Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ce8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 14.A OG TYR 296.A O no hydrogen 2.571 N/A PHE 15.A N GLN 260.A O no hydrogen 2.910 N/A HIS 16.A N GLN 24.A O no hydrogen 2.728 N/A HIS 16.A NE2 ASP 257.A OD2 no hydrogen 2.723 N/A VAL 17.A N LYS 258.A O no hydrogen 2.848 N/A THR 18.A N GLN 22.A O no hydrogen 3.013 N/A THR 18.A OG1 ASP 20.A OD1 no hydrogen 2.776 N/A THR 18.A OG1 GLN 22.A O no hydrogen 3.489 N/A GLN 22.A N ASP 20.A OD1 no hydrogen 3.149 N/A GLN 24.A N HIS 16.A O no hydrogen 2.918 N/A VAL 26.A N SER 14.A O no hydrogen 3.008 N/A ALA 32.A N PRO 29.A O no hydrogen 3.086 N/A ILE 38.A N GLY 35.A O no hydrogen 2.984 N/A ARG 40.A N ILE 336.A O no hydrogen 2.803 N/A ARG 40.A NE TYR 337.A OXT no hydrogen 3.101 N/A ARG 40.A NH1 PHE 3.A O no hydrogen 3.033 N/A HIS 41.A N ILE 336.A O no hydrogen 3.356 N/A ARG 43.A N GLU 334.A O no hydrogen 2.933 N/A ILE 45.A N VAL 332.A O no hydrogen 2.786 N/A ASN 46.A N VAL 332.A O no hydrogen 3.356 N/A LEU 48.A N ALA 330.A O no hydrogen 2.763 N/A HIS 50.A N LEU 48.A O no hydrogen 2.853 N/A HIS 50.A NE2 THR 68.A O no hydrogen 3.094 N/A GLY 51.A N LYS 328.A O no hydrogen 2.835 N/A VAL 54.A N SER 325.A O no hydrogen 3.204 N/A CYS 55.A N GLY 69.A O no hydrogen 3.111 N/A CYS 55.A SG VAL 53.A O no hydrogen 3.770 N/A THR 58.A N TYR 67.A O no hydrogen 2.978 N/A THR 58.A OG1 CYS 103.A O no hydrogen 2.724 N/A ILE 59.A N ASP 313.A OD2 no hydrogen 3.119 N/A SER 60.A N HIS 65.A O no hydrogen 2.835 N/A SER 60.A OG PRO 62.A O no hydrogen 2.607 N/A SER 60.A OG HIS 65.A O no hydrogen 3.157 N/A ARG 64.A N SER 60.A OG no hydrogen 3.069 N/A HIS 65.A N SER 60.A OG no hydrogen 2.931 N/A VAL 66.A N TRP 77.A O no hydrogen 2.911 N/A TYR 67.A N THR 58.A O no hydrogen 2.779 N/A THR 68.A N LYS 75.A O no hydrogen 3.001 N/A GLY 69.A N ALA 56.A O no hydrogen 2.810 N/A GLY 70.A N CYS 73.A O no hydrogen 3.033 N/A GLY 72.A N ASN 98.A O no hydrogen 2.773 N/A VAL 74.A N LEU 91.A O no hydrogen 2.878 N/A LYS 75.A N THR 68.A O no hydrogen 2.958 N/A LYS 75.A NZ HIS 50.A O no hydrogen 2.723 N/A VAL 76.A N SER 89.A O no hydrogen 2.889 N/A TRP 77.A N VAL 66.A O no hydrogen 2.922 N/A TRP 77.A NE1 THR 68.A OG1 no hydrogen 2.838 N/A ILE 79.A N ARG 64.A O no hydrogen 2.845 N/A SER 80.A N ASP 78.A OD1 no hydrogen 2.915 N/A SER 80.A OG ASP 78.A OD1 no hydrogen 2.634 N/A HIS 81.A ND1 ASP 78.A OD2 no hydrogen 2.775 N/A ASN 84.A N HIS 81.A O no hydrogen 3.023 N/A VAL 88.A N VAL 76.A O no hydrogen 2.720 N/A SER 89.A N VAL 76.A O no hydrogen 3.403 N/A GLN 90.A NE2 ASP 92.A OD1 no hydrogen 2.869 N/A LEU 91.A N VAL 74.A O no hydrogen 2.713 N/A CYS 93.A N GLY 72.A O no hydrogen 2.807 N/A CYS 93.A SG LEU 91.A O no hydrogen 3.532 N/A CYS 93.A SG SER 122.A OG no hydrogen 3.564 N/A LEU 94.A N GLY 72.A O no hydrogen 3.064 N/A ASP 97.A N ASN 95.A OD1 no hydrogen 3.097 N/A ASN 98.A N ASN 95.A O no hydrogen 2.727 N/A ILE 100.A N GLY 70.A O no hydrogen 2.878 N/A ARG 101.A N GLY 115.A O no hydrogen 2.890 N/A ARG 101.A NH1 GLU 117.A OE1 no hydrogen 3.033 N/A SER 102.A N GLY 115.A O no hydrogen 3.106 N/A CYS 103.A SG THR 58.A OG1 no hydrogen 3.646 N/A LYS 104.A N ILE 113.A O no hydrogen 2.848 N/A LEU 106.A N THR 111.A O no hydrogen 2.851 N/A GLY 109.A N LEU 106.A O no hydrogen 2.799 N/A CYS 110.A N ASP 108.A OD1 no hydrogen 3.146 N/A CYS 110.A SG ASP 108.A O no hydrogen 3.859 N/A CYS 110.A SG ASP 108.A OD2 no hydrogen 3.587 N/A LEU 112.A N TRP 124.A O no hydrogen 3.074 N/A ILE 113.A N LYS 104.A O no hydrogen 2.776 N/A VAL 114.A N SER 122.A O no hydrogen 2.914 N/A GLY 115.A N SER 102.A O no hydrogen 3.066 N/A GLU 117.A N TYR 99.A O no hydrogen 2.819 N/A ALA 118.A N GLY 116.A O no hydrogen 2.724 N/A SER 119.A OG SER 139.A O no hydrogen 3.421 N/A SER 119.A OG ALA 141.A O no hydrogen 3.021 N/A LEU 121.A N LEU 137.A O no hydrogen 2.773 N/A SER 122.A N VAL 114.A O no hydrogen 3.004 N/A ILE 123.A N ALA 135.A O no hydrogen 2.773 N/A TRP 124.A N LEU 112.A O no hydrogen 2.837 N/A TRP 124.A NE1 SER 122.A OG no hydrogen 2.910 N/A ASP 125.A N ARG 132.A O no hydrogen 2.659 N/A LEU 126.A N CYS 110.A O no hydrogen 2.676 N/A ALA 127.A N ASP 125.A OD1 no hydrogen 3.230 N/A ARG 132.A N ASP 125.A O no hydrogen 3.111 N/A ARG 132.A NH2 ASP 125.A OD2 no hydrogen 3.191 N/A LYS 134.A N ILE 123.A O no hydrogen 2.713 N/A ALA 135.A N ILE 123.A O no hydrogen 3.236 N/A LEU 137.A N LEU 121.A O no hydrogen 2.824 N/A SER 139.A N SER 119.A O no hydrogen 2.847 N/A ALA 143.A N SER 161.A OG no hydrogen 3.252 N/A CYS 144.A N GLY 116.A O no hydrogen 2.795 N/A CYS 144.A SG ALA 146.A O no hydrogen 3.566 N/A CYS 144.A SG SER 158.A OG no hydrogen 3.286 N/A TYR 145.A N CYS 159.A O no hydrogen 2.882 N/A LEU 147.A N SER 102.A OG no hydrogen 3.059 N/A ALA 148.A N PHE 157.A O no hydrogen 3.059 N/A SER 150.A N VAL 155.A O no hydrogen 2.945 N/A SER 150.A OG ASP 152.A OD1 no hydrogen 2.959 N/A SER 150.A OG VAL 155.A O no hydrogen 3.250 N/A SER 153.A N SER 150.A O no hydrogen 2.842 N/A LYS 154.A N ASP 152.A OD1 no hydrogen 3.042 N/A VAL 155.A N SER 150.A OG no hydrogen 2.979 N/A CYS 156.A N TRP 168.A O no hydrogen 2.954 N/A CYS 156.A SG PHE 157.A O no hydrogen 4.007 N/A PHE 157.A N ALA 148.A O no hydrogen 2.765 N/A SER 158.A N ALA 166.A O no hydrogen 2.791 N/A CYS 159.A N ALA 146.A O no hydrogen 2.896 N/A CYS 159.A SG CYS 188.A O no hydrogen 3.571 N/A CYS 160.A N ASN 164.A O no hydrogen 2.868 N/A CYS 160.A SG SER 158.A O no hydrogen 3.774 N/A SER 161.A N ALA 143.A O no hydrogen 3.024 N/A GLY 163.A N CYS 160.A O no hydrogen 2.970 N/A ASN 164.A N ASP 162.A OD1 no hydrogen 3.027 N/A ILE 165.A N PHE 179.A O no hydrogen 3.070 N/A ALA 166.A N SER 158.A O no hydrogen 2.831 N/A VAL 167.A N ARG 177.A O no hydrogen 2.929 N/A TRP 168.A N CYS 156.A O no hydrogen 2.784 N/A ASP 169.A N THR 174.A O no hydrogen 2.900 N/A LEU 170.A N LYS 154.A O no hydrogen 2.970 N/A ASN 172.A N ASP 169.A OD2 no hydrogen 3.397 N/A GLN 173.A NE2 LEU 170.A O no hydrogen 3.040 N/A THR 174.A N ASP 169.A O no hydrogen 3.309 N/A THR 174.A OG1 ASN 172.A O no hydrogen 3.120 N/A THR 174.A OG1 ASN 172.A OD1 no hydrogen 3.157 N/A VAL 176.A N VAL 167.A O no hydrogen 2.751 N/A ARG 177.A N VAL 167.A O no hydrogen 3.491 N/A PHE 179.A N ILE 165.A O no hydrogen 2.885 N/A HIS 182.A ND1 ASP 204.A OD1 no hydrogen 3.076 N/A HIS 182.A NE2 THR 200.A OG1 no hydrogen 2.703 N/A THR 183.A N ASP 204.A OD2 no hydrogen 2.962 N/A THR 183.A OG1 ASP 204.A OD2 no hydrogen 3.514 N/A GLY 185.A N ASP 184.A OD1 no hydrogen 2.740 N/A ALA 186.A N CYS 160.A O no hydrogen 3.127 N/A SER 187.A N GLY 201.A O no hydrogen 2.917 N/A SER 187.A OG GLY 201.A O no hydrogen 3.301 N/A SER 187.A OG ILE 227.A O no hydrogen 2.519 N/A CYS 188.A SG SER 187.A OG no hydrogen 3.613 N/A ASP 190.A N TRP 199.A O no hydrogen 2.874 N/A ILE 191.A N ASP 190.A OD1 no hydrogen 2.826 N/A SER 192.A N LYS 197.A O no hydrogen 2.848 N/A SER 192.A OG ASP 194.A OD2 no hydrogen 2.796 N/A SER 192.A OG LYS 197.A O no hydrogen 3.515 N/A GLY 195.A N SER 192.A O no hydrogen 2.987 N/A THR 196.A N ASP 194.A OD2 no hydrogen 3.080 N/A THR 196.A OG1 ASP 194.A OD1 no hydrogen 3.299 N/A THR 196.A OG1 ASP 194.A OD2 no hydrogen 2.670 N/A LYS 197.A N SER 192.A OG no hydrogen 3.164 N/A LYS 197.A NZ THR 196.A OG1 no hydrogen 3.253 N/A LEU 198.A N TRP 210.A O no hydrogen 2.901 N/A TRP 199.A N ASP 190.A O no hydrogen 2.834 N/A THR 200.A N ARG 208.A O no hydrogen 2.884 N/A THR 200.A OG1 HIS 182.A NE2 no hydrogen 2.703 N/A GLY 201.A N CYS 188.A O no hydrogen 3.093 N/A GLY 202.A N THR 206.A O no hydrogen 2.865 N/A LEU 203.A N GLY 185.A O no hydrogen 2.945 N/A ASN 205.A N GLY 202.A O no hydrogen 3.154 N/A ASN 205.A ND2 PHE 223.A O no hydrogen 3.569 N/A THR 206.A N ASP 204.A OD1 no hydrogen 3.341 N/A THR 206.A OG1 ASP 204.A OD1 no hydrogen 2.715 N/A THR 206.A OG1 ASP 204.A OD2 no hydrogen 3.285 N/A VAL 207.A N HIS 221.A O no hydrogen 2.827 N/A ARG 208.A N THR 200.A O no hydrogen 2.944 N/A ARG 208.A NE THR 206.A OG1 no hydrogen 3.024 N/A ARG 208.A NH2 ASP 204.A OD2 no hydrogen 2.848 N/A SER 209.A N GLN 219.A O no hydrogen 3.425 N/A TRP 210.A N LEU 198.A O no hydrogen 2.891 N/A TRP 210.A NE1 THR 200.A OG1 no hydrogen 2.840 N/A ASP 211.A N ARG 216.A O no hydrogen 2.994 N/A LEU 212.A N THR 196.A O no hydrogen 3.049 N/A ARG 213.A NE ASP 211.A OD2 no hydrogen 3.100 N/A GLU 214.A N ASP 211.A OD1 no hydrogen 2.510 N/A GLY 215.A N ASP 211.A O no hydrogen 2.756 N/A LEU 218.A N SER 209.A O no hydrogen 2.800 N/A GLN 219.A N SER 209.A OG no hydrogen 2.906 N/A GLN 220.A NE2 ASP 222.A OD1 no hydrogen 3.004 N/A HIS 221.A N VAL 207.A O no hydrogen 2.811 N/A HIS 221.A NE2 GLN 219.A OE1 no hydrogen 3.248 N/A PHE 223.A N ASN 205.A O no hydrogen 2.804 N/A GLN 226.A NE2 LEU 203.A O no hydrogen 3.377 N/A ILE 227.A N GLY 202.A O no hydrogen 3.133 N/A PHE 228.A N GLY 242.A O no hydrogen 2.992 N/A SER 229.A N GLY 242.A O no hydrogen 3.417 N/A SER 229.A OG VAL 268.A O no hydrogen 3.126 N/A GLY 231.A N ALA 240.A O no hydrogen 2.896 N/A TYR 232.A N ASP 190.A OD2 no hydrogen 2.734 N/A CYS 233.A N TRP 238.A O no hydrogen 2.940 N/A CYS 233.A SG THR 235.A OG1 no hydrogen 3.367 N/A CYS 233.A SG GLY 236.A O no hydrogen 3.717 N/A CYS 233.A SG GLY 277.A O no hydrogen 3.612 N/A GLY 236.A N CYS 233.A O no hydrogen 2.800 N/A LEU 239.A N LEU 251.A O no hydrogen 2.903 N/A ALA 240.A N GLY 231.A O no hydrogen 2.940 N/A VAL 241.A N GLU 249.A O no hydrogen 2.795 N/A GLY 242.A N SER 229.A O no hydrogen 2.759 N/A MET 243.A N ASN 247.A O no hydrogen 2.992 N/A GLU 244.A N GLN 226.A O no hydrogen 2.836 N/A SER 245.A N SER 225.A OG no hydrogen 3.207 N/A SER 246.A N MET 243.A O no hydrogen 3.073 N/A SER 246.A OG SER 245.A O no hydrogen 2.573 N/A SER 246.A OG HIS 264.A O no hydrogen 3.281 N/A ASN 247.A N SER 245.A OG no hydrogen 3.353 N/A VAL 248.A N LEU 261.A O no hydrogen 3.072 N/A GLU 249.A N VAL 241.A O no hydrogen 2.883 N/A VAL 250.A N TYR 259.A O no hydrogen 2.774 N/A LEU 251.A N LEU 239.A O no hydrogen 2.760 N/A HIS 252.A N ASP 257.A O no hydrogen 3.255 N/A HIS 252.A ND1 GLU 237.A O no hydrogen 3.363 N/A VAL 253.A N GLU 237.A O no hydrogen 2.724 N/A LYS 255.A N HIS 252.A O no hydrogen 2.958 N/A LYS 258.A N VAL 17.A O no hydrogen 3.070 N/A LYS 258.A NZ GLU 249.A OE1 no hydrogen 2.579 N/A TYR 259.A N VAL 250.A O no hydrogen 2.891 N/A GLN 260.A N PHE 15.A O no hydrogen 2.835 N/A GLN 260.A NE2 GLU 249.A OE1 no hydrogen 3.327 N/A GLN 260.A NE2 GLU 249.A OE2 no hydrogen 3.050 N/A LEU 261.A N VAL 248.A O no hydrogen 2.922 N/A HIS 262.A N TYR 13.A O no hydrogen 2.804 N/A HIS 264.A ND1 ASP 286.A OD1 no hydrogen 3.003 N/A HIS 264.A NE2 SER 282.A OG no hydrogen 2.754 N/A GLU 265.A N ASP 286.A OD2 no hydrogen 2.773 N/A CYS 267.A N SER 266.A OG no hydrogen 2.810 N/A CYS 267.A SG GLU 244.A O no hydrogen 3.680 N/A CYS 267.A SG GLU 244.A OE2 no hydrogen 3.877 N/A VAL 268.A N MET 243.A O no hydrogen 3.013 N/A LEU 269.A N THR 283.A O no hydrogen 2.851 N/A SER 270.A OG THR 283.A OG1 no hydrogen 2.755 N/A LYS 272.A N VAL 281.A O no hydrogen 2.950 N/A ALA 274.A N TRP 279.A O no hydrogen 2.963 N/A TYR 275.A N ASP 318.A OD1 no hydrogen 2.653 N/A CYS 276.A N ASP 318.A OD2 no hydrogen 2.918 N/A CYS 276.A SG ASP 318.A OD2 no hydrogen 3.672 N/A GLY 277.A N ALA 274.A O no hydrogen 2.913 N/A LYS 278.A NZ PRO 36.A O no hydrogen 3.310 N/A PHE 280.A N TRP 292.A O no hydrogen 2.908 N/A VAL 281.A N LYS 272.A O no hydrogen 2.923 N/A SER 282.A N ASN 290.A O no hydrogen 2.862 N/A SER 282.A OG HIS 264.A NE2 no hydrogen 2.754 N/A THR 283.A N SER 270.A O no hydrogen 2.884 N/A THR 283.A OG1 SER 270.A OG no hydrogen 2.755 N/A THR 283.A OG1 VAL 309.A O no hydrogen 2.737 N/A GLY 284.A N LEU 288.A O no hydrogen 3.068 N/A LYS 285.A N CYS 267.A O no hydrogen 3.087 N/A ASN 287.A N GLY 284.A O no hydrogen 2.990 N/A ASN 287.A ND2 LYS 285.A O no hydrogen 3.292 N/A LEU 288.A N ASP 286.A OD1 no hydrogen 3.302 N/A LEU 289.A N SER 303.A O no hydrogen 2.886 N/A ASN 290.A N SER 282.A O no hydrogen 2.812 N/A ASN 290.A ND2 LEU 263.A O no hydrogen 3.072 N/A ALA 291.A N PHE 301.A O no hydrogen 2.918 N/A TRP 292.A N PHE 280.A O no hydrogen 2.702 N/A TRP 292.A NE1 SER 282.A OG no hydrogen 2.810 N/A ARG 293.A N ALA 298.A O no hydrogen 2.801 N/A ARG 293.A NE ASP 31.A O no hydrogen 2.748 N/A ARG 293.A NH1 LYS 278.A O no hydrogen 3.122 N/A ARG 293.A NH2 ASP 31.A O no hydrogen 3.037 N/A THR 294.A N LYS 278.A O no hydrogen 2.952 N/A THR 294.A OG1 GLY 277.A O no hydrogen 2.824 N/A GLY 297.A N ARG 293.A O no hydrogen 2.860 N/A SER 299.A N TYR 13.A OH no hydrogen 2.914 N/A ILE 300.A N ALA 291.A O no hydrogen 2.891 N/A SER 303.A N LEU 289.A O no hydrogen 2.994 N/A SER 303.A OG TYR 333.A OH no hydrogen 2.911 N/A LYS 304.A NZ ASP 286.A O no hydrogen 2.407 N/A GLU 305.A N ASN 287.A O no hydrogen 2.863 N/A SER 306.A OG ASP 327.A OD2 no hydrogen 2.553 N/A SER 308.A OG LYS 285.A O no hydrogen 3.016 N/A VAL 309.A N GLY 284.A O no hydrogen 2.883 N/A LEU 310.A N GLY 324.A O no hydrogen 2.806 N/A SER 311.A OG VAL 54.A O no hydrogen 3.080 N/A CYS 312.A SG SER 270.A OG no hydrogen 3.340 N/A ASP 313.A N VAL 322.A O no hydrogen 2.896 N/A SER 315.A N TYR 320.A O no hydrogen 2.854 N/A SER 315.A OG ASP 317.A OD1 no hydrogen 2.587 N/A ASP 318.A N SER 315.A O no hydrogen 2.977 N/A LYS 319.A N SER 315.A OG no hydrogen 3.217 N/A LYS 319.A N ASP 317.A OD1 no hydrogen 3.210 N/A LYS 319.A NZ TYR 320.A OH no hydrogen 3.006 N/A TYR 320.A N SER 315.A OG no hydrogen 3.036 N/A ILE 321.A N TYR 333.A O no hydrogen 3.009 N/A VAL 322.A N ASP 313.A O no hydrogen 2.981 N/A THR 323.A N THR 331.A O no hydrogen 2.931 N/A THR 323.A OG1 GLU 305.A OE2 no hydrogen 2.607 N/A GLY 324.A N SER 311.A O no hydrogen 2.921 N/A SER 325.A N LYS 329.A O no hydrogen 2.807 N/A GLY 326.A N SER 308.A O no hydrogen 2.870 N/A ASP 327.A N SER 325.A OG no hydrogen 2.804 N/A LYS 328.A N SER 325.A O no hydrogen 3.125 N/A ALA 330.A N LEU 48.A O no hydrogen 2.942 N/A THR 331.A N THR 323.A O no hydrogen 2.920 N/A VAL 332.A N ASN 46.A O no hydrogen 2.869 N/A TYR 333.A N ILE 321.A O no hydrogen 2.794 N/A TYR 333.A OH SER 303.A OG no hydrogen 2.911 N/A TYR 333.A OH GLU 305.A OE2 no hydrogen 2.612 N/A GLU 334.A N ARG 43.A O no hydrogen 2.732 N/A VAL 335.A N LYS 319.A O no hydrogen 2.771 N/A ILE 336.A N HIS 41.A O no hydrogen 2.741 N/A TYR 337.A OH ASP 318.A O no hydrogen 2.781 N/A