Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ya1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A ND1 ASP 59.A OD2 no hydrogen 2.803 N/A ALA 4.A N ALA 1.A O no hydrogen 3.278 N/A SER 5.A OG ASN 7.A OD1 no hydrogen 3.467 N/A PHE 9.A N VAL 60.A O no hydrogen 2.814 N/A ARG 10.A N ASN 95.A O no hydrogen 3.006 N/A ARG 10.A NE ASP 59.A OD1 no hydrogen 2.721 N/A ARG 10.A NH2 ASP 59.A OD1 no hydrogen 3.560 N/A ARG 10.A NH2 ASP 59.A OD2 no hydrogen 2.816 N/A ILE 11.A N LEU 58.A O no hydrogen 2.877 N/A HIS 12.A N ALA 97.A O no hydrogen 2.965 N/A HIS 12.A NE2 GLU 96.A OE1 no hydrogen 2.752 N/A VAL 13.A N TYR 56.A O no hydrogen 2.538 N/A LYS 14.A N LEU 99.A O no hydrogen 3.037 N/A GLU 18.A N GLN 24.A OE1 no hydrogen 2.658 N/A LYS 21.A NZ LYS 47.A O no hydrogen 3.368 N/A ASP 22.A N ASN 20.A OD1 no hydrogen 2.955 N/A ALA 23.A N ASN 20.A O no hydrogen 3.110 N/A GLN 24.A N LYS 21.A O no hydrogen 3.395 N/A GLN 24.A NE2 GLU 18.A O no hydrogen 2.837 N/A GLN 24.A NE2 ASN 20.A O no hydrogen 2.690 N/A GLY 25.A N ASN 74.A O no hydrogen 2.967 N/A LEU 26.A N LEU 44.A O no hydrogen 2.622 N/A TRP 27.A N LEU 72.A O no hydrogen 2.981 N/A THR 28.A N SER 36.A OG no hydrogen 2.951 N/A THR 28.A OG1 SER 36.A OG no hydrogen 3.362 N/A TRP 29.A N SER 70.A O no hydrogen 2.870 N/A ASP 31.A N LYS 68.A O no hydrogen 2.756 N/A VAL 32.A N ASP 30.A O no hydrogen 2.693 N/A GLU 33.A N LYS 61.A O no hydrogen 3.001 N/A SER 36.A N THR 28.A O no hydrogen 2.887 N/A SER 36.A OG THR 28.A O no hydrogen 3.514 N/A SER 36.A OG THR 28.A OG1 no hydrogen 3.362 N/A TRP 39.A NE1 GLY 78.A O no hydrogen 2.952 N/A GLY 42.A N ASN 38.A O no hydrogen 2.922 N/A ALA 43.A N PRO 40.A O no hydrogen 3.120 N/A LEU 44.A N LEU 26.A O no hydrogen 2.833 N/A PHE 46.A N GLN 24.A O no hydrogen 3.110 N/A LYS 47.A N SER 45.A OG no hydrogen 2.901 N/A ALA 49.A N PHE 46.A O no hydrogen 3.121 N/A ASP 52.A N GLY 55.A O no hydrogen 2.830 N/A GLY 55.A N ASP 52.A O no hydrogen 3.253 N/A GLY 55.A N ASP 52.A OD1 no hydrogen 2.890 N/A TYR 56.A N VAL 13.A O no hydrogen 3.133 N/A TYR 57.A N LYS 50.A O no hydrogen 2.862 N/A LEU 58.A N ILE 11.A O no hydrogen 2.855 N/A VAL 60.A N PHE 9.A O no hydrogen 2.796 N/A LEU 62.A N ASN 7.A O no hydrogen 2.622 N/A LYS 63.A NZ ASP 31.A OD1 no hydrogen 3.170 N/A LYS 67.A N ASP 31.A OD2 no hydrogen 3.043 N/A LYS 68.A N ASP 31.A OD2 no hydrogen 2.722 N/A ILE 69.A N VAL 87.A O no hydrogen 2.971 N/A SER 70.A N TRP 29.A O no hydrogen 3.089 N/A SER 70.A OG ASP 30.A OD2 no hydrogen 2.382 N/A PHE 71.A N LYS 85.A O no hydrogen 2.901 N/A LEU 72.A N TRP 27.A O no hydrogen 3.011 N/A ILE 73.A N THR 82.A OG1 no hydrogen 3.111 N/A ASN 74.A N GLY 25.A O no hydrogen 2.927 N/A ASN 74.A ND2 PRO 40.A O no hydrogen 2.889 N/A ASN 75.A N LYS 79.A O no hydrogen 3.346 N/A ASN 75.A ND2 GLU 18.A OE1 no hydrogen 2.811 N/A THR 76.A N ALA 23.A O no hydrogen 2.844 N/A THR 76.A OG1 GLU 801.A O no hydrogen 2.394 N/A ALA 77.A N ASN 75.A OD1 no hydrogen 3.060 N/A GLY 78.A N ASN 806.A OD1 no hydrogen 3.171 N/A LYS 79.A N ASN 75.A OD1 no hydrogen 2.725 N/A ASN 80.A ND2 ASP 84.A OD1 no hydrogen 2.846 N/A LEU 81.A N ILE 73.A O no hydrogen 2.837 N/A THR 82.A OG1 GLY 83.A O no hydrogen 2.546 N/A GLY 83.A N ASN 80.A OD1 no hydrogen 2.805 N/A LYS 85.A N PHE 71.A O no hydrogen 2.756 N/A LYS 85.A NZ TYR 103.A O no hydrogen 2.632 N/A VAL 87.A N ILE 69.A O no hydrogen 2.764 N/A LYS 89.A N LYS 67.A O no hydrogen 2.633 N/A LYS 89.A NZ MET 94.A O no hydrogen 2.930 N/A MET 94.A N VAL 91.A O no hydrogen 2.982 N/A ALA 97.A N ARG 10.A O no hydrogen 2.869 N/A TRP 98.A N PHE 106.A O no hydrogen 2.948 N/A LEU 99.A N HIS 12.A O no hydrogen 2.941 N/A ASP 100.A N LYS 104.A O no hydrogen 2.959 N/A ASP 102.A N ASP 100.A OD1 no hydrogen 3.012 N/A TYR 103.A N ASP 100.A O no hydrogen 2.697 N/A LYS 104.A N ASP 100.A OD1 no hydrogen 2.661 N/A PHE 106.A N TRP 98.A O no hydrogen 2.966 N/A TYR 108.A OH HIS 202.A ND1 no hydrogen 2.785 N/A GLN 111.A N SER 203.A OG no hydrogen 2.743 N/A GLN 111.A NE2 GLU 109.A O no hydrogen 3.389 N/A VAL 116.A N ILE 164.A O no hydrogen 3.248 N/A ARG 117.A N SER 203.A O no hydrogen 2.846 N/A ARG 117.A NE ASP 163.A OD1 no hydrogen 2.772 N/A ARG 117.A NH2 ASP 163.A OD2 no hydrogen 2.857 N/A VAL 118.A N ILE 162.A O no hydrogen 2.723 N/A ASN 119.A N ILE 205.A O no hydrogen 3.004 N/A ASN 119.A ND2 GLN 204.A OE1 no hydrogen 2.598 N/A ASN 119.A ND2 ILE 205.A O no hydrogen 3.029 N/A TYR 120.A N ARG 160.A O no hydrogen 2.809 N/A TYR 120.A OH ASP 209.A O no hydrogen 2.628 N/A TYR 121.A N LEU 207.A O no hydrogen 2.765 N/A ARG 122.A N TYR 127.A OH no hydrogen 3.076 N/A ARG 122.A NE ASP 124.A OD1 no hydrogen 2.927 N/A ARG 122.A NE ASN 126.A O no hydrogen 3.131 N/A ARG 122.A NH1 TYR 120.A OH no hydrogen 2.826 N/A ARG 122.A NH2 ASP 124.A OD2 no hydrogen 2.838 N/A THR 123.A N ASP 209.A OD1 no hydrogen 2.801 N/A THR 123.A OG1 ASP 209.A OD1 no hydrogen 3.564 N/A THR 123.A OG1 ASP 209.A OD2 no hydrogen 2.685 N/A GLY 125.A N ARG 122.A O no hydrogen 2.677 N/A ASN 126.A N ASP 124.A OD1 no hydrogen 3.059 N/A ASP 128.A N ASN 126.A OD1 no hydrogen 3.187 N/A LYS 130.A N TYR 127.A O no hydrogen 3.087 N/A LYS 130.A NZ ASN 126.A O no hydrogen 2.819 N/A SER 131.A N LEU 178.A O no hydrogen 2.996 N/A SER 131.A OG GLU 180.A OE2 no hydrogen 2.726 N/A LEU 132.A N THR 150.A O no hydrogen 2.800 N/A TRP 133.A N LEU 176.A O no hydrogen 2.942 N/A TYR 134.A N SER 142.A OG no hydrogen 2.677 N/A TYR 134.A OH ASN 140.A O no hydrogen 3.272 N/A TRP 135.A N GLY 174.A O no hydrogen 3.033 N/A ASP 137.A N GLU 172.A O no hydrogen 2.936 N/A VAL 138.A N GLY 136.A O no hydrogen 2.706 N/A LYS 139.A N PRO 165.A O no hydrogen 3.031 N/A SER 142.A N TYR 134.A O no hydrogen 2.965 N/A SER 142.A OG TYR 134.A O no hydrogen 3.282 N/A ASP 148.A N GLN 145.A O no hydrogen 2.959 N/A GLY 149.A N GLU 180.A OE2 no hydrogen 3.263 N/A THR 150.A N LEU 132.A O no hydrogen 2.730 N/A PHE 152.A N LYS 130.A O no hydrogen 2.945 N/A GLY 156.A N GLY 159.A O no hydrogen 3.027 N/A LYS 157.A NZ GLU 96.A OE2 no hydrogen 2.855 N/A ARG 160.A NH1 PHE 152.A O no hydrogen 2.794 N/A TYR 161.A N ALA 154.A O no hydrogen 3.038 N/A ILE 162.A N VAL 118.A O no hydrogen 2.896 N/A ILE 164.A N VAL 116.A O no hydrogen 2.988 N/A LEU 166.A N GLY 114.A O no hydrogen 2.738 N/A ASN 167.A N ASP 137.A O no hydrogen 3.182 N/A ARG 171.A N ASP 137.A OD2 no hydrogen 3.065 N/A ARG 171.A NE ALA 170.A O no hydrogen 3.258 N/A ARG 171.A NH2 ALA 170.A O no hydrogen 3.436 N/A GLU 172.A N ASP 137.A OD2 no hydrogen 2.920 N/A PHE 173.A N PHE 196.A O no hydrogen 3.142 N/A GLY 174.A N TRP 135.A O no hydrogen 2.800 N/A PHE 175.A N TYR 194.A O no hydrogen 2.863 N/A LEU 176.A N TRP 133.A O no hydrogen 2.705 N/A LEU 178.A N SER 131.A O no hydrogen 2.794 N/A ASP 179.A N VAL 187.A O no hydrogen 2.775 N/A GLU 180.A N LYS 129.A O no hydrogen 2.813 N/A SER 181.A N ASP 179.A OD1 no hydrogen 3.195 N/A SER 181.A OG ASP 179.A OD1 no hydrogen 2.660 N/A SER 181.A OG ASP 179.A OD2 no hydrogen 3.351 N/A LYS 182.A N ASP 179.A O no hydrogen 3.141 N/A ASP 186.A N GLN 183.A O no hydrogen 3.090 N/A VAL 187.A N GLY 184.A O no hydrogen 3.376 N/A LYS 188.A N ASP 185.A O no hydrogen 2.959 N/A ILE 189.A N LEU 177.A O no hydrogen 2.983 N/A ARG 190.A NE GLU 192.A OE2 no hydrogen 3.037 N/A ARG 190.A NH1 ASP 210.A O no hydrogen 2.804 N/A ARG 190.A NH2 GLU 192.A OE2 no hydrogen 2.977 N/A LYS 191.A NZ LYS 188.A O no hydrogen 3.079 N/A GLU 192.A N GLU 192.A OE1 no hydrogen 2.795 N/A TYR 194.A N PHE 175.A O no hydrogen 2.966 N/A TYR 194.A OH ASP 211.A O no hydrogen 2.798 N/A PHE 196.A N PHE 173.A O no hydrogen 2.789 N/A LEU 199.A N ARG 171.A O no hydrogen 3.263 N/A ASN 201.A N ASP 198.A O no hydrogen 3.418 N/A HIS 202.A N ASP 198.A O no hydrogen 3.263 N/A HIS 202.A ND1 TYR 108.A OH no hydrogen 2.785 N/A SER 203.A N TYR 108.A OH no hydrogen 3.235 N/A GLN 204.A NE2 GLU 109.A O no hydrogen 2.688 N/A ILE 205.A N ARG 117.A O no hydrogen 3.059 N/A PHE 206.A N TYR 215.A O no hydrogen 2.900 N/A LEU 207.A N ASN 119.A O no hydrogen 2.644 N/A LYS 208.A NZ ASP 211.A OD2 no hydrogen 2.908 N/A ASP 209.A N TYR 121.A O no hydrogen 2.810 N/A ASP 211.A N LYS 208.A O no hydrogen 2.934 N/A SER 213.A N ASP 211.A OD1 no hydrogen 2.954 N/A SER 213.A OG HIS 222.A NE2 no hydrogen 3.404 N/A TYR 215.A N PHE 206.A O no hydrogen 3.009 N/A TYR 215.A OH ASP 211.A OD2 no hydrogen 2.700 N/A TYR 215.A OH HIS 222.A NE2 no hydrogen 3.257 N/A ARG 225.A N SER 236.A OG no hydrogen 3.249 N/A ARG 225.A NE HIS 222.A O no hydrogen 3.275 N/A THR 227.A N SER 234.A O no hydrogen 2.592 N/A GLY 228.A N SER 234.A O no hydrogen 3.417 N/A GLN 230.A N GLU 232.A O no hydrogen 3.261 N/A SER 233.A N VAL 255.A O no hydrogen 2.555 N/A SER 233.A OG GLY 228.A O no hydrogen 2.915 N/A SER 234.A N GLY 228.A O no hydrogen 3.080 N/A PHE 235.A N LYS 253.A O no hydrogen 3.303 N/A SER 236.A N ARG 225.A O no hydrogen 3.009 N/A SER 236.A OG ASP 223.A O no hydrogen 2.733 N/A SER 236.A OG ARG 225.A O no hydrogen 3.431 N/A LEU 238.A N THR 237.A OG1 no hydrogen 2.793 N/A SER 243.A N LEU 240.A O no hydrogen 3.479 N/A SER 243.A OG ILE 239.A O no hydrogen 2.729 N/A ASN 244.A N SER 264.A O no hydrogen 3.012 N/A THR 246.A N THR 262.A O no hydrogen 3.281 N/A LYS 253.A N GLU 250.A O no hydrogen 3.178 N/A LYS 253.A NZ PHE 235.A O no hydrogen 2.895 N/A LYS 254.A N ASP 249.A O no hydrogen 2.685 N/A VAL 255.A N SER 233.A O no hydrogen 3.144 N/A VAL 263.A N PHE 270.A O no hydrogen 2.973 N/A SER 264.A N ASN 244.A O no hydrogen 3.137 N/A TYR 265.A N ASP 268.A O no hydrogen 3.330 N/A ASN 266.A N HIS 242.A O no hydrogen 3.193 N/A ASP 268.A N TYR 265.A O no hydrogen 3.315 N/A PHE 270.A N VAL 263.A O no hydrogen 2.772 N/A THR 272.A N TYR 261.A O no hydrogen 2.999 N/A SER 275.A N HIS 231.A O no hydrogen 3.300 N/A LEU 278.A N SER 275.A OG no hydrogen 2.794 N/A LYS 279.A N SER 275.A O no hydrogen 3.183 N/A LYS 279.A NZ GLU 564.A OE2 no hydrogen 3.375 N/A LYS 279.A NZ PRO 565.A O no hydrogen 3.223 N/A ASP 280.A N TRP 276.A O no hydrogen 2.935 N/A GLU 281.A N ARG 277.A O no hydrogen 3.178 N/A THR 282.A N LEU 278.A O no hydrogen 3.364 N/A THR 282.A N LYS 279.A O no hydrogen 3.271 N/A THR 282.A OG1 LEU 278.A O no hydrogen 3.051 N/A TYR 283.A N LYS 279.A O no hydrogen 2.849 N/A SER 284.A N ASP 280.A O no hydrogen 3.277 N/A TYR 285.A OH LYS 288.A O no hydrogen 3.425 N/A GLY 290.A N THR 303.A O no hydrogen 3.112 N/A ASP 292.A N ASP 301.A O no hydrogen 3.030 N/A LYS 294.A N GLN 299.A O no hydrogen 2.764 N/A GLY 297.A N LYS 294.A O no hydrogen 2.847 N/A LYS 298.A N GLU 295.A O no hydrogen 3.065 N/A LYS 298.A NZ GLU 296.A O no hydrogen 3.110 N/A GLN 299.A N LYS 294.A O no hydrogen 3.240 N/A GLN 299.A NE2 ASP 301.A OD1 no hydrogen 3.097 N/A VAL 300.A N LEU 343.A O no hydrogen 2.683 N/A ASP 301.A N ASP 292.A O no hydrogen 2.939 N/A LEU 302.A N GLN 341.A O no hydrogen 2.823 N/A THR 303.A N GLY 290.A O no hydrogen 2.977 N/A LEU 304.A N TRP 339.A O no hydrogen 2.891 N/A TRP 305.A NE1 TYR 283.A O no hydrogen 2.882 N/A SER 306.A N GLY 337.A O no hydrogen 2.949 N/A SER 306.A OG LEU 563.A O no hydrogen 2.752 N/A SER 308.A N GLU 564.A OE1 no hydrogen 3.014 N/A SER 308.A OG GLU 564.A OE1 no hydrogen 3.522 N/A SER 308.A OG GLU 564.A OE2 no hydrogen 2.424 N/A ALA 309.A N SER 306.A O no hydrogen 3.356 N/A ASP 310.A N GLU 364.A O no hydrogen 2.737 N/A LYS 311.A N GLU 364.A O no hydrogen 3.431 N/A SER 313.A N GLN 362.A O no hydrogen 2.956 N/A VAL 314.A N VAL 329.A O no hydrogen 3.067 N/A VAL 315.A N GLN 360.A O no hydrogen 2.853 N/A VAL 316.A N GLY 327.A O no hydrogen 3.055 N/A TYR 317.A N TYR 358.A O no hydrogen 2.791 N/A TYR 317.A OH GLN 360.A OE1 no hydrogen 2.665 N/A ASP 318.A N LYS 324.A O no hydrogen 2.999 N/A ASN 320.A N ASP 318.A OD2 no hydrogen 3.065 N/A ASP 321.A N ASP 318.A OD2 no hydrogen 3.151 N/A ASP 323.A N ASP 321.A OD1 no hydrogen 3.415 N/A LYS 324.A N ASP 321.A O no hydrogen 2.976 N/A VAL 326.A N VAL 316.A O no hydrogen 2.780 N/A VAL 329.A N VAL 314.A O no hydrogen 3.201 N/A LEU 331.A N VAL 312.A O no hydrogen 2.691 N/A GLU 332.A N LYS 340.A O no hydrogen 3.048 N/A GLY 334.A N THR 338.A O no hydrogen 2.806 N/A ARG 336.A NH1 GLU 281.A O no hydrogen 2.858 N/A THR 338.A N GLU 335.A O no hydrogen 3.160 N/A THR 338.A OG1 GLU 335.A O no hydrogen 2.776 N/A TRP 339.A N LEU 304.A O no hydrogen 2.745 N/A TRP 339.A NE1 SER 306.A O no hydrogen 2.759 N/A LYS 340.A N GLU 332.A O no hydrogen 2.884 N/A LYS 340.A NZ LYS 333.A O no hydrogen 3.407 N/A GLN 341.A N LEU 302.A O no hydrogen 3.198 N/A GLN 341.A NE2 ALA 330.A O no hydrogen 2.774 N/A THR 342.A N GLN 341.A OE1 no hydrogen 3.091 N/A THR 342.A OG1 ASP 301.A OD1 no hydrogen 3.051 N/A LEU 343.A N VAL 300.A O no hydrogen 2.717 N/A THR 346.A N ASP 344.A OD1 no hydrogen 2.755 N/A ASN 347.A N ASP 344.A O no hydrogen 2.882 N/A ASN 347.A ND2 ASP 344.A O no hydrogen 2.839 N/A ASN 347.A ND2 ILE 351.A O no hydrogen 2.766 N/A LEU 349.A N ASN 347.A OD1 no hydrogen 2.808 N/A ILE 351.A N ASN 347.A OD1 no hydrogen 3.202 N/A PHE 354.A N GLY 297.A O no hydrogen 2.879 N/A THR 355.A N ASP 353.A OD1 no hydrogen 3.053 N/A THR 355.A OG1 ASP 353.A OD1 no hydrogen 2.774 N/A GLY 356.A N PHE 401.A O no hydrogen 2.790 N/A TYR 357.A N PHE 354.A O no hydrogen 3.069 N/A TYR 358.A N TYR 317.A O no hydrogen 3.176 N/A TYR 359.A N ALA 399.A O no hydrogen 2.910 N/A TYR 359.A OH ASP 374.A OD2 no hydrogen 2.580 N/A GLN 360.A N VAL 315.A O no hydrogen 3.004 N/A GLN 360.A NE2 ALA 393.A O no hydrogen 3.105 N/A GLN 360.A NE2 ALA 397.A O no hydrogen 3.162 N/A TYR 361.A N ALA 372.A O no hydrogen 2.787 N/A GLN 362.A N SER 313.A O no hydrogen 2.702 N/A ILE 363.A N VAL 370.A O no hydrogen 2.839 N/A GLU 364.A N LYS 311.A O no hydrogen 3.011 N/A ARG 365.A N LYS 368.A O no hydrogen 2.806 N/A ARG 365.A NH1 ASP 562.A O no hydrogen 3.411 N/A ARG 365.A NH1 LEU 563.A O no hydrogen 3.518 N/A ARG 365.A NH2 ASP 562.A O no hydrogen 3.141 N/A GLN 366.A N ASP 310.A OD2 no hydrogen 2.960 N/A LYS 368.A N ARG 365.A O no hydrogen 2.742 N/A VAL 370.A N ILE 363.A O no hydrogen 3.052 N/A ALA 372.A N TYR 361.A O no hydrogen 2.797 N/A TYR 376.A N ASP 374.A OD1 no hydrogen 3.038 N/A TYR 376.A OH ASP 599.A OD2 no hydrogen 2.807 N/A ALA 377.A N ASP 374.A O no hydrogen 3.064 N/A LYS 378.A NZ ALA 291.A O no hydrogen 3.064 N/A LYS 378.A NZ ASP 292.A OD1 no hydrogen 2.581 N/A SER 379.A OG PRO 524.A O no hydrogen 2.575 N/A ALA 381.A N LYS 398.A O no hydrogen 2.787 N/A TRP 383.A N GLU 484.A OE1 no hydrogen 2.822 N/A TRP 383.A NE1 TYR 480.A O no hydrogen 2.756 N/A SER 385.A N VAL 482.A O no hydrogen 3.047 N/A ASP 386.A N ASN 384.A OD1 no hydrogen 2.977 N/A ASP 387.A N ASN 384.A O no hydrogen 3.046 N/A SER 388.A N SER 385.A O no hydrogen 3.060 N/A SER 388.A OG SER 385.A O no hydrogen 2.796 N/A ILE 390.A N ASP 387.A O no hydrogen 3.243 N/A HIS 394.A N ASP 391.A O no hydrogen 3.132 N/A HIS 394.A N ASP 391.A OD1 no hydrogen 2.859 N/A HIS 394.A ND1 ASP 391.A OD1 no hydrogen 2.810 N/A LYS 395.A N ASP 392.A O no hydrogen 3.327 N/A LYS 395.A NZ ASP 558.A OD2 no hydrogen 3.159 N/A LYS 395.A NZ ASP 562.A OD2 no hydrogen 2.717 N/A LYS 398.A NZ PRO 322.A O no hydrogen 2.505 N/A ALA 399.A N TYR 359.A O no hydrogen 3.002 N/A ALA 400.A N SER 379.A O no hydrogen 2.945 N/A PHE 401.A N TYR 357.A O no hydrogen 2.790 N/A LEU 407.A N PRO 404.A O no hydrogen 2.724 N/A GLN 410.A NE2 ALA 405.A O no hydrogen 3.245 N/A LEU 412.A N PRO 409.A O no hydrogen 3.416 N/A GLY 415.A N ASP 611.A OD1 no hydrogen 3.059 N/A HIS 418.A N GLY 542.A O no hydrogen 2.987 N/A HIS 418.A ND1 ASN 419.A OD1 no hydrogen 2.869 N/A HIS 418.A NE2 VAL 468.A O no hydrogen 3.168 N/A LYS 421.A N ASP 425.A OD2 no hydrogen 2.905 N/A THR 422.A N ASP 425.A OD2 no hydrogen 3.320 N/A THR 422.A OG1 GLU 424.A OE1 no hydrogen 3.253 N/A ARG 423.A NH1 THR 671.A O no hydrogen 2.856 N/A ARG 423.A NH2 SER 721.A OG no hydrogen 3.111 N/A ARG 423.A NH2 ASP 724.A OD1 no hydrogen 2.722 N/A GLU 424.A N GLU 424.A OE1 no hydrogen 2.744 N/A ASP 425.A N THR 422.A O no hydrogen 2.803 N/A ALA 426.A N ARG 423.A O no hydrogen 3.214 N/A VAL 427.A N THR 469.A OG1 no hydrogen 2.784 N/A ILE 428.A N PRO 776.A O no hydrogen 3.017 N/A TYR 429.A N HIS 470.A O no hydrogen 2.822 N/A TYR 429.A OH SER 780.A OG no hydrogen 2.973 N/A TYR 429.A OH GLU 783.A OE2 no hydrogen 2.880 N/A GLU 430.A N ILE 778.A O no hydrogen 2.909 N/A ALA 431.A N GLN 472.A O no hydrogen 2.889 N/A HIS 432.A NE2 ASN 502.A O no hydrogen 3.021 N/A ARG 434.A N HIS 432.A ND1 no hydrogen 3.073 N/A ARG 434.A NE ASP 833.A OD1 no hydrogen 2.888 N/A ARG 434.A NE ASP 833.A OD2 no hydrogen 3.408 N/A ARG 434.A NH1 ASN 487.A O no hydrogen 2.813 N/A ARG 434.A NH2 GLU 489.A O no hydrogen 2.760 N/A ARG 434.A NH2 ASP 833.A OD2 no hydrogen 2.847 N/A ASP 435.A N HIS 432.A ND1 no hydrogen 3.431 N/A PHE 436.A N HIS 432.A O no hydrogen 3.038 N/A THR 437.A N ARG 434.A O no hydrogen 3.299 N/A SER 438.A N ASP 435.A O no hydrogen 3.451 N/A SER 438.A OG ARG 434.A O no hydrogen 3.360 N/A SER 438.A OG ASP 435.A O no hydrogen 3.534 N/A ALA 441.A N ASP 439.A OD1 no hydrogen 2.942 N/A ILE 442.A N ASP 439.A O no hydrogen 3.122 N/A ALA 443.A N PRO 440.A O no hydrogen 3.082 N/A ASP 445.A N ILE 442.A O no hydrogen 2.985 N/A LEU 446.A N ALA 443.A O no hydrogen 3.451 N/A THR 447.A N GLU 458.A OE1 no hydrogen 2.899 N/A THR 447.A N GLU 458.A OE2 no hydrogen 2.982 N/A THR 447.A OG1 GLU 458.A OE1 no hydrogen 2.625 N/A LYS 448.A N GLU 458.A OE2 no hydrogen 2.718 N/A GLY 451.A N THR 437.A OG1 no hydrogen 2.614 N/A THR 452.A OG1 PRO 449.A O no hydrogen 2.646 N/A PHE 453.A N TYR 517.A O no hydrogen 2.842 N/A ALA 455.A N THR 452.A OG1 no hydrogen 3.228 N/A PHE 456.A N THR 452.A O no hydrogen 3.031 N/A GLU 458.A N ALA 455.A O no hydrogen 3.056 N/A LYS 459.A N PHE 456.A O no hydrogen 3.097 N/A LEU 460.A N ILE 457.A O no hydrogen 3.205 N/A TYR 462.A OH GLU 783.A OE2 no hydrogen 2.714 N/A LYS 464.A N LEU 460.A O no hydrogen 2.949 N/A ASP 465.A N ASP 461.A O no hydrogen 2.779 N/A LEU 466.A N TYR 462.A O no hydrogen 3.041 N/A GLY 467.A N LEU 463.A O no hydrogen 3.109 N/A THR 469.A N VAL 427.A O no hydrogen 3.105 N/A THR 469.A OG1 VAL 427.A O no hydrogen 3.367 N/A THR 469.A OG1 HIS 470.A ND1 no hydrogen 2.744 N/A HIS 470.A N VAL 427.A O no hydrogen 3.230 N/A HIS 470.A ND1 THR 469.A OG1 no hydrogen 2.744 N/A ILE 471.A N GLY 544.A O no hydrogen 2.949 N/A GLN 472.A N TYR 429.A O no hydrogen 2.750 N/A LEU 473.A N ILE 546.A O no hydrogen 2.704 N/A LEU 474.A N ALA 431.A O no hydrogen 3.117 N/A SER 478.A N SER 512.A O no hydrogen 3.009 N/A SER 478.A OG GLN 508.A OE1 no hydrogen 3.540 N/A TYR 479.A OH TYR 517.A OH no hydrogen 2.751 N/A TYR 480.A N ASP 506.A O no hydrogen 2.700 N/A TYR 480.A OH LYS 395.A O no hydrogen 2.723 N/A VAL 482.A N SER 385.A OG no hydrogen 3.303 N/A ASN 483.A N ASN 500.A OD1 no hydrogen 2.904 N/A GLU 484.A N TRP 383.A O no hydrogen 2.871 N/A LYS 486.A N ASN 483.A O no hydrogen 3.064 N/A ASN 487.A N GLU 484.A O no hydrogen 3.062 N/A ASN 487.A ND2 MET 516.A O no hydrogen 2.908 N/A ASN 487.A ND2 SER 518.A O no hydrogen 2.673 N/A HIS 488.A NE2 SER 519.A O no hydrogen 3.033 N/A GLU 489.A N LYS 486.A O no hydrogen 3.100 N/A LEU 491.A N ASP 833.A OD2 no hydrogen 3.001 N/A ALA 495.A N SER 832.A OG no hydrogen 3.246 N/A SER 496.A OG ASN 806.A O no hydrogen 2.721 N/A ASN 498.A N ASP 830.A OD2 no hydrogen 2.822 N/A SER 499.A N ASP 830.A OD1 no hydrogen 2.942 N/A ASN 500.A ND2 ASN 483.A O no hydrogen 3.030 N/A TYR 501.A N SER 499.A OG no hydrogen 3.277 N/A TYR 501.A OH ASP 435.A OD1 no hydrogen 2.510 N/A TYR 501.A OH ASP 435.A OD2 no hydrogen 3.114 N/A ASN 502.A ND2 PHE 481.A O no hydrogen 2.855 N/A ASN 502.A ND2 ASP 506.A OD2 no hydrogen 2.684 N/A TRP 503.A N TYR 829.A O no hydrogen 3.308 N/A GLY 504.A N ASN 502.A OD1 no hydrogen 2.687 N/A TYR 505.A OH ASP 548.A OD2 no hydrogen 2.360 N/A GLN 508.A N SER 478.A O no hydrogen 2.861 N/A ASN 509.A ND2 PRO 375.A O no hydrogen 2.909 N/A TYR 510.A OH VAL 550.A O no hydrogen 3.042 N/A PHE 511.A N ASN 509.A OD1 no hydrogen 2.844 N/A SER 512.A N ASN 509.A OD1 no hydrogen 2.768 N/A SER 512.A OG ALA 377.A O no hydrogen 2.499 N/A SER 512.A OG ASN 509.A OD1 no hydrogen 3.228 N/A THR 514.A N VAL 476.A O no hydrogen 2.781 N/A THR 514.A OG1 GLU 484.A OE2 no hydrogen 3.442 N/A GLY 515.A N GLU 484.A OE2 no hydrogen 2.881 N/A MET 516.A N THR 514.A OG1 no hydrogen 3.220 N/A TYR 517.A OH HIS 432.A NE2 no hydrogen 2.955 N/A SER 518.A N GLY 515.A O no hydrogen 3.100 N/A SER 518.A OG GLU 530.A OE1 no hydrogen 3.072 N/A SER 519.A N GLU 530.A OE2 no hydrogen 2.830 N/A SER 519.A OG GLU 530.A OE2 no hydrogen 2.508 N/A ASP 520.A N SER 518.A OG no hydrogen 3.043 N/A LYS 522.A N ASP 520.A OD1 no hydrogen 3.329 N/A ASN 523.A N ASP 520.A O no hydrogen 3.120 N/A GLU 525.A N ASN 523.A OD1 no hydrogen 2.943 N/A LYS 526.A N ASN 523.A O no hydrogen 3.177 N/A LYS 526.A N ASN 523.A OD1 no hydrogen 3.252 N/A LYS 526.A NZ ASP 520.A OD2 no hydrogen 2.757 N/A ARG 527.A NH1 LEU 513.A O no hydrogen 2.923 N/A ARG 527.A NH2 PRO 521.A O no hydrogen 2.953 N/A ILE 528.A N GLU 525.A O no hydrogen 3.162 N/A ALA 529.A N GLU 525.A O no hydrogen 3.272 N/A GLU 530.A N LYS 526.A O no hydrogen 2.816 N/A PHE 531.A N ARG 527.A O no hydrogen 3.065 N/A LYS 532.A N ILE 528.A O no hydrogen 2.978 N/A LYS 532.A NZ PRO 404.A O no hydrogen 3.125 N/A LYS 532.A NZ LEU 407.A O no hydrogen 2.619 N/A ASN 533.A N ALA 529.A O no hydrogen 3.051 N/A ASN 533.A ND2 GLU 454.A OE2 no hydrogen 2.877 N/A LEU 534.A N GLU 530.A O no hydrogen 3.018 N/A ILE 535.A N PHE 531.A O no hydrogen 2.939 N/A ASN 536.A N LYS 532.A O no hydrogen 2.886 N/A ASN 536.A ND2 ASP 411.A OD1 no hydrogen 3.256 N/A GLU 537.A N ASN 533.A O no hydrogen 2.892 N/A ILE 538.A N LEU 534.A O no hydrogen 2.963 N/A HIS 539.A N ILE 535.A O no hydrogen 2.949 N/A HIS 539.A NE2 ASP 611.A OD2 no hydrogen 2.628 N/A LYS 540.A N ASN 536.A O no hydrogen 2.876 N/A LYS 540.A NZ GLU 537.A OE2 no hydrogen 3.073 N/A ARG 541.A N ILE 538.A O no hydrogen 3.006 N/A ARG 541.A NE ASP 461.A OD1 no hydrogen 2.977 N/A ARG 541.A NH1 GLU 537.A O no hydrogen 3.004 N/A ARG 541.A NH1 GLU 537.A OE1 no hydrogen 2.890 N/A GLY 542.A N HIS 539.A O no hydrogen 2.751 N/A MET 543.A N ILE 538.A O no hydrogen 3.215 N/A GLY 544.A N THR 469.A O no hydrogen 2.686 N/A ALA 545.A N ASP 611.A OD2 no hydrogen 2.810 N/A ILE 546.A N ILE 471.A O no hydrogen 2.858 N/A LEU 547.A N GLY 612.A O no hydrogen 3.007 N/A ASP 548.A N LEU 473.A O no hydrogen 2.929 N/A VAL 549.A N ARG 614.A O no hydrogen 2.895 N/A TYR 551.A OH SER 600.A OG no hydrogen 2.618 N/A THR 554.A N GLY 584.A O no hydrogen 2.942 N/A THR 554.A OG1 LYS 556.A O no hydrogen 3.042 N/A ALA 555.A N PRO 507.A O no hydrogen 2.885 N/A LYS 556.A NZ TYR 480.A OH no hydrogen 3.222 N/A LEU 559.A N LYS 556.A O no hydrogen 3.238 N/A PHE 560.A N VAL 557.A O no hydrogen 3.212 N/A GLU 561.A N VAL 557.A O no hydrogen 2.844 N/A ASP 562.A N ASP 558.A O no hydrogen 2.973 N/A LEU 563.A N PHE 560.A O no hydrogen 3.268 N/A GLU 564.A N PHE 560.A O no hydrogen 3.436 N/A ASN 566.A N GLU 561.A OE1 no hydrogen 2.724 N/A TYR 567.A OH ASP 280.A OD1 no hydrogen 2.627 N/A HIS 569.A ND1 GLU 561.A OE2 no hydrogen 2.959 N/A PHE 570.A N ARG 585.A O no hydrogen 2.730 N/A MET 571.A N ASP 653.A OD1 no hydrogen 3.074 N/A ASP 572.A N THR 576.A O no hydrogen 2.985 N/A ALA 573.A N GLU 654.A OE1 no hydrogen 2.977 N/A GLY 575.A N ASP 572.A O no hydrogen 2.981 N/A THR 576.A N ASP 574.A OD1 no hydrogen 3.127 N/A THR 576.A OG1 ASP 574.A OD1 no hydrogen 2.685 N/A ARG 578.A N PHE 570.A O no hydrogen 2.691 N/A ARG 578.A NE ASP 572.A OD1 no hydrogen 2.686 N/A ARG 578.A NH1 GLY 652.A O no hydrogen 2.924 N/A ARG 578.A NH2 ASP 572.A OD1 no hydrogen 3.426 N/A SER 580.A N GLY 583.A O no hydrogen 2.995 N/A GLY 583.A N SER 580.A O no hydrogen 3.006 N/A GLY 584.A N THR 554.A OG1 no hydrogen 3.195 N/A ARG 585.A N ARG 578.A O no hydrogen 3.026 N/A GLY 587.A N TYR 568.A O no hydrogen 2.916 N/A THR 588.A OG1 HIS 621.A ND1 no hydrogen 3.179 N/A THR 588.A OG1 ASP 622.A OD1 no hydrogen 2.735 N/A HIS 590.A N GLY 587.A O no hydrogen 2.948 N/A HIS 590.A ND1 TYR 567.A O no hydrogen 2.536 N/A HIS 590.A NE2 ASP 653.A OD1 no hydrogen 3.188 N/A HIS 590.A NE2 ASP 653.A OD2 no hydrogen 2.807 N/A HIS 591.A N ASP 280.A OD2 no hydrogen 2.965 N/A HIS 591.A NE2 ASP 286.A OD1 no hydrogen 2.751 N/A MET 592.A N TYR 567.A OH no hydrogen 2.664 N/A THR 593.A OG1 TYR 568.A O no hydrogen 2.775 N/A LYS 594.A N HIS 590.A O no hydrogen 2.821 N/A LYS 594.A NZ THR 588.A O no hydrogen 3.390 N/A LYS 594.A NZ SER 625.A OG no hydrogen 3.042 N/A ARG 595.A N HIS 591.A O no hydrogen 2.978 N/A ARG 595.A NE ASP 599.A OD2 no hydrogen 2.847 N/A ARG 595.A NH1 TYR 285.A O no hydrogen 2.720 N/A ARG 595.A NH1 GLY 287.A O no hydrogen 2.856 N/A ARG 595.A NH2 GLY 287.A O no hydrogen 2.961 N/A ARG 595.A NH2 ASP 599.A OD2 no hydrogen 3.012 N/A LEU 596.A N MET 592.A O no hydrogen 3.064 N/A LEU 597.A N THR 593.A O no hydrogen 3.138 N/A ILE 598.A N LYS 594.A O no hydrogen 3.070 N/A ASP 599.A N ARG 595.A O no hydrogen 2.848 N/A SER 600.A N LEU 596.A O no hydrogen 3.040 N/A SER 600.A OG TYR 510.A O no hydrogen 2.814 N/A SER 600.A OG TYR 551.A OH no hydrogen 2.618 N/A ILE 601.A N LEU 597.A O no hydrogen 2.949 N/A LYS 602.A N ILE 598.A O no hydrogen 2.814 N/A TYR 603.A N ASP 599.A O no hydrogen 2.675 N/A LEU 604.A N SER 600.A O no hydrogen 2.797 N/A VAL 605.A N ILE 601.A O no hydrogen 2.970 N/A ASP 606.A N LYS 602.A O no hydrogen 3.011 N/A THR 607.A N TYR 603.A O no hydrogen 2.908 N/A THR 607.A OG1 TYR 603.A O no hydrogen 2.702 N/A TYR 608.A N LEU 604.A O no hydrogen 3.040 N/A LYS 609.A NZ ASP 606.A O no hydrogen 2.799 N/A LYS 609.A NZ ASP 606.A OD1 no hydrogen 3.521 N/A ASP 611.A N ALA 545.A O no hydrogen 2.903 N/A PHE 613.A N ILE 641.A O no hydrogen 3.188 N/A ARG 614.A N LEU 547.A O no hydrogen 2.918 N/A ARG 614.A NH1 ASP 548.A OD1 no hydrogen 2.821 N/A ARG 614.A NH1 ASP 616.A OD1 no hydrogen 3.370 N/A PHE 615.A N LEU 643.A O no hydrogen 2.853 N/A ASP 616.A N VAL 549.A O no hydrogen 2.980 N/A MET 617.A N GLU 645.A OE1 no hydrogen 3.011 N/A GLY 619.A N GLU 645.A O no hydrogen 3.162 N/A ASP 620.A N MET 617.A O no hydrogen 3.042 N/A HIS 621.A N MET 618.A O no hydrogen 2.942 N/A HIS 621.A ND1 THR 588.A OG1 no hydrogen 3.179 N/A ALA 623.A N LYS 659.A O no hydrogen 2.860 N/A SER 625.A N ASP 622.A OD2 no hydrogen 2.822 N/A SER 625.A OG THR 588.A O no hydrogen 2.766 N/A SER 625.A OG ASP 622.A OD1 no hydrogen 2.748 N/A SER 625.A OG ASP 622.A OD2 no hydrogen 2.601 N/A GLU 627.A N ALA 623.A O no hydrogen 2.946 N/A GLU 628.A N ALA 624.A O no hydrogen 2.861 N/A ALA 629.A N SER 625.A O no hydrogen 2.928 N/A TYR 630.A N ILE 626.A O no hydrogen 2.900 N/A LYS 631.A N GLU 627.A O no hydrogen 2.945 N/A ALA 632.A N GLU 628.A O no hydrogen 2.900 N/A ALA 633.A N ALA 629.A O no hydrogen 2.837 N/A ARG 634.A N TYR 630.A O no hydrogen 2.952 N/A ARG 634.A NH1 LEU 640.A O no hydrogen 2.766 N/A ALA 635.A N LYS 631.A O no hydrogen 2.964 N/A LEU 636.A N ALA 633.A O no hydrogen 3.139 N/A ASN 637.A N ALA 633.A O no hydrogen 2.911 N/A ASN 637.A ND2 VAL 610.A O no hydrogen 3.432 N/A ASN 639.A N ASN 637.A OD1 no hydrogen 3.027 N/A LEU 640.A N ASN 637.A O no hydrogen 2.985 N/A ILE 641.A N ASP 611.A O no hydrogen 3.175 N/A LEU 643.A N PHE 613.A O no hydrogen 2.964 N/A GLY 644.A N ALA 673.A O no hydrogen 2.865 N/A GLU 645.A N PHE 615.A O no hydrogen 3.092 N/A TRP 647.A NE1 GLU 645.A OE2 no hydrogen 2.813 N/A ARG 648.A NE ASP 664.A OD2 no hydrogen 2.806 N/A ARG 648.A NH2 ASP 664.A OD1 no hydrogen 3.126 N/A ARG 648.A NH2 ASN 716.A O no hydrogen 2.910 N/A THR 649.A OG1 ASP 620.A OD1 no hydrogen 2.878 N/A THR 649.A OG1 TRP 647.A O no hydrogen 3.552 N/A TYR 650.A OH THR 658.A OG1 no hydrogen 3.391 N/A GLU 654.A N MET 571.A O no hydrogen 2.928 N/A MET 656.A N ASP 653.A O no hydrogen 3.132 N/A THR 658.A OG1 TYR 650.A OH no hydrogen 3.391 N/A ALA 661.A N HIS 621.A O no hydrogen 2.865 N/A GLN 663.A N GLY 646.A O no hydrogen 2.771 N/A GLN 663.A NE2 PHE 675.A O no hydrogen 3.168 N/A GLN 663.A NE2 ASP 677.A OD1 no hydrogen 2.823 N/A ASP 664.A N ASP 662.A OD1 no hydrogen 2.785 N/A TRP 665.A N ASP 662.A O no hydrogen 2.943 N/A TRP 665.A N ASP 662.A OD1 no hydrogen 3.297 N/A MET 666.A N GLN 663.A O no hydrogen 3.280 N/A HIS 668.A N TRP 665.A O no hydrogen 2.939 N/A THR 669.A OG1 GLU 627.A OE2 no hydrogen 3.229 N/A THR 669.A OG1 THR 671.A OG1 no hydrogen 2.892 N/A THR 671.A OG1 THR 669.A OG1 no hydrogen 2.892 N/A VAL 672.A N THR 671.A OG1 no hydrogen 2.541 N/A ALA 673.A N MET 642.A O no hydrogen 3.111 N/A VAL 674.A N ASP 724.A O no hydrogen 3.063 N/A PHE 675.A N GLY 644.A O no hydrogen 3.285 N/A SER 676.A N ILE 726.A O no hydrogen 2.977 N/A ARG 680.A N SER 676.A O no hydrogen 3.490 N/A ARG 680.A NE ASN 681.A OD1 no hydrogen 2.658 N/A ARG 680.A NH1 TYR 728.A OH no hydrogen 2.839 N/A ARG 680.A NH2 ASN 681.A OD1 no hydrogen 2.863 N/A ASN 681.A N ASP 677.A O no hydrogen 2.806 N/A ASN 682.A N ASP 678.A O no hydrogen 2.987 N/A LEU 683.A N ILE 679.A O no hydrogen 2.978 N/A LYS 684.A N ARG 680.A O no hydrogen 3.193 N/A LYS 684.A NZ SER 685.A O no hydrogen 3.095 N/A LYS 684.A NZ ILE 729.A O no hydrogen 2.595 N/A ASN 689.A N GLY 686.A O no hydrogen 2.743 N/A GLY 691.A N SER 685.A OG no hydrogen 2.655 N/A GLN 692.A N ASN 689.A O no hydrogen 3.409 N/A ALA 694.A N THR 697.A OG1 no hydrogen 2.643 N/A PHE 695.A N ASN 682.A O no hydrogen 2.919 N/A ILE 696.A N LEU 683.A O no hydrogen 2.795 N/A THR 697.A N ALA 694.A O no hydrogen 2.844 N/A THR 697.A OG1 ALA 694.A O no hydrogen 3.051 N/A GLY 699.A N ALA 694.A O no hydrogen 2.821 N/A ARG 701.A N ASP 899.A O no hydrogen 2.982 N/A VAL 703.A N LYS 897.A O no hydrogen 3.054 N/A THR 705.A N ASP 702.A OD1 no hydrogen 3.256 N/A ILE 706.A N ASP 702.A O no hydrogen 3.021 N/A PHE 707.A N VAL 703.A O no hydrogen 3.006 N/A LYS 708.A N ASN 704.A O no hydrogen 2.907 N/A ASN 709.A N THR 705.A O no hydrogen 3.181 N/A ASN 709.A ND2 ASP 678.A OD2 no hydrogen 2.616 N/A ASN 709.A ND2 THR 705.A O no hydrogen 3.048 N/A LEU 710.A N ILE 706.A O no hydrogen 2.960 N/A ILE 711.A N PHE 707.A O no hydrogen 2.948 N/A ILE 711.A N LYS 708.A O no hydrogen 3.204 N/A ALA 712.A N ASN 709.A O no hydrogen 3.016 N/A GLN 713.A N LYS 708.A O no hydrogen 2.730 N/A THR 715.A N ASP 678.A OD2 no hydrogen 2.933 N/A THR 715.A OG1 ASP 678.A OD1 no hydrogen 3.493 N/A THR 715.A OG1 ASP 678.A OD2 no hydrogen 2.951 N/A ASN 716.A ND2 ASP 677.A OD1 no hydrogen 3.072 N/A ASP 724.A N SER 721.A O no hydrogen 3.081 N/A VAL 725.A N PRO 722.A O no hydrogen 2.997 N/A ILE 726.A N VAL 674.A O no hydrogen 2.765 N/A GLN 727.A N THR 775.A O no hydrogen 2.804 N/A GLN 727.A NE2 ASN 709.A O no hydrogen 2.871 N/A GLN 727.A NE2 GLN 773.A O no hydrogen 2.756 N/A HIS 732.A N GLU 430.A OE1 no hydrogen 2.738 N/A LEU 735.A N GLU 690.A OE2 no hydrogen 2.930 N/A THR 736.A OG1 ARG 786.A O no hydrogen 2.861 N/A ASP 739.A N THR 736.A OG1 no hydrogen 3.084 N/A ILE 740.A N THR 736.A O no hydrogen 2.781 N/A ILE 741.A N LEU 737.A O no hydrogen 3.028 N/A ALA 742.A N PHE 738.A O no hydrogen 3.160 N/A GLN 743.A N ASP 739.A O no hydrogen 2.943 N/A GLN 743.A NE2 HIS 809.A ND1 no hydrogen 3.687 N/A SER 744.A N ILE 740.A O no hydrogen 2.748 N/A SER 744.A OG ILE 740.A O no hydrogen 2.590 N/A ILE 745.A N ILE 741.A O no hydrogen 2.934 N/A LYS 746.A N GLN 743.A O no hydrogen 3.232 N/A LYS 747.A N ALA 742.A O no hydrogen 3.308 N/A LYS 747.A NZ GLU 757.A OE1 no hydrogen 3.133 N/A LYS 747.A NZ GLU 757.A OE2 no hydrogen 3.325 N/A SER 750.A N ASP 748.A OD1 no hydrogen 2.933 N/A SER 750.A OG ASP 748.A OD1 no hydrogen 2.792 N/A LYS 751.A N ASP 748.A O no hydrogen 3.073 N/A GLU 753.A N GLU 753.A OE1 no hydrogen 2.661 N/A ASN 754.A ND2 ASP 748.A O no hydrogen 3.062 N/A TYR 755.A N LYS 751.A O no hydrogen 2.969 N/A ALA 756.A N ALA 752.A O no hydrogen 3.012 N/A GLU 757.A N GLU 753.A O no hydrogen 2.981 N/A ILE 758.A N ASN 754.A O no hydrogen 2.896 N/A HIS 759.A N TYR 755.A O no hydrogen 3.126 N/A HIS 759.A ND1 SER 855.A OG no hydrogen 2.754 N/A ARG 760.A N ALA 756.A O no hydrogen 3.044 N/A ARG 760.A NE LEU 971.A O no hydrogen 2.777 N/A ARG 760.A NH1 GLU 945.A OE1 no hydrogen 3.191 N/A ARG 760.A NH2 GLU 945.A OE1 no hydrogen 2.784 N/A ARG 760.A NH2 LEU 971.A O no hydrogen 3.019 N/A ARG 760.A NH2 THR 972.A OG1 no hydrogen 2.807 N/A ARG 761.A N GLU 757.A O no hydrogen 3.085 N/A ARG 761.A NE GLU 757.A OE2 no hydrogen 2.736 N/A ARG 761.A NH1 ILE 696.A O no hydrogen 3.011 N/A ARG 761.A NH2 GLU 757.A OE2 no hydrogen 2.875 N/A LEU 762.A N ILE 758.A O no hydrogen 2.816 N/A ARG 763.A N HIS 759.A O no hydrogen 2.935 N/A ARG 763.A NE SER 855.A OG no hydrogen 3.108 N/A ARG 763.A NH2 GLU 851.A O no hydrogen 3.105 N/A ARG 763.A NH2 GLU 851.A OE2 no hydrogen 2.346 N/A ARG 763.A NH2 SER 855.A OG no hydrogen 3.065 N/A LEU 764.A N ARG 760.A O no hydrogen 2.944 N/A GLY 765.A N ARG 761.A O no hydrogen 2.962 N/A ASN 766.A N LEU 762.A O no hydrogen 2.992 N/A ASN 766.A ND2 GLN 782.A O no hydrogen 3.288 N/A LEU 767.A N ARG 763.A O no hydrogen 2.797 N/A MET 768.A N LEU 764.A O no hydrogen 2.975 N/A VAL 769.A N GLY 765.A O no hydrogen 3.010 N/A LEU 770.A N ASN 766.A O no hydrogen 2.899 N/A THR 771.A N LEU 767.A O no hydrogen 3.054 N/A THR 771.A OG1 LEU 767.A O no hydrogen 3.022 N/A ALA 772.A N VAL 769.A O no hydrogen 3.195 N/A GLN 773.A N LEU 710.A O no hydrogen 2.951 N/A GLN 773.A NE2 ALA 871.A O no hydrogen 2.898 N/A THR 775.A N VAL 725.A O no hydrogen 3.058 N/A THR 775.A OG1 ARG 423.A O no hydrogen 2.662 N/A PHE 777.A N GLN 727.A O no hydrogen 2.978 N/A ILE 778.A N ILE 428.A O no hydrogen 2.687 N/A HIS 779.A N GLN 782.A OE1 no hydrogen 2.808 N/A SER 780.A N GLU 430.A O no hydrogen 2.886 N/A SER 780.A OG TYR 429.A OH no hydrogen 2.973 N/A GLN 782.A N HIS 779.A O no hydrogen 2.708 N/A GLN 782.A NE2 ASN 766.A OD1 no hydrogen 2.921 N/A GLU 783.A N GLU 783.A OE1 no hydrogen 2.551 N/A ARG 786.A N GLY 781.A O no hydrogen 2.798 N/A ARG 786.A NH1 SER 780.A O no hydrogen 2.981 N/A ARG 786.A NH2 ASP 435.A OD2 no hydrogen 3.140 N/A THR 787.A OG1 ASP 739.A OD1 no hydrogen 2.591 N/A THR 787.A OG1 ASP 739.A OD2 no hydrogen 3.511 N/A LYS 788.A N ASP 739.A OD2 no hydrogen 2.794 N/A LYS 788.A NZ SER 828.A OG no hydrogen 3.157 N/A GLN 789.A N THR 787.A OG1 no hydrogen 3.229 N/A GLN 789.A NE2 TYR 821.A O no hydrogen 2.924 N/A PHE 790.A N TYR 823.A O no hydrogen 2.696 N/A ARG 791.A NH1 GLN 789.A OE1 no hydrogen 2.890 N/A ALA 794.A N ASN 792.A OD1 no hydrogen 2.996 N/A TYR 795.A N ASN 792.A O no hydrogen 2.719 N/A TYR 795.A OH LYS 803.A O no hydrogen 2.484 N/A VAL 799.A N TYR 823.A OH no hydrogen 2.785 N/A LYS 803.A N ALA 800.A O no hydrogen 2.768 N/A ASN 806.A ND2 SER 496.A O no hydrogen 2.964 N/A ASN 806.A ND2 TYR 829.A OH no hydrogen 3.370 N/A LYS 807.A N ALA 77.A O no hydrogen 2.802 N/A SER 808.A OG PRO 805.A O no hydrogen 2.895 N/A HIS 809.A N PHE 824.A O no hydrogen 2.893 N/A LEU 811.A N PRO 822.A O no hydrogen 2.834 N/A ARG 812.A NE GLY 816.A O no hydrogen 2.714 N/A ARG 812.A NH2 GLY 816.A O no hydrogen 3.376 N/A ASP 813.A N ASN 817.A O no hydrogen 2.786 N/A ASP 815.A N ASP 813.A OD1 no hydrogen 2.914 N/A GLY 816.A N ASP 813.A O no hydrogen 2.979 N/A ASN 817.A N ASP 813.A OD1 no hydrogen 2.963 N/A PHE 819.A N LEU 811.A O no hydrogen 2.862 N/A ASP 820.A N ASP 748.A OD2 no hydrogen 2.884 N/A TYR 821.A N ARG 796.A O no hydrogen 2.869 N/A PHE 824.A N HIS 809.A O no hydrogen 2.936 N/A ILE 825.A N LYS 788.A O no hydrogen 3.062 N/A HIS 826.A N LYS 807.A O no hydrogen 2.900 N/A SER 831.A N SER 828.A O no hydrogen 3.239 N/A SER 832.A N ALA 495.A O no hydrogen 2.945 N/A SER 832.A OG ASP 493.A O no hydrogen 2.498 N/A ASP 833.A N LEU 491.A O no hydrogen 3.001 N/A VAL 835.A N SER 832.A O no hydrogen 3.104 N/A ASN 836.A N SER 832.A O no hydrogen 2.946 N/A ASN 836.A ND2 SER 828.A OG no hydrogen 2.647 N/A LYS 837.A N ASP 833.A O no hydrogen 2.858 N/A LYS 837.A NZ ASP 839.A OD2 no hydrogen 3.337 N/A PHE 838.A N ASP 435.A O no hydrogen 3.109 N/A ASP 839.A N TYR 784.A OH no hydrogen 2.845 N/A TRP 840.A N ASP 439.A OD2 no hydrogen 2.877 N/A TRP 840.A NE1 PHE 436.A O no hydrogen 2.650 N/A LYS 842.A N ASP 839.A OD1 no hydrogen 2.918 N/A ALA 843.A N ASP 839.A O no hydrogen 3.029 N/A THR 844.A OG1 TRP 840.A O no hydrogen 2.549 N/A ASP 845.A N THR 841.A O no hydrogen 2.889 N/A ALA 848.A N ASP 845.A O no hydrogen 3.154 N/A ALA 848.A N ASP 845.A OD1 no hydrogen 3.063 N/A TYR 849.A N ASP 845.A O no hydrogen 2.928 N/A ASN 852.A ND2 TYR 755.A OH no hydrogen 2.596 N/A VAL 853.A N TYR 849.A O no hydrogen 3.059 N/A LYS 854.A N PRO 850.A O no hydrogen 2.729 N/A SER 855.A N GLU 851.A O no hydrogen 2.971 N/A SER 855.A OG HIS 759.A ND1 no hydrogen 2.754 N/A SER 855.A OG GLU 851.A O no hydrogen 3.197 N/A ARG 856.A N ASN 852.A O no hydrogen 2.922 N/A ARG 856.A NH1 ASP 465.A OD2 no hydrogen 2.713 N/A ARG 856.A NH2 ASP 465.A OD2 no hydrogen 2.825 N/A ASP 857.A N VAL 853.A O no hydrogen 2.794 N/A TYR 858.A N LYS 854.A O no hydrogen 2.931 N/A TYR 858.A OH ASP 944.A O no hydrogen 2.611 N/A MET 859.A N SER 855.A O no hydrogen 3.068 N/A LYS 860.A N ARG 856.A O no hydrogen 3.113 N/A LYS 860.A NZ ASP 465.A OD1 no hydrogen 2.810 N/A GLY 861.A N ASP 857.A O no hydrogen 2.866 N/A LEU 862.A N TYR 858.A O no hydrogen 2.881 N/A ILE 863.A N MET 859.A O no hydrogen 2.927 N/A ALA 864.A N LYS 860.A O no hydrogen 3.127 N/A LEU 865.A N GLY 861.A O no hydrogen 2.816 N/A ARG 866.A N LEU 862.A O no hydrogen 2.861 N/A ARG 866.A NH1 LEU 770.A O no hydrogen 2.790 N/A ARG 866.A NH1 ALA 772.A O no hydrogen 2.715 N/A ARG 866.A NH2 ALA 772.A O no hydrogen 2.895 N/A GLN 867.A N ILE 863.A O no hydrogen 2.909 N/A SER 868.A N ALA 864.A O no hydrogen 2.869 N/A SER 868.A N LEU 865.A O no hydrogen 3.049 N/A SER 868.A OG LEU 865.A O no hydrogen 2.689 N/A ALA 871.A N THR 869.A OG1 no hydrogen 2.829 N/A ARG 873.A N ASP 870.A O no hydrogen 2.982 N/A ARG 873.A NE ARG 866.A O no hydrogen 2.984 N/A ARG 873.A NH1 ASP 425.A OD1 no hydrogen 3.374 N/A ARG 873.A NH2 GLN 867.A O no hydrogen 2.801 N/A LEU 874.A N GLN 773.A OE1 no hydrogen 2.817 N/A LYS 875.A NZ ASP 425.A OD1 no hydrogen 2.639 N/A LYS 875.A NZ ARG 873.A O no hydrogen 2.808 N/A GLN 878.A NE2 ASP 882.A OD1 no hydrogen 2.632 N/A ASP 879.A N SER 876.A OG no hydrogen 3.312 N/A ILE 880.A N SER 876.A O no hydrogen 3.064 N/A LYS 881.A N LEU 877.A O no hydrogen 2.813 N/A LYS 881.A NZ GLN 713.A OE1 no hydrogen 2.712 N/A ASP 882.A N GLN 878.A O no hydrogen 2.981 N/A ARG 883.A N ASP 879.A O no hydrogen 2.848 N/A ARG 883.A NE ASP 879.A OD1 no hydrogen 2.744 N/A ARG 883.A NH1 THR 907.A O no hydrogen 3.112 N/A VAL 884.A N ILE 880.A O no hydrogen 3.013 N/A HIS 885.A N GLN 905.A O no hydrogen 2.804 N/A ILE 887.A N GLY 903.A O no hydrogen 2.934 N/A THR 888.A N GLY 903.A O no hydrogen 3.348 N/A VAL 889.A N ILE 887.A O no hydrogen 3.056 N/A GLY 891.A N VAL 895.A O no hydrogen 2.756 N/A GLN 892.A N VAL 889.A O no hydrogen 3.206 N/A VAL 895.A N GLN 892.A O no hydrogen 2.693 N/A ASP 899.A N ARG 701.A O no hydrogen 2.996 N/A VAL 900.A N ASP 899.A OD1 no hydrogen 2.623 N/A ILE 902.A N VAL 918.A O no hydrogen 3.035 N/A GLY 903.A N THR 888.A OG1 no hydrogen 3.105 N/A TYR 904.A N VAL 916.A O no hydrogen 3.010 N/A GLN 905.A N HIS 885.A O no hydrogen 2.852 N/A GLN 905.A NE2 HIS 935.A NE2 no hydrogen 2.660 N/A ILE 906.A N TYR 914.A O no hydrogen 2.682 N/A THR 907.A N ARG 883.A O no hydrogen 2.931 N/A ALA 908.A N ASP 912.A O no hydrogen 2.802 N/A GLY 911.A N ALA 908.A O no hydrogen 3.035 N/A ASP 912.A N ASN 910.A OD1 no hydrogen 3.192 N/A ILE 913.A N VAL 978.A O no hydrogen 2.848 N/A TYR 914.A N ILE 906.A O no hydrogen 2.808 N/A ALA 915.A N LEU 976.A O no hydrogen 2.791 N/A VAL 916.A N TYR 904.A O no hydrogen 2.891 N/A PHE 917.A N THR 974.A O no hydrogen 2.971 N/A VAL 918.A N ILE 902.A O no hydrogen 2.771 N/A ASN 919.A N THR 972.A O no hydrogen 2.597 N/A ASN 919.A ND2 LYS 923.A O no hydrogen 3.126 N/A ASN 919.A ND2 LEU 968.A O no hydrogen 2.870 N/A ASN 919.A ND2 ASN 969.A O no hydrogen 2.753 N/A ALA 920.A N VAL 900.A O no hydrogen 2.840 N/A ASP 921.A N ASN 919.A OD1 no hydrogen 3.026 N/A GLU 922.A N ASP 921.A OD1 no hydrogen 2.571 N/A ARG 925.A N LEU 968.A O no hydrogen 2.965 N/A ARG 925.A NH1 ASP 899.A OD1 no hydrogen 2.947 N/A ARG 925.A NH1 ASP 921.A OD2 no hydrogen 3.031 N/A ARG 925.A NH2 ASP 899.A OD2 no hydrogen 2.749 N/A PHE 927.A N LEU 966.A O no hydrogen 2.681 N/A LEU 929.A N LYS 964.A O no hydrogen 2.889 N/A PHE 933.A N LEU 929.A O no hydrogen 3.290 N/A ALA 934.A N THR 931.A O no hydrogen 3.375 N/A LEU 936.A N PHE 933.A O no hydrogen 3.043 N/A ARG 937.A N ALA 934.A O no hydrogen 2.977 N/A ARG 937.A NH1 THR 962.A O no hydrogen 3.091 N/A ARG 937.A NH2 THR 962.A O no hydrogen 2.848 N/A ASN 938.A N HIS 935.A O no hydrogen 2.889 N/A ALA 939.A N LEU 936.A O no hydrogen 3.025 N/A GLU 940.A N ARG 977.A O no hydrogen 2.858 N/A LEU 942.A N VAL 975.A O no hydrogen 2.699 N/A ALA 943.A N VAL 975.A O no hydrogen 3.395 N/A ASP 944.A N GLN 947.A O no hydrogen 2.902 N/A GLU 945.A N LYS 957.A O no hydrogen 3.219 N/A ASN 946.A N ASP 944.A OD1 no hydrogen 2.888 N/A GLN 947.A N ASP 944.A OD1 no hydrogen 2.979 N/A ILE 953.A N VAL 941.A O no hydrogen 2.873 N/A LYS 957.A N ASP 944.A OD2 no hydrogen 2.797 N/A GLU 960.A N LYS 967.A O no hydrogen 2.921 N/A THR 962.A N GLY 965.A O no hydrogen 2.751 N/A THR 962.A OG1 GLU 926.A OE2 no hydrogen 2.690 N/A GLY 965.A N THR 962.A OG1 no hydrogen 2.901 N/A LEU 966.A N PHE 927.A O no hydrogen 3.156 N/A LYS 967.A N GLU 960.A O no hydrogen 2.684 N/A LEU 968.A N ARG 925.A O no hydrogen 2.903 N/A ASN 969.A N GLY 958.A O no hydrogen 2.937 N/A LEU 971.A N ASP 921.A O no hydrogen 3.074 N/A THR 972.A N ASN 919.A O no hydrogen 2.950 N/A THR 972.A OG1 ASN 969.A O no hydrogen 3.041 N/A THR 972.A OG1 ALA 970.A O no hydrogen 3.083 N/A THR 974.A N PHE 917.A O no hydrogen 2.765 N/A THR 974.A OG1 ALA 943.A O no hydrogen 2.631 N/A VAL 975.A N ALA 943.A O no hydrogen 3.224 N/A LEU 976.A N ALA 915.A O no hydrogen 2.828 N/A ARG 977.A N GLU 940.A O no hydrogen 2.927 N/A ARG 977.A NE GLU 940.A OE2 no hydrogen 2.997 N/A ARG 977.A NH1 PRO 950.A O no hydrogen 2.941 N/A ARG 977.A NH2 GLU 940.A OE1 no hydrogen 2.876 N/A ARG 977.A NH2 GLU 940.A OE2 no hydrogen 2.969 N/A ARG 977.A NH2 PRO 950.A O no hydrogen 3.446 N/A VAL 978.A N ILE 913.A O no hydrogen 2.717 N/A SER 979.A OG GLU 940.A OE2 no hydrogen 3.482 N/A