Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1u98_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ASP 1.A O no hydrogen 3.113 N/A LYS 6.A N GLU 2.A O no hydrogen 3.469 N/A ALA 7.A N ASN 3.A O no hydrogen 2.841 N/A LEU 8.A N LYS 4.A O no hydrogen 2.660 N/A ALA 9.A N GLN 5.A O no hydrogen 2.862 N/A ALA 10.A N LYS 6.A O no hydrogen 2.848 N/A ALA 11.A N ALA 7.A O no hydrogen 2.903 N/A LEU 12.A N LEU 8.A O no hydrogen 2.887 N/A GLY 13.A N ALA 9.A O no hydrogen 3.089 N/A GLN 14.A N ALA 10.A O no hydrogen 3.069 N/A ILE 15.A N ALA 11.A O no hydrogen 2.965 N/A GLU 16.A N LEU 12.A O no hydrogen 3.001 N/A LYS 17.A N GLY 13.A O no hydrogen 2.806 N/A GLN 18.A N GLN 14.A O no hydrogen 2.675 N/A PHE 19.A N ILE 15.A O no hydrogen 2.680 N/A GLY 20.A N GLU 16.A O no hydrogen 2.793 N/A GLY 22.A N GLU 16.A OE1 no hydrogen 2.669 N/A SER 23.A N GLY 20.A O no hydrogen 3.147 N/A SER 23.A OG GLY 20.A O no hydrogen 2.826 N/A ILE 24.A N GLU 16.A OE2 no hydrogen 2.881 N/A GLU 29.A N ARG 26.A O no hydrogen 2.745 N/A SER 32.A OG ILE 234.A O no hydrogen 3.233 N/A MET 33.A N ILE 234.A O no hydrogen 3.212 N/A ILE 38.A N LEU 54.A O no hydrogen 2.957 N/A SER 39.A OG ASP 46.A OD2 no hydrogen 2.596 N/A THR 40.A N ASP 46.A OD1 no hydrogen 2.927 N/A THR 40.A OG1 ASP 46.A OD1 no hydrogen 2.959 N/A GLY 41.A N SER 39.A OG no hydrogen 3.091 N/A SER 42.A N THR 40.A OG1 no hydrogen 3.208 N/A SER 42.A OG GLU 256.A OE1 no hydrogen 3.475 N/A SER 42.A OG GLU 256.A OE2 no hydrogen 2.573 N/A LEU 43.A N GLU 256.A OE1 no hydrogen 2.799 N/A SER 44.A N GLU 256.A OE2 no hydrogen 3.164 N/A SER 44.A OG SER 42.A OG no hydrogen 3.145 N/A SER 44.A OG GLU 256.A OE2 no hydrogen 2.585 N/A LEU 45.A N SER 42.A OG no hydrogen 3.138 N/A ASP 46.A N SER 42.A O no hydrogen 3.022 N/A ILE 47.A N LEU 43.A O no hydrogen 3.022 N/A ALA 48.A N SER 44.A O no hydrogen 2.890 N/A LEU 49.A N LEU 45.A O no hydrogen 2.894 N/A GLY 50.A N ILE 47.A O no hydrogen 2.877 N/A LEU 54.A N ILE 38.A O no hydrogen 2.889 N/A MET 56.A N GLU 36.A O no hydrogen 2.882 N/A ARG 58.A NH1 SER 203.A OG no hydrogen 2.873 N/A VAL 60.A N LEU 185.A O no hydrogen 2.879 N/A GLU 61.A N VAL 204.A O no hydrogen 3.010 N/A ILE 62.A N PHE 187.A O no hydrogen 2.990 N/A TYR 63.A N LEU 206.A O no hydrogen 2.863 N/A TYR 63.A OH ASP 207.A OD2 no hydrogen 3.410 N/A GLY 64.A N ASN 189.A O no hydrogen 3.377 N/A SER 68.A N PRO 65.A O no hydrogen 3.206 N/A SER 68.A OG PRO 65.A O no hydrogen 2.695 N/A LYS 70.A NZ GLY 64.A O no hydrogen 2.901 N/A LYS 70.A NZ PRO 65.A O no hydrogen 2.862 N/A THR 72.A OG1 TYR 101.A OH no hydrogen 2.868 N/A LEU 73.A N GLY 69.A O no hydrogen 3.030 N/A THR 74.A N LYS 70.A O no hydrogen 3.300 N/A THR 74.A OG1 THR 71.A O no hydrogen 2.899 N/A LEU 75.A N THR 71.A O no hydrogen 2.995 N/A GLN 76.A N THR 72.A O no hydrogen 2.929 N/A VAL 77.A N LEU 73.A O no hydrogen 2.947 N/A ILE 78.A N THR 74.A O no hydrogen 2.988 N/A ALA 79.A N LEU 75.A O no hydrogen 2.823 N/A ALA 80.A N GLN 76.A O no hydrogen 3.010 N/A ALA 81.A N VAL 77.A O no hydrogen 2.995 N/A GLN 82.A N ILE 78.A O no hydrogen 2.899 N/A GLN 82.A NE2 ASP 108.A O no hydrogen 3.056 N/A ARG 83.A N ALA 79.A O no hydrogen 2.979 N/A GLU 84.A N ALA 81.A O no hydrogen 2.792 N/A GLY 85.A N GLN 82.A O no hydrogen 2.780 N/A LYS 86.A N ALA 81.A O no hydrogen 3.110 N/A LYS 86.A NZ GLU 36.A OE1 no hydrogen 3.473 N/A LYS 86.A NZ GLU 84.A OE2 no hydrogen 2.868 N/A THR 87.A N ASP 137.A OD2 no hydrogen 2.780 N/A CYS 88.A SG ILE 78.A O no hydrogen 3.850 N/A ALA 89.A N VAL 138.A O no hydrogen 2.790 N/A PHE 90.A N LEU 113.A O no hydrogen 2.746 N/A ILE 91.A N VAL 140.A O no hydrogen 2.773 N/A ASP 92.A N SER 115.A O no hydrogen 2.670 N/A ALA 93.A N ASP 142.A O no hydrogen 2.805 N/A GLU 94.A N ASP 92.A OD1 no hydrogen 2.823 N/A HIS 95.A N ASP 92.A OD1 no hydrogen 2.643 N/A ILE 100.A N ASP 98.A OD1 no hydrogen 3.045 N/A TYR 101.A N ASP 98.A OD1 no hydrogen 3.202 N/A TYR 101.A OH THR 72.A OG1 no hydrogen 2.868 N/A ALA 102.A N ASP 98.A O no hydrogen 2.907 N/A ARG 103.A N PRO 99.A O no hydrogen 3.021 N/A LYS 104.A N ILE 100.A O no hydrogen 3.255 N/A LEU 105.A N TYR 101.A O no hydrogen 3.075 N/A LEU 105.A N ALA 102.A O no hydrogen 3.002 N/A GLY 106.A N ARG 103.A O no hydrogen 2.788 N/A VAL 107.A N ALA 102.A O no hydrogen 2.943 N/A ASP 108.A N GLN 82.A OE1 no hydrogen 2.568 N/A ASN 111.A N ASP 108.A O no hydrogen 3.130 N/A ASN 111.A N ASP 108.A OD1 no hydrogen 3.418 N/A ASN 111.A ND2 ASP 108.A OD1 no hydrogen 3.383 N/A ASN 111.A ND2 ASP 108.A OD2 no hydrogen 2.594 N/A LEU 112.A N ILE 109.A O no hydrogen 2.997 N/A LEU 113.A N CYS 88.A O no hydrogen 3.049 N/A CYS 114.A SG PHE 90.A O no hydrogen 3.753 N/A SER 115.A N PHE 90.A O no hydrogen 3.012 N/A ASP 118.A N GLN 122.A OE1 no hydrogen 2.795 N/A THR 119.A OG1 GLU 121.A OE1 no hydrogen 3.497 N/A GLY 120.A N THR 148.A O no hydrogen 2.871 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.722 N/A GLN 122.A N THR 119.A OG1 no hydrogen 2.882 N/A GLN 122.A NE2 ASP 118.A OD2 no hydrogen 3.146 N/A ALA 123.A N THR 119.A O no hydrogen 2.990 N/A LEU 124.A N GLY 120.A O no hydrogen 3.077 N/A GLU 125.A N GLU 121.A O no hydrogen 2.886 N/A ILE 126.A N GLN 122.A O no hydrogen 2.869 N/A CYS 127.A N ALA 123.A O no hydrogen 2.999 N/A CYS 127.A SG ALA 123.A O no hydrogen 3.436 N/A ASP 128.A N LEU 124.A O no hydrogen 2.949 N/A ALA 129.A N GLU 125.A O no hydrogen 2.897 N/A LEU 130.A N ILE 126.A O no hydrogen 2.943 N/A ALA 131.A N CYS 127.A O no hydrogen 2.928 N/A ARG 132.A N ASP 128.A O no hydrogen 2.943 N/A SER 133.A N ALA 129.A O no hydrogen 3.099 N/A SER 133.A OG LEU 130.A O no hydrogen 2.774 N/A ALA 135.A N SER 133.A OG no hydrogen 2.925 N/A ASP 137.A N THR 87.A O no hydrogen 2.860 N/A VAL 138.A N THR 87.A O no hydrogen 3.151 N/A ILE 139.A N LEU 184.A O no hydrogen 2.851 N/A VAL 140.A N ALA 89.A O no hydrogen 2.890 N/A VAL 141.A N ILE 186.A O no hydrogen 2.792 N/A ASP 142.A N ILE 91.A O no hydrogen 2.976 N/A SER 143.A OG GLU 94.A OE1 no hydrogen 2.614 N/A VAL 144.A N ILE 188.A O no hydrogen 2.851 N/A ALA 146.A N SER 143.A O no hydrogen 3.064 N/A LEU 147.A N VAL 144.A O no hydrogen 3.129 N/A THR 148.A N ALA 146.A O no hydrogen 2.811 N/A THR 148.A OG1 ALA 146.A O no hydrogen 3.346 N/A LYS 150.A N GLU 121.A OE1 no hydrogen 2.889 N/A LYS 150.A N GLU 121.A OE2 no hydrogen 3.415 N/A ILE 153.A N PRO 149.A O no hydrogen 3.000 N/A GLU 154.A N LYS 150.A O no hydrogen 2.881 N/A GLY 155.A N GLU 152.A O no hydrogen 2.754 N/A GLY 161.A N SER 158.A OG no hydrogen 3.255 N/A LEU 162.A N SER 158.A O no hydrogen 2.805 N/A ALA 163.A N HIS 159.A O no hydrogen 3.049 N/A ALA 164.A N MET 160.A O no hydrogen 2.996 N/A ARG 165.A N GLY 161.A O no hydrogen 2.968 N/A MET 166.A N LEU 162.A O no hydrogen 2.903 N/A MET 167.A N ALA 163.A O no hydrogen 3.000 N/A SER 168.A N ALA 164.A O no hydrogen 2.980 N/A SER 168.A OG ALA 164.A O no hydrogen 3.019 N/A GLN 169.A N ARG 165.A O no hydrogen 2.929 N/A ALA 170.A N MET 167.A O no hydrogen 3.241 N/A MET 171.A N MET 167.A O no hydrogen 3.002 N/A LEU 174.A N ALA 170.A O no hydrogen 3.107 N/A ALA 175.A N MET 171.A O no hydrogen 2.822 N/A GLY 176.A N ARG 172.A O no hydrogen 3.007 N/A ASN 177.A N LYS 173.A O no hydrogen 2.941 N/A LEU 178.A N LEU 174.A O no hydrogen 2.814 N/A LYS 179.A N ALA 175.A O no hydrogen 2.978 N/A GLN 180.A N GLY 176.A O no hydrogen 2.946 N/A SER 181.A N ASN 177.A O no hydrogen 3.111 N/A SER 181.A OG ALA 131.A O no hydrogen 2.576 N/A SER 181.A OG ASN 177.A O no hydrogen 2.985 N/A SER 181.A OG LEU 178.A O no hydrogen 3.551 N/A SER 181.A OG THR 183.A OG1 no hydrogen 2.744 N/A ASN 182.A N LYS 179.A O no hydrogen 3.174 N/A ASN 182.A ND2 GLU 36.A OE2 no hydrogen 3.173 N/A THR 183.A N LEU 178.A O no hydrogen 2.821 N/A THR 183.A OG1 VAL 136.A O no hydrogen 2.855 N/A THR 183.A OG1 SER 181.A OG no hydrogen 2.744 N/A LEU 184.A N ASP 137.A O no hydrogen 3.034 N/A LEU 185.A N ARG 58.A O no hydrogen 3.114 N/A ILE 186.A N ILE 139.A O no hydrogen 2.832 N/A PHE 187.A N VAL 60.A O no hydrogen 2.769 N/A ILE 188.A N VAL 141.A O no hydrogen 2.950 N/A ASN 189.A N ILE 62.A O no hydrogen 2.848 N/A ASN 189.A ND2 GLU 61.A OE2 no hydrogen 2.924 N/A ASN 189.A ND2 THR 193.A O no hydrogen 2.840 N/A GLN 190.A N ASN 189.A OD1 no hydrogen 2.726 N/A THR 192.A OG1 GLU 61.A OE2 no hydrogen 2.746 N/A THR 193.A N GLN 190.A O no hydrogen 3.480 N/A THR 193.A OG1 ASN 189.A OD1 no hydrogen 2.878 N/A PHE 200.A N ASN 196.A O no hydrogen 3.156 N/A TYR 201.A N ALA 197.A O no hydrogen 2.913 N/A ALA 202.A N LEU 198.A O no hydrogen 2.940 N/A SER 203.A N ILE 59.A O no hydrogen 2.818 N/A ARG 205.A N LYS 231.A O no hydrogen 3.033 N/A ARG 205.A NE GLU 61.A OE1 no hydrogen 2.677 N/A ARG 205.A NH2 GLU 61.A OE1 no hydrogen 2.997 N/A LEU 206.A N GLU 61.A O no hydrogen 2.714 N/A ASP 207.A N LYS 228.A O no hydrogen 2.920 N/A ILE 208.A N TYR 63.A O no hydrogen 2.971 N/A ARG 209.A N ARG 226.A O no hydrogen 3.003 N/A ARG 209.A NE ASP 207.A OD1 no hydrogen 2.816 N/A ARG 209.A NH2 ASP 207.A OD2 no hydrogen 2.940 N/A ARG 210.A NE SER 223.A OG no hydrogen 2.866 N/A ILE 211.A N GLU 224.A O no hydrogen 2.957 N/A VAL 214.A N GLY 222.A O no hydrogen 2.874 N/A GLU 216.A N ASN 219.A O no hydrogen 3.046 N/A VAL 221.A N VAL 214.A O no hydrogen 2.736 N/A GLY 222.A N VAL 214.A O no hydrogen 3.288 N/A SER 223.A N ILE 245.A O no hydrogen 2.824 N/A GLU 224.A N GLY 212.A O no hydrogen 2.756 N/A THR 225.A N PHE 243.A O no hydrogen 2.684 N/A THR 225.A OG1 SER 223.A O no hydrogen 3.361 N/A ARG 226.A N ARG 209.A O no hydrogen 3.027 N/A ARG 226.A NE GLU 242.A OE2 no hydrogen 2.831 N/A ARG 226.A NH2 GLU 242.A OE2 no hydrogen 3.061 N/A VAL 227.A N ALA 241.A O no hydrogen 2.831 N/A LYS 228.A N ASP 207.A O no hydrogen 2.791 N/A VAL 229.A N LYS 239.A O no hydrogen 2.914 N/A LYS 231.A N ARG 205.A O no hydrogen 3.452 N/A LYS 231.A NZ LYS 199.A O no hydrogen 2.819 N/A LYS 231.A NZ ALA 202.A O no hydrogen 2.722 N/A ASN 232.A ND2 LEU 49.A O no hydrogen 3.060 N/A LYS 233.A N SER 203.A O no hydrogen 2.819 N/A ILE 234.A N ASN 232.A OD1 no hydrogen 2.959 N/A ALA 235.A N ASN 232.A OD1 no hydrogen 3.105 N/A PHE 238.A N VAL 229.A O no hydrogen 2.678 N/A ALA 241.A N VAL 227.A O no hydrogen 2.812 N/A PHE 243.A N THR 225.A O no hydrogen 3.044 N/A GLN 244.A NE2 GLU 224.A OE1 no hydrogen 2.799 N/A ILE 245.A N SER 223.A O no hydrogen 2.941 N/A LEU 246.A N GLY 250.A O no hydrogen 2.780 N/A TYR 247.A N VAL 221.A O no hydrogen 2.873 N/A GLU 249.A N LEU 246.A O no hydrogen 3.071 N/A GLY 250.A N LEU 246.A O no hydrogen 2.763 N/A ILE 251.A N GLN 76.A OE1 no hydrogen 2.859 N/A ASN 252.A N GLN 244.A O no hydrogen 2.882 N/A ASN 252.A ND2 GLN 244.A OE1 no hydrogen 2.983 N/A PHE 253.A N ILE 251.A O no hydrogen 2.894 N/A GLY 255.A N ASN 252.A O no hydrogen 3.226 N/A GLY 255.A N ASN 252.A OD1 no hydrogen 3.053 N/A GLU 256.A N ASN 252.A O no hydrogen 3.333 N/A LEU 257.A N PHE 253.A O no hydrogen 2.940 N/A VAL 258.A N TYR 254.A O no hydrogen 3.030 N/A ASP 259.A N GLY 255.A O no hydrogen 3.392 N/A LEU 260.A N GLU 256.A O no hydrogen 2.816 N/A GLY 261.A N LEU 257.A O no hydrogen 2.669 N/A VAL 262.A N VAL 258.A O no hydrogen 2.990 N/A LYS 263.A N ASP 259.A O no hydrogen 2.904 N/A GLU 264.A N LEU 260.A O no hydrogen 2.867 N/A LYS 265.A N VAL 262.A O no hydrogen 2.823 N/A LYS 265.A NZ LYS 263.A O no hydrogen 3.124 N/A LEU 266.A N GLY 261.A O no hydrogen 2.788 N/A ILE 267.A N GLY 261.A O no hydrogen 3.009 N/A GLU 268.A N SER 275.A O no hydrogen 2.797 N/A ALA 270.A N TRP 273.A O no hydrogen 2.720 N/A TRP 273.A N ALA 270.A O no hydrogen 2.992 N/A TYR 274.A N GLY 282.A O no hydrogen 2.856 N/A SER 275.A N GLU 268.A O no hydrogen 2.731 N/A TYR 276.A N GLU 279.A O no hydrogen 2.889 N/A TYR 276.A OH GLU 301.A OE1 no hydrogen 2.622 N/A LYS 277.A NZ GLU 301.A OE1 no hydrogen 3.243 N/A LYS 277.A NZ GLU 301.A OE2 no hydrogen 3.318 N/A ILE 281.A N TYR 274.A O no hydrogen 2.715 N/A GLY 284.A N ALA 272.A O no hydrogen 2.528 N/A ASN 287.A ND2 GLN 283.A O no hydrogen 2.491 N/A ALA 288.A N GLY 284.A O no hydrogen 2.989 N/A THR 289.A N LYS 285.A O no hydrogen 2.802 N/A THR 289.A OG1 LYS 285.A O no hydrogen 2.662 N/A ALA 290.A N ALA 286.A O no hydrogen 3.058 N/A TRP 291.A N ASN 287.A O no hydrogen 2.816 N/A LEU 292.A N ALA 288.A O no hydrogen 3.130 N/A LYS 293.A N THR 289.A O no hydrogen 2.987 N/A ASP 294.A N ALA 290.A O no hydrogen 2.954 N/A ASN 295.A N TRP 291.A O no hydrogen 2.810 N/A ASN 295.A N LEU 292.A O no hydrogen 3.056 N/A ASN 295.A ND2 TRP 291.A O no hydrogen 2.901 N/A THR 298.A N ASN 295.A O no hydrogen 3.038 N/A ALA 299.A N ASN 295.A O no hydrogen 3.141 N/A LYS 300.A N PRO 296.A O no hydrogen 2.984 N/A LYS 300.A NZ GLU 297.A OE1 no hydrogen 3.347 N/A GLU 301.A N GLU 297.A O no hydrogen 3.270 N/A ILE 302.A N THR 298.A O no hydrogen 3.069 N/A GLU 303.A N ALA 299.A O no hydrogen 2.823 N/A LYS 304.A N LYS 300.A O no hydrogen 2.851 N/A LYS 305.A N GLU 301.A O no hydrogen 3.196 N/A VAL 306.A N ILE 302.A O no hydrogen 2.754 N/A ARG 307.A N GLU 303.A O no hydrogen 2.818 N/A ARG 307.A NE GLU 303.A OE2 no hydrogen 3.156 N/A ARG 307.A NH1 GLY 52.A O no hydrogen 3.349 N/A ARG 307.A NH2 ASP 46.A OD2 no hydrogen 2.813 N/A ARG 307.A NH2 GLU 303.A OE2 no hydrogen 3.325 N/A GLU 308.A N LYS 304.A O no hydrogen 2.988 N/A LEU 309.A N LYS 305.A O no hydrogen 2.984 N/A LEU 310.A N VAL 306.A O no hydrogen 2.899 N/A LEU 311.A N ARG 307.A O no hydrogen 2.836 N/A