Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5c3j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 449.A OD2 no hydrogen 3.174 N/A ILE 9.A N ILE 195.A O no hydrogen 2.720 N/A HIS 11.A N ARG 197.A O no hydrogen 2.735 N/A TYR 13.A N ARG 199.A O no hydrogen 2.768 N/A ASP 14.A N LYS 37.A O no hydrogen 3.011 N/A VAL 15.A N LYS 37.A O no hydrogen 3.315 N/A VAL 16.A N ARG 202.A O no hydrogen 3.099 N/A ILE 17.A N ALA 39.A O no hydrogen 2.852 N/A ILE 18.A N ILE 204.A O no hydrogen 2.740 N/A GLY 19.A N VAL 41.A O no hydrogen 2.858 N/A GLY 22.A N THR 51.A OG1 no hydrogen 2.955 N/A LEU 25.A N GLY 21.A O no hydrogen 3.031 N/A ARG 26.A N GLY 22.A O no hydrogen 3.097 N/A ARG 26.A NE GLU 103.A OE2 no hydrogen 3.409 N/A ARG 26.A NH1 GLU 103.A OE2 no hydrogen 2.741 N/A ARG 26.A NH2 ARG 26.A O no hydrogen 2.910 N/A ALA 27.A N ALA 23.A O no hydrogen 3.105 N/A ALA 28.A N GLY 24.A O no hydrogen 3.004 N/A MET 29.A N LEU 25.A O no hydrogen 2.895 N/A GLY 30.A N ARG 26.A O no hydrogen 3.251 N/A LEU 31.A N ALA 27.A O no hydrogen 3.008 N/A GLY 32.A N ALA 28.A O no hydrogen 2.878 N/A GLU 33.A N MET 29.A O no hydrogen 2.920 N/A ALA 34.A N GLY 30.A O no hydrogen 3.067 N/A GLY 35.A N GLY 32.A O no hydrogen 3.089 N/A PHE 36.A N LEU 31.A O no hydrogen 3.099 N/A LYS 37.A N ASP 14.A OD1 no hydrogen 2.750 N/A LYS 37.A NZ ALA 12.A O no hydrogen 3.105 N/A THR 38.A OG1 PHE 36.A O no hydrogen 3.491 N/A ALA 39.A N VAL 15.A O no hydrogen 3.009 N/A VAL 40.A N THR 165.A O no hydrogen 3.087 N/A VAL 41.A N ILE 17.A O no hydrogen 2.949 N/A THR 42.A N PHE 167.A O no hydrogen 3.270 N/A THR 42.A OG1 MET 44.A O no hydrogen 2.523 N/A LYS 43.A NZ MET 222.A O no hydrogen 3.156 N/A LYS 43.A NZ ASP 226.A OD2 no hydrogen 2.839 N/A LYS 43.A NZ GLU 519.A OE1 no hydrogen 2.862 N/A MET 44.A N THR 42.A OG1 no hydrogen 3.103 N/A ARG 48.A N PHE 45.A O no hydrogen 2.845 N/A SER 49.A N PRO 46.A O no hydrogen 3.172 N/A SER 49.A OG PRO 46.A O no hydrogen 3.004 N/A THR 52.A N SER 49.A O no hydrogen 3.159 N/A THR 52.A OG1 THR 47.A O no hydrogen 3.534 N/A ALA 53.A N HIS 50.A O no hydrogen 2.718 N/A ALA 54.A N THR 51.A O no hydrogen 3.082 N/A GLN 55.A NE2 LEU 257.A O no hydrogen 3.038 N/A ILE 58.A N CYS 141.A O no hydrogen 2.915 N/A ASN 59.A N ALA 406.A O no hydrogen 2.815 N/A ASN 59.A ND2 THR 140.A OG1 no hydrogen 2.468 N/A ALA 60.A N ARG 139.A O no hydrogen 3.010 N/A LEU 62.A N ALA 60.A O no hydrogen 2.864 N/A SER 64.A OG ILE 119.A O no hydrogen 2.772 N/A ASP 69.A N ASP 68.A OD2 no hydrogen 2.846 N/A LYS 71.A N ASP 69.A OD2 no hydrogen 3.346 N/A TRP 72.A N ASP 69.A O no hydrogen 3.007 N/A PHE 74.A N TRP 70.A O no hydrogen 2.880 N/A TYR 75.A N LYS 71.A O no hydrogen 2.776 N/A ASP 76.A N TRP 72.A O no hydrogen 3.142 N/A THR 77.A N HIS 73.A O no hydrogen 3.007 N/A THR 77.A OG1 HIS 73.A O no hydrogen 2.911 N/A THR 77.A OG1 ASN 407.A OD1 no hydrogen 3.127 N/A VAL 78.A N PHE 74.A O no hydrogen 3.111 N/A LYS 79.A N TYR 75.A O no hydrogen 2.998 N/A LYS 79.A NZ SER 615.A O no hydrogen 2.787 N/A GLY 80.A N ASP 76.A O no hydrogen 2.979 N/A SER 81.A N THR 77.A O no hydrogen 2.944 N/A SER 81.A OG VAL 78.A O no hydrogen 2.588 N/A ASP 82.A N LYS 79.A O no hydrogen 3.071 N/A TRP 83.A NE1 ILE 609.A O no hydrogen 2.625 N/A LEU 84.A N SER 81.A O no hydrogen 3.194 N/A GLY 85.A N SER 81.A OG no hydrogen 3.285 N/A ASP 86.A N SER 397.A O no hydrogen 3.041 N/A GLN 87.A N ILE 597.A O no hydrogen 2.896 N/A GLN 87.A NE2 ILE 609.A O no hydrogen 3.241 N/A ALA 89.A N ASP 86.A O no hydrogen 3.117 N/A MET 90.A N ASP 86.A O no hydrogen 2.897 N/A HIS 91.A N GLN 87.A O no hydrogen 2.858 N/A TYR 92.A N ASN 88.A O no hydrogen 3.061 N/A LEU 93.A N ALA 89.A O no hydrogen 2.984 N/A THR 94.A N MET 90.A O no hydrogen 3.178 N/A THR 94.A OG1 MET 90.A O no hydrogen 2.636 N/A THR 94.A OG1 HIS 91.A O no hydrogen 3.028 N/A ARG 95.A N HIS 91.A O no hydrogen 2.798 N/A ARG 95.A NH1 GLU 605.A OE1 no hydrogen 2.670 N/A ASN 96.A N TYR 92.A O no hydrogen 3.350 N/A ALA 97.A N THR 94.A O no hydrogen 3.335 N/A ALA 100.A N ASN 96.A O no hydrogen 2.938 N/A VAL 101.A N ALA 97.A O no hydrogen 3.193 N/A THR 102.A N VAL 98.A O no hydrogen 3.121 N/A THR 102.A OG1 VAL 98.A O no hydrogen 2.723 N/A GLU 103.A N GLU 99.A O no hydrogen 2.814 N/A LEU 104.A N ALA 100.A O no hydrogen 3.230 N/A GLU 105.A N VAL 101.A O no hydrogen 3.087 N/A ASN 106.A N THR 102.A O no hydrogen 2.791 N/A PHE 107.A N GLU 103.A O no hydrogen 2.719 N/A GLY 108.A N GLU 105.A O no hydrogen 2.801 N/A MET 109.A N LEU 104.A O no hydrogen 3.129 N/A PHE 111.A N MET 109.A O no hydrogen 3.005 N/A SER 112.A N CYS 142.A O no hydrogen 3.231 N/A ARG 113.A NE PHE 111.A O no hydrogen 3.390 N/A ARG 113.A NH1 GLY 117.A O no hydrogen 3.483 N/A ARG 113.A NH2 GLU 105.A OE2 no hydrogen 3.030 N/A THR 114.A N LYS 118.A O no hydrogen 2.742 N/A THR 114.A OG1 LYS 118.A O no hydrogen 3.036 N/A GLY 117.A N THR 114.A O no hydrogen 2.837 N/A LYS 118.A N THR 114.A OG1 no hydrogen 2.952 N/A TYR 120.A N SER 112.A O no hydrogen 2.796 N/A TYR 120.A OH GLU 265.A OE1 no hydrogen 2.771 N/A TYR 120.A OH GLU 265.A OE2 no hydrogen 3.405 N/A ARG 122.A N THR 140.A O no hydrogen 2.757 N/A ARG 122.A NE GLU 265.A OE1 no hydrogen 2.998 N/A ARG 122.A NH1 ALA 144.A O no hydrogen 3.222 N/A ARG 122.A NH2 GLY 56.A O no hydrogen 2.718 N/A ARG 122.A NH2 ALA 144.A O no hydrogen 2.821 N/A SER 123.A OG ALA 137.A O no hydrogen 2.400 N/A GLY 126.A N LEU 288.A O no hydrogen 2.857 N/A GLN 127.A NE2 THR 140.A OG1 no hydrogen 3.363 N/A SER 128.A N ASP 76.A OD2 no hydrogen 2.388 N/A SER 128.A OG ASP 76.A OD1 no hydrogen 2.676 N/A SER 128.A OG ASP 76.A OD2 no hydrogen 3.123 N/A ASN 129.A N GLY 135.A O no hydrogen 3.168 N/A LYS 133.A N ASN 130.A O no hydrogen 2.823 N/A GLY 134.A N ASN 129.A O no hydrogen 2.770 N/A ALA 137.A N GLN 127.A O no hydrogen 3.182 N/A ARG 139.A NE GLN 127.A OE1 no hydrogen 3.071 N/A ARG 139.A NH1 ASP 68.A OD1 no hydrogen 3.365 N/A ARG 139.A NH1 ASP 68.A OD2 no hydrogen 2.940 N/A ARG 139.A NH1 SER 128.A O no hydrogen 3.291 N/A ARG 139.A NH2 ASP 76.A OD2 no hydrogen 2.769 N/A ARG 139.A NH2 GLN 127.A OE1 no hydrogen 3.323 N/A ARG 139.A NH2 SER 128.A O no hydrogen 3.278 N/A THR 140.A N ARG 122.A O no hydrogen 3.204 N/A CYS 141.A N ILE 58.A O no hydrogen 2.917 N/A CYS 141.A SG ILE 58.A O no hydrogen 3.374 N/A CYS 141.A SG ALA 60.A O no hydrogen 3.940 N/A CYS 141.A SG GLN 121.A OE1 no hydrogen 3.584 N/A CYS 141.A SG ARG 139.A O no hydrogen 3.628 N/A VAL 143.A N THR 147.A OG1 no hydrogen 3.403 N/A ARG 146.A N VAL 143.A O no hydrogen 3.180 N/A THR 147.A N GLN 55.A O no hydrogen 3.102 N/A THR 147.A OG1 GLN 55.A O no hydrogen 2.915 N/A GLY 148.A N ALA 54.A O no hydrogen 2.842 N/A SER 150.A N ARG 146.A O no hydrogen 3.262 N/A MET 151.A N THR 147.A O no hydrogen 2.949 N/A LEU 152.A N GLY 148.A O no hydrogen 2.774 N/A HIS 153.A N HIS 149.A O no hydrogen 2.876 N/A THR 154.A N SER 150.A O no hydrogen 2.833 N/A THR 154.A OG1 SER 150.A O no hydrogen 2.613 N/A LEU 155.A N MET 151.A O no hydrogen 2.864 N/A TYR 156.A N LEU 152.A O no hydrogen 2.724 N/A GLY 157.A N HIS 153.A O no hydrogen 2.944 N/A ASN 158.A N THR 154.A O no hydrogen 2.868 N/A ASN 158.A ND2 PHE 107.A O no hydrogen 2.929 N/A ASN 158.A ND2 THR 154.A O no hydrogen 2.826 N/A SER 159.A N LEU 155.A O no hydrogen 3.010 N/A SER 159.A N TYR 156.A O no hydrogen 2.864 N/A SER 159.A OG TYR 156.A O no hydrogen 2.841 N/A LEU 160.A N GLY 157.A O no hydrogen 2.832 N/A ARG 161.A N ASN 158.A O no hydrogen 3.321 N/A CYS 162.A N SER 159.A O no hydrogen 3.248 N/A CYS 162.A SG MET 29.A O no hydrogen 4.022 N/A CYS 162.A SG ASN 158.A O no hydrogen 3.244 N/A CYS 164.A SG ALA 28.A O no hydrogen 3.216 N/A CYS 164.A SG CYS 162.A O no hydrogen 3.288 N/A THR 165.A N THR 38.A O no hydrogen 2.980 N/A PHE 167.A N VAL 40.A O no hydrogen 2.730 N/A TYR 170.A N THR 42.A O no hydrogen 3.038 N/A PHE 171.A N LEU 188.A O no hydrogen 2.873 N/A LEU 173.A N ILE 186.A O no hydrogen 2.730 N/A ASP 174.A N ILE 186.A O no hydrogen 3.314 N/A LEU 176.A N GLY 184.A O no hydrogen 2.607 N/A ASP 178.A N ARG 181.A O no hydrogen 2.841 N/A ARG 181.A N ASP 178.A O no hydrogen 3.388 N/A CYS 182.A N PRO 385.A O no hydrogen 2.994 N/A CYS 182.A SG GLY 184.A O no hydrogen 3.554 N/A CYS 182.A SG THR 203.A OG1 no hydrogen 3.190 N/A VAL 183.A N LEU 176.A O no hydrogen 2.709 N/A VAL 185.A N PHE 198.A O no hydrogen 3.106 N/A ILE 186.A N ASP 174.A O no hydrogen 2.881 N/A ALA 187.A N HIS 196.A O no hydrogen 2.905 N/A LEU 188.A N PHE 171.A O no hydrogen 2.831 N/A CYS 189.A N THR 194.A O no hydrogen 2.747 N/A CYS 189.A SG ASP 192.A OD2 no hydrogen 3.136 N/A LEU 190.A N GLU 169.A O no hydrogen 3.136 N/A THR 194.A N ASP 192.A OD2 no hydrogen 3.172 N/A THR 194.A OG1 ASP 192.A OD1 no hydrogen 3.302 N/A THR 194.A OG1 ASP 192.A OD2 no hydrogen 2.493 N/A THR 194.A OG1 HIS 196.A NE2 no hydrogen 2.773 N/A ILE 195.A N LYS 7.A O no hydrogen 2.892 N/A HIS 196.A N ALA 187.A O no hydrogen 2.746 N/A HIS 196.A ND1 HIS 11.A NE2 no hydrogen 3.197 N/A HIS 196.A NE2 THR 194.A OG1 no hydrogen 2.773 N/A ARG 197.A N ILE 9.A O no hydrogen 2.779 N/A PHE 198.A N VAL 185.A O no hydrogen 2.787 N/A ARG 199.A N HIS 11.A O no hydrogen 2.857 N/A ARG 199.A NH1 ILE 433.A O no hydrogen 3.526 N/A ARG 199.A NH1 PRO 434.A O no hydrogen 2.711 N/A SER 200.A N VAL 183.A O no hydrogen 2.581 N/A SER 200.A OG ARG 202.A O no hydrogen 2.853 N/A SER 200.A OG THR 203.A OG1 no hydrogen 3.416 N/A LYS 201.A NZ ASP 14.A OD2 no hydrogen 2.655 N/A ARG 202.A N ASP 14.A O no hydrogen 3.135 N/A ARG 202.A NH1 GLU 431.A OE1 no hydrogen 3.216 N/A THR 203.A N GLY 386.A O no hydrogen 2.806 N/A THR 203.A OG1 SER 200.A OG no hydrogen 3.416 N/A ILE 204.A N VAL 16.A O no hydrogen 2.893 N/A VAL 205.A N TYR 388.A O no hydrogen 2.901 N/A ALA 206.A N ILE 18.A O no hydrogen 2.678 N/A TYR 210.A OH THR 530.A OG1 no hydrogen 3.113 N/A ARG 212.A N ASN 223.A O no hydrogen 3.254 N/A ALA 213.A N TYR 210.A O no hydrogen 3.034 N/A TYR 214.A N GLY 211.A O no hydrogen 3.330 N/A TYR 214.A OH ALA 475.A O no hydrogen 2.821 N/A PHE 215.A N GLN 472.A OE1 no hydrogen 2.872 N/A SER 216.A N GLN 472.A OE1 no hydrogen 3.056 N/A CYS 217.A SG GLY 211.A O no hydrogen 3.642 N/A CYS 217.A SG THR 219.A O no hydrogen 3.975 N/A CYS 217.A SG THR 219.A OG1 no hydrogen 2.853 N/A THR 218.A N VAL 357.A O no hydrogen 2.953 N/A THR 218.A OG1 HIS 358.A ND1 no hydrogen 2.820 N/A ASN 223.A N ALA 220.A O no hydrogen 2.967 N/A THR 224.A N MET 222.A O no hydrogen 2.937 N/A THR 224.A OG1 ASP 226.A OD1 no hydrogen 2.245 N/A GLY 225.A N GLY 209.A O no hydrogen 3.336 N/A THR 228.A OG1 GLY 225.A O no hydrogen 2.976 N/A THR 228.A OG1 ASN 526.A OD1 no hydrogen 2.393 N/A ALA 229.A N GLY 225.A O no hydrogen 2.938 N/A LEU 230.A N ASP 226.A O no hydrogen 2.662 N/A ALA 231.A N GLY 227.A O no hydrogen 3.197 N/A THR 232.A N THR 228.A O no hydrogen 2.926 N/A THR 232.A OG1 THR 228.A O no hydrogen 3.235 N/A ARG 233.A N ALA 229.A O no hydrogen 2.895 N/A ARG 233.A NE ASP 174.A OD1 no hydrogen 2.582 N/A ARG 233.A NH2 LEU 173.A O no hydrogen 2.937 N/A ALA 234.A N ALA 231.A O no hydrogen 2.993 N/A GLY 235.A N THR 232.A O no hydrogen 2.744 N/A ILE 236.A N ALA 231.A O no hydrogen 2.934 N/A LEU 238.A N THR 580.A O no hydrogen 3.024 N/A GLU 239.A N GLY 363.A O no hydrogen 2.758 N/A ASP 240.A N THR 578.A O no hydrogen 3.050 N/A GLU 242.A N GLU 242.A OE1 no hydrogen 2.498 N/A PHE 243.A N ASP 240.A O no hydrogen 3.086 N/A GLN 245.A N TYR 359.A O no hydrogen 3.397 N/A GLN 245.A NE2 ARG 403.A O no hydrogen 2.812 N/A HIS 247.A N THR 356.A O no hydrogen 2.830 N/A THR 249.A N HIS 247.A ND1 no hydrogen 3.274 N/A THR 249.A OG1 ILE 258.A O no hydrogen 2.907 N/A GLY 250.A N ILE 354.A O no hydrogen 3.247 N/A ILE 251.A N CYS 256.A O no hydrogen 2.838 N/A TYR 252.A N PRO 352.A O no hydrogen 3.210 N/A TYR 252.A OH ASP 313.A OD2 no hydrogen 2.656 N/A VAL 254.A N ILE 251.A O no hydrogen 3.352 N/A GLY 255.A N ILE 251.A O no hydrogen 2.943 N/A ILE 258.A N THR 249.A O no hydrogen 3.027 N/A GLY 261.A N THR 259.A OG1 no hydrogen 3.116 N/A SER 262.A N THR 259.A O no hydrogen 2.935 N/A SER 262.A OG THR 259.A O no hydrogen 2.634 N/A ARG 263.A NH1 ASP 287.A O no hydrogen 2.788 N/A ARG 263.A NH2 GLU 260.A OE2 no hydrogen 2.703 N/A GLY 264.A N GLU 260.A O no hydrogen 2.876 N/A GLU 265.A N GLY 261.A O no hydrogen 2.809 N/A GLY 266.A N ARG 263.A O no hydrogen 2.770 N/A GLY 267.A N SER 262.A O no hydrogen 2.918 N/A PHE 268.A N GLN 318.A O no hydrogen 3.090 N/A LEU 269.A N ASP 287.A OD2 no hydrogen 2.853 N/A VAL 270.A N TYR 316.A O no hydrogen 2.855 N/A ASN 271.A N GLU 275.A O no hydrogen 3.164 N/A ASN 271.A ND2 GLU 275.A OE1 no hydrogen 3.543 N/A ASN 271.A ND2 GLU 301.A OE2 no hydrogen 2.827 N/A SER 272.A N ARG 306.A O no hydrogen 2.842 N/A SER 272.A OG GLU 273.A OE1 no hydrogen 2.929 N/A SER 272.A OG ARG 306.A O no hydrogen 3.119 N/A GLY 274.A N ASN 271.A O no hydrogen 2.883 N/A GLU 275.A N ASN 271.A OD1 no hydrogen 3.079 N/A ARG 276.A NE ASP 287.A OD1 no hydrogen 2.731 N/A ARG 276.A NH2 ASP 287.A OD1 no hydrogen 2.988 N/A GLU 279.A N ARG 276.A O no hydrogen 3.069 N/A ARG 280.A N PHE 277.A O no hydrogen 3.033 N/A ARG 280.A NH1 GLU 275.A OE1 no hydrogen 2.911 N/A ARG 280.A NH1 GLU 301.A OE1 no hydrogen 3.180 N/A ARG 280.A NH2 GLU 301.A OE1 no hydrogen 3.319 N/A TYR 281.A N PHE 277.A O no hydrogen 3.418 N/A TYR 281.A OH GLU 301.A OE1 no hydrogen 2.980 N/A ALA 282.A N MET 278.A O no hydrogen 3.024 N/A LYS 284.A NZ TYR 616.A OXT no hydrogen 2.933 N/A ALA 285.A N TYR 616.A O no hydrogen 2.880 N/A LYS 286.A N ALA 282.A O no hydrogen 2.626 N/A LEU 288.A N ALA 285.A O no hydrogen 2.736 N/A SER 290.A OG ASP 292.A OD1 no hydrogen 2.688 N/A ARG 291.A NE GLN 245.A OE1 no hydrogen 2.774 N/A ARG 291.A NH1 GLN 245.A OE1 no hydrogen 2.882 N/A ARG 291.A NH2 GLU 260.A OE1 no hydrogen 3.318 N/A VAL 294.A N SER 290.A O no hydrogen 3.036 N/A SER 295.A N ARG 291.A O no hydrogen 3.103 N/A SER 295.A OG PHE 246.A O no hydrogen 2.679 N/A SER 295.A OG ARG 291.A O no hydrogen 3.419 N/A ARG 296.A N ASP 292.A O no hydrogen 3.231 N/A ARG 296.A NH1 GLY 542.A O no hydrogen 2.841 N/A ARG 296.A NH2 ASP 292.A OD2 no hydrogen 3.136 N/A ARG 296.A NH2 GLY 542.A O no hydrogen 3.290 N/A ALA 297.A N VAL 293.A O no hydrogen 3.097 N/A GLU 298.A N VAL 294.A O no hydrogen 3.185 N/A THR 299.A N SER 295.A O no hydrogen 2.905 N/A THR 299.A OG1 SER 295.A O no hydrogen 3.020 N/A ILE 300.A N ARG 296.A O no hydrogen 2.848 N/A GLU 301.A N ALA 297.A O no hydrogen 3.032 N/A ILE 302.A N GLU 298.A O no hydrogen 3.318 N/A MET 303.A N THR 299.A O no hydrogen 3.184 N/A GLU 304.A N ILE 300.A O no hydrogen 2.850 N/A GLY 305.A N ILE 302.A O no hydrogen 2.815 N/A ARG 306.A N GLU 301.A O no hydrogen 2.735 N/A ARG 306.A NE GLU 301.A OE2 no hydrogen 3.072 N/A ARG 306.A NH2 GLU 301.A OE1 no hydrogen 3.310 N/A ARG 306.A NH2 GLU 304.A OE2 no hydrogen 3.391 N/A VAL 308.A N HIS 314.A O no hydrogen 2.621 N/A LYS 312.A N GLY 309.A O no hydrogen 2.477 N/A LYS 312.A NZ GLY 305.A O no hydrogen 3.330 N/A LYS 312.A NZ GLY 307.A O no hydrogen 3.097 N/A ILE 315.A N VAL 353.A O no hydrogen 3.009 N/A TYR 316.A N VAL 270.A O no hydrogen 3.192 N/A LEU 317.A N ILE 351.A O no hydrogen 2.936 N/A GLN 318.A N PHE 268.A O no hydrogen 2.750 N/A GLN 318.A NE2 HIS 321.A ND1 no hydrogen 3.618 N/A HIS 321.A NE2 GLY 266.A O no hydrogen 2.769 N/A LEU 322.A N LEU 319.A O no hydrogen 2.689 N/A GLN 326.A N PRO 323.A O no hydrogen 2.796 N/A LEU 327.A N PRO 323.A O no hydrogen 2.970 N/A HIS 328.A N ALA 324.A O no hydrogen 2.897 N/A GLN 329.A N GLU 325.A O no hydrogen 3.130 N/A ARG 330.A N GLN 326.A O no hydrogen 2.871 N/A LEU 331.A N LEU 327.A O no hydrogen 3.161 N/A ILE 334.A N ASP 145.A OD2 no hydrogen 2.353 N/A SER 335.A N LEU 331.A O no hydrogen 3.286 N/A SER 335.A OG LEU 327.A O no hydrogen 3.506 N/A SER 335.A OG LEU 331.A O no hydrogen 2.476 N/A GLU 336.A N PRO 332.A O no hydrogen 3.166 N/A THR 337.A N GLY 333.A O no hydrogen 2.976 N/A THR 337.A OG1 GLY 333.A O no hydrogen 2.879 N/A ALA 338.A N ILE 334.A O no hydrogen 2.615 N/A LYS 339.A N SER 335.A O no hydrogen 3.352 N/A ILE 340.A N GLU 336.A O no hydrogen 2.993 N/A PHE 341.A N THR 337.A O no hydrogen 3.060 N/A ALA 342.A N ALA 338.A O no hydrogen 3.113 N/A GLY 343.A N LYS 339.A O no hydrogen 2.989 N/A VAL 344.A N ALA 338.A O no hydrogen 3.290 N/A ASP 345.A N GLU 349.A OE1 no hydrogen 2.893 N/A THR 347.A N ASP 345.A OD1 no hydrogen 2.981 N/A THR 347.A OG1 ASP 345.A OD1 no hydrogen 2.560 N/A LYS 348.A N ASP 345.A O no hydrogen 3.248 N/A GLU 349.A N ASP 345.A O no hydrogen 2.853 N/A ILE 351.A N LEU 317.A O no hydrogen 2.940 N/A VAL 353.A N ILE 315.A O no hydrogen 2.829 N/A ILE 354.A N GLY 250.A O no hydrogen 3.000 N/A THR 356.A N HIS 247.A O no hydrogen 2.849 N/A THR 356.A OG1 ILE 354.A O no hydrogen 2.688 N/A HIS 358.A N GLN 245.A O no hydrogen 2.943 N/A HIS 358.A ND1 THR 218.A OG1 no hydrogen 2.820 N/A TYR 359.A OH HIS 399.A NE2 no hydrogen 3.199 N/A ASN 360.A ND2 GLU 392.A OE2 no hydrogen 3.469 N/A GLY 363.A N GLU 239.A O no hydrogen 3.029 N/A ILE 364.A N CYS 393.A O no hydrogen 2.885 N/A THR 366.A N CYS 395.A O no hydrogen 3.017 N/A THR 366.A OG1 ASN 367.A O no hydrogen 2.691 N/A THR 366.A OG1 HIS 396.A ND1 no hydrogen 2.748 N/A ASN 367.A N GLN 371.A O no hydrogen 3.246 N/A ASN 367.A ND2 GLN 371.A OE1 no hydrogen 3.174 N/A LYS 369.A N ASN 367.A OD1 no hydrogen 2.717 N/A ALA 370.A N ASN 367.A O no hydrogen 3.211 N/A GLN 371.A N ASN 367.A OD1 no hydrogen 3.084 N/A GLN 371.A NE2 TYR 388.A OH no hydrogen 3.010 N/A VAL 372.A N LEU 387.A O no hydrogen 3.001 N/A ILE 373.A N PRO 365.A O no hydrogen 3.130 N/A LYS 374.A N LYS 382.A O no hydrogen 2.934 N/A THR 376.A N GLY 380.A O no hydrogen 3.381 N/A GLY 379.A N THR 376.A OG1 no hydrogen 3.002 N/A GLY 380.A N THR 376.A O no hydrogen 3.007 N/A LYS 382.A N LYS 374.A O no hydrogen 2.941 N/A VAL 384.A N VAL 372.A O no hydrogen 2.873 N/A LEU 387.A N VAL 384.A O no hydrogen 3.126 N/A TYR 388.A N THR 203.A O no hydrogen 2.879 N/A TYR 388.A OH ASN 422.A O no hydrogen 3.378 N/A TYR 388.A OH GLU 426.A OE1 no hydrogen 3.235 N/A ALA 389.A N ALA 370.A O no hydrogen 2.968 N/A CYS 390.A N VAL 205.A O no hydrogen 2.888 N/A CYS 390.A SG PHE 415.A O no hydrogen 3.975 N/A CYS 393.A SG VAL 205.A O no hydrogen 3.108 N/A CYS 393.A SG CYS 390.A O no hydrogen 3.516 N/A ALA 394.A N GLY 391.A O no hydrogen 2.919 N/A CYS 395.A N ILE 364.A O no hydrogen 2.726 N/A CYS 395.A SG GLU 239.A OE1 no hydrogen 3.383 N/A CYS 395.A SG MET 361.A O no hydrogen 3.335 N/A HIS 396.A ND1 THR 366.A OG1 no hydrogen 2.748 N/A SER 397.A N ASP 86.A OD2 no hydrogen 2.947 N/A HIS 399.A NE2 ASP 411.A OD2 no hydrogen 3.362 N/A GLY 400.A N SER 397.A OG no hydrogen 2.930 N/A ALA 401.A N SER 81.A O no hydrogen 3.156 N/A ASN 402.A N HIS 399.A O no hydrogen 3.173 N/A ARG 403.A NE LEU 404.A O no hydrogen 3.440 N/A ASN 407.A N LEU 404.A O no hydrogen 2.999 N/A ASN 407.A ND2 ASN 59.A OD1 no hydrogen 2.965 N/A ASN 407.A ND2 HIS 73.A NE2 no hydrogen 3.190 N/A ASP 411.A N ASN 407.A O no hydrogen 2.988 N/A ALA 412.A N SER 408.A O no hydrogen 2.783 N/A VAL 413.A N LEU 409.A O no hydrogen 3.159 N/A VAL 414.A N LEU 410.A O no hydrogen 2.869 N/A PHE 415.A N ASP 411.A O no hydrogen 2.901 N/A GLY 416.A N ALA 412.A O no hydrogen 2.809 N/A ARG 417.A N VAL 413.A O no hydrogen 2.811 N/A ARG 417.A NH1 GLU 103.A OE1 no hydrogen 2.804 N/A ALA 418.A N VAL 414.A O no hydrogen 2.764 N/A CYS 419.A N PHE 415.A O no hydrogen 3.025 N/A CYS 419.A SG PHE 415.A O no hydrogen 3.440 N/A SER 420.A OG ARG 417.A O no hydrogen 3.064 N/A ILE 421.A N ARG 417.A O no hydrogen 2.954 N/A ASN 422.A N ALA 418.A O no hydrogen 2.713 N/A ILE 423.A N SER 420.A O no hydrogen 3.253 N/A LYS 424.A N SER 420.A O no hydrogen 3.007 N/A GLU 425.A N ILE 421.A O no hydrogen 3.061 N/A LEU 427.A N ILE 423.A O no hydrogen 2.693 N/A GLU 431.A N LYS 428.A O no hydrogen 2.939 N/A ALA 440.A N PRO 437.A O no hydrogen 3.235 N/A GLU 442.A N GLY 439.A O no hydrogen 2.861 N/A SER 444.A N GLY 441.A O no hydrogen 3.161 N/A SER 444.A OG ASP 174.A OD2 no hydrogen 2.417 N/A ILE 445.A N GLY 441.A O no hydrogen 3.339 N/A ALA 446.A N GLU 442.A O no hydrogen 3.192 N/A ASN 447.A N GLU 443.A O no hydrogen 3.110 N/A LEU 448.A N SER 444.A O no hydrogen 3.024 N/A ASP 449.A N ILE 445.A O no hydrogen 2.813 N/A ALA 450.A N ALA 446.A O no hydrogen 2.935 N/A VAL 451.A N ASN 447.A O no hydrogen 2.857 N/A ARG 452.A N LEU 448.A O no hydrogen 2.630 N/A ARG 452.A NE ARG 506.A O no hydrogen 2.876 N/A ARG 452.A NH1 TYR 6.A OH no hydrogen 3.316 N/A ARG 452.A NH2 ARG 506.A O no hydrogen 2.763 N/A TYR 453.A N ASP 449.A O no hydrogen 3.037 N/A ALA 454.A N VAL 451.A O no hydrogen 3.119 N/A VAL 458.A N ARG 500.A O no hydrogen 2.965 N/A THR 460.A N LYS 502.A O no hydrogen 3.207 N/A THR 460.A OG1 SER 517.A OG no hydrogen 2.735 N/A GLU 462.A N PRO 459.A O no hydrogen 2.822 N/A LEU 463.A N PRO 459.A O no hydrogen 3.374 N/A ARG 464.A N THR 460.A O no hydrogen 3.316 N/A LEU 465.A N ALA 461.A O no hydrogen 3.087 N/A THR 466.A N GLU 462.A O no hydrogen 2.937 N/A THR 466.A OG1 GLU 462.A O no hydrogen 3.526 N/A THR 466.A OG1 LEU 463.A O no hydrogen 3.097 N/A MET 467.A N LEU 463.A O no hydrogen 2.966 N/A GLN 468.A N ARG 464.A O no hydrogen 2.876 N/A LYS 469.A N LEU 465.A O no hydrogen 3.028 N/A THR 470.A N THR 466.A O no hydrogen 2.822 N/A THR 470.A OG1 THR 466.A O no hydrogen 2.584 N/A MET 471.A N MET 467.A O no hydrogen 3.013 N/A GLN 472.A N GLN 468.A O no hydrogen 3.247 N/A LYS 473.A N LYS 469.A O no hydrogen 3.052 N/A HIS 474.A N THR 470.A O no hydrogen 3.069 N/A HIS 474.A ND1 THR 470.A O no hydrogen 2.676 N/A ALA 475.A N MET 471.A O no hydrogen 2.999 N/A ARG 479.A N ALA 545.A O no hydrogen 2.964 N/A ARG 479.A NE GLY 476.A O no hydrogen 2.784 N/A ARG 479.A NH1 GLU 242.A O no hydrogen 2.799 N/A ARG 480.A NH1 ASP 482.A OD2 no hydrogen 3.076 N/A GLY 481.A N ASP 548.A OD1 no hydrogen 2.825 N/A ASP 482.A N ASP 482.A OD2 no hydrogen 2.483 N/A LEU 484.A N ARG 480.A O no hydrogen 2.847 N/A ALA 485.A N GLY 481.A O no hydrogen 3.096 N/A GLU 486.A N ASP 482.A O no hydrogen 2.625 N/A GLY 487.A N ILE 483.A O no hydrogen 2.878 N/A VAL 488.A N LEU 484.A O no hydrogen 2.821 N/A LYS 489.A N ALA 485.A O no hydrogen 3.345 N/A LYS 489.A NZ ASP 493.A OD1 no hydrogen 3.371 N/A LYS 490.A N GLU 486.A O no hydrogen 3.082 N/A MET 491.A N GLY 487.A O no hydrogen 2.990 N/A MET 492.A N VAL 488.A O no hydrogen 2.967 N/A ASP 493.A N LYS 489.A O no hydrogen 3.054 N/A LEU 494.A N LYS 490.A O no hydrogen 3.065 N/A PHE 495.A N MET 491.A O no hydrogen 2.950 N/A LYS 496.A N MET 492.A O no hydrogen 3.159 N/A GLU 497.A N ASP 493.A O no hydrogen 2.712 N/A LYS 499.A N LYS 496.A O no hydrogen 3.045 N/A ARG 500.A N GLU 497.A O no hydrogen 2.775 N/A ARG 500.A NE ASP 457.A OD1 no hydrogen 2.989 N/A ARG 500.A NH2 ASP 457.A OD1 no hydrogen 2.521 N/A LYS 502.A N VAL 458.A O no hydrogen 2.664 N/A THR 503.A N ALA 454.A O no hydrogen 3.334 N/A THR 503.A OG1 VAL 451.A O no hydrogen 2.968 N/A THR 503.A OG1 ARG 452.A O no hydrogen 2.961 N/A THR 504.A N ASP 513.A OD2 no hydrogen 2.869 N/A ASP 505.A N ASP 513.A OD2 no hydrogen 3.170 N/A ARG 506.A NE ARG 452.A O no hydrogen 3.070 N/A ARG 506.A NH2 ARG 452.A O no hydrogen 3.268 N/A ARG 506.A NH2 ALA 454.A O no hydrogen 2.806 N/A SER 507.A N ASP 505.A OD2 no hydrogen 2.749 N/A SER 507.A OG ASP 505.A OD1 no hydrogen 3.299 N/A SER 507.A OG ASP 505.A OD2 no hydrogen 2.433 N/A TRP 510.A N LEU 190.A O no hydrogen 2.610 N/A TRP 510.A NE1 GLU 169.A OE1 no hydrogen 3.068 N/A ASN 511.A ND2 ASP 505.A O no hydrogen 2.948 N/A ASN 511.A ND2 SER 507.A O no hydrogen 2.624 N/A LEU 514.A N ASN 511.A OD1 no hydrogen 3.156 N/A THR 515.A N ASN 511.A O no hydrogen 3.456 N/A THR 515.A OG1 ASN 511.A O no hydrogen 3.326 N/A GLU 516.A N SER 512.A O no hydrogen 2.967 N/A SER 517.A N ASP 513.A O no hydrogen 2.980 N/A SER 517.A N LEU 514.A O no hydrogen 2.985 N/A SER 517.A OG THR 460.A OG1 no hydrogen 2.735 N/A SER 517.A OG ASP 513.A O no hydrogen 3.145 N/A LEU 518.A N LEU 514.A O no hydrogen 2.906 N/A GLU 519.A N THR 515.A O no hydrogen 2.665 N/A LEU 520.A N GLU 516.A O no hydrogen 3.090 N/A GLN 521.A N SER 517.A O no hydrogen 3.091 N/A ASN 522.A N LEU 518.A O no hydrogen 2.786 N/A LEU 523.A N GLU 519.A O no hydrogen 2.743 N/A MET 524.A N LEU 520.A O no hydrogen 2.963 N/A LEU 525.A N GLN 521.A O no hydrogen 3.426 N/A ASN 526.A N ASN 522.A O no hydrogen 3.468 N/A ASN 526.A ND2 GLY 225.A O no hydrogen 2.743 N/A ASN 526.A ND2 ASN 522.A O no hydrogen 2.851 N/A ALA 527.A N LEU 523.A O no hydrogen 2.748 N/A THR 528.A N MET 524.A O no hydrogen 2.758 N/A THR 528.A OG1 MET 524.A O no hydrogen 2.966 N/A THR 528.A OG1 LEU 525.A O no hydrogen 3.256 N/A GLN 529.A N LEU 525.A O no hydrogen 3.167 N/A GLN 529.A NE2 THR 232.A OG1 no hydrogen 2.693 N/A GLN 529.A NE2 GLN 582.A OE1 no hydrogen 3.119 N/A THR 530.A N ASN 526.A O no hydrogen 2.818 N/A THR 530.A OG1 TYR 210.A OH no hydrogen 3.113 N/A THR 530.A OG1 ASN 526.A O no hydrogen 2.721 N/A ILE 531.A N ALA 527.A O no hydrogen 3.001 N/A VAL 532.A N THR 528.A O no hydrogen 3.068 N/A ALA 534.A N THR 530.A O no hydrogen 3.056 N/A GLU 535.A N ILE 531.A O no hydrogen 2.814 N/A ASN 536.A N VAL 532.A O no hydrogen 3.100 N/A ASN 536.A N ALA 533.A O no hydrogen 3.292 N/A ASN 536.A ND2 TYR 593.A OH no hydrogen 2.786 N/A ARG 537.A N ALA 534.A O no hydrogen 3.268 N/A ARG 537.A NE GLU 242.A OE2 no hydrogen 2.925 N/A ARG 537.A NH1 GLU 539.A OE2 no hydrogen 2.794 N/A ARG 537.A NH1 TRP 574.A O no hydrogen 2.903 N/A ARG 537.A NH2 GLU 242.A OE2 no hydrogen 3.498 N/A ARG 537.A NH2 LYS 576.A O no hydrogen 2.933 N/A ARG 537.A NH2 THR 578.A OG1 no hydrogen 2.818 N/A LYS 538.A NZ ASN 536.A O no hydrogen 2.905 N/A SER 540.A N LYS 551.A O no hydrogen 3.159 N/A SER 540.A OG PHE 549.A O no hydrogen 2.957 N/A ARG 541.A N HIS 544.A O no hydrogen 2.842 N/A ARG 541.A NE GLU 539.A OE2 no hydrogen 2.763 N/A ARG 541.A NH1 ASP 82.A O no hydrogen 2.953 N/A ARG 541.A NH1 ASP 554.A OD1 no hydrogen 3.097 N/A ARG 541.A NH2 ASP 554.A OD1 no hydrogen 2.911 N/A GLY 542.A N ASP 82.A OD1 no hydrogen 2.973 N/A ALA 543.A N ALA 401.A O no hydrogen 2.947 N/A HIS 544.A N ARG 541.A O no hydrogen 3.138 N/A ARG 546.A N SER 540.A OG no hydrogen 2.847 N/A ARG 546.A NE ASP 548.A OD2 no hydrogen 3.014 N/A ARG 546.A NH1 ASP 548.A OD1 no hydrogen 2.924 N/A ARG 546.A NH1 ASP 548.A OD2 no hydrogen 3.321 N/A ARG 546.A NH2 ALA 534.A O no hydrogen 3.561 N/A ARG 546.A NH2 GLU 535.A O no hydrogen 2.931 N/A ASP 547.A N ARG 479.A O no hydrogen 2.911 N/A ASP 548.A N ASP 548.A OD2 no hydrogen 2.575 N/A PHE 549.A N ARG 546.A O no hydrogen 3.151 N/A ARG 552.A NE ASP 554.A OD1 no hydrogen 3.247 N/A ARG 552.A NE ASP 554.A OD2 no hydrogen 2.862 N/A ARG 552.A NH1 ASP 82.A OD2 no hydrogen 2.696 N/A ARG 552.A NH1 ILE 612.A O no hydrogen 2.912 N/A ARG 552.A NH2 ASP 554.A OD2 no hydrogen 2.766 N/A ARG 552.A NH2 ILE 612.A O no hydrogen 2.817 N/A GLU 553.A N GLU 539.A OE1 no hydrogen 3.117 N/A ASP 557.A N GLN 565.A OE1 no hydrogen 3.315 N/A TYR 558.A OH GLU 555.A OE1 no hydrogen 2.770 N/A TYR 558.A OH GLU 555.A OE2 no hydrogen 2.650 N/A SER 559.A N ASP 557.A OD1 no hydrogen 2.826 N/A SER 559.A OG ASP 557.A OD1 no hydrogen 2.938 N/A LYS 560.A N ASP 557.A OD1 no hydrogen 3.478 N/A GLN 565.A N ILE 562.A O no hydrogen 3.213 N/A GLN 565.A NE2 ASP 557.A O no hydrogen 3.194 N/A GLN 565.A NE2 PRO 561.A O no hydrogen 3.161 N/A ARG 568.A N GLU 555.A O no hydrogen 2.916 N/A LYS 572.A N PRO 569.A O no hydrogen 3.022 N/A TRP 574.A N GLU 553.A O no hydrogen 2.792 N/A ARG 575.A NE TRP 83.A O no hydrogen 3.173 N/A ARG 575.A NH1 GLU 555.A OE2 no hydrogen 2.867 N/A ARG 575.A NH2 ASP 598.A OD2 no hydrogen 2.639 N/A LYS 576.A NZ PHE 570.A O no hydrogen 2.955 N/A LYS 576.A NZ HIS 573.A O no hydrogen 3.057 N/A HIS 577.A N ARG 594.A O no hydrogen 2.821 N/A HIS 577.A ND1 ASP 240.A OD1 no hydrogen 2.664 N/A HIS 577.A NE2 ASP 86.A OD1 no hydrogen 2.731 N/A THR 578.A N ASP 240.A OD2 no hydrogen 2.728 N/A THR 578.A OG1 GLU 242.A OE2 no hydrogen 2.388 N/A LEU 579.A N ASP 592.A O no hydrogen 3.157 N/A THR 580.A N LEU 238.A O no hydrogen 3.020 N/A THR 580.A OG1 LEU 238.A O no hydrogen 3.489 N/A THR 580.A OG1 GLN 529.A OE1 no hydrogen 2.806 N/A LYS 581.A N THR 590.A O no hydrogen 2.930 N/A GLN 582.A NE2 THR 528.A OG1 no hydrogen 2.720 N/A GLN 582.A NE2 GLY 587.A O no hydrogen 3.233 N/A ASP 583.A N HIS 588.A O no hydrogen 3.047 N/A ARG 585.A N ASP 583.A OD1 no hydrogen 3.211 N/A THR 586.A N ASP 583.A OD1 no hydrogen 3.473 N/A GLY 587.A N ASP 583.A O no hydrogen 2.633 N/A HIS 588.A N THR 586.A OG1 no hydrogen 3.340 N/A THR 590.A N LYS 581.A O no hydrogen 2.881 N/A ASP 592.A N LEU 579.A O no hydrogen 3.156 N/A TYR 593.A N ASP 592.A OD1 no hydrogen 2.815 N/A ARG 594.A N HIS 577.A O no hydrogen 3.024 N/A ARG 594.A NE ASP 381.A OD1 no hydrogen 2.668 N/A ARG 594.A NH2 ASP 381.A OD1 no hydrogen 3.557 N/A ARG 594.A NH2 ASP 381.A OD2 no hydrogen 2.853 N/A ILE 597.A N ASP 86.A OD1 no hydrogen 3.029 N/A THR 600.A OG1 VAL 606.A O no hydrogen 3.053 N/A GLU 605.A N ASP 602.A O no hydrogen 3.024 N/A VAL 606.A N ASP 602.A O no hydrogen 2.983 N/A ILE 609.A N GLN 87.A OE1 no hydrogen 3.143 N/A ARG 614.A NE LYS 79.A O no hydrogen 2.822 N/A ARG 614.A NH1 ASP 292.A OD1 no hydrogen 3.522 N/A ARG 614.A NH2 GLY 80.A O no hydrogen 3.286 N/A ARG 614.A NH2 ASP 292.A OD1 no hydrogen 2.884 N/A