Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6azd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 84.A OE2 no hydrogen 3.270 N/A SER 5.A N SER 1.A O no hydrogen 2.873 N/A SER 5.A OG SER 1.A O no hydrogen 2.701 N/A THR 6.A N PRO 2.A O no hydrogen 2.847 N/A THR 6.A OG1 PRO 2.A O no hydrogen 2.443 N/A HIS 7.A N LEU 3.A O no hydrogen 3.320 N/A HIS 7.A ND1 ASP 51.A O no hydrogen 2.923 N/A ASN 8.A N SER 5.A O no hydrogen 3.000 N/A ASN 8.A ND2 ASP 51.A OD2 no hydrogen 3.025 N/A ASN 8.A ND2 SER 57.A O no hydrogen 2.754 N/A VAL 9.A N LEU 4.A O no hydrogen 2.911 N/A THR 10.A N LEU 49.A O no hydrogen 2.836 N/A THR 10.A OG1 ASN 8.A O no hydrogen 3.125 N/A THR 10.A OG1 GLN 30.A OE1 no hydrogen 2.969 N/A LEU 12.A N VAL 47.A O no hydrogen 2.844 N/A ASN 14.A ND2 ASP 17.A OD2 no hydrogen 2.998 N/A ASP 17.A N ASN 14.A O no hydrogen 3.172 N/A VAL 20.A N GLN 46.A O no hydrogen 2.761 N/A VAL 21.A N VAL 91.A O no hydrogen 2.768 N/A LEU 22.A N VAL 48.A O no hydrogen 3.003 N/A GLY 23.A N VAL 93.A O no hydrogen 2.740 N/A HIS 24.A ND1 GLY 25.A O no hydrogen 2.920 N/A THR 28.A N GLY 25.A O no hydrogen 3.419 N/A THR 28.A OG1 ASP 29.A O no hydrogen 3.213 N/A ASP 29.A N THR 28.A OG1 no hydrogen 2.597 N/A GLN 30.A N ASP 51.A OD1 no hydrogen 3.071 N/A GLN 30.A NE2 ASN 8.A O no hydrogen 2.999 N/A GLN 30.A NE2 ASP 51.A OD1 no hydrogen 2.671 N/A SER 31.A N ASP 29.A OD1 no hydrogen 2.746 N/A SER 31.A OG ASP 29.A OD1 no hydrogen 2.335 N/A VAL 32.A N ASP 29.A O no hydrogen 2.982 N/A TRP 33.A N GLN 30.A O no hydrogen 2.965 N/A LYS 34.A N SER 31.A O no hydrogen 2.939 N/A LYS 34.A NZ GLU 174.A OE1 no hydrogen 2.858 N/A LYS 34.A NZ GLU 174.A OE2 no hydrogen 3.067 N/A THR 36.A N TRP 33.A O no hydrogen 2.959 N/A VAL 37.A N TRP 33.A O no hydrogen 3.048 N/A LEU 40.A N THR 36.A O no hydrogen 3.300 N/A VAL 41.A N VAL 37.A O no hydrogen 2.957 N/A ASN 42.A N PRO 38.A O no hydrogen 3.004 N/A GLN 43.A N SER 39.A O no hydrogen 3.064 N/A GLN 43.A N LEU 40.A O no hydrogen 3.261 N/A ASN 44.A N VAL 41.A O no hydrogen 2.942 N/A PHE 45.A N LEU 40.A O no hydrogen 3.117 N/A GLN 46.A N PRO 18.A O no hydrogen 2.766 N/A VAL 47.A N LEU 12.A O no hydrogen 2.647 N/A VAL 48.A N VAL 20.A O no hydrogen 2.791 N/A LEU 49.A N THR 10.A O no hydrogen 2.779 N/A TYR 50.A OH TYR 92.A OH no hydrogen 2.624 N/A ASP 51.A N HIS 7.A O no hydrogen 2.794 N/A THR 52.A N HIS 24.A NE2 no hydrogen 3.033 N/A ALA 55.A N THR 52.A O no hydrogen 3.139 N/A SER 57.A OG ASP 51.A OD2 no hydrogen 2.507 N/A THR 58.A N ALA 55.A O no hydrogen 2.934 N/A SER 61.A N GLU 59.A OE2 no hydrogen 3.358 N/A SER 61.A OG GLU 59.A OE2 no hydrogen 2.626 N/A ARG 67.A N ASN 64.A OD1 no hydrogen 3.065 N/A ARG 67.A NE TYR 68.A OH no hydrogen 3.263 N/A ARG 67.A NH2 ASP 77.A OD1 no hydrogen 3.041 N/A TYR 68.A N ASN 64.A O no hydrogen 3.180 N/A TYR 68.A OH ASP 77.A OD2 no hydrogen 2.495 N/A SER 69.A N LYS 66.A O no hydrogen 3.086 N/A SER 69.A OG LYS 66.A O no hydrogen 2.480 N/A GLN 72.A N SER 70.A OG no hydrogen 3.180 N/A GLN 72.A NE2 ASP 76.A OD1 no hydrogen 2.588 N/A GLN 72.A NE2 ASP 76.A OD2 no hydrogen 3.529 N/A GLN 72.A NE2 GLU 108.A OE1 no hydrogen 2.976 N/A VAL 75.A N LEU 71.A O no hydrogen 2.832 N/A ASP 76.A N GLN 72.A O no hydrogen 2.856 N/A ASP 77.A N GLY 73.A O no hydrogen 2.973 N/A LEU 78.A N HIS 74.A O no hydrogen 2.907 N/A LEU 79.A N VAL 75.A O no hydrogen 2.972 N/A ALA 80.A N ASP 76.A O no hydrogen 2.960 N/A ILE 81.A N ASP 77.A O no hydrogen 3.032 N/A LEU 82.A N LEU 78.A O no hydrogen 3.127 N/A ASP 83.A N LEU 79.A O no hydrogen 3.151 N/A GLU 84.A N ALA 80.A O no hydrogen 3.001 N/A LEU 85.A N ILE 81.A O no hydrogen 2.945 N/A GLU 86.A N ASP 83.A O no hydrogen 2.908 N/A ILE 87.A N LEU 82.A O no hydrogen 2.973 N/A ASN 89.A ND2 ASP 111.A O no hydrogen 3.502 N/A CYS 90.A N LEU 112.A O no hydrogen 3.029 N/A CYS 90.A SG LEU 112.A O no hydrogen 3.417 N/A VAL 91.A N VAL 19.A O no hydrogen 3.049 N/A TYR 92.A N LYS 115.A O no hydrogen 3.006 N/A TYR 92.A OH TYR 50.A OH no hydrogen 2.624 N/A VAL 93.A N VAL 21.A O no hydrogen 2.723 N/A GLY 94.A N ILE 117.A O no hydrogen 2.852 N/A HIS 95.A N GLY 23.A O no hydrogen 3.128 N/A HIS 95.A NE2 HIS 247.A O no hydrogen 2.791 N/A SER 96.A N LEU 119.A O no hydrogen 2.829 N/A SER 96.A OG HIS 247.A NE2 no hydrogen 2.786 N/A SER 98.A N HIS 95.A O no hydrogen 2.895 N/A SER 98.A OG HIS 24.A O no hydrogen 2.887 N/A GLY 99.A N SER 96.A O no hydrogen 2.753 N/A ILE 101.A N MET 97.A O no hydrogen 3.297 N/A GLY 102.A N SER 98.A O no hydrogen 3.037 N/A VAL 103.A N GLY 99.A O no hydrogen 3.060 N/A LEU 104.A N MET 100.A O no hydrogen 2.766 N/A ALA 105.A N ILE 101.A O no hydrogen 2.778 N/A SER 106.A N GLY 102.A O no hydrogen 2.825 N/A SER 106.A OG VAL 103.A O no hydrogen 2.703 N/A LEU 107.A N VAL 103.A O no hydrogen 3.016 N/A GLU 108.A N LEU 104.A O no hydrogen 3.284 N/A GLU 108.A N ALA 105.A O no hydrogen 3.115 N/A ARG 109.A N ALA 105.A O no hydrogen 2.872 N/A ARG 109.A NE ASP 111.A OD1 no hydrogen 3.115 N/A ARG 109.A NH2 ASP 111.A OD2 no hydrogen 3.069 N/A LEU 112.A N ARG 109.A O no hydrogen 2.974 N/A PHE 113.A N PRO 110.A O no hydrogen 3.296 N/A ARG 114.A N CYS 90.A O no hydrogen 2.803 N/A ARG 114.A NE ASN 89.A OD1 no hydrogen 2.636 N/A LYS 115.A NZ CYS 264.A O no hydrogen 2.641 N/A LYS 115.A NZ ILE 265.A O no hydrogen 2.961 N/A LEU 116.A N PRO 209.A O no hydrogen 2.857 N/A ILE 117.A N TYR 92.A O no hydrogen 2.839 N/A LEU 118.A N HIS 211.A O no hydrogen 2.825 N/A LEU 119.A N GLY 94.A O no hydrogen 2.904 N/A SER 120.A N VAL 213.A O no hydrogen 2.906 N/A SER 120.A OG HIS 247.A O no hydrogen 3.294 N/A ARG 124.A N SER 122.A OG no hydrogen 3.312 N/A ARG 124.A NE LEU 126.A O no hydrogen 2.955 N/A ARG 124.A NH1 ASP 198.A OD2 no hydrogen 2.618 N/A ARG 124.A NH2 ASN 127.A O no hydrogen 3.074 N/A ASN 127.A N PHE 135.A O no hydrogen 2.740 N/A ASN 127.A ND2 GLU 136.A OE2 no hydrogen 2.853 N/A ASP 128.A N TYR 131.A O no hydrogen 2.805 N/A SER 129.A N ASP 128.A OD1 no hydrogen 2.629 N/A SER 130.A OG SER 129.A O no hydrogen 2.597 N/A TYR 131.A N ASP 128.A O no hydrogen 3.170 N/A TYR 131.A OH ARG 124.A O no hydrogen 2.730 N/A GLY 133.A N ASN 127.A OD1 no hydrogen 2.966 N/A GLY 134.A N ASN 127.A OD1 no hydrogen 2.963 N/A PHE 135.A N TYR 125.A O no hydrogen 3.131 N/A GLU 136.A N ASP 139.A OD1 no hydrogen 3.442 N/A GLN 137.A NE2 ASP 141.A OD1 no hydrogen 2.943 N/A GLN 137.A NE2 GLN 196.A OE1 no hydrogen 2.782 N/A LEU 140.A N GLU 136.A O no hydrogen 3.145 N/A ASP 141.A N GLN 137.A O no hydrogen 2.874 N/A GLN 142.A N GLU 138.A O no hydrogen 3.045 N/A LEU 143.A N ASP 139.A O no hydrogen 2.774 N/A PHE 144.A N LEU 140.A O no hydrogen 2.770 N/A SER 145.A N ASP 141.A O no hydrogen 2.937 N/A SER 146.A N GLN 142.A O no hydrogen 2.957 N/A SER 146.A OG GLN 142.A O no hydrogen 3.272 N/A MET 147.A N LEU 143.A O no hydrogen 3.037 N/A ARG 148.A N PHE 144.A O no hydrogen 3.022 N/A SER 149.A N SER 145.A O no hydrogen 2.906 N/A SER 149.A OG SER 145.A O no hydrogen 2.572 N/A ASN 150.A N SER 146.A O no hydrogen 3.110 N/A ALA 153.A N ASN 150.A OD1 no hydrogen 3.114 N/A TRP 154.A N ASN 150.A O no hydrogen 2.878 N/A VAL 155.A N PHE 151.A O no hydrogen 2.796 N/A SER 156.A N SER 152.A O no hydrogen 3.047 N/A SER 156.A OG SER 152.A O no hydrogen 2.662 N/A GLY 157.A N ALA 153.A O no hydrogen 3.184 N/A PHE 158.A N TRP 154.A O no hydrogen 2.833 N/A ALA 159.A N VAL 155.A O no hydrogen 2.753 N/A THR 160.A N SER 156.A O no hydrogen 3.283 N/A THR 160.A OG1 SER 156.A O no hydrogen 3.302 N/A THR 160.A OG1 GLY 157.A O no hydrogen 2.877 N/A ALA 161.A N GLY 157.A O no hydrogen 3.230 N/A ALA 162.A N PHE 158.A O no hydrogen 2.746 N/A VAL 163.A N ALA 159.A O no hydrogen 2.919 N/A GLY 164.A N THR 160.A O no hydrogen 3.342 N/A THR 165.A N ASP 245.A OD2 no hydrogen 2.845 N/A THR 165.A OG1 ASP 245.A OD1 no hydrogen 3.192 N/A ASP 169.A N ASP 166.A O no hydrogen 2.778 N/A GLU 170.A N ASP 166.A OD1 no hydrogen 3.007 N/A ALA 171.A N ASP 166.A OD1 no hydrogen 2.945 N/A VAL 172.A N ASP 166.A OD2 no hydrogen 3.253 N/A GLU 174.A N GLU 170.A O no hydrogen 2.963 N/A PHE 175.A N ALA 171.A O no hydrogen 2.772 N/A SER 176.A N VAL 172.A O no hydrogen 2.820 N/A SER 176.A OG VAL 172.A O no hydrogen 2.725 N/A SER 177.A N GLN 173.A O no hydrogen 2.950 N/A SER 177.A N GLU 174.A O no hydrogen 3.232 N/A SER 177.A OG GLN 173.A O no hydrogen 2.663 N/A THR 178.A N GLU 174.A O no hydrogen 3.309 N/A THR 178.A OG1 GLY 27.A O no hydrogen 2.801 N/A THR 178.A OG1 GLU 174.A O no hydrogen 3.440 N/A THR 178.A OG1 PHE 175.A O no hydrogen 3.109 N/A PHE 179.A N PHE 175.A O no hydrogen 3.115 N/A ILE 180.A N SER 176.A O no hydrogen 2.918 N/A SER 181.A N SER 177.A O no hydrogen 3.235 N/A SER 181.A N THR 178.A O no hydrogen 3.291 N/A SER 181.A OG SER 177.A O no hydrogen 3.516 N/A SER 181.A OG THR 178.A O no hydrogen 2.540 N/A MET 182.A N PHE 179.A O no hydrogen 3.092 N/A ARG 183.A NE ASP 185.A OD1 no hydrogen 3.082 N/A ARG 183.A NH1 THR 60.A O no hydrogen 2.544 N/A ARG 183.A NH2 ASP 185.A OD1 no hydrogen 3.456 N/A ARG 183.A NH2 ASP 185.A OD2 no hydrogen 2.603 N/A VAL 186.A N ASP 185.A OD1 no hydrogen 2.744 N/A ALA 187.A N ARG 183.A O no hydrogen 2.997 N/A LEU 188.A N PRO 184.A O no hydrogen 2.809 N/A ARG 189.A N ASP 185.A O no hydrogen 2.966 N/A ARG 189.A NH1 GLN 192.A OE1 no hydrogen 2.843 N/A THR 190.A N VAL 186.A O no hydrogen 2.971 N/A THR 190.A OG1 VAL 186.A O no hydrogen 2.818 N/A SER 191.A N ALA 187.A O no hydrogen 2.859 N/A SER 191.A OG ALA 187.A O no hydrogen 2.587 N/A GLN 192.A N LEU 188.A O no hydrogen 2.772 N/A PHE 193.A N ARG 189.A O no hydrogen 3.214 N/A VAL 194.A N THR 190.A O no hydrogen 2.929 N/A PHE 195.A N SER 191.A O no hydrogen 2.790 N/A GLN 196.A NE2 GLN 192.A O no hydrogen 3.350 N/A SER 197.A N VAL 194.A O no hydrogen 3.104 N/A SER 197.A OG VAL 194.A O no hydrogen 2.637 N/A PHE 199.A N PRO 123.A O no hydrogen 2.792 N/A ARG 200.A N ASP 198.A OD1 no hydrogen 3.196 N/A ARG 200.A NE ASP 198.A OD1 no hydrogen 2.959 N/A ARG 200.A NH2 ASP 128.A OD2 no hydrogen 2.882 N/A ARG 200.A NH2 ASP 198.A OD2 no hydrogen 2.943 N/A LEU 203.A N ARG 200.A O no hydrogen 3.331 N/A GLU 205.A N ILE 202.A O no hydrogen 2.974 N/A VAL 206.A N LEU 203.A O no hydrogen 2.981 N/A CYS 210.A N TRP 236.A O no hydrogen 2.872 N/A CYS 210.A SG VAL 208.A O no hydrogen 3.689 N/A HIS 211.A N LEU 116.A O no hydrogen 2.805 N/A ILE 212.A N SER 238.A O no hydrogen 2.717 N/A VAL 213.A N LEU 118.A O no hydrogen 2.848 N/A GLN 214.A N ASP 240.A O no hydrogen 3.406 N/A GLN 214.A NE2 SER 215.A O no hydrogen 3.023 N/A GLN 214.A NE2 VAL 221.A O no hydrogen 2.960 N/A SER 215.A OG THR 244.A OG1 no hydrogen 3.181 N/A SER 215.A OG GLY 246.A O no hydrogen 2.720 N/A ARG 216.A N LEU 242.A O no hydrogen 2.967 N/A ARG 216.A N THR 244.A O no hydrogen 3.125 N/A ARG 216.A NH1 ARG 216.A O no hydrogen 3.485 N/A LYS 217.A N THR 244.A O no hydrogen 3.380 N/A ALA 220.A N ASP 218.A OD1 no hydrogen 2.969 N/A VAL 221.A N ASP 218.A O no hydrogen 2.936 N/A VAL 225.A N PRO 222.A O no hydrogen 2.787 N/A ALA 226.A N ILE 223.A O no hydrogen 3.021 N/A GLU 227.A N ILE 223.A O no hydrogen 3.380 N/A TYR 228.A N GLU 224.A O no hydrogen 2.996 N/A LEU 229.A N VAL 225.A O no hydrogen 2.990 N/A ARG 230.A N ALA 226.A O no hydrogen 3.023 N/A ARG 230.A NE GLU 227.A OE1 no hydrogen 3.124 N/A ARG 230.A NH2 GLU 227.A OE1 no hydrogen 3.503 N/A ARG 230.A NH2 GLU 227.A OE2 no hydrogen 2.552 N/A CYS 231.A N GLU 227.A O no hydrogen 3.110 N/A CYS 231.A N TYR 228.A O no hydrogen 3.237 N/A CYS 231.A SG GLU 227.A O no hydrogen 3.368 N/A CYS 231.A SG GLU 227.A OE2 no hydrogen 3.050 N/A ASN 232.A N LEU 229.A O no hydrogen 3.308 N/A ASN 232.A ND2 TYR 228.A O no hydrogen 2.948 N/A LEU 233.A N LEU 229.A O no hydrogen 3.000 N/A GLY 234.A N LEU 203.A O no hydrogen 3.042 N/A THR 237.A OG1 ARG 230.A O no hydrogen 2.906 N/A SER 238.A N CYS 210.A O no hydrogen 3.146 N/A ASP 240.A N ILE 212.A O no hydrogen 2.787 N/A LEU 242.A N GLN 214.A O no hydrogen 2.910 N/A GLN 243.A NE2 ILE 241.A O no hydrogen 2.842 N/A THR 244.A OG1 SER 215.A OG no hydrogen 3.181 N/A GLY 246.A N LYS 217.A O no hydrogen 2.844 N/A HIS 247.A N ALA 162.A O no hydrogen 2.588 N/A HIS 247.A ND1 ASP 218.A OD2 no hydrogen 2.893 N/A HIS 247.A NE2 SER 96.A OG no hydrogen 2.786 N/A GLN 250.A N GLN 250.A OE1 no hydrogen 2.728 N/A LEU 251.A N LEU 248.A O no hydrogen 3.093 N/A SER 252.A N LEU 248.A O no hydrogen 3.092 N/A SER 252.A OG LEU 248.A O no hydrogen 3.443 N/A CYS 253.A N PRO 249.A O no hydrogen 2.724 N/A CYS 253.A SG GLU 255.A OE2 no hydrogen 3.005 N/A GLU 255.A N GLU 255.A OE1 no hydrogen 2.714 N/A LEU 256.A N CYS 253.A O no hydrogen 3.159 N/A VAL 257.A N PRO 254.A O no hydrogen 3.052 N/A VAL 258.A N PRO 254.A O no hydrogen 2.800 N/A LEU 261.A N VAL 257.A O no hydrogen 2.861 N/A LEU 262.A N VAL 258.A O no hydrogen 2.783 N/A HIS 263.A N PRO 259.A O no hydrogen 3.033 N/A CYS 264.A N VAL 260.A O no hydrogen 3.035 N/A CYS 264.A SG HIS 211.A ND1 no hydrogen 3.381 N/A CYS 264.A SG ASP 240.A OD2 no hydrogen 3.851 N/A CYS 264.A SG VAL 260.A O no hydrogen 3.345 N/A ILE 265.A N LEU 261.A O no hydrogen 3.107 N/A ASP 266.A N LEU 262.A O no hydrogen 3.295 N/A