Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3o2j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ARG 33.A O no hydrogen 2.757 N/A ILE 5.A N THR 35.A O no hydrogen 3.011 N/A GLY 6.A N ALA 63.A O no hydrogen 2.917 N/A GLY 7.A N HIS 37.A O no hydrogen 2.958 N/A LEU 8.A N PHE 65.A O no hydrogen 2.839 N/A PHE 9.A N ASP 39.A O no hydrogen 2.950 N/A ARG 11.A N LEU 41.A O no hydrogen 3.116 N/A ALA 13.A N PRO 10.A O no hydrogen 3.268 N/A ASP 14.A N GLY 12.A O no hydrogen 2.789 N/A GLN 15.A NE2 GLY 244.A O no hydrogen 2.885 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 2.852 N/A TYR 17.A N ALA 13.A O no hydrogen 3.184 N/A SER 18.A N ASP 14.A O no hydrogen 2.933 N/A SER 18.A OG ASP 14.A O no hydrogen 3.190 N/A SER 18.A OG PRO 243.A O no hydrogen 2.659 N/A ALA 19.A N GLN 15.A O no hydrogen 2.840 N/A PHE 20.A N GLU 16.A O no hydrogen 2.920 N/A ARG 21.A N TYR 17.A O no hydrogen 2.919 N/A ARG 21.A NH1 GLU 241.A O no hydrogen 3.062 N/A ARG 21.A NH2 GLU 241.A OE2 no hydrogen 2.875 N/A VAL 22.A N SER 18.A O no hydrogen 2.768 N/A GLY 23.A N ALA 19.A O no hydrogen 2.814 N/A MET 24.A N PHE 20.A O no hydrogen 2.997 N/A VAL 25.A N ARG 21.A O no hydrogen 3.207 N/A GLN 26.A N VAL 22.A O no hydrogen 2.899 N/A PHE 27.A N GLY 23.A O no hydrogen 2.866 N/A SER 28.A N VAL 25.A O no hydrogen 3.351 N/A SER 28.A OG VAL 25.A O no hydrogen 2.699 N/A GLU 31.A N THR 29.A OG1 no hydrogen 3.103 N/A ARG 33.A N ASN 1.A O no hydrogen 3.089 N/A THR 35.A N ILE 3.A O no hydrogen 2.755 N/A HIS 37.A N ILE 5.A O no hydrogen 2.702 N/A HIS 37.A NE2 GLN 4.A OE1 no hydrogen 2.606 N/A ASP 39.A N GLY 7.A O no hydrogen 2.760 N/A LEU 41.A N PHE 9.A O no hydrogen 2.909 N/A ALA 44.A N GLU 42.A OE2 no hydrogen 3.039 N/A ASN 45.A N GLU 42.A O no hydrogen 3.083 N/A ALA 48.A N ASN 45.A OD1 no hydrogen 3.030 N/A VAL 49.A N ASN 45.A O no hydrogen 2.983 N/A THR 50.A N SER 46.A O no hydrogen 2.934 N/A THR 50.A OG1 SER 46.A O no hydrogen 2.814 N/A ALA 51.A N PHE 47.A O no hydrogen 2.944 N/A ALA 52.A N ALA 48.A O no hydrogen 2.967 N/A PHE 53.A N VAL 49.A O no hydrogen 2.838 N/A CYS 54.A N THR 50.A O no hydrogen 2.874 N/A CYS 54.A SG THR 50.A O no hydrogen 3.250 N/A SER 55.A N ALA 51.A O no hydrogen 2.984 N/A GLN 56.A N ALA 52.A O no hydrogen 2.989 N/A GLN 56.A NE2 HIS 37.A O no hydrogen 2.879 N/A PHE 57.A N PHE 53.A O no hydrogen 2.882 N/A SER 58.A N CYS 54.A O no hydrogen 2.834 N/A SER 58.A OG CYS 54.A O no hydrogen 3.375 N/A SER 58.A OG SER 55.A O no hydrogen 2.820 N/A ARG 59.A N SER 55.A O no hydrogen 3.211 N/A ARG 59.A N GLN 56.A O no hydrogen 3.003 N/A ARG 59.A NH1 HIS 37.A ND1 no hydrogen 2.833 N/A GLY 60.A N PHE 57.A O no hydrogen 2.882 N/A VAL 61.A N GLN 56.A O no hydrogen 3.420 N/A TYR 62.A N GLN 4.A O no hydrogen 2.954 N/A ILE 64.A N SER 86.A O no hydrogen 2.800 N/A PHE 65.A N GLY 6.A O no hydrogen 2.889 N/A GLY 66.A N ILE 88.A O no hydrogen 3.067 N/A PHE 67.A N LEU 8.A O no hydrogen 3.075 N/A TYR 68.A N SER 91.A OG no hydrogen 3.002 N/A TYR 68.A OH PHE 92.A O no hydrogen 2.848 N/A ASP 69.A N SER 72.A OG no hydrogen 3.069 N/A LYS 70.A NZ ASP 131.A OD1 no hydrogen 2.950 N/A LYS 71.A N ASP 69.A OD1 no hydrogen 3.201 N/A SER 72.A N ASP 69.A O no hydrogen 3.089 N/A SER 72.A OG VAL 43.A O no hydrogen 2.548 N/A SER 72.A OG ASP 69.A OD1 no hydrogen 3.262 N/A VAL 73.A N ASP 69.A O no hydrogen 2.927 N/A ILE 76.A N SER 72.A O no hydrogen 3.133 N/A THR 77.A N VAL 73.A O no hydrogen 2.947 N/A THR 77.A OG1 VAL 73.A O no hydrogen 3.489 N/A THR 77.A OG1 ASN 74.A O no hydrogen 3.347 N/A SER 78.A N ASN 74.A O no hydrogen 2.985 N/A PHE 79.A N THR 75.A O no hydrogen 2.898 N/A CYS 80.A N ILE 76.A O no hydrogen 2.843 N/A CYS 80.A SG ILE 76.A O no hydrogen 3.169 N/A CYS 80.A SG VAL 85.A O no hydrogen 3.319 N/A GLY 81.A N THR 77.A O no hydrogen 3.007 N/A THR 82.A N SER 78.A O no hydrogen 2.979 N/A THR 82.A OG1 SER 78.A O no hydrogen 2.836 N/A LEU 83.A N PHE 79.A O no hydrogen 2.919 N/A VAL 85.A N CYS 80.A O no hydrogen 3.316 N/A PHE 87.A N PHE 100.A O no hydrogen 2.830 N/A ILE 88.A N ILE 64.A O no hydrogen 2.880 N/A THR 89.A N ILE 102.A O no hydrogen 2.941 N/A THR 89.A OG1 GLY 66.A O no hydrogen 2.631 N/A SER 91.A N THR 89.A OG1 no hydrogen 3.051 N/A SER 91.A OG TYR 68.A O no hydrogen 3.318 N/A SER 91.A OG THR 89.A OG1 no hydrogen 3.128 N/A THR 94.A N GLN 103.A OE1 no hydrogen 3.148 N/A THR 94.A OG1 HIS 98.A ND1.A no hydrogen 2.929 N/A PHE 100.A N GLU 302.A OE2 no hydrogen 2.814 N/A ILE 102.A N PHE 87.A O no hydrogen 2.690 N/A GLN 103.A N GLY 323.A O no hydrogen 2.759 N/A GLN 103.A NE2 TYR 68.A OH no hydrogen 3.009 N/A GLN 103.A NE2 THR 94.A OG1 no hydrogen 2.811 N/A MET 104.A N THR 89.A O no hydrogen 2.775 N/A ARG 105.A NE PRO 90.A O no hydrogen 2.986 N/A ARG 105.A NH2 PRO 90.A O no hydrogen 3.099 N/A LYS 109.A N ASP 107.A OD2 no hydrogen 3.112 N/A LYS 109.A NZ ASP 95.A OD1 no hydrogen 3.349 N/A LYS 109.A NZ ASP 107.A OD1 no hydrogen 2.572 N/A LYS 109.A NZ ASP 107.A OD2 no hydrogen 3.545 N/A LYS 109.A NZ SER 135.A OG no hydrogen 2.813 N/A LEU 112.A N LEU 108.A O no hydrogen 2.925 N/A LEU 113.A N LYS 109.A O no hydrogen 2.956 N/A SER 114.A N GLY 110.A O no hydrogen 3.019 N/A SER 114.A OG GLY 110.A O no hydrogen 3.128 N/A SER 114.A OG LYS 351.A O no hydrogen 3.515 N/A LEU 115.A N ALA 111.A O no hydrogen 2.837 N/A ILE 116.A N LEU 112.A O no hydrogen 3.019 N/A GLU 117.A N LEU 113.A O no hydrogen 3.206 N/A TYR 118.A N SER 114.A O no hydrogen 2.864 N/A TYR 118.A OH THR 355.A OG1 no hydrogen 3.165 N/A TYR 119.A N LEU 115.A O no hydrogen 2.953 N/A TYR 119.A OH SER 215.A OG no hydrogen 2.583 N/A TYR 119.A OH GLU 334.A OE2 no hydrogen 2.530 N/A GLN 120.A N GLU 117.A O no hydrogen 2.899 N/A TRP 121.A N ILE 116.A O no hydrogen 3.070 N/A LYS 123.A NZ GLU 161.A OE1 no hydrogen 2.980 N/A LYS 123.A NZ GLU 161.A OE2 no hydrogen 3.330 N/A PHE 124.A N GLN 150.A O no hydrogen 3.022 N/A ALA 125.A N ARG 163.A O no hydrogen 2.856 N/A TYR 126.A N THR 152.A O no hydrogen 2.705 N/A TYR 126.A OH ASP 167.A OD2 no hydrogen 2.542 N/A LEU 127.A N ILE 165.A O no hydrogen 2.864 N/A TYR 128.A N ILE 154.A O no hydrogen 3.059 N/A ASP 129.A N ASP 167.A O no hydrogen 3.053 N/A ASP 131.A N ASP 129.A OD1 no hydrogen 3.360 N/A ARG 132.A NH1 ASP 167.A OD1 no hydrogen 2.892 N/A GLY 133.A N SER 130.A O no hydrogen 2.887 N/A GLN 138.A N LEU 134.A O no hydrogen 3.103 N/A ALA 139.A N SER 135.A O no hydrogen 2.963 N/A VAL 140.A N THR 136.A O no hydrogen 2.914 N/A LEU 141.A N LEU 137.A O no hydrogen 2.922 N/A ASP 142.A N GLN 138.A O no hydrogen 2.702 N/A SER 143.A N ALA 139.A O no hydrogen 3.009 N/A SER 143.A OG ALA 139.A O no hydrogen 3.031 N/A ALA 144.A N VAL 140.A O no hydrogen 2.808 N/A ALA 145.A N LEU 141.A O no hydrogen 3.052 N/A GLU 146.A N ASP 142.A O no hydrogen 3.139 N/A LYS 147.A N SER 143.A O no hydrogen 2.826 N/A TRP 149.A N ALA 144.A O no hydrogen 3.076 N/A GLN 150.A N ASP 122.A O no hydrogen 2.725 N/A THR 152.A N PHE 124.A O no hydrogen 2.919 N/A ILE 154.A N TYR 126.A O no hydrogen 3.061 N/A VAL 156.A N TYR 128.A O no hydrogen 2.700 N/A GLY 157.A N ASN 155.A OD1 no hydrogen 2.973 N/A VAL 164.A N HIS 191.A O no hydrogen 2.972 N/A ILE 165.A N ALA 125.A O no hydrogen 2.741 N/A LEU 166.A N ILE 193.A O no hydrogen 2.810 N/A ASP 167.A N LEU 127.A O no hydrogen 2.925 N/A CYS 168.A SG GLU 169.A O no hydrogen 3.864 N/A GLU 169.A N ASP 129.A OD2 no hydrogen 2.793 N/A LYS 172.A N GLU 169.A O no hydrogen 2.972 N/A LYS 172.A NZ ASP 129.A OD2 no hydrogen 2.910 N/A ILE 176.A N LYS 172.A O no hydrogen 2.916 N/A VAL 177.A N VAL 173.A O no hydrogen 2.928 N/A ASP 178.A N ASN 174.A O no hydrogen 2.887 N/A GLN 179.A N ASP 175.A O no hydrogen 3.468 N/A VAL 180.A N ILE 176.A O no hydrogen 3.404 N/A ILE 181.A N VAL 177.A O no hydrogen 3.101 N/A THR 182.A OG1 ASP 178.A O no hydrogen 3.548 N/A THR 182.A OG1 GLN 179.A O no hydrogen 3.264 N/A THR 182.A OG1 ILE 181.A O no hydrogen 2.331 N/A ILE 183.A N VAL 180.A O no hydrogen 3.114 N/A GLY 189.A N HIS 186.A O no hydrogen 2.447 N/A TYR 190.A N VAL 187.A O no hydrogen 3.329 N/A HIS 191.A N ARG 162.A O no hydrogen 2.835 N/A HIS 191.A NE2 SER 215.A OG no hydrogen 2.846 N/A TYR 192.A N ASN 213.A O no hydrogen 2.931 N/A ILE 193.A N VAL 164.A O no hydrogen 2.788 N/A ILE 194.A N SER 215.A O no hydrogen 2.823 N/A ALA 195.A N LEU 166.A O no hydrogen 2.894 N/A ASN 196.A N ILE 194.A O no hydrogen 2.953 N/A GLY 198.A N ASN 196.A OD1 no hydrogen 2.816 N/A PHE 199.A N PHE 217.A O no hydrogen 2.898 N/A THR 200.A N GLN 218.A OE1 no hydrogen 3.074 N/A THR 200.A OG1 GLN 218.A OE1 no hydrogen 3.164 N/A ASP 201.A N GLY 198.A O no hydrogen 2.818 N/A LYS 206.A N ASP 203.A O no hydrogen 2.915 N/A LYS 206.A NZ ASP 203.A OD1 no hydrogen 2.819 N/A ILE 207.A N LEU 204.A O no hydrogen 3.108 N/A GLY 210.A N GLN 208.A OE1 no hydrogen 2.798 N/A ALA 212.A N PHE 209.A O no hydrogen 3.240 N/A ASN 213.A N TYR 190.A O no hydrogen 2.987 N/A ASN 213.A ND2 HIS 191.A ND1 no hydrogen 3.672 N/A SER 215.A N TYR 192.A O no hydrogen 2.867 N/A SER 215.A OG TYR 119.A OH no hydrogen 2.583 N/A SER 215.A OG HIS 191.A NE2 no hydrogen 2.846 N/A GLY 216.A N MET 333.A O no hydrogen 2.953 N/A GLN 218.A N ASN 331.A O no hydrogen 3.006 N/A GLN 218.A NE2 VAL 220.A O no hydrogen 3.076 N/A ILE 219.A N LEU 197.A O no hydrogen 3.423 N/A ASP 223.A N ASP 221.A OD1 no hydrogen 2.868 N/A ASP 224.A N ASP 221.A O no hydrogen 2.871 N/A SER 228.A N ASP 224.A O no hydrogen 2.766 N/A SER 228.A OG TYR 222.A O no hydrogen 3.161 N/A SER 228.A OG ASP 224.A O no hydrogen 2.974 N/A LYS 229.A N SER 225.A O no hydrogen 2.896 N/A PHE 230.A N LEU 226.A O no hydrogen 3.196 N/A ILE 231.A N VAL 227.A O no hydrogen 2.910 N/A GLU 232.A N SER 228.A O no hydrogen 3.004 N/A ARG 233.A N LYS 229.A O no hydrogen 3.352 N/A TRP 234.A N PHE 230.A O no hydrogen 2.778 N/A TRP 234.A NE1 THR 247.A OG1 no hydrogen 2.927 N/A SER 235.A N ILE 231.A O no hydrogen 2.820 N/A SER 235.A OG ILE 231.A O no hydrogen 2.619 N/A SER 235.A OG GLU 232.A O no hydrogen 3.358 N/A THR 236.A N ARG 233.A O no hydrogen 2.941 N/A THR 236.A OG1 ARG 233.A O no hydrogen 2.938 N/A LEU 237.A N TRP 234.A O no hydrogen 3.308 N/A LYS 240.A N GLU 238.A OE1 no hydrogen 3.020 N/A TYR 242.A N GLU 238.A O no hydrogen 2.680 N/A ALA 245.A N TYR 242.A O no hydrogen 2.918 N/A HIS 246.A N TRP 234.A O no hydrogen 3.058 N/A HIS 246.A ND1 LEU 237.A O no hydrogen 2.906 N/A THR 247.A OG1 THR 249.A O no hydrogen 2.548 N/A ILE 250.A N TYR 222.A OH no hydrogen 2.997 N/A LYS 251.A N GLN 15.A OE1 no hydrogen 3.150 N/A LYS 251.A NZ GLU 16.A OE2 no hydrogen 2.930 N/A TYR 252.A N ASP 201.A OD2 no hydrogen 2.706 N/A THR 253.A OG1 GLU 16.A OE2 no hydrogen 2.768 N/A SER 254.A OG GLN 15.A OE1 no hydrogen 2.675 N/A ALA 255.A N LYS 251.A O no hydrogen 2.941 N/A LEU 256.A N TYR 252.A O no hydrogen 2.890 N/A THR 257.A N THR 253.A O no hydrogen 3.041 N/A THR 257.A OG1 THR 253.A O no hydrogen 2.808 N/A TYR 258.A N SER 254.A O no hydrogen 3.101 N/A ASP 259.A N ALA 255.A O no hydrogen 2.892 N/A ALA 260.A N LEU 256.A O no hydrogen 2.774 N/A VAL 261.A N THR 257.A O no hydrogen 3.255 N/A GLN 262.A N TYR 258.A O no hydrogen 3.419 N/A VAL 263.A N ASP 259.A O no hydrogen 3.064 N/A MET 264.A N ALA 260.A O no hydrogen 2.971 N/A THR 265.A N VAL 261.A O no hydrogen 2.955 N/A THR 265.A OG1 VAL 261.A O no hydrogen 2.858 N/A GLU 266.A N GLN 262.A O no hydrogen 2.876 N/A ALA 267.A N VAL 263.A O no hydrogen 2.934 N/A PHE 268.A N MET 264.A O no hydrogen 2.965 N/A ARG 269.A N THR 265.A O no hydrogen 2.963 N/A ASN 270.A N GLU 266.A O no hydrogen 3.076 N/A LEU 271.A N ALA 267.A O no hydrogen 2.906 N/A ARG 272.A N PHE 268.A O no hydrogen 2.830 N/A LYS 273.A N ARG 269.A O no hydrogen 2.968 N/A GLN 274.A N ASN 270.A O no hydrogen 3.092 N/A GLN 274.A NE2 ASN 270.A OD1 no hydrogen 2.953 N/A ARG 275.A N ARG 272.A O no hydrogen 3.031 N/A ILE 276.A N LEU 271.A O no hydrogen 3.089 N/A SER 279.A N GLU 277.A OE2 no hydrogen 3.065 N/A SER 279.A OG SER 2.A O no hydrogen 3.386 N/A LEU 288.A N ASP 286.A OD1 no hydrogen 2.907 N/A ALA 289.A N ASP 286.A O no hydrogen 3.068 N/A GLN 297.A NE2 GLU 277.A O no hydrogen 2.889 N/A GLY 298.A N TRP 295.A O no hydrogen 3.242 N/A ILE 301.A N GLN 297.A O no hydrogen 2.963 N/A GLU 302.A N GLY 298.A O no hydrogen 2.921 N/A ARG 303.A N VAL 299.A O no hydrogen 3.026 N/A ARG 303.A NH1 GLU 300.A OE1 no hydrogen 3.119 N/A ALA 304.A N GLU 300.A O no hydrogen 2.881 N/A LEU 305.A N ILE 301.A O no hydrogen 3.014 N/A LYS 306.A N GLU 302.A O no hydrogen 3.116 N/A LYS 306.A NZ GLU 302.A OE2 no hydrogen 2.604 N/A LYS 306.A NZ GLN 321.A O no hydrogen 2.799 N/A GLN 307.A N ALA 304.A O no hydrogen 3.176 N/A VAL 308.A N LEU 305.A O no hydrogen 3.246 N/A VAL 310.A N ILE 317.A O no hydrogen 3.044 N/A GLY 312.A N GLY 315.A O no hydrogen 2.847 N/A LEU 313.A N ASP 259.A OD1 no hydrogen 2.833 N/A SER 314.A N ASP 259.A OD2 no hydrogen 2.790 N/A SER 314.A OG ASP 259.A OD2 no hydrogen 2.625 N/A GLY 315.A N GLY 312.A O no hydrogen 2.918 N/A ILE 317.A N VAL 310.A O no hydrogen 2.703 N/A LYS 318.A NZ GLN 309.A OE1 no hydrogen 2.994 N/A ASP 320.A N LYS 324.A O no hydrogen 2.814 N/A ASN 322.A N ASP 320.A OD1 no hydrogen 2.792 N/A GLY 323.A N ASP 320.A O no hydrogen 2.988 N/A LYS 324.A N ASP 320.A OD1 no hydrogen 3.040 N/A LYS 324.A NZ ASP 95.A O no hydrogen 3.297 N/A ARG 325.A NH1 MET 104.A O no hydrogen 2.804 N/A ARG 325.A NH1 SER 314.A OG no hydrogen 2.905 N/A ARG 325.A NH2 SER 314.A O no hydrogen 3.072 N/A ARG 325.A NH2 SER 314.A OG no hydrogen 3.337 N/A ARG 325.A NH2 ASN 316.A O no hydrogen 3.029 N/A ILE 326.A N LYS 318.A O no hydrogen 2.854 N/A ASN 327.A N GLU 348.A OE1 no hydrogen 2.820 N/A TYR 328.A OH ASP 107.A O no hydrogen 2.876 N/A ILE 330.A N TRP 346.A O no hydrogen 2.798 N/A ASN 331.A N GLN 218.A O no hydrogen 2.929 N/A ASN 331.A ND2 ASP 221.A OD2 no hydrogen 2.957 N/A ILE 332.A N GLY 344.A O no hydrogen 2.842 N/A MET 333.A N GLY 216.A O no hydrogen 2.908 N/A GLU 334.A N ARG 341.A O no hydrogen 2.980 N/A LEU 335.A N VAL 214.A O no hydrogen 2.779 N/A LYS 336.A N GLY 339.A O no hydrogen 3.006 N/A LYS 336.A NZ GLU 334.A OE1 no hydrogen 2.983 N/A GLY 339.A N LYS 336.A O no hydrogen 2.821 N/A ARG 341.A N GLU 334.A O no hydrogen 2.922 N/A ARG 341.A NH1 PRO 340.A O no hydrogen 2.702 N/A LYS 342.A NZ ASN 331.A OD1 no hydrogen 3.048 N/A ILE 343.A N ILE 332.A O no hydrogen 2.860 N/A TYR 345.A N VAL 354.A O no hydrogen 2.975 N/A TRP 346.A N ILE 330.A O no hydrogen 2.815 N/A TRP 346.A NE1 SER 114.A OG no hydrogen 2.935 N/A GLU 348.A N TYR 328.A O no hydrogen 2.995 N/A ASP 350.A N SER 347.A OG no hydrogen 3.090 N/A LYS 351.A N SER 347.A O no hydrogen 2.617 N/A LYS 351.A NZ GLU 348.A O no hydrogen 2.843 N/A LYS 351.A NZ GLU 348.A OE2 no hydrogen 3.482 N/A VAL 354.A N TYR 345.A O no hydrogen 2.764 N/A THR 355.A OG1 TYR 118.A OH no hydrogen 3.165 N/A LEU 356.A N ILE 343.A O no hydrogen 2.775 N/A