A N ASN 143.A O no hydrogen 2.789 N/A LEU 20.A N THR 65.A OG1 no hydrogen 2.615 N/A GLU 21.A N HIS 141.A O no hydrogen 3.228 N/A ARG 22.A N LEU 63.A O no hydrogen 2.689 N/A SER 24.A N LEU 61.A O no hydrogen 2.578 N/A SER 24.A OG TRP 96.A O no hydrogen 2.606 N/A ARG 26.A N PRO 59.A O no hydrogen 3.167 N/A ARG 26.A NH1 GLU 93.A OE1 no hydrogen 2.729 N/A ARG 26.A NH2 THR 37.A O no hydrogen 2.703 N/A ARG 26.A NH2 GLU 58.A O no hydrogen 3.371 N/A ILE 27.A N TYR 94.A O no hydrogen 2.681 N/A HIS 28.A N ARG 33.A O no hydrogen 2.614 N/A GLN 29.A N ASP 92.A O no hydrogen 3.331 N/A THR 31.A N HIS 28.A ND1 no hydrogen 3.118 N/A THR 31.A OG1 HIS 28.A ND1 no hydrogen 3.146 N/A GLN 32.A N GLN 29.A O no hydrogen 2.873 N/A ARG 33.A N HIS 28.A O no hydrogen 2.944 N/A ALA 35.A N ARG 26.A O no hydrogen 3.121 N/A GLN 36.A NE2 ASP 108.A O no hydrogen 2.799 N/A HIS 39.A N GLU 58.A OE2 no hydrogen 3.300 N/A THR 42.A OG1 SER 88.A O no hydrogen 2.873 N/A SER 45.A OG ASN 47.A OD1 no hydrogen 2.553 N/A ARG 46.A NH2.B THR 54.A OG1 no hydrogen 2.630 N/A HIS 49.A N SER 45.A O no hydrogen 3.108 N/A HIS 49.A NE2 GLN 432.A O no hydrogen 2.725 N/A ILE 52.A N HIS 49.A ND1 no hydrogen 2.773 N/A GLN 53.A N GLU 62.A O no hydrogen 2.686 N/A GLN 53.A NE2 ARG 46.A O no hydrogen 2.792 N/A ASP 55.A N GLN 60.A O no hydrogen 3.295 N/A GLU 58.A N GLN 110.A O no hydrogen 3.314 N/A GLN 60.A NE2 GLN 135.A O no hydrogen 2.740 N/A LEU 61.A N SER 24.A O no hydrogen 2.544 N/A GLU 62.A N GLN 53.A O no hydrogen 2.572 N/A LEU 63.A N ARG 22.A O no hydrogen 2.539 N/A ILE 64.A N TYR 51.A O no hydrogen 2.468 N/A THR 65.A N LEU 20.A O no hydrogen 2.894 N/A THR 65.A OG1 LEU 20.A O no hydrogen 2.983 N/A THR 65.A OG1 PRO 66.A O no hydrogen 3.289 N/A ALA 68.A N PHE 18.A O no hydrogen 2.750 N/A LYS 69.A NZ ASP 70.A OD2 no hydrogen 3.015 N/A SER 71.A OG ASP 295.A OD1 no hydrogen 2.472 N/A SER 71.A OG ASP 295.A OD2 no hydrogen 3.555 N/A ALA 74.A N ASP 70.A O no hydrogen 3.244 N/A ALA 74.A N SER 71.A O no hydrogen 3.071 N/A ILE 75.A N SER 71.A O no hydrogen 2.983 N/A ARG 76.A N GLN 72.A O no hydrogen 3.210 N/A ARG 76.A NE GLY 415.A O no hydrogen 3.227 N/A ARG 76.A NH1 GLU 442.A OE2 no hydrogen 3.403 N/A ARG 76.A NH2 GLY 415.A O no hydrogen 2.628 N/A PHE 77.A N GLU 73.A O no hydrogen 3.327 N/A LEU 78.A N ALA 74.A O no hydrogen 2.894 N/A LYS 79.A N ILE 75.A O no hydrogen 2.863 N/A ALA 80.A N ARG 76.A O no hydrogen 2.924 N/A ILE 81.A N PHE 77.A O no hydrogen 3.064 N/A SER 82.A N LEU 78.A O no hydrogen 2.836 N/A SER 82.A OG LEU 78.A O no hydrogen 2.853 N/A ASP 83.A N LYS 79.A O no hydrogen 2.826 N/A VAL 84.A N ALA 80.A O no hydrogen 2.849 N/A ALA 85.A N ILE 81.A O no hydrogen 2.919 N/A GLY 86.A N SER 82.A O no hydrogen 2.660 N/A ARG 87.A N ASP 83.A O no hydrogen 2.993 N/A ARG 87.A NE ALA 406.A O no hydrogen 2.636 N/A ARG 87.A NH2 ALA 412.A O no hydrogen 2.536 N/A SER 88.A N VAL 84.A O no hydrogen 2.906 N/A SER 88.A N ALA 85.A O no hydrogen 3.171 N/A SER 88.A OG VAL 84.A O no hydrogen 2.843 N/A SER 88.A OG GLN 432.A OE1 no hydrogen 3.296 N/A ILE 89.A N ALA 85.A O no hydrogen 3.154 N/A GLU 93.A N ASN 90.A O no hydrogen 3.081 N/A TYR 94.A N ILE 27.A O no hydrogen 2.668 N/A TRP 96.A N LEU 25.A O no hydrogen 2.934 N/A TRP 96.A NE1 MET 100.A O no hydrogen 2.641 N/A SER 99.A OG ALA 191.A O no hydrogen 3.520 N/A ILE 109.A N ARG 105.A O no hydrogen 3.146 N/A ALA 112.A N TYR 56.A O no hydrogen 3.021 N/A GLN 113.A N GLU 58.A OE1 no hydrogen 2.897 N/A PHE 118.A N ASP 116.A OD1 no hydrogen 2.727 N/A GLU 119.A N ASP 116.A OD2 no hydrogen 2.721 N/A ASP 121.A N ALA 117.A O no hydrogen 3.146 N/A TYR 122.A N PHE 118.A O no hydrogen 3.046 N/A ARG 123.A N GLU 119.A O no hydrogen 2.843 N/A LYS 124.A N TYR 120.A O no hydrogen 2.683 N/A TYR 125.A N ASP 121.A O no hydrogen 2.573 N/A LEU 126.A N TYR 122.A O no hydrogen 2.778 N/A GLU 127.A N ARG 123.A O no hydrogen 2.829 N/A LYS 128.A N LYS 124.A O no hydrogen 2.997 N/A THR 129.A N TYR 125.A O no hydrogen 3.193 N/A TYR 130.A N LEU 126.A O no hydrogen 3.170 N/A GLN 135.A N LYS 132.A O no hydrogen 3.117 N/A SER 136.A N LEU 133.A O no hydrogen 3.246 N/A SER 136.A OG LEU 133.A O no hydrogen 3.016 N/A ILE 137.A N ILE 134.A O no hydrogen 3.339 N/A SER 138.A N SER 99.A O no hydrogen 2.908 N/A SER 138.A OG GLN 60.A OE1 no hydrogen 2.476 N/A SER 138.A OG SER 136.A O no hydrogen 3.242 N/A GLY 139.A N GLU 23.A OE1 no hydrogen 2.534 N/A HIS 141.A N GLU 21.A O no hydrogen 2.986 N/A TYR 142.A N PHE 276.A O no hydrogen 2.758 N/A TYR 142.A OH VAL 294.A O no hydrogen 2.907 N/A ASN 143.A N GLY 19.A O no hydrogen 3.148 N/A ASN 143.A ND2 GLU 21.A OE2 no hydrogen 3.437 N/A LEU 144.A N LEU 274.A O no hydrogen 3.085 N/A GLY 145.A N THR 17.A O no hydrogen 2.866 N/A LEU 146.A N TYR 171.A OH no hydrogen 3.182 N/A GLY 147.A N GLN 15.A O no hydrogen 3.254 N/A LEU 151.A N GLY 147.A O no hydrogen 2.728 N/A THR 152.A N GLN 148.A O no hydrogen 2.637 N/A THR 152.A OG1 GLN 148.A O no hydrogen 2.828 N/A THR 152.A OG1 GLN 148.A OE1 no hydrogen 3.414 N/A SER 153.A N GLU 149.A O no hydrogen 2.955 N/A LEU 154.A N LEU 150.A O no hydrogen 3.142 N/A PHE 155.A N LEU 151.A O no hydrogen 2.848 N/A GLU 156.A N THR 152.A O no hydrogen 3.107 N/A SER 158.A N LEU 154.A O no hydrogen 3.441 N/A SER 158.A OG LEU 154.A O no hydrogen 3.494 N/A SER 158.A OG PHE 155.A O no hydrogen 3.469 N/A GLN 159.A N PHE 155.A O no hydrogen 3.350 N/A PHE 166.A N ASN 162.A O no hydrogen 3.276 N/A GLN 167.A N ALA 163.A O no hydrogen 3.038 N/A ASN 168.A N ILE 164.A O no hydrogen 2.991 N/A ASN 168.A ND2 ILE 164.A O no hydrogen 2.698 N/A ASN 168.A ND2 LEU 267.A O no hydrogen 3.546 N/A GLN 169.A N ASP 165.A O no hydrogen 3.002 N/A LEU 170.A N PHE 166.A O no hydrogen 2.865 N/A TYR 171.A N GLN 167.A O no hydrogen 2.680 N/A MET 172.A N ASN 168.A O no hydrogen 2.886 N/A LYS 173.A N GLN 169.A O no hydrogen 2.940 N/A LEU 174.A N LEU 170.A O no hydrogen 3.043 N/A SER 175.A N TYR 171.A O no hydrogen 2.963 N/A SER 175.A OG TYR 171.A O no hydrogen 3.196 N/A SER 175.A OG MET 172.A O no hydrogen 2.637 N/A GLN 176.A N MET 172.A O no hydrogen 3.046 N/A ASN 177.A N LYS 173.A O no hydrogen 3.115 N/A ASN 177.A ND2 LYS 173.A O no hydrogen 2.758 N/A PHE 178.A N LEU 174.A O no hydrogen 2.675 N/A LEU 179.A N SER 175.A O no hydrogen 2.941 N/A ARG 180.A N GLN 176.A O no hydrogen 3.098 N/A TYR 181.A N ASN 177.A O no hydrogen 2.931 N/A LEU 184.A N TYR 181.A O no hydrogen 2.929 N/A THR 186.A N ARG 182.A O no hydrogen 3.204 N/A THR 186.A OG1 THR 278.A OG1 no hydrogen 3.334 N/A THR 186.A OG1 ASN 322.A OD1 no hydrogen 3.359 N/A TYR 187.A N TRP 183.A O no hydrogen 2.790 N/A TYR 187.A OH GLN 370.A O no hydrogen 2.827 N/A LEU 188.A N LEU 184.A O no hydrogen 2.962 N/A TYR 189.A N LEU 185.A O no hydrogen 3.196 N/A SER 192.A N ARG 209.A O no hydrogen 3.305 N/A SER 192.A OG ASP 280.A OD2 no hydrogen 3.185 N/A ASN 206.A N GLN 202.A O no hydrogen 2.804 N/A ASN 206.A ND2 LYS 203.A O no hydrogen 3.076 N/A VAL 208.A N PRO 193.A O no hydrogen 3.156 N/A ARG 209.A N SER 328.A O no hydrogen 2.674 N/A ARG 209.A NE ILE 325.A O no hydrogen 3.128 N/A ARG 209.A NH2 ILE 325.A O no hydrogen 3.131 N/A SER 210.A N ALA 326.A O no hydrogen 2.829 N/A SER 210.A OG SER 192.A OG no hydrogen 2.791 N/A SER 210.A OG ASP 280.A OD2 no hydrogen 2.817 N/A LEU 211.A N SER 192.A O no hydrogen 2.678 N/A ARG 212.A N SER 192.A OG no hydrogen 3.219 N/A ARG 212.A NE ASP 280.A OD1 no hydrogen 2.744 N/A ARG 212.A NH2 PHE 279.A O no hydrogen 2.733 N/A ASN 213.A N SER 210.A OG no hydrogen 3.375 N/A ASN 213.A ND2 SER 210.A OG no hydrogen 2.981 N/A ASN 213.A ND2 THR 278.A O no hydrogen 3.274 N/A ASN 213.A ND2 ASP 280.A OD1 no hydrogen 2.807 N/A SER 214.A N LEU 211.A O no hydrogen 2.825 N/A HIS 215.A N ASP 323.A OD2 no hydrogen 3.388 N/A HIS 215.A ND1 ASP 323.A OD2 no hydrogen 2.753 N/A GLY 217.A N SER 214.A O no hydrogen 3.157 N/A TYR 218.A OH GLN 135.A OE1 no hydrogen 3.148 N/A SER 230.A OG ASP 233.A OD1 no hydrogen 2.571 N/A ASP 233.A N SER 230.A OG no hydrogen 2.627 N/A TYR 234.A N SER 230.A O no hydrogen 2.792 N/A VAL 235.A N LEU 231.A O no hydrogen 2.649 N/A ASN 236.A N LYS 232.A O no hydrogen 2.585 N/A ASP 237.A N ASP 233.A O no hydrogen 2.989 N/A LEU 238.A N TYR 234.A O no hydrogen 2.926 N/A GLU 239.A N VAL 235.A O no hydrogen 3.038 N/A ASN 240.A N ASN 236.A O no hydrogen 3.171 N/A ALA 241.A N ASP 237.A O no hydrogen 2.956 N/A VAL 242.A N ASN 240.A O no hydrogen 2.664 N/A GLN 246.A N VAL 242.A O no hydrogen 3.035 N/A PHE 251.A N GLU 248.A O no hydrogen 3.004 N/A SER 253.A OG VAL 255.A O no hydrogen 3.569 N/A ARG 256.A N GLU 275.A O no hydrogen 3.000 N/A ARG 258.A N TYR 273.A O no hydrogen 3.194 N/A ASN 265.A N ALA 262.A O no hydrogen 2.791 N/A LEU 267.A N ARG 264.A O no hydrogen 3.219 N/A LYS 269.A N TYR 266.A O no hydrogen 2.781 N/A THR 272.A OG1 GLY 259.A O no hydrogen 3.224 N/A TYR 273.A N ARG 258.A O no hydrogen 3.486 N/A LEU 274.A N LEU 144.A O no hydrogen 3.126 N/A GLU 275.A N ARG 256.A O no hydrogen 3.123 N/A PHE 276.A N TYR 142.A O no hydrogen 2.559 N/A ARG 277.A N PRO 254.A O no hydrogen 2.958 N/A THR 278.A OG1 THR 186.A OG1 no hydrogen 3.334 N/A ASN 282.A N GLY 288.A O no hydrogen 3.149 N/A SER 285.A N ASN 282.A O no hydrogen 3.392 N/A SER 285.A OG ILE 289.A O no hydrogen 2.922 N/A GLY 288.A N SER 285.A O no hydrogen 2.698 N/A THR 290.A OG1 GLU 292.A OE1 no hydrogen 3.391 N/A THR 290.A OG1 THR 293.A OG1 no hydrogen 2.617 N/A GLU 292.A N GLU 292.A OE1 no hydrogen 2.589 N/A THR 293.A N THR 290.A OG1 no hydrogen 3.010 N/A THR 293.A OG1 THR 290.A OG1 no hydrogen 2.617 N/A VAL 294.A N THR 290.A O no hydrogen 2.806 N/A ASP 295.A N GLN 291.A O no hydrogen 2.706 N/A THR 296.A N GLU 292.A O no hydrogen 2.817 N/A THR 296.A OG1 GLU 292.A O no hydrogen 2.617 N/A VAL 297.A N THR 293.A O no hydrogen 3.088 N/A HIS 298.A N VAL 294.A O no hydrogen 3.078 N/A HIS 298.A NE2 LEU 14.A O no hydrogen 3.334 N/A LEU 299.A N ASP 295.A O no hydrogen 2.902 N/A PHE 300.A N THR 296.A O no hydrogen 2.768 N/A LEU 301.A N VAL 297.A O no hydrogen 2.717 N/A LEU 302.A N HIS 298.A O no hydrogen 2.943 N/A ALA 303.A N LEU 299.A O no hydrogen 2.626 N/A LEU 304.A N PHE 300.A O no hydrogen 3.347 N/A LEU 304.A N LEU 301.A O no hydrogen 3.140 N/A TRP 306.A N LEU 302.A O no hydrogen 3.362 N/A ILE 307.A N ALA 303.A O no hydrogen 2.664 N/A ASP 308.A N LEU 305.A O no hydrogen 3.154 N/A ASP 314.A N HIS 310.A O no hydrogen 3.095 N/A ILE 315.A N ILE 311.A O no hydrogen 3.045 N/A LYS 316.A N ASP 312.A O no hydrogen 3.229 N/A GLU 317.A N GLN 313.A O no hydrogen 2.778 N/A ALA 318.A N ASP 314.A O no hydrogen 2.936 N/A ASN 319.A N ILE 315.A O no hydrogen 3.272 N/A ASN 319.A ND2 ILE 315.A O no hydrogen 2.831 N/A LEU 321.A N GLU 317.A O no hydrogen 3.349 N/A ASN 322.A N ALA 318.A O no hydrogen 2.542 N/A ASP 323.A N ASN 319.A O no hydrogen 2.787 N/A LEU 324.A N ARG 320.A O no hydrogen 2.780 N/A ILE 325.A N LEU 321.A O no hydrogen 2.641 N/A ALA 326.A N ASN 322.A O no hydrogen 2.685 N/A LEU 327.A N ASP 323.A O no hydrogen 2.540 N/A SER 328.A N LEU 324.A O no hydrogen 2.734 N/A LEU 331.A N HIS 329.A ND1 no hydrogen 3.226 N/A GLU 332.A N HIS 329.A O no hydrogen 2.972 N/A ALA 338.A N PRO 335.A O no hydrogen 3.272 N/A ASP 342.A N PRO 339.A O no hydrogen 3.209 N/A VAL 344.A N VAL 340.A O no hydrogen 3.071 N/A ASP 345.A N SER 341.A O no hydrogen 3.043 N/A ALA 346.A N ASP 342.A O no hydrogen 3.174 N/A MET 347.A N LEU 343.A O no hydrogen 2.989 N/A GLN 348.A N VAL 344.A O no hydrogen 2.799 N/A SER 349.A N ASP 345.A O no hydrogen 2.557 N/A SER 349.A OG ASP 345.A O no hydrogen 2.522 N/A VAL 350.A N ALA 346.A O no hydrogen 2.726 N/A ILE 351.A N MET 347.A O no hydrogen 2.975 N/A GLN 352.A N GLN 348.A O no hydrogen 2.834 N/A HIS 353.A N SER 349.A O no hydrogen 2.703 N/A HIS 353.A NE2 SER 7.A O no hydrogen 2.845 N/A PHE 354.A N VAL 350.A O no hydrogen 2.940 N/A LEU 356.A N ILE 351.A O no hydrogen 3.195 N/A TYR 359.A OH ASP 295.A OD2 no hydrogen 2.799 N/A TYR 360.A N SER 357.A O no hydrogen 2.803 N/A GLN 361.A N SER 357.A O no hydrogen 3.289 N/A ASP 362.A N PRO 358.A O no hydrogen 2.708 N/A LEU 363.A N TYR 359.A O no hydrogen 3.090 N/A LEU 364.A N TYR 360.A O no hydrogen 3.175 N/A GLU 365.A N GLN 361.A O no hydrogen 3.119 N/A SER 366.A N ASP 362.A O no hydrogen 3.277 N/A SER 366.A OG ASP 362.A O no hydrogen 3.270 N/A SER 366.A OG LEU 363.A O no hydrogen 2.577 N/A VAL 367.A N LEU 363.A O no hydrogen 3.078 N/A LYS 368.A N LEU 364.A O no hydrogen 2.950 N/A LYS 368.A NZ GLU 365.A OE1 no hydrogen 3.288 N/A ARG 369.A N GLU 365.A O no hydrogen 2.968 N/A GLN 370.A N SER 366.A O no hydrogen 3.166 N/A GLN 370.A NE2 SER 366.A O no hydrogen 3.670 N/A ILE 371.A N VAL 367.A O no hydrogen 3.244 N/A GLN 372.A N LYS 368.A O no hydrogen 2.883 N/A SER 373.A N ARG 369.A O no hydrogen 2.908 N/A LEU 376.A N SER 373.A O no hydrogen 3.381 N/A THR 377.A N PRO 374.A O no hydrogen 2.986 N/A THR 377.A OG1.A TYR 187.A O no hydrogen 2.745 N/A THR 377.A OG1.A LEU 188.A O no hydrogen 2.796 N/A THR 377.A OG1.B PRO 374.A O no hydrogen 2.606 N/A VAL 378.A N LEU 188.A O no hydrogen 3.157 N/A GLY 380.A N THR 377.A O no hydrogen 2.875 N/A GLY 380.A N THR 377.A OG1.B no hydrogen 3.332 N/A GLN 381.A N THR 377.A O no hydrogen 3.456 N/A GLN 381.A NE2 GLU 375.A O no hydrogen 2.962 N/A LEU 382.A N VAL 378.A O no hydrogen 3.143 N/A LEU 383.A N ALA 379.A O no hydrogen 2.667 N/A MET 385.A N LEU 382.A O no hydrogen 2.853 N/A ILE 386.A N LEU 382.A O no hydrogen 3.293 N/A ILE 386.A N LEU 383.A O no hydrogen 3.155 N/A GLU 387.A N SER 390.A O no hydrogen 2.939 N/A SER 390.A N GLU 387.A O no hydrogen 2.902 N/A SER 390.A OG GLU 196.A OE1 no hydrogen 2.635 N/A GLU 392.A N SER 390.A OG no hydrogen 3.156 N/A GLY 395.A N LEU 391.A O no hydrogen 2.624 N/A GLN 396.A N GLU 392.A O no hydrogen 3.193 N/A ARG 397.A N THR 393.A O no hydrogen 3.119 N/A GLN 398.A N PHE 394.A O no hydrogen 2.777 N/A GLY 399.A N GLY 395.A O no hydrogen 2.855 N/A GLN 400.A N GLN 396.A O no hydrogen 2.987 N/A ILE 401.A N ARG 397.A O no hydrogen 3.276 N/A TYR 402.A N GLN 398.A O no hydrogen 2.816 N/A TYR 402.A OH PRO 283.A O no hydrogen 2.846 N/A HIS 403.A N GLY 399.A O no hydrogen 2.993 N/A ASP 404.A N GLN 400.A O no hydrogen 3.023 N/A ASP 404.A N ILE 401.A O no hydrogen 3.037 N/A TYR 405.A N ILE 401.A O no hydrogen 3.169 N/A ALA 406.A N TYR 402.A O no hydrogen 2.950 N/A TRP 407.A N ASP 404.A O no hydrogen 2.985 N/A GLU 408.A N TYR 405.A O no hydrogen 2.863 N/A TYR 411.A OH PRO 605.A O no hydrogen 3.071 N/A TYR 411.A OH HIS 611.A NE2 no hydrogen 2.958 N/A ALA 412.A N ALA 409.A O no hydrogen 2.898 N/A LEU 413.A N GLN 424.A OE1 no hydrogen 2.714 N/A LYS 414.A NZ ASP 83.A OD1 no hydrogen 3.302 N/A LYS 414.A NZ ASP 83.A OD2 no hydrogen 3.236 N/A LYS 414.A NZ TYR 405.A O no hydrogen 3.023 N/A TYR 416.A N LEU 413.A O no hydrogen 2.665 N/A GLU 417.A N GLU 417.A OE2 no hydrogen 2.813 N/A MET 419.A N TYR 416.A O no hydrogen 3.268 N/A THR 423.A N GLU 420.A O no hydrogen 2.702 N/A GLN 424.A N GLU 420.A O no hydrogen 2.883 N/A GLN 424.A NE2 MET 419.A O no hydrogen 2.999 N/A LEU 425.A N LEU 421.A O no hydrogen 3.116 N/A LEU 426.A N SER 422.A O no hydrogen 3.345 N/A LEU 427.A N THR 423.A O no hydrogen 2.809 N/A PHE 428.A N GLN 424.A O no hydrogen 2.966 N/A ASP 429.A N LEU 425.A O no hydrogen 2.957 N/A VAL 430.A N LEU 426.A O no hydrogen 2.985 N/A ILE 431.A N LEU 427.A O no hydrogen 2.934 N/A GLN 432.A N PHE 428.A O no hydrogen 2.915 N/A LYS 433.A N ASP 429.A O no hydrogen 2.763 N/A GLY 434.A N ILE 431.A O no hydrogen 3.390 N/A VAL 435.A N VAL 430.A O no hydrogen 3.020 N/A ASN 436.A N TRP 450.A O no hydrogen 3.006 N/A ASN 436.A ND2 TYR 51.A OH no hydrogen 3.250 N/A PHE 437.A N TYR 51.A OH no hydrogen 3.072 N/A GLU 438.A N LYS 448.A O no hydrogen 2.681 N/A LEU 440.A N PHE 446.A O no hydrogen 2.833 N/A ASP 441.A N PHE 446.A O no hydrogen 3.305 N/A GLN 443.A N ASP 441.A O no hydrogen 2.629 N/A GLN 445.A N GLU 442.A O no hydrogen 3.162 N/A LEU 447.A N VAL 458.A O no hydrogen 2.839 N/A LYS 448.A N GLU 438.A O no hydrogen 2.708 N/A LEU 449.A N GLU 456.A O no hydrogen 2.909 N/A TRP 450.A N ASN 436.A O no hydrogen 2.855 N/A HIS 451.A N HIS 454.A O no hydrogen 2.947 N/A HIS 454.A N HIS 451.A O no hydrogen 3.105 N/A GLU 456.A N LEU 449.A O no hydrogen 2.682 N/A VAL 458.A N LEU 447.A O no hydrogen 3.072 N/A LYS 459.A N MET 463.A O no hydrogen 3.014 N/A ASN 460.A N GLN 445.A O no hydrogen 2.857 N/A ASN 460.A ND2 GLU 420.A OE1 no hydrogen 3.278 N/A ASN 462.A N ASN 460.A O no hydrogen 2.843 N/A ASN 462.A ND2 PRO 715.A O no hydrogen 2.656 N/A MET 463.A N LYS 459.A O no hydrogen 3.014 N/A THR 464.A N ASP 467.A OD2 no hydrogen 3.179 N/A THR 464.A OG1 ASP 467.A OD2 no hydrogen 3.118 N/A SER 465.A OG GLU 456.A OE1 no hydrogen 3.276 N/A SER 465.A OG GLU 456.A OE2 no hydrogen 2.762 N/A ASP 467.A N THR 464.A O no hydrogen 3.302 N/A ASN 468.A N GLY 682.A O no hydrogen 2.955 N/A ILE 470.A N ASN 468.A OD1 no hydrogen 3.024 N/A VAL 471.A N ASN 468.A O no hydrogen 3.144 N/A ALA 474.A N ILE 470.A O no hydrogen 2.712 N/A ALA 474.A N VAL 471.A O no hydrogen 3.145 N/A ASN 477.A N ALA 474.A O no hydrogen 2.906 N/A VAL 479.A N ASN 477.A O no hydrogen 2.644 N/A VAL 480.A N ASN 477.A OD1 no hydrogen 2.779 N/A THR 481.A OG1 LYS 478.A O no hydrogen 2.594 N/A LYS 482.A N LYS 478.A O no hydrogen 3.110 N/A LYS 482.A NZ PRO 493.A O no hydrogen 2.715 N/A LYS 482.A NZ GLY 495.A O no hydrogen 3.140 N/A LYS 483.A N VAL 480.A O no hydrogen 2.715 N/A ILE 484.A N VAL 480.A O no hydrogen 3.285 N/A LEU 485.A N THR 481.A O no hydrogen 3.091 N/A ASP 486.A N LYS 482.A O no hydrogen 2.543 N/A GLU 487.A N LYS 483.A O no hydrogen 2.665 N/A LYS 488.A N ILE 484.A O no hydrogen 3.002 N/A LYS 488.A N LEU 485.A O no hydrogen 2.762 N/A HIS 489.A N ASP 486.A O no hydrogen 2.901 N/A PHE 490.A N LEU 485.A O no hydrogen 3.311 N/A THR 492.A OG1 ASP 486.A OD1 no hydrogen 2.935 N/A THR 492.A OG1 PHE 490.A O no hydrogen 3.099 N/A PHE 498.A N ILE 555.A O no hydrogen 3.119 N/A LYS 502.A N THR 499.A O no hydrogen 3.281 N/A ASN 506.A N GLU 503.A OE2 no hydrogen 2.791 N/A TYR 507.A N GLU 503.A O no hydrogen 3.256 N/A PHE 508.A N ALA 504.A O no hydrogen 2.791 N/A SER 509.A N LEU 505.A O no hydrogen 2.655 N/A GLN 510.A N ASN 506.A O no hydrogen 3.010 N/A ILE 511.A N TYR 507.A O no hydrogen 2.815 N/A ILE 516.A N PHE 532.A O no hydrogen 2.952 N/A VAL 517.A N GLU 558.A O no hydrogen 2.759 N/A VAL 518.A N SER 530.A O no hydrogen 2.713 N/A LYS 519.A N LEU 556.A O no hydrogen 2.871 N/A LYS 521.A N ALA 554.A O no hydrogen 2.893 N/A SER 530.A N VAL 518.A O no hydrogen 2.700 N/A SER 530.A OG VAL 518.A O no hydrogen 3.407 N/A SER 530.A OG ALA 544.A O no hydrogen 3.229 N/A PHE 532.A N ILE 516.A O no hydrogen 2.923 N/A LYS 533.A NZ TYR 560.A OH no hydrogen 3.303 N/A LYS 533.A NZ GLU 562.A OE2 no hydrogen 3.197 N/A SER 540.A OG ASN 537.A O no hydrogen 2.828 N/A TYR 541.A N ASN 537.A O no hydrogen 2.679 N/A TYR 541.A OH ALA 504.A O no hydrogen 3.275 N/A GLU 542.A N LEU 538.A O no hydrogen 3.111 N/A LYS 543.A N ALA 539.A O no hydrogen 3.215 N/A ALA 544.A N SER 540.A O no hydrogen 3.147 N/A ILE 545.A N TYR 541.A O no hydrogen 2.943 N/A ASP 546.A N GLU 542.A O no hydrogen 2.920 N/A ILE 547.A N LYS 543.A O no hydrogen 2.937 N/A ALA 548.A N ALA 544.A O no hydrogen 3.358 N/A PHE 549.A N ILE 545.A O no hydrogen 3.261 N/A THR 550.A N ASP 546.A O no hydrogen 2.975 N/A GLU 551.A N ILE 547.A O no hydrogen 2.897 N/A ASP 552.A N ALA 548.A O no hydrogen 2.722 N/A ALA 554.A N ASP 552.A OD1 no hydrogen 2.816 N/A LEU 556.A N LYS 519.A O no hydrogen 2.597 N/A GLU 558.A N VAL 517.A O no hydrogen 2.833 N/A TYR 560.A N PRO 515.A O no hydrogen 3.219 N/A TYR 560.A OH GLU 562.A OE2 no hydrogen 2.724 N/A THR 564.A N ILE 692.A O no hydrogen 2.886 N/A TYR 566.A N LEU 690.A O no hydrogen 2.996 N/A ARG 567.A N LEU 579.A O no hydrogen 2.903 N/A PHE 568.A N VAL 688.A O no hydrogen 2.682 N/A PHE 569.A N ALA 577.A O no hydrogen 3.111 N/A VAL 570.A N CYS 686.A O no hydrogen 3.198 N/A LEU 571.A N ASP 574.A O no hydrogen 3.142 N/A ASP 574.A N LEU 571.A O no hydrogen 2.864 N/A CYS 575.A SG ALA 577.A O no hydrogen 3.256 N/A ILE 576.A N PHE 569.A O no hydrogen 2.752 N/A VAL 578.A N THR 663.A OG1 no hydrogen 2.758 N/A LEU 579.A N ARG 567.A O no hydrogen 3.003 N/A LEU 580.A N ILE 660.A O no hydrogen 3.062 N/A VAL 582.A N ASP 658.A O no hydrogen 3.228 N/A VAL 586.A N ILE 645.A O no hydrogen 3.014 N/A GLY 588.A N THR 643.A O no hydrogen 2.886 N/A HIS 592.A N ASP 589.A O no hydrogen 2.994 N/A THR 593.A N GLN 596.A OE1 no hydrogen 3.256 N/A THR 593.A OG1 SER 595.A OG no hydrogen 2.989 N/A THR 593.A OG1 GLN 596.A OE1 no hydrogen 3.314 N/A ILE 594.A N SER 637.A O no hydrogen 3.090 N/A SER 595.A N VAL 635.A O no hydrogen 3.010 N/A SER 595.A OG THR 593.A OG1 no hydrogen 2.989 N/A GLN 596.A N THR 593.A OG1 no hydrogen 3.123 N/A LEU 597.A N THR 593.A O no hydrogen 3.007 N/A VAL 598.A N ILE 594.A O no hydrogen 2.948 N/A LYS 599.A N SER 595.A O no hydrogen 3.138 N/A LEU 600.A N GLN 596.A O no hydrogen 2.924 N/A LYS 601.A N LEU 597.A O no hydrogen 3.047 N/A LYS 601.A NZ ASN 585.A O no hydrogen 2.624 N/A LYS 601.A NZ ASP 658.A OD2 no hydrogen 3.024 N/A ASN 602.A N VAL 598.A O no hydrogen 2.803 N/A ASN 602.A ND2 ILE 618.A O no hydrogen 2.851 N/A GLN 603.A N LEU 600.A O no hydrogen 3.196 N/A ASN 604.A N LYS 601.A O no hydrogen 3.242 N/A LEU 606.A N ASN 604.A OD1 no hydrogen 3.202 N/A ARG 607.A N ASN 604.A O no hydrogen 3.173 N/A ARG 607.A NH1 GLY 656.A O no hydrogen 2.868 N/A ARG 607.A NH2 GLY 656.A O no hydrogen 3.206 N/A GLY 608.A N LEU 615.A O no hydrogen 2.802 N/A HIS 611.A NE2 TYR 411.A OH no hydrogen 2.958 N/A ARG 612.A NH2 GLY 608.A O no hydrogen 3.282 N/A SER 613.A OG LEU 606.A O no hydrogen 3.011 N/A SER 613.A OG LEU 615.A O no hydrogen 2.732 N/A LEU 615.A N LEU 606.A O no hydrogen 3.033 N/A ILE 618.A N ASN 602.A OD1 no hydrogen 2.698 N/A GLY 621.A N GLU 619.A O no hydrogen 2.569 N/A GLU 624.A N GLU 624.A OE2 no hydrogen 3.046 N/A GLN 625.A N GLY 621.A O no hydrogen 2.763 N/A GLN 625.A NE2 LEU 620.A O no hydrogen 3.401 N/A LEU 626.A N GLU 622.A O no hydrogen 3.129 N/A MET 627.A N VAL 623.A O no hydrogen 3.316 N/A LEU 628.A N GLU 624.A O no hydrogen 2.824 N/A GLU 629.A N GLN 625.A O no hydrogen 2.759 N/A GLN 630.A N LEU 626.A O no hydrogen 2.806 N/A GLN 631.A N MET 627.A O no hydrogen 3.011 N/A GLY 632.A N GLU 629.A O no hydrogen 2.716 N/A THR 634.A N SER 637.A OG no hydrogen 2.521 N/A THR 634.A OG1 TYR 633.A O no hydrogen 2.793 N/A SER 637.A OG THR 634.A O no hydrogen 2.689 N/A GLY 642.A N GLY 588.A O no hydrogen 2.961 N/A THR 643.A N PRO 640.A O no hydrogen 3.088 N/A THR 643.A OG1 PRO 640.A O no hydrogen 3.302 N/A ILE 645.A N VAL 586.A O no hydrogen 2.926 N/A LEU 647.A N ALA 584.A O no hydrogen 2.853 N/A SER 651.A OG ARG 581.A O no hydrogen 3.323 N/A THR 655.A OG1 ASN 652.A O no hydrogen 2.809 N/A GLY 656.A N ILE 653.A O no hydrogen 2.849 N/A GLY 657.A N ASN 652.A O no hydrogen 2.552 N/A ASP 658.A N VAL 582.A O no hydrogen 3.009 N/A ILE 660.A N LEU 580.A O no hydrogen 2.939 N/A ASP 661.A N GLU 725.A O no hydrogen 2.881 N/A VAL 662.A N VAL 578.A O no hydrogen 2.878 N/A THR 663.A N ASP 661.A OD2 no hydrogen 3.047 N/A THR 663.A OG1 VAL 578.A O no hydrogen 3.262 N/A THR 663.A OG1 ASP 661.A OD2 no hydrogen 2.768 N/A THR 663.A OG1 GLN 729.A OE1 no hydrogen 3.258 N/A THR 665.A OG1 VAL 662.A O no hydrogen 3.387 N/A MET 666.A N VAL 662.A O no hydrogen 2.959 N/A THR 669.A N ASP 667.A OD1 no hydrogen 3.283 N/A THR 669.A OG1 ASP 667.A OD1 no hydrogen 2.636 N/A TYR 670.A N ASP 667.A O no hydrogen 3.281 N/A TYR 670.A OH ASN 694.A O no hydrogen 2.724 N/A TYR 670.A OH GLN 697.A O no hydrogen 2.821 N/A TYR 670.A OH ASN 705.A OD1 no hydrogen 2.695 N/A LYS 671.A NZ THR 663.A O no hydrogen 3.503 N/A GLN 672.A N PRO 668.A O no hydrogen 3.035 N/A LEU 673.A N THR 669.A O no hydrogen 3.084 N/A ALA 674.A N TYR 670.A O no hydrogen 2.938 N/A ALA 675.A N GLN 672.A O no hydrogen 2.819 N/A GLU 676.A N GLN 672.A O no hydrogen 2.963 N/A MET 677.A N LEU 673.A O no hydrogen 2.926 N/A ALA 678.A N ALA 674.A O no hydrogen 3.151 N/A GLU 679.A N ALA 675.A O no hydrogen 2.728 N/A ALA 680.A N MET 677.A O no hydrogen 3.155 N/A MET 681.A N ALA 678.A O no hydrogen 3.135 N/A GLY 682.A N GLU 679.A O no hydrogen 3.080 N/A ALA 683.A N ALA 678.A O no hydrogen 3.090 N/A VAL 685.A N ASP 467.A OD1 no hydrogen 2.979 N/A GLY 687.A N ASN 712.A O no hydrogen 2.804 N/A VAL 688.A N PHE 568.A O no hydrogen 2.605 N/A LEU 690.A N TYR 566.A O no hydrogen 3.115 N/A ILE 691.A N THR 707.A O no hydrogen 3.146 N/A ILE 692.A N THR 564.A O no hydrogen 2.993 N/A THR 696.A N ASN 694.A OD1 no hydrogen 3.390 N/A THR 696.A OG1 ASN 694.A OD1 no hydrogen 2.694 N/A TYR 699.A N THR 669.A OG1 no hydrogen 3.281 N/A LYS 704.A N LYS 701.A O no hydrogen 2.714 N/A ASN 705.A N SER 700.A O no hydrogen 3.494 N/A THR 707.A N ILE 691.A O no hydrogen 3.400 N/A CYS 708.A N PRO 491.A O no hydrogen 3.077 N/A CYS 708.A SG GLU 710.A O no hydrogen 3.223 N/A ILE 709.A N ASP 689.A O no hydrogen 3.053 N/A ASN 712.A N GLY 687.A O no hydrogen 2.988 N/A ASN 714.A N ASN 712.A OD1 no hydrogen 3.145 N/A ASN 714.A ND2 ASN 460.A O no hydrogen 3.092 N/A ASN 714.A ND2 ASN 462.A OD1 no hydrogen 2.594 N/A MET 717.A N SER 422.A OG no hydrogen 3.255 N/A HIS 720.A N MET 717.A O no hydrogen 3.035 N/A THR 721.A OG1 GLN 729.A O no hydrogen 2.574 N/A TYR 722.A N TYR 718.A O no hydrogen 3.041 N/A CYS 723.A SG MET 719.A O no hydrogen 3.510 N/A CYS 723.A SG HIS 720.A O no hydrogen 3.285 N/A GLU 725.A N SER 659.A O no hydrogen 3.215 N/A GLY 728.A N ASP 661.A OD1 no hydrogen 2.686 N/A GLN 729.A NE2 ASP 661.A OD2 no hydrogen 3.315 N/A ARG 734.A N ILE 731.A O no hydrogen 3.211 N/A ILE 735.A N ILE 731.A O no hydrogen 3.429 N/A LEU 736.A N THR 732.A O no hydrogen 3.437 N/A ALA 737.A N PRO 733.A O no hydrogen 2.949 N/A LYS 738.A N ARG 734.A O no hydrogen 2.903 N/A LEU 739.A N ILE 735.A O no hydrogen 2.869 N/A PHE 740.A N LEU 736.A O no hydrogen 3.078 N/A GLU 742.A N GLU 742.A OE1 no hydrogen 3.198 N/A