Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6mkk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N LYS 240.A O no hydrogen 3.354 N/A TYR 9.A OH ASP 11.A OD1 no hydrogen 2.601 N/A GLN 15.A N ASP 261.A OD2 no hydrogen 2.823 N/A GLN 15.A NE2 THR 17.A O no hydrogen 2.959 N/A SER 18.A N LYS 22.A O no hydrogen 2.888 N/A SER 18.A OG SER 20.A OG no hydrogen 2.973 N/A SER 20.A N SER 18.A OG no hydrogen 3.160 N/A SER 20.A OG SER 18.A OG no hydrogen 2.973 N/A GLY 21.A N SER 18.A O no hydrogen 2.878 N/A LYS 22.A N SER 18.A OG no hydrogen 3.233 N/A LYS 22.A NZ LEU 282.A O no hydrogen 3.022 N/A ALA 24.A N LYS 16.A O no hydrogen 2.792 N/A THR 25.A N LEU 280.A O no hydrogen 2.821 N/A THR 25.A OG1 LEU 280.A O no hydrogen 3.559 N/A THR 25.A OG1 LEU 282.A OXT no hydrogen 2.731 N/A LEU 26.A N LEU 280.A O no hydrogen 3.018 N/A LYS 27.A N ASP 54.A OD2 no hydrogen 2.875 N/A LYS 27.A NZ GLU 51.A O no hydrogen 2.826 N/A LYS 27.A NZ TYR 279.A OH no hydrogen 3.147 N/A ILE 28.A N LEU 278.A O no hydrogen 2.932 N/A CYS 29.A N ILE 55.A O no hydrogen 2.894 N/A CYS 29.A SG ILE 276.A O no hydrogen 3.649 N/A CYS 29.A SG THR 277.A OG1 no hydrogen 3.683 N/A SER 30.A N ILE 276.A O no hydrogen 2.852 N/A TRP 31.A N CYS 57.A O no hydrogen 2.881 N/A TRP 31.A NE1 HIS 273.A O no hydrogen 2.917 N/A VAL 33.A N GLN 59.A O no hydrogen 2.947 N/A GLY 35.A N GLU 60.A O no hydrogen 2.881 N/A LEU 36.A N THR 61.A O no hydrogen 2.805 N/A ARG 37.A NH1 LYS 67.A O no hydrogen 2.723 N/A ARG 37.A NH2 LYS 67.A O no hydrogen 2.791 N/A TRP 39.A N GLY 35.A O no hydrogen 2.882 N/A ILE 40.A N LEU 36.A O no hydrogen 2.951 N/A LYS 41.A N ARG 37.A O no hydrogen 3.041 N/A LYS 42.A N ALA 38.A O no hydrogen 3.054 N/A LYS 43.A N ILE 40.A O no hydrogen 2.927 N/A GLY 44.A N TRP 39.A O no hydrogen 2.974 N/A TRP 47.A N LYS 43.A O no hydrogen 3.295 N/A VAL 48.A N GLY 44.A O no hydrogen 3.016 N/A LYS 49.A N LEU 45.A O no hydrogen 2.905 N/A LYS 49.A NZ GLU 74.A O no hydrogen 2.629 N/A GLU 50.A N ASP 46.A O no hydrogen 3.226 N/A GLU 51.A N TRP 47.A O no hydrogen 2.929 N/A ALA 52.A N VAL 48.A O no hydrogen 2.841 N/A ASP 54.A N LYS 27.A O no hydrogen 2.812 N/A ILE 55.A N LYS 27.A O no hydrogen 3.281 N/A LEU 56.A N LEU 98.A O no hydrogen 2.798 N/A CYS 57.A N CYS 29.A O no hydrogen 2.779 N/A LEU 58.A N GLY 96.A O no hydrogen 2.848 N/A GLN 59.A N TRP 31.A O no hydrogen 2.947 N/A GLN 59.A NE2 SER 30.A OG no hydrogen 2.965 N/A GLN 59.A NE2 THR 133.A OG1 no hydrogen 2.987 N/A THR 61.A N GLY 94.A O no hydrogen 3.060 N/A LYS 62.A N SER 93.A O no hydrogen 2.768 N/A LYS 62.A NZ ASP 34.A OD1 no hydrogen 3.110 N/A CYS 63.A SG SER 64.A O no hydrogen 3.543 N/A CYS 63.A SG LYS 67.A O no hydrogen 3.187 N/A ASN 66.A N SER 64.A OG no hydrogen 3.082 N/A LYS 67.A N SER 64.A O no hydrogen 2.978 N/A GLU 71.A N GLU 71.A OE1 no hydrogen 2.746 N/A LEU 72.A N PRO 69.A O no hydrogen 3.277 N/A GLN 73.A N ALA 70.A O no hydrogen 2.958 N/A GLU 74.A N GLU 71.A O no hydrogen 3.012 N/A LEU 78.A N LEU 75.A O no hydrogen 3.026 N/A HIS 80.A N SER 99.A O no hydrogen 3.172 N/A GLN 81.A NE2 LEU 72.A O no hydrogen 3.000 N/A GLN 81.A NE2 LEU 78.A O no hydrogen 3.040 N/A TYR 82.A N LEU 97.A O no hydrogen 2.823 N/A SER 84.A N VAL 95.A O no hydrogen 2.941 N/A ALA 85.A N GLU 65.A OE2 no hydrogen 2.901 N/A SER 87.A N GLN 117.A O no hydrogen 2.965 N/A SER 87.A OG GLN 117.A O no hydrogen 3.446 N/A LYS 89.A N PRO 86.A O no hydrogen 2.929 N/A GLU 90.A N ASP 88.A OD1 no hydrogen 2.781 N/A TYR 92.A OH ASP 88.A OD2 no hydrogen 2.644 N/A SER 93.A OG GLU 118.A O no hydrogen 2.659 N/A SER 93.A OG GLY 119.A O no hydrogen 3.477 N/A VAL 95.A N SER 84.A O no hydrogen 2.901 N/A GLY 96.A N LEU 58.A O no hydrogen 2.878 N/A LEU 97.A N TYR 82.A O no hydrogen 2.823 N/A LEU 98.A N LEU 56.A O no hydrogen 2.823 N/A SER 99.A N HIS 80.A O no hydrogen 2.742 N/A SER 99.A OG.A GLN 101.A O no hydrogen 2.663 N/A SER 99.A OG.B HIS 80.A O no hydrogen 3.396 N/A SER 99.A OG.B GLN 101.A O no hydrogen 2.793 N/A ARG 100.A N ASP 54.A O no hydrogen 2.936 N/A ARG 100.A NE ASP 54.A OD1 no hydrogen 3.161 N/A SER 107.A N VAL 123.A O no hydrogen 2.896 N/A GLY 109.A N VAL 121.A O no hydrogen 2.975 N/A ILE 110.A N ASP 116.A OD1 no hydrogen 2.779 N/A ASP 112.A N ASP 116.A OD2 no hydrogen 3.013 N/A GLU 114.A N ASP 112.A OD1 no hydrogen 3.426 N/A HIS 115.A N ASP 112.A O no hydrogen 2.836 N/A HIS 115.A ND1 TYR 148.A OH no hydrogen 2.927 N/A ASP 116.A N GLU 113.A O no hydrogen 3.289 N/A GLN 117.A NE2 SER 87.A OG no hydrogen 2.773 N/A ARG 120.A NE GLU 118.A OE1 no hydrogen 2.991 N/A ARG 120.A NH1 TYR 135.A O no hydrogen 2.933 N/A ARG 120.A NH2 GLU 118.A OE1 no hydrogen 3.018 N/A ILE 122.A N THR 133.A O no hydrogen 3.102 N/A VAL 123.A N SER 107.A O no hydrogen 2.871 N/A ALA 124.A N LEU 131.A O no hydrogen 2.710 N/A GLU 125.A N LYS 105.A O no hydrogen 2.848 N/A PHE 126.A N PHE 129.A O no hydrogen 2.873 N/A VAL 130.A N PRO 168.A O no hydrogen 2.841 N/A LEU 131.A N ALA 124.A O no hydrogen 2.850 N/A VAL 132.A N VAL 170.A O no hydrogen 2.836 N/A THR 133.A N ILE 122.A O no hydrogen 2.944 N/A THR 133.A OG1 CYS 172.A O no hydrogen 3.179 N/A ALA 134.A N CYS 172.A O no hydrogen 2.948 N/A TYR 135.A N ARG 120.A O no hydrogen 2.873 N/A TYR 135.A OH GLU 60.A OE1 no hydrogen 2.584 N/A VAL 136.A N ASP 174.A O no hydrogen 2.993 N/A ASN 138.A ND2 ASN 176.A OD1 no hydrogen 3.390 N/A GLY 140.A N ASN 138.A OD1 no hydrogen 2.780 N/A LEU 143.A N GLY 140.A O no hydrogen 3.020 N/A VAL 144.A N ARG 141.A O no hydrogen 3.402 N/A ARG 145.A N ALA 139.A O no hydrogen 2.889 N/A ARG 145.A NH2 GLU 118.A OE1 no hydrogen 3.127 N/A LEU 146.A N LEU 143.A O no hydrogen 3.019 N/A TYR 148.A OH HIS 115.A ND1 no hydrogen 2.927 N/A ARG 149.A N ARG 145.A O no hydrogen 2.850 N/A ARG 149.A NE ASP 153.A OD1 no hydrogen 2.939 N/A ARG 149.A NE ASP 153.A OD2 no hydrogen 3.487 N/A ARG 149.A NH1 PRO 137.A O.A no hydrogen 2.904 N/A ARG 149.A NH1 PRO 137.A O.B no hydrogen 2.843 N/A ARG 149.A NH1 ASN 176.A O no hydrogen 3.202 N/A ARG 149.A NH2 ASN 176.A O no hydrogen 3.057 N/A GLN 150.A N LEU 146.A O no hydrogen 2.992 N/A ARG 151.A N GLU 147.A O no hydrogen 3.223 N/A ARG 151.A NE GLU 114.A OE2 no hydrogen 3.162 N/A ARG 151.A NH2 GLU 114.A OE1 no hydrogen 3.552 N/A TRP 152.A N TYR 148.A O no hydrogen 2.819 N/A ASP 153.A N ARG 149.A O no hydrogen 2.802 N/A GLU 154.A N GLN 150.A O no hydrogen 3.180 N/A ALA 155.A N ARG 151.A O no hydrogen 3.051 N/A PHE 156.A N TRP 152.A O no hydrogen 2.784 N/A ARG 157.A N ASP 153.A O no hydrogen 2.918 N/A LYS 158.A N GLU 154.A O no hydrogen 3.046 N/A LYS 158.A NZ GLU 154.A OE2 no hydrogen 2.698 N/A PHE 159.A N ALA 155.A O no hydrogen 2.959 N/A LEU 160.A N PHE 156.A O no hydrogen 2.927 N/A LYS 161.A N ARG 157.A O no hydrogen 2.952 N/A LYS 161.A NZ ALA 210.A O no hydrogen 3.521 N/A GLY 162.A N LYS 158.A O no hydrogen 3.202 N/A LEU 163.A N PHE 159.A O no hydrogen 3.112 N/A ALA 164.A N LEU 160.A O no hydrogen 2.921 N/A SER 165.A N LYS 161.A O no hydrogen 3.084 N/A SER 165.A N GLY 162.A O no hydrogen 3.176 N/A SER 165.A OG GLY 162.A O no hydrogen 2.632 N/A ARG 166.A N LEU 163.A O no hydrogen 3.000 N/A ARG 166.A NE GLY 162.A O no hydrogen 3.263 N/A LYS 167.A N LEU 163.A O no hydrogen 3.258 N/A LYS 167.A NZ GLU 125.A OE2 no hydrogen 2.935 N/A LYS 167.A NZ PHE 126.A O no hydrogen 2.750 N/A LYS 167.A NZ ASP 127.A O no hydrogen 3.042 N/A LEU 169.A N SER 252.A OG no hydrogen 2.903 N/A VAL 170.A N VAL 130.A O no hydrogen 2.876 N/A LEU 171.A N LEU 250.A O no hydrogen 2.827 N/A CYS 172.A N VAL 132.A O no hydrogen 2.826 N/A CYS 172.A SG VAL 132.A O no hydrogen 4.009 N/A CYS 172.A SG THR 133.A OG1 no hydrogen 3.583 N/A GLY 173.A N TYR 248.A O no hydrogen 3.208 N/A ASP 174.A N ALA 134.A O no hydrogen 3.161 N/A LEU 175.A N LEU 246.A O no hydrogen 2.874 N/A ASN 176.A N ASP 174.A OD1 no hydrogen 2.982 N/A ASN 176.A ND2 VAL 136.A O no hydrogen 2.772 N/A ALA 178.A N GLY 195.A O no hydrogen 2.867 N/A HIS 179.A N TYR 248.A OH no hydrogen 3.142 N/A GLU 180.A N ASP 183.A OD2 no hydrogen 2.899 N/A ASP 183.A N GLU 180.A O no hydrogen 2.771 N/A LEU 184.A N GLU 181.A O no hydrogen 3.301 N/A ARG 185.A N GLY 243.A O no hydrogen 2.947 N/A ARG 185.A NH1 GLY 5.A O no hydrogen 2.981 N/A ARG 185.A NH1 LYS 240.A O no hydrogen 3.022 N/A ARG 185.A NH1 ASN 241.A O no hydrogen 3.217 N/A ARG 185.A NH2 GLY 5.A O no hydrogen 2.798 N/A GLY 189.A N ASN 186.A OD1 no hydrogen 2.928 N/A ASN 190.A N PRO 187.A O no hydrogen 3.165 N/A ASN 190.A ND2 ASN 186.A O no hydrogen 2.842 N/A ASN 193.A N ASN 190.A O no hydrogen 2.875 N/A GLY 195.A N GLU 200.A OE1 no hydrogen 2.869 N/A GLY 195.A N GLU 200.A OE2 no hydrogen 3.144 N/A PHE 196.A N ASN 193.A O no hydrogen 3.033 N/A THR 197.A N GLU 200.A OE1 no hydrogen 3.358 N/A THR 197.A OG1 GLU 200.A OE1 no hydrogen 2.713 N/A GLN 199.A N GLN 199.A OE1 no hydrogen 2.819 N/A GLU 200.A N THR 197.A OG1 no hydrogen 3.039 N/A ARG 201.A N THR 197.A O no hydrogen 3.007 N/A ARG 201.A NE HIS 179.A O no hydrogen 2.883 N/A ARG 201.A NH2 GLU 180.A OE1 no hydrogen 2.866 N/A GLN 202.A N PRO 198.A O no hydrogen 2.934 N/A GLY 203.A N GLN 199.A O no hydrogen 2.975 N/A PHE 204.A N GLU 200.A O no hydrogen 3.016 N/A GLY 205.A N ARG 201.A O no hydrogen 2.986 N/A GLU 206.A N GLN 202.A O no hydrogen 2.724 N/A LEU 207.A N GLY 203.A O no hydrogen 2.931 N/A LEU 208.A N PHE 204.A O no hydrogen 3.023 N/A GLN 209.A N GLY 205.A O no hydrogen 2.981 N/A ALA 210.A N GLU 206.A O no hydrogen 2.872 N/A VAL 211.A N LEU 207.A O no hydrogen 3.374 N/A LEU 213.A N LEU 208.A O no hydrogen 2.908 N/A ALA 214.A N LEU 251.A O no hydrogen 2.780 N/A SER 216.A N PHE 249.A O no hydrogen 2.929 N/A SER 216.A OG PHE 249.A O no hydrogen 2.751 N/A SER 216.A OG SER 262.A OG no hydrogen 2.809 N/A ARG 218.A N ASP 215.A OD1 no hydrogen 3.372 N/A ARG 218.A NH1 TYR 221.A O no hydrogen 2.914 N/A ARG 218.A NH1 THR 224.A O no hydrogen 2.821 N/A ARG 218.A NH2 ASP 183.A OD1 no hydrogen 2.818 N/A HIS 219.A N ASP 215.A O no hydrogen 2.810 N/A LEU 220.A N SER 216.A O no hydrogen 3.191 N/A TYR 221.A N PHE 217.A O no hydrogen 2.843 N/A TYR 221.A OH ASP 261.A OD1 no hydrogen 2.629 N/A THR 224.A N TYR 221.A O no hydrogen 3.356 N/A THR 229.A N TRP 244.A O no hydrogen 2.845 N/A THR 229.A OG1 ASP 247.A OD1 no hydrogen 2.610 N/A PHE 230.A N TRP 244.A O no hydrogen 2.980 N/A TRP 231.A N ASP 272.A O no hydrogen 3.002 N/A TRP 231.A NE1 ASN 241.A OD1 no hydrogen 2.925 N/A THR 232.A OG1.A MET 234.A O no hydrogen 3.226 N/A THR 232.A OG1.B MET 234.A O no hydrogen 3.286 N/A MET 234.A N THR 232.A OG1.C no hydrogen 3.139 N/A ALA 237.A N MET 234.A O no hydrogen 3.147 N/A ARG 238.A NH2 SER 266.A O no hydrogen 2.788 N/A ARG 238.A NH2 ALA 268.A O no hydrogen 2.951 N/A SER 239.A OG ASN 236.A O no hydrogen 2.829 N/A SER 239.A OG ASN 236.A OD1.B no hydrogen 2.452 N/A LYS 240.A N ASN 236.A O no hydrogen 3.352 N/A LYS 240.A N ALA 237.A O no hydrogen 3.162 N/A LYS 240.A NZ MET 1.A O no hydrogen 2.834 N/A ASN 241.A N ARG 238.A O no hydrogen 3.036 N/A ASN 241.A ND2 ALA 7.A O no hydrogen 2.840 N/A ASN 241.A ND2 TYR 226.A O no hydrogen 3.058 N/A VAL 242.A N ALA 237.A O no hydrogen 3.016 N/A TRP 244.A N PHE 230.A O no hydrogen 2.903 N/A ARG 245.A N ASP 183.A O no hydrogen 2.704 N/A ARG 245.A NE ASP 183.A OD1 no hydrogen 2.856 N/A ARG 245.A NH1 ASP 215.A OD1 no hydrogen 3.089 N/A ARG 245.A NH1 ASP 215.A OD2 no hydrogen 3.483 N/A ARG 245.A NH2 ASP 183.A OD1 no hydrogen 2.847 N/A ARG 245.A NH2 ASP 215.A OD2 no hydrogen 2.864 N/A LEU 246.A N THR 229.A OG1 no hydrogen 3.031 N/A ASP 247.A N THR 229.A OG1 no hydrogen 3.099 N/A TYR 248.A N GLY 173.A O no hydrogen 3.052 N/A TYR 248.A OH VAL 177.A O no hydrogen 2.668 N/A LEU 250.A N LEU 171.A O no hydrogen 2.786 N/A LEU 251.A N ALA 214.A O no hydrogen 2.872 N/A SER 252.A N LEU 169.A O no hydrogen 2.958 N/A LEU 255.A N SER 252.A O no hydrogen 2.919 N/A LEU 256.A N HIS 253.A O no hydrogen 3.053 N/A ALA 258.A N LEU 255.A O no hydrogen 2.834 N/A LEU 259.A N LEU 256.A O no hydrogen 3.020 N/A CYS 260.A N TYR 279.A O no hydrogen 2.961 N/A CYS 260.A SG ALA 258.A O no hydrogen 3.776 N/A ASP 261.A N TYR 279.A O no hydrogen 3.444 N/A SER 262.A N ASP 261.A OD1 no hydrogen 2.839 N/A SER 262.A OG SER 216.A OG no hydrogen 2.809 N/A LYS 263.A N THR 277.A O no hydrogen 2.687 N/A LYS 263.A NZ PRO 12.A O no hydrogen 2.883 N/A LYS 263.A NZ PRO 13.A O no hydrogen 3.332 N/A LYS 263.A NZ ASP 261.A OD1 no hydrogen 3.536 N/A LYS 263.A NZ ASP 261.A OD2 no hydrogen 2.844 N/A ILE 264.A N ASP 11.A OD2 no hydrogen 2.946 N/A ARG 265.A N PRO 275.A O no hydrogen 2.916 N/A ARG 265.A NE GLU 51.A OE2 no hydrogen 2.906 N/A ARG 265.A NH1 ASP 14.A OD1 no hydrogen 2.837 N/A ARG 265.A NH1 ASP 14.A OD2 no hydrogen 3.520 N/A ARG 265.A NH2 ASP 14.A OD2 no hydrogen 2.981 N/A ARG 265.A NH2 GLU 51.A OE2 no hydrogen 2.913 N/A SER 266.A N ILE 264.A O no hydrogen 2.966 N/A SER 266.A OG ILE 264.A O no hydrogen 3.433 N/A ALA 268.A N ARG 265.A O no hydrogen 3.115 N/A SER 271.A OG ASN 32.A O no hydrogen 2.715 N/A SER 271.A OG ASP 272.A OD1 no hydrogen 3.534 N/A HIS 273.A N SER 271.A OG no hydrogen 3.142 N/A HIS 273.A ND1 ASP 247.A OD1 no hydrogen 2.691 N/A CYS 274.A N THR 229.A O no hydrogen 2.877 N/A CYS 274.A SG TYR 228.A O no hydrogen 3.968 N/A CYS 274.A SG PRO 275.A O no hydrogen 3.619 N/A ILE 276.A N SER 30.A O no hydrogen 2.924 N/A THR 277.A N LYS 263.A O no hydrogen 3.047 N/A THR 277.A OG1 GLU 51.A OE2 no hydrogen 2.770 N/A LEU 278.A N ILE 28.A O no hydrogen 2.786 N/A TYR 279.A N ASP 261.A O no hydrogen 2.929 N/A TYR 279.A OH ASP 14.A OD2 no hydrogen 2.698 N/A LEU 280.A N LEU 26.A O no hydrogen 2.910 N/A ALA 281.A N ALA 258.A O no hydrogen 2.727 N/A LEU 282.A N THR 25.A OG1 no hydrogen 2.912 N/A