Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6rx5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 87.A OD2 no hydrogen 2.872 N/A ALA 5.A N ARG 28.A O no hydrogen 2.768 N/A VAL 6.A N VAL 88.A O no hydrogen 2.865 N/A VAL 7.A N VAL 30.A O no hydrogen 3.056 N/A THR 8.A N VAL 90.A O no hydrogen 3.026 N/A THR 8.A OG1 VAL 90.A O no hydrogen 3.422 N/A GLY 9.A N HIS 32.A ND1 no hydrogen 2.899 N/A ALA 10.A N HIS 32.A O no hydrogen 2.860 N/A LYS 12.A NZ SER 36.A OG no hydrogen 3.379 N/A ARG 13.A NH1 LEU 199.A O no hydrogen 2.876 N/A ARG 13.A NH2 LEU 198.A O no hydrogen 2.921 N/A ARG 16.A N LYS 12.A O no hydrogen 3.042 N/A ARG 16.A NH2 GLU 46.A OE1 no hydrogen 3.166 N/A ALA 17.A N ARG 13.A O no hydrogen 3.158 N/A ILE 18.A N ILE 14.A O no hydrogen 2.925 N/A ALA 19.A N GLY 15.A O no hydrogen 2.941 N/A VAL 20.A N ARG 16.A O no hydrogen 2.806 N/A LYS 21.A N ALA 17.A O no hydrogen 2.913 N/A LYS 21.A NZ GLU 225.A OE2.A no hydrogen 2.738 N/A LYS 21.A NZ ASP 229.A OD1 no hydrogen 3.143 N/A LEU 22.A N ILE 18.A O no hydrogen 2.842 N/A HIS 23.A N ALA 19.A O no hydrogen 2.914 N/A HIS 23.A NE2 THR 54.A OG1 no hydrogen 2.699 N/A GLN 24.A N VAL 20.A O no hydrogen 2.831 N/A THR 25.A N LYS 21.A O no hydrogen 2.997 N/A THR 25.A N LEU 22.A O no hydrogen 3.079 N/A THR 25.A OG1 LYS 21.A O no hydrogen 2.734 N/A GLY 26.A N HIS 23.A O no hydrogen 2.963 N/A TYR 27.A N LEU 22.A O no hydrogen 2.988 N/A ARG 28.A N PRO 3.A O no hydrogen 2.904 N/A ARG 28.A NE ALA 2.A O no hydrogen 3.245 N/A ARG 28.A NH2 ALA 2.A O no hydrogen 2.783 N/A VAL 29.A N.A THR 54.A O no hydrogen 2.943 N/A VAL 29.A N.B THR 54.A O no hydrogen 2.928 N/A VAL 30.A N ALA 5.A O no hydrogen 2.838 N/A ILE 31.A N VAL 56.A O no hydrogen 2.769 N/A HIS 32.A N VAL 7.A O no hydrogen 3.113 N/A HIS 32.A NE2 ALA 60.A O no hydrogen 2.769 N/A TYR 33.A N CYS 58.A O no hydrogen 3.005 N/A ALA 37.A N ASN 35.A O no hydrogen 3.003 N/A ALA 40.A N SER 36.A O no hydrogen 2.926 N/A VAL 41.A N ALA 37.A O no hydrogen 2.978 N/A SER 42.A N GLU 38.A O no hydrogen 2.924 N/A LEU 43.A N ALA 39.A O no hydrogen 3.022 N/A ALA 44.A N ALA 40.A O no hydrogen 2.915 N/A ASP 45.A N VAL 41.A O no hydrogen 2.879 N/A GLU 46.A N SER 42.A O no hydrogen 3.094 N/A LEU 47.A N LEU 43.A O no hydrogen 2.925 N/A ASN 48.A N ALA 44.A O no hydrogen 2.891 N/A ASN 48.A ND2 ALA 55.A O no hydrogen 2.914 N/A LYS 49.A N ASP 45.A O no hydrogen 2.988 N/A GLU 50.A N GLU 46.A O no hydrogen 3.229 N/A ARG 51.A N LEU 47.A O no hydrogen 3.030 N/A ARG 51.A NH1 HIS 23.A O no hydrogen 3.008 N/A ARG 51.A NH2 HIS 23.A O no hydrogen 3.061 N/A THR 54.A N ASN 48.A OD1 no hydrogen 2.806 N/A THR 54.A OG1 HIS 23.A NE2 no hydrogen 2.699 N/A THR 54.A OG1 ARG 51.A O no hydrogen 2.672 N/A ALA 55.A N ASN 48.A OD1 no hydrogen 2.926 N/A VAL 56.A N VAL 29.A O.A no hydrogen 3.043 N/A VAL 56.A N VAL 29.A O.B no hydrogen 3.037 N/A CYS 58.A N ILE 31.A O no hydrogen 2.949 N/A CYS 58.A SG SER 78.A OG.A no hydrogen 3.589 N/A CYS 58.A SG SER 78.A OG.B no hydrogen 3.600 N/A GLN 59.A NE2 HIS 34.A O no hydrogen 3.029 N/A ALA 60.A N TYR 33.A O no hydrogen 2.898 N/A THR 63.A N ASP 61.A OD1 no hydrogen 3.041 N/A THR 63.A OG1 ASP 61.A OD1 no hydrogen 2.629 N/A ASN 64.A N ALA 111.A O no hydrogen 2.898 N/A VAL 67.A N.A SER 65.A OG no hydrogen 3.065 N/A VAL 67.A N.B SER 65.A OG no hydrogen 3.053 N/A LEU 68.A N SER 65.A O no hydrogen 3.099 N/A SER 71.A N VAL 67.A O.A no hydrogen 3.039 N/A SER 71.A N VAL 67.A O.B no hydrogen 3.068 N/A SER 71.A OG VAL 67.A O.B no hydrogen 3.153 N/A CYS 72.A N LEU 68.A O no hydrogen 2.921 N/A CYS 72.A SG LEU 68.A O no hydrogen 3.461 N/A CYS 72.A SG ALA 120.A O no hydrogen 3.889 N/A GLU 73.A N PRO 69.A O no hydrogen 2.935 N/A GLU 74.A N ALA 70.A O no hydrogen 2.871 N/A ILE 75.A N SER 71.A O no hydrogen 2.965 N/A ILE 76.A N CYS 72.A O no hydrogen 3.238 N/A ASN 77.A N GLU 73.A O no hydrogen 2.851 N/A SER 78.A N.A GLU 74.A O no hydrogen 2.848 N/A SER 78.A N.B GLU 74.A O no hydrogen 2.836 N/A SER 78.A OG.A GLU 74.A O no hydrogen 2.871 N/A SER 78.A OG.A GLU 74.A OE2 no hydrogen 3.084 N/A SER 78.A OG.B ILE 75.A O no hydrogen 2.573 N/A CYS 79.A N ILE 75.A O no hydrogen 3.409 N/A CYS 79.A N ILE 76.A O no hydrogen 3.015 N/A CYS 79.A SG ARG 85.A O no hydrogen 3.359 N/A PHE 80.A N ILE 76.A O no hydrogen 3.273 N/A ARG 81.A N ASN 77.A O no hydrogen 2.798 N/A ARG 81.A NH1 GLU 74.A OE2 no hydrogen 3.116 N/A ARG 81.A NH1 SER 78.A OG.A no hydrogen 3.179 N/A ARG 81.A NH2 GLU 74.A OE1 no hydrogen 3.128 N/A ARG 81.A NH2 GLU 74.A OE2 no hydrogen 3.004 N/A ALA 82.A N SER 78.A O.A no hydrogen 3.060 N/A ALA 82.A N SER 78.A O.B no hydrogen 3.222 N/A PHE 83.A N CYS 79.A O no hydrogen 2.855 N/A GLY 84.A N PHE 80.A O no hydrogen 2.818 N/A ARG 85.A NE ASP 87.A OD2 no hydrogen 2.792 N/A ARG 85.A NH1 GLU 1.A OE2 no hydrogen 3.034 N/A ARG 85.A NH2 ASP 87.A OD1 no hydrogen 2.910 N/A ARG 85.A NH2 ASP 87.A OD2 no hydrogen 3.470 N/A CYS 86.A SG VAL 88.A O no hydrogen 4.007 N/A ASP 87.A N ALA 4.A O no hydrogen 2.814 N/A VAL 88.A N ALA 4.A O no hydrogen 3.205 N/A LEU 89.A N SER 145.A O no hydrogen 3.129 N/A VAL 90.A N VAL 6.A O no hydrogen 2.802 N/A ASN 91.A N VAL 147.A O no hydrogen 2.896 N/A ASN 91.A ND2 ASN 148.A OD1 no hydrogen 2.810 N/A ASN 92.A N THR 8.A OG1 no hydrogen 2.945 N/A ASN 92.A ND2 THR 8.A O no hydrogen 3.134 N/A ALA 93.A N THR 8.A OG1 no hydrogen 2.969 N/A SER 94.A OG ALA 95.A O no hydrogen 3.281 N/A SER 94.A OG ASN 117.A OD1 no hydrogen 2.649 N/A ALA 95.A N THR 116.A OG1 no hydrogen 2.905 N/A TYR 97.A OH GLU 112.A OE1 no hydrogen 2.715 N/A THR 99.A N ALA 160.A O no hydrogen 2.706 N/A THR 99.A OG1 THR 99.A O no hydrogen 2.674 N/A LYS 104.A NZ GLU 112.A OE1 no hydrogen 2.755 N/A THR 105.A OG1 THR 108.A OG1 no hydrogen 3.016 N/A THR 108.A N THR 105.A OG1 no hydrogen 2.987 N/A THR 108.A OG1 THR 105.A OG1 no hydrogen 3.016 N/A GLN 109.A N THR 105.A O no hydrogen 3.023 N/A VAL 110.A N VAL 106.A O.A no hydrogen 2.813 N/A VAL 110.A N VAL 106.A O.B no hydrogen 2.903 N/A ALA 111.A N GLU 107.A O no hydrogen 2.929 N/A GLU 112.A N THR 108.A O no hydrogen 2.837 N/A LEU 113.A N GLN 109.A O no hydrogen 2.825 N/A ILE 114.A N VAL 110.A O no hydrogen 2.864 N/A GLY 115.A N ALA 111.A O no hydrogen 2.940 N/A THR 116.A N GLU 112.A O no hydrogen 2.979 N/A THR 116.A OG1 GLU 112.A O no hydrogen 2.771 N/A ASN 117.A N LEU 113.A O no hydrogen 3.270 N/A ASN 117.A ND2 ALA 95.A O no hydrogen 3.027 N/A ASN 117.A ND2 LEU 113.A O no hydrogen 2.936 N/A ALA 118.A N ILE 114.A O no hydrogen 2.962 N/A ILE 119.A N ILE 114.A O no hydrogen 2.941 N/A ALA 120.A N GLY 115.A O no hydrogen 2.750 N/A PHE 122.A N ALA 118.A O no hydrogen 3.023 N/A LEU 123.A N ILE 119.A O no hydrogen 2.869 N/A LEU 124.A N ALA 120.A O no hydrogen 2.743 N/A THR 125.A N PRO 121.A O no hydrogen 2.867 N/A THR 125.A OG1 PRO 121.A O no hydrogen 2.667 N/A MET 126.A N PHE 122.A O no hydrogen 2.915 N/A SER 127.A N LEU 123.A O no hydrogen 2.866 N/A SER 127.A OG LEU 123.A O no hydrogen 3.373 N/A PHE 128.A N LEU 124.A O no hydrogen 2.776 N/A ALA 129.A N THR 125.A O no hydrogen 2.964 N/A GLN 130.A N MET 126.A O no hydrogen 2.918 N/A ARG 131.A N SER 127.A O no hydrogen 3.017 N/A ARG 131.A NH1 ASN 77.A OD1 no hydrogen 2.601 N/A GLN 132.A N ALA 129.A O no hydrogen 3.203 N/A GLN 132.A NE2 CYS 86.A O no hydrogen 2.902 N/A GLN 132.A NE2 PHE 128.A O no hydrogen 3.185 N/A LYS 133.A N.A GLN 130.A O no hydrogen 3.280 N/A GLY 134.A N.A ARG 131.A O no hydrogen 3.454 N/A THR 135.A N.A GLN 132.A O no hydrogen 3.116 N/A THR 135.A OG1.A GLN 132.A O no hydrogen 2.743 N/A THR 135.A OG1.A ASN 136.A O.A no hydrogen 3.425 N/A ASN 138.A ND2.A SER 141.A OG.A no hydrogen 2.483 N/A THR 140.A N.A ASN 138.A OD1.A no hydrogen 3.295 N/A SER 141.A N.A ASN 138.A O.A no hydrogen 3.297 N/A SER 141.A N.A ASN 138.A OD1.A no hydrogen 2.735 N/A SER 142.A N ASN 138.A O.A no hydrogen 3.123 N/A ASN 143.A ND2 VAL 235.A O no hydrogen 2.747 N/A SER 145.A N ASP 87.A O no hydrogen 3.038 N/A ILE 146.A N ARG 188.A O no hydrogen 2.872 N/A VAL 147.A N LEU 89.A O no hydrogen 2.901 N/A ASN 148.A N ASN 190.A O no hydrogen 2.856 N/A ASN 148.A ND2 THR 175.A OG1 no hydrogen 2.943 N/A LEU 149.A N ASN 91.A O no hydrogen 2.953 N/A CYS 150.A N VAL 192.A O no hydrogen 2.774 N/A CYS 150.A SG ASN 148.A O no hydrogen 3.664 N/A ALA 152.A N PRO 194.A O no hydrogen 2.800 N/A MET 153.A N ASP 151.A OD1 no hydrogen 2.925 N/A VAL 154.A N ASP 151.A O no hydrogen 3.182 N/A GLN 156.A N MET 153.A O no hydrogen 2.917 N/A GLN 156.A NE2 SER 254.A O no hydrogen 3.308 N/A PHE 161.A N CYS 158.A O no hydrogen 3.258 N/A SER 162.A OG.A THR 99.A O no hydrogen 3.526 N/A LEU 163.A N THR 99.A OG1 no hydrogen 3.222 N/A TYR 164.A OH ASP 151.A OD2 no hydrogen 2.656 N/A ASN 165.A N PHE 161.A O no hydrogen 2.873 N/A ASN 165.A ND2 VAL 154.A O no hydrogen 2.920 N/A MET 166.A N SER 162.A O.A no hydrogen 2.810 N/A MET 166.A N SER 162.A O.B no hydrogen 2.819 N/A GLY 167.A N LEU 163.A O no hydrogen 2.916 N/A LYS 168.A N TYR 164.A O no hydrogen 2.938 N/A LYS 168.A NZ ASN 117.A OD1 no hydrogen 3.067 N/A LYS 168.A NZ LEU 149.A O no hydrogen 2.773 N/A HIS 169.A N ASN 165.A O no hydrogen 2.820 N/A ALA 170.A N MET 166.A O no hydrogen 2.928 N/A LEU 171.A N GLY 167.A O no hydrogen 2.940 N/A VAL 172.A N LYS 168.A O no hydrogen 3.124 N/A GLY 173.A N HIS 169.A O no hydrogen 3.085 N/A LEU 174.A N ALA 170.A O no hydrogen 2.818 N/A THR 175.A N LEU 171.A O no hydrogen 2.886 N/A THR 175.A OG1 LEU 171.A O no hydrogen 2.789 N/A GLN 176.A N VAL 172.A O no hydrogen 3.059 N/A SER 177.A N GLY 173.A O no hydrogen 2.830 N/A SER 177.A OG GLY 173.A O no hydrogen 3.143 N/A ALA 178.A N LEU 174.A O no hydrogen 2.777 N/A ALA 179.A N THR 175.A O no hydrogen 2.961 N/A LEU 180.A N.A GLN 176.A O no hydrogen 3.129 N/A LEU 180.A N.B GLN 176.A O no hydrogen 3.096 N/A GLU 181.A N SER 177.A O no hydrogen 2.999 N/A LEU 182.A N ALA 178.A O no hydrogen 2.837 N/A ALA 183.A N ALA 179.A O no hydrogen 3.096 N/A TYR 185.A N LEU 182.A O no hydrogen 2.898 N/A GLY 186.A N ALA 183.A O no hydrogen 2.931 N/A ILE 187.A N LEU 182.A O no hydrogen 3.281 N/A ARG 188.A N LEU 144.A O no hydrogen 3.117 N/A ARG 188.A NH1 LEU 234.A O no hydrogen 2.885 N/A ARG 188.A NH1 ILE 242.A O no hydrogen 3.139 N/A ARG 188.A NH2 ASN 143.A OD1 no hydrogen 3.142 N/A ARG 188.A NH2 LEU 234.A O no hydrogen 2.903 N/A VAL 189.A N THR 243.A OG1 no hydrogen 2.968 N/A ASN 190.A N ILE 146.A O no hydrogen 2.905 N/A ASN 190.A ND2 ILE 242.A O no hydrogen 2.959 N/A GLY 191.A N SER 245.A O no hydrogen 2.831 N/A VAL 192.A N ASN 148.A O no hydrogen 2.963 N/A ALA 193.A N ILE 247.A O no hydrogen 2.808 N/A GLY 195.A N VAL 249.A O no hydrogen 3.432 N/A SER 197.A OG ALA 222.A O no hydrogen 2.915 N/A MET 203.A N PRO 200.A O no hydrogen 3.039 N/A LYS 208.A N GLY 204.A O no hydrogen 2.947 N/A ASP 209.A N GLU 205.A O no hydrogen 2.840 N/A LYS 210.A N GLU 206.A O no hydrogen 3.045 N/A TRP 211.A N GLU 207.A O no hydrogen 3.309 N/A ARG 212.A N LYS 208.A O no hydrogen 2.947 N/A ARG 212.A NE GLU 221.A OE1 no hydrogen 3.452 N/A ARG 212.A NE GLU 221.A OE2 no hydrogen 2.837 N/A ARG 212.A NH1 GLU 205.A OE2 no hydrogen 2.857 N/A ARG 212.A NH1 ASP 209.A OD1 no hydrogen 2.919 N/A ARG 212.A NH2 GLU 221.A OE1 no hydrogen 2.967 N/A ARG 213.A N ASP 209.A O no hydrogen 2.917 N/A LYS 214.A N TRP 211.A O no hydrogen 3.069 N/A VAL 215.A N ARG 212.A O no hydrogen 3.115 N/A LEU 217.A N GLY 251.A O no hydrogen 2.961 N/A GLY 218.A N PRO 216.A O no hydrogen 3.096 N/A ARG 219.A N VAL 215.A O no hydrogen 3.032 N/A ARG 219.A NH1 ARG 213.A O no hydrogen 2.730 N/A GLU 221.A N GLU 221.A OE2 no hydrogen 2.713 N/A ALA 222.A N VAL 196.A O no hydrogen 2.942 N/A SER 223.A N GLN 226.A OE1 no hydrogen 2.957 N/A GLN 226.A N SER 223.A OG no hydrogen 3.096 N/A ILE 227.A N SER 223.A O no hydrogen 3.327 N/A ALA 228.A N ALA 224.A O no hydrogen 2.973 N/A ASP 229.A N GLU 225.A O no hydrogen 2.795 N/A ALA 230.A N ILE 227.A O no hydrogen 3.110 N/A VAL 231.A N ILE 227.A O no hydrogen 3.337 N/A ILE 232.A N ALA 228.A O no hydrogen 2.881 N/A PHE 233.A N ASP 229.A O no hydrogen 3.044 N/A LEU 234.A N ALA 230.A O no hydrogen 3.081 N/A VAL 235.A N VAL 231.A O no hydrogen 3.021 N/A SER 236.A N PHE 233.A O no hydrogen 3.035 N/A SER 236.A OG PHE 233.A O no hydrogen 2.725 N/A SER 238.A N SER 236.A OG no hydrogen 3.012 N/A ALA 239.A N SER 236.A O no hydrogen 3.128 N/A GLN 240.A N GLY 237.A O no hydrogen 3.393 N/A ILE 242.A N ALA 239.A O no hydrogen 2.869 N/A THR 243.A OG1 VAL 189.A O no hydrogen 3.567 N/A GLY 244.A N VAL 189.A O no hydrogen 2.750 N/A SER 245.A N ASN 190.A OD1 no hydrogen 2.951 N/A ILE 247.A N GLY 191.A O no hydrogen 2.885 N/A LYS 248.A NZ SER 254.A OG no hydrogen 3.031 N/A VAL 249.A N ALA 193.A O no hydrogen 2.903 N/A GLY 252.A N ASP 250.A OD1 no hydrogen 2.946 N/A LEU 253.A N ASP 250.A O no hydrogen 2.948 N/A SER 254.A N ASP 250.A OD2 no hydrogen 2.946 N/A SER 254.A OG ASP 250.A OD2 no hydrogen 2.722 N/A LEU 255.A N GLY 252.A O no hydrogen 2.933 N/A VAL 256.A N LEU 253.A O no hydrogen 3.124 N/A HIS 257.A ND1 ALA 258.A OXT no hydrogen 2.628 N/A