Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ak4_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 ASP 28.A OD2 no hydrogen 3.511 N/A LYS 2.A N GLU 25.A O no hydrogen 3.253 N/A THR 4.A N VAL 23.A O no hydrogen 2.687 N/A GLN 5.A NE2 TYR 89.A O no hydrogen 2.895 N/A GLN 7.A NE2 THR 19.A O no hydrogen 3.294 N/A ILE 10.A N ARG 109.A O no hydrogen 2.802 N/A VAL 12.A N GLN 111.A O no hydrogen 3.056 N/A VAL 13.A N GLU 16.A OE1 no hydrogen 3.313 N/A GLU 14.A N PHE 113.A O no hydrogen 2.908 N/A LYS 15.A N SER 81.A O no hydrogen 2.840 N/A GLU 16.A N VAL 13.A O no hydrogen 3.185 N/A VAL 18.A N ILE 78.A O no hydrogen 3.025 N/A THR 19.A OG1 THR 77.A OG1 no hydrogen 3.268 N/A LEU 20.A N PHE 76.A O no hydrogen 2.726 N/A ASP 21.A N GLN 7.A OE1 no hydrogen 2.966 N/A CYS 22.A N ASN 75.A OD1 no hydrogen 3.417 N/A VAL 23.A N THR 4.A O no hydrogen 2.947 N/A TYR 24.A N SER 72.A O no hydrogen 3.051 N/A TYR 24.A OH TYR 31.A OH no hydrogen 2.595 N/A GLU 25.A N LYS 2.A O no hydrogen 2.920 N/A TYR 31.A N SER 52.A OG no hydrogen 3.035 N/A TYR 31.A OH TYR 24.A OH no hydrogen 2.595 N/A TYR 32.A N SER 94.A O no hydrogen 2.946 N/A LEU 33.A N ARG 50.A O no hydrogen 2.670 N/A PHE 34.A N ALA 92.A O no hydrogen 2.839 N/A TRP 35.A N ILE 48.A O no hydrogen 3.171 N/A TRP 35.A NE1 PHE 74.A O no hydrogen 2.889 N/A TYR 36.A N PHE 90.A O no hydrogen 2.793 N/A LYS 37.A N VAL 45.A O no hydrogen 2.833 N/A LYS 37.A NZ VAL 84.A O no hydrogen 3.069 N/A GLN 38.A N VAL 88.A O no hydrogen 2.816 N/A GLN 38.A NE2 GLY 42.A O no hydrogen 2.950 N/A SER 41.A OG GLU 43.A OE1 no hydrogen 3.189 N/A GLY 42.A N PRO 39.A O no hydrogen 2.718 N/A GLU 43.A N GLU 43.A OE1 no hydrogen 2.732 N/A VAL 45.A N LYS 37.A O no hydrogen 2.812 N/A LEU 47.A N TRP 35.A O no hydrogen 2.952 N/A ARG 49.A NE ASN 51.A OD1 no hydrogen 3.125 N/A ARG 49.A NH2 ASN 51.A OD1 no hydrogen 3.071 N/A ARG 50.A N LEU 33.A O no hydrogen 2.905 N/A ARG 50.A NH1 GLU 55.A O no hydrogen 3.275 N/A ASN 51.A N ASP 54.A OD2 no hydrogen 3.080 N/A SER 52.A N TYR 31.A O no hydrogen 2.831 N/A SER 52.A OG TYR 31.A O no hydrogen 2.852 N/A ASP 54.A N ASN 51.A O no hydrogen 2.889 N/A GLU 58.A N TRP 65.A O no hydrogen 3.405 N/A ARG 62.A NE THR 79.A O no hydrogen 3.132 N/A ARG 62.A NE ALA 80.A O no hydrogen 3.129 N/A ARG 62.A NH1 ASP 85.A OD1 no hydrogen 3.458 N/A ARG 62.A NH2 ALA 80.A O no hydrogen 3.207 N/A ARG 62.A NH2 ASP 85.A OD1 no hydrogen 3.210 N/A ARG 62.A NH2 ASP 85.A OD2 no hydrogen 2.265 N/A TYR 63.A N SER 60A.A O no hydrogen 3.123 N/A SER 64.A N THR 77.A O no hydrogen 2.998 N/A SER 64.A OG THR 77.A O no hydrogen 3.568 N/A TRP 65.A N GLU 58.A O no hydrogen 3.085 N/A ASN 66.A N ASN 75.A O no hydrogen 2.947 N/A ASN 66.A ND2 GLN 56A.A O no hydrogen 3.368 N/A PHE 67.A N GLN 56A.A O no hydrogen 2.813 N/A GLN 68.A N SER 73.A O no hydrogen 2.963 N/A SER 72.A N LYS 69.A O no hydrogen 2.990 N/A SER 73.A N GLN 68.A O no hydrogen 3.036 N/A PHE 74.A N CYS 22.A O no hydrogen 3.006 N/A PHE 76.A N LEU 20.A O no hydrogen 2.922 N/A THR 77.A N SER 64.A O no hydrogen 2.857 N/A THR 77.A OG1 THR 19.A OG1 no hydrogen 3.268 N/A ILE 78.A N VAL 18.A O no hydrogen 2.817 N/A THR 79.A N ARG 62.A O no hydrogen 2.889 N/A THR 79.A OG1 ARG 62.A O no hydrogen 3.248 N/A ALA 80.A N ASP 17.A OD1 no hydrogen 2.929 N/A SER 81.A N GLU 16.A O no hydrogen 3.025 N/A SER 81.A OG GLU 16.A O no hydrogen 2.821 N/A GLN 82.A N ASP 85.A OD2 no hydrogen 2.626 N/A ASP 85.A N GLN 82.A O no hydrogen 2.733 N/A SER 86.A N VAL 83.A O no hydrogen 3.028 N/A SER 86.A OG VAL 83.A O no hydrogen 3.139 N/A ALA 87.A N LEU 110.A O no hydrogen 3.119 N/A VAL 88.A N GLN 38.A O no hydrogen 3.118 N/A TYR 89.A N THR 108.A O no hydrogen 2.843 N/A TYR 89.A OH ASP 85.A O no hydrogen 2.532 N/A PHE 90.A N TYR 36.A O no hydrogen 2.789 N/A CYS 91.A N GLN 5.A OE1 no hydrogen 2.975 N/A ALA 92.A N PHE 34.A O no hydrogen 2.916 N/A LEU 93.A N ILE 103.A O no hydrogen 2.861 N/A SER 94.A N TYR 32.A O no hydrogen 3.047 N/A SER 94.A OG GLY 95.A O no hydrogen 2.648 N/A TYR 97.A N ASP 100.A OD2 no hydrogen 3.230 N/A ASP 100.A N TYR 97.A O no hydrogen 3.001 N/A ILE 103.A N LEU 93.A O no hydrogen 2.764 N/A GLY 105.A N CYS 91.A O no hydrogen 2.901 N/A GLY 107.A N GLN 5.A OE1 no hydrogen 3.141 N/A THR 108.A N TYR 89.A O no hydrogen 3.057 N/A THR 108.A OG1 GLN 7.A O no hydrogen 2.969 N/A ARG 109.A N THR 8.A O no hydrogen 2.859 N/A LEU 110.A N ALA 87.A O no hydrogen 2.815 N/A GLN 111.A N ILE 10.A O no hydrogen 2.809 N/A GLN 111.A NE2 GLU 9.A OE1 no hydrogen 3.050 N/A VAL 112.A N SER 86.A OG no hydrogen 2.968 N/A PHE 113.A N VAL 12.A O no hydrogen 2.838 N/A ASN 115.A N GLU 14.A OE1 no hydrogen 2.807 N/A ASP 120.A N ASP 141.A O no hydrogen 2.798 N/A ALA 122.A N THR 140.A O no hydrogen 3.194 N/A VAL 123.A N PHE 201.A O no hydrogen 3.197 N/A TYR 124.A N LEU 138.A O no hydrogen 2.839 N/A LEU 126.A N VAL 136.A O no hydrogen 2.871 N/A SER 129.A OG SER 132.A OG no hydrogen 2.594 N/A SER 132.A OG SER 129.A OG no hydrogen 2.594 N/A SER 135.A OG GLN 125.A OE1 no hydrogen 3.122 N/A CYS 137.A N ALA 178.A O no hydrogen 2.757 N/A LEU 138.A N TYR 124.A O no hydrogen 2.810 N/A PHE 139.A N ALA 176.A O no hydrogen 2.960 N/A THR 140.A N ALA 122.A O no hydrogen 3.080 N/A THR 140.A OG1 ASP 141.A OD1 no hydrogen 3.452 N/A THR 140.A OG1 ASN 174.A O no hydrogen 3.013 N/A ASP 141.A N ASN 174.A O no hydrogen 2.989 N/A SER 144.A OG PRO 114.A O no hydrogen 2.732 N/A THR 146.A N ASP 143.A O no hydrogen 3.350 N/A THR 146.A OG1 ASP 143.A OD1 no hydrogen 3.376 N/A THR 146.A OG1 ASP 143.A OD2 no hydrogen 3.177 N/A SER 149.A N SER 194.A OG no hydrogen 2.813 N/A SER 151.A OG ASP 153.A O no hydrogen 3.120 N/A SER 151.A OG VAL 156.A O no hydrogen 2.718 N/A ASP 155.A N ASP 153.A OD1 no hydrogen 2.701 N/A TYR 157.A N TRP 179.A O no hydrogen 2.958 N/A THR 159.A N VAL 177.A O no hydrogen 2.981 N/A THR 159.A OG1 ASP 160.A O no hydrogen 3.383 N/A THR 159.A OG1 VAL 177.A O no hydrogen 3.458 N/A LYS 161.A N ASP 160.A OD1 no hydrogen 2.767 N/A LYS 161.A NZ THR 146.A O no hydrogen 3.151 N/A LYS 161.A NZ ASN 147.A OD1 no hydrogen 3.553 N/A CYS 162.A N SER 175.A O no hydrogen 2.742 N/A LEU 164.A N SER 173.A O no hydrogen 2.731 N/A MET 166.A N PHE 171.A O no hydrogen 2.838 N/A ARG 167.A NH2 ASP 165.A OD2 no hydrogen 3.532 N/A MET 169.A N MET 166.A O no hydrogen 3.347 N/A ASP 170.A N ARG 167.A O no hydrogen 3.319 N/A PHE 171.A N MET 166.A O no hydrogen 3.333 N/A LYS 172.A NZ GLU 14.A OE2 no hydrogen 3.087 N/A SER 173.A N LEU 164.A O no hydrogen 3.146 N/A ASN 174.A ND2 PHE 142.A O no hydrogen 3.149 N/A ASN 174.A ND2 SER 144.A OG no hydrogen 3.254 N/A SER 175.A N CYS 162.A O no hydrogen 3.030 N/A ALA 176.A N PHE 139.A O no hydrogen 2.747 N/A VAL 177.A N THR 159.A OG1 no hydrogen 2.873 N/A ALA 178.A N CYS 137.A O no hydrogen 2.864 N/A TRP 179.A N TYR 157.A O no hydrogen 3.052 N/A SER 180.A OG ASP 155.A O no hydrogen 2.918 N/A ASN 181.A ND2 ASP 155.A OD1 no hydrogen 3.308 N/A CYS 187.A SG TYR 124.A O no hydrogen 3.803 N/A ASN 193.A ND2 ASN 193.A O no hydrogen 2.908 N/A SER 194.A N PHE 191.A O no hydrogen 3.098 N/A THR 200.A OG1 PRO 197.A O no hydrogen 2.641 N/A PHE 201.A N PRO 121.A O no hydrogen 2.927 N/A SER 60A.A N TYR 63.A O no hydrogen 2.849 N/A