Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2psj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ PRO 183.A O no hydrogen 3.083 N/A LYS 2.A NZ SER 184.A O no hydrogen 3.143 N/A LYS 2.A NZ ILE 186.A O no hydrogen 2.570 N/A GLU 7.A N ASP 5.A OD1 no hydrogen 3.062 N/A GLN 8.A N ASP 5.A O no hydrogen 3.161 N/A GLN 8.A NE2 HIS 60.A NE2 no hydrogen 3.182 N/A GLN 8.A NE2 GLU 194.A OE2 no hydrogen 2.998 N/A ARG 9.A NH1 GLU 191.A OE1 no hydrogen 3.091 N/A ARG 9.A NH1 GLU 193.A OE1 no hydrogen 3.015 N/A ARG 9.A NH2 GLU 193.A OE2 no hydrogen 3.116 N/A ARG 11.A N GLN 8.A O no hydrogen 2.969 N/A ARG 11.A NE GLN 8.A OE1 no hydrogen 3.058 N/A ARG 11.A NH1 ASP 289.A OD1 no hydrogen 3.181 N/A ARG 11.A NH1 ASP 289.A OD2 no hydrogen 2.850 N/A ARG 11.A NH2 ASP 289.A OD2 no hydrogen 3.109 N/A MET 12.A N ARG 9.A O no hydrogen 3.292 N/A THR 14.A N GLN 17.A OE1 no hydrogen 2.786 N/A GLN 17.A N THR 14.A OG1 no hydrogen 3.179 N/A TRP 18.A N THR 14.A O no hydrogen 2.991 N/A TRP 18.A NE1 SER 55.A OG no hydrogen 2.879 N/A TRP 19.A N GLY 15.A O no hydrogen 2.842 N/A ALA 20.A N PRO 16.A O no hydrogen 3.013 N/A ARG 21.A N TRP 18.A O no hydrogen 2.937 N/A ARG 21.A NH2 TYR 35.A OH no hydrogen 3.246 N/A CYS 22.A N TRP 19.A O no hydrogen 3.123 N/A CYS 22.A SG TRP 18.A O no hydrogen 3.470 N/A LYS 23.A N TYR 34.A O no hydrogen 2.645 N/A LYS 23.A NZ GLU 38.A OE1 no hydrogen 3.080 N/A GLN 24.A NE2 ASN 33.A OD1 no hydrogen 2.973 N/A MET 25.A N ILE 32.A O no hydrogen 3.110 N/A VAL 27.A N SER 30.A O no hydrogen 2.863 N/A SER 30.A N VAL 27.A O no hydrogen 2.834 N/A SER 30.A OG LYS 84.A O no hydrogen 2.703 N/A ILE 32.A N MET 25.A O no hydrogen 2.890 N/A ASN 33.A N SER 82.A OG no hydrogen 2.877 N/A ASN 33.A ND2 ASP 75.A OD2 no hydrogen 2.621 N/A TYR 34.A N LYS 23.A O no hydrogen 2.799 N/A TYR 35.A N ILE 73.A O no hydrogen 2.856 N/A TYR 35.A OH GLU 66.A OE2 no hydrogen 2.281 N/A SER 37.A N CYS 71.A O no hydrogen 2.943 N/A SER 37.A OG CYS 71.A O no hydrogen 3.546 N/A GLU 38.A N ASP 36.A OD1 no hydrogen 2.968 N/A LYS 39.A N SER 37.A O no hydrogen 2.744 N/A GLU 42.A N GLU 42.A OE1 no hydrogen 2.884 N/A ASN 43.A N HIS 40.A O no hydrogen 3.342 N/A VAL 45.A N ARG 70.A O no hydrogen 2.771 N/A ILE 46.A N ILE 113.A O no hydrogen 2.837 N/A PHE 47.A N ILE 72.A O no hydrogen 2.997 N/A LEU 48.A N VAL 115.A O no hydrogen 2.746 N/A HIS 49.A ND1 GLY 50.A O no hydrogen 2.900 N/A ASN 51.A N ASP 118.A OD2 no hydrogen 2.800 N/A ASN 51.A ND2 THR 212.A O no hydrogen 3.266 N/A THR 53.A OG1 GLY 50.A O no hydrogen 3.305 N/A SER 55.A N ASP 75.A OD1 no hydrogen 2.773 N/A SER 55.A OG ASP 75.A OD1 no hydrogen 2.593 N/A TYR 56.A N SER 54.A OG no hydrogen 3.213 N/A TYR 56.A OH ILE 13.A O no hydrogen 2.555 N/A LEU 57.A N SER 54.A O no hydrogen 3.074 N/A TRP 58.A N SER 55.A O no hydrogen 2.953 N/A ARG 59.A N TYR 56.A O no hydrogen 3.115 N/A ARG 59.A NH1 TYR 56.A O no hydrogen 2.939 N/A ARG 59.A NH1 GLU 285.A OE2 no hydrogen 2.899 N/A ARG 59.A NH2 GLU 194.A OE2 no hydrogen 2.982 N/A ARG 59.A NH2 GLU 285.A OE1 no hydrogen 3.058 N/A ARG 59.A NH2 GLU 285.A OE2 no hydrogen 3.349 N/A VAL 61.A N TRP 58.A O no hydrogen 2.942 N/A VAL 62.A N TRP 58.A O no hydrogen 3.038 N/A HIS 64.A N VAL 61.A O no hydrogen 3.283 N/A HIS 64.A NE2 ASP 289.A OD1 no hydrogen 2.789 N/A ILE 65.A N VAL 62.A O no hydrogen 2.966 N/A GLU 66.A N VAL 62.A O no hydrogen 3.109 N/A VAL 68.A N ILE 65.A O no hydrogen 3.031 N/A ALA 69.A N ILE 65.A O no hydrogen 3.351 N/A ARG 70.A N HIS 40.A O no hydrogen 3.101 N/A ARG 70.A NE ASP 36.A OD1 no hydrogen 2.919 N/A ARG 70.A NE ASP 36.A OD2 no hydrogen 3.474 N/A ARG 70.A NH1 LEU 106.A O no hydrogen 2.858 N/A ARG 70.A NH2 ASP 36.A OD2 no hydrogen 2.896 N/A ARG 70.A NH2 LEU 106.A O no hydrogen 3.204 N/A CYS 71.A N SER 37.A OG no hydrogen 2.827 N/A CYS 71.A SG ALA 69.A O no hydrogen 3.426 N/A ILE 72.A N VAL 45.A O no hydrogen 2.826 N/A ILE 73.A N TYR 35.A O no hydrogen 2.781 N/A ASP 75.A N ASN 33.A O no hydrogen 2.863 N/A LEU 76.A N HIS 49.A NE2 no hydrogen 3.004 N/A GLY 78.A N GLY 83.A O no hydrogen 2.941 N/A MET 79.A N LEU 76.A O no hydrogen 2.925 N/A LYS 81.A N ASP 75.A OD2 no hydrogen 2.898 N/A SER 82.A N MET 79.A O no hydrogen 3.174 N/A SER 82.A OG ASP 75.A O no hydrogen 2.534 N/A GLY 83.A N PHE 31.A O no hydrogen 2.868 N/A SER 85.A N TYR 90.A OH no hydrogen 2.945 N/A SER 85.A OG SER 89.A O no hydrogen 2.903 N/A GLY 86.A N TYR 98.A OH no hydrogen 2.888 N/A GLY 88.A N SER 85.A O no hydrogen 3.044 N/A SER 89.A N ASN 87.A OD1 no hydrogen 3.145 N/A SER 89.A OG ASP 94.A OD2 no hydrogen 2.553 N/A ARG 91.A N ASP 94.A OD2 no hydrogen 2.936 N/A ARG 91.A NE GLU 218.A OE2 no hydrogen 3.029 N/A ARG 91.A NH1 ASP 228.A OD2 no hydrogen 2.929 N/A ARG 91.A NH2 GLU 218.A OE1 no hydrogen 3.415 N/A ARG 91.A NH2 GLU 218.A OE2 no hydrogen 3.047 N/A ARG 91.A NH2 ASP 228.A OD1 no hydrogen 2.996 N/A ARG 91.A NH2 ASP 228.A OD2 no hydrogen 3.495 N/A LEU 92.A N GLU 218.A OE1 no hydrogen 2.827 N/A HIS 95.A N ARG 91.A O no hydrogen 3.045 N/A TYR 96.A N LEU 92.A O no hydrogen 2.920 N/A TYR 96.A OH GLU 130.A OE1 no hydrogen 2.716 N/A LYS 97.A N LEU 93.A O no hydrogen 2.872 N/A TYR 98.A N ASP 94.A O no hydrogen 3.281 N/A TYR 98.A OH ASP 29.A OD1 no hydrogen 2.599 N/A LEU 99.A N HIS 95.A O no hydrogen 2.898 N/A THR 100.A N TYR 96.A O no hydrogen 2.964 N/A THR 100.A OG1 TYR 96.A O no hydrogen 2.812 N/A THR 100.A OG1 LYS 97.A O no hydrogen 3.265 N/A ALA 101.A N LYS 97.A O no hydrogen 3.227 N/A TRP 102.A N TYR 98.A O no hydrogen 2.886 N/A PHE 103.A N LEU 99.A O no hydrogen 2.992 N/A GLU 104.A N THR 100.A O no hydrogen 3.297 N/A LEU 105.A N TRP 102.A O no hydrogen 2.961 N/A LEU 106.A N PHE 103.A O no hydrogen 3.092 N/A LYS 110.A NZ ASP 133.A O no hydrogen 3.295 N/A ILE 112.A N ARG 134.A O no hydrogen 2.784 N/A ILE 113.A N ALA 44.A O no hydrogen 2.889 N/A PHE 114.A N ALA 137.A O no hydrogen 3.102 N/A VAL 115.A N ILE 46.A O no hydrogen 2.874 N/A GLY 116.A N VAL 139.A O no hydrogen 2.866 N/A HIS 117.A N LEU 48.A O no hydrogen 3.120 N/A HIS 117.A NE2 HIS 281.A O no hydrogen 2.920 N/A ASP 118.A N MET 141.A O no hydrogen 3.421 N/A ALA 121.A N ASP 118.A O no hydrogen 3.005 N/A LEU 123.A N TRP 119.A O no hydrogen 3.059 N/A ALA 124.A N GLY 120.A O no hydrogen 3.043 N/A PHE 125.A N ALA 121.A O no hydrogen 2.808 N/A HIS 126.A N ALA 122.A O no hydrogen 2.866 N/A TYR 127.A N LEU 123.A O no hydrogen 2.919 N/A ALA 128.A N ALA 124.A O no hydrogen 2.847 N/A TYR 129.A N PHE 125.A O no hydrogen 2.969 N/A GLU 130.A N HIS 126.A O no hydrogen 3.082 N/A HIS 131.A N ALA 128.A O no hydrogen 3.153 N/A HIS 131.A ND1 TYR 127.A O no hydrogen 2.710 N/A GLN 132.A NE2 TYR 129.A O no hydrogen 2.956 N/A ARG 134.A N HIS 131.A O no hydrogen 2.991 N/A ARG 134.A NE LYS 110.A O no hydrogen 2.681 N/A ARG 134.A NH2 PRO 109.A O no hydrogen 3.053 N/A LYS 136.A N ILE 112.A O no hydrogen 2.831 N/A LYS 136.A NZ ASN 43.A OD1 no hydrogen 2.692 N/A LYS 136.A NZ GLU 306.A OE1 no hydrogen 2.768 N/A LYS 136.A NZ GLU 306.A OE2 no hydrogen 3.322 N/A ILE 138.A N PRO 247.A O no hydrogen 3.084 N/A VAL 139.A N PHE 114.A O no hydrogen 2.773 N/A HIS 140.A N LEU 249.A O no hydrogen 2.905 N/A MET 141.A N GLY 116.A O no hydrogen 3.117 N/A VAL 147.A N ASP 146.A OD1 no hydrogen 2.857 N/A ILE 148.A N PRO 220.A O no hydrogen 2.910 N/A TRP 152.A NE1 ASP 158.A OD2 no hydrogen 2.979 N/A ILE 155.A N TRP 152.A O no hydrogen 3.071 N/A ASP 158.A N ASP 154.A O no hydrogen 3.092 N/A ILE 159.A N ILE 155.A O no hydrogen 2.866 N/A ALA 160.A N GLU 156.A O no hydrogen 2.797 N/A LEU 161.A N GLU 157.A O no hydrogen 3.067 N/A ILE 162.A N ASP 158.A O no hydrogen 2.911 N/A LYS 163.A N ILE 159.A O no hydrogen 2.953 N/A SER 164.A N ALA 160.A O no hydrogen 3.193 N/A SER 164.A N LEU 161.A O no hydrogen 2.990 N/A SER 164.A OG LEU 161.A O no hydrogen 2.570 N/A GLU 166.A N SER 164.A OG no hydrogen 3.177 N/A GLY 167.A N SER 164.A O no hydrogen 2.957 N/A LYS 169.A N GLU 165.A O no hydrogen 3.335 N/A LYS 169.A NZ GLU 166.A OE1 no hydrogen 3.368 N/A MET 170.A N GLU 166.A O no hydrogen 2.736 N/A VAL 171.A N GLY 167.A O no hydrogen 2.995 N/A LEU 172.A N GLU 168.A O no hydrogen 2.724 N/A GLU 173.A N GLU 168.A O no hydrogen 3.444 N/A ASN 174.A N LYS 169.A O no hydrogen 2.982 N/A ASN 174.A ND2 LYS 169.A O no hydrogen 3.123 N/A ASN 175.A N VAL 171.A O no hydrogen 2.829 N/A ASN 175.A ND2 GLU 179.A OE2 no hydrogen 2.845 N/A PHE 176.A N MET 170.A O no hydrogen 2.926 N/A GLU 179.A N ASN 175.A O no hydrogen 2.838 N/A THR 180.A N PHE 176.A O no hydrogen 2.985 N/A VAL 181.A N PHE 176.A O no hydrogen 2.951 N/A LEU 182.A N PHE 177.A O no hydrogen 2.925 N/A SER 184.A OG VAL 181.A O no hydrogen 2.651 N/A LYS 185.A N LEU 182.A O no hydrogen 3.039 N/A LYS 185.A NZ SER 184.A OG no hydrogen 2.853 N/A ILE 186.A N PRO 183.A O no hydrogen 3.375 N/A MET 187.A N ASP 286.A OD2 no hydrogen 2.734 N/A ARG 188.A N ASP 286.A OD1 no hydrogen 2.971 N/A ARG 188.A NE GLU 285.A O no hydrogen 2.760 N/A ARG 188.A NH1 GLU 194.A OE1 no hydrogen 2.934 N/A ARG 188.A NH2 GLU 194.A OE1 no hydrogen 3.332 N/A ARG 188.A NH2 GLU 194.A OE2 no hydrogen 3.053 N/A ARG 188.A NH2 GLU 285.A OE1 no hydrogen 2.886 N/A LYS 189.A N VAL 3.A O no hydrogen 2.975 N/A GLU 191.A N GLU 194.A OE1 no hydrogen 2.804 N/A GLU 193.A N GLU 193.A OE1 no hydrogen 2.704 N/A GLU 194.A N GLU 191.A O no hydrogen 2.961 N/A PHE 195.A N GLU 191.A O no hydrogen 3.099 N/A ALA 196.A N PRO 192.A O no hydrogen 2.989 N/A ALA 197.A N GLU 193.A O no hydrogen 3.196 N/A ALA 197.A N GLU 194.A O no hydrogen 3.137 N/A TYR 198.A N PHE 195.A O no hydrogen 3.024 N/A TYR 198.A OH GLU 285.A OE2 no hydrogen 2.548 N/A LEU 199.A N PHE 195.A O no hydrogen 2.963 N/A GLU 200.A N ALA 196.A O no hydrogen 2.920 N/A PHE 202.A N LEU 199.A O no hydrogen 2.780 N/A LYS 203.A N GLU 200.A O no hydrogen 3.334 N/A LYS 205.A NZ GLU 173.A O no hydrogen 3.213 N/A GLY 206.A N LEU 172.A O no hydrogen 2.896 N/A ARG 209.A N GLY 206.A O no hydrogen 2.985 N/A ARG 209.A NE PHE 202.A O no hydrogen 2.929 N/A ARG 209.A NH1 LEU 172.A O no hydrogen 3.105 N/A ARG 209.A NH1 GLU 173.A O no hydrogen 3.154 N/A ARG 209.A NH2 PHE 202.A O no hydrogen 3.172 N/A ARG 209.A NH2 LYS 203.A O no hydrogen 3.365 N/A ARG 210.A N GLU 207.A O no hydrogen 2.918 N/A ARG 210.A NE GLU 207.A OE1 no hydrogen 3.528 N/A ARG 210.A NE GLU 207.A OE2 no hydrogen 2.835 N/A ARG 210.A NH1 GLU 168.A OE2 no hydrogen 2.970 N/A ARG 210.A NH2 GLU 207.A OE1 no hydrogen 3.140 N/A THR 212.A N ARG 209.A O no hydrogen 2.968 N/A THR 212.A OG1 ARG 209.A O no hydrogen 2.750 N/A LEU 213.A N ARG 210.A O no hydrogen 2.937 N/A SER 214.A N ARG 210.A O no hydrogen 2.836 N/A SER 214.A OG ARG 210.A O no hydrogen 3.229 N/A TRP 215.A N PRO 211.A O no hydrogen 3.154 N/A ARG 217.A N LEU 213.A O no hydrogen 3.401 N/A ARG 217.A NE ILE 162.A O no hydrogen 2.890 N/A ARG 217.A NH1 GLU 168.A OE2 no hydrogen 3.123 N/A ARG 217.A NH2 ILE 162.A O no hydrogen 3.165 N/A ARG 217.A NH2 GLU 168.A OE2 no hydrogen 3.379 N/A GLU 218.A N SER 214.A O no hydrogen 3.229 N/A GLU 218.A N TRP 215.A O no hydrogen 2.899 N/A ILE 219.A N PRO 216.A O no hydrogen 3.117 N/A LEU 221.A N ILE 219.A O no hydrogen 2.806 N/A VAL 222.A N ILE 148.A O no hydrogen 2.865 N/A GLY 225.A N LEU 221.A O no hydrogen 2.717 N/A LYS 226.A NZ GLU 218.A OE2 no hydrogen 2.998 N/A VAL 229.A N ASP 228.A OD1 no hydrogen 2.973 N/A VAL 230.A N LYS 226.A O no hydrogen 3.002 N/A GLN 231.A N PRO 227.A O no hydrogen 3.019 N/A GLN 231.A NE2 ASN 235.A OD1 no hydrogen 2.826 N/A ILE 232.A N ASP 228.A O no hydrogen 3.028 N/A VAL 233.A N VAL 229.A O no hydrogen 2.965 N/A ARG 234.A N VAL 230.A O no hydrogen 2.834 N/A ASN 235.A N GLN 231.A O no hydrogen 2.890 N/A TYR 236.A N ILE 232.A O no hydrogen 3.071 N/A TYR 236.A OH VAL 144.A O no hydrogen 2.681 N/A ASN 237.A N VAL 233.A O no hydrogen 2.901 N/A ASN 237.A ND2 VAL 145.A O no hydrogen 2.833 N/A ALA 238.A N ARG 234.A O no hydrogen 3.059 N/A TYR 239.A N ASN 235.A O no hydrogen 3.158 N/A LEU 240.A N TYR 236.A O no hydrogen 2.890 N/A ARG 241.A N ASN 237.A O no hydrogen 2.946 N/A ARG 241.A NE ASN 237.A OD1 no hydrogen 2.862 N/A ARG 241.A NH2 ASP 146.A OD2 no hydrogen 3.169 N/A ALA 242.A N TYR 239.A O no hydrogen 3.209 N/A SER 243.A N LEU 240.A O no hydrogen 3.129 N/A SER 243.A OG LEU 240.A O no hydrogen 2.609 N/A ASP 244.A N ALA 242.A O no hydrogen 3.056 N/A LEU 246.A N SER 243.A O no hydrogen 3.130 N/A LYS 248.A N ASN 271.A O no hydrogen 2.832 N/A LYS 248.A NZ SER 243.A O no hydrogen 2.824 N/A LYS 248.A NZ SER 243.A OG no hydrogen 2.861 N/A LYS 248.A NZ LEU 246.A O no hydrogen 2.723 N/A LYS 248.A NZ PRO 270.A O no hydrogen 2.778 N/A LEU 249.A N ILE 138.A O no hydrogen 2.985 N/A PHE 250.A N GLU 273.A O no hydrogen 2.870 N/A ILE 251.A N HIS 140.A O no hydrogen 3.042 N/A GLU 252.A N VAL 275.A O no hydrogen 2.820 N/A SER 253.A OG LEU 280.A O no hydrogen 3.060 N/A ASP 254.A N VAL 277.A O no hydrogen 2.882 N/A GLY 256.A N GLY 279.A O no hydrogen 3.035 N/A PHE 257.A N SER 259.A OG no hydrogen 3.031 N/A SER 259.A OG GLU 142.A OE2 no hydrogen 2.641 N/A SER 259.A OG PHE 257.A O no hydrogen 3.251 N/A ASN 260.A N GLU 151.A OE1 no hydrogen 3.013 N/A ALA 261.A N GLU 151.A OE2 no hydrogen 3.416 N/A VAL 263.A N SER 259.A O no hydrogen 3.117 N/A GLU 264.A N ASN 260.A O no hydrogen 3.034 N/A GLY 265.A N ALA 261.A O no hydrogen 2.988 N/A ALA 266.A N ILE 262.A O no hydrogen 2.808 N/A LYS 267.A N VAL 263.A O no hydrogen 2.982 N/A LYS 268.A N GLY 265.A O no hydrogen 3.028 N/A PHE 269.A N ALA 266.A O no hydrogen 3.157 N/A ASN 271.A ND2 ASP 244.A O no hydrogen 2.853 N/A THR 272.A OG1 PHE 269.A O no hydrogen 2.870 N/A GLU 273.A N LYS 248.A O no hydrogen 2.905 N/A VAL 275.A N PHE 250.A O no hydrogen 3.065 N/A VAL 277.A N GLU 252.A O no hydrogen 2.982 N/A GLY 279.A N ASP 254.A O no hydrogen 3.081 N/A HIS 281.A N LYS 185.A O no hydrogen 3.274 N/A HIS 281.A ND1 GLU 142.A OE1 no hydrogen 2.816 N/A PHE 282.A N LYS 185.A O no hydrogen 3.177 N/A GLN 284.A N GLN 284.A OE1 no hydrogen 2.771 N/A GLU 285.A N PHE 282.A O no hydrogen 3.042 N/A ASP 286.A N LEU 283.A O no hydrogen 3.060 N/A ALA 287.A N LEU 283.A O no hydrogen 2.934 N/A MET 291.A N ALA 287.A O no hydrogen 2.986 N/A GLY 292.A N PRO 288.A O no hydrogen 2.827 N/A LYS 293.A N ASP 289.A O no hydrogen 2.931 N/A TYR 294.A N GLU 290.A O no hydrogen 3.005 N/A ILE 295.A N MET 291.A O no hydrogen 2.839 N/A LYS 296.A N GLY 292.A O no hydrogen 2.812 N/A SER 297.A N LYS 293.A O no hydrogen 3.072 N/A SER 297.A OG LYS 293.A O no hydrogen 3.301 N/A PHE 298.A N TYR 294.A O no hydrogen 3.050 N/A VAL 299.A N ILE 295.A O no hydrogen 2.891 N/A GLU 300.A N LYS 296.A O no hydrogen 2.926 N/A ARG 301.A N SER 297.A O no hydrogen 2.909 N/A VAL 302.A N PHE 298.A O no hydrogen 2.849 N/A LEU 303.A N VAL 299.A O no hydrogen 2.862 N/A LYS 304.A N GLU 300.A O no hydrogen 2.996 N/A GLU 306.A N VAL 302.A O no hydrogen 3.253 N/A GLU 306.A N LYS 304.A O no hydrogen 2.682 N/A