Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1z3i_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 ALA 11.A O no hydrogen 3.359 N/A ARG 4.A NH2 ALA 11.A O no hydrogen 2.683 N/A ARG 9.A NH1 LEU 42.A O no hydrogen 2.375 N/A ARG 9.A NH2 ASP 109.A O no hydrogen 2.789 N/A LYS 10.A NZ ARG 5.A O no hydrogen 3.326 N/A PHE 16.A N ASP 14.A OD1 no hydrogen 3.020 N/A ALA 20.A N GLU 17.A O no hydrogen 3.047 N/A LEU 23.A N VAL 46.A O no hydrogen 2.934 N/A TYR 24.A N VAL 46.A O no hydrogen 3.373 N/A ASP 33.A N SER 30.A OG no hydrogen 3.218 N/A LEU 34.A N SER 30.A O no hydrogen 2.951 N/A ILE 35.A N ALA 31.A O no hydrogen 3.199 N/A LYS 36.A N HIS 32.A O no hydrogen 3.447 N/A ALA 37.A N ASP 33.A O no hydrogen 2.781 N/A ASP 38.A N ASP 38.A OD2 no hydrogen 2.420 N/A LYS 39.A NZ LEU 34.A O no hydrogen 3.122 N/A LYS 39.A NZ ILE 35.A O no hydrogen 3.256 N/A LYS 41.A N ASP 38.A O no hydrogen 3.016 N/A VAL 44.A N PRO 108.A O no hydrogen 2.774 N/A VAL 46.A N TYR 24.A O no hydrogen 3.073 N/A VAL 47.A N GLN 106.A OE1 no hydrogen 2.792 N/A VAL 48.A N LEU 21.A O no hydrogen 3.048 N/A VAL 51.A N ASP 49.A OD2 no hydrogen 2.975 N/A LEU 52.A N ASP 49.A O no hydrogen 2.969 N/A SER 53.A N ASP 49.A O no hydrogen 2.951 N/A LYS 54.A N PRO 50.A O no hydrogen 3.013 N/A VAL 55.A N LEU 52.A O no hydrogen 2.903 N/A LEU 56.A N SER 53.A O no hydrogen 3.493 N/A ARG 57.A N GLN 60.A OE1 no hydrogen 2.745 N/A ARG 57.A NE ASP 513.A OD2 no hydrogen 2.710 N/A ARG 57.A NH2 ASP 513.A OD1 no hydrogen 2.730 N/A ARG 57.A NH2 ASP 513.A OD2 no hydrogen 3.508 N/A HIS 59.A NE2 LEU 90.A O no hydrogen 3.017 N/A GLN 60.A NE2 LEU 90.A O no hydrogen 3.237 N/A ARG 61.A N ARG 57.A O no hydrogen 2.901 N/A ARG 61.A NH1 ALA 20.A O no hydrogen 3.368 N/A ARG 61.A NH2 GLY 19.A O no hydrogen 2.306 N/A GLU 62.A N PRO 58.A O no hydrogen 3.005 N/A GLY 63.A N HIS 59.A O no hydrogen 2.871 N/A VAL 64.A N GLN 60.A O no hydrogen 3.137 N/A LYS 65.A N ARG 61.A O no hydrogen 3.185 N/A LYS 65.A NZ GLU 62.A OE2 no hydrogen 3.546 N/A PHE 66.A N GLU 62.A O no hydrogen 2.895 N/A LEU 67.A N GLY 63.A O no hydrogen 2.789 N/A TRP 68.A N VAL 64.A O no hydrogen 2.930 N/A ASP 69.A N LYS 65.A O no hydrogen 2.865 N/A CYS 70.A N PHE 66.A O no hydrogen 2.946 N/A CYS 70.A SG PHE 66.A O no hydrogen 3.325 N/A VAL 71.A N LEU 67.A O no hydrogen 2.888 N/A THR 72.A N TRP 68.A O no hydrogen 3.185 N/A THR 72.A OG1 TRP 68.A O no hydrogen 3.129 N/A GLY 73.A N CYS 70.A O no hydrogen 3.078 N/A ARG 74.A N ASP 69.A O no hydrogen 2.957 N/A ARG 74.A NH1 THR 72.A OG1 no hydrogen 2.848 N/A ARG 75.A N ASP 69.A O no hydrogen 3.170 N/A ARG 75.A NE ARG 293.A O no hydrogen 2.912 N/A SER 79.A N ILE 76.A O no hydrogen 3.209 N/A CYS 82.A N ARG 223.A O no hydrogen 2.931 N/A CYS 82.A SG CYS 294.A O no hydrogen 4.026 N/A ILE 83.A N CYS 294.A O no hydrogen 3.036 N/A MET 84.A N LEU 225.A O no hydrogen 2.784 N/A ALA 85.A N ILE 296.A O no hydrogen 2.664 N/A GLU 87.A N ARG 298.A O no hydrogen 3.033 N/A GLN 95.A N GLY 91.A O no hydrogen 3.458 N/A GLN 95.A NE2 GLY 91.A O no hydrogen 3.022 N/A CYS 96.A N LYS 92.A O no hydrogen 3.031 N/A CYS 96.A SG LYS 92.A O no hydrogen 3.297 N/A ILE 97.A N THR 93.A O no hydrogen 2.821 N/A THR 98.A N LEU 94.A O no hydrogen 3.017 N/A THR 98.A OG1 LEU 94.A O no hydrogen 2.539 N/A LEU 99.A N GLN 95.A O no hydrogen 2.987 N/A ILE 100.A N CYS 96.A O no hydrogen 2.795 N/A TRP 101.A N ILE 97.A O no hydrogen 2.828 N/A TRP 101.A NE1 ASP 49.A OD1 no hydrogen 2.957 N/A THR 102.A N THR 98.A O no hydrogen 2.964 N/A THR 102.A OG1 THR 98.A O no hydrogen 2.705 N/A LEU 103.A N LEU 99.A O no hydrogen 2.944 N/A LEU 104.A N ILE 100.A O no hydrogen 2.738 N/A LYS 105.A N THR 102.A O no hydrogen 3.255 N/A GLN 106.A N THR 102.A O no hydrogen 2.838 N/A GLN 106.A NE2 VAL 47.A O no hydrogen 2.930 N/A SER 107.A OG LYS 111.A O no hydrogen 2.854 N/A ASP 109.A N SER 107.A OG no hydrogen 3.105 N/A CYS 110.A N SER 107.A O no hydrogen 2.790 N/A CYS 110.A SG LYS 10.A O no hydrogen 3.738 N/A GLU 113.A N LEU 103.A O no hydrogen 2.838 N/A GLU 113.A N GLN 106.A O no hydrogen 3.176 N/A ILE 114.A N LEU 103.A O no hydrogen 3.109 N/A LYS 116.A NZ ILE 162.A O no hydrogen 3.284 N/A LYS 116.A NZ LYS 192.A O no hydrogen 2.991 N/A VAL 117.A N PRO 172.A O no hydrogen 2.894 N/A ILE 118.A N LEU 195.A O no hydrogen 2.926 N/A VAL 119.A N LEU 174.A O no hydrogen 2.710 N/A VAL 120.A N ILE 197.A O no hydrogen 2.789 N/A SER 121.A N ILE 176.A O no hydrogen 3.093 N/A SER 121.A OG PRO 122.A O no hydrogen 2.901 N/A SER 123.A OG ASP 147.A OD1 no hydrogen 2.974 N/A SER 123.A OG ASP 147.A OD2 no hydrogen 2.973 N/A LEU 125.A N PRO 122.A O no hydrogen 3.023 N/A VAL 126.A N SER 123.A O no hydrogen 3.120 N/A ASN 128.A ND2 ALA 478.A O no hydrogen 2.978 N/A ASN 128.A ND2 GLY 480.A O no hydrogen 2.813 N/A TRP 129.A N LEU 125.A O no hydrogen 3.103 N/A TRP 129.A N VAL 126.A O no hydrogen 3.113 N/A TRP 129.A NE1 ASP 199.A OD2 no hydrogen 2.996 N/A TYR 130.A N VAL 126.A O no hydrogen 3.144 N/A ASN 131.A N ARG 127.A O no hydrogen 2.968 N/A ASN 131.A ND2 ILE 452.A O no hydrogen 3.658 N/A GLU 132.A N ASN 128.A O no hydrogen 3.013 N/A VAL 133.A N TRP 129.A O no hydrogen 3.113 N/A GLY 134.A N TYR 130.A O no hydrogen 3.297 N/A LYS 135.A N ASN 131.A O no hydrogen 2.808 N/A TRP 136.A N GLU 132.A O no hydrogen 3.136 N/A LEU 137.A N VAL 133.A O no hydrogen 3.057 N/A GLY 138.A N GLY 134.A O no hydrogen 3.037 N/A ARG 140.A N LEU 137.A O no hydrogen 3.155 N/A ARG 140.A NH1 LEU 137.A O no hydrogen 3.279 N/A GLN 142.A NE2 PRO 143.A O no hydrogen 2.795 N/A VAL 144.A N ILE 173.A O no hydrogen 2.747 N/A ILE 146.A N ILE 175.A O no hydrogen 2.772 N/A GLY 148.A N THR 180.A OG1 no hydrogen 3.217 N/A SER 150.A N GLU 153.A OE1 no hydrogen 3.164 N/A ASP 152.A N SER 150.A OG no hydrogen 3.184 N/A ILE 154.A N SER 150.A O no hydrogen 2.855 N/A SER 156.A N ASP 152.A O no hydrogen 3.009 N/A LYS 157.A N GLU 153.A O no hydrogen 3.242 N/A LYS 157.A NZ ALA 145.A O no hydrogen 2.975 N/A LEU 158.A N ILE 154.A O no hydrogen 2.940 N/A VAL 159.A N ASP 155.A O no hydrogen 2.821 N/A ASN 160.A N SER 156.A O no hydrogen 2.945 N/A PHE 161.A N LYS 157.A O no hydrogen 2.970 N/A ILE 162.A N LEU 158.A O no hydrogen 3.107 N/A SER 163.A N VAL 159.A O no hydrogen 3.044 N/A SER 163.A OG VAL 159.A O no hydrogen 2.768 N/A GLN 164.A N ILE 162.A O no hydrogen 2.576 N/A LEU 174.A N VAL 117.A O no hydrogen 2.872 N/A ILE 175.A N VAL 144.A O no hydrogen 2.774 N/A ILE 176.A N VAL 119.A O no hydrogen 3.141 N/A SER 177.A N ILE 146.A O no hydrogen 3.289 N/A SER 177.A OG ASP 147.A OD1 no hydrogen 3.411 N/A TYR 178.A N SER 121.A O no hydrogen 2.982 N/A TYR 178.A OH ASP 199.A O no hydrogen 2.415 N/A THR 180.A N SER 177.A OG no hydrogen 3.144 N/A THR 180.A OG1 SER 177.A OG no hydrogen 3.219 N/A PHE 181.A N SER 177.A O no hydrogen 2.876 N/A ARG 182.A N TYR 178.A O no hydrogen 2.928 N/A ARG 182.A NH1 THR 211.A OG1 no hydrogen 2.371 N/A LEU 183.A N GLU 179.A O no hydrogen 3.364 N/A HIS 184.A N PHE 181.A O no hydrogen 3.245 N/A HIS 184.A NE2 LYS 151.A O no hydrogen 3.288 N/A GLU 186.A N GLU 186.A OE2 no hydrogen 2.938 N/A VAL 187.A N HIS 184.A O no hydrogen 3.237 N/A LEU 188.A N ALA 185.A O no hydrogen 3.054 N/A HIS 189.A N GLU 186.A O no hydrogen 3.209 N/A GLY 191.A N LEU 188.A O no hydrogen 2.946 N/A GLY 194.A N LYS 116.A O no hydrogen 3.065 N/A VAL 196.A N ARG 222.A O no hydrogen 3.084 N/A ILE 197.A N ILE 118.A O no hydrogen 2.922 N/A CYS 198.A N VAL 224.A O no hydrogen 3.006 N/A ASP 199.A N VAL 120.A O no hydrogen 2.727 N/A GLU 200.A N ASP 199.A OD1 no hydrogen 2.597 N/A GLY 201.A N ILE 226.A O no hydrogen 2.592 N/A ARG 203.A N GLU 200.A O no hydrogen 3.373 N/A ARG 203.A NH1 GLU 200.A OE2 no hydrogen 3.058 N/A LEU 204.A N GLY 201.A O no hydrogen 3.267 N/A LYS 205.A NZ GLU 237.A OE1 no hydrogen 3.570 N/A LYS 205.A NZ VAL 548.A O no hydrogen 2.634 N/A ASN 206.A N GLU 237.A O no hydrogen 3.385 N/A ASP 208.A N LYS 205.A O no hydrogen 2.889 N/A ASN 209.A N SER 207.A O no hydrogen 2.798 N/A ASN 209.A ND2 SER 207.A O no hydrogen 3.437 N/A THR 211.A N ASP 208.A OD2 no hydrogen 3.318 N/A THR 211.A OG1 ASP 208.A OD1 no hydrogen 3.041 N/A THR 211.A OG1 ASP 208.A OD2 no hydrogen 2.820 N/A TYR 212.A OH LEU 204.A O no hydrogen 2.977 N/A LEU 213.A N ASN 209.A O no hydrogen 3.214 N/A ALA 214.A N GLN 210.A O no hydrogen 2.905 N/A LEU 215.A N THR 211.A O no hydrogen 2.644 N/A ASN 216.A N TYR 212.A O no hydrogen 2.735 N/A SER 217.A N LEU 213.A O no hydrogen 2.814 N/A SER 217.A OG ALA 185.A O no hydrogen 3.462 N/A MET 218.A N ALA 214.A O no hydrogen 3.187 N/A ASN 219.A N LEU 215.A O no hydrogen 3.102 N/A ARG 222.A N GLY 194.A O no hydrogen 3.340 N/A ARG 222.A NH2 GLN 221.A OE1 no hydrogen 3.085 N/A ARG 223.A N TYR 80.A O no hydrogen 2.966 N/A ARG 223.A NE ALA 220.A O no hydrogen 2.796 N/A ARG 223.A NE GLN 221.A O no hydrogen 3.144 N/A ARG 223.A NH1 PHE 244.A O no hydrogen 2.773 N/A ARG 223.A NH2 ALA 220.A O no hydrogen 3.190 N/A VAL 224.A N VAL 196.A O no hydrogen 2.876 N/A LEU 225.A N CYS 82.A O no hydrogen 2.811 N/A ILE 226.A N CYS 198.A O no hydrogen 3.007 N/A SER 227.A N MET 84.A O no hydrogen 3.011 N/A SER 227.A OG THR 229.A O no hydrogen 2.890 N/A GLY 228.A N HIS 202.A ND1 no hydrogen 3.214 N/A THR 229.A OG1 PRO 230.A O no hydrogen 3.498 N/A ASP 234.A N ILE 231.A O no hydrogen 2.955 N/A GLU 237.A N ASP 234.A O no hydrogen 3.166 N/A TYR 238.A N LEU 235.A O no hydrogen 2.741 N/A TYR 238.A OH HIS 202.A O no hydrogen 3.355 N/A VAL 242.A N TYR 238.A O no hydrogen 2.917 N/A HIS 243.A N PHE 239.A O no hydrogen 2.787 N/A PHE 244.A N SER 240.A O no hydrogen 2.681 N/A VAL 245.A N LEU 241.A O no hydrogen 2.972 N/A ASN 246.A N VAL 242.A O no hydrogen 2.943 N/A ASN 246.A ND2 VAL 242.A O no hydrogen 3.176 N/A ILE 249.A N ASN 246.A O no hydrogen 2.929 N/A LEU 250.A N ASN 246.A O no hydrogen 2.985 N/A GLY 251.A N SER 247.A O no hydrogen 3.099 N/A THR 252.A N GLU 255.A OE1 no hydrogen 2.808 N/A PHE 256.A N THR 252.A O no hydrogen 2.747 N/A LYS 257.A N ALA 253.A O no hydrogen 2.980 N/A LYS 257.A NZ GLU 261.A OE2 no hydrogen 3.275 N/A LYS 258.A N GLN 254.A O no hydrogen 2.938 N/A ARG 259.A N GLU 255.A O no hydrogen 2.875 N/A PHE 260.A N PHE 256.A O no hydrogen 2.777 N/A GLU 261.A N PHE 256.A O no hydrogen 3.315 N/A ILE 262.A N LYS 257.A O no hydrogen 2.827 N/A ILE 264.A N PHE 260.A O no hydrogen 3.052 N/A LEU 265.A N GLU 261.A O no hydrogen 2.963 N/A LYS 266.A N ILE 262.A O no hydrogen 2.851 N/A LYS 266.A NZ ASP 276.A OD1 no hydrogen 3.470 N/A GLY 267.A N PRO 263.A O no hydrogen 2.881 N/A ARG 268.A N ILE 264.A O no hydrogen 3.123 N/A ARG 268.A NH2 GLU 281.A OE1 no hydrogen 3.153 N/A ASP 269.A N LYS 266.A O no hydrogen 3.402 N/A ASP 271.A N ASP 269.A O no hydrogen 2.648 N/A ALA 272.A N ASP 269.A O no hydrogen 2.981 N/A ASP 276.A N SER 273.A OG no hydrogen 3.107 N/A ALA 278.A N ASP 274.A O no hydrogen 3.151 N/A ALA 279.A N LYS 275.A O no hydrogen 2.944 N/A GLY 280.A N ASP 276.A O no hydrogen 3.131 N/A GLU 281.A N ARG 277.A O no hydrogen 3.174 N/A GLN 282.A N ALA 278.A O no hydrogen 3.162 N/A LYS 283.A N ALA 279.A O no hydrogen 3.146 N/A LYS 283.A NZ GLU 286.A OE1 no hydrogen 3.234 N/A LYS 283.A NZ GLU 286.A OE2 no hydrogen 3.092 N/A LEU 284.A N GLY 280.A O no hydrogen 2.864 N/A GLN 285.A N GLU 281.A O no hydrogen 2.868 N/A GLN 285.A NE2 GLU 281.A OE2 no hydrogen 3.350 N/A GLU 286.A N GLN 282.A O no hydrogen 3.129 N/A LEU 287.A N LYS 283.A O no hydrogen 2.984 N/A ILE 288.A N LEU 284.A O no hydrogen 2.856 N/A SER 289.A N GLN 285.A O no hydrogen 3.014 N/A ILE 290.A N GLU 286.A O no hydrogen 3.135 N/A VAL 291.A N LEU 287.A O no hydrogen 2.950 N/A ASN 292.A N ILE 288.A O no hydrogen 2.834 N/A ARG 293.A N SER 289.A O no hydrogen 2.875 N/A ARG 293.A NH2 ARG 75.A O no hydrogen 3.059 N/A CYS 294.A N ILE 290.A O no hydrogen 3.240 N/A CYS 294.A N VAL 291.A O no hydrogen 2.993 N/A CYS 294.A SG ASN 246.A OD1 no hydrogen 3.624 N/A CYS 294.A SG ILE 290.A O no hydrogen 3.539 N/A CYS 294.A SG VAL 291.A O no hydrogen 3.473 N/A ILE 296.A N ILE 83.A O no hydrogen 3.009 N/A ARG 297.A NE ALA 85.A O no hydrogen 2.799 N/A ARG 297.A NH2 GLY 228.A O no hydrogen 2.999 N/A ARG 298.A N ASP 86.A OD1 no hydrogen 2.666 N/A ARG 298.A NH1 ASP 86.A OD1 no hydrogen 2.866 N/A ARG 298.A NH1 GLN 95.A OE1 no hydrogen 3.549 N/A ARG 298.A NH2 GLN 95.A OE1 no hydrogen 3.117 N/A THR 299.A OG1 ASP 301.A OD2 no hydrogen 2.413 N/A SER 300.A N GLU 87.A OE2 no hydrogen 2.794 N/A SER 300.A OG GLU 87.A OE1 no hydrogen 3.359 N/A ILE 302.A N THR 299.A O no hydrogen 3.497 N/A LEU 303.A N SER 300.A O no hydrogen 3.191 N/A SER 304.A N ASP 301.A O no hydrogen 3.369 N/A SER 304.A OG ASP 301.A O no hydrogen 2.927 N/A LYS 305.A N ILE 302.A O no hydrogen 3.339 N/A TYR 306.A N LEU 303.A O no hydrogen 2.919 N/A LEU 307.A N LEU 303.A O no hydrogen 2.931 N/A LYS 310.A N SER 639.A OG no hydrogen 2.823 N/A LYS 310.A NZ GLU 312.A OE2 no hydrogen 3.144 N/A ILE 311.A N CYS 519.A O no hydrogen 2.756 N/A GLU 312.A N GLN 637.A O no hydrogen 2.996 N/A GLN 313.A N ILE 521.A O no hydrogen 2.922 N/A VAL 314.A N PHE 635.A O no hydrogen 2.805 N/A VAL 315.A N ARG 523.A O no hydrogen 2.732 N/A CYS 316.A N PHE 633.A O no hydrogen 2.793 N/A CYS 317.A N LEU 525.A O no hydrogen 2.728 N/A CYS 317.A SG VAL 315.A O no hydrogen 3.464 N/A CYS 317.A SG LEU 525.A O no hydrogen 3.906 N/A ASN 318.A N ALA 630.A O no hydrogen 2.625 N/A THR 320.A N GLN 323.A OE1 no hydrogen 3.075 N/A THR 320.A OG1 GLN 323.A OE1 no hydrogen 3.231 N/A THR 320.A OG1 GLN 396.A O no hydrogen 3.185 N/A GLN 323.A NE2 LEU 359.A O no hydrogen 2.873 N/A GLN 323.A NE2 CYS 360.A O no hydrogen 2.970 N/A LYS 324.A N THR 320.A O no hydrogen 2.860 N/A LYS 324.A NZ LEU 319.A O no hydrogen 3.374 N/A GLU 325.A N PRO 321.A O no hydrogen 3.084 N/A LEU 326.A N LEU 322.A O no hydrogen 2.903 N/A TYR 327.A N GLN 323.A O no hydrogen 2.722 N/A LYS 328.A N LYS 324.A O no hydrogen 2.701 N/A LYS 328.A NZ GLU 572.A OE2 no hydrogen 2.932 N/A LEU 329.A N GLU 325.A O no hydrogen 2.982 N/A PHE 330.A N LEU 326.A O no hydrogen 2.699 N/A LEU 331.A N TYR 327.A O no hydrogen 2.988 N/A LYS 332.A N LYS 328.A O no hydrogen 2.925 N/A GLN 333.A N LEU 329.A O no hydrogen 3.111 N/A GLN 333.A NE2 ASP 378.A O no hydrogen 2.813 N/A ALA 334.A N PHE 330.A O no hydrogen 2.733 N/A LYS 335.A N LEU 331.A O no hydrogen 3.035 N/A GLU 338.A N LYS 335.A O no hydrogen 3.057 N/A SER 339.A OG PRO 336.A O no hydrogen 2.786 N/A GLN 341.A NE2 VAL 337.A O no hydrogen 2.724 N/A SER 351.A OG VAL 347.A O no hydrogen 3.381 N/A SER 352.A N SER 348.A O no hydrogen 3.309 N/A SER 352.A OG SER 348.A O no hydrogen 2.454 N/A ILE 353.A N SER 349.A O no hydrogen 3.140 N/A THR 354.A N LEU 350.A O no hydrogen 2.883 N/A THR 354.A OG1 LEU 350.A O no hydrogen 2.784 N/A SER 355.A N SER 351.A O no hydrogen 2.785 N/A SER 355.A OG SER 351.A O no hydrogen 2.958 N/A LEU 356.A N SER 352.A O no hydrogen 3.059 N/A LYS 357.A N ILE 353.A O no hydrogen 2.958 N/A LYS 357.A NZ TYR 425.A OH no hydrogen 2.775 N/A LYS 358.A N THR 354.A O no hydrogen 3.166 N/A LEU 359.A N SER 355.A O no hydrogen 2.826 N/A CYS 360.A N LEU 356.A O no hydrogen 2.908 N/A CYS 360.A SG LEU 356.A O no hydrogen 3.366 N/A CYS 360.A SG THR 529.A OG1 no hydrogen 3.764 N/A ASN 361.A N LYS 357.A O no hydrogen 3.159 N/A HIS 362.A N LYS 358.A O no hydrogen 2.869 N/A LEU 365.A N HIS 362.A O no hydrogen 2.862 N/A ILE 366.A N PRO 363.A O no hydrogen 2.598 N/A TYR 367.A N ALA 364.A O no hydrogen 3.307 N/A LYS 369.A N ILE 366.A O no hydrogen 3.086 N/A LYS 369.A NZ GLU 374.A OE1 no hydrogen 3.428 N/A CYS 370.A N TYR 367.A O no hydrogen 2.874 N/A CYS 370.A SG ILE 366.A O no hydrogen 3.662 N/A LEU 371.A N TYR 367.A O no hydrogen 3.358 N/A THR 372.A N GLU 368.A O no hydrogen 3.459 N/A THR 372.A OG1 GLU 368.A O no hydrogen 3.206 N/A GLY 373.A N LYS 369.A O no hydrogen 3.171 N/A GLU 374.A N LYS 369.A O no hydrogen 3.294 N/A PHE 377.A N GLU 374.A O no hydrogen 3.008 N/A ASP 378.A N GLN 333.A OE1 no hydrogen 2.896 N/A ALA 380.A N PHE 377.A O no hydrogen 3.103 N/A ASP 382.A N GLY 379.A O no hydrogen 3.407 N/A LEU 383.A N ALA 380.A O no hydrogen 2.973 N/A GLN 396.A N GLU 394.A OE1 no hydrogen 3.049 N/A LEU 397.A N GLU 394.A O no hydrogen 3.004 N/A SER 398.A N PRO 395.A O no hydrogen 3.370 N/A SER 398.A OG ASN 361.A O no hydrogen 2.955 N/A GLY 399.A N GLN 323.A OE1 no hydrogen 2.867 N/A LYS 400.A NZ PHE 494.A O no hydrogen 2.975 N/A LYS 400.A NZ GLU 531.A OE1 no hydrogen 3.054 N/A LYS 400.A NZ GLU 531.A OE2 no hydrogen 2.643 N/A MET 401.A N SER 398.A OG no hydrogen 3.053 N/A LEU 402.A N SER 398.A O no hydrogen 3.084 N/A VAL 403.A N GLY 399.A O no hydrogen 3.097 N/A LEU 404.A N LYS 400.A O no hydrogen 2.770 N/A ASP 405.A N MET 401.A O no hydrogen 2.893 N/A TYR 406.A N LEU 402.A O no hydrogen 2.835 N/A TYR 406.A OH ASP 628.A OD2 no hydrogen 2.897 N/A ILE 407.A N VAL 403.A O no hydrogen 2.815 N/A LEU 408.A N LEU 404.A O no hydrogen 2.953 N/A ALA 409.A N ASP 405.A O no hydrogen 2.831 N/A MET 410.A N TYR 406.A O no hydrogen 2.804 N/A THR 411.A N ILE 407.A O no hydrogen 2.724 N/A THR 411.A OG1 ILE 407.A O no hydrogen 2.520 N/A ARG 412.A N LEU 408.A O no hydrogen 2.896 N/A THR 413.A N ALA 409.A O no hydrogen 3.329 N/A THR 413.A N MET 410.A O no hydrogen 3.289 N/A THR 413.A OG1 ALA 409.A O no hydrogen 3.114 N/A THR 413.A OG1 MET 410.A O no hydrogen 3.467 N/A THR 414.A OG1 MET 410.A O no hydrogen 3.059 N/A THR 415.A N THR 411.A O no hydrogen 3.197 N/A THR 415.A OG1 THR 411.A O no hydrogen 2.615 N/A ASP 417.A N THR 415.A OG1 no hydrogen 3.326 N/A LYS 418.A NZ PHE 462.A O no hydrogen 3.085 N/A LYS 418.A NZ SER 467.A O no hydrogen 3.390 N/A LYS 418.A NZ SER 467.A OG no hydrogen 2.599 N/A VAL 419.A N PHE 470.A O no hydrogen 2.949 N/A VAL 420.A N ARG 490.A O no hydrogen 3.003 N/A LEU 421.A N PHE 472.A O no hydrogen 2.917 N/A VAL 422.A N VAL 492.A O no hydrogen 2.868 N/A SER 423.A N LEU 474.A O no hydrogen 3.352 N/A SER 423.A OG TYR 425.A O no hydrogen 3.387 N/A SER 423.A OG ASP 495.A OD1 no hydrogen 2.970 N/A ASN 424.A N ASP 495.A OD2 no hydrogen 2.879 N/A ASN 424.A ND2 ASP 495.A OD2 no hydrogen 2.589 N/A TYR 425.A N SER 423.A OG no hydrogen 2.987 N/A THR 428.A OG1 ASN 361.A OD1 no hydrogen 2.930 N/A LEU 429.A N TYR 425.A O no hydrogen 3.073 N/A ASP 430.A N THR 426.A O no hydrogen 2.866 N/A LEU 431.A N GLN 427.A O no hydrogen 3.257 N/A LEU 431.A N THR 428.A O no hydrogen 2.904 N/A PHE 432.A N THR 428.A O no hydrogen 3.048 N/A GLU 433.A N LEU 429.A O no hydrogen 2.908 N/A LYS 434.A N ASP 430.A O no hydrogen 3.333 N/A LYS 434.A NZ THR 390.A O no hydrogen 3.196 N/A LEU 435.A N LEU 431.A O no hydrogen 2.829 N/A CYS 436.A N PHE 432.A O no hydrogen 2.856 N/A CYS 436.A SG PHE 432.A O no hydrogen 3.260 N/A ARG 437.A N GLU 433.A O no hydrogen 3.219 N/A ASN 438.A N LYS 434.A O no hydrogen 3.026 N/A ARG 439.A N LEU 435.A O no hydrogen 2.786 N/A ARG 439.A NH1 ASP 405.A OD1 no hydrogen 2.789 N/A ARG 440.A N ARG 437.A O no hydrogen 3.322 N/A TYR 441.A N CYS 436.A O no hydrogen 2.832 N/A TYR 443.A OH GLU 433.A OE1 no hydrogen 2.722 N/A VAL 444.A N ILE 471.A O no hydrogen 3.002 N/A ARG 445.A NH1 ASP 430.A OD1 no hydrogen 2.590 N/A ARG 445.A NH1 GLU 433.A OE2 no hydrogen 2.751 N/A LEU 446.A N MET 473.A O no hydrogen 2.856 N/A LYS 454.A N SER 451.A OG no hydrogen 3.355 N/A ARG 455.A N SER 451.A O no hydrogen 2.965 N/A ALA 456.A N ILE 452.A O no hydrogen 3.188 N/A LYS 457.A N LYS 453.A O no hydrogen 2.919 N/A ILE 458.A N LYS 454.A O no hydrogen 3.064 N/A GLU 460.A N ALA 456.A O no hydrogen 3.147 N/A ARG 461.A N LYS 457.A O no hydrogen 2.870 N/A PHE 462.A N ILE 458.A O no hydrogen 2.997 N/A ASN 463.A N VAL 459.A O no hydrogen 2.978 N/A ASN 463.A ND2 ASN 484.A O no hydrogen 2.664 N/A ASN 464.A N GLU 460.A O no hydrogen 3.303 N/A ASN 464.A N ARG 461.A O no hydrogen 3.212 N/A SER 466.A N ASN 464.A OD1 no hydrogen 2.921 N/A SER 466.A OG ASN 464.A OD1 no hydrogen 3.450 N/A SER 467.A N ASN 464.A O no hydrogen 3.153 N/A SER 467.A OG ASN 464.A O no hydrogen 3.143 N/A PHE 470.A N LEU 442.A O no hydrogen 3.005 N/A ILE 471.A N LEU 442.A O no hydrogen 3.327 N/A PHE 472.A N VAL 419.A O no hydrogen 2.830 N/A MET 473.A N VAL 444.A O no hydrogen 2.926 N/A LEU 474.A N LEU 421.A O no hydrogen 2.953 N/A SER 476.A N SER 423.A O no hydrogen 3.298 N/A SER 476.A OG ASN 424.A OD1 no hydrogen 3.105 N/A ALA 478.A N SER 475.A O no hydrogen 2.789 N/A GLY 479.A N SER 476.A O no hydrogen 2.926 N/A CYS 481.A SG ASP 199.A OD2 no hydrogen 3.216 N/A LEU 483.A N GLY 480.A O no hydrogen 3.388 N/A LEU 485.A N ARG 509.A O no hydrogen 2.785 N/A GLY 487.A N ASN 463.A OD1 no hydrogen 3.147 N/A ALA 488.A N LEU 485.A O no hydrogen 2.918 N/A ASN 489.A N LYS 418.A O no hydrogen 3.177 N/A ARG 490.A NE ASP 417.A OD2 no hydrogen 2.782 N/A ARG 490.A NH1 ASP 620.A OD1 no hydrogen 3.194 N/A ARG 490.A NH2 ASP 417.A OD2 no hydrogen 3.175 N/A LEU 491.A N TYR 520.A O no hydrogen 2.883 N/A VAL 492.A N VAL 420.A O no hydrogen 2.871 N/A MET 493.A N TYR 522.A O no hydrogen 2.736 N/A PHE 494.A N VAL 422.A O no hydrogen 2.875 N/A ASP 497.A N ASP 503.A OD1 no hydrogen 2.928 N/A ASP 497.A N ASP 503.A OD2 no hydrogen 3.457 N/A ASN 499.A N ASP 497.A OD2 no hydrogen 3.201 N/A ALA 501.A N ASN 499.A OD1 no hydrogen 2.930 N/A ASN 502.A N ASN 499.A O no hydrogen 3.246 N/A ASN 502.A ND2 ASP 497.A OD2 no hydrogen 2.768 N/A GLU 504.A N PRO 500.A O no hydrogen 3.033 N/A GLN 505.A N ALA 501.A O no hydrogen 2.999 N/A ALA 506.A N ASN 502.A O no hydrogen 3.428 N/A MET 507.A N ASP 503.A O no hydrogen 2.944 N/A ALA 508.A N GLN 505.A O no hydrogen 3.332 N/A ARG 509.A NE GLN 505.A O no hydrogen 2.815 N/A ARG 509.A NH1 LEU 483.A O no hydrogen 2.903 N/A ARG 509.A NH2 GLN 505.A O no hydrogen 2.805 N/A TRP 511.A NE1 PRO 308.A O no hydrogen 2.660 N/A GLN 515.A N ARG 512.A O no hydrogen 2.805 N/A GLN 515.A NE2 ILE 486.A O no hydrogen 3.443 N/A GLN 515.A NE2 ALA 488.A O no hydrogen 3.043 N/A GLN 515.A NE2 VAL 510.A O no hydrogen 2.669 N/A LYS 517.A N GLN 515.A OE1 no hydrogen 3.111 N/A LYS 517.A NZ SER 416.A O no hydrogen 3.256 N/A LYS 517.A NZ ASP 417.A OD1 no hydrogen 2.877 N/A CYS 519.A N VAL 309.A O no hydrogen 2.881 N/A CYS 519.A SG ASN 489.A O no hydrogen 3.801 N/A CYS 519.A SG VAL 510.A O no hydrogen 3.944 N/A CYS 519.A SG LYS 517.A O no hydrogen 3.821 N/A TYR 520.A N ASN 489.A O no hydrogen 3.101 N/A ILE 521.A N ILE 311.A O no hydrogen 2.891 N/A TYR 522.A N LEU 491.A O no hydrogen 2.826 N/A TYR 522.A OH ASP 620.A OD2 no hydrogen 2.616 N/A ARG 523.A N GLN 313.A O no hydrogen 2.865 N/A ARG 523.A NH2 ASP 503.A OD2 no hydrogen 3.224 N/A ARG 523.A NH2 GLN 538.A OE1 no hydrogen 2.858 N/A LEU 524.A N MET 493.A O no hydrogen 3.210 N/A LEU 525.A N VAL 315.A O no hydrogen 3.061 N/A SER 526.A N GLU 531.A OE1 no hydrogen 2.854 N/A SER 526.A OG GLU 531.A OE1 no hydrogen 2.913 N/A THR 527.A N CYS 317.A O no hydrogen 2.924 N/A THR 527.A OG1 SER 632.A OG no hydrogen 2.782 N/A GLY 528.A N GLU 532.A OE1 no hydrogen 2.795 N/A THR 529.A OG1 THR 527.A O no hydrogen 3.504 N/A ILE 530.A N TYR 327.A OH no hydrogen 3.129 N/A GLU 532.A N THR 529.A O no hydrogen 3.064 N/A LYS 533.A N THR 529.A O no hydrogen 3.488 N/A LYS 533.A NZ GLU 566.A OE1 no hydrogen 3.095 N/A LYS 533.A NZ ASP 577.A OD1 no hydrogen 3.302 N/A ILE 534.A N ILE 530.A O no hydrogen 2.717 N/A LEU 535.A N GLU 531.A O no hydrogen 2.920 N/A GLN 536.A N GLU 532.A O no hydrogen 2.824 N/A GLN 536.A NE2 ASP 577.A OD1 no hydrogen 3.208 N/A GLN 536.A NE2 THR 578.A OG1 no hydrogen 2.964 N/A ARG 537.A N LYS 533.A O no hydrogen 2.955 N/A GLN 538.A N ILE 534.A O no hydrogen 2.956 N/A GLN 538.A NE2 ASP 497.A O no hydrogen 2.751 N/A ALA 539.A N LEU 535.A O no hydrogen 3.223 N/A HIS 540.A N GLN 536.A O no hydrogen 2.973 N/A LYS 541.A N ARG 537.A O no hydrogen 2.921 N/A LYS 541.A NZ TRP 498.A O no hydrogen 3.185 N/A LYS 541.A NZ VAL 549.A O no hydrogen 3.139 N/A LYS 542.A N GLN 538.A O no hydrogen 3.001 N/A ALA 543.A N ALA 539.A O no hydrogen 2.842 N/A LEU 544.A N HIS 540.A O no hydrogen 3.304 N/A GLU 563.A N GLU 563.A OE1 no hydrogen 2.694 N/A LEU 564.A N SER 560.A O no hydrogen 2.909 N/A ARG 565.A N LEU 561.A O no hydrogen 3.319 N/A GLU 566.A N GLY 562.A O no hydrogen 3.147 N/A LEU 567.A N GLU 563.A O no hydrogen 3.181 N/A PHE 568.A N LEU 564.A O no hydrogen 3.149 N/A SER 569.A N GLU 566.A O no hydrogen 3.234 N/A SER 569.A OG ARG 565.A O no hydrogen 2.822 N/A SER 569.A OG GLU 566.A O no hydrogen 2.962 N/A ASN 571.A N GLY 528.A O no hydrogen 2.971 N/A SER 576.A OG GLU 532.A OE2 no hydrogen 2.885 N/A ASP 577.A N GLU 532.A OE1 no hydrogen 3.021 N/A THR 578.A N GLU 532.A OE2 no hydrogen 2.708 N/A THR 578.A OG1 GLU 532.A OE2 no hydrogen 2.849 N/A HIS 579.A N SER 576.A OG no hydrogen 3.048 N/A ASP 580.A N SER 576.A O no hydrogen 3.072 N/A ARG 581.A N ASP 577.A O no hydrogen 3.021 N/A PHE 582.A N HIS 579.A O no hydrogen 2.990 N/A ARG 583.A N ASP 580.A O no hydrogen 2.920 N/A CYS 584.A SG HIS 611.A ND1 no hydrogen 3.323 N/A ARG 586.A NH1 ARG 594.A O no hydrogen 2.716 N/A ARG 586.A NH2 SER 607.A O no hydrogen 3.134 N/A ARG 586.A NH2 TRP 609.A O no hydrogen 2.734 N/A CYS 587.A SG HIS 579.A NE2 no hydrogen 3.479 N/A CYS 587.A SG HIS 611.A ND1 no hydrogen 3.526 N/A VAL 588.A N ARG 591.A O no hydrogen 2.758 N/A ARG 591.A N VAL 588.A O no hydrogen 3.038 N/A VAL 593.A N ARG 586.A O no hydrogen 2.667 N/A ARG 594.A N ARG 586.A O no hydrogen 3.027 N/A ASP 599.A N ASP 599.A OD2 no hydrogen 2.490 N/A SER 600.A N PRO 597.A O no hydrogen 3.217 N/A SER 600.A OG PRO 597.A O no hydrogen 2.875 N/A SER 600.A OG ASN 608.A O no hydrogen 3.303 N/A SER 600.A OG GLN 637.A OE1 no hydrogen 3.462 N/A THR 603.A N ASP 601.A OD2 no hydrogen 3.047 N/A THR 603.A OG1 ASP 601.A OD2 no hydrogen 2.510 N/A CYS 604.A N ASP 601.A O no hydrogen 3.102 N/A CYS 604.A SG ASP 601.A OD2 no hydrogen 3.544 N/A ASN 608.A N ASP 605.A O no hydrogen 2.834 N/A TRP 609.A N LEU 606.A O no hydrogen 3.088 N/A TRP 609.A NE1 CYS 604.A O no hydrogen 2.818 N/A HIS 610.A N HIS 636.A O no hydrogen 2.756 N/A HIS 611.A NE2 LEU 606.A O no hydrogen 2.841 N/A CYS 612.A SG ASP 614.A O no hydrogen 2.701 N/A CYS 612.A SG ARG 616.A O no hydrogen 3.358 N/A VAL 622.A N ASP 620.A OD1 no hydrogen 3.217 N/A LEU 623.A N ASP 620.A OD2 no hydrogen 3.304 N/A GLN 624.A N ASP 620.A O no hydrogen 3.003 N/A ALA 625.A N PRO 621.A O no hydrogen 3.030 N/A SER 626.A N VAL 622.A O no hydrogen 3.269 N/A SER 626.A N LEU 623.A O no hydrogen 2.894 N/A SER 626.A OG VAL 622.A O no hydrogen 2.835 N/A TRP 627.A N GLN 624.A O no hydrogen 2.975 N/A ALA 630.A N ASP 628.A OD1 no hydrogen 2.684 N/A VAL 631.A N ASP 628.A O no hydrogen 3.380 N/A SER 632.A N CYS 316.A O no hydrogen 2.813 N/A SER 632.A OG CYS 316.A O no hydrogen 3.339 N/A SER 632.A OG THR 527.A OG1 no hydrogen 2.782 N/A SER 632.A OG LEU 575.A O no hydrogen 2.547 N/A VAL 634.A N CYS 612.A O no hydrogen 2.956 N/A PHE 635.A N VAL 314.A O no hydrogen 2.950 N/A HIS 636.A N HIS 610.A O no hydrogen 2.971 N/A GLN 637.A N GLU 312.A O no hydrogen 3.041 N/A SER 639.A N LYS 310.A O no hydrogen 2.865 N/A SER 639.A OG HIS 640.A ND1 no hydrogen 2.671 N/A ARG 644.A N GLU 641.A O no hydrogen 3.246 N/A