Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3b6z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 8.A N ALA 25.A O no hydrogen 2.871 N/A GLN 8.A NE2 PRO 26.A O no hydrogen 2.855 N/A GLN 8.A NE2 TYR 106.A O no hydrogen 3.265 N/A ALA 10.A N TRP 22.A O no hydrogen 2.926 N/A LEU 11.A N PHE 103.A O no hydrogen 2.982 N/A THR 12.A N THR 20.A O no hydrogen 3.058 N/A THR 12.A OG1 ALA 60.A O no hydrogen 2.596 N/A ASN 14.A N GLU 18.A O no hydrogen 2.897 N/A ASN 14.A ND2 GLU 18.A OE1 no hydrogen 2.935 N/A HIS 16.A N ASN 14.A OD1 no hydrogen 2.824 N/A GLU 18.A N ASN 14.A OD1 no hydrogen 3.014 N/A THR 20.A N THR 12.A O no hydrogen 2.841 N/A THR 20.A OG1 GLU 18.A O no hydrogen 2.946 N/A TRP 22.A N ALA 10.A O no hydrogen 2.815 N/A ASN 23.A ND2 THR 9.A OG1 no hydrogen 2.999 N/A ALA 25.A N GLN 8.A O no hydrogen 2.806 N/A CYS 27.A SG PRO 5.A O no hydrogen 3.418 N/A ARG 32.A NH2 ASP 76.A OD2 no hydrogen 3.513 N/A GLN 34.A N PRO 31.A O no hydrogen 3.168 N/A GLN 34.A NE2 GLY 111.A O no hydrogen 2.773 N/A VAL 35.A N THR 109.A OG1 no hydrogen 2.968 N/A TYR 36.A N ALA 72.A O no hydrogen 2.844 N/A TYR 36.A OH PRO 28.A O no hydrogen 2.694 N/A VAL 37.A N THR 107.A O no hydrogen 2.795 N/A ARG 38.A N THR 69.A O no hydrogen 2.860 N/A ARG 38.A NE GLU 40.A OE2 no hydrogen 3.318 N/A ARG 38.A NH2 GLU 40.A OE2 no hydrogen 3.335 N/A VAL 39.A N GLN 105.A O no hydrogen 2.832 N/A GLU 40.A N ALA 67.A O no hydrogen 2.848 N/A ALA 41.A N ALA 67.A O no hydrogen 3.051 N/A VAL 42.A N VAL 349.A O no hydrogen 2.963 N/A ALA 43.A N ASP 65.A O no hydrogen 3.128 N/A ILE 44.A N LEU 347.A O no hydrogen 2.857 N/A ASN 45.A N ASP 48.A OD2 no hydrogen 2.888 N/A ASN 45.A ND2 ASP 65.A OD2 no hydrogen 2.845 N/A SER 47.A OG GLU 92.A OE2 no hydrogen 3.503 N/A ASP 48.A N ASN 45.A O no hydrogen 2.938 N/A THR 49.A OG1 PRO 46.A O no hydrogen 2.722 N/A LYS 50.A N SER 47.A O no hydrogen 3.150 N/A MET 51.A N ASP 48.A O no hydrogen 3.231 N/A ARG 52.A N LYS 50.A O no hydrogen 2.906 N/A GLY 53.A N ASP 17.A OD1 no hydrogen 2.922 N/A PHE 55.A N ARG 52.A O no hydrogen 2.811 N/A ALA 56.A N GLY 53.A O no hydrogen 3.045 N/A TRP 59.A N VAL 13.A O no hydrogen 2.997 N/A TRP 59.A NE1 ASP 15.A OD1 no hydrogen 3.145 N/A ALA 60.A N THR 57.A O no hydrogen 3.063 N/A PHE 61.A N PRO 98.A O no hydrogen 2.959 N/A LEU 62.A N LEU 11.A O no hydrogen 2.999 N/A GLY 63.A N GLU 92.A OE1 no hydrogen 2.973 N/A THR 64.A OG1 GLU 92.A OE2 no hydrogen 3.306 N/A TYR 66.A N GLY 88.A O no hydrogen 3.166 N/A ALA 67.A N ALA 41.A O no hydrogen 2.937 N/A GLY 68.A N VAL 86.A O no hydrogen 2.916 N/A THR 69.A N ARG 38.A O no hydrogen 2.918 N/A THR 69.A OG1 GLU 40.A OE2 no hydrogen 2.988 N/A VAL 70.A N ASP 84.A O no hydrogen 2.863 N/A VAL 71.A N TYR 36.A O no hydrogen 2.845 N/A GLY 74.A N GLN 34.A O no hydrogen 2.803 N/A SER 75.A OG ASP 76.A OD1 no hydrogen 3.369 N/A ASP 76.A N ARG 32.A O no hydrogen 2.908 N/A VAL 77.A N GLY 74.A O no hydrogen 3.071 N/A THR 78.A OG1 HIS 79.A ND1 no hydrogen 3.294 N/A GLN 81.A N ASP 84.A OD2 no hydrogen 2.802 N/A GLY 83.A N VAL 70.A O no hydrogen 2.783 N/A ASP 84.A N GLN 81.A O no hydrogen 3.093 N/A ARG 85.A NH1 LEU 121.A O no hydrogen 3.035 N/A ARG 85.A NH2 LEU 121.A O no hydrogen 2.788 N/A VAL 86.A N GLY 68.A O no hydrogen 3.004 N/A TYR 87.A N ALA 115.A O no hydrogen 2.928 N/A GLY 88.A N TYR 66.A O no hydrogen 3.085 N/A ALA 89.A N VAL 113.A O no hydrogen 3.190 N/A GLN 90.A N THR 64.A O no hydrogen 2.700 N/A ASN 91.A ND2 GLU 279.A OE1 no hydrogen 2.581 N/A MET 93.A N PHE 61.A O no hydrogen 3.275 N/A CYS 94.A SG THR 97.A OG1 no hydrogen 3.463 N/A THR 97.A N CYS 94.A O no hydrogen 2.723 N/A THR 97.A OG1 CYS 94.A O no hydrogen 3.452 N/A GLN 100.A N THR 97.A O no hydrogen 3.126 N/A ALA 102.A N GLY 63.A O no hydrogen 2.851 N/A PHE 103.A N LEU 62.A O no hydrogen 2.910 N/A SER 104.A OG GLY 101.A O no hydrogen 2.809 N/A SER 104.A OG TYR 106.A O no hydrogen 3.244 N/A GLN 105.A N THR 9.A O no hydrogen 3.228 N/A TYR 106.A N GLN 8.A OE1 no hydrogen 2.750 N/A THR 107.A N VAL 37.A O no hydrogen 2.952 N/A THR 107.A OG1 GLN 90.A OE1 no hydrogen 3.301 N/A THR 107.A OG1 GLY 101.A O no hydrogen 3.567 N/A THR 107.A OG1 VAL 108.A O no hydrogen 3.418 N/A THR 109.A N VAL 35.A O no hydrogen 3.099 N/A THR 109.A OG1 GLN 34.A OE1 no hydrogen 2.570 N/A ARG 110.A NE GLU 279.A OE1 no hydrogen 3.243 N/A ARG 110.A NE GLU 279.A OE2 no hydrogen 2.950 N/A ARG 110.A NH1 THR 97.A OG1 no hydrogen 3.351 N/A ARG 110.A NH2 THR 97.A OG1 no hydrogen 2.928 N/A ARG 110.A NH2 GLU 279.A OE1 no hydrogen 3.132 N/A ARG 110.A NH2 GLU 279.A OE2 no hydrogen 3.549 N/A ARG 112.A NH1 ASP 33.A O no hydrogen 3.010 N/A ARG 112.A NH1 GLY 111.A O no hydrogen 2.726 N/A ARG 112.A NH2 ASP 33.A O no hydrogen 2.775 N/A VAL 113.A N ARG 110.A O no hydrogen 3.082 N/A TRP 114.A NE1 GLY 111.A O no hydrogen 3.051 N/A ALA 115.A N TYR 87.A O no hydrogen 3.012 N/A ILE 117.A N ARG 85.A O no hydrogen 3.004 N/A LEU 121.A N PRO 118.A O no hydrogen 3.026 N/A SER 122.A OG GLU 124.A OE1 no hydrogen 3.416 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.807 N/A GLN 125.A N SER 122.A OG no hydrogen 3.135 N/A ALA 126.A N SER 122.A O no hydrogen 3.033 N/A ALA 127.A N PHE 123.A O no hydrogen 2.873 N/A LEU 129.A N ALA 126.A O no hydrogen 3.127 N/A ALA 131.A N ASP 65.A OD1 no hydrogen 2.703 N/A ILE 133.A N LEU 129.A O no hydrogen 2.890 N/A SER 134.A N PRO 130.A O no hydrogen 3.045 N/A SER 134.A OG PRO 130.A O no hydrogen 2.838 N/A THR 135.A N ALA 131.A O no hydrogen 2.813 N/A THR 135.A OG1 ALA 131.A O no hydrogen 2.758 N/A ALA 136.A N GLY 132.A O no hydrogen 2.919 N/A GLY 137.A N ILE 133.A O no hydrogen 3.058 N/A LEU 138.A N SER 134.A O no hydrogen 3.040 N/A ALA 139.A N THR 135.A O no hydrogen 2.913 N/A MET 140.A N ALA 136.A O no hydrogen 2.991 N/A LYS 141.A N GLY 137.A O no hydrogen 2.991 N/A LEU 142.A N LEU 138.A O no hydrogen 2.944 N/A LEU 143.A N ALA 139.A O no hydrogen 2.882 N/A GLY 144.A N LYS 141.A O no hydrogen 3.157 N/A LEU 145.A N MET 140.A O no hydrogen 2.846 N/A SER 151.A N SER 149.A OG no hydrogen 3.242 N/A VAL 164.A N ILE 187.A O no hydrogen 2.960 N/A LEU 165.A N TYR 230.A O no hydrogen 2.917 N/A VAL 166.A N ILE 189.A O no hydrogen 2.886 N/A TYR 167.A N LEU 232.A O no hydrogen 2.947 N/A GLY 168.A N THR 191.A O no hydrogen 3.037 N/A GLY 168.A N THR 191.A OG1 no hydrogen 3.378 N/A GLY 169.A N THR 191.A O no hydrogen 2.791 N/A THR 171.A N GLY 168.A O no hydrogen 3.231 N/A THR 171.A OG1 GLY 168.A O no hydrogen 2.859 N/A ALA 174.A N THR 171.A OG1 no hydrogen 3.120 N/A THR 175.A N THR 171.A O no hydrogen 3.158 N/A THR 175.A OG1 ALA 172.A O no hydrogen 3.382 N/A THR 177.A N THR 173.A O no hydrogen 2.874 N/A THR 177.A OG1 THR 173.A O no hydrogen 2.682 N/A MET 178.A N ALA 174.A O no hydrogen 2.770 N/A GLN 179.A NE2 ARG 314.A O no hydrogen 3.667 N/A MET 180.A N VAL 176.A O no hydrogen 3.218 N/A LEU 181.A N THR 177.A O no hydrogen 2.791 N/A ARG 182.A N MET 178.A O no hydrogen 3.078 N/A ARG 182.A NE GLY 204.A O no hydrogen 2.638 N/A ARG 182.A NH1 GLU 206.A OE1 no hydrogen 3.448 N/A ARG 182.A NH2 GLY 204.A O no hydrogen 3.162 N/A ARG 182.A NH2 GLU 206.A OE1 no hydrogen 3.025 N/A LEU 183.A N GLN 179.A O no hydrogen 3.061 N/A SER 184.A N MET 180.A O no hydrogen 3.127 N/A SER 184.A N LEU 181.A O no hydrogen 3.134 N/A SER 184.A OG PRO 146.A O no hydrogen 2.690 N/A GLY 185.A N ARG 182.A O no hydrogen 2.933 N/A TYR 186.A N LEU 181.A O no hydrogen 2.963 N/A ILE 187.A N VAL 162.A O no hydrogen 2.940 N/A ILE 189.A N VAL 164.A O no hydrogen 2.951 N/A ALA 190.A N GLU 207.A O no hydrogen 2.997 N/A THR 191.A N VAL 166.A O no hydrogen 3.246 N/A CYS 192.A N PHE 209.A O no hydrogen 2.930 N/A CYS 192.A SG SER 193.A O no hydrogen 3.543 N/A ASN 196.A N SER 193.A O no hydrogen 2.954 N/A ASN 196.A ND2 SER 343.A OG no hydrogen 2.925 N/A PHE 197.A N PRO 194.A O no hydrogen 3.052 N/A ALA 200.A N ASN 196.A O no hydrogen 3.041 N/A LYS 201.A N PHE 197.A O no hydrogen 3.099 N/A SER 202.A N ASP 198.A O no hydrogen 2.905 N/A SER 202.A OG LEU 199.A O no hydrogen 2.857 N/A ARG 203.A N LEU 199.A O no hydrogen 3.181 N/A ARG 203.A N ALA 200.A O no hydrogen 3.123 N/A ARG 203.A NH1 SER 202.A OG no hydrogen 3.030 N/A ARG 203.A NH2 HIS 317.A O no hydrogen 2.949 N/A GLY 204.A N LYS 201.A O no hydrogen 3.307 N/A ALA 205.A N ALA 200.A O no hydrogen 3.142 N/A GLU 206.A N PRO 188.A O no hydrogen 2.728 N/A VAL 208.A N GLU 207.A OE1 no hydrogen 3.111 N/A PHE 209.A N ALA 190.A O no hydrogen 2.804 N/A ARG 212.A N ASP 210.A OD1 no hydrogen 2.961 N/A ARG 212.A NE ASP 210.A OD1 no hydrogen 3.011 N/A ARG 212.A NE ASP 210.A OD2 no hydrogen 3.210 N/A ARG 212.A NH2 ASP 210.A OD2 no hydrogen 2.699 N/A ALA 213.A N ASP 210.A O no hydrogen 3.113 N/A LEU 216.A N ALA 213.A O no hydrogen 3.237 N/A THR 219.A N ASN 215.A O no hydrogen 3.327 N/A ILE 220.A N LEU 216.A O no hydrogen 2.822 N/A ARG 221.A N ALA 217.A O no hydrogen 2.779 N/A ARG 221.A NH1 ALA 246.A O no hydrogen 2.905 N/A THR 222.A N GLN 218.A O no hydrogen 2.835 N/A THR 222.A OG1 GLN 218.A O no hydrogen 3.203 N/A THR 222.A OG1 GLN 218.A OE1 no hydrogen 3.279 N/A TYR 223.A N THR 219.A O no hydrogen 2.958 N/A THR 224.A N ILE 220.A O no hydrogen 2.906 N/A THR 224.A OG1 ILE 220.A O no hydrogen 2.824 N/A THR 224.A OG1 ARG 221.A O no hydrogen 3.349 N/A LYS 225.A N THR 222.A O no hydrogen 3.198 N/A ASN 226.A N ARG 221.A O no hydrogen 2.849 N/A ASN 227.A N THR 224.A O no hydrogen 2.980 N/A ALA 231.A N HIS 254.A O no hydrogen 2.890 N/A LEU 232.A N LEU 165.A O no hydrogen 2.811 N/A ASP 233.A N VAL 256.A O no hydrogen 2.809 N/A CYS 234.A N TYR 167.A O no hydrogen 2.828 N/A ILE 235.A N ASP 233.A OD1 no hydrogen 2.889 N/A THR 236.A N ASP 233.A OD1 no hydrogen 2.844 N/A THR 236.A OG1 ILE 235.A O no hydrogen 2.785 N/A ASN 237.A N SER 240.A OG no hydrogen 2.825 N/A SER 240.A N ASN 237.A OD1 no hydrogen 2.944 N/A SER 240.A OG ASP 233.A OD1 no hydrogen 3.149 N/A SER 240.A OG ASP 233.A OD2 no hydrogen 2.589 N/A SER 240.A OG ASN 237.A O no hydrogen 3.060 N/A SER 240.A OG ASN 237.A OD1 no hydrogen 3.338 N/A THR 241.A N ASN 237.A O no hydrogen 3.145 N/A THR 241.A OG1 ASN 237.A O no hydrogen 3.137 N/A THR 241.A OG1 TYR 255.A OH no hydrogen 2.814 N/A THR 242.A N VAL 238.A O no hydrogen 3.243 N/A THR 242.A OG1 VAL 238.A O no hydrogen 3.189 N/A PHE 243.A N GLU 239.A O no hydrogen 2.950 N/A CYS 244.A N SER 240.A O no hydrogen 2.977 N/A CYS 244.A SG SER 240.A O no hydrogen 3.399 N/A PHE 245.A N THR 241.A O no hydrogen 3.015 N/A ALA 246.A N THR 242.A O no hydrogen 3.097 N/A ALA 247.A N PHE 243.A O no hydrogen 2.975 N/A ALA 247.A N CYS 244.A O no hydrogen 3.257 N/A ILE 248.A N CYS 244.A O no hydrogen 3.210 N/A GLY 249.A N LEU 228.A O no hydrogen 2.824 N/A ARG 250.A N ASN 226.A O no hydrogen 3.111 N/A GLY 252.A N GLY 249.A O no hydrogen 3.205 N/A GLY 253.A N MET 265.A O no hydrogen 3.105 N/A HIS 254.A N ARG 229.A O no hydrogen 2.671 N/A HIS 254.A NE2 ASP 269.A OD2 no hydrogen 2.614 N/A TYR 255.A N THR 267.A O no hydrogen 2.856 N/A TYR 255.A OH ASP 233.A OD2 no hydrogen 2.567 N/A VAL 256.A N ALA 231.A O no hydrogen 2.830 N/A SER 257.A N ASP 269.A O no hydrogen 3.041 N/A SER 257.A OG ASN 259.A O no hydrogen 3.005 N/A ASN 259.A N SER 257.A OG no hydrogen 3.312 N/A ASN 259.A ND2 THR 236.A OG1 no hydrogen 3.154 N/A ARG 263.A NE LYS 264.A O no hydrogen 3.133 N/A ARG 263.A NH1 PHE 245.A O no hydrogen 2.903 N/A ARG 263.A NH1 ILE 248.A O no hydrogen 3.058 N/A ARG 263.A NH2 GLY 249.A O no hydrogen 3.016 N/A ARG 263.A NH2 LYS 264.A O no hydrogen 3.541 N/A THR 267.A N GLY 253.A O no hydrogen 3.105 N/A ASP 269.A N TYR 255.A O no hydrogen 3.160 N/A THR 271.A N SER 257.A O no hydrogen 3.052 N/A THR 275.A N LEU 272.A O no hydrogen 3.149 N/A ILE 276.A N GLY 273.A O no hydrogen 2.964 N/A PHE 277.A N PRO 274.A O no hydrogen 2.896 N/A GLY 278.A N THR 275.A O no hydrogen 3.080 N/A SER 281.A N ARG 289.A O no hydrogen 3.133 N/A TRP 283.A N SER 281.A OG no hydrogen 3.155 N/A TYR 287.A N PRO 284.A O no hydrogen 3.012 N/A GLY 288.A N PRO 284.A O no hydrogen 3.165 N/A ARG 289.A N SER 281.A O no hydrogen 3.240 N/A ARG 289.A NH1 GLU 295.A OE1 no hydrogen 3.332 N/A SER 292.A N GLY 278.A O no hydrogen 2.908 N/A GLU 294.A N GLU 294.A OE2 no hydrogen 2.822 N/A GLU 295.A N SER 292.A OG no hydrogen 2.890 N/A ARG 296.A N SER 292.A O no hydrogen 3.010 N/A ARG 296.A NE GLU 293.A OE1 no hydrogen 2.800 N/A ARG 296.A NH1 GLU 293.A OE1 no hydrogen 3.472 N/A ARG 296.A NH1 GLU 300.A OE1 no hydrogen 2.681 N/A ARG 296.A NH2 GLU 300.A OE1 no hydrogen 3.009 N/A GLN 297.A N GLU 293.A O no hydrogen 2.852 N/A GLN 297.A NE2 ASP 301.A OD1 no hydrogen 2.784 N/A PHE 298.A N GLU 294.A O no hydrogen 2.931 N/A GLY 299.A N GLU 295.A O no hydrogen 3.179 N/A GLU 300.A N ARG 296.A O no hydrogen 3.053 N/A ASP 301.A N GLN 297.A O no hydrogen 2.860 N/A LEU 302.A N PHE 298.A O no hydrogen 2.774 N/A TRP 303.A N GLY 299.A O no hydrogen 3.069 N/A TRP 303.A NE1 SER 134.A OG no hydrogen 3.075 N/A ARG 304.A N GLU 300.A O no hydrogen 2.866 N/A ILE 305.A N ASP 301.A O no hydrogen 2.954 N/A ALA 306.A N LEU 302.A O no hydrogen 2.679 N/A GLY 307.A N TRP 303.A O no hydrogen 2.795 N/A GLN 308.A NE2 ASP 312.A OD2 no hydrogen 3.155 N/A LEU 309.A N ILE 305.A O no hydrogen 3.040 N/A VAL 310.A N ALA 306.A O no hydrogen 2.827 N/A GLU 311.A N GLY 307.A O no hydrogen 2.974 N/A ASP 312.A N GLN 308.A O no hydrogen 2.941 N/A GLY 313.A N VAL 310.A O no hydrogen 3.170 N/A ARG 314.A N LEU 309.A O no hydrogen 2.888 N/A ARG 314.A N ASP 312.A OD1 no hydrogen 3.334 N/A ARG 314.A NE ASP 312.A OD1 no hydrogen 3.166 N/A ARG 314.A NE ASP 312.A OD2 no hydrogen 3.451 N/A ARG 314.A NH2 PRO 150.A O no hydrogen 2.634 N/A ARG 314.A NH2 SER 151.A O no hydrogen 3.276 N/A ARG 314.A NH2 ASP 312.A OD2 no hydrogen 2.990 N/A LEU 315.A N LEU 309.A O no hydrogen 3.207 N/A HIS 317.A ND1 HIS 318.A O no hydrogen 2.902 N/A HIS 318.A NE2 SER 170.A O no hydrogen 3.057 N/A ARG 321.A N LYS 346.A O no hydrogen 2.824 N/A VAL 323.A N VAL 348.A O no hydrogen 2.853 N/A GLY 325.A N ARG 350.A O no hydrogen 3.050 N/A LYS 331.A N PHE 327.A O no hydrogen 3.124 N/A LYS 331.A NZ VAL 19.A O no hydrogen 2.950 N/A GLN 332.A N ASP 328.A O no hydrogen 2.871 N/A GLY 333.A N HIS 329.A O no hydrogen 2.960 N/A MET 334.A N ILE 330.A O no hydrogen 2.898 N/A GLU 335.A N LYS 331.A O no hydrogen 3.435 N/A LEU 336.A N GLN 332.A O no hydrogen 3.168 N/A VAL 337.A N GLY 333.A O no hydrogen 2.930 N/A ARG 338.A N MET 334.A O no hydrogen 2.741 N/A ARG 338.A NE GLU 335.A OE2 no hydrogen 2.992 N/A ARG 338.A NH2 GLU 335.A OE1 no hydrogen 3.065 N/A LYS 339.A N GLU 335.A O no hydrogen 3.024 N/A LYS 339.A N LEU 336.A O no hydrogen 3.230 N/A GLY 340.A N VAL 337.A O no hydrogen 2.931 N/A GLU 341.A N LEU 336.A O no hydrogen 3.148 N/A SER 343.A OG HIS 195.A NE2 no hydrogen 2.979 N/A LYS 346.A N PRO 319.A O no hydrogen 2.737 N/A LYS 346.A NZ ASN 45.A OD1 no hydrogen 2.457 N/A VAL 348.A N ARG 321.A O no hydrogen 2.979 N/A VAL 349.A N VAL 42.A O no hydrogen 2.880 N/A ARG 350.A N VAL 323.A O no hydrogen 2.791 N/A ARG 350.A NH1 GLU 124.A OE2 no hydrogen 3.442 N/A LEU 351.A N GLU 40.A O no hydrogen 2.917 N/A GLU 352.A N GLY 325.A O no hydrogen 2.940 N/A