Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lre_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N THR 262.A O no hydrogen 3.059 N/A LYS 2.A NZ HIS 58.A O no hydrogen 2.946 N/A VAL 3.A N ASP 43.A OD2 no hydrogen 3.019 N/A VAL 4.A N MET 264.A O no hydrogen 2.937 N/A VAL 5.A N ALA 44.A O no hydrogen 3.036 N/A ARG 6.A N ALA 266.A O no hydrogen 2.865 N/A ARG 6.A NE SER 50.A OG no hydrogen 3.172 N/A ARG 6.A NH1 GLN 52.A OE1 no hydrogen 2.867 N/A ARG 6.A NH1 THR 88.A OG1 no hydrogen 2.922 N/A ARG 6.A NH2 SER 50.A O no hydrogen 3.297 N/A ARG 6.A NH2 SER 50.A OG no hydrogen 3.260 N/A ARG 6.A NH2 GLN 52.A OE1 no hydrogen 3.275 N/A VAL 7.A N PHE 46.A O no hydrogen 3.054 N/A ARG 8.A N VAL 268.A O no hydrogen 3.265 N/A ARG 8.A NE GLY 82.A O no hydrogen 2.734 N/A ARG 8.A NH1 PRO 9.A O no hydrogen 3.131 N/A ARG 8.A NH1 GLU 14.A OE1 no hydrogen 3.072 N/A ARG 8.A NH2 GLU 14.A OE2 no hydrogen 2.969 N/A ASN 11.A N GLU 14.A OE1 no hydrogen 3.258 N/A GLU 14.A N ASN 11.A OD1 no hydrogen 3.033 N/A LYS 15.A N ASN 11.A O no hydrogen 3.180 N/A ALA 16.A N THR 12.A O no hydrogen 3.401 N/A ALA 17.A N LYS 13.A O no hydrogen 3.232 N/A LYS 21.A NZ GLU 10.A OE1 no hydrogen 2.902 N/A VAL 22.A N PRO 270.A O no hydrogen 2.684 N/A HIS 24.A N VAL 32.A O no hydrogen 2.961 N/A VAL 26.A N ILE 30.A O no hydrogen 3.139 N/A ASP 27.A N ILE 30.A O no hydrogen 3.333 N/A HIS 29.A N ASP 27.A OD1 no hydrogen 3.250 N/A ILE 30.A N ASP 27.A OD1 no hydrogen 3.098 N/A LEU 31.A N PHE 40.A O no hydrogen 3.028 N/A VAL 32.A N HIS 24.A O no hydrogen 2.748 N/A PHE 33.A N LEU 38.A O no hydrogen 2.731 N/A ASP 34.A N VAL 22.A O no hydrogen 2.669 N/A LYS 36.A N ASP 34.A OD2 no hydrogen 3.428 N/A LYS 36.A NZ TYR 279.A OH no hydrogen 2.905 N/A LEU 38.A N PHE 33.A O no hydrogen 2.996 N/A PHE 40.A N LEU 31.A O no hydrogen 2.900 N/A PHE 42.A N HIS 29.A O no hydrogen 2.817 N/A ASP 43.A N VAL 3.A O no hydrogen 3.134 N/A VAL 45.A N LYS 28.A O no hydrogen 2.779 N/A PHE 46.A N VAL 5.A O no hydrogen 2.957 N/A THR 49.A N ASP 47.A OD1 no hydrogen 2.628 N/A THR 49.A OG1 ASP 47.A OD1 no hydrogen 2.767 N/A SER 50.A N ASP 47.A O no hydrogen 2.993 N/A SER 50.A OG ASP 47.A O no hydrogen 2.903 N/A GLN 52.A NE2 HIS 87.A O no hydrogen 2.809 N/A GLN 52.A NE2 GLU 95.A O no hydrogen 3.172 N/A GLU 54.A N THR 51.A OG1 no hydrogen 3.037 N/A VAL 55.A N THR 51.A O no hydrogen 3.067 N/A PHE 56.A N GLN 52.A O no hydrogen 2.801 N/A GLU 57.A N SER 53.A O no hydrogen 2.821 N/A HIS 58.A N GLU 54.A O no hydrogen 3.257 N/A HIS 58.A N VAL 55.A O no hydrogen 3.144 N/A THR 59.A N PHE 56.A O no hydrogen 3.151 N/A THR 59.A OG1 VAL 55.A O no hydrogen 2.613 N/A THR 59.A OG1 PHE 56.A O no hydrogen 3.552 N/A THR 60.A OG1 THR 102.A OG1 no hydrogen 2.692 N/A LYS 61.A N PHE 56.A O no hydrogen 3.038 N/A LEU 64.A N THR 60.A O no hydrogen 2.914 N/A ARG 65.A N PRO 62.A O no hydrogen 3.096 N/A PHE 67.A N ILE 63.A O no hydrogen 3.027 N/A LEU 68.A N LEU 64.A O no hydrogen 2.942 N/A ASN 69.A N SER 66.A O no hydrogen 3.057 N/A GLY 70.A N PHE 67.A O no hydrogen 2.962 N/A TYR 71.A N SER 66.A O no hydrogen 3.113 N/A ASN 72.A ND2 ASP 254.A O no hydrogen 2.941 N/A CYS 73.A N LYS 214.A O no hydrogen 2.921 N/A CYS 73.A SG ILE 63.A O no hydrogen 3.577 N/A CYS 73.A SG TYR 71.A O no hydrogen 3.467 N/A THR 74.A N GLN 261.A O no hydrogen 2.980 N/A THR 74.A OG1 SER 255.A O no hydrogen 2.489 N/A VAL 75.A N SER 216.A O no hydrogen 2.704 N/A LEU 76.A N ILE 263.A O no hydrogen 2.915 N/A ALA 77.A N ILE 218.A O no hydrogen 2.826 N/A TYR 78.A N ILE 265.A O no hydrogen 3.076 N/A THR 81.A N GLU 224.A OE1 no hydrogen 2.926 N/A THR 81.A OG1 SER 187.A OG no hydrogen 2.245 N/A THR 81.A OG1 GLU 224.A OE1 no hydrogen 2.880 N/A THR 81.A OG1 GLU 224.A OE2 no hydrogen 2.501 N/A ALA 83.A N ALA 80.A O no hydrogen 3.099 N/A LYS 85.A NZ GLY 79.A O no hydrogen 2.756 N/A LYS 85.A NZ ALA 80.A O no hydrogen 2.932 N/A THR 86.A OG1 ASP 219.A OD2 no hydrogen 2.742 N/A THR 88.A N GLY 84.A O no hydrogen 2.896 N/A THR 88.A OG1 GLY 84.A O no hydrogen 2.881 N/A MET 89.A N LYS 85.A O no hydrogen 2.923 N/A LEU 90.A N THR 86.A O no hydrogen 2.778 N/A GLY 91.A N THR 86.A O no hydrogen 2.949 N/A SER 92.A N GLU 95.A O no hydrogen 3.024 N/A GLU 95.A N SER 92.A OG no hydrogen 3.404 N/A GLY 97.A N LEU 90.A O no hydrogen 3.083 N/A VAL 98.A N THR 88.A O no hydrogen 2.954 N/A MET 99.A N MET 89.A O no hydrogen 3.132 N/A TYR 100.A OH SER 166.A OG no hydrogen 2.477 N/A LEU 101.A N GLY 97.A O no hydrogen 3.103 N/A THR 102.A N VAL 98.A O no hydrogen 2.904 N/A THR 102.A OG1 THR 60.A OG1 no hydrogen 2.692 N/A THR 102.A OG1 VAL 98.A O no hydrogen 2.472 N/A MET 103.A N MET 99.A O no hydrogen 2.996 N/A LEU 104.A N TYR 100.A O no hydrogen 2.973 N/A HIS 105.A N LEU 101.A O no hydrogen 3.008 N/A LEU 106.A N THR 102.A O no hydrogen 2.838 N/A TYR 107.A N MET 103.A O no hydrogen 2.996 N/A TYR 107.A OH PRO 163.A O no hydrogen 2.643 N/A LYS 108.A N LEU 104.A O no hydrogen 2.980 N/A LYS 108.A NZ GLU 112.A OE2 no hydrogen 2.758 N/A CYS 109.A N HIS 105.A O no hydrogen 2.803 N/A CYS 109.A SG HIS 105.A O no hydrogen 3.272 N/A MET 110.A N LEU 106.A O no hydrogen 2.955 N/A ASP 111.A N TYR 107.A O no hydrogen 3.186 N/A GLU 112.A N LYS 108.A O no hydrogen 3.076 N/A ILE 113.A N CYS 109.A O no hydrogen 3.292 N/A ILE 113.A N MET 110.A O no hydrogen 3.379 N/A GLU 116.A N ILE 113.A O no hydrogen 2.890 N/A LYS 117.A N ILE 113.A O no hydrogen 2.994 N/A LYS 117.A NZ LEU 68.A O no hydrogen 2.598 N/A LYS 117.A NZ GLN 199.A OE1 no hydrogen 2.157 N/A ILE 118.A N GLN 200.A O no hydrogen 2.933 N/A SER 120.A N ARG 198.A O no hydrogen 2.966 N/A ALA 122.A N TYR 196.A O no hydrogen 3.090 N/A VAL 123.A N HIS 161.A O no hydrogen 2.835 N/A SER 124.A N GLN 194.A O no hydrogen 2.886 N/A SER 124.A OG TYR 196.A OH no hydrogen 2.588 N/A LEU 126.A N VAL 192.A O no hydrogen 3.002 N/A GLU 127.A N ARG 134.A O no hydrogen 2.704 N/A VAL 128.A N HIS 190.A O no hydrogen 2.919 N/A TYR 129.A N GLN 132.A O no hydrogen 3.007 N/A GLN 132.A N TYR 129.A O no hydrogen 3.129 N/A ARG 134.A N GLU 127.A O no hydrogen 2.768 N/A ARG 134.A NH1 GLN 132.A OE1 no hydrogen 2.960 N/A ARG 134.A NH2 GLN 132.A OE1 no hydrogen 3.182 N/A LEU 136.A N TYR 125.A O no hydrogen 2.913 N/A LEU 137.A N ASP 135.A OD1 no hydrogen 2.812 N/A LEU 143.A N ILE 133.A O no hydrogen 3.052 N/A ARG 146.A N VAL 154.A O no hydrogen 2.814 N/A ARG 146.A NH1 VAL 145.A O no hydrogen 3.144 N/A ASP 148.A N GLY 152.A O no hydrogen 2.785 N/A LYS 151.A N ASP 148.A O no hydrogen 3.324 N/A GLY 152.A N ASP 148.A OD1 no hydrogen 2.841 N/A VAL 153.A N ASP 254.A OD2 no hydrogen 3.055 N/A VAL 154.A N ARG 146.A O no hydrogen 2.869 N/A HIS 156.A N ALA 144.A O no hydrogen 3.144 N/A LEU 158.A N VAL 155.A O no hydrogen 3.151 N/A THR 159.A N ASP 135.A OD2 no hydrogen 2.900 N/A THR 159.A OG1 ASP 135.A OD1 no hydrogen 3.394 N/A THR 159.A OG1 ASP 135.A OD2 no hydrogen 2.417 N/A HIS 161.A N VAL 123.A O no hydrogen 2.824 N/A GLN 162.A NE2 THR 121.A O no hydrogen 2.873 N/A SER 165.A OG GLU 168.A OE2 no hydrogen 3.358 N/A SER 166.A OG TYR 100.A OH no hydrogen 2.477 N/A GLU 168.A N SER 165.A OG no hydrogen 3.277 N/A ILE 169.A N SER 165.A O no hydrogen 2.959 N/A LEU 170.A N SER 166.A O no hydrogen 3.015 N/A HIS 171.A N GLU 167.A O no hydrogen 2.778 N/A LEU 172.A N GLU 168.A O no hydrogen 2.881 N/A LEU 173.A N ILE 169.A O no hydrogen 3.123 N/A ASP 174.A N LEU 170.A O no hydrogen 3.064 N/A ASN 175.A N HIS 171.A O no hydrogen 2.975 N/A ASN 175.A ND2 HIS 171.A NE2 no hydrogen 3.171 N/A GLY 176.A N LEU 172.A O no hydrogen 2.977 N/A ASN 177.A N LEU 173.A O no hydrogen 2.925 N/A LYS 178.A N ASP 174.A O no hydrogen 2.954 N/A LYS 178.A NZ ASP 174.A OD1 no hydrogen 3.346 N/A LYS 178.A NZ ASP 174.A OD2 no hydrogen 3.233 N/A ASN 179.A N GLY 176.A O no hydrogen 3.238 N/A ASN 179.A ND2 LEU 136.A O no hydrogen 3.009 N/A ARG 180.A N ASN 177.A O no hydrogen 3.240 N/A ARG 180.A NE SER 189.A OG no hydrogen 3.047 N/A ARG 180.A NH1 ASP 219.A OD2 no hydrogen 2.726 N/A ARG 180.A NH2 SER 189.A O no hydrogen 2.717 N/A THR 181.A N GLU 127.A OE1 no hydrogen 2.901 N/A THR 181.A OG1 GLU 127.A OE1 no hydrogen 3.330 N/A THR 181.A OG1 GLU 127.A OE2 no hydrogen 2.935 N/A HIS 183.A N ALA 184.A O no hydrogen 3.011 N/A SER 186.A N THR 181.A O no hydrogen 2.781 N/A SER 187.A OG THR 81.A OG1 no hydrogen 2.245 N/A SER 187.A OG GLU 224.A OE2 no hydrogen 2.822 N/A ARG 188.A N SER 186.A OG no hydrogen 3.027 N/A SER 189.A N SER 186.A O no hydrogen 3.357 N/A SER 189.A OG GLU 127.A OE1 no hydrogen 2.587 N/A HIS 190.A N VAL 128.A O no hydrogen 3.078 N/A ALA 191.A N ASP 219.A O no hydrogen 2.818 N/A VAL 192.A N LEU 126.A O no hydrogen 2.744 N/A PHE 193.A N LEU 217.A O no hydrogen 3.000 N/A GLN 194.A N SER 124.A O no hydrogen 2.854 N/A GLN 194.A NE2 SER 216.A OG no hydrogen 2.868 N/A ILE 195.A N MET 215.A O no hydrogen 2.945 N/A TYR 196.A N ALA 122.A O no hydrogen 2.737 N/A TYR 196.A OH SER 124.A OG no hydrogen 2.588 N/A LEU 197.A N ALA 213.A O no hydrogen 2.852 N/A ARG 198.A N SER 120.A O no hydrogen 2.805 N/A ARG 198.A NH1 GLN 208.A O no hydrogen 3.364 N/A ARG 198.A NH2 GLN 200.A OE1 no hydrogen 3.227 N/A ARG 198.A NH2 GLN 208.A O no hydrogen 3.259 N/A GLN 200.A N ILE 118.A O no hydrogen 2.884 N/A GLN 200.A NE2 ASP 201.A O no hydrogen 3.296 N/A GLN 200.A NE2 ALA 204.A O no hydrogen 2.943 N/A GLN 200.A NE2 SER 205.A O no hydrogen 3.279 N/A LYS 202.A NZ LYS 114.A O no hydrogen 2.744 N/A ALA 204.A N ASP 201.A O no hydrogen 3.246 N/A SER 205.A OG ASN 207.A OD1 no hydrogen 3.257 N/A ASN 207.A N SER 205.A OG no hydrogen 3.428 N/A GLN 208.A N SER 205.A O no hydrogen 3.033 N/A ARG 211.A NH1 ASN 72.A OD1 no hydrogen 3.004 N/A ARG 211.A NH2 GLY 70.A O no hydrogen 2.669 N/A ARG 211.A NH2 ASN 72.A OD1 no hydrogen 2.892 N/A ALA 213.A N LEU 197.A O no hydrogen 3.016 N/A LYS 214.A N ASN 72.A OD1 no hydrogen 3.001 N/A LYS 214.A NZ ASP 254.A OD1 no hydrogen 2.718 N/A LYS 214.A NZ ASP 254.A OD2 no hydrogen 2.755 N/A MET 215.A N ILE 195.A O no hydrogen 2.995 N/A SER 216.A N CYS 73.A O no hydrogen 2.763 N/A LEU 217.A N PHE 193.A O no hydrogen 2.797 N/A ILE 218.A N VAL 75.A O no hydrogen 2.821 N/A ASP 219.A N ALA 191.A O no hydrogen 2.857 N/A LEU 220.A N ALA 77.A O no hydrogen 3.055 N/A ALA 221.A N HIS 190.A ND1 no hydrogen 3.023 N/A GLY 222.A N SER 187.A O no hydrogen 2.728 N/A SER 223.A N GLY 79.A O no hydrogen 3.326 N/A GLU 224.A N GLU 224.A OE1 no hydrogen 2.783 N/A SER 228.A OG GLU 131.A OE1 no hydrogen 3.420 N/A SER 228.A OG GLU 131.A OE2 no hydrogen 2.409 N/A ALA 231.A N ARG 227.A O no hydrogen 2.976 N/A LEU 232.A N SER 228.A O no hydrogen 2.919 N/A GLY 233.A N LEU 229.A O no hydrogen 3.265 N/A ASN 234.A N LEU 230.A O no hydrogen 2.919 N/A VAL 235.A N ALA 231.A O no hydrogen 2.882 N/A ILE 236.A N LEU 232.A O no hydrogen 2.938 N/A ASN 237.A N GLY 233.A O no hydrogen 2.956 N/A ASN 237.A ND2 GLY 233.A O no hydrogen 3.201 N/A ALA 238.A N ASN 234.A O no hydrogen 2.928 N/A LEU 239.A N VAL 235.A O no hydrogen 2.963 N/A TYR 243.A N ILE 241.A O no hydrogen 2.796 N/A ASN 245.A N PRO 242.A O no hydrogen 3.152 N/A SER 246.A OG THR 249.A OG1 no hydrogen 2.297 N/A LYS 247.A N GLU 131.A OE1 no hydrogen 2.841 N/A LYS 247.A NZ LEU 143.A O no hydrogen 3.524 N/A LEU 248.A N SER 228.A OG no hydrogen 3.315 N/A THR 249.A N SER 246.A OG no hydrogen 3.177 N/A THR 249.A OG1 TYR 243.A O no hydrogen 2.885 N/A THR 249.A OG1 SER 246.A O no hydrogen 3.393 N/A THR 249.A OG1 SER 246.A OG no hydrogen 2.297 N/A ARG 250.A N SER 246.A O no hydrogen 3.011 N/A LEU 251.A N LYS 247.A O no hydrogen 3.023 N/A LEU 252.A N LEU 248.A O no hydrogen 3.221 N/A LYS 253.A N ARG 250.A O no hydrogen 2.956 N/A LYS 253.A NZ GLU 147.A OE1 no hydrogen 3.033 N/A LYS 253.A NZ GLU 147.A OE2 no hydrogen 3.130 N/A SER 255.A N LEU 252.A O no hydrogen 2.891 N/A SER 255.A OG ASP 254.A OD1 no hydrogen 2.791 N/A CYS 260.A N GLY 257.A O no hydrogen 3.189 N/A CYS 260.A SG ASP 254.A O no hydrogen 3.436 N/A CYS 260.A SG GLY 257.A O no hydrogen 3.141 N/A GLN 261.A N ASN 72.A O no hydrogen 3.268 N/A ILE 263.A N THR 74.A O no hydrogen 2.959 N/A MET 264.A N LYS 2.A O no hydrogen 2.942 N/A ILE 265.A N LEU 76.A O no hydrogen 2.924 N/A ALA 266.A N VAL 4.A O no hydrogen 2.949 N/A ALA 267.A N TYR 78.A O no hydrogen 2.820 N/A VAL 268.A N ARG 6.A O no hydrogen 3.036 N/A SER 271.A OG GLU 10.A OE2 no hydrogen 3.562 N/A SER 271.A OG GLU 14.A OE1 no hydrogen 2.964 N/A SER 272.A N HIS 20.A O no hydrogen 3.276 N/A SER 272.A OG HIS 20.A O no hydrogen 3.238 N/A PHE 274.A N SER 271.A O no hydrogen 2.976 N/A TYR 275.A N SER 272.A O no hydrogen 3.257 N/A TYR 275.A OH ASP 34.A OD2 no hydrogen 2.510 N/A THR 278.A N PHE 274.A O no hydrogen 3.014 N/A THR 278.A OG1 SER 269.A O no hydrogen 2.776 N/A THR 278.A OG1 PHE 274.A O no hydrogen 3.268 N/A TYR 279.A N TYR 275.A O no hydrogen 2.962 N/A ASN 280.A N ASP 276.A O no hydrogen 3.004 N/A THR 281.A N ASP 277.A O no hydrogen 3.022 N/A THR 281.A OG1 ASP 277.A O no hydrogen 3.126 N/A LEU 282.A N THR 278.A O no hydrogen 2.866 N/A LYS 283.A N TYR 279.A O no hydrogen 3.043 N/A TYR 284.A N ASN 280.A O no hydrogen 2.890 N/A ALA 285.A N THR 281.A O no hydrogen 2.927 N/A ASN 286.A N LEU 282.A O no hydrogen 3.064 N/A ARG 287.A N LYS 283.A O no hydrogen 2.936 N/A ALA 288.A N TYR 284.A O no hydrogen 3.117 N/A ALA 288.A N ALA 285.A O no hydrogen 3.258 N/A LYS 289.A NZ VAL 41.A O no hydrogen 2.885 N/A