Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5sxe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N HIS 5.A NE2 no hydrogen 3.383 N/A HIS 6.A N TYR 3.A O no hydrogen 3.062 N/A SER 20.A N MET 18.A O no hydrogen 2.836 N/A ARG 24.A NE MET 21.A O no hydrogen 3.021 N/A GLU 28.A N HIS 33.A O no hydrogen 3.244 N/A TRP 30.A N PHE 114.A O no hydrogen 3.313 N/A MET 35.A N GLU 28.A OE2 no hydrogen 3.055 N/A ARG 38.A NH1 GLU 54.A OE1 no hydrogen 2.710 N/A ILE 39.A N CYS 55.A O no hydrogen 2.735 N/A VAL 41.A N LEU 53.A O no hydrogen 2.750 N/A CYS 43.A N VAL 51.A O no hydrogen 2.770 N/A CYS 43.A SG VAL 41.A O no hydrogen 3.546 N/A LEU 44.A N LEU 118.A O no hydrogen 2.785 N/A LEU 45.A N MET 49.A O no hydrogen 3.208 N/A ASN 47.A ND2 LEU 77.A O no hydrogen 3.368 N/A GLY 48.A N LEU 45.A O no hydrogen 3.348 N/A MET 49.A N ASN 47.A OD1 no hydrogen 2.932 N/A VAL 51.A N CYS 43.A O no hydrogen 3.446 N/A THR 52.A OG1 GLU 42.A OE1 no hydrogen 2.865 N/A LEU 53.A N VAL 41.A O no hydrogen 3.058 N/A CYS 55.A N ILE 39.A O no hydrogen 2.707 N/A ARG 57.A N PRO 37.A O no hydrogen 3.182 N/A ALA 59.A N LEU 56.A O no hydrogen 2.963 N/A THR 60.A OG1 THR 63.A OG1 no hydrogen 2.371 N/A LEU 61.A N ARG 106.A O no hydrogen 3.114 N/A ILE 62.A N GLU 104.A O no hydrogen 2.930 N/A THR 63.A N THR 60.A OG1 no hydrogen 3.028 N/A THR 63.A OG1 THR 60.A OG1 no hydrogen 2.371 N/A ILE 64.A N THR 60.A O no hydrogen 2.763 N/A LYS 65.A N LEU 61.A O no hydrogen 2.703 N/A LYS 65.A NZ GLU 104.A OE1 no hydrogen 3.207 N/A HIS 66.A N ILE 62.A O no hydrogen 3.094 N/A GLU 67.A N THR 63.A O no hydrogen 3.273 N/A LEU 68.A N ILE 64.A O no hydrogen 2.742 N/A PHE 69.A N LYS 65.A O no hydrogen 2.899 N/A LYS 70.A N HIS 66.A O no hydrogen 3.336 N/A GLU 71.A N GLU 67.A O no hydrogen 2.909 N/A ARG 73.A N LYS 70.A O no hydrogen 3.198 N/A LYS 74.A NZ GLU 71.A OE1 no hydrogen 2.875 N/A TYR 75.A N ALA 72.A O no hydrogen 3.324 N/A LEU 80.A N LEU 77.A O no hydrogen 3.115 N/A LEU 81.A N HIS 78.A O no hydrogen 3.061 N/A GLN 82.A N TYR 87.A OH no hydrogen 3.120 N/A SER 85.A N ASP 83.A OD1 no hydrogen 3.324 N/A SER 85.A OG ASP 83.A OD1 no hydrogen 3.225 N/A SER 86.A N ASP 83.A O no hydrogen 2.917 N/A SER 86.A OG ASP 83.A O no hydrogen 3.240 N/A TYR 87.A N GLU 84.A O no hydrogen 2.858 N/A ILE 88.A N ILE 121.A O no hydrogen 2.729 N/A VAL 90.A N LYS 119.A O no hydrogen 2.840 N/A SER 91.A N GLU 99.A O no hydrogen 3.332 N/A SER 91.A OG VAL 92.A O no hydrogen 3.387 N/A SER 91.A OG PHE 117.A O no hydrogen 2.619 N/A THR 93.A N GLU 97.A O no hydrogen 2.926 N/A GLN 94.A N ARG 112.A O no hydrogen 3.114 N/A GLN 94.A NE2 GLY 27.A O no hydrogen 2.707 N/A GLN 94.A NE2 LEU 113.A O no hydrogen 3.161 N/A GLU 95.A N THR 93.A OG1 no hydrogen 3.339 N/A ALA 96.A N THR 93.A O no hydrogen 2.877 N/A PHE 101.A N PHE 89.A O no hydrogen 2.818 N/A THR 105.A OG1 ASP 103.A OD1 no hydrogen 2.394 N/A ARG 106.A N ASP 103.A O no hydrogen 2.820 N/A ARG 106.A NH1 GLU 99.A OE2 no hydrogen 2.899 N/A ARG 106.A NH2 ASP 110.A O no hydrogen 3.230 N/A ARG 107.A NH1 GLU 58.A O no hydrogen 2.847 N/A ARG 107.A NH2 ASP 743.A OD2 no hydrogen 3.496 N/A LEU 108.A N ALA 59.A O no hydrogen 2.928 N/A CYS 109.A N ARG 57.A O no hydrogen 3.062 N/A CYS 109.A SG ARG 57.A O no hydrogen 3.352 N/A CYS 109.A SG ASP 110.A OD1 no hydrogen 3.644 N/A PHE 114.A N VAL 92.A O no hydrogen 3.266 N/A LEU 118.A N GLU 42.A O no hydrogen 3.074 N/A LYS 119.A N VAL 90.A O no hydrogen 2.707 N/A VAL 120.A N LEU 44.A O no hydrogen 2.788 N/A ILE 121.A N ILE 88.A O no hydrogen 3.243 N/A GLU 128.A N ASN 126.A O no hydrogen 2.835 N/A ILE 131.A N GLU 128.A O no hydrogen 2.986 N/A GLY 137.A N ASN 133.A O no hydrogen 2.840 N/A PHE 138.A N ARG 134.A O no hydrogen 2.651 N/A ALA 139.A N GLU 135.A O no hydrogen 3.163 N/A ILE 140.A N ILE 136.A O no hydrogen 2.925 N/A GLY 141.A N GLY 137.A O no hydrogen 2.709 N/A GLY 141.A N PHE 138.A O no hydrogen 3.007 N/A MET 142.A N GLY 137.A O no hydrogen 3.249 N/A GLU 146.A N PRO 143.A O no hydrogen 3.082 N/A PHE 147.A N VAL 144.A O no hydrogen 2.784 N/A VAL 150.A N PHE 147.A O no hydrogen 2.845 N/A GLU 154.A N ASP 152.A OD1 no hydrogen 2.703 N/A GLN 156.A N ASP 152.A O no hydrogen 3.446 N/A ASP 157.A N PRO 153.A O no hydrogen 2.580 N/A PHE 158.A N GLU 154.A O no hydrogen 2.623 N/A ARG 159.A N VAL 155.A O no hydrogen 2.896 N/A ARG 159.A NE GLU 686.A OE1 no hydrogen 3.089 N/A ARG 159.A NH1 ASP 148.A OD1 no hydrogen 2.784 N/A ARG 159.A NH2 ASP 148.A OD1 no hydrogen 3.389 N/A ARG 159.A NH2 GLU 686.A OE2 no hydrogen 2.770 N/A ARG 160.A N GLN 156.A O no hydrogen 3.091 N/A ASN 161.A N ASP 157.A O no hydrogen 2.855 N/A ILE 162.A N PHE 158.A O no hydrogen 2.961 N/A ASN 164.A N ASN 161.A O no hydrogen 3.071 N/A VAL 165.A N ILE 162.A O no hydrogen 2.843 N/A CYS 166.A N ILE 162.A O no hydrogen 3.408 N/A CYS 166.A SG ILE 162.A O no hydrogen 3.719 N/A LYS 167.A N LEU 163.A O no hydrogen 2.934 N/A LYS 167.A NZ ASP 171.A OD1 no hydrogen 3.126 N/A GLU 168.A N ASN 164.A O no hydrogen 3.200 N/A ALA 169.A N VAL 165.A O no hydrogen 3.112 N/A VAL 170.A N CYS 166.A O no hydrogen 3.232 N/A ASP 171.A N LYS 167.A O no hydrogen 3.184 N/A LEU 172.A N GLU 168.A O no hydrogen 3.320 N/A ARG 173.A N ALA 169.A O no hydrogen 3.287 N/A ARG 173.A NH1 LEU 655.A O no hydrogen 2.979 N/A ARG 173.A NH1 ALA 691.A O no hydrogen 3.181 N/A ARG 173.A NH2 ALA 691.A O no hydrogen 2.779 N/A ASP 174.A N VAL 170.A O no hydrogen 3.415 N/A SER 180.A N ASN 176.A O no hydrogen 3.400 N/A ALA 182.A N PRO 178.A O no hydrogen 2.979 N/A MET 183.A N HIS 179.A O no hydrogen 2.701 N/A TYR 184.A N SER 180.A O no hydrogen 2.882 N/A TYR 184.A OH CYS 692.A O no hydrogen 3.360 N/A VAL 185.A N ARG 181.A O no hydrogen 2.916 N/A TYR 186.A N ALA 182.A O no hydrogen 2.740 N/A ASN 189.A ND2 GLU 278.A OE2 no hydrogen 3.347 N/A GLU 191.A N GLN 288.A O no hydrogen 2.651 N/A TYR 201.A N PRO 197.A O no hydrogen 3.022 N/A ASN 202.A N LYS 198.A O no hydrogen 2.922 N/A ASN 202.A ND2 LYS 198.A O no hydrogen 2.729 N/A LYS 203.A N ILE 200.A O no hydrogen 2.949 N/A LYS 203.A NZ MET 297.A O no hydrogen 3.246 N/A LEU 204.A N TYR 201.A O no hydrogen 2.659 N/A GLN 208.A N LEU 204.A O no hydrogen 2.937 N/A ILE 209.A N ILE 230.A O no hydrogen 3.010 N/A VAL 211.A N LEU 228.A O no hydrogen 2.748 N/A VAL 212.A N PRO 302.A O no hydrogen 2.949 N/A ILE 213.A N TYR 226.A O no hydrogen 3.408 N/A TRP 214.A N LEU 304.A O no hydrogen 3.218 N/A TRP 214.A NE1 ASN 303.A OD1 no hydrogen 2.843 N/A VAL 217.A N ASP 222.A O no hydrogen 3.030 N/A ASN 220.A N VAL 217.A O no hydrogen 3.041 N/A LYS 223.A NZ ILE 785.A O no hydrogen 2.777 N/A GLN 224.A N VAL 215.A O no hydrogen 3.094 N/A THR 227.A OG1 THR 227.A O no hydrogen 2.660 N/A ILE 230.A N ILE 209.A O no hydrogen 3.200 N/A HIS 232.A N GLY 207.A O no hydrogen 2.824 N/A HIS 232.A ND1 SER 287.A OG no hydrogen 2.838 N/A CYS 234.A N ASN 231.A O no hydrogen 3.515 N/A CYS 234.A SG ASN 231.A O no hydrogen 3.533 N/A VAL 235.A N GLN 238.A OE1 no hydrogen 3.158 N/A VAL 239.A N VAL 235.A O no hydrogen 3.113 N/A ILE 240.A N PRO 236.A O no hydrogen 2.748 N/A ALA 241.A N GLU 237.A O no hydrogen 3.037 N/A GLU 242.A N GLN 238.A O no hydrogen 3.188 N/A ALA 243.A N VAL 239.A O no hydrogen 3.099 N/A ILE 244.A N ILE 240.A O no hydrogen 3.048 N/A ARG 245.A N ALA 241.A O no hydrogen 2.694 N/A LYS 246.A N GLU 242.A O no hydrogen 2.967 N/A LYS 247.A N ALA 243.A O no hydrogen 3.152 N/A THR 248.A N ILE 244.A O no hydrogen 3.066 N/A THR 248.A N ARG 245.A O no hydrogen 3.276 N/A THR 248.A OG1 ILE 244.A O no hydrogen 2.731 N/A LEU 252.A N SER 250.A OG no hydrogen 3.025 N/A GLN 257.A N SER 254.A OG no hydrogen 3.252 N/A LEU 258.A N SER 254.A O no hydrogen 2.913 N/A LYS 259.A N SER 255.A O no hydrogen 2.953 N/A CYS 261.A N GLN 257.A O no hydrogen 3.345 N/A CYS 261.A SG GLN 257.A O no hydrogen 3.651 N/A VAL 262.A N LEU 258.A O no hydrogen 2.884 N/A LEU 263.A N LYS 259.A O no hydrogen 3.256 N/A GLU 264.A N LEU 260.A O no hydrogen 3.204 N/A TYR 265.A N VAL 262.A O no hydrogen 3.269 N/A GLN 266.A N VAL 262.A O no hydrogen 2.663 N/A LYS 268.A N TYR 265.A O no hydrogen 3.044 N/A ILE 270.A N MET 307.A O no hydrogen 2.626 N/A LYS 272.A N MET 305.A O no hydrogen 2.861 N/A LYS 272.A NZ VAL 273.A O no hydrogen 3.570 N/A LYS 272.A NZ CYS 276.A O no hydrogen 3.133 N/A LYS 272.A NZ ASP 784.A OD1 no hydrogen 2.878 N/A VAL 273.A N GLU 278.A O no hydrogen 3.175 N/A CYS 274.A N ASN 303.A O no hydrogen 2.890 N/A CYS 274.A SG LEU 304.A O no hydrogen 2.951 N/A GLY 275.A N ASP 784.A OD2 no hydrogen 2.925 N/A ASP 277.A N ALA 755.A O no hydrogen 3.139 N/A PHE 280.A N LEU 271.A O no hydrogen 3.083 N/A LYS 283.A NZ GLU 237.A OE1 no hydrogen 3.163 N/A LEU 286.A N CYS 234.A O no hydrogen 3.009 N/A SER 287.A N HIS 232.A O no hydrogen 3.209 N/A SER 287.A OG HIS 232.A ND1 no hydrogen 2.838 N/A SER 287.A OG HIS 232.A O no hydrogen 2.869 N/A GLN 288.A NE2 GLU 191.A O no hydrogen 3.578 N/A GLN 288.A NE2 SER 192.A O no hydrogen 3.474 N/A TYR 289.A N LEU 286.A O no hydrogen 2.878 N/A TYR 289.A OH GLU 282.A O no hydrogen 2.674 N/A LYS 290.A N ASN 189.A O no hydrogen 2.772 N/A ARG 293.A N TYR 289.A O no hydrogen 3.331 N/A ARG 293.A NE SER 287.A O no hydrogen 3.098 N/A ARG 293.A NH1 GLU 195.A O no hydrogen 3.487 N/A ARG 293.A NH2 PRO 194.A O no hydrogen 3.243 N/A SER 294.A N LYS 290.A O no hydrogen 3.071 N/A SER 294.A OG LYS 290.A O no hydrogen 2.953 N/A CYS 295.A N TYR 291.A O no hydrogen 3.107 N/A CYS 295.A SG TYR 291.A O no hydrogen 3.252 N/A ILE 296.A N ILE 292.A O no hydrogen 2.877 N/A MET 297.A N ARG 293.A O no hydrogen 3.169 N/A LEU 298.A N SER 294.A O no hydrogen 2.874 N/A GLY 299.A N ILE 296.A O no hydrogen 3.229 N/A ARG 300.A N CYS 295.A O no hydrogen 2.636 N/A ASN 303.A N TYR 291.A OH no hydrogen 3.296 N/A ASN 303.A ND2 MET 301.A O no hydrogen 2.603 N/A LEU 304.A N VAL 212.A O no hydrogen 3.104 N/A MET 305.A N LYS 272.A O no hydrogen 3.152 N/A LEU 306.A N TRP 214.A O no hydrogen 3.052 N/A MET 307.A N ILE 270.A O no hydrogen 2.871 N/A LYS 309.A N LYS 268.A O no hydrogen 2.900 N/A LYS 309.A NZ GLY 267.A O no hydrogen 3.502 N/A SER 311.A N ALA 308.A O no hydrogen 3.048 N/A SER 311.A OG ALA 308.A O no hydrogen 2.881 N/A LEU 312.A N ALA 308.A O no hydrogen 3.256 N/A TYR 313.A N LYS 309.A O no hydrogen 2.697 N/A SER 314.A N GLU 310.A O no hydrogen 2.832 N/A LEU 316.A N LEU 312.A O no hydrogen 3.275 N/A CYS 320.A SG MET 318.A O no hydrogen 3.235 N/A TYR 326.A OH GLU 686.A OE2 no hydrogen 3.155 N/A SER 327.A OG TYR 326.A O no hydrogen 3.282 N/A THR 330.A OG1 VAL 480.A O no hydrogen 3.224 N/A TRP 334.A N SER 332.A OG no hydrogen 3.102 N/A VAL 335.A N SER 332.A O no hydrogen 3.343 N/A ILE 336.A N LEU 333.A O no hydrogen 3.019 N/A LEU 340.A N ILE 397.A O no hydrogen 3.289 N/A ARG 341.A NE ASP 475.A OD2 no hydrogen 2.617 N/A ARG 341.A NH2 ASP 475.A OD1 no hydrogen 3.075 N/A ILE 342.A N LEU 393.A O no hydrogen 3.163 N/A LYS 343.A N GLU 473.A O no hydrogen 2.702 N/A LYS 343.A NZ ASN 390.A OD1 no hydrogen 3.132 N/A ILE 344.A N GLU 391.A O no hydrogen 3.183 N/A CYS 346.A SG CYS 346.A O no hydrogen 2.962 N/A TYR 349.A OH GLU 466.A OE1 no hydrogen 3.303 N/A ILE 357.A N ASN 353.A O no hydrogen 2.949 N/A ASP 358.A N VAL 415.A O no hydrogen 3.189 N/A LYS 359.A N VAL 415.A O no hydrogen 3.199 N/A TYR 361.A OH HIS 416.A ND1 no hydrogen 3.188 N/A VAL 362.A N ASN 378.A OD1 no hydrogen 3.043 N/A ARG 363.A NE ASP 375.A OD2 no hydrogen 2.805 N/A THR 364.A N ASN 376.A O no hydrogen 2.865 N/A THR 364.A OG1 ASN 376.A O no hydrogen 3.425 N/A THR 364.A OG1 TYR 395.A OH no hydrogen 3.019 N/A GLY 365.A N CYS 409.A O no hydrogen 2.905 N/A TYR 367.A N ARG 407.A O no hydrogen 2.620 N/A HIS 368.A N GLY 370.A O no hydrogen 2.918 N/A ASN 376.A N THR 364.A O no hydrogen 3.284 N/A THR 379.A N GLU 391.A OE1 no hydrogen 3.419 N/A THR 379.A OG1 GLU 391.A OE1 no hydrogen 3.230 N/A THR 379.A OG1 GLU 391.A OE2 no hydrogen 3.254 N/A ARG 381.A N THR 379.A O no hydrogen 2.772 N/A CYS 384.A SG ILE 357.A O no hydrogen 3.224 N/A CYS 384.A SG ASP 358.A O no hydrogen 3.228 N/A SER 385.A OG PRO 383.A O no hydrogen 3.434 N/A LEU 393.A N ILE 342.A O no hydrogen 2.838 N/A TYR 395.A N LEU 340.A O no hydrogen 2.957 N/A TYR 395.A OH THR 364.A OG1 no hydrogen 3.019 N/A ILE 397.A N TYR 395.A O no hydrogen 2.726 N/A ILE 399.A N SER 338.A O no hydrogen 3.111 N/A ASP 401.A N TYR 398.A O no hydrogen 3.002 N/A ARG 404.A NE ASP 431.A OD1 no hydrogen 3.136 N/A ARG 404.A NH1 ARG 404.A O no hydrogen 2.704 N/A ARG 404.A NH1 TYR 641.A OH no hydrogen 2.759 N/A ARG 404.A NH2 ASP 428.A O no hydrogen 3.003 N/A ARG 404.A NH2 ASP 431.A OD1 no hydrogen 3.138 N/A ARG 404.A NH2 TYR 641.A OH no hydrogen 3.315 N/A ARG 407.A N TYR 367.A O no hydrogen 3.095 N/A ARG 407.A NH1 PRO 455.A O no hydrogen 3.403 N/A ARG 407.A NH2 PRO 455.A O no hydrogen 2.644 N/A LEU 408.A N ILE 424.A O no hydrogen 2.848 N/A CYS 409.A N GLY 365.A O no hydrogen 2.838 N/A LEU 410.A N GLY 422.A O no hydrogen 3.140 N/A SER 411.A N ARG 363.A O no hydrogen 3.115 N/A SER 411.A OG LEU 452.A O no hydrogen 3.183 N/A CYS 413.A N TYR 361.A O no hydrogen 2.816 N/A CYS 413.A SG SER 411.A OG no hydrogen 3.064 N/A SER 414.A OG CYS 417.A O no hydrogen 3.189 N/A VAL 415.A N LYS 359.A O no hydrogen 2.843 N/A LEU 419.A N ILE 412.A O no hydrogen 2.838 N/A TRP 421.A N TRP 443.A O no hydrogen 2.899 N/A GLY 422.A N LEU 410.A O no hydrogen 3.194 N/A ASN 423.A ND2 ASN 454.A O no hydrogen 3.071 N/A ASN 423.A ND2 GLY 457.A O no hydrogen 3.366 N/A ILE 424.A N LEU 408.A O no hydrogen 2.878 N/A ASN 425.A ND2 GLN 640.A O no hydrogen 3.432 N/A LEU 426.A N ALA 406.A O no hydrogen 3.081 N/A ASP 428.A N THR 432.A O no hydrogen 3.222 N/A TYR 429.A OH ASP 157.A OD2 no hydrogen 2.988 N/A THR 430.A OG1 ASP 428.A OD1 no hydrogen 2.739 N/A THR 430.A OG1 ASP 428.A OD2 no hydrogen 3.002 N/A THR 430.A OG1 THR 432.A OG1 no hydrogen 2.875 N/A ASP 431.A N ASP 428.A O no hydrogen 3.023 N/A THR 432.A N ASP 428.A OD1 no hydrogen 2.854 N/A THR 432.A OG1 ASP 428.A OD1 no hydrogen 3.351 N/A THR 432.A OG1 THR 430.A OG1 no hydrogen 2.875 N/A LEU 433.A N VAL 481.A O no hydrogen 2.607 N/A VAL 434.A N LEU 426.A O no hydrogen 2.800 N/A GLY 436.A N PHE 474.A O no hydrogen 3.115 N/A MET 438.A N LEU 472.A O no hydrogen 3.116 N/A ASN 441.A ND2 ALA 439.A O no hydrogen 3.212 N/A LEU 442.A N PRO 468.A O no hydrogen 2.739 N/A TRP 443.A N TRP 421.A O no hydrogen 2.700 N/A TRP 443.A NE1 GLY 460.A O no hydrogen 3.240 N/A THR 459.A OG1 ASN 425.A OD1 no hydrogen 2.648 N/A GLY 460.A N ASN 423.A O no hydrogen 2.795 N/A SER 461.A OG ASN 462.A O no hydrogen 3.004 N/A ASN 462.A N ASN 441.A O no hydrogen 2.854 N/A ASN 462.A ND2 LEU 442.A O no hydrogen 3.298 N/A ASN 464.A N ASN 462.A OD1 no hydrogen 2.774 N/A THR 467.A N LYS 465.A O no hydrogen 2.678 N/A THR 467.A OG1 ASN 464.A O no hydrogen 2.621 N/A LEU 472.A N MET 438.A O no hydrogen 3.121 N/A GLU 473.A N LYS 343.A O no hydrogen 2.812 N/A PHE 474.A N GLY 436.A O no hydrogen 2.582 N/A SER 478.A OG PHE 477.A O no hydrogen 2.924 N/A SER 479.A OG SER 478.A O no hydrogen 2.593 N/A LYS 482.A N LYS 331.A O no hydrogen 3.383 N/A PHE 483.A N ASP 431.A O no hydrogen 3.034 N/A ILE 489.A N ASP 485.A O no hydrogen 3.341 N/A GLU 490.A N MET 486.A O no hydrogen 2.704 N/A GLU 491.A N SER 487.A O no hydrogen 3.273 N/A HIS 492.A N VAL 488.A O no hydrogen 3.113 N/A HIS 492.A NE2 ASP 575.A OD1 no hydrogen 2.903 N/A ALA 493.A N ILE 489.A O no hydrogen 3.023 N/A ASN 494.A N GLU 490.A O no hydrogen 2.909 N/A TRP 495.A N GLU 491.A O no hydrogen 3.005 N/A SER 496.A N HIS 492.A O no hydrogen 2.803 N/A VAL 497.A N ALA 493.A O no hydrogen 2.777 N/A SER 498.A N ASN 494.A O no hydrogen 3.475 N/A SER 498.A OG ASN 494.A O no hydrogen 2.744 N/A ARG 499.A N TRP 495.A O no hydrogen 2.952 N/A ALA 501.A N VAL 497.A O no hydrogen 3.191 N/A GLY 502.A N ARG 499.A O no hydrogen 3.250 N/A PHE 503.A N GLU 500.A O no hydrogen 3.154 N/A SER 504.A OG GLY 502.A O no hydrogen 3.035 N/A SER 511.A OG ASN 512.A OD1 no hydrogen 3.231 N/A ASN 512.A N ASN 512.A OD1 no hydrogen 2.652 N/A ARG 513.A N LEU 510.A O no hydrogen 2.582 N/A ASN 518.A N ASP 517.A OD1 no hydrogen 2.977 N/A LYS 525.A N ARG 521.A O no hydrogen 3.317 N/A GLN 527.A N ASN 523.A O no hydrogen 3.253 N/A LEU 528.A N ASP 524.A O no hydrogen 2.936 N/A LYS 529.A NZ TYR 554.A OH no hydrogen 3.483 N/A ALA 530.A N GLU 526.A O no hydrogen 3.152 N/A SER 532.A N LEU 528.A O no hydrogen 2.869 N/A THR 533.A N LYS 529.A O no hydrogen 3.253 N/A THR 533.A OG1 ALA 530.A O no hydrogen 2.804 N/A ARG 534.A N ILE 531.A O no hydrogen 2.896 N/A ARG 534.A NH1 GLU 544.A OE1 no hydrogen 2.414 N/A LEU 537.A N ASP 535.A OD2 no hydrogen 2.735 N/A SER 538.A N ASP 535.A OD2 no hydrogen 3.215 N/A SER 538.A OG ASP 535.A O no hydrogen 2.890 N/A SER 538.A OG ASP 535.A OD1 no hydrogen 2.934 N/A THR 541.A N GLU 544.A OE2 no hydrogen 2.779 N/A THR 541.A OG1 GLU 544.A OE2 no hydrogen 2.517 N/A GLN 543.A N GLN 543.A OE1 no hydrogen 2.715 N/A GLU 544.A N THR 541.A OG1 no hydrogen 3.138 N/A LYS 545.A N THR 541.A O no hydrogen 2.722 N/A ASP 546.A N GLU 542.A O no hydrogen 2.821 N/A PHE 547.A N GLN 543.A O no hydrogen 2.683 N/A LEU 548.A N GLU 544.A O no hydrogen 2.683 N/A TRP 549.A N LYS 545.A O no hydrogen 2.770 N/A SER 550.A N ASP 546.A O no hydrogen 2.859 N/A SER 550.A OG SER 511.A O no hydrogen 3.531 N/A SER 550.A OG ASP 546.A O no hydrogen 3.105 N/A SER 550.A OG PHE 547.A O no hydrogen 2.688 N/A SER 550.A OG HIS 551.A ND1 no hydrogen 2.924 N/A HIS 551.A N PHE 547.A O no hydrogen 3.326 N/A HIS 551.A ND1 PHE 547.A O no hydrogen 2.893 N/A ARG 552.A NE HIS 553.A NE2 no hydrogen 3.342 N/A ARG 552.A NH1 TRP 549.A O no hydrogen 2.602 N/A ARG 552.A NH2 GLU 500.A OE2 no hydrogen 3.192 N/A ARG 552.A NH2 GLN 579.A OE1 no hydrogen 2.581 N/A TYR 554.A N HIS 551.A O no hydrogen 2.663 N/A CYS 555.A N HIS 551.A O no hydrogen 3.090 N/A CYS 555.A SG HIS 551.A O no hydrogen 3.737 N/A THR 557.A N TYR 554.A O no hydrogen 3.011 N/A THR 557.A OG1 TYR 554.A O no hydrogen 3.166 N/A ILE 558.A N CYS 555.A O no hydrogen 3.275 N/A GLU 560.A N GLU 560.A OE1 no hydrogen 3.243 N/A ILE 561.A N ILE 558.A O no hydrogen 2.844 N/A LEU 562.A N PRO 559.A O no hydrogen 2.912 N/A LYS 564.A N ILE 561.A O no hydrogen 2.801 N/A LYS 564.A NZ ARG 534.A O no hydrogen 2.640 N/A LEU 565.A N ILE 561.A O no hydrogen 3.319 N/A LEU 566.A N LEU 562.A O no hydrogen 2.696 N/A LEU 567.A N PRO 563.A O no hydrogen 3.129 N/A SER 568.A N LEU 565.A O no hydrogen 2.862 N/A SER 568.A OG LYS 564.A O no hydrogen 2.515 N/A TRP 571.A NE1 LEU 566.A O no hydrogen 2.877 N/A SER 573.A N LYS 570.A O no hydrogen 2.853 N/A VAL 577.A N SER 573.A O no hydrogen 2.948 N/A ALA 578.A N ARG 574.A O no hydrogen 2.634 N/A GLN 579.A N ASP 575.A O no hydrogen 3.420 N/A GLN 579.A NE2 GLU 500.A OE1 no hydrogen 2.745 N/A GLN 579.A NE2 ASP 575.A O no hydrogen 3.524 N/A MET 580.A N GLU 576.A O no hydrogen 3.003 N/A TYR 581.A N VAL 577.A O no hydrogen 3.045 N/A TYR 581.A OH ASP 605.A OD2 no hydrogen 3.341 N/A CYS 582.A N GLN 579.A O no hydrogen 2.995 N/A CYS 582.A SG ALA 578.A O no hydrogen 3.720 N/A LEU 583.A N GLN 579.A O no hydrogen 3.236 N/A LEU 583.A N MET 580.A O no hydrogen 3.102 N/A VAL 584.A N MET 580.A O no hydrogen 3.034 N/A LYS 585.A N TYR 581.A O no hydrogen 2.988 N/A ASP 586.A N LEU 583.A O no hydrogen 3.147 N/A TRP 587.A N VAL 584.A O no hydrogen 3.312 N/A TRP 587.A NE1 PRO 559.A O no hydrogen 3.068 N/A GLN 594.A N LYS 591.A O no hydrogen 2.783 N/A ALA 595.A N LYS 591.A O no hydrogen 2.793 N/A MET 596.A N PRO 592.A O no hydrogen 2.870 N/A GLU 597.A N GLN 594.A O no hydrogen 3.310 N/A LEU 598.A N ALA 595.A O no hydrogen 3.143 N/A LEU 599.A N MET 596.A O no hydrogen 3.063 N/A ASP 600.A N GLU 597.A O no hydrogen 2.913 N/A ASN 602.A N ASP 600.A OD1 no hydrogen 2.493 N/A TYR 603.A N ASP 600.A O no hydrogen 3.505 N/A TYR 603.A OH PRO 563.A O no hydrogen 3.247 N/A TYR 603.A OH GLU 597.A OE1 no hydrogen 3.180 N/A MET 607.A N ASP 605.A OD1 no hydrogen 2.833 N/A ARG 609.A N ASP 605.A O no hydrogen 3.000 N/A ARG 609.A NE TYR 603.A O no hydrogen 3.172 N/A ARG 609.A NH2 ASP 600.A O no hydrogen 3.290 N/A GLY 610.A N PRO 606.A O no hydrogen 2.798 N/A PHE 611.A N MET 607.A O no hydrogen 2.929 N/A ALA 612.A N VAL 608.A O no hydrogen 2.898 N/A VAL 613.A N ARG 609.A O no hydrogen 3.034 N/A ARG 614.A N GLY 610.A O no hydrogen 2.869 N/A ARG 614.A NH2 VAL 584.A O no hydrogen 3.136 N/A CYS 615.A N PHE 611.A O no hydrogen 3.053 N/A CYS 615.A SG PHE 611.A O no hydrogen 3.239 N/A LEU 616.A N ALA 612.A O no hydrogen 3.172 N/A GLU 617.A N VAL 613.A O no hydrogen 2.806 N/A LYS 618.A N ARG 614.A O no hydrogen 3.291 N/A LYS 618.A N CYS 615.A O no hydrogen 3.008 N/A TYR 619.A N CYS 615.A O no hydrogen 2.817 N/A LEU 620.A N LEU 616.A O no hydrogen 3.100 N/A LEU 625.A N THR 621.A O no hydrogen 2.952 N/A SER 626.A N ASP 622.A O no hydrogen 3.408 N/A GLN 627.A N ASP 623.A O no hydrogen 3.350 N/A TYR 628.A N LYS 624.A O no hydrogen 3.099 N/A TYR 628.A OH GLU 593.A OE2 no hydrogen 2.913 N/A GLN 631.A NE2 GLN 811.A OE1 no hydrogen 3.101 N/A LEU 632.A N TYR 628.A O no hydrogen 3.128 N/A VAL 633.A N LEU 629.A O no hydrogen 2.919 N/A GLN 634.A N ILE 630.A O no hydrogen 3.129 N/A GLN 634.A NE2 GLU 671.A OE2 no hydrogen 3.304 N/A VAL 635.A N GLN 631.A O no hydrogen 2.946 N/A LEU 636.A N VAL 633.A O no hydrogen 3.194 N/A LYS 637.A NZ GLU 671.A OE2 no hydrogen 3.331 N/A TYR 638.A N VAL 635.A O no hydrogen 3.124 N/A GLU 639.A N LEU 636.A O no hydrogen 2.816 N/A GLN 640.A NE2 ASN 425.A OD1 no hydrogen 3.533 N/A TYR 641.A OH PHE 427.A O no hydrogen 2.753 N/A LEU 642.A N GLU 154.A OE2 no hydrogen 2.984 N/A ARG 648.A N ASN 644.A O no hydrogen 3.227 N/A ARG 648.A NE ASP 643.A OD1 no hydrogen 2.882 N/A ARG 648.A NH2 ASP 643.A OD1 no hydrogen 3.381 N/A ARG 648.A NH2 ASP 643.A OD2 no hydrogen 3.108 N/A PHE 649.A N LEU 645.A O no hydrogen 2.998 N/A PHE 649.A N LEU 646.A O no hydrogen 3.247 N/A LEU 650.A N LEU 646.A O no hydrogen 3.150 N/A LEU 651.A N VAL 647.A O no hydrogen 2.934 N/A LYS 652.A N ARG 648.A O no hydrogen 3.281 N/A LYS 652.A NZ GLU 168.A OE1 no hydrogen 3.094 N/A LYS 653.A N PHE 649.A O no hydrogen 3.060 N/A LYS 653.A NZ LEU 620.A O no hydrogen 3.426 N/A LYS 653.A NZ ASP 622.A OD1 no hydrogen 2.885 N/A ALA 654.A N LEU 650.A O no hydrogen 2.835 N/A LEU 655.A N LEU 651.A O no hydrogen 3.038 N/A THR 656.A N LYS 653.A O no hydrogen 2.898 N/A THR 656.A OG1 LYS 652.A O no hydrogen 3.533 N/A ASN 657.A N LYS 653.A O no hydrogen 2.784 N/A ASN 657.A ND2 ASP 622.A OD2 no hydrogen 3.339 N/A GLN 658.A N TYR 184.A O no hydrogen 3.178 N/A ARG 659.A N ASN 657.A OD1 no hydrogen 2.732 N/A ARG 659.A NH1 PRO 187.A O no hydrogen 3.343 N/A ARG 659.A NH2 PRO 187.A O no hydrogen 2.696 N/A ILE 660.A N ASN 657.A OD1 no hydrogen 3.093 N/A GLY 661.A N ASN 657.A O no hydrogen 2.889 N/A HIS 662.A N GLN 658.A O no hydrogen 3.035 N/A HIS 662.A NE2 PRO 751.A O no hydrogen 2.722 N/A PHE 664.A N ILE 660.A O no hydrogen 2.854 N/A PHE 665.A N GLY 661.A O no hydrogen 2.836 N/A TRP 666.A N HIS 662.A O no hydrogen 3.178 N/A TRP 666.A NE1 GLN 702.A OE1 no hydrogen 2.794 N/A HIS 667.A N PHE 663.A O no hydrogen 2.871 N/A LEU 668.A N PHE 664.A O no hydrogen 3.494 N/A LYS 669.A N PHE 665.A O no hydrogen 2.671 N/A LYS 669.A NZ ALA 139.A O no hydrogen 2.737 N/A SER 670.A N TRP 666.A O no hydrogen 2.845 N/A SER 670.A OG GLU 671.A OE1 no hydrogen 3.484 N/A MET 672.A N LYS 669.A O no hydrogen 3.381 N/A HIS 673.A ND1 SER 670.A O no hydrogen 2.853 N/A ASN 674.A N GLU 671.A O no hydrogen 2.885 N/A THR 676.A N ASN 674.A OD1 no hydrogen 3.392 N/A VAL 677.A N ASN 674.A O no hydrogen 2.846 N/A SER 678.A N ASN 674.A O no hydrogen 2.918 N/A SER 678.A OG MET 672.A O no hydrogen 3.221 N/A SER 678.A OG ASN 674.A O no hydrogen 2.817 N/A ARG 680.A NH2 TYR 641.A O no hydrogen 2.876 N/A PHE 681.A N VAL 677.A O no hydrogen 2.922 N/A GLY 682.A N SER 678.A O no hydrogen 2.877 N/A LEU 683.A N GLN 679.A O no hydrogen 2.975 N/A LEU 684.A N ARG 680.A O no hydrogen 3.013 N/A LEU 685.A N PHE 681.A O no hydrogen 2.826 N/A GLU 686.A N GLY 682.A O no hydrogen 3.031 N/A SER 687.A N LEU 683.A O no hydrogen 3.112 N/A SER 687.A OG LEU 683.A O no hydrogen 3.091 N/A TYR 688.A N LEU 684.A O no hydrogen 3.106 N/A CYS 689.A N LEU 685.A O no hydrogen 2.844 N/A CYS 689.A SG LEU 685.A O no hydrogen 3.097 N/A ARG 690.A N GLU 686.A O no hydrogen 2.821 N/A ARG 690.A NH2 GLU 686.A OE2 no hydrogen 2.908 N/A ALA 691.A N SER 687.A O no hydrogen 3.098 N/A ALA 691.A N TYR 688.A O no hydrogen 3.060 N/A CYS 692.A SG CYS 689.A O no hydrogen 3.873 N/A TYR 695.A OH HIS 662.A ND1 no hydrogen 2.685 N/A LEU 696.A N GLY 693.A O no hydrogen 3.464 N/A LYS 697.A N MET 694.A O no hydrogen 2.751 N/A HIS 698.A N MET 694.A O no hydrogen 3.470 N/A LEU 699.A N TYR 695.A O no hydrogen 2.880 N/A ASN 700.A N LEU 696.A O no hydrogen 2.821 N/A ASN 700.A ND2 GLU 135.A O no hydrogen 3.165 N/A ARG 701.A N LYS 697.A O no hydrogen 3.167 N/A GLN 702.A N HIS 698.A O no hydrogen 3.114 N/A GLN 702.A NE2 TYR 695.A OH no hydrogen 3.256 N/A GLN 702.A NE2 HIS 698.A O no hydrogen 3.690 N/A VAL 703.A N LEU 699.A O no hydrogen 2.701 N/A GLU 704.A N ASN 700.A O no hydrogen 3.164 N/A ALA 705.A N ARG 701.A O no hydrogen 3.170 N/A MET 706.A N GLN 702.A O no hydrogen 3.010 N/A GLU 707.A N VAL 703.A O no hydrogen 3.005 N/A LYS 708.A N GLU 704.A O no hydrogen 3.021 N/A LYS 708.A NZ ASP 740.A OD2 no hydrogen 3.454 N/A LEU 709.A N ALA 705.A O no hydrogen 3.303 N/A ILE 710.A N MET 706.A O no hydrogen 2.831 N/A ASN 711.A N GLU 707.A O no hydrogen 3.098 N/A LEU 712.A N LYS 708.A O no hydrogen 2.809 N/A THR 713.A N LEU 709.A O no hydrogen 3.134 N/A THR 713.A OG1 LEU 709.A O no hydrogen 2.642 N/A THR 713.A OG1 ILE 710.A O no hydrogen 3.172 N/A ASP 714.A N ILE 710.A O no hydrogen 2.900 N/A ILE 715.A N ASN 711.A O no hydrogen 3.099 N/A ILE 715.A N LEU 712.A O no hydrogen 3.224 N/A LEU 716.A N LEU 712.A O no hydrogen 3.304 N/A LYS 717.A N THR 713.A O no hydrogen 3.047 N/A LYS 717.A NZ LYS 773.A O no hydrogen 3.355 N/A GLN 718.A N ILE 715.A O no hydrogen 2.939 N/A GLN 718.A NE2 LYS 717.A O no hydrogen 3.651 N/A GLU 719.A N ILE 715.A O no hydrogen 3.031 N/A LYS 720.A N ILE 715.A O no hydrogen 3.325 N/A GLN 725.A NE2 ILE 768.A O no hydrogen 2.512 N/A GLN 728.A N THR 724.A O no hydrogen 2.976 N/A GLN 728.A NE2 LYS 720.A O no hydrogen 2.711 N/A MET 729.A N GLN 725.A O no hydrogen 2.687 N/A LYS 730.A N LYS 726.A O no hydrogen 3.000 N/A PHE 731.A N VAL 727.A O no hydrogen 2.997 N/A LEU 732.A N GLN 728.A O no hydrogen 2.721 N/A VAL 733.A N MET 729.A O no hydrogen 3.176 N/A GLU 734.A N LYS 730.A O no hydrogen 2.886 N/A GLN 735.A N PHE 731.A O no hydrogen 3.148 N/A MET 736.A N LEU 732.A O no hydrogen 2.997 N/A ARG 737.A N VAL 733.A O no hydrogen 3.314 N/A ARG 738.A N GLN 735.A O no hydrogen 3.060 N/A ARG 738.A NE GLN 735.A OE1 no hydrogen 3.218 N/A ARG 738.A NH1 GLU 58.A OE1 no hydrogen 3.434 N/A ARG 738.A NH2 GLN 735.A OE1 no hydrogen 3.504 N/A PHE 741.A N ARG 738.A O no hydrogen 2.954 N/A MET 742.A N ARG 738.A O no hydrogen 2.991 N/A ASP 743.A N PRO 739.A O no hydrogen 2.673 N/A ALA 744.A N ASP 740.A O no hydrogen 3.220 N/A LEU 745.A N PHE 741.A O no hydrogen 2.928 N/A PHE 748.A N LEU 758.A O no hydrogen 2.964 N/A SER 750.A N HIS 756.A O no hydrogen 3.194 N/A ASN 753.A N SER 750.A O no hydrogen 3.036 N/A ALA 755.A N ASN 753.A OD1 no hydrogen 3.179 N/A HIS 756.A N ASN 753.A O no hydrogen 2.990 N/A LEU 758.A N PHE 748.A O no hydrogen 2.757 N/A GLY 759.A N GLU 781.A O no hydrogen 3.183 N/A ARG 762.A N ASN 779.A O no hydrogen 3.324 N/A CYS 766.A SG ARG 762.A O no hydrogen 3.256 N/A CYS 766.A SG ASN 779.A O no hydrogen 3.957 N/A ARG 767.A N TRP 777.A O no hydrogen 2.974 N/A ARG 767.A NH1 GLU 765.A O no hydrogen 3.432 N/A MET 769.A N PRO 775.A O no hydrogen 3.017 N/A LYS 773.A N SER 771.A OG no hydrogen 3.286 N/A ARG 774.A N SER 771.A O no hydrogen 3.119 N/A ARG 774.A NE GLN 728.A OE1 no hydrogen 2.889 N/A ARG 774.A NH1 SER 771.A O no hydrogen 2.577 N/A ARG 774.A NH2 GLN 725.A OE1 no hydrogen 2.669 N/A ARG 774.A NH2 GLN 728.A OE1 no hydrogen 2.554 N/A LEU 776.A N PHE 797.A O no hydrogen 3.011 N/A TRP 777.A N ARG 767.A O no hydrogen 2.797 N/A TRP 777.A NE1 GLU 794.A OE2 no hydrogen 3.043 N/A LEU 778.A N ILE 795.A O no hydrogen 3.417 N/A ASN 779.A ND2 GLU 794.A OE2 no hydrogen 2.942 N/A TRP 780.A N ASN 793.A O no hydrogen 2.693 N/A TRP 780.A NE1 LEU 745.A O no hydrogen 2.830 N/A GLU 781.A N GLY 759.A O no hydrogen 2.918 N/A GLU 781.A N ASN 760.A O no hydrogen 3.020 N/A ASN 782.A N GLN 791.A O no hydrogen 3.034 N/A ASN 782.A ND2 GLY 275.A O no hydrogen 3.451 N/A ASN 782.A ND2 GLN 757.A O no hydrogen 3.668 N/A MET 786.A N ASP 784.A OD2 no hydrogen 3.074 N/A LEU 788.A N MET 786.A O no hydrogen 3.108 N/A LEU 788.A N GLU 787.A OE2 no hydrogen 2.676 N/A ASN 793.A N TRP 780.A O no hydrogen 2.953 N/A ILE 795.A N LEU 778.A O no hydrogen 3.148 N/A ILE 796.A N ILE 844.A O no hydrogen 2.851 N/A PHE 797.A N LEU 776.A O no hydrogen 2.991 N/A LYS 798.A N GLY 842.A O no hydrogen 3.233 N/A ASN 799.A ND2 THR 713.A OG1 no hydrogen 2.670 N/A ARG 804.A NH1 ASP 802.A OD1 no hydrogen 3.198 N/A GLN 805.A NE2 ASP 802.A OD2 no hydrogen 3.234 N/A GLN 805.A NE2 GLU 1004.A OE1 no hydrogen 3.075 N/A MET 807.A N LEU 803.A O no hydrogen 2.910 N/A LEU 808.A N GLN 805.A O no hydrogen 2.955 N/A THR 809.A N GLN 805.A O no hydrogen 3.029 N/A LEU 810.A N ASP 806.A O no hydrogen 2.745 N/A GLN 811.A N MET 807.A O no hydrogen 3.010 N/A GLN 811.A NE2 GLN 631.A OE1 no hydrogen 2.937 N/A ILE 812.A N LEU 808.A O no hydrogen 2.675 N/A ILE 813.A N THR 809.A O no hydrogen 2.705 N/A ARG 814.A N LEU 810.A O no hydrogen 3.062 N/A ARG 814.A NH2 PRO 831.A O no hydrogen 3.318 N/A ILE 815.A N GLN 811.A O no hydrogen 3.068 N/A MET 816.A N ILE 812.A O no hydrogen 3.107 N/A GLU 817.A N ILE 813.A O no hydrogen 2.769 N/A ASN 818.A N ARG 814.A O no hydrogen 3.182 N/A ILE 819.A N ILE 815.A O no hydrogen 2.948 N/A TRP 820.A N MET 816.A O no hydrogen 2.885 N/A TRP 820.A NE1 ALA 979.A O no hydrogen 3.198 N/A GLN 821.A N GLU 817.A O no hydrogen 2.941 N/A GLN 821.A NE2 LEU 827.A O no hydrogen 3.655 N/A ASN 822.A N ASN 818.A O no hydrogen 2.888 N/A LEU 825.A N TRP 820.A O no hydrogen 3.013 N/A GLY 833.A N GLU 845.A OE2 no hydrogen 3.004 N/A CYS 834.A SG LEU 843.A O no hydrogen 3.823 N/A LEU 835.A N LEU 843.A O no hydrogen 2.780 N/A SER 836.A OG GLY 838.A O no hydrogen 3.162 N/A SER 836.A OG VAL 841.A O no hydrogen 3.337 N/A ILE 837.A N VAL 841.A O no hydrogen 2.882 N/A CYS 840.A SG ASP 839.A OD1 no hydrogen 3.744 N/A LEU 843.A N LEU 835.A O no hydrogen 2.891 N/A ILE 844.A N ILE 796.A O no hydrogen 2.790 N/A GLU 845.A N GLY 833.A O no hydrogen 2.769 N/A ARG 848.A NH1 ASN 792.A O no hydrogen 3.345 N/A SER 850.A OG VAL 847.A O no hydrogen 3.157 N/A HIS 851.A N VAL 919.A O no hydrogen 3.060 N/A THR 852.A N GLN 855.A OE1 no hydrogen 3.110 N/A THR 852.A OG1 GLN 855.A OE1 no hydrogen 3.071 N/A ILE 853.A N ILE 917.A O no hydrogen 3.259 N/A MET 854.A N ASN 914.A O no hydrogen 3.428 N/A GLN 855.A N THR 852.A O no hydrogen 2.577 N/A ILE 856.A N THR 852.A O no hydrogen 3.367 N/A GLN 857.A N ILE 853.A O no hydrogen 3.018 N/A CYS 858.A N MET 854.A O no hydrogen 2.788 N/A CYS 858.A SG MET 854.A O no hydrogen 3.379 N/A LYS 859.A N GLN 855.A O no hydrogen 2.616 N/A GLY 860.A N ILE 856.A O no hydrogen 2.759 N/A GLY 861.A N LYS 859.A O no hydrogen 2.536 N/A LEU 862.A N GLY 860.A O no hydrogen 2.946 N/A HIS 871.A N ASN 869.A OD1 no hydrogen 2.749 N/A THR 872.A N ASN 869.A O no hydrogen 2.849 N/A THR 872.A OG1 ASN 869.A O no hydrogen 2.508 N/A GLN 875.A N HIS 871.A O no hydrogen 2.689 N/A TRP 876.A N THR 872.A O no hydrogen 2.666 N/A LEU 877.A N LEU 873.A O no hydrogen 2.777 N/A LYS 878.A N HIS 874.A O no hydrogen 2.899 N/A ASP 879.A N GLN 875.A O no hydrogen 2.849 N/A LYS 880.A N LEU 877.A O no hydrogen 3.088 N/A ASN 881.A N LEU 877.A O no hydrogen 2.918 N/A ASN 881.A ND2 ASP 921.A O no hydrogen 3.290 N/A LYS 882.A NZ ASP 879.A O no hydrogen 3.225 N/A ALA 888.A N GLU 884.A O no hydrogen 3.425 N/A ALA 889.A N ILE 885.A O no hydrogen 2.975 N/A ILE 890.A N TYR 886.A O no hydrogen 3.187 N/A ASP 891.A N ASP 887.A O no hydrogen 3.224 N/A LEU 892.A N ALA 888.A O no hydrogen 3.035 N/A PHE 893.A N ALA 889.A O no hydrogen 2.916 N/A THR 894.A N ILE 890.A O no hydrogen 2.822 N/A THR 894.A OG1 ILE 890.A O no hydrogen 2.833 N/A ARG 895.A N ASP 891.A O no hydrogen 2.637 N/A ARG 895.A NE ASP 891.A OD1 no hydrogen 3.165 N/A ARG 895.A NE ASP 891.A OD2 no hydrogen 3.084 N/A ARG 895.A NH1 ASP 826.A O no hydrogen 2.905 N/A SER 896.A N LEU 892.A O no hydrogen 2.728 N/A SER 896.A OG LEU 892.A O no hydrogen 3.250 N/A SER 896.A OG PHE 893.A O no hydrogen 3.116 N/A SER 896.A OG LEU 925.A O no hydrogen 3.294 N/A CYS 897.A N PHE 893.A O no hydrogen 2.763 N/A ALA 898.A N THR 894.A O no hydrogen 3.375 N/A TYR 900.A N SER 896.A O no hydrogen 2.950 N/A TYR 900.A OH LEU 830.A O no hydrogen 3.038 N/A CYS 901.A N CYS 897.A O no hydrogen 3.085 N/A CYS 901.A SG PHE 946.A O no hydrogen 3.763 N/A VAL 902.A N ALA 898.A O no hydrogen 3.174 N/A ALA 903.A N GLY 899.A O no hydrogen 2.913 N/A THR 904.A N TYR 900.A O no hydrogen 3.058 N/A THR 904.A OG1 TYR 900.A O no hydrogen 2.822 N/A PHE 905.A N CYS 901.A O no hydrogen 2.957 N/A ILE 906.A N VAL 902.A O no hydrogen 2.973 N/A LEU 907.A N ALA 903.A O no hydrogen 2.959 N/A GLY 908.A N THR 904.A O no hydrogen 2.737 N/A GLY 910.A N PHE 930.A O no hydrogen 2.998 N/A ARG 912.A N PRO 945.A O no hydrogen 3.042 N/A ARG 912.A NE GLY 910.A O no hydrogen 3.262 N/A ARG 912.A NH1 ILE 928.A O no hydrogen 2.694 N/A ARG 912.A NH2 GLY 910.A O no hydrogen 3.556 N/A ARG 912.A NH2 ASP 929.A O no hydrogen 3.182 N/A HIS 913.A N ASN 916.A OD1 no hydrogen 3.045 N/A ASN 916.A N HIS 913.A O no hydrogen 2.757 N/A ASN 916.A ND2 ASP 911.A O no hydrogen 3.272 N/A MET 918.A N PHE 926.A O no hydrogen 2.867 N/A VAL 919.A N HIS 851.A O no hydrogen 2.948 N/A LYS 920.A N GLN 924.A O no hydrogen 2.852 N/A LYS 920.A NZ ASP 922.A OD1 no hydrogen 2.983 N/A LYS 920.A NZ GLN 924.A OE1 no hydrogen 2.963 N/A GLY 923.A N LYS 920.A O no hydrogen 2.691 N/A GLN 924.A NE2 ARG 828.A O no hydrogen 2.763 N/A LEU 925.A N SER 896.A OG no hydrogen 3.023 N/A PHE 926.A N MET 918.A O no hydrogen 2.847 N/A ILE 928.A N ASN 916.A O no hydrogen 3.038 N/A HIS 932.A ND1 GLU 1004.A OE2 no hydrogen 2.868 N/A ASP 935.A N PHE 933.A O no hydrogen 2.806 N/A LYS 940.A N LYS 937.A O no hydrogen 3.266 N/A ARG 941.A NH1 LYS 937.A O no hydrogen 3.524 N/A ARG 941.A NH2 ASP 935.A OD1 no hydrogen 2.676 N/A ARG 943.A NH1 ILE 909.A O no hydrogen 3.181 N/A ARG 943.A NH1 ASP 911.A OD1 no hydrogen 3.108 N/A ARG 943.A NH2 ILE 909.A O no hydrogen 3.299 N/A ARG 943.A NH2 ASP 935.A OD1 no hydrogen 3.150 N/A THR 949.A OG1 ASP 951.A OD1 no hydrogen 3.374 N/A LEU 953.A N THR 949.A O no hydrogen 3.237 N/A ILE 954.A N GLN 950.A O no hydrogen 2.760 N/A ILE 956.A N PHE 952.A O no hydrogen 2.894 N/A SER 957.A N LEU 953.A O no hydrogen 3.240 N/A SER 957.A OG LEU 953.A O no hydrogen 3.068 N/A SER 957.A OG ILE 954.A O no hydrogen 3.389 N/A GLY 959.A N ILE 954.A O no hydrogen 3.416 N/A GLY 959.A N SER 957.A O no hydrogen 3.013 N/A CYS 963.A SG ALA 960.A O no hydrogen 3.564 N/A LYS 965.A N GLU 962.A O no hydrogen 3.380 N/A THR 966.A N CYS 963.A O no hydrogen 3.222 N/A THR 966.A OG1 CYS 963.A O no hydrogen 3.542 N/A PHE 969.A N THR 966.A OG1 no hydrogen 3.016 N/A GLU 970.A N THR 966.A O no hydrogen 3.321 N/A ARG 971.A N ARG 967.A O no hydrogen 2.807 N/A PHE 972.A N GLU 968.A O no hydrogen 3.408 N/A GLN 973.A N PHE 969.A O no hydrogen 2.870 N/A GLU 974.A N GLU 970.A O no hydrogen 3.020 N/A MET 975.A N ARG 971.A O no hydrogen 2.979 N/A CYS 976.A N PHE 972.A O no hydrogen 3.050 N/A CYS 976.A SG PHE 972.A O no hydrogen 3.562 N/A TYR 977.A N GLN 973.A O no hydrogen 2.932 N/A LYS 978.A N GLU 974.A O no hydrogen 2.970 N/A ALA 979.A N MET 975.A O no hydrogen 2.895 N/A TYR 980.A N CYS 976.A O no hydrogen 2.872 N/A TYR 980.A OH THR 1017.A O no hydrogen 2.631 N/A LEU 981.A N TYR 977.A O no hydrogen 3.206 N/A ALA 982.A N LYS 978.A O no hydrogen 3.087 N/A ILE 983.A N ALA 979.A O no hydrogen 3.227 N/A ARG 984.A N TYR 980.A O no hydrogen 3.244 N/A ARG 984.A NE LEU 1018.A O no hydrogen 3.090 N/A ARG 984.A NE ALA 1019.A O no hydrogen 2.877 N/A ARG 984.A NH2 ALA 1019.A O no hydrogen 2.791 N/A GLN 985.A N LEU 981.A O no hydrogen 3.109 N/A HIS 986.A N ILE 983.A O no hydrogen 2.997 N/A ILE 991.A N ALA 987.A O no hydrogen 3.076 N/A ASN 992.A N ASN 988.A O no hydrogen 2.780 N/A ASN 992.A ND2 GLU 593.A O no hydrogen 3.346 N/A LEU 993.A N LEU 989.A O no hydrogen 2.742 N/A PHE 994.A N PHE 990.A O no hydrogen 2.953 N/A SER 995.A N ILE 991.A O no hydrogen 2.706 N/A SER 995.A OG ILE 991.A O no hydrogen 2.742 N/A MET 996.A N ASN 992.A O no hydrogen 2.908 N/A MET 997.A N PHE 994.A O no hydrogen 3.090 N/A LEU 998.A N SER 995.A O no hydrogen 3.311 N/A SER 1000.A OG MET 997.A O no hydrogen 2.567 N/A GLU 1004.A N GLU 1004.A OE1 no hydrogen 2.727 N/A LEU 1005.A N MET 1002.A O no hydrogen 3.052 N/A GLN 1006.A N ASP 1010.A OD2 no hydrogen 2.994 N/A SER 1007.A N ASP 1010.A OD2 no hydrogen 2.724 N/A SER 1007.A OG ASP 1009.A OD1 no hydrogen 3.176 N/A ASP 1010.A N SER 1007.A O no hydrogen 2.736 N/A ALA 1012.A N PHE 1008.A O no hydrogen 2.796 N/A ILE 1014.A N ILE 1011.A O no hydrogen 2.993 N/A ARG 1015.A N ALA 1012.A O no hydrogen 2.843 N/A ARG 1015.A NE ASP 535.A OD2 no hydrogen 3.326 N/A ARG 1015.A NH1 ASP 1021.A OD1 no hydrogen 2.953 N/A ARG 1015.A NH2 ASP 535.A OD1 no hydrogen 3.061 N/A ARG 1015.A NH2 ASP 1021.A OD1 no hydrogen 2.865 N/A THR 1017.A N TYR 1013.A O no hydrogen 3.185 N/A THR 1017.A OG1 PHE 905.A O no hydrogen 3.155 N/A THR 1017.A OG1 ILE 906.A O no hydrogen 3.538 N/A ALA 1019.A N ARG 1015.A O no hydrogen 2.461 N/A THR 1023.A N GLU 1026.A OE1 no hydrogen 3.117 N/A THR 1023.A OG1 GLU 1026.A OE1 no hydrogen 2.964 N/A GLN 1025.A NE2 GLU 1029.A OE2 no hydrogen 3.108 N/A ALA 1027.A N THR 1023.A O no hydrogen 2.851 N/A LEU 1028.A N GLU 1024.A O no hydrogen 2.597 N/A GLU 1029.A N GLN 1025.A O no hydrogen 3.163 N/A TYR 1030.A N GLU 1026.A O no hydrogen 2.699 N/A PHE 1031.A N ALA 1027.A O no hydrogen 2.914 N/A MET 1032.A N LEU 1028.A O no hydrogen 2.960 N/A LYS 1033.A N GLU 1029.A O no hydrogen 2.716 N/A GLN 1034.A N TYR 1030.A O no hydrogen 2.743 N/A MET 1035.A N PHE 1031.A O no hydrogen 2.664 N/A ASN 1036.A N MET 1032.A O no hydrogen 2.724 N/A ASP 1037.A N LYS 1033.A O no hydrogen 3.202 N/A HIS 1039.A N ASN 1036.A O no hydrogen 3.140 N/A HIS 1040.A N ASN 1036.A O no hydrogen 2.702 N/A GLY 1041.A N ASN 1036.A OD1 no hydrogen 3.142 N/A THR 1045.A OG1 THR 1044.A O no hydrogen 2.591 N/A