Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4lxg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 3.A OE2 no hydrogen 2.607 N/A GLU 3.A N GLU 3.A OE1 no hydrogen 2.694 N/A GLN 4.A N GLN 4.A OE1 no hydrogen 2.773 N/A PHE 5.A N PHE 2.A O no hydrogen 3.187 N/A SER 7.A OG HIS 18.A NE2 no hydrogen 2.757 N/A LYS 8.A N TYR 19.A O no hydrogen 2.871 N/A LYS 8.A NZ GLU 6.A OE1 no hydrogen 3.169 N/A ILE 10.A N THR 17.A O no hydrogen 3.068 N/A CYS 12.A N ILE 15.A O no hydrogen 2.822 N/A CYS 12.A SG ILE 10.A O no hydrogen 3.808 N/A CYS 12.A SG THR 17.A OG1 no hydrogen 3.251 N/A GLY 14.A N ASP 11.A OD2 no hydrogen 3.296 N/A ILE 15.A N CYS 12.A O no hydrogen 3.053 N/A ARG 16.A N ASP 69.A OD2 no hydrogen 3.038 N/A THR 17.A N ILE 10.A O no hydrogen 2.889 N/A THR 17.A OG1 ILE 15.A O no hydrogen 2.856 N/A THR 17.A OG1 HIS 86.A NE2 no hydrogen 2.798 N/A HIS 18.A N THR 68.A OG1 no hydrogen 2.794 N/A HIS 18.A ND1 ASP 61.A OD2 no hydrogen 2.866 N/A HIS 18.A NE2 SER 7.A OG no hydrogen 2.757 N/A TYR 19.A N LYS 8.A O no hydrogen 2.893 N/A ILE 20.A N ALA 59.A O no hydrogen 2.870 N/A MET 22.A N VAL 57.A O no hydrogen 3.051 N/A LEU 28.A N ARG 56.A O no hydrogen 2.832 N/A VAL 29.A N CYS 100.A O no hydrogen 2.899 N/A LEU 30.A N ILE 58.A O no hydrogen 2.691 N/A VAL 31.A N ILE 102.A O no hydrogen 2.676 N/A HIS 32.A ND1 GLY 33.A O no hydrogen 2.765 N/A GLY 33.A N ASN 43.A OD1 no hydrogen 2.895 N/A ALA 38.A N GLY 35.A O no hydrogen 3.139 N/A ASP 39.A N SER 42.A OG no hydrogen 3.361 N/A GLY 40.A N ASP 61.A OD1 no hydrogen 2.916 N/A ARG 41.A NE TYR 177.A OH no hydrogen 2.824 N/A ARG 41.A NH2 TYR 177.A OH no hydrogen 3.203 N/A SER 42.A N ASP 39.A OD1 no hydrogen 2.860 N/A SER 42.A OG ASP 39.A O no hydrogen 3.385 N/A SER 42.A OG ASP 39.A OD1 no hydrogen 2.718 N/A ASN 43.A N ASP 39.A O no hydrogen 3.191 N/A PHE 44.A N GLY 40.A O no hydrogen 2.955 N/A ALA 45.A N ARG 41.A O no hydrogen 2.828 N/A ASN 47.A N PHE 44.A O no hydrogen 2.810 N/A ASN 47.A ND2 MET 256.A O no hydrogen 2.927 N/A ASN 47.A ND2 PRO 260.A O no hydrogen 3.587 N/A PHE 48.A N PHE 44.A O no hydrogen 3.275 N/A PHE 48.A N ALA 45.A O no hydrogen 3.188 N/A PHE 51.A N ASN 47.A O no hydrogen 3.050 N/A ALA 52.A N PHE 48.A O no hydrogen 2.844 N/A ARG 53.A N ILE 50.A O no hydrogen 3.228 N/A HIS 54.A N PHE 51.A O no hydrogen 2.938 N/A MET 55.A N PHE 51.A O no hydrogen 2.923 N/A ARG 56.A N ASP 26.A O no hydrogen 2.954 N/A ARG 56.A NE GLU 21.A OE1 no hydrogen 2.734 N/A ARG 56.A NH2 GLU 21.A OE1 no hydrogen 3.284 N/A ARG 56.A NH2 GLU 21.A OE2 no hydrogen 2.888 N/A VAL 57.A N MET 22.A O no hydrogen 2.843 N/A ILE 58.A N LEU 28.A O no hydrogen 2.702 N/A ALA 59.A N ILE 20.A O no hydrogen 2.993 N/A ASP 61.A N HIS 18.A O no hydrogen 2.963 N/A MET 62.A N HIS 32.A NE2 no hydrogen 2.939 N/A VAL 63.A N HIS 86.A ND1 no hydrogen 3.253 N/A GLN 67.A N ASP 61.A OD2 no hydrogen 2.860 N/A THR 68.A N PHE 65.A O no hydrogen 3.171 N/A THR 68.A OG1 ASP 61.A O no hydrogen 2.744 N/A ASP 69.A N ARG 16.A O no hydrogen 2.786 N/A ALA 74.A N ASP 72.A OD1 no hydrogen 2.836 N/A GLY 75.A N ASP 72.A O no hydrogen 2.809 N/A TYR 78.A OH PRO 71.A O no hydrogen 2.604 N/A GLN 80.A NE2 THR 84.A OG1 no hydrogen 3.132 N/A GLN 80.A NE2 THR 110.A OG1 no hydrogen 3.026 N/A ALA 82.A N THR 79.A OG1 no hydrogen 3.100 N/A ARG 83.A NE GLN 80.A OE1 no hydrogen 3.024 N/A ARG 83.A NH2 GLN 80.A OE1 no hydrogen 2.724 N/A THR 84.A N GLN 80.A O no hydrogen 2.901 N/A THR 84.A OG1 GLN 80.A O no hydrogen 3.359 N/A ASP 85.A N ALA 81.A O no hydrogen 2.819 N/A HIS 86.A N ALA 82.A O no hydrogen 3.018 N/A HIS 86.A NE2 THR 17.A OG1 no hydrogen 2.798 N/A LEU 87.A N ARG 83.A O no hydrogen 2.972 N/A ILE 88.A N THR 84.A O no hydrogen 3.110 N/A SER 89.A N ASP 85.A O no hydrogen 2.831 N/A SER 89.A OG ASP 13.A OD2 no hydrogen 2.809 N/A PHE 90.A N HIS 86.A O no hydrogen 2.752 N/A ILE 91.A N LEU 87.A O no hydrogen 2.922 N/A LYS 92.A N ILE 88.A O no hydrogen 3.156 N/A ALA 93.A N SER 89.A O no hydrogen 2.922 N/A LEU 94.A N PHE 90.A O no hydrogen 3.260 N/A GLY 95.A N LYS 92.A O no hydrogen 3.002 N/A LEU 96.A N ILE 91.A O no hydrogen 3.160 N/A ILE 99.A N LEU 121.A O no hydrogen 2.931 N/A CYS 100.A N PRO 27.A O no hydrogen 3.079 N/A LEU 101.A N ARG 124.A O no hydrogen 2.935 N/A ILE 102.A N VAL 29.A O no hydrogen 2.977 N/A GLY 103.A N VAL 126.A O no hydrogen 3.188 N/A ASN 104.A N VAL 31.A O no hydrogen 3.028 N/A ASN 104.A ND2 HIS 253.A O no hydrogen 3.428 N/A SER 105.A N MET 128.A O no hydrogen 3.059 N/A SER 105.A OG HIS 253.A NE2 no hydrogen 2.900 N/A THR 109.A N SER 105.A O no hydrogen 2.975 N/A THR 109.A OG1 SER 105.A O no hydrogen 3.352 N/A THR 109.A OG1 MET 106.A O no hydrogen 3.440 N/A THR 109.A OG1 ALA 131.A O no hydrogen 2.694 N/A THR 110.A N MET 106.A O no hydrogen 3.065 N/A THR 110.A OG1 MET 106.A O no hydrogen 2.934 N/A ALA 111.A N GLY 107.A O no hydrogen 2.890 N/A CYS 112.A N GLY 108.A O no hydrogen 2.910 N/A GLY 113.A N THR 109.A O no hydrogen 2.938 N/A ALA 114.A N THR 110.A O no hydrogen 2.895 N/A ALA 115.A N ALA 111.A O no hydrogen 2.958 N/A LEU 116.A N CYS 112.A O no hydrogen 3.015 N/A LYS 117.A N GLY 113.A O no hydrogen 2.973 N/A LYS 117.A NZ ASP 85.A OD1 no hydrogen 2.611 N/A ALA 118.A N ALA 114.A O no hydrogen 2.741 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 2.754 N/A LEU 121.A N ALA 118.A O no hydrogen 3.202 N/A ILE 122.A N PRO 119.A O no hydrogen 3.073 N/A ASP 123.A N ILE 99.A O no hydrogen 2.747 N/A ARG 124.A N ILE 99.A O no hydrogen 3.304 N/A ARG 124.A NH1 PHE 270.A O no hydrogen 3.202 N/A LEU 125.A N PRO 216.A O no hydrogen 3.034 N/A VAL 126.A N LEU 101.A O no hydrogen 2.815 N/A LEU 127.A N LEU 218.A O no hydrogen 2.901 N/A MET 128.A N GLY 103.A O no hydrogen 3.020 N/A GLY 129.A N LEU 220.A O no hydrogen 2.856 N/A ALA 131.A N SER 105.A O no hydrogen 3.081 N/A VAL 132.A N ALA 130.A O no hydrogen 3.037 N/A ASN 133.A ND2 LYS 232.A O no hydrogen 3.031 N/A ILE 134.A N LEU 203.A O no hydrogen 2.859 N/A SER 135.A N ASP 138.A OD2 no hydrogen 2.902 N/A ASP 138.A N SER 135.A OG no hydrogen 3.054 N/A MET 139.A N SER 135.A O no hydrogen 2.986 N/A MET 139.A N PRO 136.A O no hydrogen 2.976 N/A VAL 140.A N ASP 137.A O no hydrogen 3.235 N/A ALA 145.A N ASP 142.A O no hydrogen 3.120 N/A MET 148.A N LEU 144.A O no hydrogen 2.683 N/A SER 149.A N ALA 145.A O no hydrogen 2.979 N/A SER 149.A OG ALA 145.A O no hydrogen 2.799 N/A TYR 150.A N VAL 147.A O no hydrogen 3.176 N/A TYR 150.A OH SER 182.A OG no hydrogen 2.798 N/A SER 153.A N ASP 151.A OD1 no hydrogen 2.986 N/A SER 153.A OG ASP 151.A OD1 no hydrogen 2.550 N/A SER 153.A OG ASP 151.A OD2 no hydrogen 3.364 N/A GLY 156.A N SER 153.A OG no hydrogen 3.044 N/A MET 157.A N SER 153.A O no hydrogen 3.022 N/A ARG 158.A N GLU 154.A O no hydrogen 3.012 N/A ARG 158.A NH2 ASP 172.A OD1 no hydrogen 3.216 N/A LYS 159.A N GLU 155.A O no hydrogen 3.000 N/A ILE 160.A N GLY 156.A O no hydrogen 2.977 N/A ILE 161.A N MET 157.A O no hydrogen 3.031 N/A ALA 162.A N ARG 158.A O no hydrogen 3.012 N/A ALA 163.A N LYS 159.A O no hydrogen 2.960 N/A LEU 164.A N ILE 160.A O no hydrogen 2.878 N/A LEU 164.A N ILE 161.A O no hydrogen 3.273 N/A THR 165.A OG1 ILE 161.A O no hydrogen 2.751 N/A HIS 166.A N GLU 258.A OE1 no hydrogen 2.968 N/A ILE 174.A N THR 171.A OG1 no hydrogen 3.297 N/A VAL 175.A N THR 171.A O no hydrogen 2.981 N/A HIS 176.A N ASP 172.A O no hydrogen 2.816 N/A TYR 177.A N ASP 173.A O no hydrogen 3.044 N/A TYR 177.A OH ASP 39.A OD2 no hydrogen 2.531 N/A ARG 178.A N ILE 174.A O no hydrogen 2.895 N/A HIS 179.A N VAL 175.A O no hydrogen 2.869 N/A HIS 179.A NE2 GLY 152.A O no hydrogen 2.763 N/A GLU 180.A N HIS 176.A O no hydrogen 3.003 N/A ALA 181.A N TYR 177.A O no hydrogen 2.821 N/A SER 182.A N ARG 178.A O no hydrogen 2.965 N/A SER 182.A OG TYR 150.A OH no hydrogen 2.798 N/A SER 182.A OG HIS 179.A O no hydrogen 2.607 N/A LEU 183.A N GLU 180.A O no hydrogen 2.963 N/A ARG 184.A NH1 THR 187.A OG1 no hydrogen 3.069 N/A THR 187.A N ARG 184.A O no hydrogen 3.224 N/A THR 188.A N PRO 185.A O no hydrogen 3.272 N/A THR 188.A OG1 ARG 184.A O no hydrogen 2.684 N/A TYR 191.A N THR 187.A O no hydrogen 3.011 N/A LYS 192.A N THR 188.A O no hydrogen 3.051 N/A ALA 193.A N ALA 189.A O no hydrogen 3.129 N/A THR 194.A N ALA 190.A O no hydrogen 2.949 N/A THR 194.A OG1 ALA 190.A O no hydrogen 2.718 N/A MET 195.A N TYR 191.A O no hydrogen 2.825 N/A GLY 196.A N LYS 192.A O no hydrogen 2.913 N/A TRP 197.A N ALA 193.A O no hydrogen 2.944 N/A ALA 198.A N THR 194.A O no hydrogen 3.063 N/A LYS 199.A N MET 195.A O no hydrogen 2.897 N/A GLN 200.A N GLY 196.A O no hydrogen 3.233 N/A ASN 201.A N TRP 197.A O no hydrogen 2.838 N/A ASN 201.A ND2 TRP 197.A O no hydrogen 3.058 N/A GLY 202.A N ALA 198.A O no hydrogen 2.765 N/A LEU 203.A N ILE 134.A O no hydrogen 2.777 N/A TYR 205.A N VAL 132.A O no hydrogen 2.853 N/A TYR 205.A OH THR 109.A O no hydrogen 2.825 N/A SER 206.A N GLN 209.A OE1 no hydrogen 3.043 N/A SER 206.A OG GLU 208.A OE1 no hydrogen 3.493 N/A GLU 208.A N GLU 208.A OE1 no hydrogen 2.773 N/A GLN 209.A N SER 206.A OG no hydrogen 3.045 N/A LEU 210.A N SER 206.A O no hydrogen 2.957 N/A ALA 211.A N PRO 207.A O no hydrogen 2.946 N/A SER 212.A N GLN 209.A O no hydrogen 2.960 N/A SER 212.A OG GLN 209.A O no hydrogen 2.595 N/A LEU 218.A N LEU 125.A O no hydrogen 2.778 N/A VAL 219.A N ILE 244.A O no hydrogen 2.698 N/A LEU 220.A N LEU 127.A O no hydrogen 2.843 N/A GLY 221.A N HIS 246.A O no hydrogen 3.252 N/A LYS 223.A N PHE 248.A O no hydrogen 2.771 N/A ASN 224.A N CYS 251.A O no hydrogen 2.793 N/A ASP 225.A N GLY 222.A O no hydrogen 3.231 N/A MET 227.A N ASP 225.A OD1 no hydrogen 2.731 N/A VAL 228.A N ASP 225.A OD1 no hydrogen 2.900 N/A LYS 232.A N PRO 229.A O no hydrogen 2.937 N/A LYS 232.A NZ ASN 133.A O no hydrogen 3.368 N/A LYS 232.A NZ ASP 138.A OD2 no hydrogen 3.044 N/A VAL 233.A N PRO 229.A O no hydrogen 3.322 N/A ILE 234.A N VAL 230.A O no hydrogen 2.732 N/A ASP 235.A N ARG 231.A O no hydrogen 2.915 N/A GLN 236.A N LYS 232.A O no hydrogen 3.067 N/A GLN 236.A NE2 ALA 130.A O no hydrogen 2.808 N/A GLN 236.A NE2 ASN 133.A OD1 no hydrogen 3.028 N/A ILE 237.A N VAL 233.A O no hydrogen 3.034 N/A LEU 238.A N ILE 234.A O no hydrogen 3.057 N/A ALA 239.A N ASP 235.A O no hydrogen 2.888 N/A ILE 240.A N GLN 236.A O no hydrogen 3.100 N/A GLN 242.A N GLN 242.A OE1 no hydrogen 2.722 N/A GLN 242.A NE2 LEU 213.A O no hydrogen 2.886 N/A GLN 242.A NE2 MET 215.A O no hydrogen 2.757 N/A ALA 243.A N ILE 240.A O no hydrogen 2.968 N/A ILE 244.A N VAL 217.A O no hydrogen 2.967 N/A HIS 246.A N VAL 219.A O no hydrogen 2.834 N/A PHE 248.A N GLY 221.A O no hydrogen 2.910 N/A ASN 250.A ND2 HIS 166.A NE2 no hydrogen 3.409 N/A CYS 251.A N ASN 224.A OD1 no hydrogen 3.078 N/A CYS 251.A SG GLY 252.A O no hydrogen 3.727 N/A GLY 252.A N GLU 258.A OE1 no hydrogen 2.793 N/A HIS 253.A N LEU 164.A O no hydrogen 2.689 N/A HIS 253.A ND1 ASP 225.A OD2 no hydrogen 2.677 N/A HIS 253.A NE2 SER 105.A OG no hydrogen 2.900 N/A TRP 254.A N GLU 258.A OE2 no hydrogen 2.975 N/A ILE 257.A N TRP 254.A O no hydrogen 3.090 N/A GLU 258.A N TRP 254.A O no hydrogen 2.754 N/A TYR 259.A N VAL 255.A O no hydrogen 2.848 N/A TYR 259.A OH ASN 250.A O no hydrogen 2.636 N/A PHE 263.A N TYR 259.A O no hydrogen 2.887 N/A CYS 264.A N PRO 260.A O no hydrogen 2.962 N/A CYS 264.A SG ASN 47.A O no hydrogen 3.861 N/A CYS 264.A SG PRO 260.A O no hydrogen 3.331 N/A THR 265.A N GLU 261.A O no hydrogen 2.762 N/A THR 265.A OG1 GLU 261.A O no hydrogen 2.840 N/A GLN 266.A N GLU 262.A O no hydrogen 2.934 N/A GLN 266.A NE2 GLU 262.A OE2 no hydrogen 2.869 N/A THR 267.A N PHE 263.A O no hydrogen 3.110 N/A THR 267.A OG1 PHE 263.A O no hydrogen 2.651 N/A THR 267.A OG1 CYS 264.A O no hydrogen 3.244 N/A LEU 268.A N CYS 264.A O no hydrogen 2.901 N/A HIS 269.A N THR 265.A O no hydrogen 2.934 N/A PHE 270.A N GLN 266.A O no hydrogen 2.976 N/A PHE 271.A N THR 267.A O no hydrogen 2.743 N/A GLY 272.A N HIS 269.A O no hydrogen 2.933 N/A LYS 273.A N LEU 268.A O no hydrogen 2.842 N/A LYS 273.A NZ ASP 26.A OD2 no hydrogen 2.541 N/A