Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6p6u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N ALA 2.A O no hydrogen 3.255 N/A GLN 6.A NE2 ALA 1.A O no hydrogen 2.904 N/A GLN 6.A NE2 ALA 2.A O no hydrogen 3.105 N/A LEU 7.A N LEU 3.A O no hydrogen 2.954 N/A LEU 7.A N LYS 4.A O no hydrogen 3.315 N/A ILE 8.A N LYS 4.A O no hydrogen 2.807 N/A LEU 12.A N ASN 10.A OD1 no hydrogen 3.386 N/A GLN 19.A N ASP 45.A OD2 no hydrogen 2.949 N/A GLN 19.A NE2.A VAL 17.A O no hydrogen 3.212 N/A ASN 20.A N ASP 45.A OD1 no hydrogen 2.824 N/A LYS 21.A NZ GLU 46.A OE1 no hydrogen 2.864 N/A LYS 21.A NZ VAL 84.A O no hydrogen 2.774 N/A LYS 21.A NZ ALA 86.A O no hydrogen 2.826 N/A ILE 22.A N GLU 46.A O no hydrogen 3.066 N/A THR 23.A N LEU 90.A O no hydrogen 2.961 N/A THR 23.A OG1 SER 88.A OG no hydrogen 2.599 N/A VAL 24.A N ALA 48.A O no hydrogen 2.808 N/A VAL 25.A N ILE 92.A O no hydrogen 2.764 N/A GLY 26.A N VAL 50.A O no hydrogen 2.791 N/A VAL 27.A N ASP 51.A OD2 no hydrogen 2.885 N/A MET 32.A N GLY 28.A O no hydrogen 2.960 N/A ALA 33.A N ALA 29.A O no hydrogen 3.001 N/A CYS 34.A N VAL 30.A O no hydrogen 2.953 N/A CYS 34.A SG VAL 30.A O no hydrogen 3.319 N/A ALA 35.A N GLY 31.A O no hydrogen 2.866 N/A ILE 36.A N MET 32.A O no hydrogen 2.929 N/A SER 37.A N ALA 33.A O no hydrogen 3.106 N/A SER 37.A OG ALA 33.A O no hydrogen 2.829 N/A ILE 38.A N CYS 34.A O no hydrogen 2.976 N/A LEU 39.A N ALA 35.A O no hydrogen 2.897 N/A MET 40.A N ILE 36.A O no hydrogen 3.006 N/A LYS 41.A N ILE 38.A O no hydrogen 3.170 N/A LYS 41.A NZ GLU 260.A OE1 no hydrogen 3.091 N/A ASP 42.A N LEU 39.A O no hydrogen 3.428 N/A ASP 45.A N ASN 20.A O no hydrogen 3.240 N/A LEU 47.A N LYS 75.A O no hydrogen 2.941 N/A ALA 48.A N ILE 22.A O no hydrogen 2.969 N/A LEU 49.A N VAL 77.A O no hydrogen 2.841 N/A VAL 50.A N VAL 24.A O no hydrogen 3.112 N/A VAL 52.A N ASP 51.A OD1 no hydrogen 2.542 N/A MET 53.A N ASP 51.A OD1 no hydrogen 3.445 N/A LYS 56.A NZ VAL 27.A O no hydrogen 2.914 N/A LYS 56.A NZ GLU 60.A OE2 no hydrogen 2.972 N/A LEU 57.A N MET 53.A O no hydrogen 3.042 N/A LYS 58.A N GLU 54.A O no hydrogen 3.024 N/A GLY 59.A N ASP 55.A O no hydrogen 2.931 N/A GLU 60.A N LYS 56.A O no hydrogen 2.957 N/A MET 61.A N LEU 57.A O no hydrogen 3.040 N/A MET 62.A N LYS 58.A O no hydrogen 2.985 N/A ASP 63.A N GLY 59.A O no hydrogen 3.000 N/A LEU 64.A N GLU 60.A O no hydrogen 3.096 N/A GLN 65.A N MET 61.A O no hydrogen 2.900 N/A GLN 65.A NE2 ILE 76.A O no hydrogen 3.033 N/A HIS 66.A N MET 62.A O no hydrogen 2.944 N/A GLY 67.A N LEU 64.A O no hydrogen 2.935 N/A SER 68.A N GLN 65.A O no hydrogen 2.946 N/A SER 68.A OG GLN 65.A O no hydrogen 2.769 N/A PHE 70.A N GLY 67.A O no hydrogen 2.831 N/A LEU 71.A N SER 68.A O no hydrogen 3.022 N/A THR 73.A OG1 ALA 44.A O no hydrogen 3.059 N/A VAL 77.A N LEU 47.A O no hydrogen 2.879 N/A GLY 79.A N LEU 49.A O no hydrogen 3.197 N/A SER 83.A N ASP 81.A OD1 no hydrogen 2.663 N/A SER 83.A OG ASP 81.A OD1 no hydrogen 2.656 N/A VAL 84.A N ASP 81.A O no hydrogen 3.297 N/A THR 85.A N TYR 82.A O no hydrogen 2.789 N/A THR 85.A OG1 TYR 82.A O no hydrogen 2.692 N/A ALA 86.A N SER 83.A O no hydrogen 3.149 N/A ASN 87.A N TYR 126.A O no hydrogen 3.137 N/A SER 88.A N SER 127.A OG no hydrogen 2.991 N/A SER 88.A OG THR 23.A OG1 no hydrogen 2.599 N/A SER 88.A OG THR 85.A O no hydrogen 2.641 N/A LYS 89.A N LYS 21.A O no hydrogen 2.842 N/A LYS 89.A NZ GLN 19.A O no hydrogen 3.029 N/A LYS 89.A NZ ASN 20.A OD1 no hydrogen 3.129 N/A VAL 91.A N LYS 131.A O no hydrogen 2.954 N/A ILE 92.A N THR 23.A O no hydrogen 2.804 N/A ILE 93.A N LEU 133.A O no hydrogen 2.866 N/A THR 94.A N VAL 25.A O no hydrogen 2.863 N/A THR 94.A OG1 VAL 25.A O no hydrogen 2.754 N/A THR 94.A OG1 GLY 26.A O no hydrogen 3.235 N/A ALA 97.A N ASN 112.A OD1 no hydrogen 2.761 N/A GLN 100.A N GLU 103.A OE1 no hydrogen 2.965 N/A GLN 100.A NE2 ARG 98.A O no hydrogen 3.187 N/A GLU 103.A N GLN 100.A O no hydrogen 3.165 N/A ARG 105.A NH2 GLU 191.A OE2 no hydrogen 3.459 N/A ASN 107.A N SER 104.A OG no hydrogen 3.079 N/A ASN 107.A ND2 SER 104.A OG no hydrogen 3.101 N/A LEU 108.A N SER 104.A O no hydrogen 3.069 N/A VAL 109.A N ARG 105.A O no hydrogen 3.044 N/A GLN 110.A N LEU 106.A O no hydrogen 2.967 N/A ARG 111.A N ASN 107.A O no hydrogen 3.051 N/A ARG 111.A NE GLU 103.A OE2 no hydrogen 2.693 N/A ARG 111.A NH2 ARG 98.A O no hydrogen 2.781 N/A ARG 111.A NH2 GLU 103.A OE1 no hydrogen 2.941 N/A ASN 112.A N LEU 108.A O no hydrogen 3.165 N/A ASN 112.A ND2 LEU 108.A O no hydrogen 2.863 N/A VAL 113.A N VAL 109.A O no hydrogen 2.815 N/A ASN 114.A N GLN 110.A O no hydrogen 2.979 N/A ILE 115.A N ARG 111.A O no hydrogen 3.224 N/A PHE 116.A N ASN 112.A O no hydrogen 2.787 N/A LYS 117.A N VAL 113.A O no hydrogen 2.769 N/A LYS 117.A NZ PHE 331.A OXT no hydrogen 3.549 N/A PHE 118.A N ILE 115.A O no hydrogen 2.989 N/A ILE 119.A N ILE 115.A O no hydrogen 3.087 N/A ILE 120.A N PHE 116.A O no hydrogen 2.890 N/A ASN 122.A ND2 PHE 118.A O no hydrogen 2.895 N/A VAL 123.A N ILE 119.A O no hydrogen 2.989 N/A VAL 124.A N ILE 120.A O no hydrogen 2.909 N/A LYS 125.A N PRO 121.A O no hydrogen 2.981 N/A LYS 125.A NZ TYR 126.A OH no hydrogen 3.347 N/A TYR 126.A N VAL 123.A O no hydrogen 3.171 N/A SER 127.A N VAL 123.A O no hydrogen 2.941 N/A CYS 130.A N SER 127.A O no hydrogen 3.187 N/A CYS 130.A SG SER 127.A O no hydrogen 3.295 N/A CYS 130.A SG LYS 131.A O no hydrogen 3.858 N/A LYS 131.A N LYS 89.A O no hydrogen 3.000 N/A LYS 131.A NZ GLN 296.A O no hydrogen 2.770 N/A LEU 132.A N ARG 156.A O no hydrogen 2.883 N/A LEU 133.A N VAL 91.A O no hydrogen 2.919 N/A VAL 134.A N ILE 158.A O no hydrogen 2.716 N/A VAL 135.A N ILE 93.A O no hydrogen 2.906 N/A SER 136.A N ILE 93.A O no hydrogen 3.403 N/A SER 136.A OG ILE 93.A O no hydrogen 3.326 N/A SER 136.A OG ALA 95.A O no hydrogen 2.535 N/A LEU 142.A N PRO 138.A O no hydrogen 2.988 N/A THR 143.A N VAL 139.A O no hydrogen 2.874 N/A THR 143.A OG1 VAL 139.A O no hydrogen 2.629 N/A TYR 144.A N ASP 140.A O no hydrogen 3.402 N/A VAL 145.A N ILE 141.A O no hydrogen 2.985 N/A ALA 146.A N LEU 142.A O no hydrogen 2.935 N/A TRP 147.A N THR 143.A O no hydrogen 3.001 N/A LYS 148.A N TYR 144.A O no hydrogen 2.901 N/A ILE 149.A N VAL 145.A O no hydrogen 2.932 N/A SER 150.A N ALA 146.A O no hydrogen 2.857 N/A SER 150.A OG ALA 146.A O no hydrogen 2.948 N/A SER 150.A OG TRP 147.A O no hydrogen 3.021 N/A GLY 151.A N TRP 147.A O no hydrogen 3.087 N/A PHE 152.A N SER 150.A OG no hydrogen 2.974 N/A ASN 155.A ND2 ASN 297.A O no hydrogen 3.001 N/A ARG 156.A N PRO 153.A O no hydrogen 3.070 N/A ARG 156.A NE CYS 130.A O no hydrogen 3.141 N/A ARG 156.A NH2 PRO 128.A O no hydrogen 2.724 N/A ARG 156.A NH2 CYS 130.A O no hydrogen 3.122 N/A VAL 157.A N LYS 154.A O no hydrogen 3.276 N/A ILE 158.A N LEU 132.A O no hydrogen 2.813 N/A GLY 159.A N SER 273.A O no hydrogen 3.086 N/A SER 160.A N VAL 134.A O no hydrogen 2.950 N/A SER 160.A OG VAL 134.A O no hydrogen 3.539 N/A CYS 162.A N SER 289.A OG no hydrogen 2.918 N/A CYS 162.A SG GLY 190.A O no hydrogen 3.744 N/A CYS 162.A SG SER 289.A OG no hydrogen 3.703 N/A ASN 163.A N SER 160.A O no hydrogen 3.163 N/A ASN 163.A ND2 SER 254.A OG no hydrogen 2.777 N/A SER 166.A N CYS 162.A O no hydrogen 2.973 N/A SER 166.A OG CYS 162.A O no hydrogen 3.052 N/A ALA 167.A N ASN 163.A O no hydrogen 3.187 N/A ARG 168.A N LEU 164.A O no hydrogen 2.830 N/A ARG 168.A NH2 ASP 165.A OD1 no hydrogen 3.467 N/A PHE 169.A N ASP 165.A O no hydrogen 2.921 N/A ARG 170.A N SER 166.A O no hydrogen 2.967 N/A ARG 170.A NE ALA 181.A O no hydrogen 3.308 N/A ARG 170.A NE CYS 184.A O no hydrogen 2.692 N/A ARG 170.A NH1 ALA 181.A O no hydrogen 3.303 N/A TYR 171.A N ALA 167.A O no hydrogen 3.059 N/A LEU 172.A N ARG 168.A O no hydrogen 3.027 N/A MET 173.A N PHE 169.A O no hydrogen 2.956 N/A GLY 174.A N ARG 170.A O no hydrogen 2.903 N/A GLU 175.A N TYR 171.A O no hydrogen 2.939 N/A ARG 176.A N LEU 172.A O no hydrogen 3.138 N/A ARG 176.A NH1 GLU 224.A O no hydrogen 3.077 N/A LEU 177.A N MET 173.A O no hydrogen 2.999 N/A LEU 177.A N GLY 174.A O no hydrogen 3.269 N/A GLY 178.A N GLY 174.A O no hydrogen 2.781 N/A VAL 179.A N GLY 174.A O no hydrogen 3.247 N/A LEU 182.A N HIS 180.A ND1 no hydrogen 3.004 N/A SER 183.A N HIS 180.A O no hydrogen 2.982 N/A CYS 184.A N ALA 181.A O no hydrogen 3.156 N/A CYS 184.A SG HIS 180.A O no hydrogen 3.611 N/A HIS 185.A N ASN 204.A O no hydrogen 2.962 N/A ILE 188.A N SER 166.A OG no hydrogen 3.162 N/A LEU 189.A N VAL 197.A O no hydrogen 2.842 N/A GLY 190.A N SER 289.A O no hydrogen 2.892 N/A HIS 192.A N ASP 140.A OD2 no hydrogen 2.933 N/A SER 196.A N GLY 193.A O no hydrogen 3.131 N/A SER 196.A OG GLY 193.A O no hydrogen 2.802 N/A SER 196.A OG HIS 230.A NE2 no hydrogen 3.010 N/A VAL 197.A N LEU 189.A O no hydrogen 2.806 N/A VAL 199.A N TRP 187.A O no hydrogen 3.040 N/A GLY 202.A N VAL 199.A O no hydrogen 3.179 N/A MET 203.A N TRP 200.A O no hydrogen 3.191 N/A ASN 204.A N HIS 185.A O no hydrogen 3.057 N/A ASN 204.A ND2 GLY 202.A O no hydrogen 3.078 N/A VAL 205.A N VAL 208.A O no hydrogen 3.349 N/A GLY 207.A N ASN 204.A OD1 no hydrogen 3.038 N/A VAL 208.A N VAL 205.A O no hydrogen 2.903 N/A SER 209.A OG THR 212.A OG1 no hydrogen 3.249 N/A LEU 210.A N MET 203.A O no hydrogen 3.054 N/A LYS 211.A NZ PRO 215.A O no hydrogen 3.041 N/A LYS 211.A NZ LEU 217.A O no hydrogen 2.981 N/A THR 212.A OG1 SER 209.A OG no hydrogen 3.249 N/A HIS 214.A N LEU 210.A O no hydrogen 2.901 N/A HIS 214.A NE2 ASP 222.A OD1 no hydrogen 2.828 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 2.797 N/A LEU 217.A N HIS 214.A O no hydrogen 2.900 N/A THR 219.A N GLU 216.A O no hydrogen 2.919 N/A THR 219.A OG1 GLU 216.A O no hydrogen 2.594 N/A GLU 224.A N ASP 222.A OD1 no hydrogen 3.053 N/A GLN 225.A N ASP 222.A O no hydrogen 3.125 N/A TRP 226.A N ASP 222.A OD2 no hydrogen 2.771 N/A TRP 226.A NE1 GLU 224.A OE1 no hydrogen 2.999 N/A LYS 227.A NZ ASP 220.A OD1 no hydrogen 3.295 N/A GLN 228.A N GLN 225.A O no hydrogen 3.113 N/A VAL 229.A N TRP 226.A O no hydrogen 2.853 N/A HIS 230.A NE2 SER 196.A OG no hydrogen 3.010 N/A LYS 231.A N LYS 227.A O no hydrogen 3.372 N/A LYS 231.A NZ ASP 235.A OD2 no hydrogen 3.125 N/A GLN 232.A N GLN 228.A O no hydrogen 2.722 N/A VAL 233.A N VAL 229.A O no hydrogen 3.004 N/A VAL 234.A N HIS 230.A O no hydrogen 3.160 N/A ASP 235.A N LYS 231.A O no hydrogen 2.866 N/A SER 236.A N GLN 232.A O no hydrogen 2.785 N/A SER 236.A OG GLN 232.A O no hydrogen 2.909 N/A SER 236.A OG VAL 233.A O no hydrogen 2.844 N/A TYR 238.A OH ASP 194.A OD1 no hydrogen 2.802 N/A GLU 239.A N ASP 235.A O no hydrogen 2.856 N/A VAL 240.A N SER 236.A O no hydrogen 2.972 N/A ILE 241.A N ALA 237.A O no hydrogen 3.116 N/A LYS 242.A N TYR 238.A O no hydrogen 2.798 N/A LEU 243.A N GLU 239.A O no hydrogen 3.121 N/A LEU 243.A N VAL 240.A O no hydrogen 3.087 N/A LYS 244.A N VAL 240.A O no hydrogen 2.818 N/A GLY 245.A N ILE 241.A O no hydrogen 2.771 N/A THR 248.A OG1 ALA 29.A O no hydrogen 3.149 N/A GLY 252.A N THR 248.A O no hydrogen 3.021 N/A LEU 253.A N TRP 249.A O no hydrogen 3.005 N/A SER 254.A N ALA 250.A O no hydrogen 2.930 N/A VAL 255.A N ILE 251.A O no hydrogen 2.818 N/A ALA 256.A N GLY 252.A O no hydrogen 2.996 N/A ASP 257.A N LEU 253.A O no hydrogen 3.007 N/A LEU 258.A N SER 254.A O no hydrogen 3.207 N/A ALA 259.A N VAL 255.A O no hydrogen 2.876 N/A GLU 260.A N ALA 256.A O no hydrogen 2.856 N/A SER 261.A N ASP 257.A O no hydrogen 3.293 N/A SER 261.A OG HIS 270.A NE2 no hydrogen 2.711 N/A ILE 262.A N LEU 258.A O no hydrogen 3.107 N/A MET 263.A N ALA 259.A O no hydrogen 2.798 N/A LYS 264.A N GLU 260.A O no hydrogen 2.959 N/A LYS 264.A NZ GLU 260.A OE2 no hydrogen 3.155 N/A ASN 265.A N ILE 262.A O no hydrogen 3.286 N/A LEU 266.A N SER 261.A O no hydrogen 3.053 N/A ARG 267.A NH1 SER 300.A OG no hydrogen 3.121 N/A ARG 267.A NH2 ASP 301.A OD1 no hydrogen 3.133 N/A ARG 268.A NH1 ASP 257.A OD1 no hydrogen 3.071 N/A ARG 268.A NH2 ASP 257.A OD1 no hydrogen 3.081 N/A HIS 270.A N CYS 292.A O no hydrogen 2.894 N/A HIS 270.A NE2 SER 261.A OG no hydrogen 2.711 N/A ILE 272.A N VAL 290.A O no hydrogen 3.263 N/A SER 273.A N GLY 159.A O no hydrogen 2.906 N/A SER 273.A OG ASP 140.A OD1 no hydrogen 2.755 N/A THR 274.A N LEU 288.A O no hydrogen 3.133 N/A LEU 276.A N VAL 286.A O no hydrogen 2.983 N/A LYS 277.A NZ ASP 285.A OD1 no hydrogen 3.135 N/A GLY 278.A N ILE 282.A O no hydrogen 2.857 N/A LEU 279.A N LEU 276.A O no hydrogen 3.014 N/A TYR 280.A OH VAL 305.A O no hydrogen 3.234 N/A ILE 282.A N LEU 279.A O no hydrogen 3.028 N/A VAL 286.A N GLU 284.A O no hydrogen 2.911 N/A LEU 288.A N THR 274.A O no hydrogen 3.081 N/A SER 289.A N GLY 190.A O no hydrogen 2.981 N/A VAL 290.A N ILE 272.A O no hydrogen 3.144 N/A CYS 292.A N HIS 270.A O no hydrogen 2.767 N/A CYS 292.A SG ILE 272.A O no hydrogen 3.896 N/A CYS 292.A SG VAL 290.A O no hydrogen 3.304 N/A VAL 293.A N ASP 301.A O no hydrogen 2.924 N/A LEU 294.A N ARG 268.A O no hydrogen 2.981 N/A GLY 295.A N GLY 298.A O no hydrogen 3.089 N/A GLN 296.A N ASN 265.A OD1 no hydrogen 2.861 N/A GLY 298.A N GLY 295.A O no hydrogen 2.989 N/A ILE 299.A N ASN 155.A O no hydrogen 2.899 N/A SER 300.A N VAL 293.A O no hydrogen 3.257 N/A SER 300.A OG ASP 301.A OD1 no hydrogen 2.540 N/A VAL 303.A N PRO 291.A O no hydrogen 2.874 N/A VAL 305.A N TYR 280.A OH no hydrogen 3.213 N/A THR 308.A N GLU 311.A OE1 no hydrogen 2.892 N/A GLU 311.A N THR 308.A OG1 no hydrogen 3.090 N/A GLU 312.A N THR 308.A O no hydrogen 2.817 N/A ALA 313.A N SER 309.A O no hydrogen 2.956 N/A HIS 314.A N GLU 310.A O no hydrogen 2.964 N/A LEU 315.A N GLU 311.A O no hydrogen 3.109 N/A LYS 316.A N GLU 312.A O no hydrogen 3.164 N/A LYS 316.A NZ GLU 312.A OE1 no hydrogen 3.570 N/A LYS 317.A N ALA 313.A O no hydrogen 2.922 N/A SER 318.A N HIS 314.A O no hydrogen 3.215 N/A SER 318.A OG LEU 315.A O no hydrogen 2.545 N/A ALA 319.A N LEU 315.A O no hydrogen 2.900 N/A ASP 320.A N LYS 316.A O no hydrogen 2.917 N/A THR 321.A N LYS 317.A O no hydrogen 3.052 N/A THR 321.A OG1 LYS 317.A O no hydrogen 3.031 N/A LEU 322.A N SER 318.A O no hydrogen 2.990 N/A TRP 323.A N ALA 319.A O no hydrogen 2.910 N/A GLY 324.A N ASP 320.A O no hydrogen 2.871 N/A ILE 325.A N THR 321.A O no hydrogen 3.202 N/A GLN 326.A N LEU 322.A O no hydrogen 2.868 N/A GLN 326.A NE2 ASP 285.A O no hydrogen 2.912 N/A LYS 327.A N TRP 323.A O no hydrogen 2.841 N/A GLU 328.A N ILE 325.A O no hydrogen 2.896 N/A LEU 329.A N GLN 326.A O no hydrogen 3.075 N/A