Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w36_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLY 231.A O no hydrogen 3.498 N/A MET 1.A N ILE 234.A O no hydrogen 3.172 N/A MET 1.A N GLU 235.A OE2 no hydrogen 3.373 N/A ARG 3.A N ILE 236.A O no hydrogen 3.095 N/A VAL 4.A N GLN 321.A O no hydrogen 3.430 N/A TYR 5.A N LEU 238.A O no hydrogen 3.172 N/A TYR 5.A OH HIS 237.A ND1 no hydrogen 2.562 N/A HIS 6.A N LEU 323.A O no hydrogen 2.962 N/A SER 7.A N PHE 240.A O no hydrogen 3.376 N/A SER 7.A OG ARG 9.A O no hydrogen 3.350 N/A ARG 9.A N SER 7.A OG no hydrogen 2.898 N/A GLU 14.A N LEU 10.A O no hydrogen 2.746 N/A ALA 15.A N ASP 11.A O no hydrogen 2.749 N/A LEU 16.A N VAL 12.A O no hydrogen 2.734 N/A MET 17.A N LEU 13.A O no hydrogen 2.816 N/A GLU 18.A N GLU 14.A O no hydrogen 2.575 N/A PHE 19.A N ALA 15.A O no hydrogen 2.735 N/A ILE 20.A N LEU 16.A O no hydrogen 2.886 N/A VAL 21.A N MET 17.A O no hydrogen 3.122 N/A ARG 23.A N PHE 19.A O no hydrogen 2.996 N/A ASP 28.A N ASP 27.A OD1 no hydrogen 2.746 N/A PHE 30.A N ASP 28.A O no hydrogen 2.821 N/A ILE 35.A N ASP 61.A O no hydrogen 2.854 N/A LEU 36.A N PHE 212.A O no hydrogen 2.882 N/A VAL 37.A N PRO 63.A O no hydrogen 3.269 N/A SER 39.A OG MET 667.A O no hydrogen 3.083 N/A THR 40.A OG1 GLN 44.A OE1 no hydrogen 3.125 N/A MET 42.A N SER 39.A OG no hydrogen 3.247 N/A ALA 43.A N SER 39.A O no hydrogen 3.336 N/A GLN 44.A N THR 40.A O no hydrogen 2.619 N/A GLN 44.A NE2 SER 651.A O no hydrogen 3.555 N/A TRP 45.A N GLY 41.A O no hydrogen 2.655 N/A LEU 46.A N MET 42.A O no hydrogen 2.693 N/A GLN 47.A N ALA 43.A O no hydrogen 3.007 N/A MET 48.A N GLN 44.A O no hydrogen 3.015 N/A THR 49.A N TRP 45.A O no hydrogen 2.829 N/A THR 49.A OG1 TRP 45.A O no hydrogen 2.754 N/A LEU 50.A N LEU 46.A O no hydrogen 2.892 N/A SER 51.A N GLN 47.A O no hydrogen 2.865 N/A SER 51.A OG GLN 47.A O no hydrogen 3.428 N/A SER 51.A OG MET 48.A O no hydrogen 2.956 N/A GLN 52.A N MET 48.A O no hydrogen 3.145 N/A GLN 52.A N THR 49.A O no hydrogen 3.157 N/A LYS 53.A N THR 49.A O no hydrogen 3.234 N/A LYS 53.A NZ GLU 18.A OE1 no hydrogen 3.097 N/A GLY 55.A N GLN 52.A O no hydrogen 3.221 N/A ASN 59.A ND2 ALA 58.A O no hydrogen 3.378 N/A ASP 61.A N GLU 33.A O no hydrogen 2.897 N/A PHE 68.A N LEU 64.A O no hydrogen 3.057 N/A ILE 69.A N PRO 65.A O no hydrogen 2.855 N/A TRP 70.A N ALA 66.A O no hydrogen 3.210 N/A TRP 70.A NE1 PRO 81.A O no hydrogen 3.217 N/A ASP 71.A N SER 67.A O no hydrogen 3.125 N/A MET 72.A N PHE 68.A O no hydrogen 2.969 N/A PHE 73.A N ILE 69.A O no hydrogen 3.243 N/A VAL 74.A N TRP 70.A O no hydrogen 3.199 N/A ARG 75.A N MET 72.A O no hydrogen 2.619 N/A ARG 75.A NE ASP 71.A OD2 no hydrogen 2.677 N/A VAL 76.A N MET 72.A O no hydrogen 2.650 N/A LEU 77.A N PHE 73.A O no hydrogen 3.002 N/A PHE 86.A N SER 84.A OG no hydrogen 2.715 N/A SER 90.A OG ASN 87.A O no hydrogen 3.315 N/A MET 91.A N ASN 87.A O no hydrogen 2.977 N/A SER 92.A N LYS 88.A O no hydrogen 3.237 N/A SER 92.A N GLN 89.A O no hydrogen 2.662 N/A SER 92.A OG LYS 88.A O no hydrogen 2.718 N/A SER 92.A OG GLN 89.A O no hydrogen 2.962 N/A TRP 93.A N GLN 89.A O no hydrogen 3.423 N/A LYS 94.A N SER 90.A O no hydrogen 3.078 N/A LYS 94.A NZ GLN 181.A OE1 no hydrogen 2.857 N/A LEU 95.A N MET 91.A O no hydrogen 2.993 N/A MET 96.A N SER 92.A O no hydrogen 3.220 N/A MET 96.A N TRP 93.A O no hydrogen 2.872 N/A THR 97.A N TRP 93.A O no hydrogen 3.058 N/A THR 97.A N LYS 94.A O no hydrogen 3.002 N/A THR 97.A OG1 TRP 93.A O no hydrogen 3.380 N/A THR 97.A OG1 LYS 94.A O no hydrogen 2.713 N/A LEU 98.A N LYS 94.A O no hydrogen 3.044 N/A LEU 99.A N LEU 95.A O no hydrogen 3.037 N/A LEU 102.A N LEU 98.A O no hydrogen 3.026 N/A LEU 103.A N PRO 100.A O no hydrogen 3.378 N/A ARG 105.A NH2 ASP 107.A OD2 no hydrogen 2.370 N/A THR 109.A OG1 GLU 106.A O no hydrogen 2.787 N/A ARG 112.A N PHE 108.A O no hydrogen 2.771 N/A HIS 113.A N THR 109.A O no hydrogen 3.210 N/A TYR 114.A N LEU 110.A O no hydrogen 3.216 N/A LEU 115.A N LEU 111.A O no hydrogen 2.952 N/A THR 116.A N HIS 113.A O no hydrogen 3.403 N/A THR 116.A OG1 HIS 113.A O no hydrogen 2.937 N/A ASP 117.A N THR 116.A OG1 no hydrogen 2.491 N/A ASP 118.A N THR 116.A O no hydrogen 2.064 N/A LYS 123.A N SER 119.A OG no hydrogen 3.284 N/A LYS 123.A NZ ASP 117.A OD2 no hydrogen 3.332 N/A PHE 125.A N LYS 121.A O no hydrogen 2.838 N/A GLN 126.A N ARG 122.A O no hydrogen 3.281 N/A GLN 126.A N LYS 123.A O no hydrogen 2.883 N/A LEU 127.A N LYS 123.A O no hydrogen 2.941 N/A SER 128.A N LEU 124.A O no hydrogen 2.931 N/A SER 128.A OG LEU 124.A O no hydrogen 3.227 N/A SER 129.A N GLN 126.A O no hydrogen 2.882 N/A SER 129.A OG PHE 125.A O no hydrogen 3.215 N/A LYS 130.A N GLN 126.A O no hydrogen 2.907 N/A ALA 131.A N LEU 127.A O no hydrogen 2.821 N/A ALA 132.A N SER 128.A O no hydrogen 3.035 N/A ASP 133.A N SER 129.A O no hydrogen 2.710 N/A LEU 134.A N LYS 130.A O no hydrogen 3.035 N/A PHE 135.A N ALA 131.A O no hydrogen 3.120 N/A ASP 136.A N ALA 132.A O no hydrogen 3.071 N/A GLN 137.A N ASP 133.A O no hydrogen 3.060 N/A TYR 138.A N LEU 134.A O no hydrogen 2.698 N/A LEU 139.A N PHE 135.A O no hydrogen 2.719 N/A VAL 140.A N GLN 137.A O no hydrogen 2.425 N/A TYR 141.A N GLN 137.A O no hydrogen 2.961 N/A ARG 142.A NH1 LYS 700.A O no hydrogen 3.285 N/A ARG 142.A NH2 ASP 705.A OD2 no hydrogen 2.771 N/A TRP 145.A N ARG 142.A O no hydrogen 3.156 N/A LEU 146.A N PRO 143.A O no hydrogen 3.040 N/A GLN 148.A N ASP 144.A O no hydrogen 3.087 N/A TRP 149.A N TRP 145.A O no hydrogen 2.889 N/A GLU 150.A N LEU 146.A O no hydrogen 2.878 N/A THR 151.A OG1 GLN 148.A O no hydrogen 2.898 N/A THR 151.A OG1 HIS 153.A ND1 no hydrogen 2.702 N/A GLY 152.A N TRP 149.A O no hydrogen 3.094 N/A HIS 153.A N GLN 148.A O no hydrogen 3.177 N/A HIS 153.A N THR 151.A OG1 no hydrogen 3.370 N/A HIS 153.A ND1 THR 151.A OG1 no hydrogen 2.702 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.742 N/A GLN 162.A NE2 VAL 155.A O no hydrogen 3.444 N/A TRP 164.A N ALA 161.A O no hydrogen 3.090 N/A GLN 165.A N ALA 161.A O no hydrogen 2.764 N/A GLN 165.A NE2 TYR 138.A OH no hydrogen 2.780 N/A ALA 166.A N GLN 162.A O no hydrogen 2.938 N/A LEU 168.A N TRP 164.A O no hydrogen 2.765 N/A TRP 169.A N GLN 165.A O no hydrogen 2.675 N/A LYS 170.A N ALA 166.A O no hydrogen 3.129 N/A LYS 170.A NZ GLU 174.A OE2 no hydrogen 2.444 N/A ALA 171.A N PRO 167.A O no hydrogen 2.898 N/A LEU 172.A N LEU 168.A O no hydrogen 2.839 N/A VAL 173.A N TRP 169.A O no hydrogen 2.899 N/A GLU 174.A N LYS 170.A O no hydrogen 3.133 N/A TYR 175.A N ALA 171.A O no hydrogen 2.879 N/A THR 176.A N LEU 172.A O no hydrogen 2.718 N/A HIS 177.A N VAL 173.A O no hydrogen 3.085 N/A HIS 177.A N GLU 174.A O no hydrogen 2.513 N/A GLN 178.A N GLU 174.A O no hydrogen 2.828 N/A LEU 179.A N TYR 175.A O no hydrogen 3.042 N/A GLY 180.A N HIS 177.A O no hydrogen 2.425 N/A GLN 181.A N THR 176.A O no hydrogen 3.026 N/A ARG 186.A NH1 ALA 66.A O no hydrogen 3.279 N/A ARG 186.A NH2 ALA 66.A O no hydrogen 3.507 N/A ASN 188.A ND2 ARG 183.A O no hydrogen 2.933 N/A TYR 190.A OH ASP 144.A OD1 no hydrogen 3.235 N/A PHE 193.A N LEU 189.A O no hydrogen 3.304 N/A ILE 194.A N TYR 190.A O no hydrogen 3.014 N/A GLU 195.A N GLN 191.A O no hydrogen 2.913 N/A THR 196.A N ARG 192.A O no hydrogen 2.912 N/A LEU 197.A N ILE 194.A O no hydrogen 3.134 N/A GLU 198.A N ILE 194.A O no hydrogen 2.505 N/A SER 199.A N GLU 195.A O no hydrogen 2.897 N/A SER 199.A OG GLU 195.A O no hydrogen 3.397 N/A THR 202.A OG1 ALA 200.A O no hydrogen 2.996 N/A CYS 203.A N THR 202.A OG1 no hydrogen 2.485 N/A CYS 203.A SG THR 202.A OG1 no hydrogen 3.734 N/A SER 209.A OG GLU 31.A OE1 no hydrogen 2.990 N/A VAL 211.A N GLU 235.A O no hydrogen 2.723 N/A PHE 212.A N MET 34.A O no hydrogen 2.887 N/A ILE 213.A N HIS 237.A O no hydrogen 3.032 N/A CYS 214.A N LEU 36.A O no hydrogen 3.159 N/A LEU 224.A N PRO 220.A O no hydrogen 3.305 N/A LEU 224.A N PRO 221.A O no hydrogen 2.774 N/A GLN 225.A N PRO 221.A O no hydrogen 3.039 N/A ALA 226.A N VAL 222.A O no hydrogen 2.845 N/A GLN 228.A N LEU 224.A O no hydrogen 2.850 N/A ALA 229.A N GLN 225.A O no hydrogen 2.921 N/A LEU 230.A N ALA 226.A O no hydrogen 3.078 N/A GLY 231.A N LEU 227.A O no hydrogen 2.640 N/A LYS 232.A N LEU 230.A O no hydrogen 2.727 N/A LYS 232.A NZ GLU 198.A O no hydrogen 3.258 N/A HIS 233.A N LEU 230.A O no hydrogen 3.355 N/A HIS 233.A NE2 LEU 197.A O no hydrogen 3.236 N/A ILE 234.A N LEU 230.A O no hydrogen 3.447 N/A GLU 235.A N SER 209.A O no hydrogen 2.965 N/A ILE 236.A N MET 1.A O no hydrogen 3.021 N/A HIS 237.A N VAL 211.A O no hydrogen 2.820 N/A HIS 237.A ND1 TYR 5.A OH no hydrogen 2.562 N/A LEU 238.A N ARG 3.A O no hydrogen 3.204 N/A LEU 239.A N ILE 213.A O no hydrogen 2.769 N/A PHE 240.A N TYR 5.A O no hydrogen 3.072 N/A ASN 242.A N SER 7.A O no hydrogen 2.875 N/A ASN 242.A ND2 HIS 6.A ND1 no hydrogen 2.795 N/A CYS 244.A N ASN 242.A OD1 no hydrogen 3.353 N/A CYS 244.A SG TYR 246.A O no hydrogen 3.552 N/A CYS 244.A SG LEU 343.A O no hydrogen 3.537 N/A ARG 245.A N LEU 343.A O no hydrogen 3.262 N/A ARG 245.A NH1 GLU 344.A OE2 no hydrogen 2.660 N/A ARG 245.A NH2 ASP 328.A OD1 no hydrogen 2.821 N/A TYR 247.A OH ASP 250.A O no hydrogen 2.381 N/A TRP 248.A NE1 ASN 242.A OD1 no hydrogen 3.012 N/A ILE 251.A N ASP 290.A O no hydrogen 3.512 N/A LYS 252.A NZ TYR 312.A OH no hydrogen 3.432 N/A TYR 256.A N ASP 253.A O no hydrogen 3.198 N/A TYR 256.A OH SER 315.A O no hydrogen 3.052 N/A LYS 259.A N TYR 256.A O no hydrogen 2.886 N/A LEU 260.A N LEU 257.A O no hydrogen 2.935 N/A LEU 261.A N LEU 257.A O no hydrogen 3.180 N/A THR 262.A OG1 LEU 260.A O no hydrogen 2.949 N/A ARG 266.A N PHE 269.A O no hydrogen 2.929 N/A ARG 272.A N GLN 264.A O no hydrogen 3.111 N/A LEU 274.A N GLU 273.A OE2 no hydrogen 1.952 N/A SER 280.A OG PRO 275.A O no hydrogen 3.237 N/A SER 280.A OG LEU 276.A O no hydrogen 3.299 N/A SER 280.A OG ARG 278.A O no hydrogen 3.023 N/A ASN 282.A N ARG 278.A O no hydrogen 3.235 N/A GLU 292.A N ASP 250.A OD1 no hydrogen 3.215 N/A ASN 297.A ND2 GLU 346.A O no hydrogen 3.225 N/A LEU 299.A N ASN 297.A OD1 no hydrogen 2.764 N/A LEU 300.A N ASN 297.A OD1 no hydrogen 2.837 N/A ALA 301.A N ASN 297.A O no hydrogen 2.784 N/A SER 302.A N PRO 298.A O no hydrogen 3.125 N/A SER 302.A OG GLU 750.A OE1 no hydrogen 3.336 N/A TRP 303.A N LEU 299.A O no hydrogen 2.854 N/A TRP 303.A NE1 GLU 750.A OE1 no hydrogen 2.932 N/A GLY 304.A N LEU 300.A O no hydrogen 3.365 N/A ARG 308.A N GLY 304.A O no hydrogen 2.905 N/A ARG 308.A NH2 TRP 248.A O no hydrogen 2.720 N/A ARG 308.A NH2 GLY 249.A O no hydrogen 3.368 N/A ASP 309.A N LYS 305.A O no hydrogen 3.325 N/A TYR 310.A N LEU 306.A O no hydrogen 3.292 N/A ILE 311.A N GLY 307.A O no hydrogen 2.733 N/A TYR 312.A N ARG 308.A O no hydrogen 2.786 N/A LEU 313.A N ASP 309.A O no hydrogen 2.916 N/A LEU 314.A N TYR 310.A O no hydrogen 3.071 N/A SER 315.A N ILE 311.A O no hydrogen 3.422 N/A SER 315.A OG ILE 311.A O no hydrogen 3.212 N/A SER 315.A OG TYR 312.A O no hydrogen 3.444 N/A ASP 316.A N LEU 313.A O no hydrogen 3.331 N/A LEU 323.A N VAL 4.A O no hydrogen 2.958 N/A ASP 324.A N ARG 265.A O no hydrogen 2.673 N/A THR 330.A OG1 ASP 332.A OD1 no hydrogen 3.501 N/A ASP 332.A N THR 330.A O no hydrogen 3.080 N/A ASP 332.A N ASP 332.A OD1 no hydrogen 2.220 N/A LEU 334.A N ASP 371.A OD1 no hydrogen 2.688 N/A LEU 335.A N SER 373.A OG no hydrogen 3.120 N/A ASN 337.A N ASN 333.A O no hydrogen 2.810 N/A ILE 338.A N LEU 334.A O no hydrogen 3.131 N/A GLN 339.A N LEU 335.A O no hydrogen 2.971 N/A GLN 339.A NE2 ILE 721.A O no hydrogen 3.684 N/A SER 340.A N HIS 336.A O no hydrogen 2.759 N/A SER 340.A OG VAL 329.A O no hydrogen 3.327 N/A ASP 341.A N ASN 337.A O no hydrogen 2.613 N/A ILE 342.A N ILE 338.A O no hydrogen 3.032 N/A LEU 343.A N GLN 339.A O no hydrogen 2.806 N/A GLU 344.A N SER 340.A O no hydrogen 2.830 N/A LEU 345.A N ILE 342.A O no hydrogen 3.164 N/A GLU 346.A N ASP 341.A O no hydrogen 2.828 N/A ASN 347.A ND2 ALA 349.A O no hydrogen 3.381 N/A ARG 348.A N TYR 754.A OH no hydrogen 3.285 N/A ARG 348.A NE GLU 346.A OE1 no hydrogen 2.951 N/A ARG 348.A NH2 GLU 346.A OE1 no hydrogen 2.714 N/A VAL 350.A N GLN 757.A O no hydrogen 2.527 N/A ASN 354.A ND2 ASN 354.A O no hydrogen 2.714 N/A PHE 358.A N ASN 354.A O no hydrogen 3.004 N/A SER 359.A N ILE 355.A O no hydrogen 2.927 N/A SER 359.A OG ILE 355.A O no hydrogen 2.714 N/A ARG 360.A NH1 ASP 362.A OD1 no hydrogen 2.662 N/A LYS 364.A N SER 361.A O no hydrogen 3.166 N/A LYS 364.A NZ CYS 769.A O no hydrogen 2.968 N/A LYS 364.A NZ SER 772.A OG no hydrogen 2.670 N/A ARG 365.A N SER 758.A O no hydrogen 2.810 N/A ARG 365.A NH1 ASP 341.A OD2 no hydrogen 3.147 N/A ARG 365.A NH2 ASP 341.A OD1 no hydrogen 2.631 N/A ARG 365.A NH2 ASP 341.A OD2 no hydrogen 3.517 N/A LEU 367.A N TYR 760.A O no hydrogen 2.511 N/A LEU 370.A N ASP 368.A OD1 no hydrogen 2.641 N/A ASP 371.A N ASP 368.A O no hydrogen 3.018 N/A SER 373.A N ASP 371.A OD2 no hydrogen 3.139 N/A SER 373.A OG ASP 371.A OD2 no hydrogen 3.369 N/A THR 375.A N LEU 727.A O no hydrogen 3.165 N/A THR 375.A OG1 SER 372.A O no hydrogen 2.831 N/A PHE 376.A N LEU 780.A O no hydrogen 2.862 N/A HIS 377.A ND1 HIS 784.A NE2 no hydrogen 2.700 N/A CYS 379.A N TYR 731.A O no hydrogen 3.023 N/A CYS 379.A SG TYR 731.A O no hydrogen 3.985 N/A ARG 384.A NE GLU 387.A OE1 no hydrogen 2.475 N/A ARG 384.A NH1 THR 785.A O no hydrogen 2.271 N/A GLU 385.A N SER 381.A O no hydrogen 2.667 N/A VAL 386.A N PRO 382.A O no hydrogen 2.715 N/A VAL 386.A N GLN 383.A O no hydrogen 2.871 N/A GLU 387.A N GLN 383.A O no hydrogen 2.870 N/A VAL 388.A N ARG 384.A O no hydrogen 2.860 N/A LEU 389.A N GLU 385.A O no hydrogen 3.351 N/A HIS 390.A N VAL 386.A O no hydrogen 2.787 N/A ASP 391.A N GLU 387.A O no hydrogen 3.079 N/A ARG 392.A N VAL 388.A O no hydrogen 3.130 N/A LEU 393.A N LEU 389.A O no hydrogen 2.750 N/A LEU 394.A N HIS 390.A O no hydrogen 3.210 N/A ALA 395.A N ASP 391.A O no hydrogen 2.892 N/A MET 396.A N ARG 392.A O no hydrogen 2.842 N/A LEU 397.A N LEU 393.A O no hydrogen 2.830 N/A LEU 397.A N LEU 394.A O no hydrogen 3.087 N/A GLU 398.A N LEU 394.A O no hydrogen 2.759 N/A GLU 399.A N ALA 395.A O no hydrogen 2.811 N/A THR 402.A OG1 ASP 400.A OD2 no hydrogen 2.728 N/A THR 402.A OG1 PRO 401.A O no hydrogen 2.882 N/A LEU 403.A N PRO 401.A O no hydrogen 2.271 N/A THR 404.A OG1 ASP 407.A OD2 no hydrogen 3.413 N/A ASP 407.A N THR 404.A O no hydrogen 3.331 N/A ILE 408.A N PRO 405.A O no hydrogen 3.183 N/A ILE 409.A N VAL 674.A O no hydrogen 3.079 N/A VAL 410.A N ASN 660.A O no hydrogen 2.527 N/A MET 411.A N CYS 676.A O no hydrogen 2.957 N/A VAL 412.A N CYS 662.A O no hydrogen 2.871 N/A ASP 416.A N ASP 414.A OD1 no hydrogen 2.758 N/A SER 417.A N ASP 414.A O no hydrogen 3.087 N/A SER 417.A N ASP 414.A OD1 no hydrogen 3.218 N/A SER 417.A OG ASP 414.A O no hydrogen 2.971 N/A TYR 418.A OH GLU 385.A OE1 no hydrogen 2.675 N/A SER 419.A N ILE 415.A O no hydrogen 3.164 N/A ILE 422.A N TYR 418.A O no hydrogen 2.904 N/A GLN 423.A N SER 419.A O no hydrogen 2.964 N/A ALA 424.A N PRO 420.A O no hydrogen 2.858 N/A VAL 425.A N PHE 421.A O no hydrogen 2.973 N/A PHE 426.A N ILE 422.A O no hydrogen 2.910 N/A GLY 427.A N ALA 424.A O no hydrogen 2.714 N/A ARG 433.A NE ASP 432.A OD1 no hydrogen 3.391 N/A ARG 433.A NH2 ASP 432.A OD1 no hydrogen 3.335 N/A TYR 434.A N ALA 431.A O no hydrogen 2.932 N/A ALA 438.A N VAL 659.A O no hydrogen 3.179 N/A SER 440.A N ILE 661.A O no hydrogen 2.876 N/A ASP 441.A N ILE 650.A O no hydrogen 3.011 N/A ARG 443.A N ASP 416.A OD1 no hydrogen 3.157 N/A ALA 444.A N GLU 648.A O no hydrogen 3.063 N/A ARG 445.A N LEU 645.A O no hydrogen 3.143 N/A ARG 445.A NE ASP 646.A OD1 no hydrogen 2.875 N/A ARG 445.A NH2 ASP 646.A OD1 no hydrogen 3.245 N/A SER 447.A N ARG 443.A O no hydrogen 2.968 N/A SER 447.A N ALA 444.A O no hydrogen 2.920 N/A SER 447.A OG ARG 443.A O no hydrogen 3.181 N/A SER 447.A OG ALA 444.A O no hydrogen 3.402 N/A SER 447.A OG HIS 448.A ND1 no hydrogen 3.100 N/A HIS 448.A N ARG 445.A O no hydrogen 3.068 N/A HIS 448.A ND1 ALA 444.A O no hydrogen 3.244 N/A ALA 453.A N PRO 449.A O no hydrogen 3.338 N/A PHE 454.A N VAL 450.A O no hydrogen 2.694 N/A ILE 455.A N LEU 451.A O no hydrogen 3.046 N/A SER 456.A N GLU 452.A O no hydrogen 2.924 N/A LEU 457.A N ALA 453.A O no hydrogen 3.227 N/A LEU 458.A N PHE 454.A O no hydrogen 2.991 N/A SER 459.A N SER 456.A O no hydrogen 3.067 N/A SER 459.A OG ILE 455.A O no hydrogen 3.094 N/A LEU 460.A N LEU 457.A O no hydrogen 2.921 N/A ASP 462.A N SER 459.A O no hydrogen 2.654 N/A SER 463.A N LEU 460.A O no hydrogen 2.958 N/A PHE 465.A N SER 463.A OG no hydrogen 2.700 N/A SER 467.A N ARG 503.A O no hydrogen 2.654 N/A SER 467.A OG ARG 503.A O no hydrogen 2.657 N/A VAL 470.A N VAL 466.A O no hydrogen 3.134 N/A LEU 471.A N SER 467.A O no hydrogen 2.905 N/A ALA 472.A N GLU 468.A O no hydrogen 2.722 N/A LEU 473.A N VAL 470.A O no hydrogen 2.807 N/A LEU 474.A N LEU 471.A O no hydrogen 2.868 N/A ASP 475.A N ALA 472.A O no hydrogen 2.578 N/A VAL 476.A N LEU 473.A O no hydrogen 2.996 N/A LEU 479.A N VAL 476.A O no hydrogen 2.584 N/A ALA 480.A N VAL 476.A O no hydrogen 3.123 N/A ALA 481.A N PRO 477.A O no hydrogen 2.692 N/A ARG 482.A N VAL 478.A O no hydrogen 3.279 N/A ARG 482.A NE ASN 596.A O no hydrogen 3.190 N/A ARG 482.A NE ALA 597.A O no hydrogen 3.145 N/A ARG 482.A NH1 ARG 482.A O no hydrogen 3.368 N/A ARG 482.A NH2 ASN 596.A O no hydrogen 3.305 N/A ASP 484.A N ALA 481.A O no hydrogen 3.170 N/A ILE 485.A N ALA 480.A O no hydrogen 3.004 N/A GLY 489.A N THR 486.A OG1 no hydrogen 3.242 N/A LEU 490.A N THR 486.A O no hydrogen 2.877 N/A ARG 491.A N GLU 487.A O no hydrogen 3.283 N/A ARG 491.A N GLU 488.A O no hydrogen 3.264 N/A ARG 491.A NH2 GLU 860.A OE1 no hydrogen 3.481 N/A TYR 492.A N GLY 489.A O no hydrogen 2.695 N/A LEU 493.A N GLY 489.A O no hydrogen 2.946 N/A ARG 494.A N LEU 490.A O no hydrogen 2.974 N/A ARG 494.A NH1 GLU 468.A OE2 no hydrogen 2.446 N/A ARG 494.A NH2 GLU 468.A OE1 no hydrogen 3.304 N/A GLN 495.A N ARG 491.A O no hydrogen 3.276 N/A TRP 496.A N TYR 492.A O no hydrogen 2.674 N/A VAL 497.A N LEU 493.A O no hydrogen 2.732 N/A ASN 498.A N ARG 494.A O no hydrogen 3.158 N/A GLU 499.A N GLN 495.A O no hydrogen 2.970 N/A SER 500.A N TRP 496.A O no hydrogen 2.638 N/A SER 500.A OG TRP 496.A O no hydrogen 2.763 N/A SER 500.A OG VAL 497.A O no hydrogen 3.164 N/A GLY 501.A N ASN 498.A O no hydrogen 3.365 N/A ILE 502.A N VAL 497.A O no hydrogen 3.342 N/A ARG 503.A N HIS 522.A O no hydrogen 3.124 N/A ARG 503.A NE ILE 502.A O no hydrogen 2.509 N/A ARG 503.A NH2 ILE 502.A O no hydrogen 3.403 N/A TRP 504.A N HIS 522.A O no hydrogen 3.378 N/A TRP 504.A NE1 GLU 868.A OE1 no hydrogen 2.508 N/A ARG 512.A N ASP 508.A O no hydrogen 2.796 N/A GLU 513.A N ASP 509.A O no hydrogen 2.599 N/A LEU 514.A N VAL 511.A O no hydrogen 2.949 N/A GLU 515.A N ARG 512.A O no hydrogen 2.614 N/A LEU 516.A N VAL 511.A O no hydrogen 3.248 N/A THR 523.A OG1 ILE 506.A O no hydrogen 3.192 N/A TRP 524.A N GLY 505.A O no hydrogen 2.640 N/A TRP 524.A NE1 PHE 465.A O no hydrogen 3.114 N/A ARG 525.A N ILE 506.A O no hydrogen 3.292 N/A PHE 526.A N THR 523.A OG1 no hydrogen 3.255 N/A GLY 527.A N THR 523.A O no hydrogen 3.230 N/A LEU 528.A N TRP 524.A O no hydrogen 2.658 N/A THR 529.A N ARG 525.A O no hydrogen 2.771 N/A THR 529.A OG1 ARG 525.A O no hydrogen 2.549 N/A ARG 530.A N PHE 526.A O no hydrogen 2.817 N/A ARG 530.A NE LEU 548.A O no hydrogen 2.868 N/A ARG 530.A NH1 PRO 549.A O no hydrogen 3.402 N/A ARG 530.A NH2 SER 500.A O no hydrogen 3.051 N/A MET 531.A N GLY 527.A O no hydrogen 3.032 N/A LEU 532.A N LEU 528.A O no hydrogen 3.035 N/A LEU 533.A N THR 529.A O no hydrogen 2.747 N/A GLY 534.A N ARG 530.A O no hydrogen 2.848 N/A TYR 535.A N LEU 532.A O no hydrogen 2.869 N/A ALA 536.A N LEU 532.A O no hydrogen 3.442 N/A SER 539.A N ASP 551.A OD1 no hydrogen 2.772 N/A TRP 544.A N VAL 547.A O no hydrogen 2.660 N/A GLN 545.A NE2 TRP 544.A O no hydrogen 3.380 N/A LEU 548.A N ALA 903.A O no hydrogen 3.163 N/A TYR 550.A N ARG 530.A O no hydrogen 2.792 N/A TYR 550.A OH GLU 499.A OE2 no hydrogen 2.809 N/A ASP 551.A N ASP 551.A OD2 no hydrogen 2.256 N/A SER 553.A OG MET 531.A O no hydrogen 3.251 N/A SER 553.A OG TYR 550.A O no hydrogen 3.498 N/A SER 554.A OG GLY 534.A O no hydrogen 3.412 N/A SER 554.A OG ASP 551.A O no hydrogen 2.696 N/A GLU 559.A N LEU 556.A O no hydrogen 2.709 N/A LEU 560.A N ILE 557.A O no hydrogen 2.722 N/A GLY 562.A N ALA 558.A O no hydrogen 3.382 N/A HIS 563.A N GLU 559.A O no hydrogen 3.454 N/A LEU 564.A N LEU 560.A O no hydrogen 3.017 N/A ALA 565.A N VAL 561.A O no hydrogen 2.868 N/A SER 566.A N GLY 562.A O no hydrogen 2.796 N/A LEU 567.A N HIS 563.A O no hydrogen 2.990 N/A LEU 568.A N LEU 564.A O no hydrogen 2.931 N/A MET 569.A N ALA 565.A O no hydrogen 3.028 N/A MET 569.A N SER 566.A O no hydrogen 2.991 N/A GLN 570.A N SER 566.A O no hydrogen 3.019 N/A LEU 571.A N LEU 567.A O no hydrogen 3.151 N/A ASN 572.A N LEU 568.A O no hydrogen 3.168 N/A ILE 573.A N MET 569.A O no hydrogen 2.811 N/A TRP 574.A N GLN 570.A O no hydrogen 3.057 N/A ARG 575.A N LEU 571.A O no hydrogen 2.727 N/A ARG 576.A N ASN 572.A O no hydrogen 3.043 N/A GLY 577.A N ILE 573.A O no hydrogen 3.152 N/A LEU 578.A N TRP 574.A O no hydrogen 2.891 N/A ALA 579.A N ARG 576.A O no hydrogen 3.138 N/A ARG 582.A N VAL 632.A O no hydrogen 3.204 N/A ARG 582.A NE GLY 577.A O no hydrogen 3.544 N/A ARG 582.A NH1 GLU 586.A O no hydrogen 3.399 N/A GLU 585.A N GLU 585.A OE1 no hydrogen 2.828 N/A GLU 586.A N PRO 583.A O no hydrogen 2.445 N/A TRP 587.A N LEU 584.A O no hydrogen 2.769 N/A TRP 587.A NE1 VAL 632.A O no hydrogen 2.963 N/A LEU 588.A N GLU 585.A O no hydrogen 3.205 N/A VAL 590.A N TRP 587.A O no hydrogen 3.213 N/A ASP 593.A N PRO 589.A O no hydrogen 3.065 N/A ASP 593.A N VAL 590.A O no hydrogen 2.816 N/A MET 594.A N VAL 590.A O no hydrogen 2.795 N/A LEU 595.A N CYS 591.A O no hydrogen 3.068 N/A ALA 597.A N ASP 593.A O no hydrogen 2.882 N/A PHE 598.A N MET 594.A O no hydrogen 3.116 N/A PHE 598.A N LEU 595.A O no hydrogen 3.212 N/A PHE 599.A N LEU 595.A O no hydrogen 2.887 N/A LEU 600.A N VAL 478.A O no hydrogen 3.037 N/A ASP 602.A N THR 605.A OG1 no hydrogen 2.873 N/A ALA 603.A N ASP 602.A OD1 no hydrogen 2.354 N/A GLU 604.A N ASP 602.A OD1 no hydrogen 2.916 N/A ALA 607.A N GLU 604.A O no hydrogen 2.676 N/A ALA 608.A N GLU 604.A O no hydrogen 3.354 N/A MET 609.A N THR 605.A O no hydrogen 2.499 N/A THR 610.A N GLU 606.A O no hydrogen 2.968 N/A THR 610.A OG1 GLU 606.A O no hydrogen 3.227 N/A LEU 611.A N ALA 607.A O no hydrogen 2.986 N/A ILE 612.A N ALA 608.A O no hydrogen 3.306 N/A ILE 612.A N MET 609.A O no hydrogen 3.091 N/A GLU 613.A N MET 609.A O no hydrogen 3.389 N/A GLN 614.A N THR 610.A O no hydrogen 3.138 N/A GLN 615.A N LEU 611.A O no hydrogen 3.157 N/A TRP 616.A N ILE 612.A O no hydrogen 2.745 N/A TRP 616.A NE1 TRP 587.A O no hydrogen 3.080 N/A GLN 617.A N GLU 613.A O no hydrogen 2.763 N/A ALA 618.A N GLN 614.A O no hydrogen 2.781 N/A ILE 619.A N GLN 615.A O no hydrogen 2.801 N/A ILE 620.A N TRP 616.A O no hydrogen 3.185 N/A ALA 621.A N GLN 617.A O no hydrogen 2.831 N/A GLU 622.A N ALA 618.A O no hydrogen 2.930 N/A GLY 623.A N ILE 619.A O no hydrogen 3.175 N/A LEU 624.A N ILE 620.A O no hydrogen 2.826 N/A GLY 625.A N ALA 621.A O no hydrogen 2.722 N/A ALA 626.A N GLU 622.A O no hydrogen 3.514 N/A GLN 627.A N LEU 624.A O no hydrogen 2.613 N/A ALA 631.A N ASP 630.A OD2 no hydrogen 2.949 N/A VAL 632.A N ARG 582.A O no hydrogen 2.862 N/A ARG 638.A N LEU 634.A O no hydrogen 2.651 N/A ARG 638.A NE SER 459.A OG no hydrogen 3.071 N/A ARG 638.A NH1 ASP 639.A OD1 no hydrogen 3.456 N/A ARG 638.A NH2 ASP 462.A OD2 no hydrogen 3.322 N/A ASP 639.A N SER 635.A O no hydrogen 2.771 N/A GLU 640.A N LEU 636.A O no hydrogen 3.304 N/A LEU 641.A N LEU 637.A O no hydrogen 2.968 N/A ALA 642.A N ARG 638.A O no hydrogen 2.978 N/A GLN 643.A N ASP 639.A O no hydrogen 3.049 N/A ARG 644.A N GLU 640.A O no hydrogen 2.871 N/A ARG 644.A NH2 GLU 622.A OE2 no hydrogen 3.015 N/A LEU 645.A N LEU 641.A O no hydrogen 2.759 N/A ASP 646.A N GLN 643.A O no hydrogen 2.998 N/A ARG 649.A NH1 ASP 441.A O no hydrogen 2.792 N/A ILE 650.A N ARG 442.A O no hydrogen 2.914 N/A ALA 656.A N ARG 653.A O no hydrogen 3.433 N/A VAL 659.A N PRO 405.A O no hydrogen 2.819 N/A ASN 660.A N ILE 408.A O no hydrogen 3.409 N/A ASN 660.A ND2 PHE 654.A O no hydrogen 3.009 N/A ILE 661.A N ALA 438.A O no hydrogen 3.331 N/A CYS 662.A N VAL 410.A O no hydrogen 2.835 N/A CYS 662.A SG VAL 410.A O no hydrogen 3.780 N/A CYS 662.A SG THR 663.A O no hydrogen 3.731 N/A THR 663.A N ASP 441.A OD2 no hydrogen 3.081 N/A THR 663.A OG1 ASP 441.A OD2 no hydrogen 3.431 N/A ARG 668.A NH1 THR 663.A O no hydrogen 3.399 N/A ARG 668.A NH2 ASP 441.A OD1 no hydrogen 2.952 N/A ARG 668.A NH2 ASP 441.A OD2 no hydrogen 3.115 N/A SER 669.A OG SER 722.A OG no hydrogen 3.096 N/A PHE 672.A N SER 722.A O no hydrogen 3.181 N/A LYS 673.A NZ THR 402.A O no hydrogen 2.982 N/A LYS 673.A NZ THR 402.A OG1 no hydrogen 3.421 N/A LYS 673.A NZ ASP 407.A OD2 no hydrogen 3.397 N/A VAL 674.A N ASP 407.A O no hydrogen 3.088 N/A VAL 675.A N LYS 726.A O no hydrogen 2.999 N/A CYS 676.A N ILE 409.A O no hydrogen 3.101 N/A CYS 676.A SG ILE 409.A O no hydrogen 4.007 N/A LEU 677.A N TYR 728.A O no hydrogen 2.535 N/A LEU 678.A N MET 411.A O no hydrogen 3.118 N/A GLY 679.A N GLU 385.A OE2 no hydrogen 3.242 N/A MET 680.A N SER 730.A O no hydrogen 2.933 N/A ASP 682.A N PHE 743.A O no hydrogen 3.004 N/A VAL 684.A N ASN 681.A O no hydrogen 2.825 N/A TYR 685.A N ASN 681.A O no hydrogen 2.958 N/A TYR 685.A OH ASP 712.A O no hydrogen 2.798 N/A ARG 687.A N ASP 712.A OD2 no hydrogen 2.893 N/A ARG 687.A NE ASP 712.A OD2 no hydrogen 2.710 N/A ARG 687.A NH1 ALA 413.A O no hydrogen 2.932 N/A ARG 687.A NH1 LEU 664.A O no hydrogen 3.563 N/A ARG 687.A NH2 LEU 664.A O no hydrogen 2.793 N/A ARG 687.A NH2 ASP 712.A OD1 no hydrogen 2.891 N/A ARG 687.A NH2 ASP 712.A OD2 no hydrogen 3.534 N/A MET 697.A N ASP 695.A OD2 no hydrogen 3.085 N/A SER 698.A N ASP 695.A O no hydrogen 2.753 N/A SER 698.A OG ASP 695.A O no hydrogen 2.977 N/A GLN 699.A N LEU 696.A O no hydrogen 3.375 N/A LYS 700.A N LEU 696.A O no hydrogen 3.481 N/A LYS 700.A NZ GLY 157.A O no hydrogen 3.402 N/A LYS 702.A N ASP 705.A OD1 no hydrogen 2.629 N/A ASP 705.A N LYS 702.A O no hydrogen 3.006 N/A ARG 706.A NH1 ASP 711.A OD1 no hydrogen 2.444 N/A ASP 710.A N SER 707.A OG no hydrogen 2.983 N/A ASP 711.A N SER 707.A O no hydrogen 3.002 N/A ASP 712.A N ARG 708.A O no hydrogen 2.482 N/A ARG 713.A N ARG 709.A O no hydrogen 2.794 N/A ARG 713.A NH1 SER 302.A O no hydrogen 2.753 N/A TYR 714.A N ASP 710.A O no hydrogen 2.748 N/A LEU 715.A N ASP 711.A O no hydrogen 2.862 N/A LEU 715.A N ASP 712.A O no hydrogen 3.155 N/A PHE 716.A N ASP 712.A O no hydrogen 3.386 N/A GLU 718.A N TYR 714.A O no hydrogen 2.940 N/A ALA 719.A N LEU 715.A O no hydrogen 2.909 N/A LEU 720.A N PHE 716.A O no hydrogen 3.458 N/A ILE 721.A N LEU 717.A O no hydrogen 3.028 N/A SER 722.A N ALA 719.A O no hydrogen 2.813 N/A SER 722.A OG SER 669.A OG no hydrogen 3.096 N/A SER 722.A OG GLU 718.A O no hydrogen 2.839 N/A ALA 723.A N ALA 719.A O no hydrogen 3.120 N/A GLN 724.A N PHE 672.A O no hydrogen 2.938 N/A GLN 725.A N LYS 673.A O no hydrogen 2.967 N/A LYS 726.A N LYS 673.A O no hydrogen 3.078 N/A LYS 726.A NZ SER 372.A OG no hydrogen 3.265 N/A LYS 726.A NZ GLU 399.A OE1 no hydrogen 3.318 N/A LYS 726.A NZ GLU 399.A OE2 no hydrogen 3.152 N/A TYR 728.A N VAL 675.A O no hydrogen 2.538 N/A ILE 729.A N THR 375.A O no hydrogen 3.197 N/A SER 730.A N LEU 677.A O no hydrogen 2.513 N/A SER 730.A OG HIS 377.A O no hydrogen 3.417 N/A SER 730.A OG GLU 385.A OE2 no hydrogen 2.644 N/A TYR 731.A N HIS 377.A O no hydrogen 2.881 N/A GLY 733.A N CYS 379.A O no hydrogen 2.575 N/A ARG 734.A NE ASN 739.A OD1 no hydrogen 3.467 N/A ARG 734.A NH2 ASN 739.A O no hydrogen 3.167 N/A SER 735.A OG ASP 738.A OD1 no hydrogen 2.462 N/A SER 740.A N ASP 738.A OD1 no hydrogen 3.041 N/A SER 740.A OG ASP 738.A OD1 no hydrogen 2.954 N/A ARG 742.A N GLY 733.A O no hydrogen 3.080 N/A ARG 742.A NH2 TYR 731.A OH no hydrogen 2.783 N/A SER 745.A N MET 680.A O no hydrogen 2.944 N/A VAL 748.A N SER 745.A O no hydrogen 2.435 N/A GLN 749.A N SER 745.A O no hydrogen 3.054 N/A GLU 750.A N VAL 746.A O no hydrogen 2.864 N/A LEU 751.A N LEU 747.A O no hydrogen 3.333 N/A ILE 752.A N VAL 748.A O no hydrogen 3.105 N/A ASP 753.A N GLN 749.A O no hydrogen 2.781 N/A TYR 754.A N GLU 750.A O no hydrogen 2.996 N/A TYR 754.A OH ASP 341.A OD2 no hydrogen 2.647 N/A ILE 755.A N LEU 751.A O no hydrogen 3.305 N/A GLY 756.A N ILE 752.A O no hydrogen 3.083 N/A GLN 757.A N ASP 753.A O no hydrogen 3.182 N/A SER 758.A N ILE 755.A O no hydrogen 2.768 N/A SER 758.A OG TYR 754.A O no hydrogen 3.205 N/A SER 758.A OG ILE 755.A O no hydrogen 3.404 N/A TYR 760.A N ARG 365.A O no hydrogen 2.817 N/A LEU 761.A N ASP 764.A OD2 no hydrogen 2.934 N/A ASN 768.A N SER 361.A OG no hydrogen 2.924 N/A CYS 769.A N PHE 358.A O no hydrogen 3.222 N/A CYS 769.A SG VAL 350.A O no hydrogen 3.533 N/A SER 772.A N ASN 768.A O no hydrogen 2.630 N/A SER 772.A OG ASN 768.A O no hydrogen 2.665 N/A SER 772.A OG CYS 769.A O no hydrogen 3.078 N/A GLU 773.A N CYS 769.A O no hydrogen 2.874 N/A ALA 774.A N ASP 770.A O no hydrogen 3.166 N/A ARG 775.A N GLU 771.A O no hydrogen 3.497 N/A VAL 776.A N SER 772.A O no hydrogen 3.148 N/A LYS 777.A N GLU 773.A O no hydrogen 3.181 N/A LYS 777.A NZ GLU 773.A OE1 no hydrogen 3.500 N/A ALA 778.A N ALA 774.A O no hydrogen 2.690 N/A HIS 779.A N ARG 775.A O no hydrogen 2.792 N/A LEU 780.A N VAL 776.A O no hydrogen 3.100 N/A LEU 780.A N LYS 777.A O no hydrogen 3.012 N/A THR 781.A N LYS 777.A O no hydrogen 2.830 N/A THR 781.A OG1 LYS 777.A O no hydrogen 3.028 N/A CYS 782.A SG LEU 783.A O no hydrogen 3.881 N/A CYS 782.A SG GLU 798.A OE2 no hydrogen 3.329 N/A HIS 784.A N VAL 378.A O no hydrogen 2.983 N/A HIS 784.A NE2 HIS 377.A ND1 no hydrogen 2.700 N/A THR 785.A OG1 MET 787.A O no hydrogen 3.520 N/A THR 785.A OG1 ASN 793.A OD1 no hydrogen 2.524 N/A ARG 786.A NH2 HIS 380.A NE2 no hydrogen 3.369 N/A ARG 786.A NH2 ASN 739.A OD1 no hydrogen 3.339 N/A ASP 790.A N MET 787.A O no hydrogen 3.257 N/A GLN 792.A N ASP 790.A OD1 no hydrogen 2.869 N/A ASN 793.A N ASP 790.A O no hydrogen 3.233 N/A TYR 794.A N PRO 791.A O no hydrogen 2.398 N/A TYR 794.A OH PRO 788.A O no hydrogen 3.405 N/A TYR 794.A OH ALA 803.A O no hydrogen 2.965 N/A ARG 799.A NE ARG 799.A O no hydrogen 3.148 N/A SER 801.A N ASN 793.A O no hydrogen 2.841 N/A SER 801.A OG ASP 391.A OD1 no hydrogen 3.427 N/A SER 801.A OG ASP 391.A OD2 no hydrogen 2.910 N/A TYR 802.A N ASP 391.A OD1 no hydrogen 3.065 N/A ALA 803.A N SER 801.A OG no hydrogen 2.793 N/A TRP 806.A N ALA 803.A O no hydrogen 3.104 N/A LEU 807.A N ARG 804.A O no hydrogen 2.526 N/A ALA 810.A N TRP 806.A O no hydrogen 3.002 N/A SER 811.A N LEU 807.A O no hydrogen 3.005 N/A SER 811.A OG LEU 807.A O no hydrogen 2.978 N/A SER 811.A OG PRO 808.A O no hydrogen 2.942 N/A GLN 812.A N ALA 809.A O no hydrogen 3.125 N/A ALA 813.A N PRO 808.A O no hydrogen 2.969 N/A VAL 821.A N GLU 819.A OE1 no hydrogen 2.964 N/A LEU 824.A N SER 1032.A O no hydrogen 2.726 N/A THR 831.A OG1 GLU 830.A O no hydrogen 2.682 N/A VAL 832.A N GLN 951.A O no hydrogen 3.419 N/A LEU 834.A N THR 953.A O no hydrogen 3.094 N/A THR 836.A N PRO 833.A O no hydrogen 3.020 N/A THR 836.A OG1 PRO 833.A O no hydrogen 2.955 N/A LEU 837.A N LEU 834.A O no hydrogen 2.464 N/A GLN 838.A N LEU 834.A O no hydrogen 2.912 N/A GLN 838.A N GLU 835.A O no hydrogen 3.102 N/A ARG 839.A N GLU 835.A O no hydrogen 2.693 N/A PHE 840.A N THR 836.A O no hydrogen 3.237 N/A TRP 841.A N LEU 837.A O no hydrogen 3.470 N/A ARG 846.A NH1 ALA 842.A O no hydrogen 3.355 N/A ALA 847.A N HIS 843.A O no hydrogen 3.306 N/A PHE 848.A N PRO 844.A O no hydrogen 3.114 N/A PHE 849.A N VAL 845.A O no hydrogen 3.472 N/A GLN 850.A N ARG 846.A O no hydrogen 2.982 N/A MET 851.A N ALA 847.A O no hydrogen 2.648 N/A ARG 852.A NE MET 1031.A O no hydrogen 2.689 N/A LEU 853.A N PHE 848.A O no hydrogen 3.244 N/A VAL 855.A N PHE 849.A O no hydrogen 2.892 N/A ARG 858.A N ASN 856.A O no hydrogen 2.822 N/A SER 862.A OG ASP 861.A O no hydrogen 2.770 N/A THR 867.A OG1 GLU 868.A O no hydrogen 2.573 N/A THR 867.A OG1 GLU 868.A OE1 no hydrogen 3.265 N/A GLU 868.A N GLU 868.A OE1 no hydrogen 2.881 N/A SER 876.A N GLU 873.A O no hydrogen 3.308 N/A TYR 878.A N GLY 874.A O no hydrogen 3.247 N/A GLN 879.A N LEU 875.A O no hydrogen 2.908 N/A ILE 880.A N SER 876.A O no hydrogen 2.699 N/A ASN 881.A N ARG 877.A O no hydrogen 3.009 N/A GLN 882.A N TYR 878.A O no hydrogen 2.667 N/A LEU 884.A N ILE 880.A O no hydrogen 3.057 N/A LEU 885.A N ASN 881.A O no hydrogen 2.867 N/A ASN 886.A N GLN 882.A O no hydrogen 3.086 N/A ALA 887.A N GLN 883.A O no hydrogen 2.782 N/A LEU 888.A N LEU 885.A O no hydrogen 2.560 N/A VAL 889.A N LEU 885.A O no hydrogen 2.979 N/A GLU 890.A N ASN 886.A O no hydrogen 2.896 N/A GLN 891.A N LEU 888.A O no hydrogen 2.920 N/A ASP 892.A N ALA 887.A O no hydrogen 2.722 N/A GLU 895.A N ASP 893.A OD2 no hydrogen 2.978 N/A ARG 896.A N ASP 893.A O no hydrogen 3.301 N/A PHE 898.A N ALA 894.A O no hydrogen 2.755 N/A ARG 899.A N GLU 895.A O no hydrogen 3.139 N/A ARG 900.A N ARG 896.A O no hydrogen 3.235 N/A ARG 900.A NH1 SER 539.A OG no hydrogen 3.391 N/A ARG 900.A NH2 SER 539.A O no hydrogen 3.182 N/A PHE 901.A N LEU 897.A O no hydrogen 2.897 N/A ARG 902.A N PHE 898.A O no hydrogen 2.807 N/A ALA 903.A N ARG 899.A O no hydrogen 2.781 N/A ALA 904.A N ARG 900.A O no hydrogen 2.841 N/A ALA 904.A N PHE 901.A O no hydrogen 3.048 N/A GLY 905.A N ARG 902.A O no hydrogen 3.063 N/A ASP 906.A N PHE 901.A O no hydrogen 3.255 N/A GLY 913.A N TYR 909.A O no hydrogen 3.147 N/A GLY 913.A N GLY 910.A O no hydrogen 2.593 N/A GLU 914.A N GLY 910.A O no hydrogen 3.084 N/A ILE 915.A N ALA 911.A O no hydrogen 2.726 N/A PHE 916.A N PHE 912.A O no hydrogen 3.028 N/A TRP 917.A N GLY 913.A O no hydrogen 2.775 N/A GLU 918.A N GLU 914.A O no hydrogen 2.729 N/A THR 919.A N ILE 915.A O no hydrogen 3.194 N/A THR 919.A N PHE 916.A O no hydrogen 3.210 N/A THR 919.A OG1 GLN 920.A OE1 no hydrogen 3.356 N/A GLN 920.A N PHE 916.A O no hydrogen 3.138 N/A GLN 920.A NE2 ASN 881.A OD1 no hydrogen 2.851 N/A CYS 921.A N TRP 917.A O no hydrogen 2.936 N/A CYS 921.A SG TRP 917.A O no hydrogen 3.716 N/A GLN 922.A N GLU 918.A O no hydrogen 3.226 N/A GLU 923.A N THR 919.A O no hydrogen 3.275 N/A MET 924.A N GLN 920.A O no hydrogen 2.585 N/A GLN 925.A N CYS 921.A O no hydrogen 2.593 N/A GLN 926.A N GLN 922.A O no hydrogen 3.040 N/A LEU 927.A N MET 924.A O no hydrogen 3.132 N/A ALA 928.A N MET 924.A O no hydrogen 2.844 N/A ASP 929.A N GLN 925.A O no hydrogen 2.719 N/A ARG 930.A NH2 LEU 1000.A O no hydrogen 2.861 N/A ARG 930.A NH2 GLY 1004.A O no hydrogen 2.878 N/A VAL 931.A N LEU 927.A O no hydrogen 3.090 N/A ILE 932.A N ALA 928.A O no hydrogen 2.562 N/A ALA 933.A N ASP 929.A O no hydrogen 2.728 N/A CYS 934.A N VAL 931.A O no hydrogen 2.680 N/A CYS 934.A SG ARG 930.A O no hydrogen 4.031 N/A ARG 935.A N ILE 932.A O no hydrogen 3.382 N/A ARG 935.A NH1 GLU 890.A OE1 no hydrogen 2.752 N/A ARG 935.A NH2 GLU 890.A OE1 no hydrogen 3.081 N/A ARG 935.A NH2 GLU 890.A OE2 no hydrogen 2.854 N/A ARG 935.A NH2 GLN 958.A OE1 no hydrogen 2.799 N/A GLN 939.A N VAL 959.A O no hydrogen 3.279 N/A ILE 943.A N GLY 954.A O no hydrogen 2.649 N/A LEU 945.A N ILE 952.A O no hydrogen 3.072 N/A CYS 947.A N VAL 950.A O no hydrogen 2.790 N/A CYS 947.A SG LEU 1017.A O no hydrogen 3.916 N/A CYS 947.A SG SER 1021.A OG no hydrogen 3.458 N/A VAL 950.A N CYS 947.A O no hydrogen 2.979 N/A GLY 954.A N ILE 943.A O no hydrogen 3.286 N/A LEU 956.A N MET 941.A O no hydrogen 3.132 N/A VAL 959.A N GLN 939.A O no hydrogen 2.952 N/A GLN 960.A N GLY 963.A O no hydrogen 3.149 N/A GLN 960.A NE2 CYS 934.A O no hydrogen 3.433 N/A GLN 960.A NE2 ASP 962.A OD1 no hydrogen 3.103 N/A LEU 964.A N GLU 995.A O no hydrogen 3.131 N/A ARG 966.A N ARG 997.A O no hydrogen 2.607 N/A ARG 966.A NH1 GLU 983.A OE1 no hydrogen 2.766 N/A ARG 966.A NH2 PRO 957.A O no hydrogen 3.183 N/A ARG 968.A N PHE 999.A O no hydrogen 3.341 N/A ARG 968.A NH2 SER 970.A OG no hydrogen 3.344 N/A SER 970.A OG LEU 971.A O no hydrogen 2.802 N/A VAL 974.A N GLU 1040.A OE2 no hydrogen 3.198 N/A GLN 976.A N SER 973.A O no hydrogen 3.208 N/A GLN 976.A N SER 973.A OG no hydrogen 3.186 N/A GLY 977.A N SER 973.A O no hydrogen 3.089 N/A GLY 977.A N VAL 974.A O no hydrogen 2.758 N/A MET 978.A N VAL 974.A O no hydrogen 2.898 N/A GLN 979.A N ALA 975.A O no hydrogen 3.320 N/A LEU 980.A N GLN 976.A O no hydrogen 3.224 N/A TRP 981.A N GLY 977.A O no hydrogen 2.848 N/A LEU 982.A N MET 978.A O no hydrogen 2.957 N/A GLU 983.A N GLN 979.A O no hydrogen 3.359 N/A HIS 984.A N LEU 980.A O no hydrogen 2.799 N/A LEU 985.A N TRP 981.A O no hydrogen 2.809 N/A VAL 986.A N LEU 982.A O no hydrogen 3.113 N/A TYR 987.A N GLU 983.A O no hydrogen 3.084 N/A CYS 988.A N HIS 984.A O no hydrogen 2.880 N/A CYS 988.A SG LEU 1011.A O no hydrogen 3.859 N/A ALA 989.A N LEU 985.A O no hydrogen 2.895 N/A SER 990.A N VAL 986.A O no hydrogen 2.975 N/A SER 990.A OG VAL 986.A O no hydrogen 3.145 N/A GLY 991.A N CYS 988.A O no hydrogen 3.306 N/A GLU 995.A N ASP 962.A O no hydrogen 2.545 N/A ARG 997.A N LEU 964.A O no hydrogen 2.905 N/A LEU 998.A N TRP 1006.A O no hydrogen 2.818 N/A PHE 999.A N ARG 966.A O no hydrogen 3.079 N/A LEU 1000.A N GLY 1004.A O no hydrogen 3.318 N/A ARG 1001.A N SER 970.A O no hydrogen 2.974 N/A ARG 1001.A NE GLU 923.A OE1 no hydrogen 2.943 N/A ARG 1001.A NH1 GLU 923.A OE1 no hydrogen 3.194 N/A GLY 1004.A N ARG 1001.A O no hydrogen 2.747 N/A TRP 1006.A N LEU 998.A O no hydrogen 3.141 N/A TRP 1006.A NE1 SER 973.A O no hydrogen 3.135 N/A ARG 1007.A N ASN 1120.A OD1 no hydrogen 3.093 N/A PHE 1008.A N SER 996.A O no hydrogen 2.833 N/A ALA 1016.A N ALA 1012.A O no hydrogen 2.761 N/A HIS 1018.A N GLU 1014.A O no hydrogen 3.353 N/A TYR 1019.A N GLN 1015.A O no hydrogen 3.002 N/A LEU 1020.A N ALA 1016.A O no hydrogen 2.773 N/A SER 1021.A N HIS 1018.A O no hydrogen 3.299 N/A SER 1021.A OG LEU 1017.A O no hydrogen 2.868 N/A LEU 1023.A N TYR 1019.A O no hydrogen 3.413 N/A ILE 1024.A N LEU 1020.A O no hydrogen 3.407 N/A GLU 1025.A N SER 1021.A O no hydrogen 2.522 N/A GLY 1026.A N GLN 1022.A O no hydrogen 2.711 N/A TYR 1027.A N LEU 1023.A O no hydrogen 3.121 N/A ARG 1028.A N ILE 1024.A O no hydrogen 2.880 N/A GLU 1029.A N GLU 1025.A O no hydrogen 2.850 N/A GLY 1030.A N GLY 1026.A O no hydrogen 2.719 N/A MET 1031.A N ARG 1028.A O no hydrogen 3.259 N/A SER 1032.A N GLU 1029.A O no hydrogen 2.816 N/A SER 1032.A OG LEU 824.A O no hydrogen 2.415 N/A ALA 1033.A N GLU 1029.A O no hydrogen 3.190 N/A SER 1041.A N GLU 1084.A OE1 no hydrogen 2.684 N/A SER 1041.A OG GLU 1084.A OE1 no hydrogen 2.838 N/A GLY 1042.A N LEU 1038.A O no hydrogen 2.586 N/A GLY 1043.A N PRO 1039.A O no hydrogen 2.955 N/A ALA 1044.A N SER 1041.A O no hydrogen 2.914 N/A TRP 1045.A N SER 1041.A O no hydrogen 2.876 N/A LEU 1046.A N GLY 1042.A O no hydrogen 2.700 N/A LYS 1047.A N ALA 1044.A O no hydrogen 3.129 N/A THR 1048.A N ALA 1044.A O no hydrogen 3.248 N/A THR 1048.A N TRP 1045.A O no hydrogen 3.021 N/A THR 1048.A OG1 ALA 1044.A O no hydrogen 3.238 N/A CYS 1049.A N TRP 1045.A O no hydrogen 3.216 N/A CYS 1049.A SG TRP 1045.A O no hydrogen 3.749 N/A TYR 1050.A N LEU 1046.A O no hydrogen 3.438 N/A GLN 1053.A N ASP 1051.A OD1 no hydrogen 2.541 N/A ASP 1055.A N ALA 1052.A O no hydrogen 3.143 N/A LEU 1058.A N CYS 1049.A O no hydrogen 3.010 N/A SER 1062.A OG ASP 1060.A OD2 no hydrogen 2.788 N/A THR 1063.A OG1 ASP 1060.A O no hydrogen 3.065 N/A THR 1063.A OG1 ASP 1060.A OD2 no hydrogen 2.799 N/A LEU 1064.A N ASP 1060.A O no hydrogen 3.008 N/A LYS 1066.A N SER 1062.A O no hydrogen 3.483 N/A ALA 1067.A N THR 1063.A O no hydrogen 2.800 N/A ARG 1068.A N LEU 1064.A O no hydrogen 3.516 N/A THR 1069.A N GLN 1065.A O no hydrogen 3.033 N/A THR 1069.A N LYS 1066.A O no hydrogen 3.240 N/A THR 1069.A OG1 GLN 1065.A O no hydrogen 3.299 N/A LYS 1070.A N LYS 1066.A O no hydrogen 2.988 N/A PHE 1071.A N ALA 1067.A O no hydrogen 2.881 N/A GLN 1073.A N THR 1069.A O no hydrogen 2.652 N/A ALA 1074.A N LYS 1070.A O no hydrogen 2.872 N/A TYR 1075.A N PHE 1071.A O no hydrogen 2.661 N/A GLU 1076.A N LEU 1072.A O no hydrogen 3.053 N/A ASN 1078.A N VAL 1081.A O no hydrogen 3.103 N/A ARG 1082.A NE MET 1079.A O no hydrogen 3.020 N/A GLU 1084.A N ALA 1074.A O no hydrogen 3.110 N/A GLY 1085.A N TYR 1075.A O no hydrogen 2.845 N/A ASP 1086.A N GLY 1083.A O no hydrogen 2.958 N/A TYR 1090.A N ASP 1087.A OD1 no hydrogen 3.145 N/A TYR 1090.A OH GLU 1084.A OE2 no hydrogen 3.048 N/A GLN 1091.A N ASP 1087.A O no hydrogen 2.811 N/A ARG 1092.A N ILE 1088.A O no hydrogen 2.716 N/A ARG 1092.A N TRP 1089.A O no hydrogen 3.200 N/A ARG 1092.A NE ARG 1092.A O no hydrogen 2.556 N/A LEU 1093.A N TYR 1090.A O no hydrogen 2.581 N/A TRP 1094.A N TYR 1090.A O no hydrogen 3.205 N/A TRP 1094.A NE1 TYR 1075.A OH no hydrogen 2.727 N/A THR 1098.A OG1 THR 1101.A OG1 no hydrogen 3.219 N/A GLU 1100.A N THR 1098.A OG1 no hydrogen 3.203 N/A THR 1101.A N THR 1098.A OG1 no hydrogen 3.065 N/A THR 1101.A OG1 THR 1098.A O no hydrogen 3.290 N/A THR 1101.A OG1 THR 1098.A OG1 no hydrogen 3.219 N/A MET 1102.A N THR 1098.A O no hydrogen 2.992 N/A ALA 1104.A N GLU 1100.A O no hydrogen 3.301 N/A ILE 1105.A N THR 1101.A O no hydrogen 2.984 N/A VAL 1106.A N MET 1102.A O no hydrogen 2.936 N/A GLU 1107.A N GLU 1103.A O no hydrogen 2.932 N/A GLN 1108.A N ALA 1104.A O no hydrogen 2.898 N/A SER 1109.A N ILE 1105.A O no hydrogen 2.612 N/A SER 1109.A OG ILE 1105.A O no hydrogen 2.604 N/A SER 1109.A OG VAL 1106.A O no hydrogen 3.397 N/A GLN 1110.A N GLU 1107.A O no hydrogen 2.788 N/A ARG 1111.A N GLU 1107.A O no hydrogen 2.919 N/A ARG 1111.A NH1 GLU 1029.A OE1 no hydrogen 3.077 N/A ARG 1111.A NH1 GLU 1029.A OE2 no hydrogen 3.301 N/A ARG 1111.A NH1 GLN 1108.A OE1 no hydrogen 3.289 N/A ARG 1111.A NH2 GLU 1029.A OE1 no hydrogen 2.733 N/A PHE 1112.A N GLN 1108.A O no hydrogen 3.287 N/A LEU 1113.A N SER 1109.A O no hydrogen 3.144 N/A LEU 1114.A N GLN 1110.A O no hydrogen 2.935 N/A LEU 1116.A N LEU 1113.A O no hydrogen 3.050 N/A ARG 1118.A N LEU 1114.A O no hydrogen 2.863 N/A GLN 1121.A NE2 GLU 1005.A O no hydrogen 3.572 N/A SER 1122.A N ARG 1007.A O no hydrogen 3.647 N/A SER 1122.A N PHE 1119.A O no hydrogen 3.676 N/A