Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4aln_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N GLU 3.A OE1 no hydrogen 2.613 N/A LEU 2.A N LEU 29.A O no hydrogen 3.363 N/A LYS 5.A N LEU 2.A O no hydrogen 3.042 N/A THR 6.A N ASP 86.A OD2 no hydrogen 2.599 N/A TYR 7.A N LYS 32.A O no hydrogen 2.919 N/A TYR 7.A OH LEU 208.A O no hydrogen 2.980 N/A VAL 8.A N GLY 87.A O no hydrogen 2.985 N/A ILE 9.A N VAL 34.A O no hydrogen 2.695 N/A MET 10.A N TYR 89.A O no hydrogen 2.981 N/A GLY 11.A N THR 36.A O no hydrogen 3.387 N/A ALA 13.A N SER 17.A OG no hydrogen 2.868 N/A SER 17.A N ASN 14.A O no hydrogen 3.014 N/A PHE 20.A N SER 17.A O no hydrogen 2.777 N/A GLY 21.A N SER 17.A O no hydrogen 3.155 N/A VAL 22.A N ILE 18.A O no hydrogen 3.024 N/A ALA 23.A N ALA 19.A O no hydrogen 2.922 N/A LYS 24.A N PHE 20.A O no hydrogen 2.943 N/A VAL 25.A N GLY 21.A O no hydrogen 3.235 N/A LEU 26.A N VAL 22.A O no hydrogen 3.230 N/A ASP 27.A N ALA 23.A O no hydrogen 2.883 N/A GLN 28.A N LYS 24.A O no hydrogen 2.975 N/A LEU 29.A N VAL 25.A O no hydrogen 3.155 N/A LEU 29.A N LEU 26.A O no hydrogen 3.084 N/A GLY 30.A N LEU 26.A O no hydrogen 3.111 N/A GLY 30.A N ASP 27.A O no hydrogen 2.684 N/A ALA 31.A N LEU 26.A O no hydrogen 3.184 N/A LYS 32.A N LYS 5.A O no hydrogen 2.715 N/A LEU 33.A N GLN 55.A OE1 no hydrogen 3.089 N/A VAL 34.A N TYR 7.A O no hydrogen 2.941 N/A PHE 35.A N HIS 59.A O no hydrogen 3.059 N/A THR 36.A N ILE 9.A O no hydrogen 3.173 N/A TYR 37.A N TYR 61.A O no hydrogen 3.121 N/A TYR 37.A OH GLU 40.A OE2 no hydrogen 3.262 N/A SER 42.A N LYS 39.A O no hydrogen 2.881 N/A SER 42.A OG LYS 39.A O no hydrogen 2.843 N/A ARG 43.A N GLU 40.A O no hydrogen 2.786 N/A ARG 43.A NE GLU 47.A OE2 no hydrogen 3.337 N/A ARG 43.A NH1 TYR 37.A OH no hydrogen 3.328 N/A LEU 46.A N SER 42.A O no hydrogen 3.132 N/A GLU 47.A N ARG 43.A O no hydrogen 3.100 N/A LYS 48.A N LYS 44.A O no hydrogen 3.051 N/A LEU 49.A N GLU 45.A O no hydrogen 3.137 N/A LEU 50.A N LEU 46.A O no hydrogen 2.847 N/A GLU 51.A N LYS 48.A O no hydrogen 3.153 N/A LEU 53.A N LEU 50.A O no hydrogen 3.276 N/A ASN 54.A N ASP 27.A OD1 no hydrogen 3.244 N/A GLN 55.A NE2 ASP 27.A OD1 no hydrogen 2.873 N/A GLN 55.A NE2 ALA 31.A O no hydrogen 3.534 N/A TYR 61.A N PHE 35.A O no hydrogen 2.934 N/A TYR 61.A OH ASP 81.A OD2 no hydrogen 2.986 N/A GLN 62.A NE2 ARG 38.A O no hydrogen 3.503 N/A ILE 63.A N TYR 37.A O no hydrogen 2.822 N/A ASP 64.A N GLU 70.A OE1 no hydrogen 3.167 N/A GLN 66.A N ASP 64.A OD1 no hydrogen 3.266 N/A SER 67.A N ASP 64.A O no hydrogen 2.808 N/A GLU 70.A N SER 67.A OG no hydrogen 3.337 N/A VAL 71.A N SER 67.A O no hydrogen 3.307 N/A ILE 72.A N ASP 68.A O no hydrogen 2.924 N/A ASN 73.A N GLU 69.A O no hydrogen 2.821 N/A GLY 74.A N GLU 70.A O no hydrogen 2.775 N/A PHE 75.A N VAL 71.A O no hydrogen 3.132 N/A GLU 76.A N ILE 72.A O no hydrogen 3.203 N/A GLN 77.A N ASN 73.A O no hydrogen 2.870 N/A GLN 77.A NE2 ASP 81.A OD2 no hydrogen 3.501 N/A ILE 78.A N GLY 74.A O no hydrogen 3.001 N/A GLY 79.A N PHE 75.A O no hydrogen 2.806 N/A LYS 80.A N GLU 76.A O no hydrogen 2.585 N/A ASP 81.A N GLN 77.A O no hydrogen 2.478 N/A VAL 82.A N ILE 78.A O no hydrogen 2.566 N/A GLY 83.A N GLY 79.A O no hydrogen 2.638 N/A ILE 85.A N LEU 125.A O no hydrogen 3.005 N/A ASP 86.A N THR 6.A O no hydrogen 2.740 N/A VAL 88.A N SER 131.A O no hydrogen 3.003 N/A TYR 89.A N VAL 8.A O no hydrogen 2.756 N/A TYR 89.A OH THR 135.A OG1 no hydrogen 2.737 N/A HIS 90.A N VAL 133.A O no hydrogen 2.677 N/A SER 91.A N MET 10.A O no hydrogen 3.114 N/A SER 97.A OG SER 97.A O no hydrogen 2.436 N/A GLU 102.A N GLU 102.A OE1 no hydrogen 2.976 N/A GLY 103.A N SER 100.A OG no hydrogen 2.789 N/A PHE 104.A N SER 100.A O no hydrogen 3.134 N/A LEU 105.A N ARG 101.A O no hydrogen 3.002 N/A LEU 106.A N GLU 102.A O no hydrogen 2.770 N/A ALA 107.A N GLY 103.A O no hydrogen 2.892 N/A GLN 108.A N PHE 104.A O no hydrogen 2.955 N/A ASP 109.A N LEU 105.A O no hydrogen 2.689 N/A ILE 110.A N LEU 106.A O no hydrogen 2.804 N/A SER 111.A N ALA 107.A O no hydrogen 2.706 N/A SER 111.A OG ALA 107.A O no hydrogen 2.793 N/A SER 112.A N GLN 108.A O no hydrogen 2.848 N/A SER 112.A OG SER 150.A OG no hydrogen 2.874 N/A TYR 113.A N GLN 108.A O no hydrogen 2.951 N/A SER 114.A N ASP 109.A O no hydrogen 3.038 N/A SER 114.A OG ILE 110.A O no hydrogen 2.552 N/A LEU 115.A N SER 112.A O no hydrogen 3.105 N/A ILE 117.A N TYR 113.A O no hydrogen 3.008 N/A VAL 118.A N SER 114.A O no hydrogen 2.978 N/A ALA 119.A N LEU 115.A O no hydrogen 2.792 N/A HIS 120.A N THR 116.A O no hydrogen 3.005 N/A GLU 121.A N ILE 117.A O no hydrogen 2.912 N/A GLU 121.A N VAL 118.A O no hydrogen 3.040 N/A ALA 122.A N VAL 118.A O no hydrogen 2.600 N/A LYS 123.A N ALA 119.A O no hydrogen 2.865 N/A LYS 123.A NZ ASP 165.A OD2 no hydrogen 2.879 N/A LYS 124.A N GLU 121.A O no hydrogen 3.121 N/A LYS 124.A NZ GLU 121.A OE1 no hydrogen 3.540 N/A LYS 124.A NZ GLU 121.A OE2 no hydrogen 3.418 N/A LEU 125.A N ALA 122.A O no hydrogen 2.676 N/A MET 126.A N LYS 123.A O no hydrogen 3.052 N/A GLY 129.A N MET 126.A O no hydrogen 3.246 N/A GLY 130.A N ASN 166.A O no hydrogen 2.965 N/A SER 131.A N ASP 86.A O no hydrogen 3.160 N/A SER 131.A OG LEU 207.A O no hydrogen 2.968 N/A ILE 132.A N ARG 168.A O no hydrogen 2.635 N/A VAL 133.A N VAL 88.A O no hydrogen 2.888 N/A ALA 134.A N ASN 170.A O no hydrogen 3.024 N/A THR 135.A N HIS 90.A O no hydrogen 3.129 N/A THR 135.A OG1 TYR 89.A OH no hydrogen 2.737 N/A THR 136.A N ILE 172.A O no hydrogen 2.789 N/A VAL 146.A N ASN 142.A O no hydrogen 3.499 N/A ALA 147.A N VAL 143.A O no hydrogen 2.873 N/A LYS 148.A N MET 144.A O no hydrogen 2.854 N/A ALA 149.A N GLY 145.A O no hydrogen 2.953 N/A SER 150.A N VAL 146.A O no hydrogen 3.114 N/A SER 150.A OG GLN 108.A OE1 no hydrogen 2.923 N/A SER 150.A OG SER 112.A OG no hydrogen 2.874 N/A LEU 151.A N ALA 147.A O no hydrogen 2.829 N/A GLU 152.A N LYS 148.A O no hydrogen 2.854 N/A ALA 153.A N ALA 149.A O no hydrogen 3.104 N/A ASN 154.A N SER 150.A O no hydrogen 2.796 N/A ASN 154.A ND2 SER 112.A O no hydrogen 2.715 N/A ASN 154.A ND2 SER 112.A OG no hydrogen 3.339 N/A ASN 154.A ND2 THR 116.A OG1 no hydrogen 2.767 N/A VAL 155.A N LEU 151.A O no hydrogen 2.714 N/A LYS 156.A N GLU 152.A O no hydrogen 2.990 N/A TYR 157.A N ALA 153.A O no hydrogen 2.974 N/A LEU 158.A N ASN 154.A O no hydrogen 2.733 N/A ALA 159.A N VAL 155.A O no hydrogen 2.749 N/A LEU 160.A N LYS 156.A O no hydrogen 2.778 N/A ASP 161.A N TYR 157.A O no hydrogen 2.770 N/A LEU 162.A N LEU 158.A O no hydrogen 2.737 N/A GLY 163.A N LEU 160.A O no hydrogen 3.322 N/A ASP 165.A N LEU 162.A O no hydrogen 2.593 N/A ASN 166.A N GLY 163.A O no hydrogen 2.753 N/A ASN 166.A ND2 GLU 128.A O no hydrogen 3.103 N/A ILE 167.A N LEU 162.A O no hydrogen 3.129 N/A ARG 168.A N GLY 130.A O no hydrogen 2.876 N/A ARG 168.A NH1 LEU 207.A O no hydrogen 3.149 N/A ARG 168.A NH1 SER 212.A OG no hydrogen 3.113 N/A ARG 168.A NH1 VAL 215.A O no hydrogen 3.357 N/A ARG 168.A NH2 LEU 207.A O no hydrogen 3.035 N/A VAL 169.A N THR 216.A OG1 no hydrogen 3.036 N/A ASN 170.A N ILE 132.A O no hydrogen 3.008 N/A ASN 170.A ND2 VAL 215.A O no hydrogen 3.171 N/A ALA 171.A N GLU 218.A O no hydrogen 2.808 N/A ILE 172.A N ALA 134.A O no hydrogen 2.795 N/A SER 173.A N ILE 220.A O no hydrogen 2.892 N/A ALA 174.A N THR 136.A O no hydrogen 2.929 N/A GLY 175.A N VAL 222.A O no hydrogen 3.334 N/A LYS 183.A N ASN 179.A O no hydrogen 3.065 N/A GLU 184.A N THR 180.A O no hydrogen 3.191 N/A ILE 185.A N ILE 181.A O no hydrogen 2.958 N/A GLU 186.A N LEU 182.A O no hydrogen 3.275 N/A GLU 187.A N LYS 183.A O no hydrogen 2.888 N/A ARG 188.A N GLU 184.A O no hydrogen 2.908 N/A ALA 189.A N ILE 185.A O no hydrogen 2.595 N/A LEU 191.A N SER 224.A O no hydrogen 3.341 N/A LYS 192.A N ALA 189.A O no hydrogen 2.591 N/A LYS 192.A NZ GLU 186.A O no hydrogen 3.155 N/A LYS 192.A NZ GLU 187.A O no hydrogen 2.362 N/A GLN 197.A N GLN 197.A OE1 no hydrogen 2.515 N/A GLN 197.A NE2 ARG 16.A O no hydrogen 2.928 N/A VAL 200.A N ASP 196.A O no hydrogen 3.260 N/A GLY 201.A N GLN 197.A O no hydrogen 2.785 N/A LYS 202.A N VAL 198.A O no hydrogen 2.683 N/A THR 203.A N GLU 199.A O no hydrogen 3.154 N/A ALA 204.A N VAL 200.A O no hydrogen 2.669 N/A ALA 205.A N GLY 201.A O no hydrogen 2.591 N/A TYR 206.A N LYS 202.A O no hydrogen 2.864 N/A LEU 207.A N THR 203.A O no hydrogen 2.763 N/A LEU 208.A N ALA 204.A O no hydrogen 2.881 N/A SER 209.A N ALA 205.A O no hydrogen 2.857 N/A SER 209.A OG ALA 205.A O no hydrogen 2.760 N/A SER 209.A OG TYR 206.A O no hydrogen 2.509 N/A SER 212.A N SER 209.A O no hydrogen 3.451 N/A SER 212.A OG TYR 206.A O no hydrogen 2.532 N/A SER 212.A OG LEU 207.A O no hydrogen 2.600 N/A SER 212.A OG SER 209.A O no hydrogen 3.043 N/A VAL 215.A N SER 212.A O no hydrogen 2.945 N/A THR 216.A OG1 VAL 169.A O no hydrogen 3.563 N/A GLY 217.A N VAL 169.A O no hydrogen 2.656 N/A GLU 218.A N ASN 170.A OD1 no hydrogen 3.014 N/A ILE 220.A N ALA 171.A O no hydrogen 2.846 N/A VAL 222.A N SER 173.A O no hydrogen 3.102 N/A SER 224.A OG ARG 193.A O no hydrogen 2.718 N/A PHE 226.A N ASP 223.A O no hydrogen 3.177 N/A HIS 227.A N ASP 223.A OD2 no hydrogen 2.890 N/A HIS 227.A ND1 ASP 223.A OD1 no hydrogen 3.172 N/A ALA 228.A N GLY 225.A O no hydrogen 3.446 N/A ILE 229.A N PHE 226.A O no hydrogen 3.209 N/A