Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q8f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ PRO 25.A O no hydrogen 2.959 N/A ARG 2.A N ALA 26.A O no hydrogen 2.790 N/A ARG 2.A NH2 THR 118.A OG1 no hydrogen 2.765 N/A ARG 2.A NH2 GLU 144.A OE1 no hydrogen 2.968 N/A LYS 3.A NZ ASP 116.A OD2 no hydrogen 2.919 N/A ILE 4.A N ASP 28.A O no hydrogen 2.918 N/A ILE 5.A N THR 118.A O no hydrogen 3.151 N/A LEU 6.A N GLY 31.A O no hydrogen 3.109 N/A ASP 7.A N VAL 120.A O no hydrogen 2.944 N/A CYS 8.A N THR 33.A O no hydrogen 2.851 N/A CYS 8.A SG THR 33.A O no hydrogen 3.940 N/A ASP 9.A N ASP 14.A OD1 no hydrogen 3.091 N/A GLY 11.A N GLY 84.A O no hydrogen 2.854 N/A HIS 12.A NE2 ASP 86.A O no hydrogen 2.723 N/A ASP 13.A N ASP 13.A OD1 no hydrogen 2.641 N/A ALA 15.A N GLY 11.A O no hydrogen 3.083 N/A ALA 15.A N HIS 12.A O no hydrogen 3.163 N/A ILE 16.A N HIS 12.A O no hydrogen 3.403 N/A ALA 17.A N ASP 13.A O no hydrogen 2.942 N/A ILE 18.A N ASP 14.A O no hydrogen 2.873 N/A MET 19.A N ALA 15.A O no hydrogen 2.929 N/A MET 20.A N ILE 16.A O no hydrogen 2.985 N/A ALA 21.A N ALA 17.A O no hydrogen 2.862 N/A ALA 22.A N ILE 18.A O no hydrogen 2.978 N/A LYS 23.A N MET 20.A O no hydrogen 3.258 N/A LYS 23.A NZ GLY 306.A O no hydrogen 2.958 N/A HIS 24.A N MET 20.A O no hydrogen 3.042 N/A ALA 26.A N HIS 24.A ND1 no hydrogen 3.001 N/A ILE 27.A N HIS 24.A O no hydrogen 3.106 N/A ASP 28.A N ARG 2.A O no hydrogen 2.818 N/A LEU 30.A N ILE 4.A O no hydrogen 2.929 N/A ILE 32.A N PRO 60.A O no hydrogen 3.084 N/A THR 33.A N LEU 6.A O no hydrogen 2.803 N/A THR 33.A OG1 LEU 6.A O no hydrogen 3.538 N/A THR 33.A OG1 ASP 7.A OD1 no hydrogen 2.651 N/A ILE 34.A N TYR 62.A O no hydrogen 2.807 N/A VAL 35.A N CYS 8.A O no hydrogen 2.907 N/A ALA 36.A N MET 65.A O no hydrogen 3.018 N/A GLY 37.A N GLN 39.A O no hydrogen 2.927 N/A ASN 38.A N ASP 9.A OD2 no hydrogen 2.791 N/A THR 40.A OG1 ASP 42.A OD1 no hydrogen 2.670 N/A LYS 43.A N THR 40.A O no hydrogen 2.999 N/A LYS 43.A NZ ASP 82.A O no hydrogen 2.837 N/A LYS 43.A NZ ASP 82.A OD2 no hydrogen 3.256 N/A THR 44.A N THR 40.A O no hydrogen 3.034 N/A THR 44.A OG1 VAL 35.A O no hydrogen 3.073 N/A THR 44.A OG1 LEU 41.A O no hydrogen 3.538 N/A LEU 45.A N LEU 41.A O no hydrogen 2.867 N/A ILE 46.A N ASP 42.A O no hydrogen 3.364 N/A ASN 47.A N LYS 43.A O no hydrogen 2.841 N/A ASN 47.A ND2 PRO 10.A O no hydrogen 2.877 N/A ASN 47.A ND2 THR 83.A O no hydrogen 2.898 N/A GLY 48.A N THR 44.A O no hydrogen 2.951 N/A LEU 49.A N LEU 45.A O no hydrogen 2.983 N/A ASN 50.A N ILE 46.A O no hydrogen 2.843 N/A VAL 51.A N ASN 47.A O no hydrogen 3.072 N/A CYS 52.A N GLY 48.A O no hydrogen 3.101 N/A CYS 52.A SG GLY 48.A O no hydrogen 3.497 N/A GLN 53.A N LEU 49.A O no hydrogen 2.869 N/A GLN 53.A NE2 GLU 91.A OE2 no hydrogen 3.365 N/A GLN 53.A NE2 PRO 92.A O no hydrogen 3.149 N/A LYS 54.A N ASN 50.A O no hydrogen 2.991 N/A LYS 54.A NZ PRO 209.A O no hydrogen 3.523 N/A LEU 55.A N VAL 51.A O no hydrogen 2.968 N/A GLU 56.A N GLN 53.A O no hydrogen 3.180 N/A ILE 57.A N CYS 52.A O no hydrogen 2.863 N/A TYR 62.A N ILE 32.A O no hydrogen 2.850 N/A GLY 64.A N ILE 34.A O no hydrogen 2.818 N/A MET 65.A N ASN 127.A OD1 no hydrogen 2.801 N/A ILE 69.A N ASP 168.A OD2 no hydrogen 2.933 N/A ARG 71.A NE GLN 72.A O no hydrogen 2.811 N/A ARG 71.A NH1 PHE 166.A O no hydrogen 2.885 N/A ARG 71.A NH2 GLN 72.A O no hydrogen 3.551 N/A ALA 76.A N ASN 38.A O no hydrogen 2.936 N/A ASN 78.A ND2 ASN 228.A OD1 no hydrogen 3.097 N/A ILE 79.A N ALA 76.A O no hydrogen 3.127 N/A HIS 80.A N ALA 76.A O no hydrogen 2.971 N/A GLY 81.A N ASP 77.A O no hydrogen 2.827 N/A THR 83.A N ASP 86.A OD1 no hydrogen 3.057 N/A THR 83.A OG1 ASP 86.A OD1 no hydrogen 2.622 N/A GLY 84.A N GLY 81.A O no hydrogen 3.119 N/A LEU 85.A N THR 83.A OG1 no hydrogen 2.961 N/A ASP 86.A N HIS 80.A O no hydrogen 3.389 N/A THR 94.A N GLN 53.A OE1 no hydrogen 2.765 N/A THR 94.A OG1 GLN 53.A OE1 no hydrogen 3.366 N/A ARG 95.A N GLN 53.A OE1 no hydrogen 3.325 N/A ARG 95.A NH1 ILE 57.A O no hydrogen 2.659 N/A ARG 95.A NH2 ILE 57.A O no hydrogen 3.327 N/A GLU 98.A N VAL 61.A O no hydrogen 2.890 N/A ALA 102.A N ALA 63.A O no hydrogen 2.926 N/A LYS 104.A NZ ASP 108.A OD2 no hydrogen 2.631 N/A TYR 105.A N HIS 101.A O no hydrogen 2.905 N/A ILE 106.A N ALA 102.A O no hydrogen 2.817 N/A ILE 107.A N VAL 103.A O no hydrogen 3.018 N/A ASP 108.A N LYS 104.A O no hydrogen 2.827 N/A THR 109.A N TYR 105.A O no hydrogen 2.955 N/A THR 109.A OG1 TYR 105.A O no hydrogen 2.812 N/A LEU 110.A N ILE 106.A O no hydrogen 3.076 N/A MET 111.A N ILE 107.A O no hydrogen 2.897 N/A ALA 112.A N ASP 108.A O no hydrogen 3.126 N/A SER 113.A N LEU 110.A O no hydrogen 3.142 N/A SER 113.A OG LEU 110.A O no hydrogen 2.652 N/A GLY 115.A N SER 113.A OG no hydrogen 3.183 N/A THR 118.A N LYS 3.A O no hydrogen 2.984 N/A LEU 119.A N GLU 144.A O no hydrogen 2.992 N/A VAL 120.A N ILE 5.A O no hydrogen 2.922 N/A VAL 122.A N ASP 7.A O no hydrogen 2.704 N/A SER 126.A OG ASP 168.A OD2 no hydrogen 2.681 N/A ASN 127.A ND2 ASP 7.A OD1 no hydrogen 2.804 N/A ASN 127.A ND2 ILE 34.A O no hydrogen 3.177 N/A ALA 129.A N LEU 125.A O no hydrogen 2.949 N/A VAL 130.A N SER 126.A O no hydrogen 3.140 N/A ALA 131.A N ASN 127.A O no hydrogen 3.007 N/A MET 132.A N ILE 128.A O no hydrogen 2.935 N/A ARG 133.A N ALA 129.A O no hydrogen 3.088 N/A MET 134.A N VAL 130.A O no hydrogen 2.857 N/A GLN 135.A N ALA 131.A O no hydrogen 2.975 N/A ALA 137.A N GLN 135.A OE1 no hydrogen 2.982 N/A ILE 138.A N GLN 135.A O no hydrogen 3.012 N/A LEU 139.A N PRO 136.A O no hydrogen 3.141 N/A LYS 141.A N ILE 138.A O no hydrogen 2.989 N/A LYS 141.A NZ SER 113.A O no hydrogen 2.879 N/A ILE 142.A N LEU 139.A O no hydrogen 3.194 N/A ARG 143.A N ILE 117.A O no hydrogen 2.993 N/A ILE 145.A N PRO 181.A O no hydrogen 2.847 N/A VAL 146.A N LEU 119.A O no hydrogen 2.992 N/A LEU 147.A N VAL 183.A O no hydrogen 2.944 N/A MET 148.A N PRO 121.A O no hydrogen 3.008 N/A GLY 149.A N MET 185.A O no hydrogen 3.078 N/A GLY 150.A N GLU 162.A OE1 no hydrogen 2.788 N/A ALA 151.A N THR 271.A OG1 no hydrogen 3.025 N/A TYR 152.A N ASP 188.A OD2 no hydrogen 2.769 N/A GLY 153.A N ASP 188.A OD1 no hydrogen 2.847 N/A GLY 155.A N PRO 159.A O no hydrogen 2.876 N/A ASN 156.A N ALA 161.A O no hydrogen 3.096 N/A PHE 157.A N ASN 156.A OD1 no hydrogen 2.769 N/A THR 158.A N ALA 161.A O no hydrogen 3.349 N/A SER 160.A N THR 158.A OG1 no hydrogen 3.056 N/A SER 160.A OG PRO 266.A O no hydrogen 2.712 N/A ALA 161.A N THR 158.A O no hydrogen 3.391 N/A ALA 161.A N THR 158.A OG1 no hydrogen 2.899 N/A PHE 163.A N ASN 156.A OD1 no hydrogen 2.990 N/A ASN 164.A N GLU 162.A OE2 no hydrogen 2.765 N/A ASN 164.A ND2 VAL 122.A O no hydrogen 3.156 N/A ASN 164.A ND2 MET 148.A O no hydrogen 2.910 N/A ILE 165.A N GLU 162.A OE1 no hydrogen 3.194 N/A PHE 166.A N GLU 162.A O no hydrogen 2.893 N/A ALA 167.A N PHE 163.A O no hydrogen 2.767 N/A ASP 168.A N ILE 165.A O no hydrogen 3.078 N/A ALA 171.A N ASP 168.A OD1 no hydrogen 3.084 N/A ALA 172.A N ASP 168.A O no hydrogen 3.103 N/A ARG 173.A N PRO 169.A O no hydrogen 2.866 N/A ARG 173.A NE VAL 260.A O no hydrogen 3.018 N/A ARG 173.A NH2 VAL 260.A O no hydrogen 2.809 N/A VAL 174.A N GLU 170.A O no hydrogen 3.137 N/A VAL 175.A N ALA 171.A O no hydrogen 3.034 N/A PHE 176.A N ALA 172.A O no hydrogen 2.842 N/A THR 177.A N ARG 173.A O no hydrogen 3.202 N/A THR 177.A N VAL 174.A O no hydrogen 3.279 N/A THR 177.A OG1 ARG 173.A O no hydrogen 2.787 N/A THR 177.A OG1 VAL 174.A O no hydrogen 3.280 N/A SER 178.A N VAL 175.A O no hydrogen 3.132 N/A SER 178.A OG VAL 175.A O no hydrogen 2.694 N/A VAL 180.A N SER 178.A OG no hydrogen 3.397 N/A VAL 183.A N ILE 145.A O no hydrogen 2.776 N/A MET 184.A N LYS 286.A O no hydrogen 2.843 N/A MET 185.A N LEU 147.A O no hydrogen 2.854 N/A LEU 187.A N GLY 150.A O no hydrogen 2.887 N/A LEU 189.A N GLY 186.A O no hydrogen 3.079 N/A THR 190.A N GLY 186.A O no hydrogen 2.893 N/A THR 190.A OG1 GLY 186.A O no hydrogen 3.293 N/A THR 190.A OG1 HIS 237.A ND1 no hydrogen 2.699 N/A ASN 191.A N LEU 187.A O no hydrogen 2.891 N/A GLN 192.A N LEU 189.A O no hydrogen 3.004 N/A GLN 192.A NE2 ASP 188.A O no hydrogen 2.959 N/A GLN 192.A NE2 ILE 289.A O no hydrogen 2.947 N/A THR 193.A N THR 190.A O no hydrogen 2.926 N/A THR 193.A OG1 THR 190.A O no hydrogen 2.742 N/A CYS 195.A N GLY 234.A O no hydrogen 2.773 N/A THR 196.A OG1 ASP 198.A OD1 no hydrogen 2.599 N/A ILE 200.A N THR 196.A O no hydrogen 3.202 N/A ALA 201.A N PRO 197.A O no hydrogen 2.899 N/A ARG 202.A N ASP 198.A O no hydrogen 3.009 N/A ARG 202.A NE GLU 301.A OE1 no hydrogen 2.809 N/A ARG 202.A NH2 GLU 301.A OE1 no hydrogen 3.076 N/A MET 203.A N VAL 199.A O no hydrogen 3.145 N/A GLU 204.A N ILE 200.A O no hydrogen 2.906 N/A ARG 205.A N ALA 201.A O no hydrogen 2.949 N/A ALA 206.A N ARG 202.A O no hydrogen 3.245 N/A GLY 207.A N MET 203.A O no hydrogen 3.037 N/A GLY 211.A N GLY 207.A O no hydrogen 3.242 N/A GLU 212.A N GLY 208.A O no hydrogen 2.974 N/A LEU 213.A N PRO 209.A O no hydrogen 2.983 N/A PHE 214.A N ALA 210.A O no hydrogen 2.806 N/A SER 215.A N GLY 211.A O no hydrogen 3.083 N/A SER 215.A OG GLU 204.A OE2 no hydrogen 2.572 N/A SER 215.A OG ASN 219.A OD1 no hydrogen 3.259 N/A ASP 216.A N GLU 212.A O no hydrogen 3.017 N/A ILE 217.A N LEU 213.A O no hydrogen 2.915 N/A MET 218.A N PHE 214.A O no hydrogen 2.846 N/A ASN 219.A N SER 215.A O no hydrogen 3.096 N/A PHE 220.A N ILE 217.A O no hydrogen 3.145 N/A LEU 222.A N MET 218.A O no hydrogen 3.184 N/A LYS 223.A NZ GLU 227.A OE1 no hydrogen 2.755 N/A THR 224.A OG1 ILE 79.A O no hydrogen 2.875 N/A GLN 225.A N THR 221.A O no hydrogen 2.912 N/A GLU 227.A N LYS 223.A O no hydrogen 2.974 N/A ASN 228.A N THR 224.A O no hydrogen 2.991 N/A ASN 228.A ND2 THR 224.A O no hydrogen 2.865 N/A TYR 229.A N GLN 225.A O no hydrogen 2.986 N/A GLY 230.A N PHE 226.A O no hydrogen 2.821 N/A LEU 231.A N GLN 225.A O no hydrogen 3.389 N/A VAL 236.A N THR 193.A OG1 no hydrogen 3.053 N/A HIS 237.A ND1 THR 190.A OG1 no hydrogen 2.699 N/A ASP 238.A N ASP 13.A OD2 no hydrogen 3.015 N/A ALA 239.A N VAL 236.A O no hydrogen 3.044 N/A THR 240.A N HIS 237.A O no hydrogen 3.100 N/A THR 240.A OG1 HIS 237.A O no hydrogen 2.720 N/A CYS 241.A N ASP 238.A O no hydrogen 3.275 N/A CYS 241.A SG VAL 146.A O no hydrogen 3.689 N/A GLY 243.A N ALA 239.A O no hydrogen 2.967 N/A TYR 244.A N THR 240.A O no hydrogen 2.851 N/A LEU 245.A N CYS 241.A O no hydrogen 3.245 N/A ILE 246.A N ILE 242.A O no hydrogen 3.000 N/A ASN 247.A N GLY 243.A O no hydrogen 2.918 N/A ASP 249.A N ASN 247.A OD1 no hydrogen 3.048 N/A GLY 250.A N ASN 247.A O no hydrogen 3.050 N/A ILE 251.A N PRO 248.A O no hydrogen 3.025 N/A LYS 252.A N THR 290.A O no hydrogen 2.810 N/A GLN 254.A N VAL 287.A O no hydrogen 2.896 N/A GLN 254.A NE2 GLU 275.A O no hydrogen 2.915 N/A MET 256.A N THR 285.A O no hydrogen 2.941 N/A VAL 258.A N ASN 284.A OD1 no hydrogen 2.837 N/A GLU 259.A N VAL 272.A O no hydrogen 2.960 N/A ASP 261.A N ARG 270.A O no hydrogen 2.917 N/A ASN 263.A N ASP 261.A OD1 no hydrogen 2.975 N/A CYS 267.A SG SER 160.A OG no hydrogen 3.541 N/A TYR 268.A N GLY 265.A O no hydrogen 3.343 N/A TYR 268.A OH GLU 170.A OE1 no hydrogen 3.173 N/A TYR 268.A OH GLU 170.A OE2 no hydrogen 2.647 N/A GLY 269.A N ASP 261.A O no hydrogen 2.855 N/A ARG 270.A N CYS 267.A O no hydrogen 2.982 N/A ARG 270.A NH1 GLY 153.A O no hydrogen 2.834 N/A ARG 270.A NH1 SER 160.A O no hydrogen 2.986 N/A ARG 270.A NH2 GLY 153.A O no hydrogen 3.226 N/A THR 271.A OG1 ALA 151.A O no hydrogen 2.958 N/A VAL 272.A N GLU 259.A O no hydrogen 2.708 N/A CYS 273.A SG THR 271.A O no hydrogen 3.640 N/A ASP 274.A N TYR 257.A O no hydrogen 2.970 N/A GLY 277.A N ASP 274.A O no hydrogen 3.234 N/A VAL 278.A N ASP 274.A OD1 no hydrogen 2.885 N/A LEU 279.A N ASP 274.A OD2 no hydrogen 2.819 N/A GLY 280.A N GLY 277.A O no hydrogen 3.381 N/A ASN 284.A N MET 256.A O no hydrogen 2.968 N/A ASN 284.A ND2 VAL 258.A O no hydrogen 2.990 N/A THR 285.A N MET 256.A O no hydrogen 3.129 N/A THR 285.A OG1 ASN 284.A OD1 no hydrogen 2.893 N/A LYS 286.A N LEU 182.A O no hydrogen 2.915 N/A VAL 287.A N GLN 254.A O no hydrogen 2.851 N/A GLY 288.A N MET 184.A O no hydrogen 2.840 N/A ILE 289.A N LYS 252.A O no hydrogen 2.781 N/A THR 290.A N LYS 252.A O no hydrogen 3.374 N/A ILE 291.A N GLN 192.A OE1 no hydrogen 3.080 N/A ASP 292.A N GLY 250.A O no hydrogen 2.922 N/A TRP 295.A N ASP 292.A OD1 no hydrogen 3.074 N/A PHE 296.A N ASP 292.A O no hydrogen 2.932 N/A TRP 297.A N THR 293.A O no hydrogen 2.950 N/A GLY 298.A N ASP 294.A O no hydrogen 3.242 N/A LEU 299.A N TRP 295.A O no hydrogen 2.978 N/A VAL 300.A N PHE 296.A O no hydrogen 2.949 N/A GLU 301.A N TRP 297.A O no hydrogen 2.934 N/A GLU 302.A N GLY 298.A O no hydrogen 3.030 N/A CYS 303.A N LEU 299.A O no hydrogen 3.007 N/A CYS 303.A SG LEU 299.A O no hydrogen 3.384 N/A VAL 304.A N VAL 300.A O no hydrogen 2.885 N/A ARG 305.A N GLU 301.A O no hydrogen 2.882 N/A ARG 305.A NE GLU 301.A OE2 no hydrogen 2.687 N/A ARG 305.A NH2 GLU 301.A OE2 no hydrogen 3.368 N/A GLY 306.A N GLU 302.A O no hydrogen 3.167 N/A TYR 307.A N VAL 304.A O no hydrogen 3.096 N/A TYR 307.A OH MET 19.A O no hydrogen 2.705 N/A ILE 308.A N ARG 305.A O no hydrogen 3.130 N/A