Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3alp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N ASN 104.A O no hydrogen 2.699 N/A GLY 6.A N THR 106.A O no hydrogen 3.170 N/A ILE 8.A N MET 108.A O no hydrogen 2.925 N/A GLY 9.A N LEU 79.A O no hydrogen 2.862 N/A THR 10.A N PHE 7.A O no hydrogen 3.060 N/A THR 10.A OG1 PHE 7.A O no hydrogen 2.783 N/A VAL 12.A N LEU 76.A O no hydrogen 2.976 N/A LEU 14.A N ILE 74.A O no hydrogen 2.910 N/A CYS 16.A N THR 73.A OG1 no hydrogen 3.388 N/A CYS 16.A SG SER 101.A OG no hydrogen 3.739 N/A PHE 18.A N THR 70.A O no hydrogen 2.785 N/A VAL 25.A N LEU 22.A O no hydrogen 3.039 N/A LYS 26.A N PHE 94.A O no hydrogen 2.836 N/A THR 28.A N ALA 92.A O no hydrogen 2.697 N/A GLN 29.A N ALA 92.A O no hydrogen 3.370 N/A VAL 30.A N TYR 46.A O no hydrogen 2.886 N/A THR 31.A N GLU 90.A O no hydrogen 2.932 N/A TRP 32.A N ALA 44.A O no hydrogen 2.823 N/A TRP 32.A NE1 GLY 72.A O no hydrogen 2.824 N/A GLN 33.A N ILE 88.A O no hydrogen 2.842 N/A GLN 33.A NE2 ASN 42.A OD1 no hydrogen 3.494 N/A LYS 34.A N GLN 41.A O no hydrogen 2.891 N/A LYS 34.A NZ GLU 82.A O no hydrogen 2.717 N/A SER 35.A N VAL 86.A O no hydrogen 2.734 N/A SER 35.A OG SER 39.A O no hydrogen 3.481 N/A SER 39.A N THR 36.A O no hydrogen 3.235 N/A SER 39.A OG THR 36.A O no hydrogen 2.572 N/A LYS 40.A NZ GLN 33.A OE1 no hydrogen 3.271 N/A GLN 41.A N LYS 34.A O no hydrogen 2.932 N/A VAL 43.A N TRP 32.A O no hydrogen 2.851 N/A ALA 44.A N TRP 32.A O no hydrogen 3.436 N/A ILE 45.A N SER 53.A O no hydrogen 2.796 N/A TYR 46.A N VAL 30.A O no hydrogen 2.775 N/A ASN 47.A N GLY 51.A O no hydrogen 2.676 N/A ASN 47.A ND2 GLN 29.A OE1 no hydrogen 3.139 N/A SER 49.A N ASN 47.A OD1 no hydrogen 3.111 N/A MET 50.A N ASN 47.A O no hydrogen 2.843 N/A GLY 51.A N ASN 47.A O no hydrogen 2.575 N/A SER 53.A N ILE 45.A O no hydrogen 2.829 N/A LEU 55.A N VAL 43.A O no hydrogen 3.072 N/A TYR 58.A N LEU 55.A O no hydrogen 2.865 N/A ARG 61.A N TYR 58.A O no hydrogen 2.874 N/A ARG 61.A NE SER 77.A O no hydrogen 3.189 N/A ARG 61.A NH1 ASP 83.A OD1 no hydrogen 3.292 N/A ARG 61.A NH2 SER 77.A O no hydrogen 3.280 N/A ARG 61.A NH2 ASP 83.A OD1 no hydrogen 3.419 N/A ARG 61.A NH2 ASP 83.A OD2 no hydrogen 2.472 N/A VAL 62.A N TYR 58.A O no hydrogen 3.147 N/A GLU 63.A N ARG 75.A O no hydrogen 3.400 N/A LEU 65.A N THR 73.A O no hydrogen 3.027 N/A ARG 66.A NH1 ASP 71.A OD2 no hydrogen 3.363 N/A SER 68.A OG THR 70.A OG1 no hydrogen 3.359 N/A THR 70.A N SER 68.A OG no hydrogen 2.941 N/A THR 70.A OG1 SER 68.A OG no hydrogen 3.359 N/A GLY 72.A N CYS 16.A O no hydrogen 3.001 N/A THR 73.A N ASP 71.A OD1 no hydrogen 2.866 N/A THR 73.A OG1 CYS 16.A O no hydrogen 3.545 N/A THR 73.A OG1 ASP 71.A OD1 no hydrogen 3.002 N/A ILE 74.A N LEU 14.A O no hydrogen 3.082 N/A ARG 75.A N GLU 63.A O no hydrogen 3.074 N/A ARG 75.A NH1 GLU 63.A OE2 no hydrogen 3.473 N/A LEU 76.A N VAL 12.A O no hydrogen 2.916 N/A SER 77.A N ARG 61.A O no hydrogen 2.781 N/A SER 77.A OG ARG 61.A O no hydrogen 3.512 N/A ARG 78.A N ASP 11.A OD1 no hydrogen 2.987 N/A LEU 79.A N THR 10.A O no hydrogen 2.975 N/A GLU 80.A N ASP 83.A OD2 no hydrogen 3.029 N/A ASP 83.A N GLU 80.A O no hydrogen 2.800 N/A GLU 84.A N LEU 81.A O no hydrogen 3.177 N/A GLY 85.A N LEU 105.A O no hydrogen 3.210 N/A VAL 86.A N SER 35.A O no hydrogen 3.265 N/A TYR 87.A N LEU 103.A O no hydrogen 2.806 N/A TYR 87.A OH ASP 83.A O no hydrogen 2.589 N/A ILE 88.A N GLN 33.A O no hydrogen 2.805 N/A CYS 89.A N SER 101.A O no hydrogen 2.905 N/A GLU 90.A N THR 31.A O no hydrogen 2.827 N/A PHE 91.A N ARG 99.A O no hydrogen 2.794 N/A ALA 92.A N GLN 29.A O no hydrogen 2.891 N/A THR 93.A N GLY 97.A O no hydrogen 3.240 N/A THR 93.A OG1 THR 96.A OG1 no hydrogen 2.526 N/A THR 93.A OG1 GLY 97.A O no hydrogen 2.661 N/A PHE 94.A N LYS 26.A O no hydrogen 2.896 N/A THR 96.A OG1 THR 93.A OG1 no hydrogen 2.526 N/A GLY 97.A N THR 93.A O no hydrogen 3.021 N/A ARG 99.A N PHE 91.A O no hydrogen 2.978 N/A SER 101.A N CYS 89.A O no hydrogen 2.980 N/A LEU 103.A N TYR 87.A O no hydrogen 3.001 N/A ASN 104.A N ASP 2.A O no hydrogen 2.960 N/A LEU 105.A N GLY 85.A O no hydrogen 2.836 N/A THR 106.A N MET 4.A O no hydrogen 2.854 N/A VAL 107.A N GLU 84.A OE2 no hydrogen 3.106 N/A MET 108.A N GLY 6.A O no hydrogen 2.886 N/A ALA 109.A N LYS 143.A O no hydrogen 2.784 N/A THR 112.A N ALA 140.A O no hydrogen 2.922 N/A TRP 114.A N THR 138.A O no hydrogen 2.901 N/A TRP 114.A NE1 GLU 116.A OE2 no hydrogen 3.306 N/A GLU 116.A N THR 136.A O no hydrogen 2.944 N/A THR 118.A OG1 LEU 133.A O no hydrogen 3.447 N/A ALA 124.A N GLN 209.A O no hydrogen 2.939 N/A GLN 128.A N LYS 125.A O no hydrogen 3.178 N/A GLN 128.A NE2 ARG 123.A O no hydrogen 3.503 N/A LYS 131.A NZ GLU 157.A OE2 no hydrogen 2.928 N/A VAL 132.A N LEU 178.A O no hydrogen 2.733 N/A VAL 134.A N TYR 176.A O no hydrogen 2.925 N/A THR 136.A N GLU 116.A O no hydrogen 2.861 N/A CYS 137.A N SER 174.A O no hydrogen 2.770 N/A THR 138.A N TRP 114.A O no hydrogen 2.798 N/A SER 139.A N VAL 172.A O no hydrogen 2.812 N/A SER 139.A OG ASN 113.A OD1 no hydrogen 2.776 N/A SER 139.A OG SER 146.A OG no hydrogen 2.631 N/A ALA 140.A N THR 112.A O no hydrogen 2.733 N/A ASN 141.A N THR 171.A OG1 no hydrogen 3.107 N/A GLY 142.A N VAL 170.A O no hydrogen 3.111 N/A LYS 143.A N ALA 109.A O no hydrogen 2.834 N/A LYS 143.A NZ GLU 84.A OE2 no hydrogen 2.316 N/A LYS 143.A NZ VAL 107.A O no hydrogen 3.228 N/A SER 146.A OG SER 139.A OG no hydrogen 2.631 N/A VAL 147.A N ASN 194.A O no hydrogen 3.073 N/A SER 149.A N ILE 192.A O no hydrogen 2.874 N/A TRP 150.A NE1 SER 174.A OG no hydrogen 2.756 N/A GLU 151.A N ALA 190.A O no hydrogen 2.819 N/A THR 152.A OG1 SER 188.A O no hydrogen 2.858 N/A LEU 154.A N THR 152.A OG1 no hydrogen 3.007 N/A GLY 156.A N TYR 176.A OH no hydrogen 2.968 N/A GLU 157.A N ARG 177.A O no hydrogen 2.937 N/A GLU 159.A N ARG 175.A O no hydrogen 2.930 N/A GLN 161.A N ILE 173.A O no hydrogen 2.666 N/A ILE 163.A N THR 171.A O no hydrogen 2.792 N/A ASN 165.A N THR 169.A O no hydrogen 3.026 N/A ASN 165.A ND2 THR 169.A OG1 no hydrogen 3.079 N/A ASN 165.A ND2 THR 171.A OG1 no hydrogen 3.408 N/A GLY 168.A N ASN 165.A O no hydrogen 2.933 N/A THR 169.A N ASN 167.A OD1 no hydrogen 2.878 N/A THR 169.A OG1 ASN 167.A OD1 no hydrogen 2.588 N/A VAL 170.A N GLY 142.A O no hydrogen 2.812 N/A THR 171.A N ILE 163.A O no hydrogen 2.944 N/A VAL 172.A N SER 139.A O no hydrogen 2.839 N/A ILE 173.A N GLN 161.A O no hydrogen 2.753 N/A SER 174.A N CYS 137.A O no hydrogen 2.767 N/A SER 174.A OG GLU 159.A O no hydrogen 3.080 N/A ARG 175.A N GLU 159.A O no hydrogen 2.890 N/A TYR 176.A N ALA 135.A O no hydrogen 2.852 N/A ARG 177.A N GLU 157.A O no hydrogen 2.981 N/A ARG 177.A NH1 GLU 159.A OE2 no hydrogen 2.916 N/A LEU 178.A N VAL 132.A O no hydrogen 2.862 N/A GLU 183.A N GLU 183.A OE2 no hydrogen 2.668 N/A ALA 184.A N SER 181.A O no hydrogen 3.027 N/A HIS 185.A N ARG 182.A O no hydrogen 3.025 N/A GLN 186.A N LEU 206.A O no hydrogen 3.052 N/A GLN 187.A N ALA 184.A O no hydrogen 3.291 N/A LEU 189.A N LEU 204.A O no hydrogen 2.861 N/A ALA 190.A N GLU 151.A O no hydrogen 3.207 N/A CYS 191.A N GLU 202.A O no hydrogen 2.991 N/A ILE 192.A N SER 149.A O no hydrogen 2.708 N/A VAL 193.A N PHE 200.A O no hydrogen 2.984 N/A ASN 194.A N VAL 147.A O no hydrogen 2.938 N/A ASN 194.A ND2 ASP 198.A O no hydrogen 3.495 N/A TYR 195.A N ASP 198.A O no hydrogen 2.992 N/A TYR 195.A OH LYS 143.A O no hydrogen 2.856 N/A ASP 198.A N TYR 195.A O no hydrogen 2.914 N/A PHE 200.A N VAL 193.A O no hydrogen 2.928 N/A LYS 201.A NZ GLU 151.A OE1 no hydrogen 3.027 N/A GLU 202.A N CYS 191.A O no hydrogen 3.136 N/A LEU 204.A N LEU 189.A O no hydrogen 2.771 N/A LEU 206.A N GLN 187.A O no hydrogen 3.063 N/A GLN 209.A N LEU 122.A O no hydrogen 2.952 N/A TYR 210.A N ASN 239.A O no hydrogen 2.678 N/A TYR 210.A OH ASP 237.A OD2 no hydrogen 2.806 N/A GLU 213.A N ASP 237.A O no hydrogen 2.842 N/A THR 215.A N LYS 235.A O no hydrogen 3.179 N/A GLU 217.A N THR 233.A O no hydrogen 2.962 N/A LEU 225.A N THR 299.A O no hydrogen 3.013 N/A GLN 226.A N ILE 271.A O no hydrogen 2.920 N/A ASP 229.A N GLY 269.A O no hydrogen 3.297 N/A VAL 230.A N PHE 267.A O no hydrogen 2.937 N/A LEU 232.A N LEU 265.A O no hydrogen 3.061 N/A THR 233.A OG1 ARG 263.A O no hydrogen 3.569 N/A CYS 234.A N ARG 263.A O no hydrogen 3.339 N/A ASP 237.A N GLU 213.A O no hydrogen 3.171 N/A ASN 239.A N TYR 210.A O no hydrogen 3.507 N/A ASN 239.A ND2 HIS 185.A NE2 no hydrogen 2.623 N/A ASN 239.A ND2 ASN 207.A OD1 no hydrogen 2.999 N/A THR 243.A N THR 284.A O no hydrogen 3.000 N/A HIS 246.A N GLU 282.A O no hydrogen 3.158 N/A THR 248.A N ILE 280.A O no hydrogen 3.089 N/A THR 248.A OG1 TRP 247.A O no hydrogen 2.497 N/A THR 249.A OG1 THR 278.A O no hydrogen 2.716 N/A LEU 250.A N THR 278.A O no hydrogen 3.230 N/A GLY 252.A N THR 249.A O no hydrogen 3.190 N/A GLU 259.A N PHE 266.A O no hydrogen 2.894 N/A GLN 261.A N THR 264.A O no hydrogen 2.911 N/A ARG 263.A NH1 ARG 263.A O no hydrogen 3.334 N/A THR 264.A N GLN 261.A O no hydrogen 2.770 N/A THR 264.A OG1 GLN 261.A O no hydrogen 2.265 N/A THR 264.A OG1 ASN 262.A O no hydrogen 3.559 N/A LEU 265.A N LEU 232.A O no hydrogen 2.849 N/A PHE 266.A N GLU 259.A O no hydrogen 2.863 N/A PHE 267.A N VAL 230.A O no hydrogen 2.995 N/A ASN 272.A ND2 SER 274.A O no hydrogen 2.732 N/A TYR 279.A N VAL 294.A O no hydrogen 2.977 N/A ILE 280.A N THR 248.A O no hydrogen 2.962 N/A GLU 282.A N HIS 246.A O no hydrogen 2.784 N/A ALA 283.A N ARG 290.A O no hydrogen 2.988 N/A THR 284.A N GLU 244.A O no hydrogen 3.067 N/A THR 284.A OG1 GLY 288.A O no hydrogen 3.430 N/A THR 284.A OG1 THR 289.A OG1 no hydrogen 2.299 N/A ASN 285.A N GLY 288.A O no hydrogen 3.386 N/A ASN 285.A ND2 TYR 210.A O no hydrogen 3.261 N/A ILE 287.A N ASN 285.A OD1 no hydrogen 2.362 N/A GLY 288.A N ASN 285.A O no hydrogen 2.297 N/A THR 289.A OG1 THR 284.A OG1 no hydrogen 2.299 N/A THR 289.A OG1 GLY 288.A O no hydrogen 2.625 N/A ARG 290.A N ALA 283.A O no hydrogen 3.131 N/A GLY 292.A N CYS 281.A O no hydrogen 3.190 N/A VAL 294.A N TYR 279.A O no hydrogen 2.974 N/A VAL 296.A N GLY 277.A O no hydrogen 3.400 N/A THR 299.A N TRP 223.A O no hydrogen 2.959 N/A