Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ilp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A N MET 97.A O no hydrogen 3.371 N/A PHE 3.A N CYS 95.A O no hydrogen 2.795 N/A ARG 4.A N TRP 24.A O no hydrogen 2.840 N/A CYS 5.A N ALA 93.A O no hydrogen 2.762 N/A LEU 6.A N VAL 22.A O no hydrogen 2.842 N/A GLN 7.A N LEU 91.A O no hydrogen 2.895 N/A GLN 7.A NE2 SER 9.A OG no hydrogen 3.050 N/A MET 8.A N ASP 20.A O no hydrogen 2.795 N/A SER 9.A N ILE 89.A O no hydrogen 2.865 N/A SER 9.A OG THR 19.A OG1 no hydrogen 2.576 N/A SER 10.A N ARG 18.A O no hydrogen 2.885 N/A SER 10.A OG GLU 88.A OE1 no hydrogen 3.260 N/A SER 10.A OG GLU 88.A OE2 no hydrogen 2.543 N/A PHE 11.A N ILE 87.A O no hydrogen 2.853 N/A ALA 12.A N TRP 16.A O no hydrogen 2.967 N/A SER 15.A N ASN 13.A OD1 no hydrogen 3.076 N/A SER 15.A OG ASN 13.A OD1 no hydrogen 3.364 N/A TRP 16.A N ASN 13.A O no hydrogen 3.368 N/A ARG 18.A N SER 10.A O no hydrogen 2.894 N/A ARG 18.A NE ASP 20.A OD1 no hydrogen 2.746 N/A ARG 18.A NH2 ASP 20.A OD1 no hydrogen 3.396 N/A ARG 18.A NH2 ASP 20.A OD2 no hydrogen 2.783 N/A THR 19.A N ASN 35.A OD1 no hydrogen 2.904 N/A THR 19.A OG1 SER 9.A OG no hydrogen 2.576 N/A ASP 20.A N MET 8.A O no hydrogen 3.025 N/A SER 21.A N TRP 33.A O no hydrogen 2.922 N/A VAL 22.A N LEU 6.A O no hydrogen 2.900 N/A VAL 23.A N HIS 31.A O no hydrogen 2.987 N/A TRP 24.A N ARG 4.A O no hydrogen 2.853 N/A LEU 25.A N LEU 28.A O no hydrogen 2.846 N/A GLY 26.A N THR 2.A O no hydrogen 2.927 N/A LEU 28.A N LEU 25.A O no hydrogen 3.142 N/A GLN 29.A NE2 HIS 31.A O no hydrogen 3.169 N/A THR 30.A N VAL 23.A O no hydrogen 2.775 N/A THR 30.A OG1 VAL 23.A O no hydrogen 3.366 N/A THR 30.A OG1 HIS 31.A ND1 no hydrogen 2.820 N/A HIS 31.A N VAL 23.A O no hydrogen 3.472 N/A HIS 31.A ND1 THR 30.A OG1 no hydrogen 2.820 N/A ARG 32.A N SER 41.A O no hydrogen 3.012 N/A TRP 33.A N SER 21.A O no hydrogen 2.903 N/A TRP 33.A NE1 SER 37.A O no hydrogen 3.017 N/A SER 34.A OG ASP 36.A OD2 no hydrogen 3.215 N/A ASN 35.A N ASP 20.A OD2 no hydrogen 2.756 N/A ASP 36.A N SER 34.A OG no hydrogen 3.074 N/A SER 37.A N SER 34.A O no hydrogen 3.021 N/A SER 37.A OG THR 39.A O no hydrogen 2.721 N/A THR 39.A N SER 37.A OG no hydrogen 3.292 N/A ILE 40.A N GLN 60.A OE1 no hydrogen 2.839 N/A SER 41.A N ARG 32.A O no hydrogen 2.771 N/A THR 43.A N THR 30.A O no hydrogen 3.116 N/A THR 43.A OG1 GLN 29.A O no hydrogen 2.844 N/A LYS 44.A N SER 47.A OG no hydrogen 3.031 N/A LYS 44.A NZ GLN 29.A O no hydrogen 2.953 N/A LYS 44.A NZ THR 43.A O no hydrogen 3.269 N/A LYS 44.A NZ GLU 230.A OE1 no hydrogen 2.586 N/A LYS 44.A NZ GLU 230.A OE2 no hydrogen 3.447 N/A TRP 46.A NE1 ASP 170.A OD2 no hydrogen 2.771 N/A SER 47.A N LYS 44.A O no hydrogen 3.363 N/A SER 47.A OG THR 30.A O no hydrogen 2.516 N/A SER 47.A OG LYS 44.A O no hydrogen 3.192 N/A GLN 48.A NE2 LEU 51.A O no hydrogen 2.802 N/A GLN 48.A NE2 ASN 53.A OD1 no hydrogen 3.010 N/A GLY 49.A N TRP 46.A O no hydrogen 2.960 N/A LEU 51.A N GLN 48.A O no hydrogen 3.100 N/A GLN 55.A N SER 52.A OG no hydrogen 3.015 N/A TRP 56.A N SER 52.A O no hydrogen 2.939 N/A GLU 57.A N ASN 53.A O no hydrogen 3.067 N/A LYS 58.A N GLN 54.A O no hydrogen 3.138 N/A LEU 59.A N GLN 55.A O no hydrogen 3.058 N/A GLN 60.A N TRP 56.A O no hydrogen 2.826 N/A HIS 61.A N GLU 57.A O no hydrogen 2.711 N/A MET 62.A N LYS 58.A O no hydrogen 3.140 N/A PHE 63.A N LEU 59.A O no hydrogen 3.202 N/A GLN 64.A N GLN 60.A O no hydrogen 2.848 N/A GLN 64.A NE2 ALA 38.A O no hydrogen 2.954 N/A VAL 65.A N HIS 61.A O no hydrogen 2.989 N/A TYR 66.A N MET 62.A O no hydrogen 2.890 N/A TYR 66.A OH GLN 7.A OE1 no hydrogen 2.612 N/A ARG 67.A N PHE 63.A O no hydrogen 2.818 N/A ARG 67.A NH1 SER 34.A O no hydrogen 3.021 N/A ARG 67.A NH1 SER 37.A O no hydrogen 3.167 N/A ARG 67.A NH2 SER 37.A O no hydrogen 2.938 N/A VAL 68.A N GLN 64.A O no hydrogen 3.417 N/A SER 69.A N VAL 65.A O no hydrogen 2.923 N/A SER 69.A OG VAL 65.A O no hydrogen 3.016 N/A PHE 70.A N TYR 66.A O no hydrogen 2.785 N/A THR 71.A N ARG 67.A O no hydrogen 3.244 N/A THR 71.A OG1 ARG 67.A O no hydrogen 2.937 N/A ARG 72.A N VAL 68.A O no hydrogen 3.084 N/A ARG 72.A NE ASP 73.A OD1 no hydrogen 3.426 N/A ASP 73.A N SER 69.A O no hydrogen 2.853 N/A ILE 74.A N PHE 70.A O no hydrogen 2.930 N/A GLN 75.A N THR 71.A O no hydrogen 3.080 N/A GLN 75.A NE2 ASN 13.A O no hydrogen 3.154 N/A GLU 76.A N ARG 72.A O no hydrogen 2.947 N/A LEU 77.A N ASP 73.A O no hydrogen 2.963 N/A VAL 78.A N ILE 74.A O no hydrogen 2.944 N/A LYS 79.A N GLN 75.A O no hydrogen 3.019 N/A MET 80.A N GLU 76.A O no hydrogen 3.040 N/A MET 80.A N LEU 77.A O no hydrogen 2.990 N/A MET 81.A N LEU 77.A O no hydrogen 3.044 N/A MET 81.A N VAL 78.A O no hydrogen 2.977 N/A TYR 85.A OH GLN 75.A OE1 no hydrogen 2.559 N/A ILE 87.A N PHE 11.A O no hydrogen 2.822 N/A GLU 88.A N GLN 109.A OE1 no hydrogen 2.762 N/A ILE 89.A N SER 9.A O no hydrogen 2.860 N/A GLN 90.A N ALA 107.A O no hydrogen 2.968 N/A LEU 91.A N GLN 7.A O no hydrogen 2.988 N/A SER 92.A N HIS 105.A O no hydrogen 2.844 N/A ALA 93.A N CYS 5.A O no hydrogen 2.988 N/A GLY 94.A N PHE 103.A O no hydrogen 2.991 N/A CYS 95.A N PHE 3.A O no hydrogen 3.029 N/A GLU 96.A N GLU 101.A O no hydrogen 2.784 N/A MET 97.A N TYR 1.A O no hydrogen 2.727 N/A TYR 98.A N ALA 99.A O no hydrogen 2.794 N/A GLU 101.A N GLU 96.A O no hydrogen 3.032 N/A SER 102.A OG LEU 152.A O no hydrogen 2.427 N/A PHE 103.A N GLY 94.A O no hydrogen 3.008 N/A HIS 105.A N SER 92.A O no hydrogen 2.794 N/A VAL 106.A N VAL 114.A O no hydrogen 2.733 N/A ALA 107.A N GLN 90.A O no hydrogen 2.774 N/A PHE 108.A N LYS 111.A O no hydrogen 2.795 N/A GLN 109.A N GLU 88.A O no hydrogen 2.779 N/A GLN 109.A NE2 PRO 86.A O no hydrogen 3.101 N/A LYS 111.A N PHE 108.A O no hydrogen 3.085 N/A VAL 113.A N VAL 106.A O no hydrogen 2.888 N/A VAL 114.A N VAL 106.A O no hydrogen 3.321 N/A ARG 115.A N GLN 122.A O no hydrogen 2.909 N/A ARG 115.A NH2 GLN 122.A OE1 no hydrogen 3.381 N/A PHE 116.A N LEU 104.A O no hydrogen 2.921 N/A TRP 117.A N SER 120.A O no hydrogen 2.908 N/A SER 120.A N TRP 117.A O no hydrogen 3.311 N/A TRP 121.A N ASN 139.A OD1 no hydrogen 2.781 N/A GLN 122.A N ARG 115.A O no hydrogen 2.881 N/A VAL 124.A N VAL 113.A O no hydrogen 2.945 N/A ALA 127.A N VAL 124.A O no hydrogen 3.074 N/A LEU 131.A N PRO 128.A O no hydrogen 3.206 N/A ASP 132.A N SER 129.A O no hydrogen 3.075 N/A ILE 135.A N LEU 131.A O no hydrogen 3.037 N/A LYS 136.A N ASP 132.A O no hydrogen 2.929 N/A VAL 137.A N LEU 133.A O no hydrogen 2.843 N/A LEU 138.A N PRO 134.A O no hydrogen 2.799 N/A ASN 139.A N ILE 135.A O no hydrogen 2.876 N/A ASN 139.A ND2 TRP 121.A O no hydrogen 2.775 N/A ALA 140.A N LYS 136.A O no hydrogen 3.301 N/A ALA 140.A N VAL 137.A O no hydrogen 2.950 N/A ASP 141.A N LEU 138.A O no hydrogen 3.057 N/A THR 144.A N ASP 141.A OD1 no hydrogen 3.126 N/A THR 144.A OG1 ASP 141.A OD2 no hydrogen 2.575 N/A SER 145.A N ASP 141.A O no hydrogen 3.057 N/A SER 145.A OG THR 119.A O no hydrogen 2.811 N/A ALA 146.A N GLN 142.A O no hydrogen 2.801 N/A THR 147.A N GLY 143.A O no hydrogen 2.999 N/A THR 147.A OG1 GLY 143.A O no hydrogen 3.016 N/A VAL 148.A N THR 144.A O no hydrogen 2.938 N/A GLN 149.A N SER 145.A O no hydrogen 2.955 N/A GLN 149.A NE2 SER 145.A O no hydrogen 3.578 N/A GLN 149.A NE2 SER 145.A OG no hydrogen 3.143 N/A MET 150.A N ALA 146.A O no hydrogen 2.984 N/A LEU 151.A N THR 147.A O no hydrogen 2.896 N/A LEU 152.A N VAL 148.A O no hydrogen 2.922 N/A ASN 153.A N GLN 149.A O no hydrogen 2.822 N/A ASP 154.A N MET 150.A O no hydrogen 2.919 N/A THR 155.A N MET 150.A O no hydrogen 3.072 N/A THR 155.A OG1 MET 150.A O no hydrogen 3.520 N/A CYS 156.A N LEU 151.A O no hydrogen 2.757 N/A LEU 158.A N ASP 154.A O no hydrogen 3.204 N/A PHE 159.A N THR 155.A O no hydrogen 2.927 N/A VAL 160.A N CYS 156.A O no hydrogen 2.975 N/A ARG 161.A N PRO 157.A O no hydrogen 2.977 N/A GLY 162.A N LEU 158.A O no hydrogen 3.311 N/A LEU 163.A N PHE 159.A O no hydrogen 2.930 N/A LEU 164.A N VAL 160.A O no hydrogen 2.841 N/A GLU 165.A N ARG 161.A O no hydrogen 3.177 N/A ALA 166.A N GLY 162.A O no hydrogen 2.841 N/A GLY 167.A N LEU 163.A O no hydrogen 2.821 N/A ASP 170.A N GLY 167.A O no hydrogen 2.878 N/A LEU 171.A N GLY 167.A O no hydrogen 2.816 N/A GLU 172.A N LYS 168.A O no hydrogen 2.816 N/A LYS 173.A N ASP 170.A O no hydrogen 3.269 N/A LYS 173.A NZ GLU 230.A O no hydrogen 2.909 N/A GLU 175.A N TYR 201.A O no hydrogen 2.719 N/A VAL 178.A N SER 198.A O no hydrogen 2.955 N/A TRP 180.A N HIS 196.A O no hydrogen 2.920 N/A SER 182.A N VAL 194.A O no hydrogen 2.919 N/A SER 182.A OG HIS 196.A NE2 no hydrogen 2.625 N/A VAL 184.A N GLN 192.A O no hydrogen 2.999 N/A SER 186.A N HIS 190.A O no hydrogen 3.067 N/A SER 186.A OG ASP 239.A OD1 no hydrogen 3.292 N/A ARG 191.A N VAL 240.A O no hydrogen 2.810 N/A ARG 191.A NE SER 183.A OG no hydrogen 2.615 N/A ARG 191.A NH1 GLU 245.A OE2 no hydrogen 3.025 N/A GLN 192.A N VAL 184.A O no hydrogen 2.717 N/A LEU 193.A N LEU 238.A O no hydrogen 2.919 N/A VAL 194.A N SER 182.A O no hydrogen 2.847 N/A CYS 195.A N ALA 236.A O no hydrogen 2.908 N/A HIS 196.A N TRP 180.A O no hydrogen 2.777 N/A HIS 196.A ND1 TYR 233.A OH no hydrogen 2.848 N/A HIS 196.A NE2 SER 182.A OG no hydrogen 2.625 N/A VAL 197.A N LEU 234.A O no hydrogen 2.827 N/A SER 198.A N VAL 178.A O no hydrogen 2.885 N/A GLY 199.A N TRP 232.A O no hydrogen 2.776 N/A TYR 201.A N GLU 175.A O no hydrogen 3.005 N/A TYR 201.A OH ASP 27.A OD1 no hydrogen 2.598 N/A TRP 206.A N LYS 253.A O no hydrogen 3.072 N/A MET 208.A N ARG 251.A O no hydrogen 3.026 N/A TRP 209.A N THR 219.A OG1 no hydrogen 2.997 N/A TRP 209.A NE1 ALA 236.A O no hydrogen 3.139 N/A MET 210.A N ALA 249.A O no hydrogen 2.695 N/A ARG 211.A N GLN 214.A O no hydrogen 2.962 N/A ARG 211.A NH1 GLU 244.A O no hydrogen 3.168 N/A ARG 211.A NH2 GLU 244.A O no hydrogen 3.053 N/A GLN 214.A N ARG 211.A O no hydrogen 3.111 N/A GLN 216.A N TRP 209.A O no hydrogen 2.799 N/A THR 219.A N GLN 216.A O no hydrogen 2.983 N/A THR 219.A OG1 GLN 216.A O no hydrogen 2.708 N/A HIS 220.A N THR 237.A O no hydrogen 2.791 N/A ARG 221.A NE GLY 222.A O no hydrogen 2.858 N/A ARG 221.A NH2 GLY 222.A O no hydrogen 3.432 N/A GLY 222.A N GLN 235.A O no hydrogen 2.785 N/A LEU 225.A N TYR 233.A O no hydrogen 2.801 N/A ASN 227.A N THR 231.A O no hydrogen 2.899 N/A ASN 227.A ND2 SER 198.A OG no hydrogen 2.971 N/A ASN 227.A ND2 THR 231.A OG1 no hydrogen 3.189 N/A THR 231.A OG1 ASP 229.A OD1 no hydrogen 2.702 N/A TRP 232.A N PHE 200.A O no hydrogen 2.885 N/A TRP 232.A NE1 ASP 27.A OD2 no hydrogen 2.875 N/A TYR 233.A N LEU 225.A O no hydrogen 2.765 N/A TYR 233.A OH GLN 235.A OE1 no hydrogen 2.941 N/A LEU 234.A N VAL 197.A O no hydrogen 2.896 N/A ALA 236.A N CYS 195.A O no hydrogen 2.911 N/A THR 237.A N HIS 220.A O no hydrogen 2.945 N/A LEU 238.A N LEU 193.A O no hydrogen 2.871 N/A VAL 240.A N ARG 191.A O no hydrogen 2.855 N/A GLU 241.A N GLU 244.A OE2 no hydrogen 3.185 N/A ALA 242.A N GLY 189.A O no hydrogen 2.956 N/A GLU 244.A N GLU 241.A O no hydrogen 2.830 N/A LEU 248.A N GLU 245.A O no hydrogen 3.305 N/A ALA 249.A N MET 210.A O no hydrogen 2.901 N/A CYS 250.A N LEU 264.A O no hydrogen 2.821 N/A ARG 251.A N MET 208.A O no hydrogen 2.898 N/A ARG 251.A NE ASP 261.A OD2 no hydrogen 2.703 N/A ARG 251.A NH2 ASP 261.A OD2 no hydrogen 3.020 N/A VAL 252.A N ILE 262.A O no hydrogen 2.826 N/A LYS 253.A N TRP 206.A O no hydrogen 2.843 N/A LYS 253.A NZ ASP 261.A OD2 no hydrogen 2.730 N/A SER 255.A OG GLN 174.A OE1 no hydrogen 2.748 N/A SER 256.A OG GLU 175.A O no hydrogen 3.423 N/A LEU 257.A N HIS 254.A O no hydrogen 2.993 N/A GLN 260.A N LEU 257.A O no hydrogen 2.985 N/A ILE 262.A N VAL 252.A O no hydrogen 2.958 N/A LEU 264.A N CYS 250.A O no hydrogen 2.963 N/A TRP 266.A N LEU 248.A O no hydrogen 2.975 N/A