Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8evq_DC.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N GLY 43.A O no hydrogen 2.369 N/A ARG 9.A N VAL 5.A O no hydrogen 2.866 N/A ARG 9.A NE ASP 6.A OD1 no hydrogen 3.168 N/A SER 10.A N ASP 6.A O no hydrogen 2.897 N/A SER 10.A OG ASP 6.A O no hydrogen 3.373 N/A SER 10.A OG GLN 7.A O no hydrogen 2.638 N/A LEU 11.A N GLN 7.A O no hydrogen 2.937 N/A MET 12.A N MET 8.A O no hydrogen 2.931 N/A ASP 13.A N SER 10.A O no hydrogen 3.068 N/A THR 16.A OG1 SER 326.A OG no hydrogen 3.039 N/A ASN 17.A ND2 THR 75.A OG1 no hydrogen 2.827 N/A ARG 19.A N LEU 81.A O no hydrogen 2.459 N/A ARG 19.A NE LEU 324.A O no hydrogen 2.471 N/A ARG 19.A NH2 LEU 324.A O no hydrogen 3.020 N/A ASN 20.A ND2 VAL 103.A O no hydrogen 3.159 N/A MET 21.A N ASN 83.A O no hydrogen 3.135 N/A SER 22.A N GLY 106.A O no hydrogen 3.018 N/A ILE 24.A N LEU 108.A O no hydrogen 3.119 N/A LYS 31.A NZ ALA 25.A O no hydrogen 3.296 N/A THR 33.A OG1 GLY 30.A O no hydrogen 2.663 N/A LEU 34.A N GLY 30.A O no hydrogen 2.831 N/A THR 35.A OG1 LYS 31.A O no hydrogen 2.705 N/A ASP 36.A N SER 32.A O no hydrogen 3.005 N/A SER 37.A N THR 33.A O no hydrogen 2.877 N/A LEU 38.A N LEU 34.A O no hydrogen 2.909 N/A VAL 39.A N THR 35.A O no hydrogen 3.092 N/A GLN 40.A N ASP 36.A O no hydrogen 2.866 N/A GLN 40.A NE2 SER 37.A O no hydrogen 3.611 N/A ILE 57.A N LEU 84.A O no hydrogen 2.829 N/A SER 58.A OG ASN 83.A OD1 no hydrogen 3.057 N/A LEU 59.A N ILE 82.A O no hydrogen 2.504 N/A SER 61.A N PHE 80.A O no hydrogen 3.309 N/A ASP 65.A N SER 64.A OG no hydrogen 2.432 N/A GLU 66.A N SER 64.A OG no hydrogen 3.397 N/A LYS 69.A NZ GLU 66.A O no hydrogen 3.509 N/A GLU 70.A N GLU 70.A OE1 no hydrogen 2.554 N/A GLN 73.A NE2 THR 16.A O no hydrogen 2.384 N/A GLN 73.A NE2 THR 16.A OG1 no hydrogen 2.505 N/A ASN 78.A ND2 MET 63.A O no hydrogen 3.031 N/A PHE 80.A N ASN 78.A O no hydrogen 2.823 N/A LEU 81.A N ASN 17.A O no hydrogen 2.831 N/A ILE 82.A N LEU 59.A O no hydrogen 2.721 N/A ASN 83.A N ARG 19.A O no hydrogen 2.667 N/A ASN 83.A ND2 ASN 434.A OD1 no hydrogen 3.210 N/A LEU 84.A N ILE 57.A O no hydrogen 2.984 N/A ILE 85.A N MET 21.A O no hydrogen 2.879 N/A ASP 86.A N THR 55.A O no hydrogen 3.225 N/A SER 87.A OG VAL 23.A O no hydrogen 2.255 N/A SER 87.A OG SER 87.A O no hydrogen 2.395 N/A SER 94.A N VAL 91.A O no hydrogen 3.413 N/A SER 94.A OG VAL 91.A O no hydrogen 2.691 N/A GLU 96.A N PHE 93.A O no hydrogen 3.125 N/A THR 98.A N SER 94.A O no hydrogen 3.135 N/A THR 98.A OG1 SER 94.A O no hydrogen 3.205 N/A THR 98.A OG1 PHE 465.A O no hydrogen 3.346 N/A ALA 99.A N SER 95.A O no hydrogen 2.758 N/A ALA 100.A N GLU 96.A O no hydrogen 2.944 N/A LEU 101.A N VAL 97.A O no hydrogen 2.849 N/A ARG 102.A NH1 LYS 461.A O no hydrogen 2.335 N/A VAL 103.A N ALA 100.A O no hydrogen 3.255 N/A THR 104.A OG1 ALA 100.A O no hydrogen 2.642 N/A ASP 105.A N ASN 20.A O no hydrogen 3.029 N/A ALA 107.A N LYS 134.A O no hydrogen 3.109 N/A LEU 108.A N SER 22.A O no hydrogen 3.155 N/A VAL 109.A N VAL 136.A O no hydrogen 2.758 N/A VAL 110.A N ILE 24.A O no hydrogen 3.283 N/A VAL 111.A N VAL 138.A O no hydrogen 2.982 N/A THR 113.A N ASN 140.A O no hydrogen 3.345 N/A GLY 116.A N ASP 112.A O no hydrogen 3.102 N/A CYS 118.A SG HIS 29.A NE2 no hydrogen 3.645 N/A CYS 118.A SG GLU 115.A O no hydrogen 3.395 N/A CYS 118.A SG GLU 115.A OE1 no hydrogen 3.701 N/A CYS 118.A SG GLY 116.A O no hydrogen 3.640 N/A GLN 120.A N HIS 26.A ND1 no hydrogen 3.352 N/A GLN 120.A NE2 HIS 90.A O no hydrogen 2.352 N/A THR 121.A OG1 VAL 110.A O no hydrogen 3.546 N/A GLU 122.A N VAL 119.A O no hydrogen 3.089 N/A THR 123.A N VAL 119.A O no hydrogen 3.017 N/A THR 123.A OG1 GLN 120.A O no hydrogen 3.002 N/A VAL 124.A N GLN 120.A O no hydrogen 2.949 N/A ARG 126.A N GLU 122.A O no hydrogen 2.865 N/A ARG 126.A NE TYR 174.A OH no hydrogen 2.844 N/A ARG 126.A NH2 TYR 174.A OH no hydrogen 3.092 N/A GLN 127.A N THR 123.A O no hydrogen 2.898 N/A ALA 128.A N VAL 124.A O no hydrogen 2.853 N/A LEU 129.A N LEU 125.A O no hydrogen 2.873 N/A GLY 130.A N ARG 126.A O no hydrogen 3.022 N/A GLU 131.A N GLN 127.A O no hydrogen 3.348 N/A ARG 132.A N LEU 129.A O no hydrogen 3.337 N/A ARG 132.A NE GLN 337.A OE1 no hydrogen 2.571 N/A ARG 132.A NH2 GLN 337.A OE1 no hydrogen 2.744 N/A ILE 133.A N ALA 128.A O no hydrogen 3.213 N/A LYS 134.A NZ HIS 323.A O no hydrogen 2.444 N/A VAL 136.A N ALA 107.A O no hydrogen 2.807 N/A VAL 137.A N THR 190.A O no hydrogen 3.192 N/A VAL 138.A N VAL 109.A O no hydrogen 2.963 N/A ILE 139.A N ALA 192.A O no hydrogen 2.650 N/A ASN 140.A N VAL 111.A O no hydrogen 2.395 N/A ASN 140.A ND2 HIS 29.A O no hydrogen 2.711 N/A ARG 144.A N ASP 143.A OD1 no hydrogen 2.375 N/A ARG 144.A NE GLU 148.A OE2 no hydrogen 3.321 N/A LEU 147.A N ASP 143.A O no hydrogen 3.066 N/A GLU 148.A N ARG 144.A O no hydrogen 3.335 N/A LEU 149.A N ARG 144.A O no hydrogen 2.875 N/A VAL 151.A N ALA 145.A O no hydrogen 3.079 N/A SER 152.A OG ASP 155.A OD2 no hydrogen 2.585 N/A ASP 155.A N SER 152.A OG no hydrogen 3.176 N/A LEU 156.A N SER 152.A O no hydrogen 3.362 N/A GLN 158.A N GLU 154.A O no hydrogen 3.423 N/A THR 159.A N ASP 155.A O no hydrogen 3.165 N/A THR 159.A OG1 ASP 155.A O no hydrogen 3.304 N/A THR 159.A OG1 LEU 156.A O no hydrogen 2.407 N/A PHE 160.A N LEU 156.A O no hydrogen 3.060 N/A ALA 161.A N TYR 157.A O no hydrogen 2.659 N/A ARG 162.A N GLN 158.A O no hydrogen 2.780 N/A THR 163.A N THR 159.A O no hydrogen 3.180 N/A THR 163.A OG1 THR 159.A O no hydrogen 3.254 N/A THR 163.A OG1 PHE 160.A O no hydrogen 3.102 N/A VAL 164.A N PHE 160.A O no hydrogen 3.227 N/A GLU 165.A N ALA 161.A O no hydrogen 3.179 N/A SER 166.A N ARG 162.A O no hydrogen 2.796 N/A VAL 167.A N THR 163.A O no hydrogen 2.983 N/A ASN 168.A N VAL 164.A O no hydrogen 3.027 N/A ASN 168.A ND2 VAL 184.A O no hydrogen 3.035 N/A VAL 169.A N GLU 165.A O no hydrogen 3.167 N/A VAL 171.A N VAL 167.A O no hydrogen 3.308 N/A SER 172.A N ASN 168.A O no hydrogen 3.372 N/A SER 172.A OG ASN 168.A O no hydrogen 3.175 N/A SER 172.A OG VAL 169.A O no hydrogen 2.910 N/A THR 173.A N ILE 170.A O no hydrogen 3.267 N/A THR 173.A OG1 GLY 743.A O no hydrogen 2.551 N/A TYR 174.A N ILE 170.A O no hydrogen 3.128 N/A ALA 175.A N VAL 171.A O no hydrogen 3.173 N/A VAL 182.A N GLY 180.A O no hydrogen 2.718 N/A VAL 184.A N ASN 168.A OD1 no hydrogen 3.274 N/A TYR 185.A N THR 190.A OG1 no hydrogen 2.663 N/A GLY 189.A N PRO 186.A O no hydrogen 3.065 N/A THR 190.A N TYR 185.A O no hydrogen 3.072 N/A THR 190.A OG1 TYR 185.A O no hydrogen 2.303 N/A ALA 192.A N VAL 137.A O no hydrogen 2.831 N/A PHE 193.A N PHE 202.A O no hydrogen 2.756 N/A GLY 194.A N ILE 139.A O no hydrogen 3.183 N/A SER 195.A N TRP 200.A O no hydrogen 2.862 N/A GLY 199.A N SER 195.A O no hydrogen 3.302 N/A TRP 200.A N SER 195.A O no hydrogen 3.220 N/A ALA 201.A N LEU 310.A O no hydrogen 2.809 N/A PHE 202.A N PHE 193.A O no hydrogen 2.732 N/A THR 203.A OG1 VAL 191.A O no hydrogen 2.695 N/A ARG 205.A NH1 GLU 70.A OE2 no hydrogen 3.244 N/A ARG 205.A NH2 GLU 70.A OE2 no hydrogen 3.256 N/A PHE 207.A N THR 203.A O no hydrogen 3.152 N/A ALA 208.A N ILE 204.A O no hydrogen 2.895 N/A THR 209.A N ARG 205.A O no hydrogen 3.219 N/A THR 209.A OG1 GLN 206.A O no hydrogen 3.332 N/A ARG 210.A N PHE 207.A O no hydrogen 3.201 N/A TYR 211.A N ALA 208.A O no hydrogen 3.135 N/A ALA 212.A N ALA 208.A O no hydrogen 3.270 N/A ALA 212.A N THR 209.A O no hydrogen 3.286 N/A LYS 214.A N ARG 210.A O no hydrogen 2.933 N/A ARG 225.A N MET 222.A O no hydrogen 3.215 N/A SER 230.A OG ARG 225.A O no hydrogen 2.155 N/A PHE 231.A N THR 240.A O no hydrogen 2.794 N/A LYS 237.A N ASN 233.A O no hydrogen 2.738 N/A THR 240.A N PHE 231.A O no hydrogen 2.979 N/A ASN 241.A ND2 ASP 229.A O no hydrogen 3.552 N/A ASP 245.A N LYS 249.A O no hydrogen 3.193 N/A GLY 248.A N ASP 245.A OD1 no hydrogen 2.673 N/A LYS 249.A N GLU 247.A OE2 no hydrogen 2.949 N/A LEU 251.A N ASP 243.A O no hydrogen 3.030 N/A ARG 253.A NE GLU 154.A OE2 no hydrogen 3.353 N/A ALA 254.A N SER 230.A O no hydrogen 3.351 N/A PHE 255.A N LEU 226.A O no hydrogen 3.060 N/A MET 257.A N ARG 253.A O no hydrogen 2.727 N/A PHE 258.A N ALA 254.A O no hydrogen 3.003 N/A ILE 259.A N PHE 255.A O no hydrogen 3.152 N/A LEU 260.A N ASN 256.A O no hydrogen 3.175 N/A ASP 261.A N ASN 256.A O no hydrogen 3.190 N/A PHE 264.A N LEU 260.A O no hydrogen 2.818 N/A ARG 265.A N ASP 261.A O no hydrogen 3.037 N/A LEU 266.A N PRO 262.A O no hydrogen 3.335 N/A PHE 267.A N ILE 263.A O no hydrogen 3.075 N/A THR 268.A N PHE 264.A O no hydrogen 2.845 N/A THR 268.A OG1 PHE 264.A O no hydrogen 2.644 N/A THR 268.A OG1 ARG 265.A O no hydrogen 3.022 N/A ALA 269.A N ARG 265.A O no hydrogen 3.043 N/A ILE 270.A N LEU 266.A O no hydrogen 2.973 N/A MET 271.A N PHE 267.A O no hydrogen 3.039 N/A ASN 272.A N THR 268.A O no hydrogen 3.143 N/A PHE 273.A N ILE 270.A O no hydrogen 3.037 N/A LYS 274.A N ALA 269.A O no hydrogen 2.918 N/A GLU 277.A N ASP 276.A OD1 no hydrogen 2.652 N/A GLU 277.A N GLU 277.A OE1 no hydrogen 2.959 N/A LEU 281.A N GLU 277.A O no hydrogen 2.834 N/A LYS 284.A N VAL 280.A O no hydrogen 3.349 N/A LEU 285.A N LEU 281.A O no hydrogen 2.880 N/A ILE 287.A N LEU 282.A O no hydrogen 3.031 N/A LEU 296.A N GLU 293.A O no hydrogen 3.438 N/A LEU 301.A N GLU 297.A O no hydrogen 3.411 N/A LEU 302.A N GLY 298.A O no hydrogen 3.067 N/A LYS 303.A N LYS 299.A O no hydrogen 2.735 N/A LYS 303.A NZ LYS 299.A O no hydrogen 3.420 N/A VAL 304.A N ALA 300.A O no hydrogen 3.199 N/A VAL 305.A N LEU 301.A O no hydrogen 2.867 N/A MET 306.A N LEU 302.A O no hydrogen 3.220 N/A ARG 307.A N LYS 303.A O no hydrogen 3.485 N/A ARG 307.A NE LYS 303.A O no hydrogen 3.109 N/A LYS 308.A N VAL 304.A O no hydrogen 3.245 N/A LYS 308.A NZ GLU 293.A OE1 no hydrogen 2.899 N/A LYS 308.A NZ GLU 293.A OE2 no hydrogen 2.925 N/A PHE 309.A N MET 306.A O no hydrogen 3.350 N/A LEU 310.A N MET 306.A O no hydrogen 2.816 N/A ALA 312.A N GLY 199.A O no hydrogen 3.161 N/A ALA 315.A N PRO 311.A O no hydrogen 3.241 N/A ALA 315.A N ALA 312.A O no hydrogen 3.331 N/A LEU 316.A N ALA 312.A O no hydrogen 3.040 N/A LEU 317.A N ALA 313.A O no hydrogen 2.982 N/A MET 319.A N ALA 315.A O no hydrogen 3.290 N/A ILE 320.A N LEU 316.A O no hydrogen 2.882 N/A ILE 320.A N LEU 317.A O no hydrogen 3.119 N/A VAL 321.A N LEU 317.A O no hydrogen 3.317 N/A LEU 322.A N GLU 318.A O no hydrogen 3.261 N/A HIS 323.A N ILE 320.A O no hydrogen 3.288 N/A HIS 323.A ND1 MET 319.A O no hydrogen 3.233 N/A LEU 324.A N ILE 320.A O no hydrogen 2.660 N/A SER 326.A OG THR 16.A OG1 no hydrogen 3.039 N/A SER 326.A OG THR 329.A OG1 no hydrogen 3.274 N/A THR 329.A OG1 SER 326.A OG no hydrogen 3.274 N/A ALA 330.A N SER 326.A O no hydrogen 2.850 N/A GLN 331.A N PRO 327.A O no hydrogen 2.896 N/A ALA 332.A N THR 329.A O no hydrogen 3.236 N/A TYR 333.A N ALA 330.A O no hydrogen 3.135 N/A ARG 334.A N ALA 330.A O no hydrogen 2.795 N/A ARG 334.A NH1 THR 104.A O no hydrogen 2.605 N/A ARG 334.A NH2 ARG 102.A O no hydrogen 3.269 N/A ALA 335.A N GLN 331.A O no hydrogen 3.303 N/A GLN 337.A N ARG 334.A O no hydrogen 3.041 N/A LEU 338.A N ARG 334.A O no hydrogen 3.194 N/A ALA 343.A N GLY 341.A O no hydrogen 2.717 N/A ASP 345.A N PRO 342.A O no hydrogen 3.144 N/A CYS 348.A SG PRO 342.A O no hydrogen 3.409 N/A CYS 348.A SG ALA 343.A O no hydrogen 3.463 N/A CYS 348.A SG CYS 348.A O no hydrogen 3.068 N/A ILE 349.A N ALA 346.A O no hydrogen 3.142 N/A ALA 350.A N ALA 346.A O no hydrogen 3.116 N/A ILE 351.A N ASN 347.A O no hydrogen 3.105 N/A LYS 352.A N ILE 349.A O no hydrogen 3.280 N/A LYS 352.A NZ GLU 336.A OE2 no hydrogen 2.962 N/A ASN 353.A N ILE 349.A O no hydrogen 2.922 N/A CYS 354.A N ALA 350.A O no hydrogen 3.010 N/A CYS 354.A SG PHE 383.A O no hydrogen 3.440 N/A LEU 360.A N THR 453.A OG1 no hydrogen 3.280 N/A MET 361.A N ALA 384.A O no hydrogen 3.024 N/A LEU 362.A N LEU 451.A O no hydrogen 3.183 N/A TYR 363.A N ARG 381.A O no hydrogen 3.377 N/A VAL 364.A N GLY 449.A O no hydrogen 3.194 N/A SER 365.A N PHE 379.A O no hydrogen 2.943 N/A LYS 366.A N PHE 379.A O no hydrogen 3.487 N/A LYS 366.A NZ GLU 96.A OE1 no hydrogen 3.217 N/A LYS 366.A NZ GLU 96.A OE2 no hydrogen 2.367 N/A TYR 377.A N VAL 368.A O no hydrogen 3.353 N/A PHE 379.A N LYS 366.A O no hydrogen 2.890 N/A GLY 380.A N ILE 436.A O no hydrogen 3.226 N/A ARG 381.A N TYR 363.A O no hydrogen 3.267 N/A VAL 382.A N ASN 434.A O no hydrogen 2.897 N/A PHE 383.A N MET 361.A O no hydrogen 3.366 N/A SER 389.A OG ILE 427.A O no hydrogen 2.804 N/A GLY 390.A N LYS 388.A O no hydrogen 2.721 N/A GLN 391.A N LYS 388.A O no hydrogen 3.100 N/A VAL 393.A N LYS 411.A O no hydrogen 2.709 N/A ARG 394.A N THR 452.A O no hydrogen 2.699 N/A ILE 395.A N PHE 409.A O no hydrogen 2.674 N/A GLN 396.A N THR 450.A O no hydrogen 2.965 N/A GLN 396.A NE2 ALA 457.A O no hydrogen 3.631 N/A GLY 397.A N ASP 407.A OD1 no hydrogen 3.232 N/A TYR 400.A N GLY 397.A O no hydrogen 3.338 N/A VAL 401.A N ASP 406.A OD1 no hydrogen 3.424 N/A PHE 409.A N ILE 395.A O no hydrogen 3.104 N/A LYS 411.A N VAL 393.A O no hydrogen 3.179 N/A LYS 411.A NZ ALA 412.A O no hydrogen 3.425 N/A ARG 415.A NH1 SER 389.A OG no hydrogen 3.003 N/A VAL 416.A N SER 389.A OG no hydrogen 3.419 N/A VAL 417.A N GLY 437.A O no hydrogen 2.874 N/A GLY 421.A N ALA 56.A O no hydrogen 3.081 N/A PHE 423.A N MET 420.A O no hydrogen 3.111 N/A ILE 427.A N VAL 416.A O no hydrogen 2.666 N/A CYS 430.A N ASP 429.A OD1 no hydrogen 2.648 N/A CYS 430.A SG PRO 431.A O no hydrogen 3.776 N/A GLY 433.A N VAL 382.A O no hydrogen 2.761 N/A ASN 434.A N VAL 382.A O no hydrogen 3.266 N/A ILE 436.A N GLY 380.A O no hydrogen 3.033 N/A GLY 437.A N VAL 417.A O no hydrogen 2.950 N/A LEU 438.A N ALA 378.A O no hydrogen 3.067 N/A VAL 439.A N ARG 415.A O no hydrogen 3.135 N/A PHE 444.A N ILE 441.A O no hydrogen 3.257 N/A LYS 447.A NZ SER 494.A O no hydrogen 3.326 N/A LYS 447.A NZ ASP 497.A O no hydrogen 2.925 N/A THR 448.A OG1 LYS 447.A O no hydrogen 2.683 N/A THR 450.A N GLN 396.A O no hydrogen 3.050 N/A LEU 451.A N LEU 362.A O no hydrogen 3.037 N/A THR 452.A N ARG 394.A O no hydrogen 2.876 N/A THR 453.A N ASP 359.A OD1 no hydrogen 3.228 N/A THR 453.A OG1 ASP 359.A OD1 no hydrogen 2.315 N/A GLU 455.A N SER 454.A OG no hydrogen 2.503 N/A THR 456.A N SER 454.A OG no hydrogen 3.337 N/A HIS 458.A N TYR 339.A OH no hydrogen 2.949 N/A ASN 459.A ND2 GLN 396.A O no hydrogen 3.256 N/A ASN 459.A ND2 THR 450.A OG1 no hydrogen 2.816 N/A LYS 461.A N LEU 338.A O no hydrogen 3.236 N/A SER 466.A OG PHE 465.A O no hydrogen 2.689 N/A VAL 473.A N VAL 512.A O no hydrogen 2.949 N/A ALA 474.A N SER 539.A O no hydrogen 3.030 N/A VAL 475.A N HIS 510.A O no hydrogen 2.908 N/A GLU 476.A N LYS 537.A O no hydrogen 3.128 N/A LEU 483.A N ALA 480.A O no hydrogen 3.500 N/A LEU 486.A N ASP 482.A O no hydrogen 3.291 N/A LEU 490.A N VAL 487.A O no hydrogen 3.305 N/A ARG 492.A N GLU 488.A O no hydrogen 3.124 N/A LEU 493.A N GLY 489.A O no hydrogen 2.935 N/A SER 494.A N LEU 490.A O no hydrogen 3.043 N/A SER 494.A OG LEU 490.A O no hydrogen 2.528 N/A SER 494.A OG THR 502.A OG1 no hydrogen 2.627 N/A LYS 495.A N ARG 492.A O no hydrogen 3.326 N/A SER 496.A N ARG 492.A O no hydrogen 3.192 N/A SER 496.A OG ARG 492.A O no hydrogen 3.325 N/A SER 496.A OG LEU 493.A O no hydrogen 3.232 N/A ASP 497.A N LEU 493.A O no hydrogen 3.126 N/A CYS 499.A N ASP 497.A OD1 no hydrogen 3.505 N/A LEU 501.A N ALA 513.A O no hydrogen 3.189 N/A THR 502.A OG1 SER 494.A OG no hydrogen 2.627 N/A TYR 503.A N ILE 511.A O no hydrogen 3.228 N/A TYR 503.A OH GLN 472.A OE1 no hydrogen 3.373 N/A SER 505.A N GLU 509.A O no hydrogen 3.235 N/A GLU 506.A N GLU 506.A OE1 no hydrogen 2.942 N/A SER 507.A N SER 505.A OG no hydrogen 3.235 N/A ILE 511.A N TYR 503.A O no hydrogen 3.132 N/A VAL 512.A N VAL 473.A O no hydrogen 2.829 N/A ALA 513.A N LEU 501.A O no hydrogen 2.787 N/A GLY 514.A N VAL 471.A O no hydrogen 2.584 N/A THR 515.A N HIS 519.A ND1 no hydrogen 3.349 N/A THR 515.A OG1 ASP 92.A O no hydrogen 2.626 N/A THR 515.A OG1 HIS 519.A ND1 no hydrogen 2.754 N/A HIS 519.A ND1 THR 515.A OG1 no hydrogen 2.754 N/A HIS 519.A NE2 ASP 497.A OD2 no hydrogen 2.462 N/A LEU 520.A N GLY 516.A O no hydrogen 2.975 N/A GLU 521.A N LEU 518.A O no hydrogen 2.961 N/A ILE 522.A N LEU 518.A O no hydrogen 3.229 N/A CYS 523.A N HIS 519.A O no hydrogen 3.240 N/A CYS 523.A SG ASP 497.A OD2 no hydrogen 3.508 N/A CYS 523.A SG HIS 519.A O no hydrogen 3.198 N/A LEU 524.A N LEU 520.A O no hydrogen 2.910 N/A GLN 525.A N GLU 521.A O no hydrogen 3.038 N/A ASP 526.A N ILE 522.A O no hydrogen 2.916 N/A GLU 528.A N LEU 524.A O no hydrogen 3.168 N/A GLU 528.A N GLN 525.A O no hydrogen 2.868 N/A HIS 529.A N GLN 525.A O no hydrogen 2.850 N/A HIS 531.A N ASP 526.A O no hydrogen 2.503 N/A LYS 537.A N GLU 476.A O no hydrogen 2.852 N/A LYS 537.A NZ ILE 538.A O no hydrogen 3.334 N/A SER 539.A N ALA 474.A O no hydrogen 3.216 N/A SER 539.A OG PRO 540.A O no hydrogen 3.203 N/A ARG 546.A N GLN 706.A O no hydrogen 2.879 N/A ARG 546.A NH1 TYR 545.A O no hydrogen 2.447 N/A GLU 547.A N GLU 662.A O no hydrogen 3.132 N/A THR 548.A N LYS 704.A O no hydrogen 3.351 N/A THR 548.A OG1 ARG 664.A O no hydrogen 3.181 N/A THR 548.A OG1 SER 665.A OG no hydrogen 2.796 N/A SER 551.A N ASP 702.A OD1 no hydrogen 3.360 N/A SER 551.A OG SER 551.A O no hydrogen 2.383 N/A SER 553.A OG GLN 555.A O no hydrogen 3.124 N/A SER 554.A N LEU 700.A O no hydrogen 3.422 N/A THR 556.A OG1 LEU 570.A O no hydrogen 2.863 N/A ALA 557.A N LEU 570.A O no hydrogen 2.877 N/A SER 559.A N ILE 568.A O no hydrogen 3.489 N/A SER 559.A OG THR 689.A O no hydrogen 3.127 N/A SER 561.A N ASN 566.A O no hydrogen 2.759 N/A SER 561.A OG ASN 563.A OD1 no hydrogen 2.323 N/A ASN 563.A N GLN 685.A OE1 no hydrogen 2.704 N/A LYS 564.A N SER 561.A O no hydrogen 2.811 N/A HIS 565.A N SER 561.A OG no hydrogen 2.937 N/A HIS 565.A N ASN 563.A OD1 no hydrogen 3.247 N/A ASN 566.A N SER 561.A OG no hydrogen 3.014 N/A ARG 567.A N THR 674.A O no hydrogen 3.158 N/A ARG 567.A N THR 674.A OG1 no hydrogen 3.038 N/A ILE 568.A N SER 559.A O no hydrogen 3.239 N/A TYR 569.A N ASP 672.A O no hydrogen 2.583 N/A LEU 570.A N ALA 557.A O no hydrogen 3.449 N/A LYS 571.A N ASN 669.A O no hydrogen 3.168 N/A GLU 573.A N ARG 667.A O no hydrogen 2.816 N/A ILE 575.A N SER 665.A O no hydrogen 2.813 N/A GLU 578.A N GLU 578.A OE1 no hydrogen 2.668 N/A SER 580.A N ASP 576.A O no hydrogen 2.962 N/A SER 580.A OG ASP 576.A O no hydrogen 3.561 N/A LEU 581.A N GLU 577.A O no hydrogen 2.960 N/A ALA 582.A N GLU 578.A O no hydrogen 2.908 N/A ILE 583.A N VAL 579.A O no hydrogen 3.012 N/A GLU 584.A N SER 580.A O no hydrogen 3.057 N/A ASN 585.A N LEU 581.A O no hydrogen 2.847 N/A ILE 588.A N ALA 582.A O no hydrogen 2.980 N/A ASP 592.A N ASN 589.A O no hydrogen 3.305 N/A ARG 597.A N ASP 593.A O no hydrogen 2.710 N/A ARG 597.A NE ASN 589.A O no hydrogen 2.547 N/A ALA 598.A N PHE 594.A O no hydrogen 2.982 N/A ARG 599.A N LYS 595.A O no hydrogen 3.061 N/A ILE 600.A N ALA 596.A O no hydrogen 3.300 N/A MET 601.A N ARG 597.A O no hydrogen 3.304 N/A ALA 602.A N ARG 599.A O no hydrogen 3.404 N/A ASP 604.A N ILE 600.A O no hydrogen 3.281 N/A TRP 607.A N ALA 602.A O no hydrogen 3.252 N/A THR 610.A OG1 ASP 608.A OD2 no hydrogen 2.496 N/A ALA 612.A N ASP 608.A O no hydrogen 3.090 N/A ARG 613.A N VAL 609.A O no hydrogen 3.095 N/A LYS 614.A N ASP 611.A O no hydrogen 3.253 N/A TRP 616.A N VAL 628.A O no hydrogen 3.030 N/A GLY 622.A N GLN 650.A OE1 no hydrogen 3.037 N/A ASN 623.A N PRO 620.A O no hydrogen 3.131 N/A GLY 624.A N PHE 618.A O no hydrogen 2.349 N/A ASN 626.A ND2 GLY 619.A O no hydrogen 3.019 N/A LEU 627.A N VAL 666.A O no hydrogen 2.867 N/A ILE 629.A N VAL 668.A O no hydrogen 2.705 N/A GLN 631.A N ILE 670.A O no hydrogen 2.762 N/A GLN 631.A NE2 ASP 611.A OD1 no hydrogen 3.397 N/A LYS 642.A N HIS 639.A O no hydrogen 3.356 N/A SER 644.A N ILE 641.A O no hydrogen 3.147 N/A VAL 645.A N ILE 641.A O no hydrogen 2.941 N/A VAL 646.A N LYS 642.A O no hydrogen 2.924 N/A ALA 648.A N VAL 645.A O no hydrogen 3.251 N/A PHE 649.A N VAL 645.A O no hydrogen 3.125 N/A GLN 650.A N VAL 646.A O no hydrogen 2.986 N/A ALA 652.A N ALA 648.A O no hydrogen 2.803 N/A THR 653.A N PHE 649.A O no hydrogen 2.855 N/A THR 653.A OG1 PHE 649.A O no hydrogen 2.858 N/A THR 653.A OG1 GLN 650.A O no hydrogen 2.964 N/A LYS 654.A N GLN 650.A O no hydrogen 3.255 N/A LYS 654.A N TRP 651.A O no hydrogen 3.213 N/A GLU 655.A N TRP 651.A O no hydrogen 3.259 N/A GLU 661.A N GLU 547.A OE2 no hydrogen 3.068 N/A MET 663.A N THR 653.A O no hydrogen 3.003 N/A ARG 664.A N GLU 547.A O no hydrogen 3.137 N/A ARG 664.A NH1 GLU 584.A OE1 no hydrogen 2.876 N/A ARG 664.A NH1 GLU 584.A OE2 no hydrogen 3.080 N/A ARG 664.A NH2 GLU 577.A OE2 no hydrogen 3.320 N/A ARG 664.A NH2 GLU 584.A OE1 no hydrogen 3.110 N/A SER 665.A N PRO 625.A O no hydrogen 2.829 N/A SER 665.A OG ARG 664.A O no hydrogen 2.641 N/A VAL 666.A N ASN 626.A OD1 no hydrogen 3.100 N/A ARG 667.A N GLU 573.A O no hydrogen 2.718 N/A VAL 668.A N LEU 627.A O no hydrogen 2.995 N/A ASN 669.A N LYS 571.A O no hydrogen 3.287 N/A ILE 670.A N ILE 629.A O no hydrogen 2.679 N/A ASP 672.A N TYR 569.A O no hydrogen 3.072 N/A VAL 673.A N ASP 672.A OD1 no hydrogen 2.739 N/A THR 674.A N ARG 567.A O no hydrogen 2.957 N/A HIS 676.A N ASN 566.A OD1 no hydrogen 2.918 N/A ASP 678.A N HIS 676.A ND1 no hydrogen 3.111 N/A ARG 681.A NE HIS 676.A O no hydrogen 2.944 N/A ARG 681.A NH1 GLU 640.A OE2 no hydrogen 2.284 N/A ARG 681.A NH2 ALA 677.A O no hydrogen 3.099 N/A GLN 685.A N GLY 682.A O no hydrogen 2.865 N/A THR 689.A OG1 GLN 685.A O no hydrogen 2.269 N/A MET 690.A N ILE 686.A O no hydrogen 2.775 N/A ARG 691.A N ILE 687.A O no hydrogen 3.176 N/A ARG 692.A N PRO 688.A O no hydrogen 3.315 N/A ARG 692.A NE GLU 818.A O no hydrogen 3.526 N/A ALA 693.A N THR 689.A O no hydrogen 3.055 N/A THR 694.A N MET 690.A O no hydrogen 2.485 N/A THR 694.A OG1 MET 690.A O no hydrogen 3.140 N/A TYR 695.A N ARG 691.A O no hydrogen 2.750 N/A TYR 695.A OH GLU 655.A O no hydrogen 2.875 N/A ALA 696.A N ARG 692.A O no hydrogen 2.734 N/A GLY 697.A N ALA 693.A O no hydrogen 2.953 N/A PHE 698.A N THR 694.A O no hydrogen 2.825 N/A LEU 699.A N TYR 695.A O no hydrogen 2.901 N/A LEU 700.A N ALA 696.A O no hydrogen 3.047 N/A ALA 701.A N PHE 698.A O no hydrogen 3.460 N/A LYS 704.A N THR 548.A O no hydrogen 3.175 N/A LYS 704.A NZ GLU 550.A OE2 no hydrogen 2.863 N/A GLN 706.A N ARG 546.A O no hydrogen 2.531 N/A GLU 707.A N SER 783.A O no hydrogen 2.443 N/A VAL 709.A N HIS 781.A O no hydrogen 3.249 N/A PHE 710.A N LEU 753.A O no hydrogen 2.570 N/A LEU 711.A N VAL 778.A O no hydrogen 2.757 N/A VAL 712.A N ALA 751.A O no hydrogen 2.862 N/A GLU 713.A N GLN 776.A O no hydrogen 2.594 N/A ILE 714.A N VAL 749.A O no hydrogen 2.808 N/A GLN 715.A N PHE 774.A O no hydrogen 3.247 N/A CYS 716.A N PHE 747.A O no hydrogen 3.215 N/A CYS 716.A SG PRO 717.A O no hydrogen 3.876 N/A GLN 719.A N GLN 719.A OE1 no hydrogen 2.713 N/A ALA 720.A N PRO 717.A O no hydrogen 3.228 N/A VAL 721.A N GLU 718.A O no hydrogen 3.100 N/A ILE 724.A N ALA 720.A O no hydrogen 3.082 N/A SER 726.A OG GLY 723.A O no hydrogen 3.095 N/A VAL 727.A N ILE 724.A O no hydrogen 3.112 N/A LEU 728.A N ILE 724.A O no hydrogen 3.321 N/A ASN 729.A N TYR 725.A O no hydrogen 3.205 N/A LYS 730.A NZ SER 726.A O no hydrogen 2.457 N/A LYS 731.A N VAL 727.A O no hydrogen 3.342 N/A LYS 731.A NZ GLU 757.A O no hydrogen 3.366 N/A ARG 732.A N ASN 729.A O no hydrogen 3.458 N/A ARG 732.A NE GLU 757.A OE2 no hydrogen 2.824 N/A ARG 732.A NH1 GLU 707.A OE2 no hydrogen 3.203 N/A ARG 732.A NH2 GLU 707.A OE1 no hydrogen 3.465 N/A ARG 732.A NH2 GLU 757.A OE2 no hydrogen 3.478 N/A GLY 733.A N LEU 728.A O no hydrogen 2.817 N/A GLN 734.A N TYR 752.A O no hydrogen 2.856 N/A VAL 736.A N LYS 750.A O no hydrogen 2.812 N/A SER 737.A N LYS 750.A O no hydrogen 3.081 N/A GLU 739.A N THR 748.A O no hydrogen 3.312 N/A THR 744.A N ARG 741.A O no hydrogen 3.475 N/A PHE 747.A N CYS 716.A O no hydrogen 2.732 N/A THR 748.A N GLU 739.A O no hydrogen 2.930 N/A THR 748.A OG1 GLU 739.A OE2 no hydrogen 2.263 N/A VAL 749.A N ILE 714.A O no hydrogen 2.741 N/A LYS 750.A N SER 737.A O no hydrogen 2.825 N/A LYS 750.A NZ GLU 713.A OE1 no hydrogen 3.219 N/A LYS 750.A NZ GLU 713.A OE2 no hydrogen 2.460 N/A ALA 751.A N VAL 712.A O no hydrogen 2.995 N/A TYR 752.A N GLN 734.A O no hydrogen 2.531 N/A TYR 752.A OH ASP 780.A OD2 no hydrogen 3.254 N/A LEU 753.A N PHE 710.A O no hydrogen 2.901 N/A VAL 755.A N PRO 708.A O no hydrogen 3.282 N/A SER 758.A N VAL 755.A O no hydrogen 3.105 N/A SER 758.A OG VAL 755.A O no hydrogen 2.678 N/A PHE 761.A N SER 758.A O no hydrogen 3.136 N/A GLU 764.A N GLY 760.A O no hydrogen 3.306 N/A LEU 765.A N PHE 761.A O no hydrogen 3.046 N/A ARG 766.A N THR 762.A O no hydrogen 2.942 N/A ARG 766.A NH2 THR 515.A O no hydrogen 3.308 N/A GLN 767.A N GLY 763.A O no hydrogen 3.224 N/A ALA 768.A N GLU 764.A O no hydrogen 2.927 N/A THR 769.A OG1 LEU 765.A O no hydrogen 2.484 N/A THR 769.A OG1 GLY 770.A O no hydrogen 3.330 N/A PHE 774.A N GLN 715.A O no hydrogen 3.169 N/A VAL 778.A N LEU 711.A O no hydrogen 3.033 N/A ASP 780.A N VAL 709.A O no hydrogen 3.195 N/A HIS 781.A ND1 TRP 782.A O no hydrogen 3.127 N/A SER 783.A N GLU 707.A O no hydrogen 2.705 N/A THR 784.A OG1 ILE 705.A O no hydrogen 2.631 N/A THR 784.A OG1 LEU 785.A O no hydrogen 3.036 N/A THR 793.A N ASP 791.A O no hydrogen 2.970 N/A SER 794.A OG SER 787.A O no hydrogen 2.708 N/A SER 794.A OG ASP 788.A O no hydrogen 3.440 N/A SER 794.A OG ASP 791.A OD1 no hydrogen 3.552 N/A GLU 798.A N SER 794.A O no hydrogen 2.750 N/A LEU 801.A N GLY 797.A O no hydrogen 3.251 N/A ALA 802.A N GLU 798.A O no hydrogen 2.930 N/A ALA 803.A N ILE 799.A O no hydrogen 2.972 N/A ARG 804.A N VAL 800.A O no hydrogen 2.950 N/A ARG 804.A NE ILE 658.A O no hydrogen 3.131 N/A ARG 804.A NH2 ILE 658.A O no hydrogen 3.211 N/A LYS 805.A N LEU 801.A O no hydrogen 3.160 N/A ARG 806.A N ALA 802.A O no hydrogen 2.868 N/A HIS 807.A N ALA 803.A O no hydrogen 3.051 N/A GLY 808.A N LYS 805.A O no hydrogen 3.118 N/A MET 809.A N ARG 804.A O no hydrogen 2.741 N/A GLN 817.A N GLN 817.A OE1 no hydrogen 2.587 N/A GLU 818.A N GLY 815.A O no hydrogen 3.407 N/A TYR 819.A N TRP 816.A O no hydrogen 3.059 N/A ASP 821.A N LEU 558.A O no hydrogen 3.471 N/A