Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ukm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASN 1.A O no hydrogen 3.211 N/A PHE 6.A N SER 2.A O no hydrogen 3.376 N/A GLY 7.A N ALA 3.A O no hydrogen 3.054 N/A PHE 8.A N THR 4.A O no hydrogen 3.191 N/A LEU 9.A N MET 5.A O no hydrogen 3.028 N/A VAL 10.A N PHE 6.A O no hydrogen 2.965 N/A LEU 11.A N GLY 7.A O no hydrogen 3.300 N/A GLY 12.A N PHE 8.A O no hydrogen 2.693 N/A TYR 13.A N LEU 9.A O no hydrogen 2.898 N/A TYR 13.A OH THR 122.A OG1 no hydrogen 2.857 N/A LEU 14.A N VAL 10.A O no hydrogen 3.394 N/A LEU 15.A N LEU 11.A O no hydrogen 3.028 N/A TYR 16.A N GLY 12.A O no hydrogen 2.801 N/A TYR 16.A OH TYR 114.A O no hydrogen 2.536 N/A LEU 17.A N TYR 13.A O no hydrogen 2.954 N/A VAL 18.A N LEU 14.A O no hydrogen 3.121 N/A PHE 19.A N LEU 15.A O no hydrogen 2.556 N/A GLY 20.A N TYR 16.A O no hydrogen 2.946 N/A ALA 21.A N LEU 17.A O no hydrogen 2.954 N/A VAL 22.A N VAL 18.A O no hydrogen 2.984 N/A VAL 22.A N PHE 19.A O no hydrogen 3.013 N/A VAL 23.A N PHE 19.A O no hydrogen 2.991 N/A PHE 24.A N GLY 20.A O no hydrogen 2.818 N/A SER 25.A N ALA 21.A O no hydrogen 3.300 N/A SER 25.A OG TRP 79.A O no hydrogen 3.194 N/A SER 26.A N VAL 22.A O no hydrogen 3.014 N/A SER 26.A OG VAL 22.A O no hydrogen 3.272 N/A SER 26.A OG VAL 23.A O no hydrogen 3.098 N/A VAL 27.A N VAL 23.A O no hydrogen 3.159 N/A GLU 28.A N PHE 24.A O no hydrogen 2.890 N/A LEU 29.A N SER 25.A O no hydrogen 3.035 N/A GLU 32.A N LEU 29.A O no hydrogen 2.866 N/A ASP 33.A N LEU 29.A O no hydrogen 3.150 N/A LEU 34.A N PRO 30.A O no hydrogen 3.190 N/A LEU 35.A N TYR 31.A O no hydrogen 3.006 N/A ARG 36.A N GLU 32.A O no hydrogen 2.558 N/A GLN 37.A N ASP 33.A O no hydrogen 3.127 N/A GLU 38.A N LEU 34.A O no hydrogen 3.050 N/A LEU 39.A N LEU 35.A O no hydrogen 3.158 N/A ARG 40.A N ARG 36.A O no hydrogen 2.883 N/A LYS 41.A N GLN 37.A O no hydrogen 2.705 N/A LEU 42.A N GLU 38.A O no hydrogen 3.117 N/A LYS 43.A N LEU 39.A O no hydrogen 2.648 N/A ARG 44.A N ARG 40.A O no hydrogen 3.131 N/A ARG 45.A N LYS 41.A O no hydrogen 3.156 N/A PHE 46.A N LEU 42.A O no hydrogen 3.302 N/A PHE 46.A N LYS 43.A O no hydrogen 3.198 N/A LEU 47.A N LYS 43.A O no hydrogen 3.427 N/A GLU 48.A N ARG 44.A O no hydrogen 3.035 N/A HIS 50.A N PHE 46.A O no hydrogen 3.152 N/A LEU 53.A N HIS 50.A O no hydrogen 3.265 N/A GLN 57.A N SER 54.A O no hydrogen 2.912 N/A LEU 58.A N SER 54.A O no hydrogen 3.106 N/A GLU 59.A N GLU 55.A O no hydrogen 3.435 N/A PHE 61.A N LEU 58.A O no hydrogen 2.904 N/A LEU 62.A N LEU 58.A O no hydrogen 2.810 N/A GLY 63.A N GLU 59.A O no hydrogen 3.047 N/A VAL 65.A N PHE 61.A O no hydrogen 2.951 N/A LEU 66.A N LEU 62.A O no hydrogen 2.789 N/A GLU 67.A N GLY 63.A O no hydrogen 2.925 N/A SER 69.A N VAL 65.A O no hydrogen 3.068 N/A ASN 70.A N LEU 66.A O no hydrogen 2.985 N/A TYR 71.A N ALA 68.A O no hydrogen 3.142 N/A GLY 72.A N SER 69.A O no hydrogen 2.832 N/A VAL 73.A N ALA 68.A O no hydrogen 2.965 N/A ASN 78.A N GLU 32.A OE2 no hydrogen 2.932 N/A ASN 78.A ND2 GLY 72.A O no hydrogen 2.805 N/A TRP 79.A N GLU 32.A OE1 no hydrogen 3.150 N/A THR 82.A OG1 ASP 80.A OD2 no hydrogen 2.491 N/A SER 83.A N ASP 80.A OD2 no hydrogen 3.325 N/A SER 83.A OG ASN 78.A O no hydrogen 3.158 N/A ALA 84.A N ASP 80.A O no hydrogen 2.787 N/A LEU 85.A N PHE 81.A O no hydrogen 2.896 N/A PHE 87.A N SER 83.A O no hydrogen 2.996 N/A ALA 88.A N ALA 84.A O no hydrogen 2.999 N/A SER 89.A N LEU 85.A O no hydrogen 3.092 N/A THR 90.A N PHE 86.A O no hydrogen 3.197 N/A THR 90.A OG1 PHE 86.A O no hydrogen 3.411 N/A THR 90.A OG1 PHE 87.A O no hydrogen 3.071 N/A VAL 91.A N PHE 87.A O no hydrogen 2.936 N/A LEU 92.A N ALA 88.A O no hydrogen 3.296 N/A LEU 92.A N SER 89.A O no hydrogen 3.183 N/A SER 93.A N SER 89.A O no hydrogen 2.929 N/A SER 93.A OG SER 89.A O no hydrogen 3.375 N/A SER 93.A OG THR 95.A OG1 no hydrogen 3.407 N/A THR 94.A OG1 SER 93.A O no hydrogen 2.499 N/A THR 95.A N THR 90.A O no hydrogen 2.632 N/A THR 95.A OG1 SER 93.A OG no hydrogen 3.407 N/A THR 95.A OG1 SER 193.A O no hydrogen 3.516 N/A GLY 96.A N THR 90.A O no hydrogen 3.067 N/A TYR 97.A OH SER 193.A OG no hydrogen 2.508 N/A THR 100.A OG1 HIS 99.A ND1 no hydrogen 3.101 N/A LEU 103.A N GLU 28.A OE1 no hydrogen 2.480 N/A SER 104.A N GLU 28.A OE1 no hydrogen 2.879 N/A SER 104.A N GLU 28.A OE2 no hydrogen 2.808 N/A SER 104.A OG GLU 28.A OE2 no hydrogen 2.764 N/A GLY 107.A N SER 104.A OG no hydrogen 2.921 N/A LYS 108.A NZ PRO 102.A O no hydrogen 2.832 N/A ALA 109.A N ASP 105.A O no hydrogen 2.706 N/A PHE 110.A N GLY 106.A O no hydrogen 2.545 N/A CYS 111.A N GLY 107.A O no hydrogen 2.795 N/A ILE 112.A N LYS 108.A O no hydrogen 3.253 N/A ILE 113.A N ALA 109.A O no hydrogen 3.119 N/A TYR 114.A N PHE 110.A O no hydrogen 2.649 N/A TYR 114.A OH TYR 16.A O no hydrogen 2.453 N/A SER 115.A N CYS 111.A O no hydrogen 2.864 N/A SER 115.A OG CYS 111.A O no hydrogen 2.926 N/A VAL 116.A N ILE 112.A O no hydrogen 2.944 N/A ILE 117.A N ILE 113.A O no hydrogen 3.128 N/A GLY 118.A N TYR 114.A O no hydrogen 2.756 N/A ILE 119.A N SER 115.A O no hydrogen 2.658 N/A PHE 121.A N ILE 117.A O no hydrogen 3.261 N/A THR 122.A N GLY 118.A O no hydrogen 2.606 N/A THR 122.A OG1 TYR 13.A OH no hydrogen 2.857 N/A THR 122.A OG1 GLY 118.A O no hydrogen 2.763 N/A LEU 123.A N ILE 119.A O no hydrogen 2.993 N/A LEU 123.A N PRO 120.A O no hydrogen 2.602 N/A LEU 124.A N PRO 120.A O no hydrogen 2.961 N/A PHE 125.A N PHE 121.A O no hydrogen 2.909 N/A LEU 126.A N THR 122.A O no hydrogen 2.983 N/A THR 127.A N LEU 123.A O no hydrogen 2.621 N/A THR 127.A OG1 LEU 123.A O no hydrogen 2.701 N/A ALA 128.A N LEU 124.A O no hydrogen 2.945 N/A VAL 129.A N PHE 125.A O no hydrogen 3.017 N/A VAL 130.A N LEU 126.A O no hydrogen 2.675 N/A GLN 131.A N THR 127.A O no hydrogen 2.734 N/A ARG 132.A N ALA 128.A O no hydrogen 3.007 N/A ILE 133.A N VAL 129.A O no hydrogen 3.295 N/A THR 134.A N VAL 130.A O no hydrogen 2.541 N/A THR 134.A OG1 VAL 130.A O no hydrogen 2.778 N/A VAL 135.A N GLN 131.A O no hydrogen 3.121 N/A HIS 136.A N ARG 132.A O no hydrogen 3.118 N/A VAL 137.A N ILE 133.A O no hydrogen 2.965 N/A THR 138.A N VAL 135.A O no hydrogen 3.159 N/A PHE 145.A N VAL 142.A O no hydrogen 2.773 N/A VAL 150.A N LYS 147.A O no hydrogen 3.128 N/A ALA 151.A N GLN 148.A O no hydrogen 3.290 N/A ILE 152.A N GLN 148.A O no hydrogen 3.328 N/A HIS 154.A N VAL 150.A O no hydrogen 3.064 N/A ALA 155.A N ALA 151.A O no hydrogen 2.758 N/A LEU 157.A N VAL 153.A O no hydrogen 3.036 N/A LEU 158.A N HIS 154.A O no hydrogen 2.866 N/A GLY 159.A N ALA 155.A O no hydrogen 2.748 N/A PHE 160.A N VAL 156.A O no hydrogen 3.348 N/A VAL 161.A N LEU 157.A O no hydrogen 3.138 N/A VAL 161.A N LEU 158.A O no hydrogen 3.317 N/A THR 162.A N LEU 158.A O no hydrogen 3.290 N/A THR 162.A OG1 LEU 158.A O no hydrogen 2.937 N/A THR 162.A OG1 GLY 159.A O no hydrogen 3.401 N/A VAL 163.A N GLY 159.A O no hydrogen 2.854 N/A SER 164.A OG PHE 160.A O no hydrogen 2.541 N/A CYS 165.A N VAL 161.A O no hydrogen 2.689 N/A PHE 166.A N THR 162.A O no hydrogen 2.649 N/A PHE 167.A N VAL 163.A O no hydrogen 3.104 N/A PHE 168.A N VAL 163.A O no hydrogen 3.432 N/A ILE 169.A N SER 164.A O no hydrogen 2.946 N/A ALA 171.A N PHE 167.A O no hydrogen 2.516 N/A ALA 172.A N PHE 168.A O no hydrogen 2.928 N/A ALA 172.A N ILE 169.A O no hydrogen 3.260 N/A VAL 173.A N ILE 169.A O no hydrogen 2.922 N/A PHE 174.A N PRO 170.A O no hydrogen 2.863 N/A SER 175.A N ALA 171.A O no hydrogen 3.275 N/A SER 175.A OG ALA 171.A O no hydrogen 2.735 N/A VAL 176.A N ALA 172.A O no hydrogen 3.045 N/A LEU 177.A N VAL 173.A O no hydrogen 2.910 N/A GLU 178.A N PHE 174.A O no hydrogen 2.683 N/A ASN 182.A N GLU 185.A OE1 no hydrogen 2.847 N/A GLU 185.A N ASN 182.A OD1 no hydrogen 2.836 N/A SER 186.A N ASN 182.A O no hydrogen 2.978 N/A SER 186.A OG ASN 182.A O no hydrogen 3.027 N/A PHE 187.A N PHE 183.A O no hydrogen 2.627 N/A TYR 188.A N LEU 184.A O no hydrogen 2.532 N/A TYR 188.A OH ASP 201.A OD2 no hydrogen 3.257 N/A PHE 189.A N GLU 185.A O no hydrogen 2.841 N/A CYS 190.A N SER 186.A O no hydrogen 3.134 N/A CYS 190.A SG SER 186.A O no hydrogen 3.342 N/A CYS 190.A SG TYR 223.A OH no hydrogen 3.302 N/A PHE 191.A N PHE 187.A O no hydrogen 2.976 N/A ILE 192.A N TYR 188.A O no hydrogen 3.155 N/A SER 193.A N CYS 190.A O no hydrogen 3.210 N/A SER 193.A OG TYR 97.A OH no hydrogen 2.508 N/A SER 193.A OG PHE 189.A O no hydrogen 2.898 N/A LEU 194.A N CYS 190.A O no hydrogen 2.857 N/A SER 195.A N PHE 191.A O no hydrogen 2.957 N/A SER 195.A OG PHE 191.A O no hydrogen 3.017 N/A THR 196.A N SER 193.A O no hydrogen 3.058 N/A THR 196.A OG1 SER 195.A O no hydrogen 2.415 N/A ILE 197.A N SER 195.A OG no hydrogen 3.202 N/A GLY 198.A N ILE 192.A O no hydrogen 2.744 N/A TYR 202.A OH GLU 185.A OE2 no hydrogen 2.944 N/A GLY 205.A N GLU 178.A OE2 no hydrogen 2.613 N/A ARG 213.A NH1 ASP 80.A OD2 no hydrogen 3.562 N/A ARG 213.A NH1 GLU 214.A OE2 no hydrogen 3.371 N/A LEU 215.A N PHE 212.A O no hydrogen 3.117 N/A TYR 216.A N PHE 212.A O no hydrogen 3.389 N/A TYR 216.A OH GLU 178.A OE2 no hydrogen 3.059 N/A LYS 217.A N ARG 213.A O no hydrogen 3.033 N/A LYS 217.A NZ GLU 206.A OE2 no hydrogen 2.467 N/A ILE 218.A N GLU 214.A O no hydrogen 3.440 N/A GLY 219.A N LEU 215.A O no hydrogen 2.568 N/A ILE 220.A N TYR 216.A O no hydrogen 2.834 N/A THR 221.A N LYS 217.A O no hydrogen 2.810 N/A THR 221.A OG1 LYS 217.A O no hydrogen 2.765 N/A CYS 222.A N GLY 219.A O no hydrogen 2.950 N/A CYS 222.A SG ILE 218.A O no hydrogen 2.987 N/A TYR 223.A N GLY 219.A O no hydrogen 2.794 N/A TYR 223.A OH PHE 166.A O no hydrogen 2.385 N/A LEU 224.A N ILE 220.A O no hydrogen 2.768 N/A LEU 225.A N THR 221.A O no hydrogen 3.110 N/A LEU 226.A N CYS 222.A O no hydrogen 2.892 N/A GLY 227.A N TYR 223.A O no hydrogen 2.884 N/A LEU 228.A N LEU 224.A O no hydrogen 3.046 N/A ILE 229.A N LEU 225.A O no hydrogen 3.289 N/A ALA 230.A N LEU 226.A O no hydrogen 2.777 N/A MET 231.A N GLY 227.A O no hydrogen 2.930 N/A LEU 232.A N LEU 228.A O no hydrogen 2.900 N/A VAL 233.A N ILE 229.A O no hydrogen 2.759 N/A VAL 234.A N ALA 230.A O no hydrogen 2.947 N/A LEU 235.A N MET 231.A O no hydrogen 2.656 N/A GLU 236.A N LEU 232.A O no hydrogen 2.755 N/A THR 237.A N VAL 233.A O no hydrogen 3.013 N/A THR 237.A OG1 VAL 233.A O no hydrogen 2.658 N/A PHE 238.A N VAL 234.A O no hydrogen 3.088 N/A PHE 238.A N LEU 235.A O no hydrogen 3.000 N/A CYS 239.A N LEU 235.A O no hydrogen 2.633 N/A GLU 240.A N GLU 236.A O no hydrogen 2.890 N/A LEU 241.A N PHE 238.A O no hydrogen 3.325 N/A LEU 244.A N LEU 241.A O no hydrogen 2.948 N/A LYS 245.A N LEU 241.A O no hydrogen 3.153 N/A LYS 246.A N HIS 242.A O no hydrogen 2.959 N/A PHE 247.A N GLU 243.A O no hydrogen 2.960 N/A ARG 248.A N LEU 244.A O no hydrogen 2.672 N/A ARG 248.A NH1 CYS 239.A O no hydrogen 3.230 N/A LYS 249.A N LYS 245.A O no hydrogen 3.010 N/A MET 250.A N LYS 246.A O no hydrogen 3.107 N/A MET 250.A N PHE 247.A O no hydrogen 3.289 N/A PHE 251.A N ARG 248.A O no hydrogen 2.947 N/A TYR 252.A N LYS 249.A O no hydrogen 3.450 N/A