Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a9r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N PRO 4.A O no hydrogen 2.970 N/A ARG 8.A N PRO 4.A O no hydrogen 3.088 N/A ASP 9.A N LYS 5.A O no hydrogen 2.878 N/A GLU 10.A N LEU 7.A O no hydrogen 3.023 N/A TYR 11.A N LEU 7.A O no hydrogen 2.864 N/A ILE 12.A N PHE 23.A O no hydrogen 2.848 N/A SER 14.A N LEU 21.A O no hydrogen 2.678 N/A THR 16.A OG1 GLU 18.A OE1 no hydrogen 3.517 N/A LEU 17.A N VAL 19.A O no hydrogen 2.702 N/A LYS 20.A N ILE 33.A O no hydrogen 2.963 N/A LEU 21.A N LYS 15.A O no hydrogen 2.778 N/A ALA 22.A N VAL 31.A O no hydrogen 2.846 N/A PHE 23.A N ILE 12.A O no hydrogen 2.901 N/A GLU 24.A N LYS 29.A O no hydrogen 2.877 N/A ARG 25.A N GLU 10.A O no hydrogen 2.799 N/A ARG 25.A NE ARG 8.A O no hydrogen 2.777 N/A ARG 25.A NH2 ARG 8.A O no hydrogen 2.799 N/A THR 27.A N GLU 24.A O no hydrogen 3.358 N/A THR 27.A OG1 GLU 24.A OE1 no hydrogen 3.231 N/A CYS 28.A N GLU 24.A O no hydrogen 2.701 N/A CYS 28.A SG ARG 25.A O no hydrogen 3.987 N/A LYS 29.A N THR 27.A OG1 no hydrogen 3.069 N/A VAL 31.A N ALA 22.A O no hydrogen 2.716 N/A ALA 32.A N LEU 74.A O no hydrogen 2.838 N/A ILE 33.A N LYS 20.A O no hydrogen 2.934 N/A LYS 34.A N ILE 72.A O no hydrogen 2.783 N/A LYS 34.A NZ GLU 46.A OE1 no hydrogen 3.535 N/A LYS 34.A NZ GLU 46.A OE2 no hydrogen 2.835 N/A ILE 35.A N GLU 18.A O no hydrogen 2.783 N/A ILE 36.A N TYR 70.A O no hydrogen 2.802 N/A SER 37.A OG ASP 69.A OD1 no hydrogen 2.971 N/A LYS 38.A NZ ASP 66.A OD1 no hydrogen 2.836 N/A LYS 38.A NZ ALA 67.A O no hydrogen 3.229 N/A GLU 44.A N ALA 40.A O no hydrogen 2.548 N/A THR 45.A N LEU 41.A O no hydrogen 2.878 N/A THR 45.A OG1 LEU 41.A O no hydrogen 3.103 N/A GLU 46.A N ASN 42.A O no hydrogen 3.231 N/A ILE 47.A N VAL 43.A O no hydrogen 2.996 N/A GLU 48.A N GLU 44.A O no hydrogen 2.926 N/A ILE 49.A N THR 45.A O no hydrogen 2.952 N/A LEU 50.A N GLU 46.A O no hydrogen 2.829 N/A LYS 51.A N ILE 47.A O no hydrogen 2.964 N/A LYS 52.A N GLU 48.A O no hydrogen 3.384 N/A LYS 52.A N ILE 49.A O no hydrogen 2.901 N/A LEU 53.A N ILE 49.A O no hydrogen 3.048 N/A ASN 54.A N TYR 110.A OH no hydrogen 3.092 N/A CYS 57.A N HIS 55.A ND1 no hydrogen 3.093 N/A CYS 57.A SG GLN 103.A O no hydrogen 3.998 N/A CYS 57.A SG GLN 103.A OE1 no hydrogen 3.866 N/A ILE 58.A N HIS 55.A O no hydrogen 2.903 N/A ILE 59.A N ILE 139.A O no hydrogen 2.986 N/A LYS 60.A N GLU 75.A OE2 no hydrogen 2.988 N/A LYS 60.A NZ HIS 55.A O no hydrogen 3.304 N/A LYS 62.A N VAL 73.A O no hydrogen 2.606 N/A ASN 63.A N VAL 73.A O no hydrogen 3.257 N/A ASN 63.A ND2 GLU 10.A OE2 no hydrogen 3.541 N/A PHE 64.A N ASN 63.A OD1 no hydrogen 2.542 N/A PHE 65.A N TYR 71.A O no hydrogen 2.718 N/A ALA 67.A N ASP 69.A O no hydrogen 2.857 N/A TYR 70.A N ILE 36.A O no hydrogen 2.655 N/A TYR 71.A N PHE 65.A O no hydrogen 2.815 N/A ILE 72.A N LYS 34.A O no hydrogen 2.865 N/A VAL 73.A N ASN 63.A O no hydrogen 2.628 N/A LEU 74.A N ALA 32.A O no hydrogen 2.782 N/A GLU 75.A N LYS 60.A O no hydrogen 3.368 N/A GLY 80.A N MET 77.A O no hydrogen 2.961 N/A LEU 82.A N VAL 126.A O no hydrogen 2.748 N/A ASP 84.A N GLU 81.A O no hydrogen 3.205 N/A LYS 85.A N LEU 82.A O no hydrogen 2.878 N/A VAL 86.A N PHE 83.A O no hydrogen 3.010 N/A VAL 87.A N PHE 83.A O no hydrogen 3.043 N/A LYS 90.A N VAL 87.A O no hydrogen 3.508 N/A LYS 90.A NZ ASP 84.A O no hydrogen 3.365 N/A LYS 93.A NZ GLU 133.A OE1 no hydrogen 3.551 N/A LYS 93.A NZ GLU 133.A OE2 no hydrogen 3.485 N/A THR 96.A N LYS 93.A O no hydrogen 2.946 N/A CYS 97.A N LYS 93.A O no hydrogen 3.045 N/A CYS 97.A SG LEU 92.A O no hydrogen 3.513 N/A CYS 97.A SG LYS 93.A O no hydrogen 3.617 N/A LYS 98.A N GLU 94.A O no hydrogen 2.917 N/A LYS 98.A NZ TRP 258.A O no hydrogen 3.181 N/A LYS 98.A NZ ASP 261.A OD2 no hydrogen 2.851 N/A LEU 99.A N ALA 95.A O no hydrogen 3.241 N/A TYR 100.A N THR 96.A O no hydrogen 2.882 N/A TYR 100.A OH GLU 133.A O no hydrogen 2.672 N/A PHE 101.A N CYS 97.A O no hydrogen 2.738 N/A TYR 102.A N LYS 98.A O no hydrogen 2.891 N/A GLN 103.A NE2 LEU 99.A O no hydrogen 3.071 N/A GLN 103.A NE2 CYS 135.A O no hydrogen 3.261 N/A MET 104.A N TYR 100.A O no hydrogen 2.983 N/A LEU 105.A N PHE 101.A O no hydrogen 2.849 N/A LEU 106.A N TYR 102.A O no hydrogen 2.993 N/A ALA 107.A N GLN 103.A O no hydrogen 2.932 N/A VAL 108.A N MET 104.A O no hydrogen 2.875 N/A GLN 109.A N LEU 105.A O no hydrogen 2.617 N/A TYR 110.A N LEU 106.A O no hydrogen 2.866 N/A LEU 111.A N ALA 107.A O no hydrogen 2.873 N/A HIS 112.A N VAL 108.A O no hydrogen 2.975 N/A HIS 112.A NE2 ASP 182.A OD2 no hydrogen 3.012 N/A GLU 113.A N GLN 109.A O no hydrogen 2.820 N/A ASN 114.A N TYR 110.A O no hydrogen 3.022 N/A ASN 114.A N LEU 111.A O no hydrogen 2.857 N/A ASN 114.A ND2 TYR 110.A O no hydrogen 2.832 N/A GLY 115.A N HIS 112.A O no hydrogen 2.931 N/A ILE 116.A N LEU 111.A O no hydrogen 2.900 N/A ILE 117.A N LYS 146.A O no hydrogen 2.946 N/A HIS 118.A N ASP 182.A OD2 no hydrogen 2.951 N/A HIS 118.A NE2 THR 140.A O no hydrogen 2.850 N/A ARG 119.A N ASP 182.A OD1 no hydrogen 2.901 N/A ASP 120.A N HIS 118.A ND1 no hydrogen 2.947 N/A LYS 122.A NZ ASP 120.A OD1 no hydrogen 3.524 N/A LYS 122.A NZ ASP 120.A OD2 no hydrogen 3.383 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.470 N/A ASN 125.A N LYS 122.A O no hydrogen 2.711 N/A ASN 125.A ND2 ASP 120.A O no hydrogen 2.653 N/A ASN 125.A ND2 ASP 120.A OD2 no hydrogen 3.505 N/A VAL 126.A N PRO 123.A O no hydrogen 3.205 N/A LEU 127.A N LYS 138.A O no hydrogen 2.875 N/A LEU 128.A N GLY 80.A O no hydrogen 2.707 N/A SER 129.A N LEU 136.A O no hydrogen 2.584 N/A SER 129.A OG LEU 136.A O no hydrogen 3.216 N/A GLU 132.A N SER 130.A OG no hydrogen 2.968 N/A CYS 135.A SG TYR 100.A OH no hydrogen 3.897 N/A CYS 135.A SG SER 130.A O no hydrogen 3.937 N/A CYS 135.A SG GLU 132.A O no hydrogen 3.697 N/A CYS 135.A SG LEU 136.A O no hydrogen 3.694 N/A LEU 136.A N SER 129.A OG no hydrogen 2.801 N/A ILE 137.A N GLN 103.A OE1 no hydrogen 2.689 N/A LYS 138.A N LEU 127.A O no hydrogen 2.786 N/A LYS 138.A NZ PRO 56.A O no hydrogen 2.505 N/A LYS 138.A NZ GLU 75.A OE2 no hydrogen 3.514 N/A ILE 139.A N CYS 57.A O no hydrogen 2.846 N/A THR 140.A N ASN 125.A O no hydrogen 3.046 N/A PHE 142.A N GLU 46.A OE2 no hydrogen 3.193 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 3.426 N/A SER 145.A N PHE 142.A O no hydrogen 3.324 N/A SER 145.A OG HIS 118.A O no hydrogen 3.504 N/A SER 145.A OG PHE 142.A O no hydrogen 3.154 N/A LYS 146.A N ILE 117.A O no hydrogen 2.841 N/A THR 151.A N GLY 149.A O no hydrogen 2.366 N/A SER 152.A N GLU 150.A O no hydrogen 2.301 N/A SER 152.A OG THR 151.A O no hydrogen 2.223 N/A LEU 153.A N THR 151.A O no hydrogen 2.543 N/A THR 156.A N SER 152.A O no hydrogen 2.731 N/A THR 156.A OG1 SER 152.A O no hydrogen 3.558 N/A THR 156.A OG1 LEU 153.A O no hydrogen 2.488 N/A LEU 157.A N LEU 153.A O no hydrogen 2.716 N/A CYS 158.A N MET 154.A O no hydrogen 3.152 N/A CYS 158.A SG MET 154.A O no hydrogen 3.482 N/A GLY 159.A N THR 156.A O no hydrogen 3.046 N/A THR 160.A OG1 THR 162.A OG1 no hydrogen 3.393 N/A THR 162.A OG1 THR 160.A OG1 no hydrogen 3.393 N/A LEU 164.A N PRO 161.A O no hydrogen 2.741 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.651 N/A VAL 168.A N ALA 165.A O no hydrogen 3.125 N/A VAL 170.A N PRO 166.A O no hydrogen 2.938 N/A SER 171.A N GLU 167.A O no hydrogen 3.058 N/A SER 171.A OG VAL 168.A O no hydrogen 2.452 N/A VAL 172.A N LEU 169.A O no hydrogen 3.161 N/A GLY 173.A N VAL 170.A O no hydrogen 3.089 N/A THR 174.A N SER 171.A O no hydrogen 3.156 N/A ALA 175.A N SER 171.A O no hydrogen 3.014 N/A ALA 180.A N TYR 177.A O no hydrogen 3.129 N/A VAL 181.A N ASN 178.A O no hydrogen 3.114 N/A ASP 182.A N ARG 179.A O no hydrogen 3.050 N/A CYS 183.A SG PHE 248.A O no hydrogen 3.476 N/A TRP 184.A N ALA 180.A O no hydrogen 3.053 N/A SER 185.A N VAL 181.A O no hydrogen 3.140 N/A SER 185.A OG VAL 181.A O no hydrogen 3.057 N/A LEU 186.A N ASP 182.A O no hydrogen 2.938 N/A GLY 187.A N CYS 183.A O no hydrogen 3.169 N/A VAL 188.A N TRP 184.A O no hydrogen 2.965 N/A ILE 189.A N SER 185.A O no hydrogen 2.810 N/A LEU 190.A N LEU 186.A O no hydrogen 2.632 N/A PHE 191.A N GLY 187.A O no hydrogen 2.994 N/A ILE 192.A N VAL 188.A O no hydrogen 3.166 N/A CYS 193.A N ILE 189.A O no hydrogen 2.917 N/A CYS 193.A SG ILE 189.A O no hydrogen 3.786 N/A LEU 194.A N LEU 190.A O no hydrogen 3.005 N/A SER 195.A N PHE 191.A O no hydrogen 3.031 N/A SER 195.A N ILE 192.A O no hydrogen 3.208 N/A SER 195.A OG PHE 191.A O no hydrogen 2.815 N/A GLY 196.A N ILE 192.A O no hydrogen 2.583 N/A TYR 197.A N SER 195.A OG no hydrogen 3.361 N/A TYR 197.A OH ASN 219.A O no hydrogen 2.560 N/A VAL 207.A N THR 205.A OG1 no hydrogen 3.287 N/A ASP 211.A N SER 208.A OG no hydrogen 3.144 N/A GLN 212.A N SER 208.A O no hydrogen 3.009 N/A GLN 212.A NE2 SER 201.A O no hydrogen 2.886 N/A GLN 212.A NE2 VAL 207.A O no hydrogen 3.222 N/A ILE 213.A N LEU 209.A O no hydrogen 3.060 N/A THR 214.A N LYS 210.A O no hydrogen 2.983 N/A THR 214.A OG1 LYS 210.A O no hydrogen 2.787 N/A THR 214.A OG1 ASP 211.A O no hydrogen 3.305 N/A SER 215.A N ASP 211.A O no hydrogen 2.872 N/A SER 215.A OG ASP 211.A O no hydrogen 2.793 N/A SER 215.A OG GLN 212.A O no hydrogen 3.144 N/A GLY 216.A N ILE 213.A O no hydrogen 3.120 N/A LYS 217.A N SER 215.A OG no hydrogen 3.237 N/A ASN 219.A N PRO 199.A O no hydrogen 2.858 N/A ILE 221.A N TYR 197.A OH no hydrogen 3.036 N/A GLU 223.A N GLU 223.A OE1 no hydrogen 2.288 N/A TRP 225.A N ILE 221.A O no hydrogen 3.071 N/A TRP 225.A NE1 TYR 197.A OH no hydrogen 3.038 N/A ALA 226.A N PRO 222.A O no hydrogen 2.608 N/A GLU 227.A N VAL 224.A O no hydrogen 3.395 N/A VAL 228.A N TRP 225.A O no hydrogen 3.133 N/A SER 229.A N GLU 94.A OE1 no hydrogen 3.052 N/A SER 229.A OG GLU 94.A OE2 no hydrogen 2.806 N/A ALA 232.A N SER 229.A OG no hydrogen 3.084 N/A ASP 234.A N GLU 230.A O no hydrogen 2.916 N/A LEU 235.A N LYS 231.A O no hydrogen 3.135 N/A VAL 236.A N ALA 232.A O no hydrogen 3.351 N/A LYS 237.A N LEU 233.A O no hydrogen 3.059 N/A LYS 238.A N ASP 234.A O no hydrogen 3.114 N/A LYS 238.A N LEU 235.A O no hydrogen 3.027 N/A LYS 238.A NZ ASP 234.A OD1 no hydrogen 2.997 N/A LEU 239.A N VAL 236.A O no hydrogen 3.077 N/A LEU 240.A N VAL 236.A O no hydrogen 2.921 N/A LYS 245.A N ASP 243.A OD1 no hydrogen 3.227 N/A LYS 245.A NZ GLY 173.A O no hydrogen 3.184 N/A ALA 246.A N ASP 243.A O no hydrogen 2.879 N/A ARG 247.A N ASP 243.A O no hydrogen 2.827 N/A ARG 247.A NE VAL 241.A O no hydrogen 2.751 N/A ARG 247.A NH1 ALA 180.A O no hydrogen 2.784 N/A ARG 247.A NH2 VAL 241.A O no hydrogen 3.058 N/A ARG 247.A NH2 VAL 242.A O no hydrogen 3.115 N/A PHE 248.A N LYS 238.A O no hydrogen 3.075 N/A THR 249.A N GLU 252.A OE1 no hydrogen 2.886 N/A THR 249.A OG1 GLU 251.A OE1 no hydrogen 2.897 N/A GLU 252.A N THR 249.A OG1 no hydrogen 3.135 N/A ALA 253.A N THR 249.A O no hydrogen 2.970 N/A LEU 254.A N THR 250.A O no hydrogen 2.797 N/A ARG 255.A N GLU 251.A O no hydrogen 3.095 N/A HIS 256.A N ALA 253.A O no hydrogen 2.830 N/A HIS 256.A NE2 ASP 234.A OD1 no hydrogen 2.932 N/A TRP 258.A N HIS 256.A ND1 no hydrogen 2.895 N/A TRP 258.A NE1 GLU 94.A OE2 no hydrogen 2.864 N/A LEU 259.A N HIS 256.A O no hydrogen 2.764 N/A GLN 260.A N PRO 257.A O no hydrogen 2.757 N/A GLN 260.A NE2 LEU 254.A O no hydrogen 2.791 N/A GLN 260.A NE2 HIS 256.A O no hydrogen 2.988 N/A ASP 261.A N LEU 259.A O no hydrogen 2.961 N/A MET 264.A N ASP 261.A OD1 no hydrogen 3.294 N/A LYS 265.A N ASP 261.A O no hydrogen 3.008 N/A ARG 266.A N GLU 262.A O no hydrogen 2.721 N/A ARG 266.A NH2 ASP 263.A OD1 no hydrogen 3.149 N/A LYS 267.A N ASP 263.A O no hydrogen 3.003 N/A PHE 268.A N MET 264.A O no hydrogen 3.019 N/A GLN 269.A N LYS 265.A O no hydrogen 2.914 N/A ASP 270.A N ARG 266.A O no hydrogen 2.897 N/A LEU 271.A N LYS 267.A O no hydrogen 3.126 N/A LEU 272.A N PHE 268.A O no hydrogen 3.136 N/A SER 273.A N GLN 269.A O no hydrogen 3.452 N/A SER 273.A OG ASP 270.A O no hydrogen 3.209 N/A GLU 274.A N ASP 270.A O no hydrogen 3.191 N/A GLU 275.A N LEU 271.A O no hydrogen 3.342 N/A ASN 276.A N LEU 272.A O no hydrogen 2.851 N/A ALA 280.A N GLU 277.A O no hydrogen 2.871 N/A