Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8f3s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 7.A N ALA 3.A O no hydrogen 2.950 N/A GLU 8.A N VAL 4.A O no hydrogen 2.853 N/A LYS 9.A N GLU 5.A O no hydrogen 3.295 N/A THR 10.A N ALA 6.A O no hydrogen 3.166 N/A THR 10.A OG1 ALA 6.A O no hydrogen 2.908 N/A THR 10.A OG1 THR 107.A O no hydrogen 3.301 N/A VAL 11.A N GLY 7.A O no hydrogen 3.359 N/A GLU 12.A N GLU 8.A O no hydrogen 3.030 N/A GLN 13.A N LYS 9.A O no hydrogen 2.981 N/A GLN 13.A NE2 LYS 9.A O no hydrogen 3.067 N/A PHE 14.A N THR 10.A O no hydrogen 3.043 N/A VAL 15.A N VAL 11.A O no hydrogen 3.259 N/A GLN 16.A N GLU 12.A O no hydrogen 3.173 N/A ALA 17.A N GLN 13.A O no hydrogen 3.243 N/A LEU 18.A N PHE 14.A O no hydrogen 3.176 N/A ASN 19.A N VAL 15.A O no hydrogen 2.725 N/A LYS 20.A N GLN 16.A O no hydrogen 2.835 N/A GLY 21.A N LEU 18.A O no hydrogen 3.113 N/A ASP 22.A N ALA 17.A O no hydrogen 3.118 N/A LYS 25.A N ASP 22.A OD1 no hydrogen 2.967 N/A ALA 27.A N TYR 23.A O no hydrogen 2.994 N/A ALA 27.A N ASN 24.A O no hydrogen 3.011 N/A GLU 28.A N ASN 24.A O no hydrogen 3.126 N/A THR 30.A N ALA 27.A O no hydrogen 3.228 N/A THR 30.A OG1 ALA 27.A O no hydrogen 2.719 N/A SER 31.A N ILE 109.A O no hydrogen 3.029 N/A SER 31.A OG THR 108.A OG1 no hydrogen 3.080 N/A SER 31.A OG ASN 110.A OD1 no hydrogen 2.766 N/A ALA 34.A N SER 38.A O no hydrogen 2.920 N/A SER 38.A OG LEU 40.A O no hydrogen 3.167 N/A ALA 39.A N TRP 111.A O no hydrogen 2.964 N/A SER 41.A N GLU 44.A OE1 no hydrogen 2.651 N/A GLU 42.A N SER 41.A OG no hydrogen 2.453 N/A ILE 45.A N GLU 42.A O no hydrogen 3.111 N/A LEU 46.A N GLU 42.A O no hydrogen 3.346 N/A ASP 47.A N LYS 43.A O no hydrogen 2.983 N/A LYS 48.A N GLU 44.A O no hydrogen 3.252 N/A TYR 49.A N ILE 45.A O no hydrogen 2.952 N/A TYR 49.A OH LEU 115.A O no hydrogen 3.045 N/A GLN 50.A N LEU 46.A O no hydrogen 3.007 N/A ASN 51.A N ASP 47.A O no hydrogen 3.175 N/A ASN 51.A ND2 ASP 47.A O no hydrogen 2.656 N/A ILE 52.A N LYS 48.A O no hydrogen 3.376 N/A TYR 53.A N TYR 49.A O no hydrogen 2.730 N/A TYR 53.A OH VAL 116.A O no hydrogen 2.884 N/A GLY 54.A N GLN 50.A O no hydrogen 3.093 N/A ALA 55.A N ILE 52.A O no hydrogen 3.234 N/A ALA 56.A N ILE 52.A O no hydrogen 3.213 N/A VAL 58.A N TYR 53.A O no hydrogen 2.893 N/A LYS 59.A N ASN 85.A O no hydrogen 2.926 N/A LEU 61.A N ASN 19.A OD1 no hydrogen 2.819 N/A GLN 62.A N LYS 83.A O no hydrogen 2.933 N/A SER 64.A N LYS 81.A O no hydrogen 2.776 N/A LYS 67.A N SER 79.A O no hydrogen 3.012 N/A ASP 69.A N SER 77.A O no hydrogen 3.008 N/A ASP 72.A N THR 75.A O no hydrogen 3.448 N/A SER 74.A OG ARG 102.A O no hydrogen 3.302 N/A SER 74.A OG ASN 103.A OD1 no hydrogen 3.497 N/A PHE 78.A N GLY 98.A O no hydrogen 3.311 N/A SER 79.A N LYS 67.A O no hydrogen 3.169 N/A TYR 80.A N TYR 96.A O no hydrogen 3.328 N/A LYS 81.A N SER 64.A O no hydrogen 3.075 N/A ALA 82.A N LEU 94.A O no hydrogen 2.889 N/A LYS 83.A N GLN 62.A O no hydrogen 2.763 N/A MET 84.A N LEU 91.A O no hydrogen 3.115 N/A ASN 85.A N LYS 59.A O no hydrogen 3.040 N/A THR 86.A N GLY 89.A O no hydrogen 2.651 N/A THR 86.A OG1 GLY 89.A O no hydrogen 3.099 N/A SER 87.A N ALA 56.A O no hydrogen 2.973 N/A SER 87.A OG ALA 56.A O no hydrogen 2.952 N/A SER 87.A OG ASP 57.A OD2 no hydrogen 3.115 N/A GLY 89.A N THR 86.A O no hydrogen 3.353 N/A LEU 91.A N MET 84.A O no hydrogen 2.703 N/A LEU 94.A N ALA 82.A O no hydrogen 3.211 N/A TYR 96.A N TYR 80.A O no hydrogen 2.926 N/A ASP 101.A N THR 108.A O no hydrogen 2.952 N/A ARG 102.A N SER 74.A O no hydrogen 3.272 N/A GLN 106.A N ASN 103.A O no hydrogen 3.254 N/A THR 108.A N ASP 101.A O no hydrogen 2.817 N/A THR 108.A OG1 SER 31.A OG no hydrogen 3.080 N/A THR 108.A OG1 ASP 101.A O no hydrogen 3.389 N/A ILE 109.A N MET 29.A O no hydrogen 3.033 N/A ASN 110.A N THR 99.A O no hydrogen 3.088 N/A ASN 110.A ND2 THR 99.A OG1 no hydrogen 2.996 N/A TRP 111.A NE1 TYR 49.A OH no hydrogen 3.233 N/A LEU 115.A N GLN 112.A O no hydrogen 3.005 N/A VAL 116.A N PRO 113.A O no hydrogen 3.450 N/A MET 120.A N PHE 117.A O no hydrogen 3.445 N/A GLU 121.A N ASP 124.A OD2 no hydrogen 2.916 N/A ASN 123.A ND2 ASN 123.A O no hydrogen 2.743 N/A LYS 125.A N THR 284.A O no hydrogen 2.986 N/A LYS 125.A NZ ALA 286.A O no hydrogen 2.876 N/A SER 127.A N SER 282.A O no hydrogen 3.054 N/A THR 129.A N LYS 280.A O no hydrogen 3.030 N/A GLN 131.A N GLY 278.A O no hydrogen 2.688 N/A ARG 135.A NH2 ASP 270.A OD1 no hydrogen 2.335 N/A GLY 136.A N LEU 273.A O no hydrogen 2.623 N/A ASN 137.A N ASP 304.A OD1 no hydrogen 2.913 N/A ILE 138.A N ALA 147.A O no hydrogen 3.040 N/A ILE 139.A N ILE 305.A O no hydrogen 2.762 N/A ASP 140.A N GLU 144.A O no hydrogen 3.206 N/A ARG 141.A N ILE 309.A O no hydrogen 3.068 N/A ARG 141.A NH1 THR 308.A O no hydrogen 2.898 N/A ARG 141.A NH1 ASP 337.A OD2 no hydrogen 3.297 N/A ASN 142.A N ASP 140.A OD1 no hydrogen 3.030 N/A GLY 143.A N ASP 140.A O no hydrogen 3.312 N/A GLU 144.A N ASP 140.A OD1 no hydrogen 2.444 N/A LEU 146.A N ILE 138.A O no hydrogen 2.922 N/A ALA 147.A N ILE 138.A O no hydrogen 3.197 N/A THR 148.A N TYR 226.A O no hydrogen 3.121 N/A LEU 152.A N VAL 222.A O no hydrogen 2.662 N/A GLY 156.A N THR 218.A O no hydrogen 3.236 N/A VAL 157.A N VAL 201.A O no hydrogen 2.936 N/A SER 160.A OG ASP 198.A OD1 no hydrogen 3.058 N/A LYS 161.A N VAL 158.A O no hydrogen 3.172 N/A LYS 168.A N GLY 165.A O no hydrogen 3.163 N/A ALA 170.A N GLY 166.A O no hydrogen 3.431 N/A ASN 171.A N GLU 167.A O no hydrogen 3.054 N/A ASN 171.A ND2 GLU 167.A O no hydrogen 2.553 N/A ILE 172.A N LYS 168.A O no hydrogen 2.748 N/A LYS 173.A N ALA 170.A O no hydrogen 3.253 N/A ALA 174.A N ALA 170.A O no hydrogen 2.821 N/A ILE 175.A N ASN 171.A O no hydrogen 2.676 N/A SER 177.A N LYS 173.A O no hydrogen 3.020 N/A SER 177.A OG LYS 173.A O no hydrogen 3.096 N/A SER 178.A N ALA 174.A O no hydrogen 3.103 N/A SER 178.A OG ALA 174.A O no hydrogen 2.735 N/A LEU 181.A N ALA 176.A O no hydrogen 2.769 N/A ALA 185.A N THR 182.A O no hydrogen 3.154 N/A ASN 187.A ND2 GLU 183.A O no hydrogen 3.014 N/A ALA 189.A N ALA 185.A O no hydrogen 3.001 N/A ILE 190.A N ILE 186.A O no hydrogen 3.158 N/A SER 191.A N GLN 188.A O no hydrogen 3.358 N/A SER 191.A OG ASN 187.A O no hydrogen 2.818 N/A SER 191.A OG GLN 188.A O no hydrogen 3.312 N/A GLN 192.A NE2 ALA 189.A O no hydrogen 3.211 N/A TRP 194.A NE1 GLN 192.A OE1 no hydrogen 2.985 N/A TYR 199.A N GLN 196.A O no hydrogen 3.272 N/A VAL 201.A N VAL 157.A O no hydrogen 3.042 N/A LEU 203.A N LEU 155.A O no hydrogen 2.788 N/A ILE 206.A N LYS 153.A O no hydrogen 2.909 N/A VAL 222.A N LEU 152.A O no hydrogen 3.109 N/A GLY 224.A N GLY 150.A O no hydrogen 3.193 N/A ARG 225.A NE GLU 266.A OE2 no hydrogen 2.788 N/A ARG 225.A NH1 GLY 136.A O no hydrogen 3.170 N/A ARG 225.A NH1 THR 149.A OG1 no hydrogen 2.753 N/A ARG 225.A NH2 GLY 136.A O no hydrogen 2.913 N/A ARG 225.A NH2 GLU 266.A OE1 no hydrogen 3.173 N/A ARG 225.A NH2 GLU 266.A OE2 no hydrogen 3.136 N/A TYR 226.A N THR 148.A O no hydrogen 2.750 N/A TYR 227.A N ASN 350.A OD1 no hydrogen 2.755 N/A TYR 227.A OH GLU 266.A OE2 no hydrogen 3.098 N/A ALA 232.A N LEU 229.A O no hydrogen 3.454 N/A ALA 234.A N GLU 231.A O no hydrogen 3.310 N/A GLN 235.A N GLN 235.A OE1 no hydrogen 2.788 N/A GLN 235.A NE2 PRO 345.A O no hydrogen 3.201 N/A GLN 235.A NE2 SER 346.A OG no hydrogen 3.246 N/A GLN 235.A NE2 PRO 371.A O no hydrogen 2.802 N/A ILE 237.A N ALA 233.A O no hydrogen 2.873 N/A GLY 238.A N ALA 234.A O no hydrogen 2.940 N/A GLY 241.A N ILE 260.A O no hydrogen 2.841 N/A THR 244.A N ASP 247.A OD2 no hydrogen 3.523 N/A THR 244.A OG1 ASP 247.A OD2 no hydrogen 3.159 N/A ASP 247.A N THR 244.A O no hydrogen 3.099 N/A ASP 247.A N THR 244.A OG1 no hydrogen 3.301 N/A LYS 250.A N ASP 247.A O no hydrogen 3.196 N/A ASN 251.A N ASP 247.A O no hydrogen 3.200 N/A LEU 254.A N ASN 251.A O no hydrogen 3.422 N/A ILE 260.A N GLY 241.A O no hydrogen 3.008 N/A GLY 261.A N ASP 270.A OD1 no hydrogen 2.875 N/A ARG 262.A N TYR 239.A O no hydrogen 2.882 N/A ARG 262.A NH1 ASP 247.A OD2 no hydrogen 3.214 N/A ARG 262.A NH2 ASP 242.A O no hydrogen 2.953 N/A ARG 262.A NH2 ASP 247.A OD2 no hydrogen 2.953 N/A LEU 265.A N LEU 236.A O no hydrogen 2.986 N/A GLU 266.A N ILE 237.A O no hydrogen 2.880 N/A MET 267.A N GLY 264.A O no hydrogen 3.246 N/A ALA 268.A N GLY 264.A O no hydrogen 2.940 N/A PHE 269.A N LEU 265.A O no hydrogen 2.949 N/A ASP 270.A N MET 267.A O no hydrogen 3.318 N/A LEU 273.A N PHE 269.A O no hydrogen 3.095 N/A ARG 274.A N ASP 270.A O no hydrogen 3.058 N/A ARG 274.A NH1 ASP 270.A OD2 no hydrogen 2.812 N/A THR 276.A N GLN 300.A O no hydrogen 3.007 N/A THR 276.A OG1 GLN 300.A OE1 no hydrogen 3.290 N/A GLY 278.A N GLN 131.A O no hydrogen 3.336 N/A GLY 279.A N HIS 297.A O no hydrogen 3.125 N/A LYS 280.A N THR 129.A O no hydrogen 2.850 N/A LYS 280.A NZ GLU 290.A OE1 no hydrogen 3.407 N/A LEU 281.A N ILE 295.A O no hydrogen 2.708 N/A SER 282.A N SER 127.A O no hydrogen 3.192 N/A SER 282.A OG SER 127.A OG no hydrogen 3.197 N/A ILE 283.A N LYS 292.A O no hydrogen 2.728 N/A THR 284.A N LYS 125.A O no hydrogen 2.686 N/A THR 284.A OG1 LYS 125.A O no hydrogen 3.288 N/A VAL 289.A N ASP 285.A O no hydrogen 3.384 N/A LYS 291.A N ILE 283.A O no hydrogen 2.863 N/A LYS 291.A NZ GLU 119.A O no hydrogen 3.108 N/A LYS 291.A NZ ASP 124.A OD2 no hydrogen 2.750 N/A LYS 292.A N ILE 283.A O no hydrogen 3.263 N/A LYS 292.A NZ GLU 119.A OE1 no hydrogen 3.110 N/A LEU 294.A N LEU 281.A O no hydrogen 2.851 N/A ILE 295.A N LEU 281.A O no hydrogen 3.302 N/A HIS 297.A N GLY 279.A O no hydrogen 3.235 N/A GLN 300.A N THR 276.A O no hydrogen 3.419 N/A GLY 302.A N ALA 134.A O no hydrogen 3.017 N/A LYS 303.A N ASP 272.A O no hydrogen 2.823 N/A LYS 303.A NZ ASN 301.A O no hydrogen 3.217 N/A ILE 305.A N ASN 137.A O no hydrogen 3.077 N/A LEU 307.A N ILE 139.A O no hydrogen 2.906 N/A THR 308.A N LEU 530.A O no hydrogen 2.825 N/A THR 308.A OG1 LEU 338.A O no hydrogen 3.039 N/A THR 308.A OG1 LYS 529.A O no hydrogen 2.835 N/A THR 308.A OG1 LEU 530.A O no hydrogen 3.288 N/A ASP 310.A N LEU 339.A O no hydrogen 2.755 N/A ALA 311.A N ASP 140.A OD2 no hydrogen 3.370 N/A LYS 312.A N ASP 310.A OD1 no hydrogen 2.952 N/A GLN 314.A N ASP 310.A O no hydrogen 2.771 N/A GLN 314.A NE2 ALA 232.A O no hydrogen 2.703 N/A GLN 314.A NE2 LEU 341.A O no hydrogen 2.927 N/A LYS 315.A N ALA 311.A O no hydrogen 3.138 N/A LYS 315.A NZ ASP 319.A OD2 no hydrogen 3.507 N/A THR 316.A N LYS 312.A O no hydrogen 3.078 N/A THR 316.A OG1 LYS 312.A O no hydrogen 2.927 N/A ALA 317.A N ALA 313.A O no hydrogen 2.859 N/A PHE 318.A N GLN 314.A O no hydrogen 3.181 N/A ASP 319.A N LYS 315.A O no hydrogen 2.911 N/A SER 320.A N THR 316.A O no hydrogen 2.971 N/A SER 320.A OG THR 316.A O no hydrogen 2.984 N/A SER 320.A OG GLU 630.A OE1 no hydrogen 3.156 N/A LEU 321.A N PHE 318.A O no hydrogen 3.017 N/A GLY 322.A N ASP 319.A O no hydrogen 3.113 N/A LYS 324.A N LEU 321.A O no hydrogen 3.075 N/A LYS 324.A NZ GLU 619.A OE2 no hydrogen 3.281 N/A GLY 326.A N SER 344.A O no hydrogen 2.845 N/A SER 327.A N MET 614.A O no hydrogen 3.125 N/A THR 328.A N ALA 342.A O no hydrogen 3.171 N/A VAL 329.A N VAL 612.A O no hydrogen 2.799 N/A ALA 330.A N ALA 340.A O no hydrogen 3.150 N/A THR 331.A N MET 610.A O no hydrogen 2.763 N/A THR 332.A N ASP 337.A O no hydrogen 3.021 N/A THR 332.A OG1 THR 335.A OG1 no hydrogen 2.706 N/A THR 335.A N THR 332.A O no hydrogen 3.098 N/A THR 335.A OG1 THR 332.A OG1 no hydrogen 2.706 N/A THR 335.A OG1 ASP 337.A OD1 no hydrogen 2.607 N/A GLY 336.A N THR 332.A O no hydrogen 2.747 N/A LEU 338.A N LYS 529.A O no hydrogen 3.221 N/A LEU 339.A N ALA 330.A O no hydrogen 2.492 N/A ALA 340.A N ALA 330.A O no hydrogen 3.151 N/A LEU 341.A N GLN 314.A OE1 no hydrogen 2.656 N/A ALA 342.A N THR 328.A O no hydrogen 3.056 N/A SER 343.A OG ILE 373.A O no hydrogen 3.185 N/A SER 344.A N GLY 326.A O no hydrogen 3.033 N/A SER 344.A OG LYS 324.A O no hydrogen 2.960 N/A SER 346.A OG GLU 231.A O no hydrogen 3.002 N/A SER 346.A OG GLN 235.A OE1 no hydrogen 3.267 N/A SER 346.A OG TYR 347.A O no hydrogen 3.267 N/A ASN 350.A ND2 TYR 227.A O no hydrogen 3.039 N/A LYS 351.A NZ ASP 360.A OD2 no hydrogen 2.736 N/A MET 352.A N ASP 348.A O no hydrogen 3.196 N/A MET 352.A N PRO 349.A O no hydrogen 3.146 N/A THR 353.A N PRO 349.A O no hydrogen 3.098 N/A THR 353.A OG1 VAL 240.A O no hydrogen 2.989 N/A ASN 354.A N ASN 350.A O no hydrogen 3.326 N/A ASP 360.A N SER 357.A O no hydrogen 2.822 N/A TYR 361.A N SER 357.A O no hydrogen 3.202 N/A LYS 362.A N GLN 358.A O no hydrogen 3.137 N/A ALA 363.A N GLU 359.A O no hydrogen 3.330 N/A TYR 364.A N ASP 360.A O no hydrogen 3.331 N/A GLU 365.A N TYR 361.A O no hydrogen 3.137 N/A GLU 366.A N LYS 362.A O no hydrogen 2.877 N/A GLU 369.A N ASN 367.A OD1 no hydrogen 2.918 N/A GLN 370.A N ASN 367.A O no hydrogen 3.146 N/A ILE 373.A N GLN 370.A O no hydrogen 3.403 N/A ARG 375.A N SER 343.A OG no hydrogen 3.097 N/A ARG 375.A NE GLU 616.A OE1 no hydrogen 2.393 N/A ARG 375.A NH1 GLN 370.A O no hydrogen 3.206 N/A ARG 375.A NH2 GLU 369.A O no hydrogen 2.319 N/A ARG 375.A NH2 GLU 616.A OE1 no hydrogen 3.179 N/A ALA 377.A N SER 374.A O no hydrogen 3.082 N/A THR 378.A N ARG 375.A O no hydrogen 3.302 N/A THR 378.A OG1 SER 374.A O no hydrogen 3.136 N/A TYR 380.A N ILE 507.A O no hydrogen 3.142 N/A TYR 380.A OH GLU 616.A OE1 no hydrogen 3.422 N/A GLY 383.A N GLY 501.A O no hydrogen 2.948 N/A SER 384.A OG SER 442.A OG no hydrogen 3.263 N/A THR 385.A OG1 PRO 382.A O no hydrogen 3.304 N/A THR 385.A OG1 TYR 516.A OH no hydrogen 2.805 N/A PHE 386.A N GLY 383.A O no hydrogen 3.079 N/A LYS 387.A N SER 384.A O no hydrogen 3.187 N/A LYS 387.A NZ SER 442.A OG no hydrogen 2.897 N/A LYS 387.A NZ ASN 444.A OD1 no hydrogen 3.493 N/A MET 388.A N THR 385.A O no hydrogen 3.405 N/A ILE 389.A N PHE 386.A O no hydrogen 3.084 N/A THR 390.A N PHE 386.A O no hydrogen 3.184 N/A THR 390.A OG1 PHE 386.A O no hydrogen 3.454 N/A THR 390.A OG1 GLY 499.A O no hydrogen 2.658 N/A ALA 391.A N LYS 387.A O no hydrogen 2.717 N/A ALA 392.A N MET 388.A O no hydrogen 2.932 N/A ILE 393.A N ILE 389.A O no hydrogen 2.991 N/A GLY 394.A N THR 390.A O no hydrogen 3.002 N/A LEU 395.A N ALA 391.A O no hydrogen 2.902 N/A ASP 396.A N ALA 392.A O no hydrogen 3.220 N/A ASP 396.A N ILE 393.A O no hydrogen 3.165 N/A ASN 397.A N ILE 393.A O no hydrogen 3.266 N/A THR 399.A N ASN 397.A OD1 no hydrogen 3.220 N/A THR 399.A OG1 ASN 397.A OD1 no hydrogen 2.872 N/A ILE 400.A N GLY 394.A O no hydrogen 2.860 N/A ASN 403.A N ASP 401.A OD1 no hydrogen 3.479 N/A GLU 404.A N ASP 401.A O no hydrogen 3.193 N/A LEU 406.A N VAL 433.A O no hydrogen 2.832 N/A ILE 408.A N SER 431.A O no hydrogen 3.159 N/A LYS 415.A NZ ASP 492.A OD2 no hydrogen 3.188 N/A GLY 420.A N SER 417.A O no hydrogen 3.359 N/A TYR 422.A N TRP 419.A O no hydrogen 3.251 N/A TYR 422.A OH ASP 497.A OD1 no hydrogen 2.568 N/A TYR 422.A OH TYR 500.A OH no hydrogen 2.902 N/A VAL 424.A N TRP 413.A O no hydrogen 2.832 N/A THR 425.A OG1 GLN 423.A O no hydrogen 3.344 N/A ARG 426.A N LEU 411.A O no hydrogen 3.119 N/A ARG 426.A NE GLY 410.A O no hydrogen 2.751 N/A ARG 426.A NH1 VAL 430.A O no hydrogen 2.807 N/A ARG 426.A NH1 ASP 443.A OD2 no hydrogen 2.879 N/A ARG 426.A NH2 ILE 408.A O no hydrogen 3.228 N/A ARG 426.A NH2 GLY 410.A O no hydrogen 2.783 N/A ARG 426.A NH2 VAL 430.A O no hydrogen 2.984 N/A VAL 433.A N LEU 406.A O no hydrogen 3.064 N/A THR 437.A N ASP 434.A OD1 no hydrogen 3.326 N/A THR 437.A OG1 ASP 434.A OD1 no hydrogen 2.602 N/A ALA 438.A N ASP 434.A O no hydrogen 2.912 N/A LEU 439.A N LEU 435.A O no hydrogen 3.161 N/A ILE 440.A N LYS 436.A O no hydrogen 3.288 N/A TYR 441.A N THR 437.A O no hydrogen 3.053 N/A SER 442.A OG SER 384.A OG no hydrogen 3.263 N/A ASP 443.A N ALA 438.A O no hydrogen 3.038 N/A ASN 444.A ND2 THR 425.A O no hydrogen 3.216 N/A TYR 446.A N ASP 443.A OD1 no hydrogen 3.033 N/A ALA 448.A N ASN 444.A O no hydrogen 2.802 N/A GLN 449.A N ILE 445.A O no hydrogen 3.001 N/A GLU 450.A N TYR 446.A O no hydrogen 2.955 N/A THR 451.A N MET 447.A O no hydrogen 2.925 N/A THR 451.A OG1 MET 447.A O no hydrogen 2.526 N/A LEU 452.A N ALA 448.A O no hydrogen 3.122 N/A LYS 453.A N GLN 449.A O no hydrogen 2.872 N/A LYS 453.A NZ THR 399.A O no hydrogen 3.121 N/A MET 454.A N GLU 450.A O no hydrogen 3.075 N/A GLY 455.A N THR 451.A O no hydrogen 3.188 N/A GLY 455.A N LEU 452.A O no hydrogen 3.285 N/A PHE 459.A N GLY 455.A O no hydrogen 2.939 N/A ARG 460.A N GLU 456.A O no hydrogen 3.205 N/A ILE 461.A N LYS 457.A O no hydrogen 3.273 N/A LEU 463.A N PHE 459.A O no hydrogen 3.090 N/A ASP 464.A N ARG 460.A O no hydrogen 2.677 N/A LYS 465.A NZ ILE 461.A O no hydrogen 2.837 N/A PHE 466.A N LEU 463.A O no hydrogen 3.090 N/A GLY 469.A N ALA 481.A O no hydrogen 2.735 N/A GLU 470.A N ILE 467.A O no hydrogen 3.266 N/A GLN 482.A N LEU 506.A O no hydrogen 3.247 N/A GLN 482.A NE2 ASN 485.A OD1 no hydrogen 3.335 N/A GLN 482.A NE2 GLU 504.A O no hydrogen 3.226 N/A SER 484.A OG GLU 486.A O no hydrogen 2.476 N/A ASN 485.A N GLU 504.A OE1 no hydrogen 2.793 N/A SER 488.A OG GLU 456.A OE2 no hydrogen 3.413 N/A SER 488.A OG ASN 490.A OD1 no hydrogen 2.940 N/A PHE 489.A N GLU 456.A OE2 no hydrogen 2.871 N/A LEU 495.A N SER 491.A O no hydrogen 2.994 N/A ALA 496.A N ASP 492.A O no hydrogen 3.130 N/A ASP 497.A N ILE 493.A O no hydrogen 3.099 N/A THR 498.A N LEU 494.A O no hydrogen 3.074 N/A THR 498.A OG1 LEU 494.A O no hydrogen 2.656 N/A GLY 499.A N LEU 495.A O no hydrogen 3.133 N/A GLY 499.A N ALA 496.A O no hydrogen 2.881 N/A GLY 501.A N THR 498.A O no hydrogen 3.501 N/A GLN 502.A N ASP 497.A O no hydrogen 2.842 N/A LEU 506.A N GLN 482.A O no hydrogen 3.488 N/A ILE 507.A N TYR 380.A O no hydrogen 2.773 N/A ASN 508.A N GLN 511.A OE1 no hydrogen 3.501 N/A ILE 510.A N PHE 376.A O no hydrogen 3.458 N/A GLN 511.A N ASN 508.A OD1 no hydrogen 2.853 N/A GLN 511.A NE2 ASN 479.A O no hydrogen 3.444 N/A GLN 512.A N ASN 508.A O no hydrogen 2.848 N/A GLN 512.A NE2 ILE 507.A O no hydrogen 3.066 N/A ALA 513.A N PRO 509.A O no hydrogen 3.021 N/A ALA 514.A N ILE 510.A O no hydrogen 3.302 N/A ALA 514.A N GLN 511.A O no hydrogen 3.120 N/A MET 515.A N GLN 511.A O no hydrogen 2.997 N/A TYR 516.A N GLN 512.A O no hydrogen 2.896 N/A TYR 516.A OH THR 385.A OG1 no hydrogen 2.805 N/A SER 517.A N ALA 514.A O no hydrogen 3.275 N/A SER 517.A OG ALA 514.A O no hydrogen 2.426 N/A SER 517.A OG VAL 526.A O no hydrogen 3.449 N/A PHE 519.A N TYR 516.A O no hydrogen 3.421 N/A ALA 520.A N SER 517.A O no hydrogen 3.208 N/A ASN 521.A N VAL 518.A O no hydrogen 3.279 N/A ASN 521.A ND2 PRO 333.A O no hydrogen 2.789 N/A ASN 521.A ND2 SER 517.A O no hydrogen 2.794 N/A GLY 523.A N VAL 518.A O no hydrogen 2.857 N/A LEU 525.A N LYS 539.A O no hydrogen 2.770 N/A VAL 526.A N SER 517.A OG no hydrogen 3.202 N/A TYR 527.A N LYS 537.A O no hydrogen 3.072 N/A TYR 527.A OH GLU 470.A OE1 no hydrogen 2.926 N/A LYS 529.A N GLY 336.A O no hydrogen 2.743 N/A LYS 529.A NZ ASP 337.A OD1 no hydrogen 3.287 N/A LYS 529.A NZ THR 536.A OG1 no hydrogen 2.991 N/A ALA 532.A N LYS 306.A O no hydrogen 3.139 N/A LYS 534.A N ILE 531.A O no hydrogen 3.287 N/A LYS 539.A N LEU 525.A O no hydrogen 2.649 N/A LYS 539.A NZ LYS 465.A O no hydrogen 3.122 N/A LYS 539.A NZ PHE 466.A O no hydrogen 2.829 N/A LYS 539.A NZ GLU 470.A OE2 no hydrogen 3.230 N/A VAL 542.A N GLY 523.A O no hydrogen 3.012 N/A GLY 544.A N ASP 396.A OD1 no hydrogen 3.426 N/A GLY 544.A N ASP 396.A OD2 no hydrogen 3.172 N/A ALA 547.A N GLY 544.A O no hydrogen 3.196 N/A VAL 548.A N GLY 544.A O no hydrogen 3.427 N/A GLN 549.A N GLU 545.A O no hydrogen 3.017 N/A GLN 549.A NE2 ASN 522.A OD1 no hydrogen 3.591 N/A THR 550.A N ALA 547.A O no hydrogen 3.271 N/A THR 550.A OG1 THR 546.A O no hydrogen 2.827 N/A ILE 551.A N ALA 547.A O no hydrogen 2.896 N/A VAL 552.A N VAL 548.A O no hydrogen 3.115 N/A LEU 555.A N ILE 551.A O no hydrogen 2.810 N/A ARG 556.A N VAL 552.A O no hydrogen 3.250 N/A ARG 556.A NH2 ASP 605.A OD1 no hydrogen 2.613 N/A GLU 557.A N ASP 554.A O no hydrogen 2.916 N/A VAL 558.A N ASP 554.A O no hydrogen 3.312 N/A VAL 559.A N ARG 556.A O no hydrogen 3.094 N/A GLN 560.A N ARG 556.A O no hydrogen 2.930 N/A ASP 561.A N GLU 557.A O no hydrogen 2.868 N/A ASN 563.A N ASP 561.A OD1 no hydrogen 2.964 N/A ASN 563.A ND2 TYR 441.A OH no hydrogen 2.892 N/A GLY 564.A N ASP 561.A O no hydrogen 3.091 N/A THR 565.A OG1 THR 580.A OG1 no hydrogen 3.042 N/A ALA 566.A N VAL 558.A O no hydrogen 3.120 N/A HIS 567.A ND1 VAL 559.A O no hydrogen 3.186 N/A LEU 569.A N ALA 566.A O no hydrogen 3.154 N/A SER 570.A N HIS 567.A O no hydrogen 3.028 N/A SER 570.A OG HIS 567.A O no hydrogen 2.496 N/A LEU 572.A N LEU 569.A O no hydrogen 3.121 N/A GLY 573.A N SER 570.A O no hydrogen 3.222 N/A ALA 577.A N PHE 602.A O no hydrogen 3.086 N/A ALA 578.A N LEU 555.A O no hydrogen 3.242 N/A LYS 579.A N PHE 600.A O no hydrogen 2.922 N/A LYS 579.A NZ LEU 439.A O no hydrogen 3.396 N/A LYS 579.A NZ SER 442.A OG no hydrogen 3.137 N/A THR 580.A OG1 THR 565.A OG1 no hydrogen 3.042 N/A ILE 585.A N LYS 594.A O no hydrogen 2.773 N/A ASN 596.A N ALA 583.A O no hydrogen 3.011 N/A SER 597.A N LEU 615.A O no hydrogen 3.109 N/A PHE 598.A N GLY 581.A O no hydrogen 2.648 N/A LEU 599.A N SER 613.A O no hydrogen 2.929 N/A PHE 600.A N LYS 579.A O no hydrogen 3.181 N/A ALA 601.A N MET 611.A O no hydrogen 3.011 N/A PHE 602.A N ALA 577.A O no hydrogen 3.142 N/A ASP 605.A N ASN 603.A OD1 no hydrogen 2.931 N/A GLN 607.A N ASN 603.A O no hydrogen 3.019 N/A GLY 608.A N ASN 606.A OD1 no hydrogen 3.139 N/A MET 610.A N THR 331.A O no hydrogen 2.776 N/A MET 611.A N ALA 601.A O no hydrogen 2.744 N/A VAL 612.A N VAL 329.A O no hydrogen 2.710 N/A SER 613.A N LEU 599.A O no hydrogen 2.965 N/A MET 614.A N SER 327.A O no hydrogen 2.901 N/A LEU 615.A N SER 597.A O no hydrogen 2.784 N/A GLU 616.A N ALA 325.A O no hydrogen 2.750 N/A ASN 617.A N ASN 596.A OD1 no hydrogen 2.793 N/A LYS 618.A N GLU 595.A O no hydrogen 2.992 N/A LYS 618.A NZ GLU 595.A OE2 no hydrogen 3.377 N/A LYS 618.A NZ GLU 619.A O no hydrogen 3.272 N/A LYS 618.A NZ ASP 622.A O no hydrogen 3.452 N/A ASP 622.A N GLU 619.A O no hydrogen 3.289 N/A SER 623.A N ASP 622.A OD1 no hydrogen 2.905 N/A ALA 624.A N SER 597.A OG no hydrogen 3.051 N/A LYS 626.A N SER 623.A OG no hydrogen 3.272 N/A LYS 626.A NZ ASP 621.A O no hydrogen 2.395 N/A ARG 627.A NE ASP 622.A OD1 no hydrogen 3.460 N/A ARG 627.A NH1 SER 320.A O no hydrogen 3.059 N/A ARG 627.A NH2 ASP 622.A OD1 no hydrogen 3.278 N/A ARG 627.A NH2 ASP 622.A OD2 no hydrogen 2.980 N/A LEU 632.A N ALA 628.A O no hydrogen 3.289 N/A GLN 633.A N SER 629.A O no hydrogen 3.355 N/A TYR 634.A N GLU 630.A O no hydrogen 3.370 N/A TYR 634.A OH ASP 310.A OD2 no hydrogen 2.803 N/A LEU 635.A N LEU 631.A O no hydrogen 2.816 N/A ASN 636.A N GLN 633.A O no hydrogen 3.258 N/A GLN 637.A N GLN 633.A O no hydrogen 3.446 N/A ASN 638.A ND2 TYR 634.A O no hydrogen 3.067 N/A TYR 639.A N LEU 635.A O no hydrogen 3.334 N/A TYR 639.A OH ASP 310.A OD2 no hydrogen 2.399 N/A