Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5kml_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N VAL 147.A O no hydrogen 2.907 N/A HIS 12.A ND1 VAL 10.A O no hydrogen 3.152 N/A ILE 13.A N VAL 83.A O no hydrogen 2.799 N/A LYS 14.A NZ GLU 86.A OE1 no hydrogen 3.469 N/A ARG 15.A N GLU 86.A OE1 no hydrogen 3.256 N/A ARG 15.A NE GLU 86.A O no hydrogen 2.774 N/A ARG 15.A NH1 PRO 89.A O no hydrogen 2.856 N/A ARG 15.A NH2 GLU 86.A O no hydrogen 2.919 N/A ARG 15.A NH2 PRO 89.A O no hydrogen 2.958 N/A ASP 17.A N LYS 14.A O no hydrogen 2.993 N/A ILE 18.A N ARG 15.A O no hydrogen 3.227 N/A VAL 19.A N GLU 36.A O no hydrogen 2.807 N/A LYS 21.A N LEU 34.A O no hydrogen 2.774 N/A LYS 21.A NZ GLU 36.A OE2 no hydrogen 3.114 N/A TRP 22.A N LEU 34.A O no hydrogen 3.412 N/A LEU 24.A N VAL 32.A O no hydrogen 2.806 N/A GLY 25.A N VAL 32.A O no hydrogen 3.372 N/A GLY 27.A N GLY 30.A O no hydrogen 2.841 N/A ALA 28.A N ASP 174.A OD2 no hydrogen 3.201 N/A LYS 31.A N ALA 51.A O no hydrogen 3.308 N/A VAL 32.A N GLY 25.A O no hydrogen 2.888 N/A PHE 33.A N VAL 49.A O no hydrogen 2.914 N/A LEU 34.A N TRP 22.A O no hydrogen 2.752 N/A ALA 35.A N VAL 47.A O no hydrogen 3.041 N/A GLU 36.A N VAL 19.A O no hydrogen 2.823 N/A CYS 37.A N MET 45.A O no hydrogen 2.741 N/A CYS 37.A SG ASP 17.A O no hydrogen 3.660 N/A HIS 38.A N ASP 17.A O no hydrogen 2.865 N/A ASN 39.A N ASP 43.A O no hydrogen 3.041 N/A MET 45.A N CYS 37.A O no hydrogen 3.111 N/A VAL 47.A N ALA 35.A O no hydrogen 2.863 N/A ALA 48.A N PHE 94.A O no hydrogen 2.853 N/A VAL 49.A N PHE 33.A O no hydrogen 2.775 N/A LYS 50.A N MET 92.A O no hydrogen 2.887 N/A LYS 50.A NZ PHE 169.A O no hydrogen 3.475 N/A ALA 51.A N LYS 31.A O no hydrogen 2.877 N/A LEU 52.A N LEU 90.A O no hydrogen 2.868 N/A LYS 53.A N PHE 29.A O no hydrogen 3.049 N/A LYS 53.A NZ GLY 27.A O no hydrogen 2.908 N/A LYS 53.A NZ ALA 28.A O no hydrogen 3.083 N/A ARG 59.A N SER 55.A O no hydrogen 2.797 N/A GLN 60.A N GLU 56.A O no hydrogen 3.321 N/A ASP 61.A N SER 57.A O no hydrogen 3.298 N/A PHE 62.A N ALA 58.A O no hydrogen 2.811 N/A GLN 63.A N ARG 59.A O no hydrogen 3.109 N/A ARG 64.A N GLN 60.A O no hydrogen 2.997 N/A GLU 65.A N ASP 61.A O no hydrogen 2.976 N/A ALA 66.A N PHE 62.A O no hydrogen 2.886 N/A GLU 67.A N GLN 63.A O no hydrogen 3.044 N/A LEU 68.A N ARG 64.A O no hydrogen 2.969 N/A LEU 69.A N GLU 65.A O no hydrogen 2.808 N/A THR 70.A N ALA 66.A O no hydrogen 2.852 N/A THR 70.A OG1 ALA 66.A O no hydrogen 2.715 N/A MET 71.A N GLU 67.A O no hydrogen 3.224 N/A LEU 72.A N LEU 68.A O no hydrogen 3.210 N/A GLN 73.A N MET 71.A O no hydrogen 3.152 N/A GLN 73.A N TYR 140.A OH no hydrogen 3.106 N/A GLN 73.A NE2 LEU 69.A O no hydrogen 3.686 N/A GLN 73.A NE2 LEU 72.A O no hydrogen 3.146 N/A GLN 73.A NE2 PHE 80.A O no hydrogen 3.587 N/A HIS 76.A ND1 VAL 164.A O no hydrogen 3.198 N/A ILE 77.A N HIS 74.A O no hydrogen 3.352 N/A VAL 78.A N ILE 166.A O no hydrogen 2.906 N/A ARG 79.A N GLU 95.A OE2 no hydrogen 2.907 N/A PHE 81.A N VAL 93.A O no hydrogen 2.761 N/A VAL 83.A N HIS 11.A O no hydrogen 2.946 N/A CYS 84.A N LEU 91.A O no hydrogen 3.006 N/A CYS 84.A SG ILE 13.A O no hydrogen 3.438 N/A THR 85.A OG1 HIS 12.A NE2 no hydrogen 3.157 N/A GLY 87.A N THR 85.A O no hydrogen 2.974 N/A LEU 91.A N CYS 84.A O no hydrogen 3.185 N/A MET 92.A N LYS 50.A O no hydrogen 2.927 N/A VAL 93.A N GLY 82.A O no hydrogen 2.773 N/A PHE 94.A N ALA 48.A O no hydrogen 2.884 N/A GLU 95.A N ARG 79.A O no hydrogen 2.920 N/A HIS 99.A N VAL 158.A O no hydrogen 2.917 N/A HIS 99.A NE2 ASP 116.A OD2 no hydrogen 2.741 N/A GLY 100.A N MET 97.A O no hydrogen 3.046 N/A LEU 102.A N CYS 156.A O no hydrogen 2.893 N/A ASN 103.A N THR 153.A O no hydrogen 3.306 N/A ASN 103.A ND2 THR 153.A OG1 no hydrogen 3.305 N/A ASN 103.A ND2 GLY 224.A O no hydrogen 2.935 N/A ARG 104.A N ASP 101.A OD1 no hydrogen 2.985 N/A PHE 105.A N ASP 101.A O no hydrogen 3.050 N/A LEU 106.A N LEU 102.A O no hydrogen 2.911 N/A ARG 107.A N ASN 103.A O no hydrogen 3.067 N/A ARG 107.A NE ASN 103.A OD1 no hydrogen 3.155 N/A SER 108.A N ARG 104.A O no hydrogen 3.090 N/A SER 108.A OG ARG 104.A O no hydrogen 3.287 N/A SER 108.A OG PHE 105.A O no hydrogen 2.912 N/A SER 108.A OG HIS 109.A ND1 no hydrogen 2.881 N/A HIS 109.A N LEU 106.A O no hydrogen 3.044 N/A HIS 109.A ND1 PHE 105.A O no hydrogen 2.971 N/A ALA 113.A N GLY 110.A O no hydrogen 3.011 N/A LEU 122.A N HIS 109.A O no hydrogen 3.179 N/A LEU 127.A N GLY 123.A O no hydrogen 3.148 N/A LEU 128.A N LEU 124.A O no hydrogen 2.968 N/A ALA 129.A N GLY 125.A O no hydrogen 3.044 N/A VAL 130.A N GLN 126.A O no hydrogen 2.887 N/A ALA 131.A N LEU 127.A O no hydrogen 3.031 N/A SER 132.A N LEU 128.A O no hydrogen 3.059 N/A GLN 133.A N ALA 129.A O no hydrogen 3.200 N/A GLN 133.A NE2 ALA 129.A O no hydrogen 3.276 N/A GLN 133.A NE2 LEU 162.A O no hydrogen 3.359 N/A VAL 134.A N VAL 130.A O no hydrogen 3.367 N/A ALA 135.A N ALA 131.A O no hydrogen 3.049 N/A ALA 136.A N SER 132.A O no hydrogen 2.939 N/A GLY 137.A N GLN 133.A O no hydrogen 3.097 N/A MET 138.A N VAL 134.A O no hydrogen 3.164 N/A VAL 139.A N ALA 135.A O no hydrogen 2.911 N/A TYR 140.A N ALA 136.A O no hydrogen 3.160 N/A LEU 141.A N GLY 137.A O no hydrogen 2.996 N/A ALA 142.A N MET 138.A O no hydrogen 2.770 N/A GLY 143.A N VAL 139.A O no hydrogen 2.835 N/A LEU 144.A N TYR 140.A O no hydrogen 3.096 N/A LEU 144.A N LEU 141.A O no hydrogen 3.148 N/A HIS 145.A N ALA 142.A O no hydrogen 2.901 N/A PHE 146.A N LEU 141.A O no hydrogen 2.876 N/A VAL 147.A N SER 4.A O no hydrogen 2.828 N/A HIS 148.A N ASP 209.A OD2 no hydrogen 2.817 N/A ARG 149.A N SER 2.A O no hydrogen 2.792 N/A ARG 149.A NH1 SER 4.A OG no hydrogen 3.301 N/A ASP 150.A N HIS 148.A ND1 no hydrogen 2.986 N/A THR 153.A N GLU 219.A OE1 no hydrogen 2.985 N/A THR 153.A OG1 GLU 219.A OE2 no hydrogen 2.703 N/A ARG 154.A NE TYR 180.A OH no hydrogen 2.811 N/A ARG 154.A NH2 ASP 150.A OD1 no hydrogen 2.877 N/A ASN 155.A N ALA 152.A O no hydrogen 2.846 N/A ASN 155.A ND2 ASP 150.A O no hydrogen 2.796 N/A CYS 156.A N THR 153.A O no hydrogen 3.217 N/A CYS 156.A SG ALA 152.A O no hydrogen 3.741 N/A LEU 157.A N LYS 165.A O no hydrogen 2.713 N/A VAL 158.A N GLY 100.A O no hydrogen 2.822 N/A GLY 159.A N VAL 163.A O no hydrogen 2.767 N/A GLY 161.A N ASP 116.A OD2 no hydrogen 3.040 N/A VAL 163.A N GLY 159.A O no hydrogen 3.323 N/A VAL 164.A N GLN 133.A OE1 no hydrogen 2.885 N/A LYS 165.A N LEU 157.A O no hydrogen 2.959 N/A LYS 165.A NZ GLU 95.A OE1 no hydrogen 3.425 N/A LYS 165.A NZ GLU 95.A OE2 no hydrogen 2.769 N/A ILE 166.A N HIS 76.A O no hydrogen 2.889 N/A GLY 167.A N ASN 155.A O no hydrogen 2.961 N/A GLY 170.A N ASP 168.A OD2 no hydrogen 2.809 N/A SER 172.A OG ASN 155.A OD1 no hydrogen 2.572 N/A ARG 173.A NE MET 188.A O no hydrogen 3.213 N/A ARG 173.A NH2 MET 188.A O no hydrogen 2.987 N/A ASP 174.A N MET 171.A O no hydrogen 3.082 N/A ILE 175.A N MET 171.A O no hydrogen 2.929 N/A TYR 176.A N SER 172.A O no hydrogen 2.801 N/A TYR 176.A OH ASP 101.A OD2 no hydrogen 2.661 N/A ASP 179.A N TYR 176.A O no hydrogen 3.045 N/A TYR 180.A N SER 177.A O no hydrogen 3.087 N/A TYR 180.A OH ASP 150.A OD2 no hydrogen 2.560 N/A TYR 181.A N LEU 189.A O no hydrogen 2.771 N/A VAL 183.A N THR 187.A O no hydrogen 2.908 N/A GLY 184.A N THR 187.A O no hydrogen 3.115 N/A THR 187.A OG1 GLY 184.A O no hydrogen 3.235 N/A LEU 189.A N TYR 181.A O no hydrogen 2.890 N/A ARG 192.A NH1 PRO 227.A O no hydrogen 3.222 N/A ARG 192.A NH1 TRP 228.A O no hydrogen 2.786 N/A ARG 192.A NH1 LEU 231.A O no hydrogen 3.163 N/A ARG 192.A NH2 LEU 231.A O no hydrogen 2.917 N/A ARG 192.A NH2 ASN 233.A OD1 no hydrogen 3.333 N/A TRP 193.A N PRO 190.A O no hydrogen 3.006 N/A TRP 193.A NE1 GLU 219.A OE1 no hydrogen 2.805 N/A MET 194.A N ILE 191.A O no hydrogen 3.049 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.903 N/A SER 198.A N PRO 195.A O no hydrogen 3.011 N/A SER 198.A OG LYS 203.A O no hydrogen 2.746 N/A ILE 199.A N PRO 195.A O no hydrogen 3.211 N/A LEU 200.A N PRO 196.A O no hydrogen 2.789 N/A TYR 201.A N GLU 197.A O no hydrogen 3.079 N/A LYS 203.A N GLU 197.A O no hydrogen 3.104 N/A THR 205.A N SER 208.A OG no hydrogen 2.970 N/A THR 205.A OG1 GLU 207.A OE2 no hydrogen 2.726 N/A SER 208.A N THR 205.A O no hydrogen 2.978 N/A SER 208.A OG GLU 197.A OE2 no hydrogen 2.857 N/A ASP 209.A N THR 205.A O no hydrogen 3.257 N/A VAL 210.A N THR 206.A O no hydrogen 3.263 N/A VAL 210.A N GLU 207.A O no hydrogen 3.274 N/A TRP 211.A N GLU 207.A O no hydrogen 3.276 N/A SER 212.A N SER 208.A O no hydrogen 3.047 N/A SER 212.A OG TRP 193.A O no hydrogen 2.708 N/A SER 212.A OG SER 208.A O no hydrogen 3.352 N/A PHE 213.A N ASP 209.A O no hydrogen 2.799 N/A GLY 214.A N VAL 210.A O no hydrogen 3.010 N/A VAL 215.A N TRP 211.A O no hydrogen 3.053 N/A VAL 216.A N SER 212.A O no hydrogen 2.913 N/A LEU 217.A N PHE 213.A O no hydrogen 2.777 N/A TRP 218.A N GLY 214.A O no hydrogen 3.125 N/A TRP 218.A NE1 GLU 247.A O no hydrogen 2.815 N/A GLU 219.A N VAL 215.A O no hydrogen 2.931 N/A ILE 220.A N VAL 216.A O no hydrogen 3.039 N/A PHE 221.A N LEU 217.A O no hydrogen 3.270 N/A THR 222.A N GLU 219.A O no hydrogen 3.241 N/A THR 222.A OG1 TRP 218.A O no hydrogen 2.977 N/A THR 222.A OG1 GLU 219.A O no hydrogen 2.886 N/A TYR 223.A N ILE 220.A O no hydrogen 3.108 N/A TYR 223.A OH LEU 122.A O no hydrogen 2.668 N/A GLY 224.A N GLU 219.A O no hydrogen 2.699 N/A LYS 225.A N THR 222.A OG1 no hydrogen 3.324 N/A GLN 226.A NE2 THR 178.A O no hydrogen 2.927 N/A GLN 226.A NE2 ASP 179.A OD1 no hydrogen 2.916 N/A TYR 229.A N GLN 226.A O no hydrogen 3.102 N/A GLN 230.A N GLN 230.A OE1 no hydrogen 2.809 N/A LEU 231.A N TRP 228.A O no hydrogen 2.769 N/A SER 232.A N GLU 235.A OE1 no hydrogen 2.973 N/A ALA 236.A N SER 232.A O no hydrogen 3.037 N/A ILE 237.A N ASN 233.A O no hydrogen 3.006 N/A ASP 238.A N THR 234.A O no hydrogen 2.911 N/A CYS 239.A N GLU 235.A O no hydrogen 3.067 N/A CYS 239.A SG GLU 235.A O no hydrogen 3.676 N/A ILE 240.A N ALA 236.A O no hydrogen 3.049 N/A THR 241.A N ILE 237.A O no hydrogen 2.960 N/A THR 241.A OG1 ILE 237.A O no hydrogen 2.736 N/A THR 241.A OG1 ASP 238.A O no hydrogen 3.222 N/A GLN 242.A N ASP 238.A O no hydrogen 2.858 N/A GLY 243.A N CYS 239.A O no hydrogen 2.972 N/A ARG 244.A N CYS 239.A O no hydrogen 2.794 N/A ARG 248.A NH1 CYS 252.A O no hydrogen 2.767 N/A CYS 252.A N PRO 249.A O no hydrogen 2.817 N/A CYS 252.A SG PRO 253.A O no hydrogen 3.386 N/A GLU 255.A N GLU 255.A OE1 no hydrogen 2.792 N/A VAL 256.A N PRO 253.A O no hydrogen 3.095 N/A TYR 257.A N PRO 253.A O no hydrogen 3.095 N/A TYR 257.A OH LEU 246.A O no hydrogen 2.585 N/A ALA 258.A N PRO 254.A O no hydrogen 2.985 N/A ILE 259.A N VAL 256.A O no hydrogen 2.931 N/A MET 260.A N VAL 256.A O no hydrogen 3.133 N/A ARG 261.A N TYR 257.A O no hydrogen 2.939 N/A GLY 262.A N ALA 258.A O no hydrogen 3.264 N/A CYS 263.A N MET 260.A O no hydrogen 2.946 N/A CYS 263.A SG VAL 210.A O no hydrogen 3.501 N/A CYS 263.A SG ILE 259.A O no hydrogen 3.530 N/A TRP 264.A N MET 260.A O no hydrogen 3.242 N/A TRP 264.A N ARG 261.A O no hydrogen 3.200 N/A ARG 266.A NH1 THR 241.A O no hydrogen 2.977 N/A ARG 266.A NH2 THR 241.A O no hydrogen 2.775 N/A GLN 270.A N GLU 267.A O no hydrogen 2.889 N/A ARG 271.A N PRO 268.A O no hydrogen 3.129 N/A ARG 271.A NE GLN 265.A O no hydrogen 2.743 N/A ARG 271.A NH1 GLU 197.A OE1 no hydrogen 3.527 N/A ARG 271.A NH1 GLU 197.A OE2 no hydrogen 2.777 N/A ARG 271.A NH1 GLU 207.A O no hydrogen 3.000 N/A ARG 271.A NH2 GLU 197.A OE1 no hydrogen 2.863 N/A ARG 271.A NH2 GLN 265.A O no hydrogen 3.140 N/A ASP 276.A N SER 273.A OG no hydrogen 3.308 N/A VAL 277.A N SER 273.A O no hydrogen 3.101 N/A HIS 278.A N ILE 274.A O no hydrogen 2.800 N/A ALA 279.A N LYS 275.A O no hydrogen 3.048 N/A ARG 280.A N ASP 276.A O no hydrogen 3.166 N/A LEU 281.A N VAL 277.A O no hydrogen 3.135 N/A GLN 282.A N HIS 278.A O no hydrogen 2.827 N/A ALA 283.A N ALA 279.A O no hydrogen 3.079 N/A LEU 284.A N ARG 280.A O no hydrogen 3.191 N/A ALA 285.A N LEU 281.A O no hydrogen 2.832 N/A GLN 286.A N GLN 282.A O no hydrogen 2.877 N/A ALA 287.A N LEU 284.A O no hydrogen 3.454 N/A LEU 292.A N PRO 288.A O no hydrogen 3.039 N/A ASP 293.A N PRO 289.A O no hydrogen 2.689 N/A VAL 294.A N TYR 291.A O no hydrogen 3.235 N/A LEU 295.A N LEU 292.A O no hydrogen 3.239 N/A GLY 296.A N LEU 292.A O no hydrogen 3.301 N/A