Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1dml_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A N ILE 99.A O no hydrogen 3.353 N/A CYS 3.A SG ARG 64.A O no hydrogen 3.394 N/A GLN 4.A N ARG 62.A O no hydrogen 2.950 N/A GLN 4.A NE2 ALA 1.A O no hydrogen 2.766 N/A VAL 5.A N LEU 97.A O no hydrogen 2.921 N/A VAL 6.A N ARG 60.A O no hydrogen 2.757 N/A LEU 7.A N VAL 95.A O no hydrogen 2.868 N/A GLN 8.A N SER 59.A OG no hydrogen 2.923 N/A LEU 12.A N GLN 8.A O no hydrogen 3.093 N/A ASN 13.A N GLY 9.A O no hydrogen 3.015 N/A GLY 14.A N ALA 10.A O no hydrogen 2.847 N/A ILE 15.A N GLU 11.A O no hydrogen 2.891 N/A LEU 16.A N LEU 12.A O no hydrogen 2.911 N/A GLN 17.A N ASN 13.A O no hydrogen 2.998 N/A ALA 18.A N GLY 14.A O no hydrogen 2.904 N/A PHE 19.A N ILE 15.A O no hydrogen 3.034 N/A ALA 20.A N LEU 16.A O no hydrogen 3.062 N/A ALA 20.A N GLN 17.A O no hydrogen 3.222 N/A LEU 22.A N PHE 19.A O no hydrogen 2.834 N/A ARG 23.A N PHE 19.A O no hydrogen 3.208 N/A ARG 23.A N ALA 20.A O no hydrogen 3.119 N/A ARG 23.A NH2 ARG 228.A O no hydrogen 3.226 N/A SER 25.A N LEU 22.A O no hydrogen 2.993 N/A SER 25.A OG LEU 22.A O no hydrogen 3.027 N/A LEU 27.A N THR 24.A O no hydrogen 3.220 N/A SER 29.A N SER 72.A OG no hydrogen 2.712 N/A SER 29.A OG LEU 26.A O no hydrogen 2.645 N/A SER 29.A OG SER 72.A OG no hydrogen 3.416 N/A LEU 30.A N HIS 41.A O no hydrogen 2.908 N/A LEU 31.A N PHE 70.A O no hydrogen 2.672 N/A VAL 32.A N LEU 39.A O no hydrogen 2.742 N/A MET 33.A N ALA 68.A O no hydrogen 2.757 N/A GLY 34.A N GLY 37.A O no hydrogen 3.257 N/A ARG 36.A NE GLU 54.A OE1 no hydrogen 2.946 N/A ARG 36.A NE GLU 54.A OE2 no hydrogen 2.975 N/A ARG 36.A NH2 GLU 54.A OE1 no hydrogen 2.746 N/A GLY 37.A N GLY 34.A O no hydrogen 3.232 N/A ILE 38.A N LEU 53.A O no hydrogen 2.967 N/A LEU 39.A N VAL 32.A O no hydrogen 2.815 N/A ILE 40.A N LEU 51.A O no hydrogen 3.004 N/A HIS 41.A N LEU 30.A O no hydrogen 2.917 N/A HIS 41.A NE2 GLN 48.A OE1 no hydrogen 2.980 N/A ASN 42.A N VAL 49.A O no hydrogen 2.987 N/A ASN 42.A ND2 ASP 28.A O no hydrogen 2.635 N/A ASN 42.A ND2 HIS 41.A O no hydrogen 3.582 N/A ILE 44.A N GLU 47.A O no hydrogen 2.913 N/A GLU 47.A N ILE 44.A O no hydrogen 2.813 N/A VAL 49.A N ASN 42.A O no hydrogen 3.097 N/A PHE 50.A N SER 258.A O no hydrogen 2.930 N/A LEU 51.A N ILE 40.A O no hydrogen 2.889 N/A LEU 53.A N ILE 38.A O no hydrogen 2.874 N/A HIS 55.A N ARG 36.A O no hydrogen 2.986 N/A GLN 57.A N GLU 54.A O no hydrogen 2.761 N/A PHE 58.A N HIS 55.A O no hydrogen 3.064 N/A SER 59.A N VAL 6.A O no hydrogen 2.773 N/A ARG 60.A N VAL 6.A O no hydrogen 3.242 N/A TYR 61.A OH GLY 34.A O no hydrogen 2.650 N/A ARG 62.A N GLN 4.A O no hydrogen 2.697 N/A TRP 63.A NE1 GLY 65.A O no hydrogen 3.041 N/A ALA 68.A N MET 33.A O no hydrogen 2.794 N/A PHE 70.A N LEU 31.A O no hydrogen 2.813 N/A SER 72.A N SER 29.A O no hydrogen 2.912 N/A SER 72.A OG LEU 27.A O no hydrogen 2.490 N/A SER 72.A OG SER 29.A O no hydrogen 3.173 N/A SER 72.A OG SER 29.A OG no hydrogen 3.416 N/A VAL 74.A N ARG 78.A O no hydrogen 3.044 N/A ASP 75.A N ARG 78.A O no hydrogen 3.360 N/A LYS 77.A N ASP 75.A OD1 no hydrogen 2.857 N/A ARG 78.A N ASP 75.A O no hydrogen 2.860 N/A ARG 78.A N ASP 75.A OD1 no hydrogen 2.840 N/A ARG 78.A NH1 ASP 75.A OD2 no hydrogen 3.185 N/A SER 79.A N SER 82.A OG no hydrogen 3.109 N/A SER 79.A OG LEU 27.A O no hydrogen 2.678 N/A SER 79.A OG SER 72.A O no hydrogen 3.426 N/A LEU 80.A N SER 72.A O no hydrogen 2.679 N/A LEU 81.A N SER 79.A OG no hydrogen 3.053 N/A SER 82.A N SER 79.A O no hydrogen 2.950 N/A SER 82.A OG SER 79.A O no hydrogen 3.125 N/A ARG 85.A N SER 82.A O no hydrogen 2.960 N/A GLN 88.A N ARG 85.A O no hydrogen 3.489 N/A LEU 92.A N TYR 89.A O no hydrogen 2.950 N/A ARG 93.A N TRP 113.A O no hydrogen 2.731 N/A ARG 93.A NE THR 114.A O no hydrogen 3.321 N/A ARG 93.A NH1 GLY 119.A O no hydrogen 2.627 N/A ARG 93.A NH2 SER 117.A OG no hydrogen 2.842 N/A ARG 93.A NH2 GLY 119.A O no hydrogen 2.618 N/A ARG 94.A N TRP 113.A O no hydrogen 2.872 N/A ARG 94.A NH1 GLN 8.A OE1 no hydrogen 3.170 N/A ARG 94.A NH2 GLU 96.A OE1 no hydrogen 2.643 N/A VAL 95.A N LEU 7.A O no hydrogen 2.988 N/A GLU 96.A N ARG 111.A O no hydrogen 2.840 N/A LEU 97.A N VAL 5.A O no hydrogen 2.743 N/A ALA 98.A N VAL 109.A O no hydrogen 3.093 N/A ILE 99.A N CYS 3.A O no hydrogen 2.937 N/A THR 100.A N THR 107.A O no hydrogen 2.930 N/A PHE 105.A N GLN 102.A O no hydrogen 2.678 N/A ARG 106.A N GLU 133.A OE2 no hydrogen 2.830 N/A ARG 106.A NE GLU 133.A OE1 no hydrogen 3.402 N/A ARG 106.A NE GLU 133.A OE2 no hydrogen 2.798 N/A ARG 106.A NH1 PRO 66.A O no hydrogen 2.593 N/A ARG 106.A NH2 THR 67.A O no hydrogen 2.893 N/A ARG 106.A NH2 GLU 133.A OE1 no hydrogen 2.774 N/A THR 107.A N THR 100.A O no hydrogen 2.792 N/A LEU 108.A N LYS 131.A O no hydrogen 2.688 N/A VAL 109.A N ALA 98.A O no hydrogen 2.843 N/A GLN 110.A N LEU 129.A O no hydrogen 2.621 N/A GLN 110.A NE2 LEU 80.A O no hydrogen 2.885 N/A ARG 111.A N GLU 96.A O no hydrogen 2.928 N/A ILE 112.A N GLU 127.A O no hydrogen 2.920 N/A TRP 113.A N ARG 94.A O no hydrogen 2.705 N/A THR 114.A OG1 THR 116.A OG1 no hydrogen 2.783 N/A THR 115.A N ASP 91.A O no hydrogen 2.655 N/A THR 115.A OG1 ASP 91.A O no hydrogen 3.518 N/A THR 116.A N THR 114.A O no hydrogen 2.672 N/A THR 116.A OG1 THR 114.A OG1 no hydrogen 2.783 N/A GLU 123.A N ALA 121.A O no hydrogen 2.720 N/A SER 126.A OG LEU 124.A O no hydrogen 3.371 N/A LEU 129.A N GLN 110.A O no hydrogen 2.808 N/A LYS 131.A N LEU 108.A O no hydrogen 2.735 N/A LYS 131.A NZ LEU 73.A O no hydrogen 2.989 N/A GLU 133.A N ARG 106.A O no hydrogen 3.206 N/A THR 135.A OG1 LEU 134.A O no hydrogen 2.451 N/A SER 136.A N LEU 134.A O no hydrogen 2.224 N/A ASP 147.A N PHE 238.A O no hydrogen 2.695 N/A VAL 148.A N PHE 238.A O no hydrogen 3.359 N/A GLN 149.A N GLU 207.A O no hydrogen 3.211 N/A GLN 149.A NE2 GLU 207.A OE1 no hydrogen 3.105 N/A LEU 150.A N LEU 236.A O no hydrogen 2.896 N/A ARG 151.A N TYR 205.A O no hydrogen 2.630 N/A LEU 152.A N GLY 234.A O no hydrogen 2.731 N/A THR 153.A N GLN 156.A OE1 no hydrogen 2.719 N/A GLN 156.A NE2 ALA 201.A O no hydrogen 3.097 N/A GLN 156.A NE2 THR 203.A O no hydrogen 3.153 N/A LEU 157.A N THR 153.A O no hydrogen 2.864 N/A THR 158.A N ARG 154.A O no hydrogen 3.056 N/A THR 158.A OG1 ARG 154.A O no hydrogen 3.103 N/A LYS 159.A N PRO 155.A O no hydrogen 3.001 N/A VAL 160.A N GLN 156.A O no hydrogen 3.045 N/A LEU 161.A N LEU 157.A O no hydrogen 2.860 N/A ASN 162.A N THR 158.A O no hydrogen 2.964 N/A ALA 163.A N VAL 160.A O no hydrogen 2.678 N/A THR 164.A N VAL 160.A O no hydrogen 3.056 N/A THR 164.A OG1 LEU 161.A O no hydrogen 2.847 N/A GLY 165.A N THR 172.A OG1 no hydrogen 2.641 N/A THR 170.A N ASP 167.A O no hydrogen 2.962 N/A THR 170.A OG1 ASP 167.A O no hydrogen 3.121 N/A THR 170.A OG1 ASP 167.A OD1 no hydrogen 2.884 N/A THR 170.A OG1 ASP 167.A OD2 no hydrogen 2.816 N/A THR 173.A N PHE 185.A O no hydrogen 3.005 N/A PHE 174.A N VAL 215.A O no hydrogen 2.683 N/A GLU 175.A N SER 183.A O no hydrogen 2.767 N/A LEU 176.A N PHE 213.A O no hydrogen 2.851 N/A GLY 177.A N LYS 181.A O no hydrogen 2.746 N/A GLY 180.A N GLY 177.A O no hydrogen 3.081 N/A PHE 182.A N PHE 193.A O no hydrogen 2.772 N/A SER 183.A N GLU 175.A O no hydrogen 2.773 N/A VAL 184.A N VAL 191.A O no hydrogen 2.873 N/A PHE 185.A N THR 173.A O no hydrogen 3.055 N/A THR 186.A N THR 189.A O no hydrogen 2.711 N/A THR 186.A OG1 THR 189.A OG1 no hydrogen 2.766 N/A SER 188.A N THR 186.A OG1 no hydrogen 3.206 N/A THR 189.A OG1 ALA 163.A O no hydrogen 2.614 N/A THR 189.A OG1 THR 186.A OG1 no hydrogen 2.766 N/A VAL 191.A N VAL 184.A O no hydrogen 2.993 N/A THR 192.A OG1 PHE 182.A O no hydrogen 3.213 N/A THR 192.A OG1 SER 183.A OG no hydrogen 3.289 N/A THR 192.A OG1 PHE 193.A O no hydrogen 3.566 N/A PHE 193.A N PHE 182.A O no hydrogen 2.759 N/A ALA 194.A N LYS 202.A O no hydrogen 2.510 N/A ALA 195.A N GLY 180.A O no hydrogen 2.483 N/A GLU 198.A N GLY 206.A O no hydrogen 3.287 N/A THR 203.A N ASN 200.A O no hydrogen 3.382 N/A VAL 204.A N ALA 194.A O no hydrogen 2.817 N/A GLU 207.A N GLN 149.A O no hydrogen 2.795 N/A ASN 208.A N GLU 197.A OE2 no hydrogen 3.193 N/A ASN 208.A ND2 ASP 147.A O no hydrogen 3.627 N/A THR 209.A N GLU 197.A OE1 no hydrogen 3.082 N/A THR 209.A OG1 GLU 197.A OE1 no hydrogen 3.523 N/A ARG 211.A N ASN 208.A O no hydrogen 3.093 N/A PHE 213.A N LEU 176.A O no hydrogen 3.178 N/A VAL 215.A N PHE 174.A O no hydrogen 2.858 N/A VAL 217.A N THR 172.A O no hydrogen 2.851 N/A VAL 225.A N SER 221.A O no hydrogen 2.957 N/A LEU 226.A N MET 222.A O no hydrogen 2.906 N/A ARG 227.A N ARG 223.A O no hydrogen 2.886 N/A ARG 228.A N ALA 224.A O no hydrogen 2.944 N/A LEU 229.A N VAL 225.A O no hydrogen 2.894 N/A GLN 230.A N ARG 227.A O no hydrogen 3.072 N/A VAL 231.A N LEU 226.A O no hydrogen 3.069 N/A GLY 234.A N LEU 152.A O no hydrogen 3.082 N/A THR 235.A N THR 250.A O no hydrogen 2.865 N/A LEU 236.A N LEU 150.A O no hydrogen 2.745 N/A LYS 237.A N CYS 248.A O no hydrogen 2.856 N/A LYS 237.A NZ THR 250.A OG1 no hydrogen 2.855 N/A PHE 238.A N VAL 148.A O no hydrogen 2.842 N/A PHE 239.A N SER 246.A O no hydrogen 2.901 N/A LEU 240.A N ASP 147.A OD2 no hydrogen 2.578 N/A THR 241.A N ASP 147.A OD2 no hydrogen 3.346 N/A THR 242.A OG1 VAL 244.A O no hydrogen 2.579 N/A SER 246.A N PHE 239.A O no hydrogen 3.050 N/A LEU 247.A N PHE 261.A O no hydrogen 2.811 N/A CYS 248.A N LYS 237.A O no hydrogen 3.013 N/A CYS 248.A SG THR 250.A OG1 no hydrogen 3.712 N/A VAL 249.A N ALA 259.A O no hydrogen 2.936 N/A THR 250.A N THR 235.A O no hydrogen 3.104 N/A THR 250.A OG1 SER 258.A OG no hydrogen 2.771 N/A ALA 251.A N VAL 257.A O no hydrogen 2.856 N/A THR 252.A N GLY 233.A O no hydrogen 3.155 N/A ASN 255.A ND2 GLN 57.A OE1 no hydrogen 2.932 N/A SER 258.A N PHE 50.A O no hydrogen 2.878 N/A SER 258.A OG THR 250.A OG1 no hydrogen 2.771 N/A ALA 259.A N VAL 249.A O no hydrogen 3.102 N/A VAL 260.A N GLN 48.A O no hydrogen 2.807 N/A PHE 261.A N LEU 247.A O no hydrogen 2.889 N/A LEU 263.A N PRO 245.A O no hydrogen 2.769 N/A LYS 264.A N VAL 216.A O no hydrogen 2.942 N/A GLN 266.A NE2 SER 214.A O no hydrogen 2.948 N/A