Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qyt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ GLU 265.A OE1 no hydrogen 3.155 N/A THR 5.A OG1 SER 36.A OG no hydrogen 3.130 N/A VAL 6.A N SER 36.A O no hydrogen 3.043 N/A ARG 7.A N ASP 58.A OD2 no hydrogen 2.943 N/A ARG 7.A NE ASP 58.A OD2 no hydrogen 2.669 N/A ARG 7.A NH1 ASN 55.A O no hydrogen 3.014 N/A ARG 7.A NH2 ASN 55.A OD1 no hydrogen 3.031 N/A ARG 7.A NH2 ASP 58.A OD1 no hydrogen 3.419 N/A TRP 8.A N ALA 38.A O no hydrogen 2.812 N/A CYS 9.A N ALA 59.A O no hydrogen 2.962 N/A ALA 10.A N VAL 40.A O no hydrogen 2.877 N/A VAL 11.A N GLU 15.A OE1 no hydrogen 2.702 N/A ALA 16.A N SER 12.A O no hydrogen 3.234 N/A THR 17.A N GLU 13.A O no hydrogen 3.025 N/A THR 17.A OG1 GLU 13.A O no hydrogen 3.172 N/A LYS 18.A N HIS 14.A O no hydrogen 3.226 N/A LYS 18.A NZ LEU 284.A O no hydrogen 2.905 N/A LYS 18.A NZ SER 286.A O no hydrogen 3.128 N/A LYS 18.A NZ LEU 293.A O no hydrogen 2.931 N/A CYS 19.A N GLU 15.A O no hydrogen 2.932 N/A CYS 19.A SG TRP 8.A O no hydrogen 4.032 N/A GLN 20.A N ALA 16.A O no hydrogen 3.353 N/A SER 21.A N THR 17.A O no hydrogen 3.143 N/A PHE 22.A N LYS 18.A O no hydrogen 2.642 N/A ARG 23.A N CYS 19.A O no hydrogen 2.988 N/A ARG 23.A NH1 ASP 24.A OD2 no hydrogen 3.547 N/A ASP 24.A N GLN 20.A O no hydrogen 2.814 N/A HIS 25.A N SER 21.A O no hydrogen 3.135 N/A HIS 25.A ND1 SER 21.A O no hydrogen 2.770 N/A MET 26.A N PHE 22.A O no hydrogen 3.042 N/A LYS 27.A N ARG 23.A O no hydrogen 3.054 N/A SER 28.A N HIS 25.A O no hydrogen 3.164 N/A SER 28.A OG ASP 24.A O no hydrogen 3.009 N/A SER 28.A OG HIS 25.A O no hydrogen 3.312 N/A VAL 29.A N MET 26.A O no hydrogen 3.243 N/A ILE 30.A N MET 26.A O no hydrogen 2.833 N/A GLY 34.A N PRO 31.A O no hydrogen 3.182 N/A ALA 38.A N VAL 6.A O no hydrogen 2.920 N/A VAL 40.A N TRP 8.A O no hydrogen 3.128 N/A LYS 42.A N ALA 10.A O no hydrogen 3.450 N/A CYS 48.A N SER 44.A O no hydrogen 3.199 N/A ILE 49.A N TYR 45.A O no hydrogen 3.191 N/A ARG 50.A N LEU 46.A O no hydrogen 3.431 N/A ALA 51.A N ASP 47.A O no hydrogen 2.762 N/A ILE 52.A N CYS 48.A O no hydrogen 2.948 N/A ALA 53.A N ILE 49.A O no hydrogen 3.088 N/A ALA 54.A N ARG 50.A O no hydrogen 3.116 N/A ASN 55.A N ILE 52.A O no hydrogen 3.311 N/A GLU 56.A N ALA 51.A O no hydrogen 3.123 N/A ASP 58.A N ARG 7.A O no hydrogen 2.614 N/A ALA 59.A N ARG 7.A O no hydrogen 3.368 N/A THR 61.A OG1 LEU 294.A O no hydrogen 2.267 N/A LEU 62.A N THR 250.A O no hydrogen 2.682 N/A VAL 67.A N ASP 63.A O no hydrogen 3.128 N/A TYR 68.A N ALA 64.A O no hydrogen 3.215 N/A ASP 69.A N GLY 65.A O no hydrogen 3.319 N/A ALA 70.A N LEU 66.A O no hydrogen 2.824 N/A TYR 71.A N VAL 67.A O no hydrogen 3.032 N/A TYR 71.A N TYR 68.A O no hydrogen 2.848 N/A LEU 72.A N TYR 68.A O no hydrogen 3.269 N/A ASN 75.A N LEU 72.A O no hydrogen 2.787 N/A ASN 75.A ND2 ASP 69.A O no hydrogen 2.920 N/A ASN 75.A ND2 LEU 72.A O no hydrogen 3.295 N/A ASN 76.A N LEU 72.A O no hydrogen 2.955 N/A LEU 77.A N ALA 70.A O no hydrogen 3.015 N/A LYS 78.A N ALA 253.A O no hydrogen 2.823 N/A LYS 78.A NZ SER 255.A O no hydrogen 3.092 N/A LYS 78.A NZ GLU 260.A OE1 no hydrogen 3.557 N/A VAL 80.A N VAL 251.A O no hydrogen 2.813 N/A VAL 81.A N VAL 251.A O no hydrogen 3.200 N/A ALA 82.A N LEU 303.A O no hydrogen 2.888 N/A GLU 83.A N HIS 249.A O no hydrogen 3.067 N/A PHE 84.A N GLY 301.A O no hydrogen 3.083 N/A ASP 90.A N SER 87.A OG no hydrogen 2.960 N/A GLN 92.A NE2 ASP 90.A O no hydrogen 3.032 N/A TYR 95.A N VAL 246.A O no hydrogen 2.832 N/A ALA 97.A N ALA 244.A O no hydrogen 2.623 N/A VAL 98.A N VAL 205.A O no hydrogen 2.760 N/A VAL 100.A N ALA 203.A O no hydrogen 2.788 N/A VAL 101.A N GLU 224.A O no hydrogen 3.017 N/A LYS 103.A N GLN 222.A O no hydrogen 3.121 N/A ASP 104.A N GLU 224.A OE1 no hydrogen 3.320 N/A SER 105.A OG LYS 102.A O no hydrogen 2.859 N/A GLN 108.A N GLN 111.A OE1 no hydrogen 3.240 N/A ASN 110.A N ASN 230.A OD1 no hydrogen 2.962 N/A GLN 111.A N GLN 108.A O no hydrogen 2.799 N/A LEU 112.A N MET 109.A O no hydrogen 3.141 N/A GLY 114.A N PHE 153.A O no hydrogen 2.983 N/A LYS 115.A N LEU 112.A O no hydrogen 3.117 N/A LYS 115.A NZ GLN 111.A O no hydrogen 2.644 N/A LYS 115.A NZ ARG 113.A O no hydrogen 3.337 N/A LYS 116.A N ASP 201.A OD2 no hydrogen 2.819 N/A LYS 116.A NZ ALA 199.A O no hydrogen 3.281 N/A SER 117.A N GLY 156.A O no hydrogen 3.166 N/A SER 117.A OG HIS 119.A NE2 no hydrogen 2.759 N/A SER 117.A OG SER 157.A OG no hydrogen 2.692 N/A CYS 118.A N VAL 202.A O no hydrogen 2.838 N/A CYS 118.A SG VAL 202.A O no hydrogen 3.816 N/A HIS 119.A N CYS 158.A O no hydrogen 3.278 N/A HIS 119.A ND1 GLY 127.A O no hydrogen 2.703 N/A HIS 119.A NE2 SER 117.A OG no hydrogen 2.759 N/A LEU 122.A N PRO 160.A O no hydrogen 2.981 N/A ARG 124.A N GLY 121.A O no hydrogen 3.339 N/A TRP 128.A N SER 125.A O no hydrogen 3.412 N/A ASN 129.A N ARG 124.A O no hydrogen 2.818 N/A ILE 130.A N SER 125.A O no hydrogen 2.857 N/A ILE 132.A N TRP 128.A O no hydrogen 2.924 N/A GLY 133.A N ASN 129.A O no hydrogen 3.149 N/A LEU 134.A N ILE 130.A O no hydrogen 2.905 N/A LEU 135.A N PRO 131.A O no hydrogen 2.763 N/A TYR 136.A N GLY 133.A O no hydrogen 3.348 N/A CYS 137.A SG THR 330.A O no hydrogen 3.800 N/A ASP 138.A N LEU 135.A O no hydrogen 3.058 N/A LEU 139.A N TYR 136.A O no hydrogen 3.112 N/A ARG 143.A NE LEU 139.A O no hydrogen 3.156 N/A GLU 147.A N GLU 147.A OE1 no hydrogen 3.038 N/A LYS 148.A N PRO 145.A O no hydrogen 2.984 N/A ALA 149.A N PRO 145.A O no hydrogen 3.511 N/A VAL 150.A N LEU 146.A O no hydrogen 2.956 N/A ALA 151.A N GLU 147.A O no hydrogen 2.909 N/A ASN 152.A N LYS 148.A O no hydrogen 2.670 N/A PHE 153.A N VAL 150.A O no hydrogen 2.965 N/A PHE 154.A N VAL 150.A O no hydrogen 3.116 N/A SER 155.A N LYS 115.A O no hydrogen 3.119 N/A SER 155.A OG GLY 114.A O no hydrogen 2.880 N/A SER 157.A N GLN 169.A O no hydrogen 3.215 N/A SER 157.A OG SER 117.A OG no hydrogen 2.692 N/A CYS 158.A N SER 117.A O no hydrogen 3.011 N/A ALA 159.A N LEU 170.A O no hydrogen 2.887 N/A THR 165.A OG1 ASP 163.A OD1 no hydrogen 2.559 N/A THR 165.A OG1 ASP 166.A OD1 no hydrogen 3.192 N/A ASP 166.A N ASP 163.A OD1 no hydrogen 2.978 N/A PHE 167.A N ASP 163.A O no hydrogen 3.334 N/A CYS 171.A N PRO 168.A O no hydrogen 3.085 N/A LEU 173.A N SER 157.A O no hydrogen 3.326 N/A CYS 174.A SG ASN 183.A OD1 no hydrogen 3.543 N/A CYS 177.A SG ALA 159.A O no hydrogen 3.338 N/A CYS 177.A SG LEU 170.A O no hydrogen 3.076 N/A CYS 177.A SG CYS 174.A O no hydrogen 3.651 N/A TYR 185.A N ASN 183.A OD1 no hydrogen 3.472 N/A TYR 185.A OH ASP 197.A OD2 no hydrogen 3.111 N/A PHE 186.A N ASN 183.A O no hydrogen 3.333 N/A GLY 187.A N THR 120.A O no hydrogen 3.158 N/A GLY 190.A N PHE 186.A O no hydrogen 3.049 N/A ALA 191.A N GLY 187.A O no hydrogen 2.798 N/A PHE 192.A N TYR 188.A O no hydrogen 3.281 N/A LYS 193.A N SER 189.A O no hydrogen 3.104 N/A LYS 193.A NZ GLN 184.A OE1 no hydrogen 2.940 N/A CYS 194.A N GLY 190.A O no hydrogen 2.930 N/A LYS 196.A N PHE 192.A O no hydrogen 2.764 N/A ASP 197.A N LYS 193.A O no hydrogen 2.550 N/A GLY 198.A N CYS 194.A O no hydrogen 3.260 N/A GLY 198.A N LEU 195.A O no hydrogen 3.224 N/A GLY 200.A N CYS 194.A O no hydrogen 3.279 N/A ASP 201.A N LYS 116.A O no hydrogen 2.736 N/A VAL 202.A N LYS 116.A O no hydrogen 3.452 N/A ALA 203.A N VAL 100.A O no hydrogen 3.095 N/A PHE 204.A N CYS 118.A O no hydrogen 2.919 N/A VAL 205.A N VAL 98.A O no hydrogen 2.986 N/A LYS 206.A N THR 209.A OG1 no hydrogen 2.935 N/A HIS 207.A N TYR 96.A O no hydrogen 2.944 N/A SER 208.A OG GLU 212.A OE2 no hydrogen 2.982 N/A THR 209.A N LYS 206.A O no hydrogen 3.167 N/A THR 209.A OG1 LYS 206.A O no hydrogen 3.017 N/A GLU 212.A N SER 208.A O no hydrogen 3.108 N/A ASN 213.A N ILE 210.A O no hydrogen 2.867 N/A ASN 213.A ND2 THR 209.A O no hydrogen 2.975 N/A LEU 214.A N ILE 210.A O no hydrogen 2.686 N/A LYS 217.A NZ ASP 221.A OD1 no hydrogen 3.207 N/A LYS 217.A NZ ASP 221.A OD2 no hydrogen 3.116 N/A ASP 219.A N ASN 216.A O no hydrogen 3.329 N/A ARG 220.A NE LEU 214.A O no hydrogen 3.216 N/A ARG 220.A NH2 ALA 215.A O no hydrogen 3.029 N/A ASP 221.A N LYS 217.A O no hydrogen 2.906 N/A GLN 222.A N ASP 219.A O no hydrogen 3.151 N/A TYR 223.A N ARG 220.A O no hydrogen 2.928 N/A GLU 224.A N VAL 101.A O no hydrogen 2.811 N/A LEU 225.A N LYS 233.A O no hydrogen 2.522 N/A LEU 226.A N ALA 99.A O no hydrogen 2.986 N/A CYS 227.A N THR 231.A O no hydrogen 2.770 N/A ASP 229.A N ASP 229.A OD1 no hydrogen 2.596 N/A ASN 230.A N CYS 227.A O no hydrogen 3.093 N/A THR 231.A OG1 ASP 229.A OD1 no hydrogen 2.693 N/A THR 231.A OG1 ASP 229.A OD2 no hydrogen 2.754 N/A ARG 232.A NE PHE 107.A O no hydrogen 3.035 N/A ARG 232.A NH1 LYS 102.A O no hydrogen 2.811 N/A ARG 232.A NH1 SER 105.A OG no hydrogen 3.294 N/A ARG 232.A NH1 GLU 224.A OE1 no hydrogen 2.884 N/A ARG 232.A NH2 SER 105.A OG no hydrogen 2.610 N/A ARG 232.A NH2 PHE 107.A O no hydrogen 3.179 N/A LYS 233.A N LEU 225.A O no hydrogen 2.875 N/A GLU 237.A N PRO 234.A O no hydrogen 2.913 N/A ASP 240.A N GLU 237.A O no hydrogen 3.009 N/A CYS 241.A N TYR 238.A O no hydrogen 3.122 N/A CYS 241.A SG LEU 225.A O no hydrogen 3.557 N/A HIS 242.A ND1 TYR 238.A O no hydrogen 2.813 N/A LEU 243.A N ALA 97.A O no hydrogen 2.768 N/A SER 248.A N THR 93.A O no hydrogen 3.148 N/A HIS 249.A ND1 GLU 83.A OE2 no hydrogen 2.507 N/A THR 250.A N LEU 62.A O no hydrogen 2.836 N/A THR 250.A OG1 TYR 314.A OH no hydrogen 2.815 N/A VAL 251.A N VAL 81.A O no hydrogen 2.801 N/A VAL 252.A N VAL 60.A O no hydrogen 3.166 N/A ALA 253.A N LYS 78.A O no hydrogen 2.722 N/A ARG 254.A N GLY 258.A O no hydrogen 3.103 N/A ARG 254.A NE ILE 52.A O no hydrogen 2.929 N/A ARG 254.A NH2 ALA 57.A O no hydrogen 2.715 N/A ARG 254.A NH2 ASP 58.A OD1 no hydrogen 2.670 N/A LYS 259.A NZ ASP 3.A OD1 no hydrogen 3.154 N/A LYS 259.A NZ ASP 3.A OD2 no hydrogen 3.460 N/A LEU 262.A N LYS 259.A O no hydrogen 2.809 N/A TRP 264.A N GLU 260.A O no hydrogen 3.288 N/A GLU 265.A N ASP 261.A O no hydrogen 2.901 N/A LEU 266.A N LEU 262.A O no hydrogen 2.938 N/A LEU 267.A N ILE 263.A O no hydrogen 3.086 N/A ASN 268.A N TRP 264.A O no hydrogen 2.706 N/A GLN 269.A N GLU 265.A O no hydrogen 2.898 N/A ALA 270.A N LEU 266.A O no hydrogen 2.779 N/A GLN 271.A N LEU 267.A O no hydrogen 2.910 N/A GLU 272.A N ASN 268.A O no hydrogen 3.163 N/A HIS 273.A N ALA 270.A O no hydrogen 3.100 N/A HIS 273.A ND1 GLN 269.A O no hydrogen 2.895 N/A PHE 274.A N ALA 270.A O no hydrogen 2.750 N/A SER 279.A OG PHE 282.A O no hydrogen 3.337 N/A GLU 281.A N SER 279.A OG no hydrogen 3.084 N/A PHE 282.A N SER 279.A OG no hydrogen 3.232 N/A GLN 283.A NE2 SER 279.A O no hydrogen 2.888 N/A LEU 284.A N PHE 274.A O no hydrogen 3.043 N/A SER 286.A N GLN 283.A O no hydrogen 3.468 N/A SER 287.A OG GLY 290.A O no hydrogen 3.273 N/A LYS 291.A NZ SER 287.A O no hydrogen 3.199 N/A ASP 292.A N ASP 297.A OD2 no hydrogen 3.056 N/A LEU 294.A N GLU 15.A OE2 no hydrogen 2.864 N/A LYS 296.A N GLU 83.A OE1 no hydrogen 3.373 N/A LYS 296.A N GLU 83.A OE2 no hydrogen 3.350 N/A LYS 296.A NZ ASP 63.A OD1 no hydrogen 2.972 N/A ASP 297.A N ASP 292.A OD1 no hydrogen 3.060 N/A ALA 299.A N LYS 296.A O no hydrogen 3.289 N/A HIS 300.A N PHE 84.A O no hydrogen 2.737 N/A HIS 300.A ND1 SER 298.A O no hydrogen 2.683 N/A LEU 303.A N ALA 82.A O no hydrogen 2.881 N/A LYS 304.A NZ VAL 305.A O no hydrogen 3.560 N/A VAL 305.A N VAL 80.A O no hydrogen 3.037 N/A ARG 308.A NH1 ARG 308.A O no hydrogen 3.491 N/A MET 309.A N PRO 306.A O no hydrogen 2.826 N/A ASP 310.A N ARG 308.A O no hydrogen 3.125 N/A LYS 312.A NZ GLU 385.A OE1 no hydrogen 2.731 N/A TYR 314.A N ASP 310.A O no hydrogen 2.939 N/A TYR 314.A OH THR 250.A OG1 no hydrogen 2.815 N/A LEU 315.A N ALA 311.A O no hydrogen 2.787 N/A GLY 316.A N LYS 312.A O no hydrogen 2.750 N/A VAL 320.A N GLY 316.A O no hydrogen 2.993 N/A THR 321.A N TYR 317.A O no hydrogen 2.767 N/A THR 321.A OG1 TYR 317.A O no hydrogen 3.104 N/A ALA 322.A N GLU 318.A O no hydrogen 3.062 N/A ILE 323.A N TYR 319.A O no hydrogen 2.855 N/A ARG 324.A N VAL 320.A O no hydrogen 2.812 N/A ARG 324.A NE GLU 328.A OE1 no hydrogen 2.669 N/A ASN 325.A N THR 321.A O no hydrogen 3.248 N/A ASN 325.A ND2 GLY 133.A O no hydrogen 3.583 N/A LEU 326.A N ALA 322.A O no hydrogen 3.393 N/A ARG 327.A N ARG 324.A O no hydrogen 2.725 N/A GLU 328.A N ARG 324.A O no hydrogen 3.127 N/A CYS 331.A SG GLY 329.A O no hydrogen 3.454 N/A CYS 339.A SG GLU 338.A O no hydrogen 3.155 N/A VAL 342.A N LYS 365.A O no hydrogen 3.143 N/A LYS 343.A N ASP 387.A OD2 no hydrogen 2.894 N/A LYS 343.A NZ GLY 384.A O no hydrogen 3.489 N/A TRP 344.A N GLU 367.A O no hydrogen 2.829 N/A CYS 345.A N ALA 388.A O no hydrogen 2.943 N/A CYS 345.A SG VAL 369.A O no hydrogen 3.674 N/A ALA 346.A N VAL 369.A O no hydrogen 2.780 N/A LEU 347.A N GLU 351.A OE1 no hydrogen 2.910 N/A SER 348.A N ALA 371.A O no hydrogen 2.747 N/A ARG 352.A N SER 348.A O no hydrogen 2.924 N/A ARG 352.A NE SER 370.A OG no hydrogen 3.084 N/A ARG 352.A NH1 ASP 356.A OD1 no hydrogen 2.811 N/A LEU 353.A N HIS 349.A O no hydrogen 2.922 N/A LYS 354.A NZ LEU 621.A O no hydrogen 2.639 N/A LYS 354.A NZ ARG 623.A O no hydrogen 3.569 N/A LYS 354.A NZ LEU 629.A O no hydrogen 2.797 N/A CYS 355.A N GLU 351.A O no hydrogen 2.719 N/A ASP 356.A N ARG 352.A O no hydrogen 2.545 N/A GLU 357.A N LEU 353.A O no hydrogen 3.224 N/A GLU 357.A N LYS 354.A O no hydrogen 3.068 N/A TRP 358.A N LYS 354.A O no hydrogen 2.909 N/A SER 359.A N CYS 355.A O no hydrogen 2.785 N/A SER 359.A OG ILE 366.A O no hydrogen 2.722 N/A VAL 360.A N ASP 356.A O no hydrogen 3.222 N/A ASN 361.A N GLU 357.A O no hydrogen 3.233 N/A SER 362.A N TRP 358.A O no hydrogen 3.228 N/A SER 362.A N SER 359.A O no hydrogen 3.019 N/A SER 362.A OG SER 359.A O no hydrogen 2.665 N/A LYS 365.A N SER 362.A O no hydrogen 3.331 N/A ILE 366.A N SER 362.A OG no hydrogen 3.143 N/A GLU 367.A N VAL 342.A O no hydrogen 2.755 N/A VAL 369.A N TRP 344.A O no hydrogen 3.045 N/A ALA 371.A N ALA 346.A O no hydrogen 3.000 N/A ASP 376.A N THR 373.A OG1 no hydrogen 3.220 N/A CYS 377.A N THR 373.A O no hydrogen 3.252 N/A CYS 377.A SG ALA 346.A O no hydrogen 3.643 N/A ILE 378.A N THR 374.A O no hydrogen 2.622 N/A ALA 379.A N GLU 375.A O no hydrogen 2.876 N/A LYS 380.A N ASP 376.A O no hydrogen 2.974 N/A ILE 381.A N CYS 377.A O no hydrogen 2.840 N/A MET 382.A N ILE 378.A O no hydrogen 2.972 N/A ASN 383.A N ALA 379.A O no hydrogen 2.998 N/A GLU 385.A N ASN 383.A OD1 no hydrogen 2.803 N/A ALA 386.A N LYS 380.A O no hydrogen 2.906 N/A ASP 387.A N LYS 343.A O no hydrogen 2.890 N/A ALA 388.A N LYS 343.A O no hydrogen 3.056 N/A SER 390.A OG GLU 410.A OE2 no hydrogen 2.496 N/A SER 390.A OG ALA 586.A O no hydrogen 3.540 N/A LEU 391.A N ALA 586.A O no hydrogen 2.692 N/A GLY 394.A N ASP 392.A OD2 no hydrogen 2.773 N/A GLY 394.A N THR 457.A OG1 no hydrogen 3.315 N/A PHE 395.A N ASP 392.A O no hydrogen 2.995 N/A VAL 396.A N ASP 392.A O no hydrogen 2.811 N/A TYR 397.A N GLY 393.A O no hydrogen 2.907 N/A ALA 399.A N PHE 395.A O no hydrogen 2.849 N/A GLY 400.A N VAL 396.A O no hydrogen 2.724 N/A LYS 401.A N TYR 397.A O no hydrogen 2.919 N/A CYS 402.A N ILE 398.A O no hydrogen 2.846 N/A CYS 402.A SG ILE 398.A O no hydrogen 3.354 N/A GLY 403.A N GLY 400.A O no hydrogen 3.179 N/A LEU 404.A N ALA 399.A O no hydrogen 2.929 N/A VAL 405.A N THR 589.A O no hydrogen 2.622 N/A VAL 407.A N VAL 587.A O no hydrogen 2.788 N/A ALA 409.A N ALA 639.A O no hydrogen 3.027 N/A GLU 410.A N HIS 585.A O no hydrogen 2.902 N/A ASN 411.A N CYS 637.A O no hydrogen 2.891 N/A ASN 411.A ND2 CYS 418.A O no hydrogen 3.002 N/A ASN 411.A ND2 THR 421.A O no hydrogen 2.946 N/A TYR 412.A N GLU 423.A OE2 no hydrogen 2.982 N/A TYR 412.A OH GLU 410.A OE1 no hydrogen 2.442 N/A ASN 413.A N GLU 423.A OE1 no hydrogen 2.670 N/A SER 415.A OG LYS 414.A O no hydrogen 2.604 N/A THR 421.A OG1 ASN 417.A O no hydrogen 2.341 N/A TYR 426.A N ALA 582.A O no hydrogen 2.727 N/A TYR 426.A OH TYR 517.A OH no hydrogen 3.089 N/A PHE 427.A N HIS 535.A ND1 no hydrogen 3.223 N/A ALA 428.A N ALA 580.A O no hydrogen 3.154 N/A VAL 429.A N VAL 533.A O no hydrogen 2.857 N/A VAL 431.A N ALA 531.A O no hydrogen 2.825 N/A VAL 432.A N GLU 560.A O no hydrogen 2.984 N/A LYS 433.A NZ GLY 528.A O no hydrogen 3.010 N/A LYS 434.A N ASP 558.A O no hydrogen 2.993 N/A ALA 436.A N LYS 433.A O no hydrogen 3.194 N/A SER 437.A N SER 435.A O no hydrogen 3.032 N/A ASN 443.A N THR 440.A O no hydrogen 2.759 N/A GLY 446.A N PHE 479.A O no hydrogen 2.614 N/A LYS 447.A N LEU 444.A O no hydrogen 2.927 N/A LYS 448.A N ASP 529.A OD2 no hydrogen 2.856 N/A SER 449.A N GLU 482.A O no hydrogen 3.177 N/A SER 449.A OG HIS 451.A NE2 no hydrogen 2.862 N/A CYS 450.A N VAL 530.A O no hydrogen 2.912 N/A HIS 451.A N CYS 484.A O no hydrogen 2.791 N/A HIS 451.A ND1 GLY 459.A O no hydrogen 2.621 N/A HIS 451.A NE2 SER 449.A OG no hydrogen 2.862 N/A VAL 454.A N PRO 486.A O no hydrogen 2.996 N/A ARG 456.A N ALA 453.A O no hydrogen 3.401 N/A THR 457.A N ASP 392.A OD2 no hydrogen 2.764 N/A THR 457.A OG1 ASP 392.A OD1 no hydrogen 3.467 N/A THR 457.A OG1 ASP 392.A OD2 no hydrogen 2.884 N/A THR 457.A OG1 TYR 655.A OH no hydrogen 2.731 N/A TRP 460.A N ARG 456.A O no hydrogen 2.849 N/A ASN 461.A N ARG 456.A O no hydrogen 2.779 N/A ASN 461.A ND2 GLY 455.A O no hydrogen 2.947 N/A ASN 461.A ND2 TYR 655.A OH no hydrogen 3.117 N/A ILE 462.A N THR 457.A O no hydrogen 2.798 N/A MET 464.A N TRP 460.A O no hydrogen 2.713 N/A GLY 465.A N ASN 461.A O no hydrogen 2.900 N/A LEU 466.A N ILE 462.A O no hydrogen 3.226 N/A LEU 467.A N PRO 463.A O no hydrogen 3.055 N/A TYR 468.A N MET 464.A O no hydrogen 2.751 N/A ASN 469.A N GLY 465.A O no hydrogen 3.074 N/A LYS 470.A N LEU 467.A O no hydrogen 2.965 N/A ILE 471.A N LEU 467.A O no hydrogen 2.826 N/A ASN 472.A N TYR 468.A O no hydrogen 3.079 N/A ARG 475.A NE GLU 478.A OE1 no hydrogen 3.043 N/A ARG 475.A NH1 GLU 478.A OE1 no hydrogen 3.256 N/A PHE 476.A N CYS 474.A O no hydrogen 2.625 N/A GLU 478.A N ARG 475.A O no hydrogen 2.759 N/A PHE 480.A N PHE 476.A O no hydrogen 3.100 N/A SER 481.A N LYS 447.A O no hydrogen 2.965 N/A SER 481.A OG GLY 446.A O no hydrogen 3.220 N/A SER 481.A OG LYS 447.A O no hydrogen 3.054 N/A GLY 483.A N SER 493.A O no hydrogen 3.103 N/A CYS 484.A N SER 449.A O no hydrogen 2.724 N/A ALA 485.A N LEU 494.A O no hydrogen 2.783 N/A GLY 487.A N CYS 506.A O no hydrogen 2.947 N/A SER 488.A N ALA 485.A O no hydrogen 2.947 N/A SER 488.A OG ALA 485.A O no hydrogen 2.931 N/A LYS 490.A NZ LEU 503.A O no hydrogen 3.034 N/A LYS 490.A NZ LEU 505.A O no hydrogen 2.222 N/A LYS 490.A NZ GLU 507.A OE1 no hydrogen 2.581 N/A SER 492.A N LYS 489.A O no hydrogen 2.851 N/A SER 492.A OG LYS 489.A O no hydrogen 2.659 N/A SER 493.A OG ASP 477.A O no hydrogen 2.633 N/A CYS 495.A N SER 492.A O no hydrogen 3.270 N/A CYS 495.A SG SER 488.A O no hydrogen 3.407 N/A CYS 495.A SG LYS 489.A O no hydrogen 3.534 N/A LYS 496.A N SER 493.A O no hydrogen 2.764 N/A LEU 497.A N GLY 483.A O no hydrogen 2.941 N/A CYS 498.A N CYS 495.A O no hydrogen 3.331 N/A CYS 498.A SG LEU 494.A O no hydrogen 4.032 N/A MET 499.A N GLU 512.A OE2 no hydrogen 2.961 N/A GLY 500.A N GLU 512.A OE1 no hydrogen 2.983 N/A ASN 504.A ND2 SER 501.A O no hydrogen 3.271 N/A CYS 506.A N GLU 512.A OE1 no hydrogen 2.635 N/A CYS 506.A SG ALA 485.A O no hydrogen 3.885 N/A CYS 506.A SG LEU 494.A O no hydrogen 3.994 N/A GLU 507.A N ASN 504.A O no hydrogen 2.811 N/A ASN 509.A N GLU 507.A O no hydrogen 2.907 N/A ASN 509.A ND2 GLU 372.A O no hydrogen 2.825 N/A LYS 511.A N ASN 509.A OD1 no hydrogen 2.965 N/A LYS 511.A NZ GLU 372.A OE2 no hydrogen 2.927 N/A GLU 512.A N ASN 509.A O no hydrogen 2.918 N/A TYR 514.A N GLU 512.A OE2 no hydrogen 3.052 N/A TYR 514.A OH GLU 526.A OE1 no hydrogen 2.425 N/A TYR 515.A N GLU 512.A O no hydrogen 3.206 N/A GLY 516.A N THR 452.A O no hydrogen 3.096 N/A TYR 517.A OH HIS 585.A NE2 no hydrogen 2.763 N/A THR 518.A OG1 ASN 541.A OD1 no hydrogen 3.405 N/A THR 518.A OG1 THR 626.A O no hydrogen 2.772 N/A ALA 520.A N GLY 516.A O no hydrogen 2.741 N/A PHE 521.A N TYR 517.A O no hydrogen 3.049 N/A ARG 522.A N THR 518.A O no hydrogen 2.732 N/A ARG 522.A NE GLU 526.A OE1 no hydrogen 2.901 N/A ARG 522.A NE GLU 526.A OE2 no hydrogen 3.022 N/A ARG 522.A NH2 GLU 526.A OE2 no hydrogen 3.241 N/A CYS 523.A N GLY 519.A O no hydrogen 2.782 N/A LEU 524.A N ALA 520.A O no hydrogen 3.119 N/A VAL 525.A N PHE 521.A O no hydrogen 3.000 N/A GLU 526.A N ARG 522.A O no hydrogen 2.963 N/A LYS 527.A N CYS 523.A O no hydrogen 2.811 N/A LYS 527.A NZ LEU 497.A O no hydrogen 3.108 N/A LYS 527.A NZ CYS 498.A O no hydrogen 3.457 N/A GLY 528.A N CYS 523.A O no hydrogen 2.854 N/A ASP 529.A N LYS 448.A O no hydrogen 2.895 N/A ALA 531.A N VAL 431.A O no hydrogen 2.850 N/A PHE 532.A N CYS 450.A O no hydrogen 2.837 N/A VAL 533.A N VAL 429.A O no hydrogen 3.192 N/A LYS 534.A NZ ASP 634.A OD1 no hydrogen 3.428 N/A LYS 534.A NZ ASP 634.A OD2 no hydrogen 2.804 N/A THR 537.A N LYS 534.A O no hydrogen 3.512 N/A THR 537.A OG1 LYS 534.A O no hydrogen 3.491 N/A GLN 540.A N GLN 536.A O no hydrogen 3.072 N/A ASN 541.A N VAL 538.A O no hydrogen 2.676 N/A ASN 541.A ND2 THR 518.A OG1 no hydrogen 3.271 N/A ASN 541.A ND2 THR 537.A O no hydrogen 2.956 N/A THR 542.A N PRO 539.A O no hydrogen 3.389 N/A THR 542.A OG1 VAL 538.A O no hydrogen 2.717 N/A THR 542.A OG1 PRO 539.A O no hydrogen 3.519 N/A GLY 543.A N LEU 554.A O no hydrogen 3.016 N/A LYS 545.A N THR 542.A O no hydrogen 3.203 N/A LYS 545.A NZ PRO 539.A O no hydrogen 2.968 N/A LYS 545.A NZ THR 542.A O no hydrogen 3.212 N/A ASN 546.A ND2 ASN 541.A OD1 no hydrogen 2.774 N/A ASP 548.A N ASN 546.A OD1 no hydrogen 3.087 N/A ALA 551.A N ASP 548.A O no hydrogen 2.802 N/A LYS 552.A N PRO 549.A O no hydrogen 3.356 N/A LEU 554.A N ALA 551.A O no hydrogen 3.359 N/A ASN 555.A N ASP 558.A OD2 no hydrogen 3.203 N/A ASP 558.A N ASN 555.A O no hydrogen 2.862 N/A TYR 559.A N GLU 556.A O no hydrogen 2.985 N/A GLU 560.A N VAL 432.A O no hydrogen 3.091 N/A LEU 561.A N LYS 569.A O no hydrogen 2.747 N/A LEU 562.A N ALA 430.A O no hydrogen 2.969 N/A CYS 563.A N THR 567.A O no hydrogen 3.030 N/A CYS 563.A SG THR 567.A O no hydrogen 3.522 N/A GLY 566.A N CYS 563.A O no hydrogen 3.239 N/A THR 567.A N ASP 565.A OD1 no hydrogen 2.856 N/A THR 567.A OG1 ASP 565.A OD1 no hydrogen 2.689 N/A THR 567.A OG1 ASP 565.A OD2 no hydrogen 3.330 N/A ARG 568.A NE GLU 560.A OE1 no hydrogen 2.815 N/A ARG 568.A NH1 ALA 436.A O no hydrogen 2.763 N/A ARG 568.A NH1 LEU 439.A O no hydrogen 3.071 N/A ARG 568.A NH2 LYS 433.A O no hydrogen 2.914 N/A ARG 568.A NH2 ALA 436.A O no hydrogen 3.280 N/A ARG 568.A NH2 GLU 560.A OE1 no hydrogen 2.795 N/A LYS 569.A N LEU 561.A O no hydrogen 3.109 N/A GLU 573.A N PRO 570.A O no hydrogen 3.190 N/A ASN 576.A N GLU 573.A O no hydrogen 3.169 N/A ASN 576.A ND2 GLU 573.A OE1 no hydrogen 2.991 N/A CYS 577.A N TYR 574.A O no hydrogen 2.883 N/A CYS 577.A SG LEU 561.A O no hydrogen 3.617 N/A HIS 578.A ND1 TYR 574.A O no hydrogen 3.018 N/A LEU 579.A N ALA 428.A O no hydrogen 2.850 N/A ARG 581.A NE GLY 425.A O no hydrogen 3.144 N/A ARG 581.A NH1 GLY 425.A O no hydrogen 3.327 N/A ALA 582.A N TYR 426.A O no hydrogen 2.508 N/A ASN 584.A ND2 GLU 410.A O no hydrogen 2.679 N/A ASN 584.A ND2 ASN 411.A OD1 no hydrogen 2.998 N/A ASN 584.A ND2 GLU 423.A OE2 no hydrogen 2.610 N/A ALA 586.A N LEU 391.A O no hydrogen 2.943 N/A VAL 587.A N LEU 408.A O no hydrogen 2.759 N/A VAL 588.A N MET 389.A O no hydrogen 3.102 N/A THR 589.A N VAL 405.A O no hydrogen 2.871 N/A THR 589.A OG1 ASP 387.A O no hydrogen 2.930 N/A THR 589.A OG1 ARG 590.A O no hydrogen 3.450 N/A ARG 590.A NE ILE 381.A O no hydrogen 3.111 N/A ARG 590.A NH1 ASP 592.A OD1 no hydrogen 3.001 N/A ARG 590.A NH2 ALA 386.A O no hydrogen 3.396 N/A LYS 591.A NZ GLU 594.A OE1 no hydrogen 2.749 N/A LYS 593.A N ARG 590.A O no hydrogen 2.941 N/A LYS 593.A NZ ASP 387.A OD2 no hydrogen 3.105 N/A GLU 594.A N ARG 590.A O no hydrogen 3.354 N/A GLU 594.A N LYS 591.A O no hydrogen 3.306 N/A CYS 596.A SG GLU 338.A O no hydrogen 3.488 N/A VAL 597.A N LYS 593.A O no hydrogen 2.864 N/A HIS 598.A N GLU 594.A O no hydrogen 3.144 N/A LYS 599.A N ALA 595.A O no hydrogen 3.180 N/A ILE 600.A N CYS 596.A O no hydrogen 2.867 N/A LEU 601.A N VAL 597.A O no hydrogen 2.973 N/A ARG 602.A N HIS 598.A O no hydrogen 3.334 N/A GLN 603.A N LYS 599.A O no hydrogen 3.113 N/A GLN 604.A N ILE 600.A O no hydrogen 2.714 N/A GLN 605.A N LEU 601.A O no hydrogen 2.867 N/A GLN 605.A NE2 LEU 638.A O no hydrogen 3.241 N/A HIS 606.A N ARG 602.A O no hydrogen 3.179 N/A LEU 607.A N GLN 604.A O no hydrogen 3.177 N/A PHE 608.A N GLN 604.A O no hydrogen 3.206 N/A SER 610.A OG VAL 636.A O no hydrogen 2.947 N/A VAL 612.A N GLY 609.A O no hydrogen 3.058 N/A CYS 615.A SG VAL 612.A O no hydrogen 3.643 N/A ASN 618.A ND2 THR 613.A O no hydrogen 3.174 N/A CYS 620.A SG VAL 612.A O no hydrogen 3.922 N/A LEU 621.A N PHE 608.A O no hydrogen 2.834 N/A ARG 623.A NH1 VAL 612.A O no hydrogen 2.664 N/A ARG 623.A NH2 PHE 608.A O no hydrogen 3.277 N/A SER 624.A N ASP 633.A OD1 no hydrogen 3.300 N/A THR 626.A OG1 GLU 625.A O no hydrogen 2.598 N/A ASP 628.A N ASP 633.A OD2 no hydrogen 3.256 N/A LEU 630.A N GLU 351.A OE2 no hydrogen 2.973 N/A ARG 632.A NE ASP 634.A OD1 no hydrogen 3.100 N/A ARG 632.A NH1 TYR 517.A OH no hydrogen 3.481 N/A ARG 632.A NH2 ASP 634.A OD1 no hydrogen 3.099 N/A ARG 632.A NH2 ASP 634.A OD2 no hydrogen 3.351 N/A ASP 633.A N ASP 628.A OD1 no hydrogen 3.030 N/A THR 635.A N ARG 632.A O no hydrogen 3.212 N/A THR 635.A OG1 GLU 410.A OE1 no hydrogen 3.328 N/A THR 635.A OG1 ARG 632.A O no hydrogen 2.943 N/A VAL 636.A N ASN 411.A O no hydrogen 2.588 N/A LEU 638.A N GLN 605.A OE1 no hydrogen 2.873 N/A ALA 639.A N ALA 409.A O no hydrogen 2.675 N/A LYS 640.A N GLU 419.A O no hydrogen 3.047 N/A THR 646.A OG1 ASN 645.A O no hydrogen 2.920 N/A LYS 649.A NZ ASP 643.A O no hydrogen 3.291 N/A LYS 649.A NZ ASP 643.A OD1 no hydrogen 3.493 N/A LYS 649.A NZ ASN 645.A OD1 no hydrogen 3.074 N/A TYR 650.A N THR 646.A O no hydrogen 2.520 N/A TYR 650.A OH ASN 584.A O no hydrogen 2.857 N/A LEU 651.A N TYR 647.A O no hydrogen 2.883 N/A GLY 652.A N GLU 648.A O no hydrogen 3.043 N/A GLU 654.A N GLU 654.A OE2 no hydrogen 2.625 N/A LYS 657.A N GLU 653.A O no hydrogen 3.306 N/A ALA 658.A N GLU 654.A O no hydrogen 2.986 N/A VAL 659.A N TYR 655.A O no hydrogen 2.895 N/A GLY 660.A N VAL 656.A O no hydrogen 2.977 N/A ASN 661.A N LYS 657.A O no hydrogen 2.710 N/A LEU 662.A N ALA 658.A O no hydrogen 3.297 N/A LEU 662.A N VAL 659.A O no hydrogen 3.002 N/A ARG 663.A N GLY 660.A O no hydrogen 2.772 N/A CYS 665.A N LEU 662.A O no hydrogen 2.672 N/A SER 666.A N ARG 663.A O no hydrogen 3.021 N/A SER 668.A OG GLU 375.A OE2 no hydrogen 2.310 N/A LEU 670.A N GLU 375.A OE2 no hydrogen 3.420 N/A LEU 671.A N SER 668.A OG no hydrogen 3.061 N/A GLU 672.A N SER 668.A O no hydrogen 3.242 N/A ALA 673.A N SER 669.A O no hydrogen 3.394 N/A CYS 674.A N LEU 670.A O no hydrogen 2.857 N/A CYS 674.A SG LEU 670.A O no hydrogen 3.562 N/A THR 675.A N LEU 671.A O no hydrogen 2.971 N/A THR 675.A OG1 LEU 671.A O no hydrogen 2.774 N/A THR 675.A OG1 GLU 672.A O no hydrogen 3.220 N/A PHE 676.A N GLU 672.A O no hydrogen 2.889 N/A ARG 677.A N ALA 673.A O no hydrogen 3.081 N/A ARG 677.A NH1 GLN 245.A O no hydrogen 2.910 N/A ARG 678.A N CYS 674.A O no hydrogen 2.923 N/A