Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6lub_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N GLU 2.A OE1 no hydrogen 2.798 N/A ASN 5.A ND2 TYR 62.A OH no hydrogen 3.079 N/A ASN 5.A ND2 SER 66.A OG no hydrogen 2.784 N/A ALA 7.A N ASN 5.A OD1 no hydrogen 3.128 N/A LEU 12.A N ILE 78.A O no hydrogen 2.854 N/A LYS 13.A N GLU 16.A OE2 no hydrogen 3.344 N/A GLU 16.A N LYS 13.A O no hydrogen 2.862 N/A LYS 18.A N LEU 32.A O no hydrogen 2.884 N/A LYS 18.A NZ THR 15.A O no hydrogen 2.989 N/A ILE 20.A N LYS 30.A O no hydrogen 2.801 N/A LEU 23.A N VAL 28.A O no hydrogen 2.773 N/A GLY 24.A N VAL 28.A O no hydrogen 3.286 N/A SER 25.A OG GLY 24.A O no hydrogen 2.943 N/A TYR 29.A N ILE 46.A O no hydrogen 2.709 N/A TYR 29.A OH GLU 48.A OE1 no hydrogen 3.380 N/A LYS 30.A N LYS 21.A O no hydrogen 2.947 N/A GLY 31.A N VAL 44.A O no hydrogen 2.825 N/A LEU 32.A N LYS 18.A O no hydrogen 2.993 N/A TRP 33.A N ILE 42.A O no hydrogen 2.768 N/A ILE 34.A N GLU 16.A O no hydrogen 2.824 N/A GLU 36.A N GLU 16.A OE1 no hydrogen 2.848 N/A LYS 41.A N ASP 292.A O no hydrogen 3.078 N/A ILE 42.A N TRP 33.A O no hydrogen 2.651 N/A VAL 44.A N GLY 31.A O no hydrogen 2.842 N/A ALA 45.A N MET 88.A O no hydrogen 2.813 N/A ILE 46.A N TYR 29.A O no hydrogen 2.837 N/A LYS 47.A N LEU 86.A O no hydrogen 2.890 N/A LYS 47.A NZ GLU 60.A OE1 no hydrogen 3.372 N/A LYS 47.A NZ GLU 60.A OE2 no hydrogen 3.016 N/A GLU 48.A N THR 27.A O no hydrogen 3.273 N/A THR 49.A OG1 THR 49.A O no hydrogen 2.371 N/A ALA 53.A N SER 50.A OG no hydrogen 2.886 N/A ASN 54.A N SER 50.A O no hydrogen 3.324 N/A LYS 55.A N PRO 51.A O no hydrogen 3.247 N/A GLU 56.A N LYS 52.A O no hydrogen 3.160 N/A GLU 56.A N ALA 53.A O no hydrogen 3.221 N/A ILE 57.A N ALA 53.A O no hydrogen 3.124 N/A LEU 58.A N ASN 54.A O no hydrogen 3.178 N/A GLU 60.A N GLU 56.A O no hydrogen 2.993 N/A ALA 61.A N ILE 57.A O no hydrogen 2.957 N/A TYR 62.A N LEU 58.A O no hydrogen 2.819 N/A VAL 63.A N ASP 59.A O no hydrogen 3.064 N/A MET 64.A N GLU 60.A O no hydrogen 2.726 N/A ALA 65.A N ALA 61.A O no hydrogen 2.870 N/A SER 66.A N VAL 63.A O no hydrogen 2.862 N/A SER 66.A OG TYR 62.A O no hydrogen 2.752 N/A ASP 68.A N TYR 125.A OH no hydrogen 2.874 N/A HIS 71.A N ASN 69.A OD1 no hydrogen 2.939 N/A VAL 72.A N ASN 69.A O no hydrogen 3.105 N/A CYS 73.A N ILE 151.A O no hydrogen 2.883 N/A CYS 73.A SG ILE 151.A O no hydrogen 3.787 N/A LEU 75.A N MET 64.A O no hydrogen 3.202 N/A LEU 76.A N ILE 87.A O no hydrogen 2.842 N/A GLY 77.A N ILE 87.A O no hydrogen 3.246 N/A ILE 78.A N ARG 10.A O no hydrogen 3.022 N/A CYS 79.A N GLN 85.A O no hydrogen 2.963 N/A CYS 79.A SG LEU 12.A O no hydrogen 3.464 N/A THR 81.A OG1 THR 83.A O no hydrogen 3.116 N/A GLN 85.A N CYS 79.A O no hydrogen 3.152 N/A LEU 86.A N LYS 47.A O no hydrogen 2.837 N/A ILE 87.A N GLY 77.A O no hydrogen 2.754 N/A MET 88.A N ALA 45.A O no hydrogen 2.772 N/A GLN 89.A NE2 ASP 297.A OD2 no hydrogen 3.160 N/A LEU 90.A N PRO 43.A O no hydrogen 3.209 N/A PHE 93.A N VAL 143.A O no hydrogen 3.086 N/A GLY 94.A N MET 91.A O no hydrogen 3.164 N/A LEU 96.A N VAL 141.A O no hydrogen 2.694 N/A LEU 97.A N ALA 138.A O no hydrogen 3.304 N/A ASP 98.A N SER 95.A OG no hydrogen 3.177 N/A TYR 99.A N SER 95.A O no hydrogen 2.963 N/A VAL 100.A N LEU 96.A O no hydrogen 2.870 N/A ARG 101.A N LEU 97.A O no hydrogen 3.179 N/A ARG 101.A NE GLY 209.A O no hydrogen 2.880 N/A ARG 101.A NH2 GLY 209.A O no hydrogen 2.917 N/A GLU 102.A N ASP 98.A O no hydrogen 2.823 N/A HIS 103.A ND1 TYR 99.A O no hydrogen 3.038 N/A ASN 106.A N HIS 103.A O no hydrogen 2.926 N/A ILE 107.A N LYS 104.A O no hydrogen 3.382 N/A SER 109.A N ASP 282.A OD1 no hydrogen 3.065 N/A SER 109.A N ASP 282.A OD2 no hydrogen 3.389 N/A SER 109.A OG ASP 282.A OD2 no hydrogen 2.614 N/A GLN 110.A NE2 GLN 110.A O no hydrogen 3.460 N/A GLN 110.A NE2 ASN 114.A OD1 no hydrogen 3.069 N/A GLN 110.A NE2 ALA 270.A O no hydrogen 3.029 N/A TYR 111.A OH GLN 147.A OE1 no hydrogen 3.251 N/A LEU 112.A N GLY 108.A O no hydrogen 3.294 N/A LEU 113.A N SER 109.A O no hydrogen 2.992 N/A ASN 114.A N GLN 110.A O no hydrogen 3.050 N/A TRP 115.A N TYR 111.A O no hydrogen 2.840 N/A TRP 115.A NE1 PRO 146.A O no hydrogen 2.800 N/A CYS 116.A N LEU 112.A O no hydrogen 3.091 N/A CYS 116.A SG LEU 112.A O no hydrogen 3.352 N/A VAL 117.A N LEU 113.A O no hydrogen 2.986 N/A GLN 118.A N ASN 114.A O no hydrogen 2.871 N/A GLN 118.A NE2 GLN 147.A O no hydrogen 2.856 N/A ILE 119.A N TRP 115.A O no hydrogen 2.945 N/A ALA 120.A N CYS 116.A O no hydrogen 3.092 N/A LYS 121.A N VAL 117.A O no hydrogen 2.876 N/A GLY 122.A N GLN 118.A O no hydrogen 2.891 N/A MET 123.A N ILE 119.A O no hydrogen 2.923 N/A ASN 124.A N ALA 120.A O no hydrogen 2.789 N/A TYR 125.A N LYS 121.A O no hydrogen 2.949 N/A LEU 126.A N GLY 122.A O no hydrogen 3.028 N/A GLU 127.A N MET 123.A O no hydrogen 2.903 N/A ASP 128.A N ASN 124.A O no hydrogen 2.958 N/A ARG 129.A N TYR 125.A O no hydrogen 3.013 N/A ARG 130.A N GLU 127.A O no hydrogen 2.935 N/A ARG 130.A NH1 GLY 161.A O no hydrogen 2.702 N/A LEU 131.A N LEU 126.A O no hydrogen 2.813 N/A VAL 132.A N LYS 158.A O no hydrogen 2.985 N/A HIS 133.A N ASP 194.A OD2 no hydrogen 2.860 N/A HIS 133.A NE2 THR 152.A O no hydrogen 2.895 N/A ARG 134.A N ASP 194.A OD1 no hydrogen 3.019 N/A ARG 134.A NH1 ARG 156.A O no hydrogen 2.865 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 2.878 N/A ALA 138.A N GLU 204.A OE2 no hydrogen 3.078 N/A ARG 139.A NH2 ASP 135.A OD1 no hydrogen 2.996 N/A ASN 140.A N ALA 137.A O no hydrogen 2.834 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.738 N/A ASN 140.A ND2 ASP 135.A OD2 no hydrogen 3.113 N/A VAL 141.A N ALA 138.A O no hydrogen 3.305 N/A LEU 142.A N LYS 150.A O no hydrogen 2.797 N/A VAL 143.A N GLY 94.A O no hydrogen 2.851 N/A LYS 144.A N HIS 148.A O no hydrogen 2.998 N/A LYS 144.A NZ ASP 295.A OD2 no hydrogen 3.435 N/A LYS 144.A NZ ASP 297.A OD2 no hydrogen 2.808 N/A THR 145.A N HIS 148.A O no hydrogen 3.378 N/A GLN 147.A N THR 145.A OG1 no hydrogen 3.180 N/A GLN 147.A NE2 THR 145.A OG1 no hydrogen 3.098 N/A GLN 147.A NE2 PRO 288.A O no hydrogen 3.452 N/A HIS 148.A N THR 145.A O no hydrogen 2.846 N/A HIS 148.A NE2 PRO 70.A O no hydrogen 2.876 N/A VAL 149.A N GLN 118.A OE1 no hydrogen 2.847 N/A LYS 150.A N LEU 142.A O no hydrogen 2.920 N/A LYS 150.A NZ GLN 89.A OE1 no hydrogen 2.729 N/A LYS 150.A NZ ASP 297.A OD2 no hydrogen 2.792 N/A ILE 151.A N HIS 71.A O no hydrogen 2.956 N/A THR 152.A N ASN 140.A O no hydrogen 2.886 N/A ASP 153.A N THR 152.A OG1 no hydrogen 2.674 N/A GLY 155.A N ASP 153.A OD1 no hydrogen 3.187 N/A ARG 156.A NH1 ARG 134.A O no hydrogen 2.410 N/A ARG 156.A NH2 TYR 189.A OH no hydrogen 3.138 N/A ALA 157.A N PHE 154.A O no hydrogen 2.964 N/A LYS 158.A N VAL 132.A O no hydrogen 2.876 N/A LEU 160.A N ARG 130.A O no hydrogen 2.917 N/A TYR 167.A N TYR 189.A O no hydrogen 2.968 N/A ALA 169.A N ARG 187.A O no hydrogen 3.295 N/A LYS 177.A NZ TYR 213.A O no hydrogen 3.057 N/A LYS 177.A NZ ILE 216.A O no hydrogen 2.872 N/A TRP 178.A N PRO 175.A O no hydrogen 3.232 N/A TRP 178.A NE1 GLU 204.A OE2 no hydrogen 2.560 N/A MET 179.A N ILE 176.A O no hydrogen 3.047 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.839 N/A SER 183.A N ALA 180.A O no hydrogen 3.308 N/A SER 183.A OG ILE 188.A O no hydrogen 2.573 N/A ILE 184.A N ALA 180.A O no hydrogen 3.314 N/A LEU 185.A N LEU 181.A O no hydrogen 3.038 N/A HIS 186.A N GLU 182.A O no hydrogen 3.071 N/A ARG 187.A N SER 183.A O no hydrogen 2.861 N/A TYR 189.A N TYR 167.A O no hydrogen 3.096 N/A THR 190.A N SER 193.A OG no hydrogen 2.963 N/A GLN 192.A NE2 ALA 253.A O no hydrogen 3.196 N/A GLN 192.A NE2 PRO 257.A O no hydrogen 3.183 N/A SER 193.A N THR 190.A OG1 no hydrogen 3.222 N/A SER 193.A OG THR 190.A O no hydrogen 2.844 N/A ASP 194.A N THR 190.A O no hydrogen 3.175 N/A VAL 195.A N HIS 191.A O no hydrogen 3.070 N/A TRP 196.A N GLN 192.A O no hydrogen 3.444 N/A SER 197.A N SER 193.A O no hydrogen 3.414 N/A SER 197.A OG TRP 178.A O no hydrogen 2.568 N/A TYR 198.A N ASP 194.A O no hydrogen 2.831 N/A TYR 198.A OH CYS 116.A O no hydrogen 2.713 N/A GLY 199.A N VAL 195.A O no hydrogen 2.973 N/A VAL 200.A N TRP 196.A O no hydrogen 3.163 N/A THR 201.A N SER 197.A O no hydrogen 2.841 N/A THR 201.A OG1 SER 197.A O no hydrogen 2.680 N/A VAL 202.A N TYR 198.A O no hydrogen 2.820 N/A TRP 203.A N GLY 199.A O no hydrogen 2.978 N/A TRP 203.A NE1 PRO 232.A O no hydrogen 2.731 N/A GLU 204.A N VAL 200.A O no hydrogen 2.836 N/A LEU 205.A N THR 201.A O no hydrogen 3.078 N/A MET 206.A N VAL 202.A O no hydrogen 2.950 N/A THR 207.A N TRP 203.A O no hydrogen 3.080 N/A THR 207.A OG1 TRP 203.A O no hydrogen 3.055 N/A THR 207.A OG1 GLU 204.A O no hydrogen 3.268 N/A PHE 208.A N LEU 205.A O no hydrogen 3.018 N/A GLY 209.A N GLU 204.A O no hydrogen 2.790 N/A SER 210.A N THR 207.A OG1 no hydrogen 3.071 N/A SER 210.A OG THR 207.A O no hydrogen 3.368 N/A ILE 216.A N TYR 213.A O no hydrogen 3.015 N/A GLU 220.A N PRO 217.A O no hydrogen 2.843 N/A ILE 221.A N ALA 218.A O no hydrogen 3.074 N/A SER 223.A N GLU 220.A O no hydrogen 3.036 N/A ILE 224.A N GLU 220.A O no hydrogen 3.118 N/A LEU 225.A N ILE 221.A O no hydrogen 2.990 N/A GLU 226.A N SER 222.A O no hydrogen 3.196 N/A LYS 227.A N SER 223.A O no hydrogen 2.919 N/A GLY 228.A N LEU 225.A O no hydrogen 3.285 N/A GLU 229.A N ILE 224.A O no hydrogen 3.281 N/A ARG 230.A NE TRP 249.A O no hydrogen 2.997 N/A ARG 230.A NH1 LEU 225.A O no hydrogen 3.179 N/A ARG 230.A NH1 GLU 229.A O no hydrogen 2.605 N/A ARG 230.A NH2 TRP 249.A O no hydrogen 2.843 N/A GLN 233.A NE2 CYS 237.A O no hydrogen 2.866 N/A CYS 237.A N PRO 234.A O no hydrogen 2.892 N/A THR 238.A N TYR 276.A O no hydrogen 3.328 N/A THR 238.A OG1 ASP 240.A OD1 no hydrogen 3.537 N/A THR 238.A OG1 TYR 276.A O no hydrogen 2.799 N/A TYR 242.A N THR 238.A O no hydrogen 3.054 N/A TYR 242.A OH LEU 231.A O no hydrogen 2.675 N/A MET 243.A N ILE 239.A O no hydrogen 2.749 N/A ILE 244.A N ASP 240.A O no hydrogen 3.413 N/A MET 245.A N VAL 241.A O no hydrogen 3.210 N/A VAL 246.A N TYR 242.A O no hydrogen 2.925 N/A LYS 247.A N MET 243.A O no hydrogen 3.011 N/A CYS 248.A N ILE 244.A O no hydrogen 3.250 N/A CYS 248.A N MET 245.A O no hydrogen 2.829 N/A CYS 248.A SG ILE 244.A O no hydrogen 3.535 N/A TRP 249.A N VAL 246.A O no hydrogen 2.944 N/A SER 255.A N ASP 252.A O no hydrogen 2.916 N/A SER 255.A OG ASP 252.A OD2 no hydrogen 2.719 N/A ARG 256.A N ALA 253.A O no hydrogen 3.375 N/A ARG 256.A NE MET 250.A O no hydrogen 3.005 N/A ARG 256.A NH1 GLU 182.A OE1 no hydrogen 2.817 N/A ARG 256.A NH1 MET 250.A O no hydrogen 3.032 N/A ARG 256.A NH2 GLU 182.A OE1 no hydrogen 3.492 N/A ARG 256.A NH2 GLU 182.A OE2 no hydrogen 2.971 N/A ARG 256.A NH2 GLN 192.A O no hydrogen 3.024 N/A LYS 258.A N GLU 261.A OE1 no hydrogen 3.120 N/A LYS 258.A NZ GLU 127.A OE1 no hydrogen 2.901 N/A LYS 258.A NZ GLN 192.A OE1 no hydrogen 2.805 N/A GLU 261.A N LYS 258.A O no hydrogen 2.893 N/A LEU 262.A N LYS 258.A O no hydrogen 2.995 N/A ILE 263.A N PHE 259.A O no hydrogen 2.962 N/A GLU 265.A N GLU 261.A O no hydrogen 2.867 N/A PHE 266.A N LEU 262.A O no hydrogen 3.058 N/A SER 267.A N ILE 263.A O no hydrogen 2.860 N/A SER 267.A OG ILE 263.A O no hydrogen 2.690 N/A LYS 268.A N ILE 264.A O no hydrogen 2.943 N/A LYS 268.A NZ GLU 265.A OE1 no hydrogen 3.141 N/A MET 269.A N GLU 265.A O no hydrogen 3.073 N/A ALA 270.A N PHE 266.A O no hydrogen 2.888 N/A ARG 271.A N LYS 268.A O no hydrogen 3.246 N/A ASP 272.A N MET 269.A O no hydrogen 3.183 N/A ARG 275.A N ASP 272.A O no hydrogen 3.109 N/A TYR 276.A N PRO 273.A O no hydrogen 2.976 N/A LEU 277.A N PRO 273.A O no hydrogen 3.034 N/A VAL 278.A N ILE 236.A O no hydrogen 2.895 N/A ASP 282.A N ILE 279.A O no hydrogen 3.288 N/A ARG 284.A N GLY 281.A O no hydrogen 3.153 N/A MET 285.A N ASP 282.A O no hydrogen 3.361 N/A ASP 291.A N ASP 289.A OD1 no hydrogen 3.293 N/A VAL 294.A N LYS 41.A O no hydrogen 3.040 N/A ASP 297.A N ASP 295.A OD2 no hydrogen 2.934 N/A GLU 298.A N ASP 295.A O no hydrogen 2.921 N/A TYR 299.A N ALA 296.A O no hydrogen 3.063 N/A TYR 299.A OH GLU 38.A OE1 no hydrogen 2.353 N/A TYR 299.A OH GLU 38.A OE2 no hydrogen 2.788 N/A