Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1urz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A SG ASP 41.A OD2 no hydrogen 3.805 N/A THR 3.A N CYS 29.A O no hydrogen 2.874 N/A HIS 4.A N TYR 285.A OH no hydrogen 2.801 N/A LEU 5.A N THR 31.A O no hydrogen 3.261 N/A GLU 6.A N ASP 9.A OD2 no hydrogen 3.391 N/A ASN 7.A N LEU 283.A O no hydrogen 3.188 N/A ARG 8.A NH1 GLU 6.A OE2 no hydrogen 3.458 N/A ARG 8.A NH2 GLU 6.A OE2 no hydrogen 3.000 N/A ASP 9.A N GLU 6.A O no hydrogen 2.963 N/A PHE 10.A N ASN 7.A O no hydrogen 3.254 N/A VAL 11.A N ARG 19.A O no hydrogen 3.024 N/A GLY 13.A N THR 17.A O no hydrogen 2.654 N/A THR 17.A OG1 GLU 276.A OE2 no hydrogen 2.647 N/A THR 18.A N LEU 275.A O no hydrogen 2.922 N/A ARG 19.A N VAL 11.A O no hydrogen 2.806 N/A VAL 20.A N VAL 273.A O no hydrogen 2.736 N/A THR 21.A N ASP 9.A O no hydrogen 2.920 N/A LEU 22.A N CYS 271.A O no hydrogen 2.798 N/A LEU 24.A N VAL 269.A O no hydrogen 2.756 N/A GLU 25.A N GLU 25.A OE1 no hydrogen 2.606 N/A LEU 26.A N GLY 267.A O no hydrogen 2.878 N/A GLY 27.A N LEU 44.A O no hydrogen 3.364 N/A GLY 28.A N GLU 25.A O no hydrogen 2.728 N/A CYS 29.A SG VAL 42.A O no hydrogen 4.007 N/A VAL 30.A N VAL 42.A O no hydrogen 2.929 N/A THR 31.A N THR 3.A O no hydrogen 2.566 N/A THR 31.A OG1 ASP 41.A OD1 no hydrogen 2.636 N/A ILE 32.A N MET 40.A O no hydrogen 2.819 N/A ALA 34.A N TYR 166.A OH no hydrogen 3.219 N/A GLU 35.A N LYS 279.A O no hydrogen 2.811 N/A LYS 37.A N ALA 34.A O no hydrogen 2.960 N/A LYS 37.A NZ GLU 165.A O no hydrogen 3.275 N/A MET 40.A N ILE 32.A O no hydrogen 2.698 N/A ASP 41.A N GLU 143.A O no hydrogen 2.691 N/A VAL 42.A N VAL 30.A O no hydrogen 2.862 N/A TRP 43.A N LYS 141.A O no hydrogen 3.051 N/A TRP 43.A NE1 ASP 45.A OD1 no hydrogen 3.243 N/A ASP 45.A N THR 139.A O no hydrogen 2.671 N/A ALA 46.A N THR 139.A O no hydrogen 3.466 N/A TYR 48.A N VAL 137.A O no hydrogen 2.934 N/A GLN 49.A N TYR 262.A O no hydrogen 3.120 N/A ASN 51.A N THR 260.A O no hydrogen 2.821 N/A THR 55.A N GLY 128.A O no hydrogen 2.846 N/A THR 55.A OG1 GLY 128.A O no hydrogen 2.977 N/A ARG 56.A NH1 TYR 58.A OH no hydrogen 2.966 N/A ARG 56.A NH1 ASN 202.A O no hydrogen 3.082 N/A GLU 57.A N LYS 209.A O no hydrogen 2.902 N/A TYR 58.A N ALA 126.A O no hydrogen 2.747 N/A TYR 58.A OH PHE 201.A O no hydrogen 2.605 N/A CYS 59.A N PRO 207.A O no hydrogen 2.907 N/A LEU 60.A N LYS 124.A O no hydrogen 2.850 N/A LYS 63.A N ALA 119.A O no hydrogen 2.553 N/A SER 65.A N LYS 117.A O no hydrogen 3.291 N/A SER 65.A OG ASP 66.A O no hydrogen 3.173 N/A LYS 68.A N CYS 115.A O no hydrogen 3.072 N/A LYS 68.A NZ GLU 83.A OE2 no hydrogen 3.084 N/A ALA 70.A N VAL 113.A O no hydrogen 2.940 N/A CYS 73.A SG HIS 103.A O no hydrogen 3.590 N/A ALA 79.A N SER 111.A OG no hydrogen 2.819 N/A LEU 81.A N GLU 84.A OE2 no hydrogen 3.212 N/A GLU 84.A N LEU 81.A O no hydrogen 3.092 N/A THR 89.A OG1 GLU 83.A O no hydrogen 3.052 N/A THR 89.A OG1 GLN 86.A O no hydrogen 2.985 N/A VAL 90.A N VAL 116.A O no hydrogen 2.798 N/A LYS 92.A N ALA 114.A O no hydrogen 2.915 N/A ARG 93.A NH1 ALA 79.A O no hydrogen 2.986 N/A ARG 93.A NH1 GLU 84.A OE1 no hydrogen 3.236 N/A ARG 93.A NH2 ALA 79.A O no hydrogen 3.049 N/A ASP 94.A N ILE 112.A O no hydrogen 2.787 N/A GLN 95.A N ASP 94.A OD1 no hydrogen 2.564 N/A SER 96.A N GLY 110.A O no hydrogen 2.956 N/A SER 96.A OG ALA 230.A O no hydrogen 2.558 N/A ARG 98.A N GLY 108.A O no hydrogen 2.626 N/A ARG 98.A NE ASN 102.A OD1 no hydrogen 2.932 N/A ARG 98.A NH2 ASN 102.A O no hydrogen 3.228 N/A GLY 99.A N ASN 102.A OD1 no hydrogen 2.778 N/A TRP 100.A NE1 GLY 105.A O no hydrogen 2.968 N/A ASN 102.A N GLY 99.A O no hydrogen 3.348 N/A HIS 103.A N TRP 100.A O no hydrogen 3.404 N/A CYS 104.A N GLY 99.A O no hydrogen 2.769 N/A CYS 104.A SG ASN 102.A OD1 no hydrogen 3.852 N/A GLY 108.A N ARG 98.A O no hydrogen 2.934 N/A LYS 109.A NZ ASP 97.A OD1 no hydrogen 3.277 N/A LYS 109.A NZ ASP 97.A OD2 no hydrogen 3.230 N/A GLY 110.A N SER 96.A O no hydrogen 2.660 N/A ILE 112.A N ASP 94.A O no hydrogen 2.795 N/A VAL 113.A N ALA 70.A O no hydrogen 2.917 N/A ALA 114.A N LYS 92.A O no hydrogen 2.979 N/A CYS 115.A N LYS 68.A O no hydrogen 2.897 N/A VAL 116.A N VAL 90.A O no hydrogen 2.958 N/A LYS 117.A N SER 65.A OG no hydrogen 3.185 N/A ALA 118.A N GLY 88.A O no hydrogen 2.612 N/A ALA 119.A N LYS 63.A O no hydrogen 3.025 N/A CYS 120.A SG HIS 61.A O no hydrogen 3.425 N/A CYS 120.A SG GLU 121.A O no hydrogen 4.023 N/A CYS 120.A SG LYS 124.A O no hydrogen 3.685 N/A GLU 121.A N HIS 61.A O no hydrogen 2.799 N/A LYS 124.A N GLU 121.A O no hydrogen 3.028 N/A LYS 124.A NZ ASP 240.A OD2 no hydrogen 2.578 N/A LYS 125.A N ASP 190.A OD2 no hydrogen 3.216 N/A LYS 125.A NZ GLU 57.A OE1 no hydrogen 3.452 N/A LYS 125.A NZ GLU 57.A OE2 no hydrogen 3.519 N/A ALA 126.A N TYR 58.A O no hydrogen 3.006 N/A THR 127.A N GLU 188.A O no hydrogen 2.761 N/A GLY 128.A N ARG 56.A O no hydrogen 2.904 N/A HIS 129.A N ILE 186.A O no hydrogen 2.867 N/A VAL 130.A N ALA 53.A O no hydrogen 2.934 N/A ASP 132.A N GLN 49.A OE1 no hydrogen 2.752 N/A ASN 134.A N ASP 132.A OD1 no hydrogen 3.158 N/A ASN 134.A ND2 SER 155.A OG no hydrogen 3.179 N/A LYS 135.A N ASP 132.A O no hydrogen 2.648 N/A VAL 137.A N TYR 48.A O no hydrogen 2.723 N/A TYR 138.A N PHE 152.A O no hydrogen 2.880 N/A THR 139.A N ALA 46.A O no hydrogen 2.911 N/A THR 139.A OG1 SER 151.A OG no hydrogen 2.805 N/A VAL 140.A N ALA 150.A O no hydrogen 2.779 N/A LYS 141.A N TRP 43.A O no hydrogen 2.860 N/A LYS 141.A NZ ASP 45.A OD2 no hydrogen 2.802 N/A VAL 142.A N LYS 148.A O no hydrogen 2.939 N/A GLU 143.A N ASP 41.A O no hydrogen 2.862 N/A ARG 147.A NE GLU 143.A OE1 no hydrogen 2.651 N/A ARG 147.A NH2 GLU 143.A OE1 no hydrogen 2.693 N/A LYS 148.A N VAL 142.A O no hydrogen 2.813 N/A LYS 148.A NZ THR 162.A O no hydrogen 2.866 N/A ALA 150.A N VAL 140.A O no hydrogen 2.897 N/A SER 151.A OG THR 139.A OG1 no hydrogen 2.805 N/A PHE 152.A N TYR 138.A O no hydrogen 2.870 N/A THR 153.A N SER 156.A O no hydrogen 2.999 N/A SER 155.A N THR 153.A OG1 no hydrogen 3.133 N/A SER 156.A N THR 153.A OG1 no hydrogen 2.924 N/A THR 159.A N LEU 171.A O no hydrogen 2.843 N/A LEU 161.A N VAL 169.A O no hydrogen 2.822 N/A THR 162.A OG1 ASP 168.A OD1 no hydrogen 3.091 N/A MET 163.A N GLY 167.A O no hydrogen 2.961 N/A TYR 166.A N MET 163.A O no hydrogen 3.096 N/A TYR 166.A OH PRO 38.A O no hydrogen 2.582 N/A GLY 167.A N GLY 164.A O no hydrogen 2.545 N/A VAL 169.A N LEU 161.A O no hydrogen 2.726 N/A SER 170.A N GLY 274.A O no hydrogen 3.042 N/A LEU 171.A N THR 159.A O no hydrogen 2.744 N/A LEU 172.A N GLU 272.A O no hydrogen 3.143 N/A CYS 173.A N GLU 157.A O no hydrogen 2.828 N/A ARG 174.A N THR 270.A O no hydrogen 2.908 N/A ALA 176.A N HIS 268.A O no hydrogen 2.997 N/A SER 177.A OG VAL 179.A O no hydrogen 2.670 N/A GLY 178.A N SER 266.A O no hydrogen 3.114 N/A VAL 179.A N SER 177.A OG no hydrogen 3.005 N/A LEU 181.A N VAL 179.A O no hydrogen 2.819 N/A GLN 183.A N ASP 180.A O no hydrogen 2.912 N/A THR 184.A N LEU 181.A O no hydrogen 3.070 N/A THR 184.A OG1 ASP 180.A O no hydrogen 2.975 N/A VAL 185.A N VAL 196.A O no hydrogen 2.866 N/A ILE 186.A N HIS 129.A O no hydrogen 2.959 N/A LEU 187.A N TRP 194.A O no hydrogen 2.787 N/A GLU 188.A N THR 127.A O no hydrogen 2.747 N/A LEU 189.A N THR 192.A O no hydrogen 2.817 N/A TRP 194.A N LEU 187.A O no hydrogen 2.741 N/A GLN 195.A N PRO 253.A O no hydrogen 2.849 N/A VAL 196.A N VAL 185.A O no hydrogen 2.830 N/A ARG 198.A N GLN 183.A O no hydrogen 2.856 N/A ASP 199.A N HIS 197.A ND1 no hydrogen 3.058 N/A TRP 200.A NE1 ARG 382.A OXT no hydrogen 2.863 N/A PHE 201.A N HIS 197.A O no hydrogen 2.891 N/A ASN 202.A N ARG 198.A O no hydrogen 2.946 N/A ASP 203.A N TRP 200.A O no hydrogen 3.273 N/A LEU 204.A N PHE 201.A O no hydrogen 3.400 N/A LEU 206.A N LEU 204.A O no hydrogen 2.881 N/A TRP 208.A N ASN 217.A O no hydrogen 3.074 N/A TRP 208.A NE1 ASN 218.A OD1 no hydrogen 3.033 N/A LYS 209.A N GLU 57.A O no hydrogen 3.105 N/A LYS 209.A NZ GLU 57.A OE1 no hydrogen 2.735 N/A LYS 209.A NZ HIS 210.A O no hydrogen 3.501 N/A LYS 209.A NZ ALA 213.A O no hydrogen 3.019 N/A ALA 213.A N HIS 210.A O no hydrogen 3.216 N/A ASN 217.A N TRP 208.A O no hydrogen 2.671 N/A ASN 218.A ND2 GLU 220.A OE2 no hydrogen 3.229 N/A ARG 221.A N ASN 218.A O no hydrogen 3.103 N/A ARG 221.A NH1 LEU 206.A O no hydrogen 2.717 N/A LEU 222.A N ALA 219.A O no hydrogen 3.058 N/A GLU 224.A N TYR 236.A O no hydrogen 3.089 N/A GLY 226.A N ASP 234.A O no hydrogen 2.694 N/A HIS 229.A N LYS 232.A O no hydrogen 2.615 N/A HIS 229.A NE2 ASP 234.A OD2 no hydrogen 3.210 N/A LYS 232.A N HIS 229.A O no hydrogen 2.847 N/A TYR 236.A N GLU 224.A O no hydrogen 2.611 N/A ASN 237.A ND2 ALA 62.A O no hydrogen 3.153 N/A LEU 238.A N LEU 222.A O no hydrogen 2.902 N/A GLY 239.A N ASN 237.A OD1 no hydrogen 2.699 N/A GLN 241.A N LEU 60.A O no hydrogen 2.735 N/A GLN 241.A NE2 GLY 239.A O no hydrogen 2.963 N/A THR 242.A N ASP 240.A OD1 no hydrogen 2.506 N/A THR 242.A OG1 ASP 240.A OD1 no hydrogen 2.794 N/A THR 242.A OG1 ASP 240.A OD2 no hydrogen 3.550 N/A LEU 245.A N GLN 241.A O no hydrogen 3.063 N/A LEU 246.A N THR 242.A O no hydrogen 2.897 N/A LYS 247.A N GLY 243.A O no hydrogen 3.068 N/A ALA 248.A N VAL 244.A O no hydrogen 3.089 N/A LEU 249.A N LEU 245.A O no hydrogen 2.925 N/A ALA 250.A N LYS 247.A O no hydrogen 3.210 N/A VAL 252.A N LEU 249.A O no hydrogen 2.853 N/A ALA 255.A N ALA 193.A O no hydrogen 2.994 N/A GLU 258.A N LYS 261.A O no hydrogen 2.788 N/A THR 260.A OG1 GLU 50.A OE1 no hydrogen 2.561 N/A LYS 261.A N GLU 258.A O no hydrogen 3.018 N/A LYS 261.A NZ GLU 50.A OE2 no hydrogen 2.963 N/A TYR 262.A N GLN 49.A O no hydrogen 2.841 N/A TYR 262.A OH HIS 129.A NE2 no hydrogen 3.363 N/A TYR 262.A OH GLU 188.A OE1 no hydrogen 2.682 N/A HIS 263.A N HIS 256.A O no hydrogen 2.910 N/A LEU 264.A N ILE 47.A O no hydrogen 2.827 N/A HIS 268.A N ALA 176.A O no hydrogen 3.039 N/A VAL 269.A N LEU 24.A O no hydrogen 2.896 N/A THR 270.A N ARG 174.A O no hydrogen 3.045 N/A CYS 271.A N LEU 22.A O no hydrogen 2.812 N/A GLU 272.A N LEU 172.A O no hydrogen 2.899 N/A VAL 273.A N VAL 20.A O no hydrogen 2.505 N/A GLY 274.A N SER 170.A O no hydrogen 2.877 N/A LEU 275.A N THR 18.A O no hydrogen 2.980 N/A LYS 279.A NZ MET 280.A O no hydrogen 3.408 N/A LYS 281.A N THR 33.A O no hydrogen 2.763 N/A TYR 285.A OH GLU 346.A OE2 no hydrogen 2.491 N/A CYS 288.A N ARG 320.A O no hydrogen 2.844 N/A CYS 288.A SG ARG 320.A O no hydrogen 3.115 N/A THR 291.A N ASP 289.A OD1 no hydrogen 2.884 N/A THR 291.A OG1 ASP 289.A OD1 no hydrogen 2.734 N/A LYS 292.A N ASP 289.A O no hydrogen 3.067 N/A THR 294.A N THR 312.A O no hydrogen 3.070 N/A THR 294.A OG1 THR 312.A O no hydrogen 3.427 N/A TRP 295.A NE1 SER 370.A O no hydrogen 2.985 N/A LYS 296.A N GLU 310.A O no hydrogen 2.691 N/A ARG 297.A N GLU 310.A O no hydrogen 2.915 N/A THR 300.A N VAL 308.A O no hydrogen 2.911 N/A THR 300.A OG1 ASP 301.A O no hydrogen 3.488 N/A SER 302.A N THR 306.A O no hydrogen 2.812 N/A SER 302.A OG THR 306.A O no hydrogen 2.822 N/A SER 302.A OG THR 306.A OG1 no hydrogen 2.521 N/A GLY 303.A N ASP 301.A OD1 no hydrogen 2.583 N/A HIS 304.A N SER 302.A OG no hydrogen 3.231 N/A HIS 304.A NE2 GLU 354.A OE2 no hydrogen 3.246 N/A THR 306.A N SER 302.A OG no hydrogen 3.142 N/A THR 306.A OG1 SER 302.A OG no hydrogen 2.521 N/A THR 306.A OG1 GLU 354.A OE2 no hydrogen 2.951 N/A VAL 307.A N MET 355.A O no hydrogen 2.841 N/A VAL 308.A N THR 300.A O no hydrogen 2.929 N/A MET 309.A N ILE 353.A O no hydrogen 2.976 N/A GLU 310.A N ARG 297.A O no hydrogen 2.893 N/A VAL 311.A N GLY 351.A O no hydrogen 2.967 N/A THR 312.A N THR 294.A O no hydrogen 2.753 N/A SER 314.A N LYS 292.A O no hydrogen 3.100 N/A CYS 319.A N ILE 345.A O no hydrogen 3.112 N/A ARG 320.A N THR 286.A O no hydrogen 2.788 N/A ARG 320.A NH1 GLU 6.A OE1 no hydrogen 3.226 N/A ARG 320.A NH1 GLU 6.A OE2 no hydrogen 3.518 N/A ARG 320.A NH1 ASN 342.A OD1 no hydrogen 2.889 N/A ARG 320.A NH2 GLU 6.A OE2 no hydrogen 3.053 N/A ILE 321.A N PRO 343.A O no hydrogen 2.991 N/A ARG 324.A N TYR 365.A O no hydrogen 2.996 N/A ALA 325.A N ASN 334.A OD1 no hydrogen 2.886 N/A VAL 326.A N ILE 363.A O no hydrogen 3.005 N/A HIS 328.A N ASP 361.A O no hydrogen 2.997 N/A SER 330.A OG GLY 329.A O no hydrogen 2.343 N/A VAL 333.A N SER 330.A O no hydrogen 3.043 N/A VAL 335.A N ALA 325.A O no hydrogen 2.763 N/A ALA 336.A N ASN 334.A OD1 no hydrogen 3.021 N/A MET 337.A N GLN 356.A O no hydrogen 3.172 N/A ILE 339.A N GLU 354.A O no hydrogen 2.680 N/A THR 340.A N GLU 354.A O no hydrogen 3.249 N/A THR 344.A OG1 GLU 346.A OE2 no hydrogen 2.863 N/A ILE 345.A N CYS 319.A O no hydrogen 2.931 N/A GLU 346.A N GLY 349.A O no hydrogen 2.660 N/A GLY 351.A N THR 344.A O no hydrogen 3.005 N/A ILE 353.A N MET 309.A O no hydrogen 2.953 N/A GLU 354.A N THR 340.A OG1 no hydrogen 2.935 N/A MET 355.A N VAL 307.A O no hydrogen 2.882 N/A GLN 356.A N MET 337.A O no hydrogen 2.853 N/A GLY 360.A N GLN 375.A O no hydrogen 2.664 N/A ASN 362.A N TRP 373.A O no hydrogen 2.832 N/A ASN 362.A ND2 PRO 358.A O no hydrogen 3.003 N/A ASN 362.A ND2 TRP 373.A O no hydrogen 3.578 N/A ILE 363.A N VAL 326.A O no hydrogen 2.912 N/A ILE 364.A N HIS 371.A O no hydrogen 2.796 N/A TYR 365.A N ARG 324.A O no hydrogen 2.824 N/A VAL 366.A N LEU 369.A O no hydrogen 2.766 N/A GLY 367.A N PRO 322.A O no hydrogen 2.994 N/A GLU 368.A N LYS 290.A O no hydrogen 2.825 N/A LEU 369.A N VAL 366.A O no hydrogen 3.151 N/A HIS 371.A N ILE 364.A O no hydrogen 2.996 N/A HIS 371.A ND1 GLN 372.A O no hydrogen 2.870 N/A TRP 373.A N ASN 362.A O no hydrogen 2.806 N/A TRP 373.A NE1 GLN 375.A OE1 no hydrogen 3.120 N/A GLN 375.A N GLY 360.A O no hydrogen 2.737 N/A GLN 375.A NE2 LYS 376.A O no hydrogen 3.242 N/A GLY 381.A N SER 379.A OG no hydrogen 3.134 N/A ARG 382.A NH1 ALA 248.A O no hydrogen 2.752 N/A ARG 382.A NH1 ALA 250.A O no hydrogen 2.746 N/A ARG 382.A NH2 ALA 250.A O no hydrogen 2.924 N/A