Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3l1b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A NE2 GLU 125.A OE1 no hydrogen 2.937 N/A GLU 4.A N SER 1.A O no hydrogen 2.645 N/A LEU 5.A N HIS 2.A O no hydrogen 3.202 N/A THR 6.A N GLN 9.A OE1 no hydrogen 3.178 N/A GLN 9.A N THR 6.A OG1 no hydrogen 3.137 N/A GLN 10.A N THR 6.A O no hydrogen 2.776 N/A GLN 10.A NE2 HIS 2.A O no hydrogen 2.920 N/A THR 11.A N PRO 7.A O no hydrogen 2.881 N/A THR 11.A OG1 PRO 7.A O no hydrogen 3.060 N/A LEU 12.A N ASP 8.A O no hydrogen 3.017 N/A LEU 13.A N GLN 9.A O no hydrogen 2.892 N/A HIS 14.A N GLN 10.A O no hydrogen 2.901 N/A PHE 15.A N THR 11.A O no hydrogen 2.889 N/A ILE 16.A N LEU 12.A O no hydrogen 2.973 N/A MET 17.A N LEU 13.A O no hydrogen 2.812 N/A ASP 18.A N HIS 14.A O no hydrogen 2.907 N/A SER 19.A N PHE 15.A O no hydrogen 3.029 N/A SER 19.A OG PHE 15.A O no hydrogen 2.847 N/A SER 19.A OG ILE 16.A O no hydrogen 3.102 N/A TYR 20.A N ILE 16.A O no hydrogen 2.826 N/A TYR 20.A OH GLU 79.A OE1 no hydrogen 2.602 N/A ASN 21.A N MET 17.A O no hydrogen 2.935 N/A ASN 21.A ND2 GLN 124.A OE1 no hydrogen 2.810 N/A LYS 22.A N SER 19.A O no hydrogen 3.302 N/A LEU 30.A N GLU 26.A O no hydrogen 3.240 N/A ILE 31.A N GLU 27.A O no hydrogen 2.866 N/A LEU 32.A N ASN 28.A O no hydrogen 3.063 N/A THR 33.A N PHE 29.A O no hydrogen 2.894 N/A THR 33.A OG1 LEU 30.A O no hydrogen 2.754 N/A GLU 34.A N LEU 30.A O no hydrogen 2.991 N/A MET 35.A N ILE 31.A O no hydrogen 2.888 N/A ALA 36.A N LEU 32.A O no hydrogen 2.894 N/A THR 37.A N THR 33.A O no hydrogen 2.826 N/A THR 37.A OG1 THR 33.A O no hydrogen 2.993 N/A THR 37.A OG1 THR 207.A OG1 no hydrogen 3.261 N/A ASN 38.A N GLU 34.A O no hydrogen 2.966 N/A HIS 39.A N MET 35.A O no hydrogen 2.913 N/A VAL 40.A N ALA 36.A O no hydrogen 2.929 N/A GLN 41.A N THR 37.A O no hydrogen 3.187 N/A VAL 42.A N ASN 38.A O no hydrogen 3.265 N/A LEU 43.A N HIS 39.A O no hydrogen 2.745 N/A VAL 44.A N VAL 40.A O no hydrogen 2.979 N/A GLU 45.A N GLN 41.A O no hydrogen 3.291 N/A PHE 46.A N VAL 42.A O no hydrogen 3.019 N/A THR 47.A N LEU 43.A O no hydrogen 2.838 N/A THR 47.A OG1 LEU 43.A O no hydrogen 2.606 N/A LYS 48.A N VAL 44.A O no hydrogen 2.930 N/A LYS 48.A NZ GLU 45.A OE2 no hydrogen 3.205 N/A LYS 49.A N PHE 46.A O no hydrogen 3.132 N/A LEU 50.A N THR 47.A O no hydrogen 3.012 N/A PHE 53.A N LEU 50.A O no hydrogen 3.160 N/A GLN 54.A NE2 LYS 48.A O no hydrogen 3.095 N/A THR 55.A N GLY 52.A O no hydrogen 2.803 N/A THR 55.A OG1 GLY 52.A O no hydrogen 2.617 N/A LEU 56.A N PHE 53.A O no hydrogen 3.049 N/A ASP 60.A N ASP 57.A OD2 no hydrogen 3.321 N/A GLN 61.A N ASP 57.A O no hydrogen 2.878 N/A GLN 61.A NE2 PHE 53.A O no hydrogen 3.035 N/A GLN 61.A NE2 GLN 54.A OE1 no hydrogen 3.666 N/A ILE 62.A N HIS 58.A O no hydrogen 3.052 N/A ALA 63.A N GLU 59.A O no hydrogen 3.009 N/A LEU 64.A N ASP 60.A O no hydrogen 2.855 N/A LEU 65.A N GLN 61.A O no hydrogen 3.062 N/A LYS 66.A N ILE 62.A O no hydrogen 2.901 N/A LYS 66.A NZ ILE 213.A O no hydrogen 3.534 N/A GLY 67.A N ALA 63.A O no hydrogen 2.798 N/A SER 68.A N LEU 64.A O no hydrogen 3.095 N/A SER 68.A OG LEU 64.A O no hydrogen 2.909 N/A SER 68.A OG LEU 65.A O no hydrogen 3.342 N/A ALA 69.A N LYS 66.A O no hydrogen 3.480 N/A ALA 72.A N SER 68.A O no hydrogen 2.793 N/A MET 73.A N ALA 69.A O no hydrogen 2.892 N/A PHE 74.A N VAL 70.A O no hydrogen 3.017 N/A LEU 75.A N GLU 71.A O no hydrogen 2.943 N/A ARG 76.A N ALA 72.A O no hydrogen 2.954 N/A SER 77.A N MET 73.A O no hydrogen 2.932 N/A SER 77.A OG MET 73.A O no hydrogen 2.758 N/A ALA 78.A N PHE 74.A O no hydrogen 2.930 N/A GLU 79.A N LEU 75.A O no hydrogen 3.080 N/A ILE 80.A N ARG 76.A O no hydrogen 2.919 N/A PHE 81.A N SER 77.A O no hydrogen 2.862 N/A ASN 82.A N ALA 78.A O no hydrogen 3.008 N/A ASN 82.A ND2 ALA 78.A O no hydrogen 2.872 N/A ASN 82.A ND2 TYR 114.A O no hydrogen 2.925 N/A LYS 83.A N GLU 79.A O no hydrogen 2.804 N/A LYS 83.A NZ MET 122.A O no hydrogen 2.918 N/A LYS 84.A N ILE 80.A O no hydrogen 2.964 N/A LEU 85.A N ILE 80.A O no hydrogen 2.861 N/A HIS 89.A N PRO 86.A O no hydrogen 2.911 N/A SER 90.A N SER 87.A O no hydrogen 3.089 N/A LEU 93.A N HIS 89.A O no hydrogen 3.013 N/A GLU 94.A N SER 90.A O no hydrogen 3.172 N/A GLU 95.A N ASP 91.A O no hydrogen 2.830 N/A ARG 96.A N LEU 92.A O no hydrogen 2.873 N/A ILE 97.A N LEU 93.A O no hydrogen 2.971 N/A ARG 98.A N GLU 94.A O no hydrogen 2.903 N/A ARG 98.A NE ASP 104.A OD2 no hydrogen 2.734 N/A ASN 99.A N GLU 95.A O no hydrogen 3.057 N/A SER 100.A N ILE 97.A O no hydrogen 3.241 N/A SER 100.A OG ILE 97.A O no hydrogen 2.644 N/A GLY 101.A N ARG 98.A O no hydrogen 3.069 N/A TYR 106.A N SER 103.A O no hydrogen 3.035 N/A ILE 107.A N SER 103.A O no hydrogen 3.276 N/A THR 108.A N ASP 104.A O no hydrogen 3.108 N/A THR 108.A OG1 ASP 104.A O no hydrogen 2.658 N/A PHE 111.A N ILE 107.A O no hydrogen 3.039 N/A SER 112.A N THR 108.A O no hydrogen 3.020 N/A SER 112.A OG THR 108.A O no hydrogen 3.220 N/A PHE 113.A N PRO 109.A O no hydrogen 3.023 N/A TYR 114.A N MET 110.A O no hydrogen 3.088 N/A LYS 115.A N PHE 111.A O no hydrogen 3.008 N/A SER 116.A N SER 112.A O no hydrogen 2.713 N/A SER 116.A OG GLU 184.A OE1 no hydrogen 3.471 N/A ILE 117.A N PHE 113.A O no hydrogen 2.812 N/A GLY 118.A N TYR 114.A O no hydrogen 2.999 N/A GLU 119.A N LYS 115.A O no hydrogen 3.050 N/A GLU 119.A N SER 116.A O no hydrogen 3.139 N/A LEU 120.A N ILE 117.A O no hydrogen 3.037 N/A LYS 121.A N GLY 118.A O no hydrogen 2.994 N/A THR 123.A N GLU 126.A OE2 no hydrogen 3.358 N/A THR 123.A OG1 GLU 126.A OE2 no hydrogen 3.238 N/A GLN 124.A NE2 ASN 21.A OD1 no hydrogen 3.129 N/A GLU 126.A N THR 123.A OG1 no hydrogen 3.216 N/A TYR 127.A N THR 123.A O no hydrogen 3.175 N/A ALA 128.A N GLN 124.A O no hydrogen 2.936 N/A LEU 129.A N GLU 125.A O no hydrogen 2.930 N/A LEU 130.A N GLU 126.A O no hydrogen 2.817 N/A THR 131.A N TYR 127.A O no hydrogen 2.952 N/A THR 131.A OG1 TYR 127.A O no hydrogen 2.660 N/A ALA 132.A N ALA 128.A O no hydrogen 3.141 N/A ILE 133.A N LEU 129.A O no hydrogen 2.906 N/A VAL 134.A N LEU 130.A O no hydrogen 2.820 N/A ILE 135.A N THR 131.A O no hydrogen 3.021 N/A LEU 136.A N ALA 132.A O no hydrogen 2.927 N/A SER 137.A OG ILE 133.A O no hydrogen 3.475 N/A SER 137.A OG VAL 134.A O no hydrogen 2.692 N/A ARG 140.A N SER 137.A O no hydrogen 3.429 N/A ARG 140.A NH1 GLU 71.A OE2 no hydrogen 2.817 N/A ARG 140.A NH2 GLU 71.A OE1 no hydrogen 2.744 N/A ARG 140.A NH2 VAL 134.A O no hydrogen 2.905 N/A GLN 141.A N GLN 141.A OE1 no hydrogen 2.583 N/A ILE 143.A N ARG 140.A O no hydrogen 3.424 N/A LYS 144.A N ASP 60.A OD1 no hydrogen 2.840 N/A LYS 144.A NZ GLU 59.A OE1 no hydrogen 2.724 N/A ASP 145.A N ASP 60.A OD2 no hydrogen 3.068 N/A ARG 146.A NH1 PRO 138.A O no hydrogen 2.792 N/A ARG 146.A NH1 ARG 140.A O no hydrogen 2.642 N/A ARG 146.A NH2 ARG 140.A O no hydrogen 3.287 N/A ALA 148.A N ASP 145.A OD1 no hydrogen 3.239 N/A GLU 150.A N ARG 146.A O no hydrogen 2.776 N/A LYS 151.A N GLU 147.A O no hydrogen 2.868 N/A LEU 152.A N ALA 148.A O no hydrogen 3.208 N/A LEU 152.A N VAL 149.A O no hydrogen 3.025 N/A GLN 153.A N VAL 149.A O no hydrogen 2.919 N/A GLN 153.A NE2 ILE 133.A O no hydrogen 3.058 N/A GLU 154.A N GLU 150.A O no hydrogen 2.954 N/A LEU 157.A N GLN 153.A O no hydrogen 3.068 N/A ASP 158.A N GLU 154.A O no hydrogen 3.003 N/A VAL 159.A N PRO 155.A O no hydrogen 2.958 N/A LEU 160.A N LEU 156.A O no hydrogen 2.948 N/A GLN 161.A N LEU 157.A O no hydrogen 2.863 N/A LYS 162.A N ASP 158.A O no hydrogen 3.010 N/A LEU 163.A N VAL 159.A O no hydrogen 2.847 N/A CYS 164.A N LEU 160.A O no hydrogen 2.854 N/A CYS 164.A SG LEU 160.A O no hydrogen 3.232 N/A LYS 165.A N GLN 161.A O no hydrogen 3.206 N/A ILE 166.A N LYS 162.A O no hydrogen 2.980 N/A HIS 167.A N LEU 163.A O no hydrogen 2.907 N/A GLN 168.A N CYS 164.A O no hydrogen 2.945 N/A GLN 168.A NE2 LEU 120.A O no hydrogen 3.692 N/A ASN 171.A N GLN 168.A O no hydrogen 3.145 N/A ASN 171.A ND2 GLN 168.A OE1 no hydrogen 3.110 N/A HIS 174.A N ASN 171.A O no hydrogen 3.026 N/A HIS 174.A NE2 GLU 126.A OE1 no hydrogen 2.768 N/A CYS 177.A N GLN 173.A O no hydrogen 2.938 N/A CYS 177.A SG GLN 173.A O no hydrogen 3.222 N/A LEU 178.A N HIS 174.A O no hydrogen 2.947 N/A LEU 179.A N PHE 175.A O no hydrogen 3.066 N/A GLY 180.A N ALA 176.A O no hydrogen 2.780 N/A ARG 181.A N CYS 177.A O no hydrogen 3.137 N/A ARG 181.A NE SER 116.A O no hydrogen 3.634 N/A LEU 182.A N LEU 178.A O no hydrogen 3.093 N/A THR 183.A N LEU 179.A O no hydrogen 3.196 N/A THR 183.A OG1 LEU 179.A O no hydrogen 3.243 N/A GLU 184.A N GLY 180.A O no hydrogen 3.213 N/A LEU 185.A N ARG 181.A O no hydrogen 2.691 N/A ARG 186.A N LEU 182.A O no hydrogen 3.152 N/A ARG 186.A NH1 ASP 139.A OD1 no hydrogen 2.870 N/A ARG 186.A NH2 ASP 139.A OD1 no hydrogen 2.948 N/A ARG 186.A NH2 ASP 139.A OD2 no hydrogen 3.347 N/A THR 187.A N GLU 184.A O no hydrogen 3.337 N/A THR 187.A OG1 GLU 184.A O no hydrogen 2.669 N/A PHE 188.A N LEU 185.A O no hydrogen 3.082 N/A ASN 189.A N ARG 186.A O no hydrogen 3.299 N/A ASN 189.A ND2 GLU 71.A OE2 no hydrogen 2.705 N/A ASN 189.A ND2 ARG 186.A O no hydrogen 3.269 N/A HIS 191.A N THR 187.A O no hydrogen 3.325 N/A HIS 192.A N PHE 188.A O no hydrogen 2.746 N/A ALA 193.A N ASN 189.A O no hydrogen 3.013 N/A GLU 194.A N HIS 190.A O no hydrogen 2.883 N/A MET 195.A N HIS 191.A O no hydrogen 3.000 N/A LEU 196.A N HIS 192.A O no hydrogen 2.867 N/A MET 197.A N ALA 193.A O no hydrogen 3.183 N/A SER 198.A N GLU 194.A O no hydrogen 3.224 N/A TRP 199.A N MET 195.A O no hydrogen 2.872 N/A ARG 200.A N LEU 196.A O no hydrogen 2.873 N/A VAL 201.A N MET 197.A O no hydrogen 2.881 N/A ASN 202.A N SER 198.A O no hydrogen 2.972 N/A ASP 203.A N ARG 200.A O no hydrogen 3.206 N/A HIS 204.A N TRP 199.A O no hydrogen 2.818 N/A THR 207.A OG1 THR 37.A OG1 no hydrogen 3.261 N/A LEU 210.A N THR 207.A OG1 no hydrogen 3.382 N/A CYS 211.A N THR 207.A O no hydrogen 2.961 N/A CYS 211.A SG PHE 206.A O no hydrogen 3.862 N/A CYS 211.A SG THR 207.A O no hydrogen 3.580 N/A GLU 212.A N PRO 208.A O no hydrogen 2.916 N/A ILE 213.A N LEU 209.A O no hydrogen 2.794 N/A TRP 214.A N LEU 210.A O no hydrogen 2.784 N/A ASP 215.A N GLU 212.A O no hydrogen 3.301 N/A VAL 216.A N CYS 211.A O no hydrogen 2.944 N/A