Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2yxu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ASP 76.A OD2 no hydrogen 2.800 N/A VAL 5.A N GLU 32.A O no hydrogen 3.021 N/A LEU 6.A N TYR 77.A O no hydrogen 2.922 N/A SER 7.A N ASP 34.A O no hydrogen 2.814 N/A SER 7.A OG GLN 9.A OE1 no hydrogen 3.410 N/A SER 7.A OG ASN 19.A OD1 no hydrogen 2.434 N/A ILE 8.A N LEU 79.A O no hydrogen 2.856 N/A GLN 9.A N VAL 36.A O no hydrogen 3.196 N/A HIS 11.A N VAL 39.A O no hydrogen 3.028 N/A ILE 13.A N PHE 41.A O no hydrogen 2.828 N/A ARG 14.A N SER 42.A O no hydrogen 3.032 N/A TYR 16.A N GLU 284.A OE1 no hydrogen 3.090 N/A GLY 18.A N ASP 229.A OD2 no hydrogen 2.805 N/A ASN 19.A N SER 10.A O no hydrogen 2.779 N/A ASN 19.A ND2 SER 7.A O no hydrogen 3.231 N/A ASN 19.A ND2 GLN 9.A O no hydrogen 3.027 N/A ASN 19.A ND2 ASN 37.A OD1 no hydrogen 3.613 N/A ARG 20.A N VAL 17.A O no hydrogen 3.074 N/A ARG 20.A NH2 GLY 15.A O no hydrogen 3.345 N/A ALA 21.A N GLY 18.A O no hydrogen 3.073 N/A ALA 22.A N GLY 18.A O no hydrogen 2.985 N/A THR 23.A N ASN 19.A O no hydrogen 2.817 N/A THR 23.A OG1 ASN 19.A O no hydrogen 2.520 N/A LEU 26.A N ALA 22.A O no hydrogen 3.425 N/A GLN 27.A N THR 23.A O no hydrogen 2.809 N/A VAL 28.A N PHE 24.A O no hydrogen 2.905 N/A LEU 29.A N PRO 25.A O no hydrogen 3.144 N/A GLY 30.A N GLN 27.A O no hydrogen 2.833 N/A PHE 31.A N LEU 26.A O no hydrogen 2.968 N/A GLU 32.A N CYS 3.A O no hydrogen 2.962 N/A ASP 34.A N VAL 5.A O no hydrogen 2.822 N/A VAL 36.A N SER 7.A O no hydrogen 2.836 N/A SER 38.A N GLN 9.A O no hydrogen 2.885 N/A GLN 40.A N GLN 53.A O no hydrogen 2.959 N/A PHE 41.A N HIS 11.A O no hydrogen 2.904 N/A SER 42.A N LYS 51.A O no hydrogen 2.880 N/A SER 42.A OG ASN 43.A OD1 no hydrogen 2.534 N/A ASN 43.A ND2 HIS 44.A O no hydrogen 2.904 N/A ASN 43.A ND2 HIS 49.A O no hydrogen 2.716 N/A TYR 47.A OH GLU 284.A OE2 no hydrogen 2.455 N/A LYS 51.A N SER 42.A OG no hydrogen 3.390 N/A GLN 53.A N GLN 40.A O no hydrogen 3.151 N/A LEU 55.A N SER 38.A O no hydrogen 2.886 N/A ASN 56.A N GLU 59.A OE1 no hydrogen 2.888 N/A GLU 59.A N ASN 56.A OD1 no hydrogen 2.642 N/A LEU 60.A N ASN 56.A O no hydrogen 2.882 N/A GLN 61.A N SER 57.A O no hydrogen 3.022 N/A GLU 62.A N ASP 58.A O no hydrogen 2.907 N/A LEU 63.A N GLU 59.A O no hydrogen 3.012 N/A TYR 64.A N LEU 60.A O no hydrogen 2.987 N/A TYR 64.A OH GLU 98.A OE1 no hydrogen 3.166 N/A GLU 65.A N GLN 61.A O no hydrogen 2.727 N/A GLY 66.A N GLU 62.A O no hydrogen 3.017 N/A LEU 67.A N LEU 63.A O no hydrogen 3.211 N/A ARG 68.A N TYR 64.A O no hydrogen 2.870 N/A ARG 68.A NE GLU 65.A OE1 no hydrogen 3.034 N/A ARG 68.A NH2 GLU 65.A OE1 no hydrogen 2.557 N/A LEU 69.A N GLU 65.A O no hydrogen 2.834 N/A ASN 70.A N LEU 67.A O no hydrogen 3.267 N/A ASN 70.A ND2 GLY 66.A O no hydrogen 3.348 N/A ASN 71.A N ARG 68.A O no hydrogen 2.617 N/A MET 72.A N LEU 67.A O no hydrogen 2.813 N/A ASN 73.A ND2 TYR 64.A OH no hydrogen 2.815 N/A LYS 74.A NZ GLN 102.A OE1 no hydrogen 2.504 N/A TYR 75.A OH ASP 34.A OD2 no hydrogen 2.550 N/A ASP 76.A N ARG 4.A O no hydrogen 2.936 N/A TYR 77.A N ARG 4.A O no hydrogen 3.099 N/A TYR 77.A OH HIS 240.A ND1 no hydrogen 2.486 N/A VAL 78.A N VAL 107.A O no hydrogen 3.100 N/A LEU 79.A N LEU 6.A O no hydrogen 2.803 N/A THR 80.A N VAL 109.A O no hydrogen 3.195 N/A THR 80.A OG1 TYR 108.A OH no hydrogen 2.818 N/A TYR 82.A OH TYR 125.A O no hydrogen 3.169 N/A THR 83.A OG1 GLY 81.A O no hydrogen 3.370 N/A SER 87.A N ASP 85.A OD1 no hydrogen 2.833 N/A SER 87.A OG ASP 85.A OD1 no hydrogen 2.763 N/A PHE 88.A N ASP 85.A OD2 no hydrogen 2.719 N/A LEU 89.A N ASP 85.A O no hydrogen 2.917 N/A ALA 90.A N LYS 86.A O no hydrogen 2.949 N/A MET 91.A N SER 87.A O no hydrogen 3.056 N/A VAL 92.A N PHE 88.A O no hydrogen 2.964 N/A VAL 93.A N LEU 89.A O no hydrogen 3.031 N/A ASP 94.A N ALA 90.A O no hydrogen 2.988 N/A ILE 95.A N MET 91.A O no hydrogen 2.910 N/A VAL 96.A N VAL 92.A O no hydrogen 2.752 N/A GLN 97.A N VAL 93.A O no hydrogen 2.915 N/A GLU 98.A N ASP 94.A O no hydrogen 3.102 N/A LEU 99.A N ILE 95.A O no hydrogen 2.891 N/A LYS 100.A N VAL 96.A O no hydrogen 2.947 N/A LYS 100.A NZ LEU 141.A O no hydrogen 3.266 N/A LYS 100.A NZ ASP 143.A OD1 no hydrogen 3.008 N/A GLN 101.A N GLN 97.A O no hydrogen 3.084 N/A GLN 102.A N GLU 98.A O no hydrogen 3.144 N/A ASN 103.A N LEU 99.A O no hydrogen 2.851 N/A ASN 103.A ND2 TYR 75.A O no hydrogen 3.300 N/A ARG 105.A N ASN 103.A OD1 no hydrogen 2.918 N/A LEU 106.A N ASN 103.A O no hydrogen 2.875 N/A VAL 107.A N ASP 76.A O no hydrogen 2.890 N/A TYR 108.A N ASP 143.A OD1 no hydrogen 2.830 N/A TYR 108.A OH THR 80.A OG1 no hydrogen 2.818 N/A VAL 109.A N VAL 78.A O no hydrogen 2.760 N/A CYS 110.A N ILE 144.A O no hydrogen 2.959 N/A ASP 111.A N THR 80.A O no hydrogen 2.945 N/A VAL 113.A N ASP 111.A O no hydrogen 2.888 N/A LEU 114.A N GLU 151.A OE2 no hydrogen 3.003 N/A GLY 115.A N GLU 151.A OE2 no hydrogen 3.468 N/A ASP 116.A N SER 123.A O no hydrogen 3.137 N/A LYS 117.A N ASP 116.A OD1 no hydrogen 2.743 N/A LYS 117.A NZ GLU 153.A OE1 no hydrogen 2.673 N/A TRP 118.A N GLU 121.A O no hydrogen 3.039 N/A SER 123.A N ASP 116.A O no hydrogen 2.802 N/A TYR 125.A N LEU 114.A O no hydrogen 2.778 N/A LEU 130.A N PRO 127.A O no hydrogen 3.186 N/A LEU 131.A N GLU 128.A O no hydrogen 3.156 N/A TYR 134.A N LEU 130.A O no hydrogen 2.841 N/A LYS 135.A N LEU 131.A O no hydrogen 2.858 N/A GLU 136.A N PRO 132.A O no hydrogen 2.783 N/A LYS 137.A N VAL 133.A O no hydrogen 2.629 N/A VAL 138.A N VAL 133.A O no hydrogen 3.027 N/A VAL 139.A N TYR 134.A O no hydrogen 2.826 N/A LEU 141.A N VAL 138.A O no hydrogen 2.999 N/A ALA 142.A N VAL 138.A O no hydrogen 3.130 N/A ALA 142.A N VAL 139.A O no hydrogen 2.989 N/A ASP 143.A N TYR 108.A O no hydrogen 2.836 N/A ILE 144.A N TYR 108.A O no hydrogen 3.183 N/A ILE 145.A N THR 180.A O no hydrogen 2.998 N/A THR 146.A N CYS 110.A O no hydrogen 3.291 N/A ASN 148.A N GLU 151.A OE1 no hydrogen 2.987 N/A GLN 149.A N SER 185.A O no hydrogen 2.917 N/A GLN 149.A NE2 GLU 153.A OE2 no hydrogen 3.166 N/A ALA 152.A N ASN 148.A O no hydrogen 3.007 N/A GLU 153.A N GLN 149.A O no hydrogen 2.905 N/A LEU 154.A N PHE 150.A O no hydrogen 2.824 N/A LEU 155.A N GLU 151.A O no hydrogen 2.833 N/A SER 156.A N ALA 152.A O no hydrogen 3.104 N/A SER 156.A OG ALA 152.A O no hydrogen 2.828 N/A SER 156.A OG GLU 153.A O no hydrogen 3.381 N/A GLY 157.A N GLU 153.A O no hydrogen 2.661 N/A ARG 158.A N SER 156.A OG no hydrogen 3.247 N/A ILE 160.A N GLU 153.A OE2 no hydrogen 2.668 N/A HIS 161.A N GLU 165.A OE1 no hydrogen 3.031 N/A HIS 161.A ND1 GLU 165.A OE1 no hydrogen 2.697 N/A SER 162.A OG GLU 164.A OE1 no hydrogen 3.369 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.592 N/A GLU 165.A N SER 162.A OG no hydrogen 3.222 N/A ALA 166.A N SER 162.A O no hydrogen 2.963 N/A LEU 167.A N GLN 163.A O no hydrogen 3.036 N/A ARG 168.A N GLU 164.A O no hydrogen 2.925 N/A VAL 169.A N GLU 165.A O no hydrogen 2.798 N/A MET 170.A N ALA 166.A O no hydrogen 2.698 N/A ASP 171.A N LEU 167.A O no hydrogen 3.172 N/A ASP 171.A N ARG 168.A O no hydrogen 3.085 N/A MET 172.A N ARG 168.A O no hydrogen 3.264 N/A LEU 173.A N VAL 169.A O no hydrogen 3.030 N/A HIS 174.A N MET 170.A O no hydrogen 2.923 N/A HIS 174.A ND1 PRO 178.A O no hydrogen 2.807 N/A HIS 174.A NE2 SER 202.A OG no hydrogen 2.700 N/A SER 175.A N ASP 171.A O no hydrogen 3.198 N/A SER 175.A OG MET 172.A O no hydrogen 2.660 N/A MET 176.A N MET 172.A O no hydrogen 3.146 N/A MET 176.A N LEU 173.A O no hydrogen 2.914 N/A GLY 177.A N HIS 174.A O no hydrogen 3.106 N/A THR 180.A N ASP 143.A O no hydrogen 3.219 N/A THR 180.A OG1 GLN 203.A OE1 no hydrogen 3.415 N/A VAL 181.A N SER 202.A O no hydrogen 2.796 N/A VAL 182.A N ILE 145.A O no hydrogen 3.091 N/A ILE 183.A N LEU 200.A O no hydrogen 2.768 N/A THR 184.A N PRO 147.A O no hydrogen 2.924 N/A SER 186.A OG ILE 198.A O no hydrogen 2.985 N/A ASP 187.A N GLN 149.A OE1 no hydrogen 3.077 N/A LEU 188.A N SER 186.A OG no hydrogen 3.425 N/A SER 190.A OG ASP 216.A OD1 no hydrogen 2.691 N/A GLN 192.A N SER 190.A OG no hydrogen 3.048 N/A GLY 193.A N SER 190.A O no hydrogen 3.273 N/A LEU 197.A N ILE 217.A O no hydrogen 2.678 N/A VAL 199.A N MET 215.A O no hydrogen 3.001 N/A LEU 200.A N ILE 183.A O no hydrogen 3.257 N/A GLY 201.A N ILE 213.A O no hydrogen 2.839 N/A SER 202.A N VAL 181.A O no hydrogen 2.731 N/A SER 202.A OG HIS 174.A NE2 no hydrogen 2.700 N/A GLN 203.A N GLU 211.A O no hydrogen 2.923 N/A ARG 204.A N ASP 179.A O no hydrogen 2.712 N/A ARG 204.A NE ASP 179.A OD2 no hydrogen 2.677 N/A ARG 204.A NH1 HIS 174.A O no hydrogen 3.100 N/A ARG 204.A NH2 HIS 174.A O no hydrogen 2.662 N/A ARG 204.A NH2 ASP 179.A OD2 no hydrogen 2.707 N/A ARG 205.A N VAL 209.A O no hydrogen 3.063 N/A ARG 205.A NH1 GLU 211.A OE1 no hydrogen 2.555 N/A ARG 205.A NH2 GLU 211.A OE1 no hydrogen 2.778 N/A GLU 211.A N GLN 203.A O no hydrogen 2.988 N/A ARG 212.A NH1 ASP 171.A OD1 no hydrogen 2.596 N/A ARG 212.A NH2 ASP 171.A OD1 no hydrogen 3.296 N/A ARG 212.A NH2 ASP 171.A OD2 no hydrogen 3.372 N/A ILE 213.A N GLY 201.A O no hydrogen 2.958 N/A ARG 214.A N THR 304.A O no hydrogen 2.642 N/A ARG 214.A NE GLN 163.A OE1 no hydrogen 2.815 N/A ARG 214.A NH1 ASP 216.A OD1 no hydrogen 3.033 N/A ARG 214.A NH2 GLN 163.A OE1 no hydrogen 2.804 N/A MET 215.A N VAL 199.A O no hydrogen 2.887 N/A ILE 217.A N LEU 197.A O no hydrogen 2.771 N/A LYS 219.A N ASN 195.A O no hydrogen 2.822 N/A LYS 219.A NZ SER 194.A O no hydrogen 2.617 N/A ALA 222.A N VAL 220.A O no hydrogen 2.946 N/A LEU 230.A N GLY 226.A O no hydrogen 2.990 N/A PHE 231.A N THR 227.A O no hydrogen 2.820 N/A ALA 232.A N GLY 228.A O no hydrogen 3.009 N/A ALA 233.A N ASP 229.A O no hydrogen 3.135 N/A MET 234.A N LEU 230.A O no hydrogen 2.788 N/A LEU 235.A N PHE 231.A O no hydrogen 2.874 N/A LEU 236.A N ALA 232.A O no hydrogen 2.967 N/A ALA 237.A N ALA 233.A O no hydrogen 2.989 N/A TRP 238.A N MET 234.A O no hydrogen 2.887 N/A THR 239.A N LEU 235.A O no hydrogen 2.827 N/A THR 239.A OG1 LEU 235.A O no hydrogen 2.805 N/A THR 239.A OG1 LEU 236.A O no hydrogen 2.915 N/A HIS 240.A N LEU 236.A O no hydrogen 3.039 N/A HIS 240.A ND1 TYR 77.A OH no hydrogen 2.486 N/A LYS 241.A N ALA 237.A O no hydrogen 3.141 N/A LYS 241.A NZ LEU 29.A O no hydrogen 3.344 N/A HIS 242.A N TRP 238.A O no hydrogen 2.866 N/A LEU 246.A N GLU 211.A OE1 no hydrogen 3.332 N/A LYS 247.A N GLU 211.A OE2 no hydrogen 3.276 N/A LYS 247.A NZ GLU 251.A OE1 no hydrogen 3.277 N/A LYS 247.A NZ GLU 251.A OE2 no hydrogen 2.986 N/A LYS 247.A NZ GLN 302.A OE1 no hydrogen 3.512 N/A VAL 248.A N ASN 245.A OD1 no hydrogen 3.259 N/A ALA 249.A N ASN 245.A O no hydrogen 3.115 N/A CYS 250.A N LEU 246.A O no hydrogen 2.971 N/A CYS 250.A N LYS 247.A O no hydrogen 3.250 N/A CYS 250.A SG LEU 246.A O no hydrogen 3.278 N/A GLU 251.A N LYS 247.A O no hydrogen 3.028 N/A LYS 252.A N VAL 248.A O no hydrogen 2.966 N/A LYS 252.A NZ HIS 242.A NE2 no hydrogen 2.759 N/A THR 253.A N ALA 249.A O no hydrogen 3.191 N/A THR 253.A OG1 ALA 249.A O no hydrogen 2.714 N/A VAL 254.A N CYS 250.A O no hydrogen 2.912 N/A SER 255.A N GLU 251.A O no hydrogen 2.884 N/A SER 255.A OG GLU 251.A O no hydrogen 2.839 N/A THR 256.A N LYS 252.A O no hydrogen 2.964 N/A THR 256.A OG1 LYS 252.A O no hydrogen 2.720 N/A LEU 257.A N THR 253.A O no hydrogen 3.187 N/A HIS 258.A N VAL 254.A O no hydrogen 2.993 N/A HIS 259.A N SER 255.A O no hydrogen 2.928 N/A HIS 259.A NE2 GLU 298.A O no hydrogen 2.786 N/A VAL 260.A N THR 256.A O no hydrogen 3.086 N/A LEU 261.A N LEU 257.A O no hydrogen 2.824 N/A GLN 262.A N HIS 258.A O no hydrogen 2.785 N/A ARG 263.A N HIS 259.A O no hydrogen 2.870 N/A ARG 263.A NH1 SER 290.A OG no hydrogen 3.045 N/A ARG 263.A NH1 ASP 293.A OD2 no hydrogen 2.688 N/A ARG 263.A NH2 ASP 293.A OD2 no hydrogen 3.066 N/A THR 264.A N VAL 260.A O no hydrogen 2.805 N/A THR 264.A OG1 VAL 260.A O no hydrogen 2.660 N/A ILE 265.A N LEU 261.A O no hydrogen 2.690 N/A GLN 266.A N GLN 262.A O no hydrogen 3.130 N/A ALA 268.A N THR 264.A O no hydrogen 2.999 N/A LYS 269.A N ILE 265.A O no hydrogen 3.320 N/A ALA 270.A N GLN 266.A O no hydrogen 3.013 N/A GLN 271.A N CYS 267.A O no hydrogen 2.973 N/A ALA 272.A N ALA 268.A O no hydrogen 2.981 N/A ALA 272.A N LYS 269.A O no hydrogen 2.904 N/A GLY 273.A N LYS 269.A O no hydrogen 2.691 N/A VAL 276.A N GLY 273.A O no hydrogen 3.097 N/A ARG 277.A NH2 ASP 221.A OD1 no hydrogen 2.821 N/A SER 279.A N GLN 282.A OE1 no hydrogen 3.111 N/A GLN 282.A N SER 279.A OG no hydrogen 3.365 N/A LEU 283.A N SER 279.A O no hydrogen 2.905 N/A GLU 284.A N MET 281.A O no hydrogen 3.334 N/A ARG 286.A N THR 264.A OG1 no hydrogen 2.877 N/A GLN 289.A N GLN 289.A OE1 no hydrogen 2.646 N/A SER 290.A N MET 287.A O no hydrogen 2.934 N/A SER 290.A OG ARG 286.A O no hydrogen 2.613 N/A LYS 291.A N VAL 288.A O no hydrogen 3.303 N/A ILE 294.A N SER 290.A O no hydrogen 2.983 N/A ILE 294.A N LYS 291.A O no hydrogen 3.175 N/A GLU 295.A N LYS 291.A O no hydrogen 3.090 N/A ASP 296.A N ARG 292.A O no hydrogen 3.225 N/A VAL 300.A N SER 255.A OG no hydrogen 3.045 N/A ALA 303.A N GLU 251.A OE2 no hydrogen 2.537 N/A THR 304.A N ARG 214.A O no hydrogen 2.782 N/A LEU 306.A N ARG 212.A O no hydrogen 2.781 N/A