Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qhx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N ASP 93.A OD2 no hydrogen 2.802 N/A ALA 5.A N ALA 28.A O no hydrogen 2.891 N/A LEU 6.A N VAL 94.A O no hydrogen 2.777 N/A VAL 7.A N CYS 30.A O no hydrogen 3.128 N/A THR 8.A N VAL 96.A O no hydrogen 3.126 N/A THR 8.A OG1 VAL 96.A O no hydrogen 3.315 N/A GLY 9.A N HIS 32.A ND1 no hydrogen 3.047 N/A ALA 10.A N HIS 32.A O no hydrogen 2.827 N/A LYS 12.A NZ SER 36.A OG no hydrogen 3.288 N/A ARG 13.A NH1 VAL 204.A O no hydrogen 2.915 N/A ARG 13.A NH2 VAL 204.A O no hydrogen 3.515 N/A ARG 16.A N LYS 12.A O no hydrogen 3.204 N/A ARG 16.A NE GLU 20.A OE2 no hydrogen 2.862 N/A ARG 16.A NH2 GLU 20.A OE2 no hydrogen 3.395 N/A SER 17.A N ARG 13.A O no hydrogen 3.197 N/A SER 17.A OG SER 234.A OG no hydrogen 2.699 N/A ILE 18.A N LEU 14.A O no hydrogen 2.828 N/A ALA 19.A N GLY 15.A O no hydrogen 2.832 N/A GLU 20.A N ARG 16.A O no hydrogen 2.756 N/A GLY 21.A N SER 17.A O no hydrogen 2.846 N/A LEU 22.A N ILE 18.A O no hydrogen 2.936 N/A HIS 23.A N ALA 19.A O no hydrogen 2.928 N/A HIS 23.A NE2 SER 54.A OG no hydrogen 2.681 N/A ALA 24.A N GLU 20.A O no hydrogen 2.896 N/A GLU 25.A N LEU 22.A O no hydrogen 3.068 N/A GLY 26.A N HIS 23.A O no hydrogen 2.939 N/A TYR 27.A N LEU 22.A O no hydrogen 3.173 N/A ALA 28.A N PRO 3.A O no hydrogen 2.863 N/A VAL 29.A N SER 54.A O no hydrogen 2.843 N/A CYS 30.A N ALA 5.A O no hydrogen 2.797 N/A LEU 31.A N ILE 56.A O no hydrogen 2.691 N/A HIS 32.A N VAL 7.A O no hydrogen 3.002 N/A HIS 32.A NE2 ALA 60.A O no hydrogen 2.760 N/A TYR 33.A N VAL 58.A O no hydrogen 2.957 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.796 N/A ALA 40.A N SER 36.A O no hydrogen 3.058 N/A ASN 41.A N ALA 37.A O no hydrogen 2.847 N/A ALA 42.A N ALA 38.A O no hydrogen 2.866 N/A LEU 43.A N GLU 39.A O no hydrogen 2.953 N/A SER 44.A N ALA 40.A O no hydrogen 2.906 N/A ALA 45.A N ASN 41.A O no hydrogen 2.978 N/A THR 46.A N ALA 42.A O no hydrogen 3.103 N/A THR 46.A OG1 ALA 42.A O no hydrogen 3.232 N/A LEU 47.A N LEU 43.A O no hydrogen 3.107 N/A ASN 48.A N SER 44.A O no hydrogen 2.865 N/A ASN 48.A ND2 ALA 55.A O no hydrogen 3.054 N/A ALA 49.A N ALA 45.A O no hydrogen 2.948 N/A ARG 50.A N THR 46.A O no hydrogen 3.179 N/A ARG 51.A N LEU 47.A O no hydrogen 2.987 N/A ARG 51.A NH1 HIS 23.A O no hydrogen 3.161 N/A ARG 51.A NH2 HIS 23.A O no hydrogen 2.886 N/A SER 54.A N ASN 48.A OD1 no hydrogen 2.990 N/A SER 54.A OG HIS 23.A NE2 no hydrogen 2.681 N/A SER 54.A OG ARG 51.A O no hydrogen 2.610 N/A ALA 55.A N ASN 48.A OD1 no hydrogen 3.069 N/A ILE 56.A N VAL 29.A O no hydrogen 3.113 N/A THR 57.A OG1 ASN 41.A OD1 no hydrogen 3.046 N/A VAL 58.A N LEU 31.A O no hydrogen 3.033 N/A GLN 59.A NE2 HIS 34.A O no hydrogen 3.085 N/A ALA 60.A N TYR 33.A O no hydrogen 3.006 N/A SER 63.A N ASP 61.A OD1 no hydrogen 3.006 N/A ASN 64.A N ALA 117.A O no hydrogen 2.875 N/A VAL 65.A N SER 63.A O no hydrogen 2.745 N/A THR 67.A N VAL 72.A O no hydrogen 2.717 N/A THR 67.A OG1 VAL 72.A O no hydrogen 3.336 N/A VAL 72.A N THR 67.A O no hydrogen 2.721 N/A THR 73.A OG1 THR 76.A OG1 no hydrogen 3.097 N/A THR 76.A N THR 73.A OG1 no hydrogen 3.391 N/A THR 76.A OG1 THR 73.A OG1 no hydrogen 3.097 N/A ARG 77.A N THR 73.A O no hydrogen 3.072 N/A ARG 77.A NE ASP 61.A O no hydrogen 2.760 N/A ARG 77.A NH1 VAL 65.A O no hydrogen 2.916 N/A ARG 77.A NH2 ASP 61.A O no hydrogen 2.716 N/A ARG 77.A NH2 VAL 65.A O no hydrogen 3.042 N/A CYS 78.A N LEU 74.A O no hydrogen 2.835 N/A CYS 78.A SG LEU 74.A O no hydrogen 3.399 N/A CYS 78.A SG ALA 126.A O no hydrogen 3.610 N/A ALA 79.A N PHE 75.A O no hydrogen 2.872 N/A GLU 80.A N THR 76.A O no hydrogen 2.971 N/A LEU 81.A N ARG 77.A O no hydrogen 3.296 N/A VAL 82.A N CYS 78.A O no hydrogen 3.344 N/A ALA 83.A N ALA 79.A O no hydrogen 2.858 N/A ALA 84.A N GLU 80.A O no hydrogen 2.896 N/A CYS 85.A N VAL 82.A O no hydrogen 3.045 N/A CYS 85.A SG LEU 81.A O no hydrogen 3.955 N/A TYR 86.A N VAL 82.A O no hydrogen 3.391 N/A THR 87.A N ALA 83.A O no hydrogen 2.752 N/A THR 87.A OG1 ALA 83.A O no hydrogen 3.176 N/A HIS 88.A N ALA 84.A O no hydrogen 3.119 N/A HIS 88.A NE2 ASN 53.A OD1 no hydrogen 2.716 N/A TRP 89.A N CYS 85.A O no hydrogen 2.876 N/A TRP 89.A NE1 ASN 53.A O no hydrogen 3.173 N/A GLY 90.A N TYR 86.A O no hydrogen 2.794 N/A ARG 91.A NE ASP 93.A OD2 no hydrogen 2.872 N/A ARG 91.A NH2 ASP 93.A OD1 no hydrogen 2.789 N/A CYS 92.A SG VAL 94.A O no hydrogen 3.903 N/A ASP 93.A N VAL 4.A O no hydrogen 2.738 N/A VAL 94.A N VAL 4.A O no hydrogen 2.980 N/A LEU 95.A N SER 151.A O no hydrogen 3.017 N/A VAL 96.A N LEU 6.A O no hydrogen 2.803 N/A ASN 97.A N ILE 153.A O no hydrogen 2.799 N/A ASN 97.A ND2 ASN 154.A OD1 no hydrogen 2.761 N/A ASN 98.A N THR 8.A OG1 no hydrogen 2.874 N/A ASN 98.A ND2 THR 8.A O no hydrogen 3.324 N/A ASN 98.A ND2 GLY 9.A O no hydrogen 3.078 N/A ALA 99.A N THR 8.A OG1 no hydrogen 2.922 N/A SER 100.A OG SER 101.A O no hydrogen 3.359 N/A SER 100.A OG ASN 123.A OD1 no hydrogen 2.556 N/A SER 101.A N SER 122.A OG no hydrogen 3.104 N/A SER 101.A OG ASP 118.A O no hydrogen 3.074 N/A SER 101.A OG SER 122.A OG no hydrogen 3.038 N/A TYR 103.A OH ASP 118.A OD2 no hydrogen 2.651 N/A THR 105.A N GLY 166.A O no hydrogen 2.727 N/A THR 114.A OG1 GLU 110.A O no hydrogen 2.955 N/A THR 114.A OG1 ALA 111.A O no hydrogen 2.778 N/A ALA 115.A N ALA 111.A O no hydrogen 3.097 N/A THR 116.A OG1 MET 112.A O no hydrogen 2.896 N/A ALA 117.A N GLU 113.A O no hydrogen 3.266 N/A ASP 118.A N THR 114.A O no hydrogen 2.860 N/A LEU 119.A N ALA 115.A O no hydrogen 2.898 N/A PHE 120.A N THR 116.A O no hydrogen 2.943 N/A GLY 121.A N ALA 117.A O no hydrogen 2.931 N/A SER 122.A N ASP 118.A O no hydrogen 3.154 N/A SER 122.A OG SER 101.A OG no hydrogen 3.038 N/A SER 122.A OG ASP 118.A O no hydrogen 2.855 N/A SER 122.A OG LEU 119.A O no hydrogen 3.551 N/A ASN 123.A N LEU 119.A O no hydrogen 3.288 N/A ASN 123.A ND2 SER 101.A O no hydrogen 3.012 N/A ASN 123.A ND2 LEU 119.A O no hydrogen 2.968 N/A ALA 124.A N PHE 120.A O no hydrogen 3.052 N/A ILE 125.A N PHE 120.A O no hydrogen 2.904 N/A ALA 126.A N GLY 121.A O no hydrogen 2.731 N/A TYR 128.A N ALA 124.A O no hydrogen 3.113 N/A PHE 129.A N ILE 125.A O no hydrogen 3.079 N/A LEU 130.A N ALA 126.A O no hydrogen 2.707 N/A ILE 131.A N PRO 127.A O no hydrogen 2.785 N/A LYS 132.A N TYR 128.A O no hydrogen 2.867 N/A ALA 133.A N PHE 129.A O no hydrogen 2.889 N/A PHE 134.A N LEU 130.A O no hydrogen 2.893 N/A ALA 135.A N ILE 131.A O no hydrogen 2.768 N/A HIS 136.A N LYS 132.A O no hydrogen 2.831 N/A ARG 137.A N ALA 133.A O no hydrogen 3.048 N/A VAL 138.A N PHE 134.A O no hydrogen 3.276 N/A ALA 139.A N ALA 135.A O no hydrogen 2.874 N/A GLY 140.A N HIS 136.A O no hydrogen 2.935 N/A THR 141.A N VAL 138.A O no hydrogen 3.113 N/A THR 141.A OG1 ARG 137.A O no hydrogen 2.753 N/A HIS 145.A N PRO 142.A O no hydrogen 2.763 N/A ARG 146.A N ALA 143.A O no hydrogen 3.261 N/A ARG 146.A NE VAL 138.A O no hydrogen 3.018 N/A ARG 146.A NE THR 141.A O no hydrogen 2.794 N/A ARG 146.A NH2 ALA 139.A O no hydrogen 3.138 N/A ARG 146.A NH2 THR 141.A O no hydrogen 3.068 N/A GLY 147.A N TYR 150.A OH no hydrogen 2.983 N/A ASN 149.A ND2 CYS 241.A O no hydrogen 2.715 N/A SER 151.A N ASP 93.A O no hydrogen 3.030 N/A ILE 152.A N ARG 194.A O no hydrogen 2.741 N/A ILE 153.A N LEU 95.A O no hydrogen 2.788 N/A ASN 154.A N ASN 196.A O no hydrogen 2.828 N/A ASN 154.A ND2 THR 181.A OG1 no hydrogen 2.871 N/A MET 155.A N ASN 97.A O no hydrogen 2.874 N/A VAL 156.A N VAL 198.A O no hydrogen 2.788 N/A ALA 158.A N PRO 200.A O no hydrogen 2.882 N/A MET 159.A N ASP 157.A OD1 no hydrogen 2.762 N/A THR 160.A OG1 ASP 157.A O no hydrogen 3.199 N/A GLN 162.A N MET 159.A O no hydrogen 2.755 N/A GLN 162.A NE2 SER 260.A O no hydrogen 3.245 N/A TYR 167.A N LEU 164.A O no hydrogen 3.141 N/A ILE 169.A N THR 105.A OG1 no hydrogen 3.108 N/A TYR 170.A OH ASP 157.A OD2 no hydrogen 2.599 N/A THR 171.A N TYR 167.A O no hydrogen 2.926 N/A THR 171.A OG1 TYR 167.A O no hydrogen 3.094 N/A MET 172.A N THR 168.A O no hydrogen 2.740 N/A ALA 173.A N ILE 169.A O no hydrogen 2.842 N/A LYS 174.A N TYR 170.A O no hydrogen 3.001 N/A LYS 174.A NZ ASN 123.A OD1 no hydrogen 2.883 N/A LYS 174.A NZ MET 155.A O no hydrogen 2.747 N/A GLY 175.A N THR 171.A O no hydrogen 3.005 N/A ALA 176.A N MET 172.A O no hydrogen 2.955 N/A LEU 177.A N ALA 173.A O no hydrogen 2.879 N/A GLU 178.A N LYS 174.A O no hydrogen 2.865 N/A GLY 179.A N GLY 175.A O no hydrogen 3.121 N/A LEU 180.A N ALA 176.A O no hydrogen 2.836 N/A THR 181.A N LEU 177.A O no hydrogen 2.957 N/A THR 181.A OG1 LEU 177.A O no hydrogen 2.883 N/A ARG 182.A N GLU 178.A O no hydrogen 3.189 N/A SER 183.A N GLY 179.A O no hydrogen 2.853 N/A ALA 184.A N LEU 180.A O no hydrogen 2.819 N/A ALA 185.A N THR 181.A O no hydrogen 3.032 N/A LEU 186.A N ARG 182.A O no hydrogen 3.258 N/A GLU 187.A N SER 183.A O no hydrogen 3.102 N/A LEU 188.A N ALA 184.A O no hydrogen 2.825 N/A LEU 191.A N LEU 188.A O no hydrogen 3.028 N/A GLN 192.A N ALA 189.A O no hydrogen 2.818 N/A ILE 193.A N LEU 188.A O no hydrogen 3.208 N/A ARG 194.A N TYR 150.A O no hydrogen 3.170 N/A ARG 194.A NH1 LEU 240.A O no hydrogen 2.748 N/A ARG 194.A NH2 ASN 149.A OD1 no hydrogen 2.957 N/A ARG 194.A NH2 LEU 240.A O no hydrogen 3.202 N/A VAL 195.A N THR 249.A OG1 no hydrogen 2.954 N/A ASN 196.A N ILE 152.A O no hydrogen 2.949 N/A ASN 196.A ND2 ILE 248.A O no hydrogen 2.869 N/A GLY 197.A N THR 251.A O no hydrogen 2.784 N/A VAL 198.A N ASN 154.A O no hydrogen 2.976 N/A GLY 199.A N VAL 253.A O no hydrogen 2.875 N/A GLY 201.A N VAL 255.A O no hydrogen 3.376 N/A SER 203.A OG SER 228.A OG no hydrogen 2.653 N/A VAL 204.A N SER 228.A O no hydrogen 2.863 N/A LEU 205.A N ASP 227.A OD2 no hydrogen 2.850 N/A ASP 207.A N ASP 207.A OD1 no hydrogen 2.457 N/A MET 209.A N ASP 207.A O no hydrogen 2.745 N/A VAL 213.A N PRO 210.A O no hydrogen 2.802 N/A TRP 214.A N PRO 210.A O no hydrogen 3.055 N/A TRP 214.A NE1 LEU 205.A O no hydrogen 3.206 N/A GLU 215.A N PRO 211.A O no hydrogen 2.946 N/A GLY 216.A N ALA 212.A O no hydrogen 3.032 N/A HIS 217.A N VAL 213.A O no hydrogen 3.219 N/A ARG 218.A N TRP 214.A O no hydrogen 3.398 N/A ARG 218.A NE ASP 227.A OD1 no hydrogen 3.011 N/A ARG 218.A NH2 ASP 227.A OD1 no hydrogen 2.780 N/A SER 219.A N GLU 215.A O no hydrogen 3.065 N/A SER 219.A OG GLU 215.A O no hydrogen 3.225 N/A SER 219.A OG GLY 216.A O no hydrogen 2.879 N/A LYS 220.A N HIS 217.A O no hydrogen 3.229 N/A VAL 221.A N ARG 218.A O no hydrogen 3.305 N/A LEU 223.A N GLY 257.A O no hydrogen 2.947 N/A GLN 225.A NE2 PRO 222.A O no hydrogen 2.756 N/A ARG 226.A NH1 ASP 227.A O no hydrogen 3.282 N/A ARG 226.A NH1 GLU 232.A OE1 no hydrogen 2.848 N/A ARG 226.A NH1 GLU 232.A OE2 no hydrogen 3.218 N/A ARG 226.A NH2 GLU 232.A OE2 no hydrogen 2.954 N/A SER 228.A N LEU 202.A O no hydrogen 2.716 N/A SER 228.A OG SER 203.A OG no hydrogen 2.653 N/A SER 228.A OG SER 229.A O no hydrogen 2.995 N/A SER 229.A N GLU 232.A OE1 no hydrogen 2.784 N/A GLU 232.A N SER 229.A OG no hydrogen 3.188 N/A VAL 233.A N ALA 230.A O no hydrogen 3.093 N/A SER 234.A N ALA 230.A O no hydrogen 2.881 N/A SER 234.A OG SER 17.A O no hydrogen 3.392 N/A SER 234.A OG SER 17.A OG no hydrogen 2.699 N/A SER 234.A OG ALA 230.A O no hydrogen 3.405 N/A ASP 235.A N ALA 231.A O no hydrogen 2.859 N/A VAL 236.A N VAL 233.A O no hydrogen 3.055 N/A VAL 237.A N VAL 233.A O no hydrogen 3.376 N/A ILE 238.A N SER 234.A O no hydrogen 2.864 N/A PHE 239.A N ASP 235.A O no hydrogen 2.967 N/A LEU 240.A N VAL 236.A O no hydrogen 3.017 N/A CYS 241.A N VAL 237.A O no hydrogen 3.106 N/A CYS 241.A N ILE 238.A O no hydrogen 3.201 N/A CYS 241.A SG SER 151.A OG no hydrogen 3.619 N/A CYS 241.A SG VAL 237.A O no hydrogen 3.421 N/A SER 242.A N PHE 239.A O no hydrogen 2.871 N/A SER 242.A OG PHE 239.A O no hydrogen 2.714 N/A ALA 245.A N SER 242.A O no hydrogen 3.058 N/A LYS 246.A N SER 243.A O no hydrogen 3.210 N/A ILE 248.A N ALA 245.A O no hydrogen 3.082 N/A GLY 250.A N VAL 195.A O no hydrogen 2.741 N/A THR 251.A N ASN 196.A OD1 no hydrogen 2.849 N/A THR 251.A OG1 ASN 196.A OD1 no hydrogen 3.358 N/A VAL 253.A N GLY 197.A O no hydrogen 2.845 N/A VAL 255.A N GLY 199.A O no hydrogen 2.807 N/A GLY 258.A N ASP 256.A OD1 no hydrogen 2.957 N/A TYR 259.A N ASP 256.A O no hydrogen 2.947 N/A SER 260.A N ASP 256.A OD2 no hydrogen 2.897 N/A SER 260.A OG ASP 256.A OD2 no hydrogen 2.758 N/A LEU 261.A N GLY 258.A O no hydrogen 3.040 N/A THR 262.A N TYR 259.A O no hydrogen 3.064 N/A THR 262.A OG1 TYR 259.A O no hydrogen 2.665 N/A