Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kyt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A OG1 GLU 7.A OE1 no hydrogen 3.484 N/A ILE 6.A N SER 2.A O no hydrogen 3.190 N/A ILE 6.A N LEU 3.A O no hydrogen 3.097 N/A GLU 7.A N LEU 3.A O no hydrogen 2.936 N/A HIS 8.A N THR 4.A O no hydrogen 3.174 N/A LEU 9.A N GLU 5.A O no hydrogen 3.080 N/A VAL 10.A N ILE 6.A O no hydrogen 2.944 N/A GLN 11.A N GLU 7.A O no hydrogen 3.327 N/A SER 12.A N HIS 8.A O no hydrogen 2.763 N/A VAL 13.A N LEU 9.A O no hydrogen 2.960 N/A CYS 14.A N VAL 10.A O no hydrogen 3.156 N/A CYS 14.A SG VAL 10.A O no hydrogen 3.175 N/A CYS 14.A SG ASP 151.A O no hydrogen 4.045 N/A LYS 15.A N GLN 11.A O no hydrogen 3.035 N/A LYS 15.A NZ GLU 19.A OE1 no hydrogen 3.023 N/A SER 16.A N SER 12.A O no hydrogen 2.920 N/A SER 16.A OG SER 12.A O no hydrogen 2.700 N/A TYR 17.A N VAL 13.A O no hydrogen 2.738 N/A ARG 18.A N CYS 14.A O no hydrogen 3.140 N/A GLU 19.A N LYS 15.A O no hydrogen 3.078 N/A THR 20.A N TYR 17.A O no hydrogen 3.108 N/A THR 20.A OG1 SER 16.A O no hydrogen 2.857 N/A THR 20.A OG1 TYR 17.A O no hydrogen 3.564 N/A CYS 21.A SG ARG 18.A O no hydrogen 3.359 N/A CYS 21.A SG LEU 23.A O no hydrogen 3.625 N/A LEU 23.A N CYS 21.A O no hydrogen 2.709 N/A ASP 27.A N ARG 24.A O no hydrogen 2.866 N/A LEU 28.A N ARG 24.A O no hydrogen 3.405 N/A LEU 29.A N LEU 25.A O no hydrogen 2.918 N/A ARG 30.A N GLU 26.A O no hydrogen 2.856 N/A ARG 30.A NE ASP 27.A OD1 no hydrogen 2.818 N/A GLN 31.A N LEU 28.A O no hydrogen 3.047 N/A GLN 31.A NE2 ASP 27.A O no hydrogen 2.792 N/A ARG 32.A N LEU 29.A O no hydrogen 3.454 N/A ASN 34.A N GLN 31.A O no hydrogen 2.836 N/A PHE 36.A N TYR 118.A O no hydrogen 3.012 N/A SER 37.A N GLU 40.A OE2 no hydrogen 2.468 N/A ARG 38.A NH2 GLN 45.A OE1 no hydrogen 3.390 N/A GLU 40.A N SER 37.A OG.B no hydrogen 3.068 N/A VAL 41.A N SER 37.A O no hydrogen 2.724 N/A THR 42.A N ARG 38.A O no hydrogen 3.138 N/A GLY 43.A N GLU 39.A O no hydrogen 3.188 N/A TYR 44.A N GLU 40.A O no hydrogen 3.398 N/A TYR 44.A OH GLU 115.A OE1 no hydrogen 2.711 N/A GLN 45.A N VAL 41.A O no hydrogen 2.859 N/A GLN 45.A NE2 GLU 122.A O no hydrogen 2.698 N/A ARG 46.A N GLY 43.A O no hydrogen 3.324 N/A LYS 47.A N TYR 44.A O no hydrogen 3.251 N/A LYS 47.A NZ GLU 51.A OE2 no hydrogen 3.397 N/A GLU 51.A N SER 48.A OG no hydrogen 3.338 N/A MET 52.A N SER 48.A O no hydrogen 2.908 N/A TRP 53.A N MET 49.A O no hydrogen 2.868 N/A TRP 53.A NE1 LEU 127.A O no hydrogen 2.702 N/A GLU 54.A N TRP 50.A O no hydrogen 2.912 N/A ARG 55.A N GLU 51.A O no hydrogen 3.114 N/A ARG 55.A NH1 GLU 115.A OE2 no hydrogen 2.459 N/A CYS 56.A N MET 52.A O no hydrogen 2.889 N/A CYS 56.A SG MET 52.A O no hydrogen 3.510 N/A ALA 57.A N TRP 53.A O no hydrogen 2.663 N/A HIS 58.A N GLU 54.A O no hydrogen 2.981 N/A HIS 59.A N ARG 55.A O no hydrogen 3.294 N/A HIS 59.A ND1 GLU 62.A OE1 no hydrogen 3.248 N/A HIS 59.A NE2 GLU 115.A OE2 no hydrogen 2.712 N/A LEU 60.A N CYS 56.A O no hydrogen 2.965 N/A THR 61.A N ALA 57.A O no hydrogen 3.102 N/A THR 61.A OG1 ALA 57.A O no hydrogen 2.723 N/A GLU 62.A N HIS 58.A O no hydrogen 3.014 N/A ALA 63.A N HIS 59.A O no hydrogen 3.099 N/A ILE 64.A N LEU 60.A O no hydrogen 2.786 N/A GLN 65.A N THR 61.A O no hydrogen 3.079 N/A VAL 67.A N ALA 63.A O no hydrogen 3.330 N/A VAL 68.A N ILE 64.A O no hydrogen 2.831 N/A GLU 69.A N GLN 65.A O no hydrogen 3.067 N/A PHE 70.A N TYR 66.A O no hydrogen 2.798 N/A ALA 71.A N VAL 67.A O no hydrogen 2.885 N/A LYS 72.A N VAL 68.A O no hydrogen 3.076 N/A ARG 73.A N GLU 69.A O no hydrogen 3.309 N/A ARG 73.A N PHE 70.A O no hydrogen 3.094 N/A LEU 74.A N ALA 71.A O no hydrogen 2.892 N/A PHE 77.A N LEU 74.A O no hydrogen 2.989 N/A GLU 79.A N GLY 76.A O no hydrogen 3.061 N/A LEU 80.A N PHE 77.A O no hydrogen 3.347 N/A CYS 81.A N GLU 171.A OE1 no hydrogen 3.037 N/A CYS 81.A SG GLN 170.A OE1 no hydrogen 3.302 N/A ASN 83.A ND2 ASP 84.A OD1 no hydrogen 2.941 N/A ASN 83.A ND2 GLY 168.A O no hydrogen 3.138 N/A GLN 85.A N CYS 81.A O no hydrogen 3.254 N/A GLN 85.A NE2 PHE 77.A O no hydrogen 3.057 N/A ILE 86.A N GLN 82.A O no hydrogen 3.128 N/A VAL 87.A N ASN 83.A O no hydrogen 2.988 N/A LEU 88.A N ASP 84.A O no hydrogen 2.911 N/A LEU 89.A N GLN 85.A O no hydrogen 2.954 N/A LYS 90.A N ILE 86.A O no hydrogen 2.896 N/A LYS 90.A NZ GLU 240.A O no hydrogen 2.764 N/A ALA 91.A N VAL 87.A O no hydrogen 3.047 N/A GLY 92.A N LEU 88.A O no hydrogen 2.800 N/A ALA 93.A N LEU 89.A O no hydrogen 2.905 N/A VAL 96.A N GLY 92.A O no hydrogen 2.970 N/A VAL 97.A N ALA 93.A O no hydrogen 3.016 N/A LEU 98.A N MET 94.A O no hydrogen 2.923 N/A VAL 99.A N GLU 95.A O no hydrogen 3.099 N/A ARG 100.A N VAL 96.A O no hydrogen 2.755 N/A ARG 100.A NH1 THR 20.A O no hydrogen 2.933 N/A ARG 100.A NH2 THR 20.A O no hydrogen 3.298 N/A MET 101.A N VAL 97.A O no hydrogen 2.763 N/A CYS 102.A N VAL 99.A O no hydrogen 3.095 N/A CYS 102.A SG VAL 99.A O no hydrogen 3.170 N/A ARG 103.A N ARG 100.A O no hydrogen 3.277 N/A ARG 103.A NE GLU 150.A OE1 no hydrogen 3.307 N/A ARG 103.A NE GLU 150.A OE2 no hydrogen 3.090 N/A ARG 103.A NH1 LEU 23.A O no hydrogen 2.788 N/A ARG 103.A NH2 LEU 23.A O no hydrogen 2.741 N/A ARG 103.A NH2 GLU 150.A OE1 no hydrogen 2.670 N/A ALA 104.A N MET 101.A O no hydrogen 2.820 N/A TYR 105.A N CYS 102.A O no hydrogen 3.357 N/A ASN 106.A N THR 111.A O no hydrogen 2.813 N/A ARG 110.A NH1 ASP 138.A OD1 no hydrogen 3.012 N/A THR 111.A N ASN 106.A O no hydrogen 3.253 N/A THR 111.A OG1 ASN 109.A OD1 no hydrogen 2.470 N/A VAL 112.A N GLY 119.A O no hydrogen 2.932 N/A PHE 113.A N ALA 104.A O no hydrogen 2.833 N/A PHE 114.A N LYS 117.A O no hydrogen 2.737 N/A LYS 117.A N PHE 114.A O no hydrogen 3.266 N/A LYS 117.A NZ ILE 35.A O no hydrogen 2.575 N/A LYS 117.A NZ GLU 40.A OE2 no hydrogen 3.344 N/A TYR 118.A N ASN 34.A O no hydrogen 2.648 N/A TYR 118.A OH LEU 28.A O no hydrogen 2.793 N/A GLY 119.A N VAL 112.A O no hydrogen 2.847 N/A LEU 123.A N GLY 120.A O no hydrogen 3.045 N/A PHE 124.A N MET 121.A O no hydrogen 2.758 N/A ARG 125.A N GLU 122.A O no hydrogen 3.281 N/A LEU 127.A N PHE 124.A O no hydrogen 3.122 N/A GLY 128.A N ARG 125.A O no hydrogen 3.216 N/A CYS 129.A SG CYS 129.A O no hydrogen 2.788 N/A ILE 133.A N CYS 129.A O no hydrogen 3.233 N/A SER 134.A N SER 130.A O no hydrogen 3.147 N/A SER 135.A N GLU 131.A O no hydrogen 2.982 N/A SER 135.A OG GLU 131.A O no hydrogen 3.047 N/A ILE 136.A N LEU 132.A O no hydrogen 2.939 N/A PHE 137.A N ILE 133.A O no hydrogen 2.962 N/A ASP 138.A N SER 134.A O no hydrogen 2.947 N/A PHE 139.A N SER 135.A O no hydrogen 2.928 N/A SER 140.A N ILE 136.A O no hydrogen 2.942 N/A HIS 141.A N PHE 137.A O no hydrogen 2.934 N/A SER 142.A N ASP 138.A O no hydrogen 2.982 N/A SER 142.A OG PHE 139.A O no hydrogen 3.090 N/A LEU 143.A N PHE 139.A O no hydrogen 2.915 N/A SER 144.A N SER 140.A O no hydrogen 3.044 N/A SER 144.A OG SER 140.A O no hydrogen 3.018 N/A LEU 146.A N LEU 143.A O no hydrogen 3.114 N/A HIS 147.A N SER 144.A O no hydrogen 3.035 N/A SER 149.A N GLU 152.A OE1 no hydrogen 2.917 N/A GLU 152.A N SER 149.A OG no hydrogen 3.117 N/A ILE 153.A N SER 149.A O no hydrogen 2.969 N/A ALA 154.A N GLU 150.A O no hydrogen 2.922 N/A LEU 155.A N ASP 151.A O no hydrogen 2.975 N/A TYR 156.A N GLU 152.A O no hydrogen 2.893 N/A THR 157.A N ILE 153.A O no hydrogen 2.861 N/A THR 157.A OG1 ILE 153.A O no hydrogen 2.742 N/A THR 157.A OG1 ALA 154.A O no hydrogen 3.432 N/A ALA 158.A N ALA 154.A O no hydrogen 2.992 N/A LEU 159.A N LEU 155.A O no hydrogen 3.319 N/A LEU 159.A N TYR 156.A O no hydrogen 2.819 N/A VAL 160.A N TYR 156.A O no hydrogen 2.967 N/A LEU 161.A N THR 157.A O no hydrogen 3.185 N/A ILE 162.A N ALA 158.A O no hydrogen 2.978 N/A ALA 164.A N GLN 179.A OE1 no hydrogen 2.800 N/A HIS 165.A N ASN 163.A OD1 no hydrogen 2.752 N/A ARG 166.A N ASN 163.A O no hydrogen 3.411 N/A ARG 166.A NH1 GLU 95.A OE1 no hydrogen 3.132 N/A ARG 166.A NH1 GLU 95.A OE2 no hydrogen 3.483 N/A ARG 166.A NH2 GLU 95.A OE2 no hydrogen 2.731 N/A ARG 166.A NH2 VAL 160.A O no hydrogen 2.728 N/A GLN 170.A N ASP 84.A OD1 no hydrogen 2.879 N/A GLU 171.A N ASP 84.A OD2 no hydrogen 2.809 N/A LYS 172.A NZ ALA 164.A O no hydrogen 3.460 N/A ARG 173.A NE GLU 176.A OE1 no hydrogen 3.506 N/A VAL 175.A N GLU 171.A O no hydrogen 3.247 N/A GLU 176.A N LYS 172.A O no hydrogen 2.849 N/A GLN 177.A N ARG 173.A O no hydrogen 3.250 N/A LEU 178.A N LYS 174.A O no hydrogen 3.299 N/A GLN 179.A N VAL 175.A O no hydrogen 2.963 N/A TYR 180.A N GLU 176.A O no hydrogen 2.885 N/A ASN 181.A N GLN 177.A O no hydrogen 3.326 N/A LEU 182.A N LEU 178.A O no hydrogen 3.247 N/A GLU 183.A N GLN 179.A O no hydrogen 2.623 N/A LEU 184.A N TYR 180.A O no hydrogen 3.021 N/A ALA 185.A N ASN 181.A O no hydrogen 2.864 N/A PHE 186.A N LEU 182.A O no hydrogen 2.973 N/A HIS 187.A N GLU 183.A O no hydrogen 2.887 N/A HIS 187.A ND1 GLU 183.A O no hydrogen 3.203 N/A HIS 188.A N LEU 184.A O no hydrogen 2.840 N/A HIS 189.A N ALA 185.A O no hydrogen 2.926 N/A LEU 190.A N PHE 186.A O no hydrogen 2.970 N/A CYS 191.A N HIS 187.A O no hydrogen 2.985 N/A CYS 191.A SG HIS 187.A O no hydrogen 3.758 N/A CYS 191.A SG HIS 188.A O no hydrogen 3.482 N/A LYS 192.A N HIS 188.A O no hydrogen 3.056 N/A THR 193.A N HIS 189.A O no hydrogen 3.134 N/A THR 193.A N LEU 190.A O no hydrogen 3.239 N/A THR 193.A OG1 HIS 189.A O no hydrogen 2.699 N/A THR 193.A OG1 LEU 190.A O no hydrogen 3.404 N/A HIS 194.A N CYS 191.A O no hydrogen 3.323 N/A ARG 195.A N LEU 190.A O no hydrogen 3.051 N/A ARG 195.A NH1 HIS 147.A O no hydrogen 3.323 N/A ARG 195.A NH2 HIS 147.A O no hydrogen 3.221 N/A LEU 199.A N GLN 196.A O no hydrogen 3.177 N/A ARG 209.A N GLY 206.A O no hydrogen 3.383 N/A LEU 211.A N LYS 207.A O no hydrogen 2.965 N/A CYS 212.A N LEU 208.A O no hydrogen 2.924 N/A CYS 212.A SG LEU 208.A O no hydrogen 3.392 N/A SER 213.A N ARG 209.A O no hydrogen 2.901 N/A SER 213.A OG ARG 209.A O no hydrogen 2.936 N/A GLN 214.A N SER 210.A O no hydrogen 3.076 N/A HIS 215.A N LEU 211.A O no hydrogen 3.053 N/A HIS 215.A NE2 TYR 238.A OH no hydrogen 2.795 N/A VAL 216.A N CYS 212.A O no hydrogen 3.074 N/A GLU 217.A N SER 213.A O no hydrogen 2.843 N/A ARG 218.A N GLN 214.A O no hydrogen 3.009 N/A LEU 219.A N HIS 215.A O no hydrogen 2.938 N/A GLN 220.A N VAL 216.A O no hydrogen 2.789 N/A ILE 221.A N GLU 217.A O no hydrogen 3.019 N/A PHE 222.A N ARG 218.A O no hydrogen 2.933 N/A GLN 223.A N LEU 219.A O no hydrogen 2.849 N/A GLN 223.A NE2 SER 243.A OG no hydrogen 2.441 N/A HIS 224.A N GLN 220.A O no hydrogen 3.130 N/A LEU 225.A N ILE 221.A O no hydrogen 3.415 N/A LEU 225.A N PHE 222.A O no hydrogen 2.993 N/A HIS 226.A N PHE 222.A O no hydrogen 2.918 N/A GLN 231.A N PRO 227.A O no hydrogen 3.487 N/A ALA 232.A N ILE 228.A O no hydrogen 2.653 N/A ALA 232.A N VAL 229.A O no hydrogen 3.286 N/A ALA 233.A N VAL 229.A O no hydrogen 2.606 N/A PHE 234.A N VAL 229.A O no hydrogen 3.161 N/A TYR 238.A OH HIS 215.A NE2 no hydrogen 2.795 N/A LYS 239.A N PRO 235.A O no hydrogen 2.975 N/A GLU 240.A N PRO 236.A O no hydrogen 2.634 N/A LEU 241.A N LEU 237.A O no hydrogen 3.062 N/A LEU 241.A N TYR 238.A O no hydrogen 3.261 N/A PHE 242.A N TYR 238.A O no hydrogen 3.010 N/A SER 243.A N LYS 239.A O no hydrogen 2.810 N/A