Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5cqm_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 18.A N LYS 15.A O no hydrogen 3.024 N/A CYS 20.A SG GLY 38.A O no hydrogen 3.669 N/A ARG 21.A NE ASP 23.A OD1 no hydrogen 2.806 N/A ARG 21.A NH1 ASP 23.A OD1 no hydrogen 3.364 N/A ARG 21.A NH1 ASP 23.A OD2 no hydrogen 2.864 N/A ARG 21.A NH1 VAL 252.A O no hydrogen 3.010 N/A ARG 21.A NH2 GLU 37.A O no hydrogen 2.927 N/A THR 28.A N ALA 32.A O no hydrogen 2.782 N/A THR 28.A OG1 ALA 32.A O no hydrogen 3.556 N/A TRP 30.A N THR 28.A OG1 no hydrogen 3.208 N/A TRP 30.A NE1 PRO 232.A O no hydrogen 2.749 N/A LEU 31.A N THR 28.A O no hydrogen 2.898 N/A ALA 32.A N THR 28.A OG1 no hydrogen 3.009 N/A ILE 34.A N VAL 26.A O no hydrogen 2.894 N/A VAL 35.A N VAL 235.A O no hydrogen 2.867 N/A TRP 36.A NE1 LEU 25.A O no hydrogen 2.965 N/A GLU 37.A N GLU 239.A OE1 no hydrogen 2.717 N/A GLU 37.A N GLU 239.A OE2 no hydrogen 3.178 N/A THR 39.A N TRP 36.A O no hydrogen 3.086 N/A THR 39.A OG1 TRP 36.A O no hydrogen 2.699 N/A LEU 45.A N ASN 41.A O no hydrogen 3.307 N/A ASN 46.A N ILE 42.A O no hydrogen 2.813 N/A GLU 47.A N ASP 43.A O no hydrogen 3.155 N/A GLN 48.A N ILE 44.A O no hydrogen 3.026 N/A PHE 49.A N LEU 45.A O no hydrogen 2.967 N/A ARG 50.A N ASN 46.A O no hydrogen 2.828 N/A LEU 51.A N GLU 47.A O no hydrogen 2.943 N/A GLN 52.A N PHE 49.A O no hydrogen 3.223 N/A ASN 53.A N ARG 50.A O no hydrogen 2.858 N/A THR 54.A N PHE 49.A O no hydrogen 3.220 N/A THR 54.A OG1 PHE 49.A O no hydrogen 2.738 N/A THR 55.A N ASP 124.A OD2 no hydrogen 2.817 N/A ILE 56.A N ARG 86.A O no hydrogen 2.866 N/A GLY 57.A N TYR 125.A O no hydrogen 2.762 N/A LEU 58.A N HIS 88.A O no hydrogen 2.883 N/A THR 59.A N VAL 127.A O no hydrogen 2.822 N/A VAL 60.A N TYR 90.A O no hydrogen 3.012 N/A ALA 62.A N PHE 92.A O no hydrogen 2.764 N/A LYS 64.A N ASP 94.A OD1 no hydrogen 3.099 N/A LYS 64.A N ASP 94.A OD2 no hydrogen 3.180 N/A TYR 66.A N ILE 63.A O no hydrogen 2.963 N/A VAL 67.A N LYS 64.A O no hydrogen 3.364 N/A ALA 68.A N LYS 65.A O no hydrogen 3.237 N/A PHE 69.A N TYR 66.A O no hydrogen 3.004 N/A LEU 70.A N VAL 67.A O no hydrogen 3.230 N/A LYS 71.A NZ GLU 75.A OE1 no hydrogen 2.666 N/A PHE 73.A N PHE 69.A O no hydrogen 3.098 N/A LEU 74.A N LEU 70.A O no hydrogen 2.851 N/A GLU 75.A N LYS 71.A O no hydrogen 2.946 N/A THR 76.A N LEU 72.A O no hydrogen 2.962 N/A THR 76.A OG1 LEU 72.A O no hydrogen 2.863 N/A THR 76.A OG1 PHE 73.A O no hydrogen 3.200 N/A ALA 77.A N PHE 73.A O no hydrogen 2.900 N/A GLU 78.A N LEU 74.A O no hydrogen 2.926 N/A LYS 79.A N.A THR 76.A O no hydrogen 3.062 N/A LYS 79.A N.B GLU 75.A O no hydrogen 3.368 N/A LYS 79.A N.B THR 76.A O no hydrogen 3.062 N/A HIS 80.A N THR 76.A O no hydrogen 3.039 N/A HIS 80.A N ALA 77.A O no hydrogen 3.251 N/A PHE 81.A N ALA 77.A O no hydrogen 2.805 N/A MET 82.A N VAL 139.A O no hydrogen 2.844 N/A HIS 85.A N MET 82.A O no hydrogen 2.991 N/A ARG 86.A NH2 ASN 53.A O no hydrogen 3.488 N/A ARG 86.A NH2 ASN 53.A OD1 no hydrogen 2.787 N/A VAL 87.A N GLY 107.A O no hydrogen 3.321 N/A HIS 88.A N ILE 56.A O no hydrogen 2.901 N/A HIS 88.A NE2 SER 111.A OG no hydrogen 2.740 N/A TYR 89.A N GLN 109.A O no hydrogen 2.777 N/A TYR 89.A OH GLU 78.A OE1 no hydrogen 2.628 N/A TYR 90.A N LEU 58.A O no hydrogen 2.778 N/A TYR 90.A OH GLU 122.A OE2 no hydrogen 2.554 N/A VAL 91.A N SER 111.A O no hydrogen 2.885 N/A PHE 92.A N VAL 60.A O no hydrogen 2.927 N/A THR 93.A N LEU 113.A O no hydrogen 2.978 N/A THR 93.A OG1 ALA 62.A O no hydrogen 2.715 N/A GLN 95.A N THR 93.A OG1 no hydrogen 3.055 N/A GLN 95.A NE2 LYS 64.A O no hydrogen 2.851 N/A GLN 95.A NE2 ASP 94.A OD1 no hydrogen 2.986 N/A ALA 98.A N GLN 95.A O no hydrogen 2.897 N/A VAL 99.A N PRO 96.A O no hydrogen 3.290 N/A GLY 105.A N GLU 78.A OE2 no hydrogen 2.728 N/A ARG 108.A NE GLU 78.A OE1 no hydrogen 2.724 N/A ARG 108.A NH1 PHE 81.A O no hydrogen 3.042 N/A ARG 108.A NH1 MET 82.A O no hydrogen 3.294 N/A ARG 108.A NH2 GLU 78.A OE1 no hydrogen 3.530 N/A ARG 108.A NH2 PHE 81.A O no hydrogen 2.812 N/A ARG 108.A NH2 TYR 89.A OH no hydrogen 2.975 N/A GLN 109.A N VAL 87.A O no hydrogen 2.824 N/A SER 111.A N TYR 89.A O no hydrogen 2.814 N/A SER 111.A OG HIS 88.A NE2 no hydrogen 2.740 N/A LEU 113.A N VAL 91.A O no hydrogen 2.814 N/A VAL 115.A N THR 93.A O no hydrogen 2.960 N/A LEU 120.A N ARG 117.A O no hydrogen 3.120 N/A SER 121.A N ARG 117.A O no hydrogen 3.448 N/A SER 121.A OG ARG 118.A O no hydrogen 3.215 N/A GLU 122.A N ARG 118.A O no hydrogen 3.113 N/A GLU 122.A N PHE 119.A O no hydrogen 3.308 N/A VAL 123.A N PHE 119.A O no hydrogen 3.078 N/A ASP 124.A N THR 55.A O no hydrogen 2.837 N/A TYR 125.A N THR 55.A O no hydrogen 3.281 N/A LEU 126.A N GLY 191.A O no hydrogen 2.847 N/A VAL 127.A N GLY 57.A O no hydrogen 2.811 N/A CYS 128.A N PHE 189.A O no hydrogen 2.784 N/A CYS 128.A SG THR 59.A OG1 no hydrogen 3.641 N/A VAL 129.A N THR 59.A O no hydrogen 3.219 N/A ASP 130.A N ALA 187.A O no hydrogen 3.178 N/A GLU 134.A N THR 259.A O no hydrogen 2.861 N/A PHE 135.A N THR 76.A OG1 no hydrogen 2.918 N/A ARG 136.A N ARG 257.A O no hydrogen 2.813 N/A ARG 136.A NH2 GLN 244.A OE1 no hydrogen 2.494 N/A ASP 137.A N ARG 257.A O no hydrogen 3.317 N/A HIS 138.A N ASP 137.A OD1 no hydrogen 2.760 N/A HIS 138.A NE2 GLU 142.A OE2 no hydrogen 2.773 N/A VAL 139.A N HIS 80.A O no hydrogen 2.946 N/A GLY 140.A N GLU 142.A OE1 no hydrogen 2.920 N/A GLU 142.A N GLU 142.A OE2 no hydrogen 2.820 N/A ILE 143.A N GLY 140.A O no hydrogen 3.095 N/A LEU 144.A N VAL 141.A O no hydrogen 2.948 N/A THR 145.A OG1 THR 233.A OG1 no hydrogen 2.643 N/A LEU 147.A N THR 233.A OG1 no hydrogen 3.039 N/A PHE 148.A N GLY 190.A O no hydrogen 2.808 N/A THR 150.A OG1 PHE 188.A O no hydrogen 2.823 N/A LEU 151.A N LEU 236.A O no hydrogen 2.980 N/A HIS 152.A N TYR 183.A O no hydrogen 2.827 N/A PHE 155.A N HIS 152.A O no hydrogen 3.123 N/A SER 158.A N PHE 155.A O no hydrogen 2.975 N/A SER 159.A OG GLU 161.A OE1 no hydrogen 3.215 N/A ARG 160.A NE GLY 180.A O no hydrogen 2.899 N/A ARG 160.A NH1 GLY 180.A O no hydrogen 2.910 N/A ALA 162.A N SER 159.A O no hydrogen 2.913 N/A PHE 163.A N ARG 160.A O no hydrogen 3.110 N/A THR 164.A OG1 TYR 183.A OH no hydrogen 3.119 N/A TYR 165.A OH PHE 182.A O no hydrogen 2.716 N/A ARG 167.A NH1 ILE 175.A O no hydrogen 2.773 N/A ARG 167.A NH2 ARG 160.A O no hydrogen 2.944 N/A ARG 167.A NH2 PHE 163.A O no hydrogen 3.018 N/A ARG 168.A N GLU 166.A OE1 no hydrogen 2.832 N/A ARG 168.A NE GLU 166.A OE1 no hydrogen 2.716 N/A ARG 168.A NH2 GLU 166.A OE2 no hydrogen 2.835 N/A ARG 168.A NH2 GLU 216.A O no hydrogen 2.489 N/A SER 171.A N ARG 168.A O no hydrogen 3.034 N/A SER 171.A OG ASP 210.A OD1 no hydrogen 3.561 N/A SER 171.A OG ASP 210.A OD2 no hydrogen 2.614 N/A GLN 172.A N ASP 210.A OD1 no hydrogen 2.799 N/A ALA 173.A N SER 171.A OG no hydrogen 3.010 N/A TYR 174.A N SER 171.A O no hydrogen 3.025 N/A ILE 175.A N GLU 166.A O no hydrogen 2.942 N/A GLU 179.A N PRO 176.A O no hydrogen 3.048 N/A TYR 183.A OH THR 164.A O no hydrogen 3.391 N/A TYR 184.A N ASN 224.A OD1 no hydrogen 2.852 N/A MET 185.A N THR 150.A O no hydrogen 3.002 N/A PHE 189.A N CYS 128.A O no hydrogen 3.112 N/A GLY 190.A N PHE 148.A O no hydrogen 3.232 N/A GLY 191.A N LEU 126.A O no hydrogen 2.883 N/A SER 192.A N PRO 146.A O no hydrogen 2.864 N/A GLU 195.A N SER 192.A OG no hydrogen 3.126 N/A VAL 196.A N SER 192.A O no hydrogen 2.892 N/A GLN 197.A N VAL 193.A O no hydrogen 2.929 N/A ARG 198.A N GLN 194.A O no hydrogen 2.981 N/A ARG 198.A NH2 GLU 195.A OE2 no hydrogen 2.758 N/A LEU 199.A N GLU 195.A O no hydrogen 3.003 N/A THR 200.A N VAL 196.A O no hydrogen 2.938 N/A THR 200.A OG1 VAL 196.A O no hydrogen 3.304 N/A THR 200.A OG1 GLN 197.A O no hydrogen 3.223 N/A ARG 201.A N GLN 197.A O no hydrogen 2.853 N/A ALA 202.A N ARG 198.A O no hydrogen 3.002 N/A CYS 203.A N LEU 199.A O no hydrogen 2.959 N/A CYS 203.A SG LEU 199.A O no hydrogen 3.636 N/A HIS 204.A N.A THR 200.A O no hydrogen 2.942 N/A HIS 204.A N.B THR 200.A O no hydrogen 2.932 N/A GLN 205.A N ARG 201.A O no hydrogen 3.005 N/A ALA 206.A N ALA 202.A O no hydrogen 2.972 N/A MET 207.A N CYS 203.A O no hydrogen 2.933 N/A MET 208.A N HIS 204.A O.A no hydrogen 2.975 N/A MET 208.A N HIS 204.A O.B no hydrogen 3.035 N/A VAL 209.A N GLN 205.A O no hydrogen 2.986 N/A ASP 210.A N ALA 206.A O no hydrogen 2.936 N/A GLN 211.A N MET 207.A O no hydrogen 2.952 N/A ALA 212.A N MET 208.A O no hydrogen 2.915 N/A ASN 213.A N VAL 209.A O no hydrogen 3.004 N/A GLY 214.A N GLN 211.A O no hydrogen 3.024 N/A ILE 215.A N ASP 210.A O no hydrogen 2.903 N/A HIS 222.A N HIS 218.A O no hydrogen 3.282 N/A LEU 223.A N ASP 219.A O no hydrogen 2.982 N/A ASN 224.A N CYS 220.A O no hydrogen 3.004 N/A ASN 224.A ND2 TYR 184.A O no hydrogen 2.841 N/A ASN 224.A ND2 CYS 220.A O no hydrogen 2.828 N/A LYS 225.A N SER 221.A O no hydrogen 3.053 N/A LYS 225.A NZ GLN 172.A O no hydrogen 2.872 N/A LYS 225.A NZ TYR 174.A O no hydrogen 2.924 N/A TYR 226.A N HIS 222.A O no hydrogen 2.977 N/A LEU 227.A N LEU 223.A O no hydrogen 2.909 N/A LEU 228.A N ASN 224.A O no hydrogen 2.981 N/A ARG 229.A N LYS 225.A O no hydrogen 3.175 N/A ARG 229.A NH1 GLU 179.A OE1 no hydrogen 2.928 N/A HIS 230.A N TYR 226.A O no hydrogen 2.812 N/A HIS 230.A ND1 TYR 226.A O no hydrogen 3.115 N/A LYS 231.A NZ ASP 181.A OD2 no hydrogen 2.805 N/A LYS 231.A NZ LEU 228.A O no hydrogen 2.853 N/A THR 233.A N LEU 147.A O no hydrogen 2.756 N/A THR 233.A OG1 THR 145.A OG1 no hydrogen 2.643 N/A THR 233.A OG1 LEU 147.A O no hydrogen 3.135 N/A LYS 234.A N LEU 147.A O no hydrogen 3.446 N/A LYS 234.A NZ GLU 142.A O no hydrogen 2.806 N/A LYS 234.A NZ LEU 144.A O no hydrogen 2.803 N/A VAL 235.A N PRO 33.A O no hydrogen 2.954 N/A LEU 236.A N GLY 149.A O no hydrogen 2.850 N/A SER 237.A N VAL 35.A O no hydrogen 3.110 N/A SER 237.A OG VAL 35.A O no hydrogen 2.738 N/A TYR 240.A N SER 237.A O no hydrogen 3.033 N/A TYR 240.A OH GLU 142.A OE1 no hydrogen 2.634 N/A LEU 241.A N PRO 238.A O no hydrogen 3.121 N/A TRP 242.A N PHE 258.A O no hydrogen 3.035 N/A TRP 242.A NE1 GLY 248.A O no hydrogen 2.664 N/A GLN 245.A NE2 PRO 262.A O no hydrogen 3.579 N/A LEU 246.A N ASP 243.A OD1 no hydrogen 3.146 N/A LEU 247.A N ASP 243.A O no hydrogen 2.896 N/A GLY 248.A N GLN 244.A O no hydrogen 2.816 N/A TRP 249.A NE1 LEU 253.A O no hydrogen 2.744 N/A LEU 253.A N PRO 250.A O no hydrogen 2.985 N/A LYS 255.A NZ GLU 37.A OE2 no hydrogen 3.406 N/A ARG 257.A N GLU 239.A O no hydrogen 2.812 N/A ARG 257.A NE GLU 239.A OE2 no hydrogen 2.846 N/A ARG 257.A NH1 HIS 138.A O no hydrogen 2.897 N/A ARG 257.A NH2 GLU 37.A OE1 no hydrogen 2.832 N/A ARG 257.A NH2 GLU 239.A OE2 no hydrogen 2.846 N/A THR 259.A N GLU 134.A O no hydrogen 2.917 N/A THR 259.A OG1 ALA 260.A O no hydrogen 3.559 N/A ALA 260.A N TRP 242.A O no hydrogen 2.928 N/A