Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lg2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 HIS 240.A ND1 no hydrogen 2.654 N/A ARG 5.A N SER 165.A O no hydrogen 3.051 N/A ARG 5.A NE ASP 166.A OD1 no hydrogen 3.061 N/A ARG 5.A NH1 PHE 50.A O no hydrogen 3.144 N/A ARG 5.A NH2 PHE 50.A O no hydrogen 3.137 N/A ARG 5.A NH2 ASP 166.A OD2 no hydrogen 2.617 N/A CYS 6.A N LEU 235.A O no hydrogen 2.888 N/A ILE 7.A N ILE 167.A O no hydrogen 2.834 N/A ILE 8.A N GLY 233.A O no hydrogen 2.802 N/A VAL 9.A N VAL 168.A O no hydrogen 2.813 N/A ARG 10.A N GLY 231.A O no hydrogen 2.888 N/A ARG 10.A NH1 LEU 227.A O no hydrogen 2.914 N/A HIS 11.A N ALA 170.A O no hydrogen 3.183 N/A HIS 11.A ND1 GLY 12.A O no hydrogen 2.597 N/A GLY 12.A N THR 70.A OG1 no hydrogen 3.024 N/A GLN 13.A N GLN 37.A OE1 no hydrogen 3.048 N/A THR 14.A N SER 17.A OG no hydrogen 3.009 N/A SER 17.A N THR 14.A OG1 no hydrogen 2.821 N/A SER 17.A OG THR 14.A O no hydrogen 3.144 N/A SER 17.A OG THR 14.A OG1 no hydrogen 3.171 N/A LYS 18.A N THR 14.A O no hydrogen 3.073 N/A SER 19.A N TRP 16.A O no hydrogen 3.074 N/A SER 19.A OG GLU 15.A O no hydrogen 3.139 N/A SER 19.A OG TRP 16.A O no hydrogen 2.870 N/A SER 19.A OG GLN 21.A OE1 no hydrogen 2.453 N/A GLY 20.A N SER 17.A O no hydrogen 3.449 N/A GLN 21.A N TRP 16.A O no hydrogen 3.046 N/A GLN 21.A NE2 GLY 104.A O no hydrogen 3.191 N/A TYR 22.A OH THR 106.A OG1 no hydrogen 2.570 N/A THR 23.A OG1 GLN 21.A O no hydrogen 3.401 N/A GLY 24.A N GLU 103.A OE1 no hydrogen 3.092 N/A GLY 24.A N GLU 103.A OE2 no hydrogen 3.013 N/A THR 26.A N GLU 103.A OE2 no hydrogen 2.913 N/A THR 26.A OG1 GLU 103.A OE2 no hydrogen 2.364 N/A LEU 30.A N GLN 69.A OE1 no hydrogen 2.841 N/A THR 31.A N GLN 13.A O no hydrogen 2.819 N/A THR 31.A OG1 GLN 13.A O no hydrogen 3.173 N/A THR 31.A OG1 GLN 13.A OE1 no hydrogen 2.419 N/A GLY 34.A N THR 31.A OG1 no hydrogen 3.069 N/A GLU 35.A N THR 31.A O no hydrogen 3.046 N/A GLY 36.A N PRO 32.A O no hydrogen 3.181 N/A GLN 37.A N TYR 33.A O no hydrogen 2.871 N/A ARG 39.A N GLY 36.A O no hydrogen 3.004 N/A THR 40.A N GLN 37.A O no hydrogen 3.173 N/A THR 40.A OG1 GLN 37.A O no hydrogen 2.471 N/A GLU 42.A N LEU 38.A O no hydrogen 3.180 N/A SER 43.A N ARG 39.A O no hydrogen 2.913 N/A VAL 44.A N THR 40.A O no hydrogen 2.770 N/A PHE 45.A N GLY 41.A O no hydrogen 2.976 N/A ARG 46.A N GLU 42.A O no hydrogen 2.976 N/A ASN 48.A N PHE 45.A O no hydrogen 2.973 N/A GLN 49.A N ARG 46.A O no hydrogen 3.499 N/A ASP 54.A N ASN 52.A OD1 no hydrogen 2.682 N/A ASN 55.A N ASN 52.A O no hydrogen 2.793 N/A ILE 56.A N PRO 53.A O no hydrogen 3.234 N/A THR 57.A N ASP 166.A O no hydrogen 3.036 N/A THR 57.A OG1 SER 165.A OG no hydrogen 2.979 N/A TYR 58.A OH THR 207.A OG1 no hydrogen 2.908 N/A ILE 59.A N ARG 87.A O no hydrogen 2.793 N/A THR 61.A N VAL 89.A O no hydrogen 2.965 N/A THR 61.A OG1 SER 62.A O no hydrogen 2.896 N/A THR 61.A OG1 PHE 169.A O no hydrogen 3.503 N/A SER 62.A N PHE 169.A O no hydrogen 3.054 N/A SER 62.A OG HIS 171.A NE2 no hydrogen 2.716 N/A ARG 64.A N SER 62.A OG no hydrogen 3.008 N/A LEU 65.A N ASP 27.A OD1 no hydrogen 2.635 N/A ARG 66.A NH1 GLY 24.A O no hydrogen 3.472 N/A ARG 66.A NH2 GLY 24.A O no hydrogen 3.116 N/A ALA 67.A N ARG 64.A O no hydrogen 3.191 N/A ARG 68.A N ARG 64.A O no hydrogen 3.061 N/A ARG 68.A NE PRO 63.A O no hydrogen 3.450 N/A GLN 69.A N LEU 65.A O no hydrogen 2.738 N/A THR 70.A N ARG 66.A O no hydrogen 3.183 N/A THR 70.A OG1 ARG 66.A O no hydrogen 2.616 N/A VAL 71.A N ALA 67.A O no hydrogen 3.064 N/A ASP 72.A N ARG 68.A O no hydrogen 3.258 N/A LEU 73.A N GLN 69.A O no hydrogen 3.079 N/A VAL 74.A N THR 70.A O no hydrogen 2.888 N/A LEU 75.A N VAL 71.A O no hydrogen 3.165 N/A LYS 76.A N LEU 73.A O no hydrogen 3.423 N/A LEU 78.A N LEU 75.A O no hydrogen 3.097 N/A SER 79.A N GLN 82.A OE1 no hydrogen 2.465 N/A SER 79.A OG GLN 82.A OE1 no hydrogen 3.425 N/A GLN 82.A N SER 79.A OG no hydrogen 2.995 N/A ARG 83.A N SER 79.A O no hydrogen 2.782 N/A ARG 83.A NH1 ASP 80.A OD1 no hydrogen 2.817 N/A ARG 83.A NH2 LEU 75.A O no hydrogen 2.849 N/A ALA 84.A N ASP 80.A O no hydrogen 2.897 N/A ALA 84.A N GLU 81.A O no hydrogen 3.289 N/A LYS 85.A NZ GLU 81.A OE2 no hydrogen 3.284 N/A ILE 86.A N ARG 83.A O no hydrogen 3.297 N/A ARG 87.A N THR 57.A O no hydrogen 3.183 N/A VAL 89.A N ILE 59.A O no hydrogen 2.710 N/A ASP 91.A N THR 61.A O no hydrogen 2.733 N/A ASP 92.A N SER 202.A O no hydrogen 2.771 N/A ASP 93.A N ASP 91.A OD1 no hydrogen 3.022 N/A LEU 94.A N ASP 91.A O no hydrogen 2.783 N/A ARG 95.A N ASP 92.A O no hydrogen 3.219 N/A ARG 95.A NE GLU 98.A OE2 no hydrogen 3.213 N/A ARG 95.A NH1 ASP 92.A O no hydrogen 3.309 N/A ARG 95.A NH2 GLU 98.A OE2 no hydrogen 3.456 N/A TRP 97.A N GLU 96.A OE1 no hydrogen 2.863 N/A TRP 97.A NE1 GLU 135.A O no hydrogen 2.931 N/A GLU 98.A N GLU 135.A OE1 no hydrogen 3.307 N/A TYR 99.A OH HIS 173.A ND1 no hydrogen 2.550 N/A ASP 101.A N GLU 132.A O no hydrogen 2.823 N/A TYR 102.A N TYR 99.A O no hydrogen 2.823 N/A TYR 102.A OH GLU 132.A OE1 no hydrogen 2.543 N/A GLU 103.A N GLY 100.A O no hydrogen 3.045 N/A GLY 104.A N TYR 22.A O no hydrogen 2.809 N/A THR 106.A OG1 TYR 22.A OH no hydrogen 2.570 N/A ILE 109.A N LEU 105.A O no hydrogen 2.836 N/A ILE 110.A N THR 106.A O no hydrogen 2.988 N/A GLU 111.A N ARG 107.A O no hydrogen 2.994 N/A LEU 112.A N GLU 108.A O no hydrogen 2.923 N/A ARG 113.A N ILE 109.A O no hydrogen 2.883 N/A ARG 113.A NE ASP 119.A OD1 no hydrogen 3.239 N/A ARG 113.A NE ASP 119.A OD2 no hydrogen 2.723 N/A ARG 113.A NH1 TYR 102.A OH no hydrogen 2.599 N/A ARG 113.A NH2 ASP 119.A OD1 no hydrogen 2.727 N/A LYS 114.A N ILE 110.A O no hydrogen 2.861 N/A SER 115.A N GLU 111.A O no hydrogen 3.065 N/A SER 115.A OG LEU 112.A O no hydrogen 2.555 N/A ARG 116.A N ARG 113.A O no hydrogen 2.910 N/A ARG 116.A NH1 GLU 132.A OE1 no hydrogen 2.845 N/A ARG 116.A NH2 ASP 101.A OD2 no hydrogen 2.896 N/A GLY 117.A N LYS 114.A O no hydrogen 3.049 N/A LEU 118.A N ARG 113.A O no hydrogen 3.068 N/A TRP 124.A NE1 GLY 130.A O no hydrogen 3.225 N/A ASN 125.A N ASP 129.A OD2 no hydrogen 3.137 N/A ASN 125.A ND2 ASP 221.A OD1 no hydrogen 2.752 N/A ARG 128.A N ASN 125.A O no hydrogen 3.123 N/A ARG 128.A N ASN 125.A OD1 no hydrogen 3.316 N/A ARG 128.A NE ASP 129.A OD1 no hydrogen 3.360 N/A ARG 128.A NH2 PRO 123.A O no hydrogen 3.247 N/A ARG 128.A NH2 ASP 129.A OD2 no hydrogen 2.895 N/A ASP 129.A N ASN 125.A O no hydrogen 2.692 N/A GLY 130.A N ILE 126.A O no hydrogen 2.728 N/A CYS 131.A N GLU 135.A O no hydrogen 2.995 N/A GLU 132.A N TYR 102.A OH no hydrogen 3.486 N/A GLY 134.A N CYS 131.A O no hydrogen 2.794 N/A GLU 135.A N GLU 98.A O no hydrogen 2.967 N/A THR 136.A N GLN 139.A OE1 no hydrogen 2.730 N/A THR 136.A OG1 GLN 139.A OE1 no hydrogen 3.554 N/A THR 137.A OG1 TRP 127.A O no hydrogen 2.869 N/A THR 137.A OG1 TYR 177.A OH no hydrogen 2.712 N/A THR 137.A OG1 LEU 219.A O no hydrogen 3.062 N/A GLN 139.A N THR 136.A O no hydrogen 3.123 N/A GLN 139.A N THR 136.A OG1 no hydrogen 2.866 N/A ILE 140.A N THR 136.A O no hydrogen 3.386 N/A GLY 141.A N THR 137.A O no hydrogen 2.923 N/A LEU 142.A N GLN 138.A O no hydrogen 2.981 N/A ARG 143.A N GLN 139.A O no hydrogen 3.363 N/A ARG 143.A NE GLU 135.A OE1 no hydrogen 3.182 N/A ARG 143.A NE GLU 135.A OE2 no hydrogen 3.040 N/A ARG 143.A NH1 ASP 93.A O no hydrogen 2.932 N/A ARG 143.A NH1 ARG 95.A O no hydrogen 2.734 N/A ARG 143.A NH2 ARG 95.A O no hydrogen 3.080 N/A ARG 143.A NH2 GLU 135.A OE1 no hydrogen 2.709 N/A LEU 144.A N ILE 140.A O no hydrogen 2.966 N/A SER 145.A N GLY 141.A O no hydrogen 2.814 N/A SER 145.A OG GLY 141.A O no hydrogen 2.586 N/A SER 145.A OG ARG 217.A O no hydrogen 2.997 N/A ARG 146.A N LEU 142.A O no hydrogen 3.063 N/A ARG 146.A NE ASP 93.A OD2 no hydrogen 3.423 N/A ARG 146.A NH2 ASP 93.A OD1 no hydrogen 2.741 N/A ARG 146.A NH2 ASP 93.A OD2 no hydrogen 3.408 N/A ALA 147.A N ARG 143.A O no hydrogen 3.133 N/A ILE 148.A N LEU 144.A O no hydrogen 2.918 N/A ALA 149.A N SER 145.A O no hydrogen 2.836 N/A ARG 150.A N ARG 146.A O no hydrogen 3.082 N/A ARG 150.A NH1 ASP 91.A OD2 no hydrogen 2.786 N/A ARG 150.A NH1 ASP 93.A OD2 no hydrogen 2.754 N/A ARG 150.A NH2 ASP 93.A OD2 no hydrogen 3.524 N/A ILE 151.A N ALA 147.A O no hydrogen 2.966 N/A GLN 152.A N ILE 148.A O no hydrogen 2.714 N/A ASN 153.A N ALA 149.A O no hydrogen 2.922 N/A LEU 154.A N ARG 150.A O no hydrogen 3.152 N/A HIS 155.A N ILE 151.A O no hydrogen 2.997 N/A HIS 155.A ND1 TYR 237.A OH no hydrogen 2.567 N/A HIS 155.A NE2 ARG 5.A O no hydrogen 3.124 N/A ARG 156.A N GLN 152.A O no hydrogen 2.935 N/A ARG 156.A NH1 ASP 243.A OD1 no hydrogen 3.474 N/A ARG 156.A NH2 ASP 243.A OD1 no hydrogen 3.093 N/A LYS 157.A N ASN 153.A O no hydrogen 3.003 N/A HIS 158.A N LEU 154.A O no hydrogen 2.847 N/A HIS 158.A ND1 SER 165.A OG no hydrogen 2.789 N/A GLN 159.A N HIS 155.A O no hydrogen 2.860 N/A GLN 159.A NE2 HIS 240.A O no hydrogen 2.949 N/A SER 160.A N ARG 156.A O no hydrogen 2.830 N/A SER 160.A OG LYS 157.A O no hydrogen 2.989 N/A GLU 161.A N LYS 157.A O no hydrogen 2.818 N/A GLY 162.A N GLN 159.A O no hydrogen 2.594 N/A ARG 163.A N HIS 158.A O no hydrogen 2.986 N/A ARG 163.A NH1 GLU 161.A OE1 no hydrogen 3.391 N/A SER 165.A OG THR 57.A OG1 no hydrogen 2.979 N/A SER 165.A OG HIS 158.A ND1 no hydrogen 2.789 N/A ASP 166.A N ASN 55.A O no hydrogen 2.927 N/A ILE 167.A N ARG 5.A O no hydrogen 2.943 N/A PHE 169.A N PHE 60.A O no hydrogen 2.901 N/A ALA 170.A N VAL 9.A O no hydrogen 3.150 N/A HIS 171.A NE2 SER 62.A OG no hydrogen 2.716 N/A HIS 173.A N GLU 96.A OE2 no hydrogen 2.988 N/A HIS 173.A ND1 TYR 99.A OH no hydrogen 2.550 N/A ALA 174.A N GLU 96.A OE1 no hydrogen 2.935 N/A LEU 175.A N HIS 171.A O no hydrogen 2.842 N/A ARG 176.A N GLY 172.A O no hydrogen 3.308 N/A ARG 176.A NE GLY 172.A O no hydrogen 2.986 N/A TYR 177.A N HIS 173.A O no hydrogen 2.986 N/A TYR 177.A OH THR 137.A OG1 no hydrogen 2.712 N/A PHE 178.A N ALA 174.A O no hydrogen 2.816 N/A ALA 179.A N LEU 175.A O no hydrogen 2.834 N/A ALA 180.A N ARG 176.A O no hydrogen 2.874 N/A ILE 181.A N TYR 177.A O no hydrogen 3.161 N/A TRP 182.A N PHE 178.A O no hydrogen 2.906 N/A TRP 182.A NE1 SER 236.A O no hydrogen 3.132 N/A PHE 183.A N ALA 179.A O no hydrogen 3.428 N/A GLY 184.A N ILE 181.A O no hydrogen 3.128 N/A LEU 185.A N ALA 180.A O no hydrogen 2.993 N/A VAL 187.A N HIS 218.A O no hydrogen 2.745 N/A GLN 188.A NE2 SER 215.A OG no hydrogen 2.779 N/A LYS 189.A N TYR 216.A O no hydrogen 2.868 N/A LYS 189.A NZ GLU 196.A OE2 no hydrogen 3.084 N/A CYS 191.A N GLU 214.A O no hydrogen 3.080 N/A CYS 191.A SG LEU 213.A O no hydrogen 3.668 N/A GLU 192.A N GLU 196.A OE1 no hydrogen 3.221 N/A ILE 197.A N ILE 194.A O no hydrogen 3.362 N/A GLN 198.A N ILE 194.A O no hydrogen 3.166 N/A SER 202.A OG ASP 91.A OD1 no hydrogen 2.751 N/A TYR 203.A OH VAL 208.A O no hydrogen 2.900 N/A THR 207.A N ASP 205.A OD1 no hydrogen 2.960 N/A THR 207.A OG1 TYR 58.A OH no hydrogen 2.908 N/A THR 207.A OG1 ASP 205.A OD1 no hydrogen 2.563 N/A VAL 208.A N ASP 205.A O no hydrogen 2.855 N/A TYR 216.A N LYS 189.A O no hydrogen 2.709 N/A ARG 217.A N SER 145.A OG no hydrogen 3.177 N/A ARG 217.A NE GLN 188.A OE1 no hydrogen 2.872 N/A HIS 218.A N VAL 187.A O no hydrogen 3.182 N/A HIS 218.A ND1 LEU 219.A O no hydrogen 3.009 N/A LEU 219.A N TYR 177.A OH no hydrogen 3.155 N/A ASN 222.A N ASP 221.A OD1 no hydrogen 2.580 N/A CYS 224.A N ASN 222.A OD1 no hydrogen 2.791 N/A CYS 224.A SG ASN 222.A O no hydrogen 3.718 N/A ALA 229.A N ASP 228.A OD1 no hydrogen 2.373 N/A GLY 230.A N ARG 10.A O no hydrogen 3.000 N/A GLY 230.A N HIS 11.A O no hydrogen 3.267 N/A GLY 231.A N ASP 228.A O no hydrogen 2.989 N/A GLY 233.A N ILE 8.A O no hydrogen 2.811 N/A LEU 235.A N CYS 6.A O no hydrogen 2.810 N/A SER 236.A N ALA 246.A O no hydrogen 2.673 N/A SER 236.A OG PRO 4.A O no hydrogen 2.720 N/A TYR 237.A OH HIS 155.A ND1 no hydrogen 2.567 N/A ALA 238.A N GLU 244.A O no hydrogen 2.899 N/A HIS 239.A ND1 GLU 244.A OE1 no hydrogen 2.912 N/A ASN 241.A N ALA 238.A O no hydrogen 2.773 N/A ASP 243.A N ASN 241.A OD1 no hydrogen 2.551 N/A GLU 244.A N ASN 241.A O no hydrogen 2.777 N/A ALA 246.A N SER 236.A O no hydrogen 2.950 N/A GLU 248.A N VAL 234.A O no hydrogen 2.786 N/A GLU 258.A N GLU 258.A OE1 no hydrogen 2.823 N/A GLU 259.A N PRO 256.A O no hydrogen 2.648 N/A GLU 260.A N PRO 257.A O no hydrogen 3.268 N/A VAL 266.A N ASP 265.A OD1 no hydrogen 2.769 N/A