Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k8r_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N SER 25.A O no hydrogen 3.229 N/A VAL 5.A N ALA 23.A O no hydrogen 3.324 N/A SER 7.A N SER 21.A O no hydrogen 2.770 N/A SER 7.A OG SER 21.A O no hydrogen 3.423 N/A SER 7.A OG SER 21.A OG no hydrogen 2.817 N/A GLY 16.A N GLN 13.A O no hydrogen 3.136 N/A SER 17.A OG ASN 83.A OD1 no hydrogen 2.845 N/A LEU 18.A N MET 82.A O no hydrogen 2.846 N/A LEU 20.A N LEU 80.A O no hydrogen 2.977 N/A SER 21.A N SER 7.A O no hydrogen 2.739 N/A SER 21.A OG SER 7.A O no hydrogen 3.491 N/A SER 21.A OG SER 7.A OG no hydrogen 2.817 N/A CYS 22.A N LEU 78.A O no hydrogen 2.809 N/A CYS 22.A SG VAL 5.A O no hydrogen 3.810 N/A ALA 23.A N VAL 5.A O no hydrogen 2.628 N/A SER 25.A N GLN 3.A O no hydrogen 3.383 N/A SER 25.A OG ALA 23.A O no hydrogen 3.315 N/A SER 31.A N THR 28.A O no hydrogen 3.151 N/A MET 34.A N ILE 51.A O no hydrogen 2.851 N/A HIS 35.A N VAL 96.A O no hydrogen 2.928 N/A HIS 35.A NE2 GLU 98.A OE1 no hydrogen 2.999 N/A TRP 36.A N SER 49.A O no hydrogen 2.967 N/A VAL 37.A N TYR 94.A O no hydrogen 2.799 N/A ARG 38.A N GLU 46.A O no hydrogen 2.718 N/A GLN 39.A N VAL 92.A O no hydrogen 2.918 N/A GLN 39.A NE2 LYS 43.A O no hydrogen 2.877 N/A LYS 43.A N ALA 40.A O no hydrogen 3.221 N/A GLU 46.A N ARG 38.A O no hydrogen 2.757 N/A TRP 47.A NE1 HIS 35.A ND1 no hydrogen 2.867 N/A VAL 48.A N TRP 36.A O no hydrogen 2.973 N/A SER 49.A N TRP 36.A O no hydrogen 3.294 N/A ALA 50.A N TYR 58.A O no hydrogen 2.799 N/A ILE 51.A N MET 34.A O no hydrogen 2.794 N/A GLY 52.A N ASP 56.A O no hydrogen 3.216 N/A TYR 58.A N ALA 50.A O no hydrogen 2.833 N/A SER 62.A OG GLU 46.A OE2 no hydrogen 3.020 N/A VAL 63.A N PRO 60.A O no hydrogen 3.225 N/A LYS 64.A N PRO 60.A O no hydrogen 2.913 N/A ARG 66.A NH1 SER 84.A O no hydrogen 3.208 N/A THR 68.A N GLN 81.A O no hydrogen 3.067 N/A SER 70.A N TYR 79.A O no hydrogen 3.226 N/A ARG 71.A NE ASN 73.A OD1 no hydrogen 3.139 N/A ARG 71.A NH1 TYR 32.A O no hydrogen 2.949 N/A ARG 71.A NH2 TYR 32.A O no hydrogen 3.030 N/A GLU 72.A N SER 77.A O no hydrogen 3.121 N/A LYS 75.A N GLU 72.A O no hydrogen 3.100 N/A LYS 75.A NZ GLU 72.A OE1 no hydrogen 3.540 N/A ASN 76.A N ASN 73.A O no hydrogen 2.893 N/A ASN 76.A ND2 ASN 73.A O no hydrogen 2.903 N/A SER 77.A N GLU 72.A O no hydrogen 3.224 N/A SER 77.A OG LYS 75.A O no hydrogen 2.993 N/A LEU 78.A N CYS 22.A O no hydrogen 3.443 N/A TYR 79.A N SER 70.A O no hydrogen 2.760 N/A LEU 80.A N LEU 20.A O no hydrogen 3.024 N/A GLN 81.A N THR 68.A O no hydrogen 2.966 N/A GLN 81.A NE2 ASN 83.A OD1 no hydrogen 3.412 N/A MET 82.A N LEU 18.A O no hydrogen 3.066 N/A ASN 83.A N ARG 66.A O no hydrogen 2.803 N/A LEU 85.A N GLY 16.A O no hydrogen 3.349 N/A ARG 86.A N ASP 89.A OD2 no hydrogen 2.910 N/A ASP 89.A N ARG 86.A O no hydrogen 3.274 N/A THR 90.A OG1 ALA 87.A O no hydrogen 3.382 N/A THR 90.A OG1 VAL 126.A O no hydrogen 2.942 N/A VAL 92.A N GLN 39.A O no hydrogen 2.972 N/A TYR 93.A N THR 122.A O no hydrogen 3.396 N/A TYR 93.A OH ASP 89.A O no hydrogen 3.078 N/A TYR 94.A N VAL 37.A O no hydrogen 2.869 N/A CYS 95.A N GLU 6.A OE2 no hydrogen 2.786 N/A VAL 96.A N HIS 35.A O no hydrogen 2.716 N/A ARG 97.A N VAL 117.A O no hydrogen 2.849 N/A ARG 97.A NE ASP 116.A OD1 no hydrogen 3.185 N/A ARG 97.A NH2 ASP 116.A OD2 no hydrogen 3.010 N/A GLU 98.A N ASP 33.A O no hydrogen 3.168 N/A GLY 99.A N GLY 114.A O no hydrogen 2.806 N/A TYR 101.A N SER 112.A O no hydrogen 2.978 N/A HIS 103.A N TYR 110.A O no hydrogen 2.817 N/A HIS 103.A NE2 SER 112.A OG no hydrogen 2.713 N/A SER 112.A N TYR 101.A O no hydrogen 2.903 N/A SER 112.A OG TYR 101.A O no hydrogen 3.534 N/A SER 112.A OG HIS 103.A NE2 no hydrogen 2.713 N/A GLY 114.A N GLY 99.A O no hydrogen 3.334 N/A ASP 116.A N GLY 114.A O no hydrogen 2.901 N/A VAL 117.A N ASP 116.A OD1 no hydrogen 2.737 N/A GLY 119.A N CYS 95.A O no hydrogen 3.073 N/A GLN 120.A N GLU 6.A OE1 no hydrogen 2.981 N/A GLN 120.A N GLU 6.A OE2 no hydrogen 3.197 N/A GLY 121.A N GLU 6.A OE2 no hydrogen 3.051 N/A THR 122.A N TYR 93.A O no hydrogen 3.237 N/A VAL 124.A N ALA 91.A O no hydrogen 3.175 N/A THR 125.A N GLY 10.A O no hydrogen 2.890 N/A VAL 126.A N THR 90.A OG1 no hydrogen 3.183 N/A SER 127.A N VAL 12.A O no hydrogen 3.238 N/A LYS 132.A N PHE 161.A O no hydrogen 2.768 N/A LYS 132.A NZ GLY 133.A O no hydrogen 3.463 N/A LYS 132.A NZ ASP 159.A O no hydrogen 2.816 N/A SER 135.A N LYS 158.A O no hydrogen 3.236 N/A PHE 137.A N LEU 156.A O no hydrogen 2.992 N/A LEU 139.A N GLY 154.A O no hydrogen 2.962 N/A SER 145.A OG SER 142.A O no hydrogen 2.925 N/A GLY 148.A N THR 146.A O no hydrogen 2.854 N/A GLY 149.A N THR 146.A O no hydrogen 3.461 N/A ALA 151.A N VAL 199.A O no hydrogen 2.760 N/A LEU 153.A N VAL 197.A O no hydrogen 3.373 N/A GLY 154.A N LEU 139.A O no hydrogen 3.420 N/A CYS 155.A N SER 195.A O no hydrogen 3.006 N/A CYS 155.A SG PHE 137.A O no hydrogen 3.838 N/A LEU 156.A N PHE 137.A O no hydrogen 2.778 N/A VAL 157.A N LEU 193.A O no hydrogen 2.767 N/A LYS 158.A N SER 135.A O no hydrogen 3.184 N/A LYS 158.A NZ ASP 159.A OD2 no hydrogen 2.818 N/A TYR 160.A N TYR 191.A O no hydrogen 3.372 N/A THR 166.A N ASN 214.A O no hydrogen 3.296 N/A SER 168.A N ASN 212.A O no hydrogen 3.304 N/A TRP 169.A NE1 SER 195.A OG no hydrogen 2.918 N/A ASN 170.A N ILE 210.A O no hydrogen 2.822 N/A ASN 170.A ND2 THR 208.A O no hydrogen 2.794 N/A SER 171.A N ASN 212.A OD1 no hydrogen 3.241 N/A SER 171.A OG ASN 212.A OD1 no hydrogen 2.935 N/A THR 175.A OG1 ALA 173.A O no hydrogen 3.535 N/A HIS 179.A N VAL 196.A O no hydrogen 2.881 N/A THR 180.A OG1 SER 195.A OG no hydrogen 3.100 N/A PHE 181.A N SER 194.A O no hydrogen 2.995 N/A VAL 184.A N SER 192.A O no hydrogen 3.038 N/A GLN 186.A N LEU 190.A O no hydrogen 3.065 N/A GLN 186.A NE2 ASP 159.A OD1 no hydrogen 2.876 N/A GLY 189.A N GLN 186.A O no hydrogen 3.337 N/A TYR 191.A N TYR 160.A O no hydrogen 2.873 N/A SER 192.A N VAL 184.A O no hydrogen 2.924 N/A LEU 193.A N VAL 157.A O no hydrogen 2.856 N/A SER 195.A N CYS 155.A O no hydrogen 3.290 N/A SER 195.A OG THR 180.A OG1 no hydrogen 3.100 N/A VAL 196.A N HIS 179.A O no hydrogen 3.410 N/A VAL 197.A N LEU 153.A O no hydrogen 3.146 N/A THR 198.A N GLY 177.A O no hydrogen 3.109 N/A THR 198.A OG1 GLY 177.A O no hydrogen 3.361 N/A VAL 199.A N ALA 151.A O no hydrogen 3.181 N/A SER 201.A OG THR 146.A O no hydrogen 3.116 N/A SER 203.A N PRO 200.A O no hydrogen 3.363 N/A SER 203.A OG PRO 200.A O no hydrogen 2.734 N/A SER 203.A OG TYR 209.A OH no hydrogen 3.239 N/A THR 206.A OG1 SER 203.A O no hydrogen 3.039 N/A GLN 207.A N SER 203.A O no hydrogen 3.236 N/A CYS 211.A N LYS 224.A O no hydrogen 3.165 N/A CYS 211.A SG LYS 224.A O no hydrogen 3.658 N/A VAL 213.A N VAL 222.A O no hydrogen 3.414 N/A HIS 215.A N THR 220.A O no hydrogen 2.810 N/A HIS 215.A NE2 PRO 162.A O no hydrogen 2.727 N/A SER 218.A N HIS 215.A ND1 no hydrogen 3.355 N/A SER 218.A OG HIS 215.A ND1 no hydrogen 2.657 N/A SER 218.A OG THR 220.A OG1 no hydrogen 2.758 N/A ASN 219.A N LYS 216.A O no hydrogen 3.269 N/A THR 220.A OG1 SER 218.A OG no hydrogen 2.758 N/A VAL 222.A N VAL 213.A O no hydrogen 3.278 N/A LYS 224.A NZ VAL 136.A O no hydrogen 3.400 N/A VAL 226.A N TYR 209.A O no hydrogen 2.828 N/A SER 229.A N PRO 141.A O no hydrogen 3.423 N/A