Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c9c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N SER 1.A O no hydrogen 2.959 N/A VAL 6.A N PHE 2.A O no hydrogen 2.862 N/A GLU 7.A N ASP 3.A O no hydrogen 3.057 N/A GLU 8.A N ASP 4.A O no hydrogen 2.814 N/A ARG 9.A N ALA 5.A O no hydrogen 2.808 N/A ARG 9.A NH1 GLU 13.A OE2 no hydrogen 3.497 N/A VAL 10.A N VAL 6.A O no hydrogen 2.978 N/A ILE 11.A N GLU 7.A O no hydrogen 2.786 N/A ASN 12.A N GLU 8.A O no hydrogen 2.916 N/A GLU 13.A N ARG 9.A O no hydrogen 3.035 N/A GLU 14.A N VAL 10.A O no hydrogen 2.951 N/A TYR 15.A N ILE 11.A O no hydrogen 2.937 N/A LYS 16.A N ASN 12.A O no hydrogen 3.235 N/A LYS 16.A NZ GLU 13.A OE2 no hydrogen 2.747 N/A ILE 17.A N GLU 13.A O no hydrogen 3.419 N/A TRP 18.A N GLU 14.A O no hydrogen 2.826 N/A TRP 18.A NE1 TYR 26.A OH no hydrogen 3.121 N/A LYS 19.A N TYR 15.A O no hydrogen 3.085 N/A LYS 20.A N LYS 16.A O no hydrogen 3.146 N/A ASN 21.A N ILE 17.A O no hydrogen 3.017 N/A ASN 21.A N TRP 18.A O no hydrogen 2.733 N/A THR 22.A N TRP 18.A O no hydrogen 2.825 N/A THR 22.A N LYS 19.A O no hydrogen 3.133 N/A THR 22.A OG1 TRP 18.A O no hydrogen 3.483 N/A PHE 24.A N ASN 21.A O no hydrogen 2.673 N/A LEU 25.A N ASN 21.A O no hydrogen 3.260 N/A TYR 26.A N THR 22.A O no hydrogen 2.947 N/A ASP 27.A N GLN 372.A O no hydrogen 2.850 N/A LEU 28.A N GLN 372.A O no hydrogen 3.392 N/A MET 30.A N VAL 370.A O no hydrogen 2.860 N/A SER 38.A OG THR 40.A O no hydrogen 2.949 N/A SER 38.A OG GLY 63.A O no hydrogen 2.939 N/A THR 40.A OG1 ALA 107.A O no hydrogen 3.420 N/A ALA 41.A N ASP 348.A OD2 no hydrogen 2.964 N/A TRP 43.A N SER 350.A OG no hydrogen 3.297 N/A TRP 43.A NE1 SER 350.A O no hydrogen 2.960 N/A LEU 44.A N ARG 59.A O no hydrogen 2.874 N/A THR 48.A N VAL 57.A O no hydrogen 2.765 N/A ASP 54.A N ASP 54.A OD1 no hydrogen 2.694 N/A SER 56.A N LEU 80.A O no hydrogen 2.917 N/A SER 56.A OG HIS 58.A NE2 no hydrogen 3.219 N/A SER 56.A OG LEU 80.A O no hydrogen 3.512 N/A VAL 57.A N THR 48.A O no hydrogen 2.551 N/A HIS 58.A N VAL 78.A O no hydrogen 2.831 N/A ARG 59.A NE ASP 46.A OD2 no hydrogen 3.094 N/A ARG 59.A NH2 ASP 46.A OD2 no hydrogen 3.273 N/A ARG 59.A NH2 TYR 131.A OH no hydrogen 2.791 N/A LEU 60.A N ALA 76.A O no hydrogen 2.755 N/A ILE 61.A N GLN 42.A O no hydrogen 2.792 N/A LEU 62.A N LEU 74.A O no hydrogen 2.810 N/A GLY 63.A N SER 38.A OG no hydrogen 2.807 N/A THR 64.A N HIS 72.A O no hydrogen 3.199 N/A THR 64.A OG1 ASN 71.A OD1 no hydrogen 3.288 N/A THR 64.A OG1 HIS 72.A O no hydrogen 3.553 N/A THR 66.A N ASN 71.A OD1 no hydrogen 3.118 N/A THR 66.A OG1 ASN 71.A OD1 no hydrogen 3.184 N/A SER 67.A OG ASP 68.A OD1 no hydrogen 3.324 N/A GLN 70.A NE2 ASN 71.A O no hydrogen 2.676 N/A GLN 70.A NE2 HIS 100.A O no hydrogen 3.201 N/A ASN 71.A ND2 THR 66.A O no hydrogen 3.319 N/A HIS 72.A N THR 64.A OG1 no hydrogen 2.570 N/A LEU 73.A N ILE 98.A O no hydrogen 2.621 N/A LEU 74.A N LEU 62.A O no hydrogen 2.882 N/A ILE 75.A N ILE 96.A O no hydrogen 3.494 N/A ALA 76.A N LEU 60.A O no hydrogen 2.901 N/A SER 77.A N GLU 93.A O no hydrogen 2.916 N/A VAL 78.A N HIS 58.A O no hydrogen 2.567 N/A GLN 79.A N LYS 91.A O no hydrogen 2.875 N/A LEU 80.A N SER 56.A O no hydrogen 2.998 N/A SER 82.A N ASP 54.A O no hydrogen 3.064 N/A GLU 93.A N SER 77.A O no hydrogen 3.243 N/A ILE 98.A N LEU 73.A O no hydrogen 2.942 N/A HIS 100.A N ASN 71.A O no hydrogen 2.637 N/A HIS 100.A ND1 GLY 102.A O no hydrogen 2.643 N/A VAL 104.A N THR 64.A O no hydrogen 3.401 N/A ASN 105.A N LYS 120.A O no hydrogen 2.929 N/A ASN 105.A ND2 GLY 149.A O no hydrogen 3.128 N/A ALA 107.A N THR 40.A OG1 no hydrogen 3.108 N/A ARG 108.A N ALA 118.A O no hydrogen 3.035 N/A ARG 108.A NH1 THR 40.A OG1 no hydrogen 2.697 N/A ARG 108.A NH1 ALA 107.A O no hydrogen 2.793 N/A ARG 108.A NH2 ASP 348.A OD2 no hydrogen 3.092 N/A TYR 109.A N GLN 42.A OE1 no hydrogen 2.869 N/A MET 110.A N VAL 116.A O no hydrogen 2.779 N/A GLN 112.A NE2 ASN 155.A O no hydrogen 2.818 N/A GLN 112.A NE2 PRO 156.A O no hydrogen 2.625 N/A ASN 113.A N MET 110.A O no hydrogen 2.828 N/A CYS 115.A N ASN 113.A OD1 no hydrogen 3.012 N/A CYS 115.A SG ASP 130.A OD1 no hydrogen 2.629 N/A CYS 115.A SG THR 132.A OG1 no hydrogen 3.274 N/A VAL 116.A N ASN 113.A O no hydrogen 2.811 N/A ILE 117.A N PHE 129.A O no hydrogen 2.865 N/A ALA 118.A N ARG 108.A O no hydrogen 2.802 N/A THR 119.A N LEU 127.A O no hydrogen 2.664 N/A LYS 120.A N ARG 106.A O no hydrogen 3.113 N/A LYS 120.A NZ ALA 165.A O no hydrogen 2.627 N/A THR 121.A OG1 ASP 125.A O no hydrogen 3.496 N/A ASP 125.A N SER 123.A OG no hydrogen 2.853 N/A VAL 126.A N LEU 142.A O no hydrogen 3.493 N/A LEU 127.A N THR 119.A O no hydrogen 3.144 N/A VAL 128.A N LEU 140.A O no hydrogen 3.187 N/A PHE 129.A N ILE 117.A O no hydrogen 2.934 N/A ASP 130.A N ASP 139.A OD2 no hydrogen 2.935 N/A TYR 131.A N CYS 115.A O no hydrogen 3.214 N/A THR 132.A N ASP 130.A O no hydrogen 2.537 N/A LYS 133.A N ASP 130.A O no hydrogen 2.851 N/A HIS 134.A NE2 ASP 139.A OD2 no hydrogen 3.206 N/A LEU 140.A N VAL 128.A O no hydrogen 3.349 N/A ARG 141.A N ARG 184.A O no hydrogen 2.638 N/A ARG 141.A NH1 GLU 101.A OE1 no hydrogen 2.849 N/A ARG 141.A NH2 GLU 101.A OE1 no hydrogen 2.686 N/A ARG 141.A NH2 GLU 101.A OE2 no hydrogen 3.088 N/A ARG 143.A N ILE 186.A O no hydrogen 3.054 N/A ARG 143.A NH2 ASP 125.A OD1 no hydrogen 2.652 N/A GLY 144.A N ASP 187.A O no hydrogen 2.802 N/A HIS 145.A N ARG 143.A O no hydrogen 2.692 N/A SER 153.A N LEU 163.A O no hydrogen 2.873 N/A TRP 154.A NE1 ARG 108.A O no hydrogen 3.033 N/A ASN 155.A N TYR 161.A O no hydrogen 2.790 N/A ASN 157.A ND2 LEU 206.A O no hydrogen 3.424 N/A TYR 161.A N LEU 158.A O no hydrogen 2.948 N/A LEU 162.A N TRP 174.A O no hydrogen 3.142 N/A LEU 163.A N SER 153.A O no hydrogen 2.824 N/A SER 164.A N CYS 172.A O no hydrogen 3.193 N/A ALA 165.A N GLY 151.A O no hydrogen 2.909 N/A SER 166.A OG LYS 147.A O no hydrogen 3.225 N/A SER 166.A OG GLU 148.A O no hydrogen 3.171 N/A SER 166.A OG ASP 168.A OD2 no hydrogen 2.853 N/A ASP 167.A N GLU 148.A O no hydrogen 2.873 N/A ASP 168.A N SER 166.A OG no hydrogen 3.173 N/A THR 170.A N ASP 168.A OD1 no hydrogen 2.732 N/A THR 170.A OG1 ASP 168.A OD1 no hydrogen 2.215 N/A ILE 171.A N PHE 192.A O no hydrogen 3.085 N/A CYS 172.A N SER 164.A O no hydrogen 3.176 N/A LEU 173.A N ASN 190.A O no hydrogen 3.100 N/A TRP 174.A N LEU 162.A O no hydrogen 3.303 N/A ILE 176.A N GLY 160.A O no hydrogen 2.975 N/A ASN 177.A N ASP 175.A OD1 no hydrogen 2.699 N/A ASN 177.A ND2 ASN 159.A O no hydrogen 2.731 N/A ASN 177.A ND2 ASN 159.A OD1 no hydrogen 3.543 N/A VAL 185.A N LYS 181.A O no hydrogen 2.647 N/A ILE 186.A N ARG 141.A O no hydrogen 2.845 N/A PHE 192.A N ILE 171.A O no hydrogen 2.674 N/A THR 193.A N THR 231.A O no hydrogen 3.030 N/A HIS 195.A ND1 ASP 218.A OD1 no hydrogen 2.599 N/A HIS 195.A NE2 SER 214.A OG no hydrogen 2.871 N/A VAL 199.A N SER 166.A O no hydrogen 2.972 N/A GLU 200.A N VAL 215.A O no hydrogen 2.703 N/A ASP 201.A N VAL 215.A O no hydrogen 3.149 N/A ALA 203.A N GLY 213.A O no hydrogen 2.898 N/A TRP 204.A N SER 153.A OG no hydrogen 3.075 N/A HIS 205.A N LEU 211.A O no hydrogen 2.836 N/A HIS 205.A NE2 GLU 255.A O no hydrogen 2.994 N/A LEU 207.A N HIS 205.A ND1 no hydrogen 2.998 N/A HIS 208.A N HIS 205.A ND1 no hydrogen 3.219 N/A LEU 211.A N HIS 208.A O no hydrogen 2.905 N/A PHE 212.A N TRP 224.A O no hydrogen 3.176 N/A GLY 213.A N ALA 203.A O no hydrogen 2.874 N/A SER 214.A N MET 222.A O no hydrogen 2.813 N/A SER 214.A OG HIS 195.A NE2 no hydrogen 2.871 N/A SER 214.A OG MET 222.A O no hydrogen 3.567 N/A VAL 215.A N ASP 201.A O no hydrogen 3.190 N/A ALA 216.A N LYS 220.A O no hydrogen 3.377 N/A ASP 217.A N VAL 198.A O no hydrogen 2.868 N/A LYS 220.A N ASP 218.A OD2 no hydrogen 3.017 N/A LEU 221.A N VAL 238.A O no hydrogen 2.877 N/A MET 222.A N SER 214.A O no hydrogen 3.074 N/A ILE 223.A N HIS 236.A O no hydrogen 3.072 N/A TRP 224.A N PHE 212.A O no hydrogen 2.665 N/A TRP 224.A NE1 SER 214.A OG no hydrogen 2.838 N/A THR 226.A N SER 210.A O no hydrogen 3.118 N/A ARG 227.A N ASP 225.A OD1 no hydrogen 2.701 N/A ARG 227.A NE ASP 225.A OD1 no hydrogen 2.976 N/A ARG 227.A NE ASP 225.A OD2 no hydrogen 3.081 N/A ARG 227.A NH2 ASP 225.A OD2 no hydrogen 2.531 N/A ASN 228.A N ASP 225.A O no hydrogen 2.708 N/A THR 231.A OG1 ILE 191.A O no hydrogen 2.555 N/A LYS 233.A N ASN 230.A O no hydrogen 3.468 N/A HIS 236.A N ILE 223.A O no hydrogen 3.249 N/A VAL 238.A N LEU 221.A O no hydrogen 2.676 N/A HIS 241.A ND1 ASP 264.A OD2 no hydrogen 2.721 N/A HIS 241.A NE2 THR 260.A OG1 no hydrogen 2.673 N/A THR 242.A N ASP 264.A OD2 no hydrogen 3.488 N/A VAL 245.A N ALA 216.A O no hydrogen 3.230 N/A ASN 246.A N GLY 261.A O no hydrogen 2.839 N/A ASN 246.A ND2 GLU 288.A OE1 no hydrogen 2.810 N/A ASN 246.A ND2 ILE 289.A O no hydrogen 2.999 N/A CYS 247.A N GLY 261.A O no hydrogen 3.230 N/A CYS 247.A SG GLY 261.A O no hydrogen 3.855 N/A CYS 247.A SG ILE 289.A O no hydrogen 3.941 N/A LEU 248.A N ASP 201.A OD2 no hydrogen 3.501 N/A SER 249.A N ALA 259.A O no hydrogen 2.849 N/A ASN 251.A N ILE 257.A O no hydrogen 3.206 N/A TYR 253.A OH PRO 296.A O no hydrogen 2.519 N/A SER 254.A N ASN 251.A O no hydrogen 2.998 N/A PHE 256.A N SER 254.A OG no hydrogen 2.714 N/A ILE 257.A N SER 254.A OG no hydrogen 2.657 N/A LEU 258.A N TRP 270.A O no hydrogen 2.613 N/A THR 260.A N ALA 268.A O no hydrogen 2.934 N/A THR 260.A OG1 HIS 241.A NE2 no hydrogen 2.673 N/A GLY 261.A N CYS 247.A O no hydrogen 2.798 N/A SER 262.A N THR 266.A O no hydrogen 2.913 N/A SER 262.A OG GLU 244.A O no hydrogen 2.698 N/A ALA 263.A N GLU 244.A O no hydrogen 2.798 N/A ASP 264.A N SER 262.A OG no hydrogen 2.998 N/A LYS 265.A N SER 262.A O no hydrogen 3.264 N/A VAL 267.A N PHE 282.A O no hydrogen 3.370 N/A ALA 268.A N THR 260.A O no hydrogen 2.693 N/A LEU 269.A N HIS 280.A O no hydrogen 2.979 N/A TRP 270.A N LEU 258.A O no hydrogen 3.059 N/A TRP 270.A NE1 THR 260.A OG1 no hydrogen 2.819 N/A LEU 272.A N PHE 256.A O no hydrogen 2.784 N/A ARG 273.A N ASP 271.A OD1 no hydrogen 2.646 N/A ARG 273.A NE ASP 271.A OD1 no hydrogen 3.186 N/A ARG 273.A NE ASP 271.A OD2 no hydrogen 3.282 N/A ARG 273.A NH2 ASP 271.A OD2 no hydrogen 2.854 N/A ASN 274.A N ASP 271.A O no hydrogen 2.967 N/A LEU 277.A N ASN 274.A O no hydrogen 3.241 N/A LYS 278.A NZ ALA 240.A O no hydrogen 3.045 N/A PHE 282.A N VAL 267.A O no hydrogen 2.970 N/A SER 284.A OG GLU 283.A O no hydrogen 2.425 N/A HIS 285.A ND1 ASP 308.A OD1 no hydrogen 3.162 N/A HIS 285.A ND1 ASP 308.A OD2 no hydrogen 3.191 N/A HIS 285.A NE2 SER 304.A OG no hydrogen 2.817 N/A GLU 288.A N ASP 287.A OD1 no hydrogen 2.675 N/A ILE 289.A N SER 262.A O no hydrogen 3.312 N/A PHE 290.A N SER 305.A O no hydrogen 3.007 N/A GLN 291.A N SER 305.A O no hydrogen 3.147 N/A GLN 291.A NE2 ASP 348.A OD1 no hydrogen 2.718 N/A VAL 292.A N GLN 291.A OE1 no hydrogen 2.678 N/A GLN 293.A N ALA 303.A O no hydrogen 2.925 N/A GLN 293.A NE2 GLN 291.A OE1 no hydrogen 2.571 N/A TRP 294.A NE1 SER 249.A O no hydrogen 2.949 N/A SER 295.A N ILE 301.A O no hydrogen 2.943 N/A HIS 297.A N SER 295.A OG no hydrogen 2.909 N/A HIS 297.A NE2 ASN 352.A O no hydrogen 3.169 N/A ASN 298.A N SER 295.A OG no hydrogen 2.964 N/A THR 300.A OG1 ASP 315.A OD1 no hydrogen 2.762 N/A ILE 301.A N ASN 298.A O no hydrogen 3.021 N/A LEU 302.A N TRP 314.A O no hydrogen 2.925 N/A ALA 303.A N GLN 293.A O no hydrogen 2.775 N/A SER 304.A N HIS 312.A O no hydrogen 2.854 N/A SER 304.A OG HIS 285.A NE2 no hydrogen 2.817 N/A SER 305.A N GLN 291.A O no hydrogen 3.007 N/A THR 307.A N GLU 288.A O no hydrogen 2.995 N/A LEU 311.A N HIS 339.A O no hydrogen 3.215 N/A HIS 312.A N SER 304.A O no hydrogen 2.742 N/A VAL 313.A N PHE 337.A O no hydrogen 2.905 N/A TRP 314.A N LEU 302.A O no hydrogen 2.712 N/A TRP 314.A NE1 SER 304.A OG no hydrogen 2.820 N/A ASP 315.A N GLU 334.A O no hydrogen 2.790 N/A LEU 316.A N THR 300.A O no hydrogen 2.591 N/A SER 317.A N THR 300.A OG1 no hydrogen 2.922 N/A SER 317.A N ASP 315.A OD1 no hydrogen 3.152 N/A SER 317.A OG ASP 315.A OD1 no hydrogen 2.533 N/A SER 317.A OG ASP 315.A OD2 no hydrogen 2.926 N/A LYS 318.A N ASP 315.A O no hydrogen 3.038 N/A ILE 319.A N LEU 316.A O no hydrogen 2.801 N/A GLN 323.A NE2 GLY 331.A O no hydrogen 3.522 N/A ASP 327.A N SER 324.A O no hydrogen 2.451 N/A ALA 328.A N SER 324.A O no hydrogen 2.547 N/A LEU 335.A N PRO 332.A O no hydrogen 3.100 N/A LEU 336.A N VAL 313.A O no hydrogen 2.863 N/A PHE 337.A N VAL 313.A O no hydrogen 3.209 N/A HIS 339.A N LEU 311.A O no hydrogen 2.789 N/A HIS 342.A NE2 SER 361.A OG no hydrogen 2.577 N/A ILE 346.A N GLY 306.A O no hydrogen 3.324 N/A SER 347.A N VAL 362.A O no hydrogen 2.838 N/A SER 347.A OG SER 38.A O no hydrogen 3.520 N/A PHE 349.A N ASP 348.A OD1 no hydrogen 2.654 N/A SER 350.A N CYS 360.A O no hydrogen 2.879 N/A TRP 351.A NE1 GLN 293.A O no hydrogen 3.038 N/A ASN 352.A N ILE 358.A O no hydrogen 2.819 N/A ASN 354.A N ASN 352.A OD1 no hydrogen 2.880 N/A ASN 354.A ND2 PRO 45.A O no hydrogen 2.865 N/A GLU 355.A N ASN 352.A OD1 no hydrogen 3.012 N/A ILE 358.A N GLU 355.A O no hydrogen 2.902 N/A ILE 359.A N TRP 371.A O no hydrogen 2.857 N/A CYS 360.A N SER 350.A O no hydrogen 2.904 N/A CYS 360.A SG GLN 369.A O no hydrogen 3.880 N/A SER 361.A N GLN 369.A O no hydrogen 3.001 N/A SER 361.A OG HIS 342.A NE2 no hydrogen 2.577 N/A VAL 362.A N ASP 348.A O no hydrogen 2.840 N/A SER 363.A N ILE 367.A O no hydrogen 3.045 N/A SER 363.A OG LYS 345.A O no hydrogen 3.100 N/A GLU 364.A N LYS 345.A O no hydrogen 3.153 N/A ASN 366.A N SER 363.A O no hydrogen 3.261 N/A ILE 367.A N ASP 365.A OD1 no hydrogen 3.019 N/A MET 368.A N HIS 32.A O no hydrogen 2.741 N/A GLN 369.A N SER 361.A O no hydrogen 3.063 N/A GLN 369.A NE2 THR 31.A OG1 no hydrogen 3.216 N/A VAL 370.A N MET 30.A O no hydrogen 2.945 N/A TRP 371.A N ILE 359.A O no hydrogen 2.973 N/A TRP 371.A NE1 SER 361.A OG no hydrogen 2.986 N/A GLN 372.A N LEU 28.A O no hydrogen 2.866 N/A GLN 372.A NE2 PRO 356.A O no hydrogen 2.985 N/A ALA 374.A N LEU 25.A O no hydrogen 2.593 N/A GLU 375.A N ASP 27.A OD2 no hydrogen 2.628 N/A VAL 377.A N ALA 374.A O no hydrogen 2.924 N/A TYR 378.A N GLU 375.A O no hydrogen 3.051 N/A ASP 380.A N ASN 379.A OD1 no hydrogen 2.456 N/A