Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u9q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N SER 1.A O no hydrogen 3.033 N/A ARG 5.A NH1 GLN 201.A OE1 no hydrogen 2.841 N/A ARG 5.A NH2 GLN 201.A OE1 no hydrogen 2.892 N/A ALA 6.A N ALA 2.A O no hydrogen 2.979 N/A LEU 7.A N ASP 3.A O no hydrogen 2.927 N/A ALA 8.A N LEU 4.A O no hydrogen 3.009 N/A LYS 9.A N ARG 5.A O no hydrogen 2.904 N/A HIS 10.A N ALA 6.A O no hydrogen 2.894 N/A HIS 10.A NE2 SER 83.A O no hydrogen 2.778 N/A LEU 11.A N LEU 7.A O no hydrogen 2.952 N/A TYR 12.A N ALA 8.A O no hydrogen 2.985 N/A ASP 13.A N LYS 9.A O no hydrogen 2.864 N/A SER 14.A N HIS 10.A O no hydrogen 2.920 N/A SER 14.A OG HIS 10.A O no hydrogen 2.891 N/A TYR 15.A N LEU 11.A O no hydrogen 2.813 N/A TYR 15.A OH ASP 162.A OD1 no hydrogen 2.655 N/A ILE 16.A N TYR 12.A O no hydrogen 2.936 N/A LYS 17.A N ASP 13.A O no hydrogen 3.059 N/A SER 18.A N SER 14.A O no hydrogen 2.980 N/A SER 18.A N TYR 15.A O no hydrogen 3.194 N/A SER 18.A OG SER 14.A O no hydrogen 2.829 N/A PHE 19.A N TYR 15.A O no hydrogen 3.040 N/A LYS 23.A N ASP 162.A OD1 no hydrogen 2.897 N/A LYS 23.A NZ LEU 160.A O no hydrogen 2.798 N/A ALA 24.A N ASP 162.A OD2 no hydrogen 2.933 N/A LYS 25.A N THR 22.A OG1 no hydrogen 3.185 N/A ALA 26.A N THR 22.A O no hydrogen 2.889 N/A ARG 27.A N LYS 23.A O no hydrogen 2.840 N/A ARG 27.A NH1 SER 113.A O no hydrogen 2.842 N/A ARG 27.A NH1 MET 115.A O no hydrogen 2.814 N/A ARG 27.A NH2 MET 115.A O no hydrogen 3.180 N/A ALA 28.A N ALA 24.A O no hydrogen 3.204 N/A ILE 29.A N LYS 25.A O no hydrogen 3.114 N/A LEU 30.A N ALA 26.A O no hydrogen 2.931 N/A THR 31.A N ARG 27.A O no hydrogen 2.922 N/A THR 31.A OG1 ARG 27.A O no hydrogen 2.691 N/A THR 31.A OG1 ALA 28.A O no hydrogen 3.562 N/A GLY 32.A N ILE 29.A O no hydrogen 3.164 N/A LYS 33.A N ALA 28.A O no hydrogen 2.787 N/A LYS 33.A NZ THR 31.A OG1 no hydrogen 3.423 N/A THR 34.A OG1 ASP 36.A OD2 no hydrogen 3.540 N/A LYS 37.A NZ ASP 36.A OD1 no hydrogen 3.019 N/A PHE 40.A N GLN 126.A O no hydrogen 2.927 N/A ILE 42.A N PHE 128.A O no hydrogen 2.816 N/A TYR 43.A N SER 47.A OG no hydrogen 2.866 N/A ASP 44.A N SER 47.A OG no hydrogen 3.062 N/A SER 47.A N ASP 44.A OD1 no hydrogen 2.798 N/A SER 47.A OG ASP 44.A O no hydrogen 3.139 N/A SER 47.A OG ASP 44.A OD1 no hydrogen 2.796 N/A LEU 48.A N ASP 44.A O no hydrogen 3.006 N/A MET 49.A N MET 45.A O no hydrogen 3.010 N/A MET 50.A N ASN 46.A O no hydrogen 2.906 N/A GLY 51.A N SER 47.A O no hydrogen 2.807 N/A ILE 60.A N GLU 57.A O no hydrogen 3.064 N/A ARG 61.A N GLU 57.A O no hydrogen 3.079 N/A ARG 61.A NE GLU 52.A OE2 no hydrogen 2.990 N/A ARG 61.A NH1 LYS 56.A O no hydrogen 2.821 N/A ARG 61.A NH2 GLU 52.A OE1 no hydrogen 3.331 N/A ARG 61.A NH2 GLU 52.A OE2 no hydrogen 2.823 N/A ILE 62.A N VAL 58.A O no hydrogen 2.951 N/A PHE 63.A N ALA 59.A O no hydrogen 3.012 N/A GLN 64.A N ILE 60.A O no hydrogen 2.824 N/A GLY 65.A N ARG 61.A O no hydrogen 3.004 N/A CYS 66.A N ILE 62.A O no hydrogen 2.900 N/A CYS 66.A SG ILE 62.A O no hydrogen 3.345 N/A GLN 67.A N PHE 63.A O no hydrogen 3.006 N/A PHE 68.A N GLN 64.A O no hydrogen 3.251 N/A ARG 69.A N GLY 65.A O no hydrogen 3.093 N/A ARG 69.A NH1 GLU 76.A OE2 no hydrogen 3.491 N/A ARG 69.A NH2 GLU 76.A OE1 no hydrogen 3.440 N/A SER 70.A N CYS 66.A O no hydrogen 2.850 N/A SER 70.A OG CYS 66.A O no hydrogen 3.349 N/A VAL 71.A N GLN 67.A O no hydrogen 2.854 N/A GLU 72.A N PHE 68.A O no hydrogen 3.032 N/A ALA 73.A N ARG 69.A O no hydrogen 2.901 N/A VAL 74.A N SER 70.A O no hydrogen 2.821 N/A GLN 75.A N VAL 71.A O no hydrogen 3.165 N/A GLN 75.A NE2 VAL 71.A O no hydrogen 3.325 N/A GLU 76.A N GLU 72.A O no hydrogen 3.078 N/A ILE 77.A N ALA 73.A O no hydrogen 2.806 N/A THR 78.A N VAL 74.A O no hydrogen 2.895 N/A THR 78.A OG1 VAL 74.A O no hydrogen 2.844 N/A GLU 79.A N GLN 75.A O no hydrogen 3.109 N/A TYR 80.A N GLU 76.A O no hydrogen 2.969 N/A TYR 80.A OH ALA 166.A O no hydrogen 2.638 N/A ALA 81.A N ILE 77.A O no hydrogen 2.792 N/A LYS 82.A N THR 78.A O no hydrogen 3.114 N/A LYS 82.A NZ GLU 79.A OE2 no hydrogen 3.132 N/A SER 83.A N TYR 80.A O no hydrogen 2.882 N/A SER 83.A OG TYR 80.A O no hydrogen 2.662 N/A ILE 84.A N ALA 81.A O no hydrogen 2.991 N/A PHE 87.A N ILE 84.A O no hydrogen 2.951 N/A ASN 89.A N GLY 86.A O no hydrogen 3.229 N/A LEU 90.A N PHE 87.A O no hydrogen 3.040 N/A ASN 93.A N ASP 91.A OD1 no hydrogen 2.760 N/A ASN 93.A ND2 ASP 91.A OD1 no hydrogen 3.508 N/A ASP 94.A N ASP 91.A OD1 no hydrogen 3.333 N/A GLN 95.A N ASP 91.A O no hydrogen 3.020 N/A GLN 95.A NE2 LEU 90.A O no hydrogen 2.856 N/A VAL 96.A N LEU 92.A O no hydrogen 3.050 N/A THR 97.A N ASN 93.A O no hydrogen 2.984 N/A THR 97.A OG1 ASN 93.A O no hydrogen 3.109 N/A LEU 98.A N ASP 94.A O no hydrogen 2.928 N/A LEU 99.A N GLN 95.A O no hydrogen 3.047 N/A LYS 100.A N VAL 96.A O no hydrogen 2.825 N/A LYS 100.A NZ TYR 101.A OH no hydrogen 3.235 N/A LYS 100.A NZ LYS 255.A O no hydrogen 3.124 N/A LYS 100.A NZ ASP 256.A OD2 no hydrogen 3.055 N/A TYR 101.A N THR 97.A O no hydrogen 3.054 N/A GLY 102.A N LEU 99.A O no hydrogen 3.273 N/A VAL 103.A N LEU 99.A O no hydrogen 2.927 N/A ILE 106.A N GLY 102.A O no hydrogen 3.201 N/A ILE 107.A N VAL 103.A O no hydrogen 2.788 N/A TYR 108.A N HIS 104.A O no hydrogen 2.970 N/A THR 109.A N GLU 105.A O no hydrogen 3.113 N/A THR 109.A OG1 GLU 105.A O no hydrogen 2.920 N/A MET 110.A N ILE 106.A O no hydrogen 2.913 N/A LEU 111.A N ILE 107.A O no hydrogen 2.785 N/A ALA 112.A N TYR 108.A O no hydrogen 3.313 N/A ALA 112.A N THR 109.A O no hydrogen 3.250 N/A SER 113.A N MET 110.A O no hydrogen 3.057 N/A LEU 114.A N LEU 111.A O no hydrogen 2.969 N/A MET 115.A N ALA 112.A O no hydrogen 3.113 N/A ASN 116.A N GLY 119.A O no hydrogen 2.949 N/A ASP 118.A N ASN 116.A OD1 no hydrogen 2.840 N/A GLY 119.A N ASN 116.A O no hydrogen 3.453 N/A VAL 120.A N MET 129.A O no hydrogen 2.948 N/A LEU 121.A N LEU 114.A O no hydrogen 2.860 N/A ILE 122.A N GLY 127.A O no hydrogen 2.893 N/A GLY 125.A N ILE 122.A O no hydrogen 3.154 N/A GLN 126.A N SER 123.A O no hydrogen 3.167 N/A GLY 127.A N ILE 122.A O no hydrogen 3.045 N/A PHE 128.A N PHE 40.A O no hydrogen 2.876 N/A MET 129.A N VAL 120.A O no hydrogen 2.869 N/A THR 130.A N ILE 42.A O no hydrogen 2.990 N/A ARG 131.A N ASP 118.A O no hydrogen 2.872 N/A ARG 131.A NE GLU 146.A OE1 no hydrogen 2.936 N/A ARG 131.A NE GLU 146.A OE2 no hydrogen 3.209 N/A ARG 131.A NH1 LYS 117.A O no hydrogen 3.126 N/A ARG 131.A NH2 GLU 146.A OE2 no hydrogen 2.671 N/A PHE 133.A N THR 130.A OG1 no hydrogen 3.029 N/A LEU 134.A N THR 130.A O no hydrogen 3.082 N/A LYS 135.A N ARG 131.A O no hydrogen 2.991 N/A SER 136.A N GLU 132.A O no hydrogen 3.079 N/A SER 136.A N PHE 133.A O no hydrogen 3.132 N/A SER 136.A OG PHE 133.A O no hydrogen 2.720 N/A LEU 137.A N LEU 134.A O no hydrogen 3.411 N/A LYS 139.A NZ ASP 143.A OD2 no hydrogen 3.359 N/A GLY 142.A N ARG 138.A O no hydrogen 3.243 N/A ASP 143.A N PRO 140.A O no hydrogen 2.944 N/A PHE 144.A N PHE 141.A O no hydrogen 3.354 N/A LYS 148.A NZ PHE 144.A O no hydrogen 2.897 N/A LYS 148.A NZ HIS 230.A ND1 no hydrogen 2.878 N/A PHE 149.A N MET 145.A O no hydrogen 2.945 N/A GLU 150.A N GLU 146.A O no hydrogen 2.912 N/A PHE 151.A N PRO 147.A O no hydrogen 2.970 N/A ALA 152.A N LYS 148.A O no hydrogen 2.880 N/A VAL 153.A N PHE 149.A O no hydrogen 2.982 N/A PHE 155.A N PHE 151.A O no hydrogen 2.850 N/A ASN 156.A N ALA 152.A O no hydrogen 2.740 N/A ASN 156.A ND2 ALA 112.A O no hydrogen 3.386 N/A ALA 157.A N VAL 153.A O no hydrogen 3.194 N/A ALA 157.A N LYS 154.A O no hydrogen 3.247 N/A LEU 158.A N PHE 155.A O no hydrogen 3.049 N/A GLU 159.A N ASN 156.A O no hydrogen 3.054 N/A ASP 161.A N ASP 164.A OD2 no hydrogen 2.833 N/A ASP 164.A N ASP 161.A OD1 no hydrogen 2.929 N/A LEU 165.A N ASP 161.A O no hydrogen 2.904 N/A ALA 166.A N ASP 162.A O no hydrogen 2.951 N/A ILE 167.A N ASP 164.A O no hydrogen 3.216 N/A PHE 168.A N ASP 164.A O no hydrogen 3.088 N/A ILE 169.A N LEU 165.A O no hydrogen 2.839 N/A ALA 170.A N ALA 166.A O no hydrogen 3.253 N/A VAL 171.A N ILE 167.A O no hydrogen 2.935 N/A ILE 172.A N PHE 168.A O no hydrogen 3.151 N/A ILE 173.A N ILE 169.A O no hydrogen 3.056 N/A LEU 174.A N ALA 170.A O no hydrogen 3.127 N/A SER 175.A OG ILE 172.A O no hydrogen 2.736 N/A ARG 178.A NH1 GLU 105.A OE2 no hydrogen 2.944 N/A ARG 178.A NH2 GLU 105.A OE1 no hydrogen 2.852 N/A ARG 178.A NH2 ILE 172.A O no hydrogen 3.334 N/A LEU 182.A N ASP 94.A OD1 no hydrogen 2.700 N/A ASN 183.A N ASP 94.A OD2 no hydrogen 2.940 N/A GLU 188.A N VAL 184.A O no hydrogen 2.941 N/A ASP 189.A N LYS 185.A O no hydrogen 2.879 N/A ILE 190.A N PRO 186.A O no hydrogen 3.087 N/A GLN 191.A N ILE 187.A O no hydrogen 2.879 N/A GLN 191.A NE2 VAL 171.A O no hydrogen 2.919 N/A ASP 192.A N GLU 188.A O no hydrogen 2.839 N/A ASN 193.A N ASP 189.A O no hydrogen 3.269 N/A LEU 194.A N ILE 190.A O no hydrogen 2.925 N/A LEU 195.A N GLN 191.A O no hydrogen 2.770 N/A GLN 196.A N ASP 192.A O no hydrogen 2.987 N/A ALA 197.A N ASN 193.A O no hydrogen 2.952 N/A LEU 198.A N LEU 194.A O no hydrogen 2.812 N/A GLU 199.A N LEU 195.A O no hydrogen 2.926 N/A LEU 200.A N GLN 196.A O no hydrogen 3.113 N/A GLN 201.A N ALA 197.A O no hydrogen 2.966 N/A GLN 201.A NE2 ASP 164.A OD1 no hydrogen 2.896 N/A LEU 202.A N LEU 198.A O no hydrogen 2.961 N/A LYS 203.A N GLU 199.A O no hydrogen 3.016 N/A LEU 204.A N LEU 200.A O no hydrogen 2.960 N/A ASN 205.A N GLN 201.A O no hydrogen 2.851 N/A HIS 206.A N LEU 202.A O no hydrogen 2.860 N/A HIS 206.A NE2 GLU 159.A O no hydrogen 3.227 N/A SER 209.A N HIS 206.A O no hydrogen 3.042 N/A LEU 212.A N SER 209.A O no hydrogen 3.263 N/A LYS 215.A N GLN 211.A O no hydrogen 3.044 N/A LEU 216.A N LEU 212.A O no hydrogen 2.855 N/A LEU 217.A N PHE 213.A O no hydrogen 3.006 N/A GLN 218.A N ALA 214.A O no hydrogen 3.087 N/A LYS 219.A N LYS 215.A O no hydrogen 2.952 N/A MET 220.A N LEU 216.A O no hydrogen 3.073 N/A THR 221.A N LEU 217.A O no hydrogen 3.403 N/A THR 221.A OG1 GLN 218.A O no hydrogen 2.278 N/A THR 221.A OG1 GLN 218.A OE1 no hydrogen 2.629 N/A ASP 222.A N GLN 218.A O no hydrogen 2.931 N/A LEU 223.A N LYS 219.A O no hydrogen 2.886 N/A ARG 224.A NH1 ASP 177.A OD2 no hydrogen 2.932 N/A ARG 224.A NH2 ASP 177.A OD1 no hydrogen 2.909 N/A ARG 224.A NH2 ASP 177.A OD2 no hydrogen 3.406 N/A GLN 225.A N THR 221.A O no hydrogen 3.298 N/A ILE 226.A N ASP 222.A O no hydrogen 3.022 N/A VAL 227.A N LEU 223.A O no hydrogen 3.030 N/A THR 228.A N ARG 224.A O no hydrogen 3.024 N/A THR 228.A OG1 ARG 224.A O no hydrogen 3.156 N/A GLU 229.A N GLN 225.A O no hydrogen 2.977 N/A HIS 230.A N ILE 226.A O no hydrogen 2.937 N/A VAL 231.A N VAL 227.A O no hydrogen 2.928 N/A GLN 232.A N THR 228.A O no hydrogen 3.141 N/A LEU 233.A N GLU 229.A O no hydrogen 3.096 N/A LEU 234.A N HIS 230.A O no hydrogen 2.948 N/A GLN 235.A N VAL 231.A O no hydrogen 2.886 N/A VAL 236.A N GLN 232.A O no hydrogen 3.176 N/A ILE 237.A N LEU 233.A O no hydrogen 3.095 N/A LYS 238.A N LEU 234.A O no hydrogen 2.996 N/A LYS 239.A N GLN 235.A O no hydrogen 3.022 N/A THR 240.A N VAL 236.A O no hydrogen 2.988 N/A THR 240.A OG1 VAL 236.A O no hydrogen 3.497 N/A LEU 249.A N HIS 247.A ND1 no hydrogen 3.026 N/A GLN 251.A N HIS 247.A O no hydrogen 2.876 N/A GLU 252.A N PRO 248.A O no hydrogen 3.115 N/A ILE 253.A N LEU 249.A O no hydrogen 3.186 N/A TYR 254.A N LEU 250.A O no hydrogen 2.835 N/A LYS 255.A N GLU 252.A O no hydrogen 3.169 N/A LEU 257.A N ASP 256.A OD2 no hydrogen 2.543 N/A