Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5cy3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N ILE 77.A O no hydrogen 2.829 N/A ASP 7.A N TYR 31.A OH no hydrogen 2.959 N/A ARG 8.A NE GLU 81.A OE1 no hydrogen 3.298 N/A ARG 8.A NE GLU 81.A OE2 no hydrogen 2.765 N/A ARG 8.A NH1 ARG 8.A O no hydrogen 3.218 N/A ARG 8.A NH2 GLU 81.A OE1 no hydrogen 2.784 N/A LYS 9.A N ASP 7.A OD1 no hydrogen 3.061 N/A LEU 10.A N ASP 7.A O no hydrogen 2.969 N/A LEU 11.A N ARG 8.A O no hydrogen 3.033 N/A THR 12.A N TYR 30.A O no hydrogen 3.007 N/A GLU 14.A N LYS 28.A O no hydrogen 3.118 N/A LEU 18.A N VAL 26.A O no hydrogen 2.798 N/A GLY 21.A N GLY 24.A O no hydrogen 2.784 N/A ASN 22.A N ASP 151.A OD2 no hydrogen 2.856 N/A ASN 22.A ND2 ASP 133.A OD2 no hydrogen 2.780 N/A ASN 22.A ND2 ASP 151.A OD1 no hydrogen 3.092 N/A THR 25.A N ILE 44.A O no hydrogen 3.249 N/A VAL 26.A N GLY 19.A O no hydrogen 2.802 N/A LYS 27.A N VAL 42.A O no hydrogen 2.898 N/A LYS 27.A NZ ASP 15.A O no hydrogen 2.973 N/A LYS 27.A NZ ASP 15.A OD1 no hydrogen 3.293 N/A LYS 28.A NZ TYR 30.A OH no hydrogen 3.502 N/A GLY 29.A N VAL 40.A O no hydrogen 2.834 N/A TYR 30.A N THR 12.A O no hydrogen 2.925 N/A TYR 30.A OH GLU 14.A OE2 no hydrogen 3.127 N/A TYR 31.A N LYS 38.A O no hydrogen 2.768 N/A GLN 32.A N LEU 10.A O no hydrogen 2.764 N/A MET 33.A N VAL 36.A O no hydrogen 2.870 N/A VAL 36.A N MET 33.A O no hydrogen 2.971 N/A LYS 38.A N TYR 31.A O no hydrogen 2.945 N/A VAL 40.A N GLY 29.A O no hydrogen 2.771 N/A ALA 41.A N MET 87.A O no hydrogen 2.891 N/A VAL 42.A N LYS 27.A O no hydrogen 2.781 N/A LYS 43.A N LEU 85.A O no hydrogen 2.871 N/A LYS 43.A NZ GLU 59.A OE2 no hydrogen 2.763 N/A ILE 44.A N THR 25.A O no hydrogen 2.806 N/A LEU 45.A N TRP 83.A O no hydrogen 2.916 N/A LYS 46.A NZ THR 25.A OG1 no hydrogen 3.401 N/A ASN 47.A ND2 ASP 49.A O no hydrogen 2.793 N/A LEU 52.A N ASP 49.A O no hydrogen 3.395 N/A GLU 55.A N ALA 51.A O no hydrogen 3.090 N/A LEU 56.A N LEU 52.A O no hydrogen 3.031 N/A LEU 57.A N LYS 53.A O no hydrogen 3.043 N/A ALA 58.A N ASP 54.A O no hydrogen 2.989 N/A GLU 59.A N GLU 55.A O no hydrogen 3.006 N/A ALA 60.A N LEU 56.A O no hydrogen 3.093 N/A ASN 61.A N LEU 57.A O no hydrogen 2.978 N/A VAL 62.A N ALA 58.A O no hydrogen 2.862 N/A MET 63.A N GLU 59.A O no hydrogen 3.047 N/A GLN 64.A N ALA 60.A O no hydrogen 3.043 N/A GLN 65.A N ASN 61.A O no hydrogen 3.308 N/A GLN 65.A N VAL 62.A O no hydrogen 3.110 N/A GLN 65.A NE2 ASN 61.A O no hydrogen 3.559 N/A LEU 66.A N MET 63.A O no hydrogen 3.246 N/A ASP 67.A N TYR 123.A OH no hydrogen 2.993 N/A TYR 70.A N ASN 68.A OD1 no hydrogen 2.865 N/A ILE 71.A N ASN 68.A O no hydrogen 3.229 N/A VAL 72.A N ILE 149.A O no hydrogen 3.053 N/A ARG 73.A NH1 ASP 67.A OD1 no hydrogen 2.814 N/A ILE 75.A N VAL 86.A O no hydrogen 2.796 N/A GLY 76.A N VAL 86.A O no hydrogen 3.210 N/A ILE 77.A N VAL 4.A O no hydrogen 2.781 N/A CYS 78.A N MET 84.A O no hydrogen 2.881 N/A CYS 78.A SG LEU 6.A O no hydrogen 3.576 N/A ALA 80.A N SER 82.A O no hydrogen 3.203 N/A GLU 81.A N GLU 81.A OE2 no hydrogen 2.916 N/A MET 84.A N CYS 78.A O no hydrogen 2.944 N/A LEU 85.A N LYS 43.A O no hydrogen 2.869 N/A VAL 86.A N GLY 76.A O no hydrogen 2.836 N/A MET 87.A N ALA 41.A O no hydrogen 2.919 N/A GLU 88.A N ARG 73.A O no hydrogen 3.046 N/A LEU 92.A N LEU 141.A O no hydrogen 2.996 N/A GLY 93.A N ALA 90.A O no hydrogen 3.108 N/A LEU 95.A N VAL 139.A O no hydrogen 2.835 N/A LYS 97.A NZ GLN 100.A OE1 no hydrogen 3.185 N/A TYR 98.A N PRO 94.A O no hydrogen 2.972 N/A TYR 98.A OH GLN 144.A OE1 no hydrogen 2.701 N/A LEU 99.A N LEU 95.A O no hydrogen 2.979 N/A GLN 100.A N ASN 96.A O no hydrogen 3.070 N/A GLN 100.A NE2 GLY 208.A O no hydrogen 2.963 N/A GLN 101.A N LYS 97.A O no hydrogen 3.189 N/A GLN 101.A N TYR 98.A O no hydrogen 3.183 N/A ASN 102.A N LEU 99.A O no hydrogen 3.175 N/A ASN 102.A ND2 TYR 98.A O no hydrogen 2.824 N/A HIS 104.A NE2 ASN 102.A OD1 no hydrogen 3.142 N/A VAL 105.A N ASN 102.A O no hydrogen 3.309 N/A LYS 108.A N ASP 107.A OD1 no hydrogen 2.866 N/A ASN 109.A N THR 106.A OG1 no hydrogen 3.043 N/A ILE 110.A N THR 106.A O no hydrogen 3.017 N/A ILE 111.A N ASP 107.A O no hydrogen 2.910 N/A GLU 112.A N LYS 108.A O no hydrogen 3.015 N/A LEU 113.A N ASN 109.A O no hydrogen 2.992 N/A VAL 114.A N ILE 110.A O no hydrogen 2.935 N/A HIS 115.A N ILE 111.A O no hydrogen 2.896 N/A HIS 115.A NE2 GLU 262.A OE2 no hydrogen 2.749 N/A GLN 116.A N GLU 112.A O no hydrogen 2.960 N/A GLN 116.A NE2 HIS 145.A O no hydrogen 2.887 N/A VAL 117.A N LEU 113.A O no hydrogen 3.044 N/A SER 118.A N VAL 114.A O no hydrogen 2.834 N/A SER 118.A OG HIS 115.A O no hydrogen 2.711 N/A MET 119.A N HIS 115.A O no hydrogen 2.965 N/A GLY 120.A N GLN 116.A O no hydrogen 3.031 N/A MET 121.A N VAL 117.A O no hydrogen 2.875 N/A LYS 122.A N SER 118.A O no hydrogen 2.858 N/A TYR 123.A N MET 119.A O no hydrogen 3.177 N/A LEU 124.A N GLY 120.A O no hydrogen 2.951 N/A GLU 125.A N MET 121.A O no hydrogen 2.842 N/A GLU 126.A N LYS 122.A O no hydrogen 2.945 N/A SER 127.A N TYR 123.A O no hydrogen 3.086 N/A SER 127.A N LEU 124.A O no hydrogen 3.170 N/A SER 127.A OG TYR 123.A O no hydrogen 2.685 N/A ASN 128.A N GLU 125.A O no hydrogen 2.990 N/A PHE 129.A N LEU 124.A O no hydrogen 3.031 N/A VAL 130.A N LYS 156.A O no hydrogen 2.949 N/A HIS 131.A N ASP 193.A OD2 no hydrogen 2.767 N/A HIS 131.A NE2 SER 150.A O no hydrogen 2.929 N/A ARG 132.A N ASP 193.A OD1 no hydrogen 3.014 N/A ARG 132.A NH1 LEU 154.A O no hydrogen 2.829 N/A ASP 133.A N HIS 131.A ND1 no hydrogen 2.957 N/A ALA 136.A N GLU 203.A OE1 no hydrogen 2.897 N/A ARG 137.A NH2 ASP 133.A OD1 no hydrogen 2.935 N/A ASN 138.A N ALA 135.A O no hydrogen 2.933 N/A ASN 138.A ND2 ASP 133.A O no hydrogen 2.775 N/A ASN 138.A ND2 ASP 133.A OD2 no hydrogen 3.009 N/A VAL 139.A N ALA 136.A O no hydrogen 3.115 N/A LEU 140.A N LYS 148.A O no hydrogen 2.835 N/A LEU 141.A N GLY 93.A O no hydrogen 2.894 N/A VAL 142.A N TYR 146.A O no hydrogen 2.836 N/A THR 143.A N TYR 146.A O no hydrogen 3.426 N/A HIS 145.A N THR 143.A OG1 no hydrogen 3.145 N/A HIS 145.A ND1 GLU 112.A OE1 no hydrogen 2.732 N/A TYR 146.A N THR 143.A O no hydrogen 3.150 N/A TYR 146.A OH PRO 69.A O no hydrogen 2.631 N/A ALA 147.A N GLN 116.A OE1 no hydrogen 2.823 N/A LYS 148.A N LEU 140.A O no hydrogen 2.786 N/A ILE 149.A N TYR 70.A O no hydrogen 2.746 N/A SER 150.A N ASN 138.A O no hydrogen 2.797 N/A SER 150.A OG ASN 138.A O no hydrogen 2.708 N/A GLY 153.A N ASP 151.A OD1 no hydrogen 2.989 N/A SER 155.A N PHE 152.A O no hydrogen 3.117 N/A SER 155.A OG.A HIS 131.A O no hydrogen 2.895 N/A SER 155.A OG.B PHE 152.A O no hydrogen 2.735 N/A LYS 156.A N VAL 130.A O no hydrogen 3.023 N/A LEU 158.A N ASN 128.A O no hydrogen 2.782 N/A ARG 159.A N GLU 162.A OE1 no hydrogen 2.780 N/A GLU 162.A N ARG 159.A O no hydrogen 3.274 N/A TYR 165.A N PHE 188.A O no hydrogen 2.808 N/A ALA 167.A N TYR 186.A O no hydrogen 2.981 N/A VAL 175.A N TRP 173.A O no hydrogen 2.885 N/A LYS 176.A NZ TYR 212.A O no hydrogen 3.204 N/A LYS 176.A NZ MET 215.A O no hydrogen 2.863 N/A TRP 177.A N PRO 174.A O no hydrogen 2.895 N/A TRP 177.A NE1 GLU 203.A OE1 no hydrogen 2.885 N/A TYR 178.A N VAL 175.A O no hydrogen 3.000 N/A TYR 178.A OH ARG 132.A O no hydrogen 2.686 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.884 N/A CYS 182.A N ALA 179.A O no hydrogen 3.018 N/A CYS 182.A SG LYS 187.A O no hydrogen 3.505 N/A ILE 183.A N ALA 179.A O no hydrogen 3.203 N/A ASN 184.A N PRO 180.A O no hydrogen 2.734 N/A TYR 185.A N GLU 181.A O no hydrogen 2.924 N/A TYR 186.A N CYS 182.A O no hydrogen 2.962 N/A LYS 187.A N GLU 181.A O no hydrogen 3.376 N/A PHE 188.A N TYR 165.A O no hydrogen 2.893 N/A SER 189.A N SER 192.A OG no hydrogen 2.910 N/A SER 189.A OG SER 192.A OG no hydrogen 3.222 N/A LYS 191.A NZ ARG 255.A O no hydrogen 2.870 N/A SER 192.A N SER 189.A OG no hydrogen 3.248 N/A SER 192.A OG GLU 181.A OE2 no hydrogen 2.881 N/A SER 192.A OG LYS 187.A O no hydrogen 3.526 N/A SER 192.A OG SER 189.A OG no hydrogen 3.222 N/A ASP 193.A N SER 189.A O no hydrogen 3.132 N/A VAL 194.A N SER 190.A O no hydrogen 2.993 N/A TRP 195.A N LYS 191.A O no hydrogen 3.198 N/A SER 196.A N SER 192.A O no hydrogen 3.272 N/A SER 196.A OG TRP 177.A O no hydrogen 2.750 N/A SER 196.A OG SER 192.A O no hydrogen 3.419 N/A PHE 197.A N ASP 193.A O no hydrogen 2.824 N/A GLY 198.A N VAL 194.A O no hydrogen 3.035 N/A VAL 199.A N TRP 195.A O no hydrogen 3.200 N/A LEU 200.A N SER 196.A O no hydrogen 2.880 N/A MET 201.A N PHE 197.A O no hydrogen 2.882 N/A TRP 202.A N GLY 198.A O no hydrogen 3.002 N/A TRP 202.A NE1 GLY 231.A O no hydrogen 2.916 N/A GLU 203.A N VAL 199.A O no hydrogen 2.866 N/A ALA 204.A N LEU 200.A O no hydrogen 2.892 N/A PHE 205.A N MET 201.A O no hydrogen 2.980 N/A SER 206.A N TRP 202.A O no hydrogen 2.954 N/A SER 206.A N GLU 203.A O no hydrogen 3.243 N/A SER 206.A OG TRP 202.A O no hydrogen 2.771 N/A TYR 207.A N ALA 204.A O no hydrogen 2.990 N/A TYR 207.A OH VAL 105.A O no hydrogen 2.662 N/A GLY 208.A N GLU 203.A O no hydrogen 2.863 N/A MET 215.A N TYR 212.A O no hydrogen 3.101 N/A LYS 216.A N GLU 219.A OE1 no hydrogen 2.815 N/A VAL 220.A N LYS 216.A O no hydrogen 3.126 N/A THR 221.A N GLY 217.A O no hydrogen 3.014 N/A THR 221.A OG1 GLY 217.A O no hydrogen 3.304 N/A ALA 222.A N SER 218.A O no hydrogen 3.051 N/A MET 223.A N GLU 219.A O no hydrogen 2.991 N/A LEU 224.A N VAL 220.A O no hydrogen 2.974 N/A GLU 225.A N THR 221.A O no hydrogen 3.012 N/A LYS 226.A N ALA 222.A O no hydrogen 3.343 N/A LYS 226.A N MET 223.A O no hydrogen 3.298 N/A GLY 227.A N LEU 224.A O no hydrogen 2.971 N/A GLU 228.A N MET 223.A O no hydrogen 3.166 N/A ARG 229.A NE TRP 248.A O no hydrogen 3.139 N/A ARG 229.A NH1 LEU 224.A O no hydrogen 3.003 N/A ARG 229.A NH1 GLU 228.A O no hydrogen 2.839 N/A ARG 229.A NH2 TRP 248.A O no hydrogen 3.067 N/A CYS 232.A SG PRO 233.A O no hydrogen 3.725 N/A CYS 232.A SG CYS 236.A O no hydrogen 3.890 N/A CYS 236.A N PRO 233.A O no hydrogen 3.015 N/A CYS 236.A SG PRO 237.A O no hydrogen 3.560 N/A ARG 238.A NH2 ASP 242.A OD2 no hydrogen 3.041 N/A GLU 239.A N GLU 239.A OE2 no hydrogen 2.760 N/A MET 240.A N PRO 237.A O no hydrogen 2.927 N/A TYR 241.A N PRO 237.A O no hydrogen 3.072 N/A TYR 241.A OH MET 230.A O no hydrogen 2.698 N/A ASP 242.A N ARG 238.A O no hydrogen 2.843 N/A LEU 243.A N GLU 239.A O no hydrogen 3.041 N/A MET 244.A N MET 240.A O no hydrogen 2.968 N/A ASN 245.A N TYR 241.A O no hydrogen 2.948 N/A ASN 245.A ND2 TYR 241.A O no hydrogen 3.122 N/A LEU 246.A N ASP 242.A O no hydrogen 2.927 N/A CYS 247.A N LEU 243.A O no hydrogen 2.889 N/A CYS 247.A SG LEU 243.A O no hydrogen 3.402 N/A TRP 248.A N MET 244.A O no hydrogen 2.944 N/A THR 249.A N LEU 246.A O no hydrogen 3.157 N/A THR 249.A OG1 LEU 246.A O no hydrogen 2.729 N/A GLU 253.A N.A GLU 253.A OE2.A no hydrogen 2.987 N/A ASN 254.A N ASP 251.A O no hydrogen 3.152 N/A ARG 255.A N ASP 251.A O no hydrogen 3.206 N/A ARG 255.A N VAL 252.A O no hydrogen 3.289 N/A ARG 255.A NE THR 249.A O no hydrogen 2.913 N/A ARG 255.A NH1 GLU 181.A OE2 no hydrogen 2.807 N/A ARG 255.A NH1 LYS 191.A O no hydrogen 3.011 N/A ARG 255.A NH2 GLU 181.A OE1 no hydrogen 2.899 N/A ARG 255.A NH2 THR 249.A O no hydrogen 3.095 N/A ARG 255.A NH2 TYR 250.A O no hydrogen 3.091 N/A PHE 258.A N GLU 125.A OE1 no hydrogen 2.809 N/A VAL 261.A N GLY 257.A O no hydrogen 3.256 N/A GLU 262.A N PHE 258.A O no hydrogen 2.835 N/A LEU 263.A N ALA 259.A O no hydrogen 3.064 N/A ARG 264.A N ALA 260.A O no hydrogen 3.097 N/A LEU 265.A N VAL 261.A O no hydrogen 3.030 N/A ARG 266.A N GLU 262.A O no hydrogen 2.823 N/A ARG 266.A NE GLU 262.A OE2 no hydrogen 3.144 N/A ARG 266.A NH2 GLU 262.A OE1 no hydrogen 2.776 N/A ASN 267.A N LEU 263.A O no hydrogen 2.919 N/A TYR 268.A N ARG 264.A O no hydrogen 3.020 N/A TYR 269.A N LEU 265.A O no hydrogen 2.903 N/A TYR 270.A N ARG 266.A O no hydrogen 3.030 N/A ASP 271.A N ASN 267.A O no hydrogen 3.038 N/A VAL 272.A N TYR 268.A O no hydrogen 2.919 N/A VAL 273.A N TYR 269.A O no hydrogen 3.064 N/A ASN 274.A N TYR 270.A O no hydrogen 3.104 N/A ASN 274.A ND2 TYR 270.A O no hydrogen 2.830 N/A GLU 275.A N ASP 271.A O no hydrogen 2.869 N/A