Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7xdx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 ASP 36.A OD1 no hydrogen 3.509 N/A PHE 4.A N TYR 79.A O no hydrogen 3.003 N/A ALA 5.A N GLU 8.A OE2 no hydrogen 2.750 N/A ILE 9.A N ALA 5.A O no hydrogen 3.335 N/A LYS 10.A N PHE 6.A O no hydrogen 3.236 N/A ALA 11.A N ALA 7.A O no hydrogen 3.018 N/A ALA 12.A N GLU 8.A O no hydrogen 2.968 N/A THR 13.A N ILE 9.A O no hydrogen 3.185 N/A THR 13.A OG1 ILE 9.A O no hydrogen 3.270 N/A LYS 14.A N ALA 11.A O no hydrogen 3.434 N/A ASN 15.A N LYS 10.A O no hydrogen 2.607 N/A PHE 16.A N THR 13.A OG1 no hydrogen 2.669 N/A ASP 17.A N THR 13.A O no hydrogen 3.188 N/A SER 19.A OG ASP 17.A OD2 no hydrogen 2.298 N/A ARG 20.A N ASP 17.A O no hydrogen 2.923 N/A ARG 20.A NH1 GLU 34.A OE1 no hydrogen 3.076 N/A ARG 20.A NH2 GLU 34.A OE1 no hydrogen 2.427 N/A VAL 21.A N GLU 18.A O no hydrogen 3.369 N/A LEU 22.A N VAL 30.A O no hydrogen 2.806 N/A GLY 25.A N GLY 28.A O no hydrogen 2.843 N/A GLY 28.A N GLY 25.A O no hydrogen 2.878 N/A VAL 30.A N GLY 23.A O no hydrogen 2.927 N/A TYR 31.A N ILE 44.A O no hydrogen 2.628 N/A ARG 32.A N ARG 20.A O no hydrogen 2.756 N/A GLY 33.A N VAL 42.A O no hydrogen 2.781 N/A GLU 34.A N ALA 12.A O no hydrogen 3.453 N/A ILE 35.A N THR 40.A O no hydrogen 3.027 N/A GLY 38.A N ILE 35.A O no hydrogen 3.258 N/A THR 39.A N ASP 36.A O no hydrogen 3.380 N/A THR 39.A OG1 ASP 36.A O no hydrogen 3.023 N/A THR 40.A N ILE 35.A O no hydrogen 3.397 N/A THR 40.A OG1 ASP 36.A OD2 no hydrogen 3.199 N/A VAL 42.A N GLY 33.A O no hydrogen 2.681 N/A ALA 43.A N TYR 90.A O no hydrogen 2.863 N/A ILE 44.A N TYR 31.A O no hydrogen 2.681 N/A LYS 45.A N LEU 88.A O no hydrogen 2.965 N/A ARG 46.A N LYS 29.A O no hydrogen 2.892 N/A GLY 47.A N MET 86.A O no hydrogen 2.665 N/A MET 50.A N ASN 48.A OD1 no hydrogen 3.036 N/A SER 51.A N ASN 48.A O no hydrogen 3.117 N/A GLN 53.A NE2 GLU 57.A OE1 no hydrogen 2.521 N/A GLY 54.A N SER 51.A OG no hydrogen 2.840 N/A VAL 55.A N SER 51.A O no hydrogen 3.128 N/A HIS 56.A N GLU 52.A O no hydrogen 3.058 N/A GLU 57.A N GLN 53.A O no hydrogen 3.013 N/A PHE 58.A N GLY 54.A O no hydrogen 2.843 N/A GLN 59.A N VAL 55.A O no hydrogen 3.068 N/A THR 60.A N HIS 56.A O no hydrogen 2.938 N/A THR 60.A OG1 HIS 56.A O no hydrogen 2.924 N/A GLU 61.A N GLU 57.A O no hydrogen 2.755 N/A ILE 62.A N PHE 58.A O no hydrogen 3.027 N/A GLU 63.A N GLN 59.A O no hydrogen 2.687 N/A MET 64.A N THR 60.A O no hydrogen 2.914 N/A LEU 65.A N GLU 61.A O no hydrogen 2.985 N/A SER 66.A N ILE 62.A O no hydrogen 3.243 N/A SER 66.A OG ILE 62.A O no hydrogen 2.702 N/A SER 66.A OG GLU 63.A O no hydrogen 3.546 N/A LYS 67.A N MET 64.A O no hydrogen 3.154 N/A LEU 68.A N LEU 65.A O no hydrogen 3.231 N/A ARG 69.A N TYR 128.A OH no hydrogen 3.231 N/A ARG 69.A NH1 SER 66.A O no hydrogen 3.018 N/A ARG 69.A NH2 LEU 65.A O no hydrogen 3.337 N/A ARG 69.A NH2 SER 66.A O no hydrogen 3.313 N/A ARG 69.A NH2 LEU 68.A O no hydrogen 2.829 N/A HIS 72.A N HIS 70.A ND1 no hydrogen 3.019 N/A HIS 72.A ND1 ALA 155.A O no hydrogen 2.842 N/A LEU 73.A N HIS 70.A O no hydrogen 3.251 N/A VAL 74.A N VAL 157.A O no hydrogen 2.928 N/A ILE 77.A N VAL 89.A O no hydrogen 2.612 N/A GLY 78.A N VAL 89.A O no hydrogen 3.176 N/A TYR 79.A N ARG 2.A O no hydrogen 3.134 N/A CYS 80.A N ILE 87.A O no hydrogen 2.819 N/A CYS 80.A SG PHE 4.A O no hydrogen 3.315 N/A ILE 87.A N CYS 80.A O no hydrogen 2.849 N/A LEU 88.A N LYS 45.A O no hydrogen 3.049 N/A VAL 89.A N GLY 78.A O no hydrogen 2.825 N/A TYR 90.A N ALA 43.A O no hydrogen 2.887 N/A ASP 91.A N SER 75.A O no hydrogen 3.192 N/A TYR 92.A N LYS 41.A O no hydrogen 3.222 N/A HIS 95.A N LEU 149.A O no hydrogen 2.809 N/A HIS 95.A ND1 ASP 150.A O no hydrogen 3.104 N/A GLY 96.A N MET 93.A O no hydrogen 3.112 N/A THR 97.A N GLU 100.A OE2 no hydrogen 3.075 N/A THR 97.A OG1 GLU 100.A OE2 no hydrogen 3.106 N/A MET 98.A N ILE 147.A O no hydrogen 2.752 N/A ARG 99.A N THR 144.A O no hydrogen 3.108 N/A ARG 99.A NE THR 144.A OG1 no hydrogen 2.968 N/A ARG 99.A NH2 THR 144.A OG1 no hydrogen 3.189 N/A GLU 100.A N THR 97.A OG1 no hydrogen 3.242 N/A HIS 101.A N MET 98.A O no hydrogen 3.019 N/A HIS 101.A NE2 HIS 95.A O no hydrogen 2.583 N/A LEU 102.A N ARG 99.A O no hydrogen 2.837 N/A TYR 103.A N ARG 99.A O no hydrogen 3.382 N/A TYR 103.A OH GLU 195.A OE1 no hydrogen 2.645 N/A THR 105.A OG1 GLU 100.A O no hydrogen 2.800 N/A ASN 107.A N THR 105.A OG1 no hydrogen 3.047 N/A ASN 107.A ND2 GLU 100.A O no hydrogen 2.740 N/A LYS 113.A NZ GLU 117.A OE2 no hydrogen 2.941 N/A ARG 115.A N PRO 111.A O no hydrogen 2.963 N/A ARG 115.A NE LEU 110.A O no hydrogen 2.775 N/A ARG 115.A NH1 ALA 196.A O no hydrogen 3.063 N/A ARG 115.A NH1 ASP 232.A OD2 no hydrogen 2.733 N/A ARG 115.A NH2 LEU 110.A O no hydrogen 2.786 N/A ARG 115.A NH2 ASP 232.A OD2 no hydrogen 3.099 N/A LEU 116.A N TRP 112.A O no hydrogen 2.846 N/A GLU 117.A N LYS 113.A O no hydrogen 2.814 N/A ILE 118.A N GLN 114.A O no hydrogen 2.874 N/A CYS 119.A N ARG 115.A O no hydrogen 3.033 N/A CYS 119.A N LEU 116.A O no hydrogen 2.999 N/A CYS 119.A SG ARG 115.A O no hydrogen 3.455 N/A ILE 120.A N LEU 116.A O no hydrogen 2.955 N/A GLY 121.A N GLU 117.A O no hydrogen 3.034 N/A ALA 122.A N ILE 118.A O no hydrogen 3.057 N/A ALA 123.A N CYS 119.A O no hydrogen 2.876 N/A ARG 124.A N ILE 120.A O no hydrogen 2.852 N/A ARG 124.A NH2 GLU 273.A OE2 no hydrogen 2.913 N/A GLY 125.A N GLY 121.A O no hydrogen 3.002 N/A LEU 126.A N ALA 122.A O no hydrogen 2.817 N/A HIS 127.A N ALA 123.A O no hydrogen 2.830 N/A TYR 128.A N ARG 124.A O no hydrogen 2.915 N/A LEU 129.A N GLY 125.A O no hydrogen 3.087 N/A HIS 130.A N LEU 126.A O no hydrogen 3.128 N/A HIS 130.A N HIS 127.A O no hydrogen 3.240 N/A HIS 130.A NE2 ASP 185.A OD2 no hydrogen 2.907 N/A THR 131.A N HIS 127.A O no hydrogen 2.991 N/A THR 131.A OG1 HIS 127.A O no hydrogen 2.710 N/A GLY 132.A N TYR 128.A O no hydrogen 2.650 N/A THR 136.A OG1 HIS 130.A O no hydrogen 3.333 N/A ILE 137.A N LEU 129.A O no hydrogen 2.865 N/A ILE 138.A N LYS 164.A O no hydrogen 2.762 N/A HIS 139.A N ASP 185.A OD2 no hydrogen 2.839 N/A HIS 139.A NE2 SER 158.A O no hydrogen 2.831 N/A ARG 140.A N ASP 185.A OD1 no hydrogen 3.078 N/A ARG 140.A NH1 LEU 162.A O no hydrogen 3.283 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 3.065 N/A LYS 143.A NZ SER 166.A OG no hydrogen 2.695 N/A THR 144.A OG1 TYR 169.A OH no hydrogen 3.313 N/A THR 144.A OG1 GLU 195.A OE1 no hydrogen 2.649 N/A THR 144.A OG1 GLU 195.A OE2 no hydrogen 3.539 N/A ASN 146.A N LYS 143.A O no hydrogen 2.898 N/A ASN 146.A ND2 ASP 141.A O no hydrogen 2.619 N/A ASN 146.A ND2 ASP 141.A OD2 no hydrogen 3.356 N/A LEU 148.A N LYS 156.A O no hydrogen 2.746 N/A LEU 149.A N GLY 96.A O no hydrogen 2.776 N/A ASP 150.A N VAL 154.A O no hydrogen 3.278 N/A GLU 151.A N GLU 151.A OE1 no hydrogen 2.602 N/A LYS 152.A N ASP 150.A OD1 no hydrogen 2.890 N/A TRP 153.A N ASP 150.A O no hydrogen 2.826 N/A VAL 154.A N ASP 150.A OD1 no hydrogen 2.973 N/A LYS 156.A N LEU 148.A O no hydrogen 2.773 N/A LYS 156.A NZ ARG 71.A O no hydrogen 2.633 N/A VAL 157.A N HIS 72.A O no hydrogen 2.816 N/A SER 158.A N ASN 146.A O no hydrogen 2.982 N/A SER 158.A OG ASP 159.A OD1 no hydrogen 2.961 N/A PHE 160.A N GLU 61.A OE1 no hydrogen 3.331 N/A SER 163.A N PHE 160.A O no hydrogen 3.189 N/A SER 163.A OG HIS 139.A O no hydrogen 3.500 N/A SER 163.A OG PHE 160.A O no hydrogen 3.482 N/A LYS 164.A N ILE 138.A O no hydrogen 2.986 N/A SER 166.A OG ASP 141.A OD1 no hydrogen 2.952 N/A TYR 169.A N SER 166.A O no hydrogen 3.120 N/A TYR 169.A OH GLU 195.A OE1 no hydrogen 3.146 N/A TYR 169.A OH GLU 195.A OE2 no hydrogen 2.304 N/A GLU 173.A N ASP 171.A OD1 no hydrogen 2.925 N/A TYR 174.A N ASP 171.A O no hydrogen 2.886 N/A PHE 175.A N PRO 172.A O no hydrogen 3.197 N/A ARG 176.A N GLU 173.A O no hydrogen 3.197 N/A ARG 177.A N GLU 173.A O no hydrogen 2.840 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.819 N/A LYS 183.A N THR 181.A OG1 no hydrogen 3.059 N/A LYS 183.A NZ GLY 259.A O no hydrogen 3.082 N/A LYS 183.A NZ ARG 262.A O no hydrogen 2.808 N/A SER 184.A N THR 181.A O no hydrogen 2.809 N/A SER 184.A OG ASP 171.A OD2 no hydrogen 2.868 N/A ASP 185.A N GLU 182.A O no hydrogen 2.910 N/A VAL 186.A N GLU 182.A O no hydrogen 3.236 N/A TYR 187.A N LYS 183.A O no hydrogen 3.069 N/A SER 188.A N SER 184.A O no hydrogen 3.238 N/A SER 188.A OG TYR 169.A O no hydrogen 2.711 N/A SER 188.A OG SER 184.A O no hydrogen 3.170 N/A PHE 189.A N ASP 185.A O no hydrogen 2.782 N/A GLY 190.A N VAL 186.A O no hydrogen 2.856 N/A VAL 191.A N TYR 187.A O no hydrogen 3.206 N/A VAL 192.A N SER 188.A O no hydrogen 3.017 N/A LEU 193.A N PHE 189.A O no hydrogen 2.898 N/A PHE 194.A N GLY 190.A O no hydrogen 3.067 N/A GLU 195.A N VAL 191.A O no hydrogen 2.844 N/A ALA 196.A N VAL 192.A O no hydrogen 2.979 N/A LEU 197.A N LEU 193.A O no hydrogen 3.091 N/A CYS 198.A N PHE 194.A O no hydrogen 2.884 N/A CYS 198.A SG PHE 194.A O no hydrogen 3.384 N/A ALA 199.A N GLU 195.A O no hydrogen 2.726 N/A ARG 200.A NE PRO 201.A O no hydrogen 2.772 N/A ARG 200.A NH1 GLN 211.A O no hydrogen 2.757 N/A ARG 200.A NH2 PRO 201.A O no hydrogen 2.931 N/A ARG 200.A NH2 GLN 211.A O no hydrogen 3.249 N/A ARG 200.A NH2 VAL 212.A O no hydrogen 2.938 N/A ASN 204.A N VAL 212.A O no hydrogen 2.930 N/A THR 206.A N ASN 204.A OD1 no hydrogen 2.978 N/A THR 206.A OG1 ASN 204.A OD1 no hydrogen 2.780 N/A LEU 207.A N ASN 204.A O no hydrogen 3.283 N/A GLN 211.A N ALA 208.A O no hydrogen 2.934 N/A VAL 212.A N LYS 209.A O no hydrogen 3.521 N/A LEU 214.A N ALA 202.A O no hydrogen 2.778 N/A GLU 216.A N SER 213.A O no hydrogen 2.998 N/A TRP 217.A N SER 213.A O no hydrogen 2.921 N/A ALA 218.A N LEU 214.A O no hydrogen 2.962 N/A TYR 220.A N GLU 216.A O no hydrogen 3.255 N/A CYS 221.A N TRP 217.A O no hydrogen 2.869 N/A CYS 221.A SG TRP 217.A O no hydrogen 3.420 N/A TYR 222.A N ALA 218.A O no hydrogen 2.908 N/A LYS 223.A N PRO 219.A O no hydrogen 2.989 N/A LYS 224.A N TYR 220.A O no hydrogen 3.067 N/A GLY 225.A N TYR 222.A O no hydrogen 2.874 N/A MET 226.A N CYS 221.A O no hydrogen 2.711 N/A GLN 229.A N MET 226.A O no hydrogen 2.758 N/A ILE 230.A N LEU 227.A O no hydrogen 3.129 N/A ASP 232.A N LEU 197.A O no hydrogen 2.915 N/A TYR 234.A N ASP 232.A OD1 no hydrogen 2.885 N/A LEU 235.A N ASP 232.A O no hydrogen 2.904 N/A LYS 236.A N PRO 233.A O no hydrogen 3.257 N/A LYS 238.A N LEU 235.A O no hydrogen 2.925 N/A LYS 238.A NZ TYR 234.A O no hydrogen 2.696 N/A THR 240.A N GLN 279.A OE1 no hydrogen 3.086 N/A THR 240.A OG1 LEU 278.A O no hydrogen 3.059 N/A THR 240.A OG1 GLN 279.A OE1 no hydrogen 3.567 N/A CYS 243.A N THR 240.A OG1 no hydrogen 3.315 N/A CYS 243.A SG ALA 275.A O no hydrogen 3.472 N/A PHE 244.A N THR 240.A O no hydrogen 2.770 N/A LYS 245.A N PRO 241.A O no hydrogen 2.925 N/A LYS 245.A NZ GLU 242.A OE2 no hydrogen 2.701 N/A LYS 246.A N GLU 242.A O no hydrogen 3.055 N/A PHE 247.A N CYS 243.A O no hydrogen 2.744 N/A ALA 248.A N PHE 244.A O no hydrogen 2.859 N/A GLU 249.A N LYS 245.A O no hydrogen 2.959 N/A THR 250.A N LYS 246.A O no hydrogen 3.101 N/A THR 250.A OG1 LYS 246.A O no hydrogen 2.518 N/A ALA 251.A N PHE 247.A O no hydrogen 2.982 N/A MET 252.A N ALA 248.A O no hydrogen 2.861 N/A LYS 253.A N GLU 249.A O no hydrogen 3.045 N/A CYS 254.A N THR 250.A O no hydrogen 3.188 N/A CYS 254.A SG THR 250.A O no hydrogen 3.210 N/A VAL 255.A N ALA 251.A O no hydrogen 3.272 N/A VAL 255.A N MET 252.A O no hydrogen 3.177 N/A LEU 256.A N LYS 253.A O no hydrogen 3.344 N/A GLY 259.A N GLU 173.A OE2 no hydrogen 3.009 N/A GLU 261.A N GLN 258.A O no hydrogen 2.968 N/A ARG 262.A N GLY 259.A O no hydrogen 3.060 N/A ARG 262.A NE LEU 256.A O no hydrogen 2.808 N/A ARG 262.A NH1 ASP 171.A OD2 no hydrogen 2.996 N/A ARG 262.A NH1 LYS 183.A O no hydrogen 2.825 N/A ARG 262.A NH2 ASP 171.A OD1 no hydrogen 2.746 N/A ARG 262.A NH2 LEU 256.A O no hydrogen 2.868 N/A ASP 267.A N SER 264.A OG no hydrogen 3.099 N/A VAL 268.A N SER 264.A O no hydrogen 2.937 N/A LEU 269.A N MET 265.A O no hydrogen 2.757 N/A TRP 270.A N GLY 266.A O no hydrogen 3.030 N/A ASN 271.A N ASP 267.A O no hydrogen 2.988 N/A ASN 271.A ND2 ASP 267.A O no hydrogen 2.943 N/A LEU 272.A N VAL 268.A O no hydrogen 2.974 N/A GLU 273.A N LEU 269.A O no hydrogen 3.113 N/A PHE 274.A N TRP 270.A O no hydrogen 2.826 N/A ALA 275.A N ASN 271.A O no hydrogen 2.839 N/A LEU 276.A N LEU 272.A O no hydrogen 2.857 N/A GLN 277.A N GLU 273.A O no hydrogen 3.111 N/A LEU 278.A N PHE 274.A O no hydrogen 2.861 N/A GLN 279.A N ALA 275.A O no hydrogen 2.867 N/A GLN 279.A N LEU 276.A O no hydrogen 3.254 N/A GLN 279.A NE2 LYS 238.A O no hydrogen 2.919 N/A GLU 280.A N GLN 277.A O no hydrogen 3.112 N/A