Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dne_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N GLU 1.A O no hydrogen 3.241 N/A PHE 6.A N SER 2.A O no hydrogen 2.705 N/A LEU 7.A N VAL 3.A O no hydrogen 2.883 N/A ALA 8.A N LYS 4.A O no hydrogen 2.669 N/A LYS 9.A N GLU 5.A O no hydrogen 3.148 N/A ALA 10.A N PHE 6.A O no hydrogen 2.863 N/A LYS 11.A N LEU 7.A O no hydrogen 2.884 N/A GLU 12.A N ALA 8.A O no hydrogen 3.102 N/A ASP 13.A N LYS 9.A O no hydrogen 3.059 N/A PHE 14.A N ALA 10.A O no hydrogen 2.976 N/A LEU 15.A N LYS 11.A O no hydrogen 2.866 N/A LYS 16.A N GLU 12.A O no hydrogen 3.190 N/A TRP 18.A N PHE 14.A O no hydrogen 2.715 N/A GLU 19.A N LEU 15.A O no hydrogen 2.965 N/A ASN 20.A N LYS 16.A O no hydrogen 3.181 N/A ALA 22.A N GLN 84.A OE1 no hydrogen 2.957 N/A GLN 23.A NE2 SER 334.A O no hydrogen 3.232 N/A GLN 23.A NE2 PHE 336.A O no hydrogen 3.103 N/A THR 25.A N SER 97.A O no hydrogen 2.897 N/A THR 25.A OG1 SER 97.A O no hydrogen 3.402 N/A HIS 27.A N GLN 30.A OE1 no hydrogen 3.007 N/A GLN 30.A N HIS 27.A O no hydrogen 3.009 N/A PHE 31.A N LEU 28.A O no hydrogen 3.211 N/A GLU 32.A N LYS 49.A O no hydrogen 2.719 N/A ILE 34.A N LEU 47.A O no hydrogen 2.797 N/A LYS 35.A N LEU 47.A O no hydrogen 3.358 N/A LYS 35.A NZ ASP 316.A OD1 no hydrogen 2.795 N/A THR 36.A N GLU 319.A OE2 no hydrogen 2.922 N/A THR 36.A OG1 GLU 319.A OE1 no hydrogen 2.579 N/A THR 36.A OG1 GLU 319.A OE2 no hydrogen 3.445 N/A LEU 37.A N VAL 45.A O no hydrogen 2.765 N/A GLY 38.A N VAL 45.A O no hydrogen 3.353 N/A GLY 40.A N GLY 43.A O no hydrogen 2.848 N/A ARG 44.A N ILE 61.A O no hydrogen 2.903 N/A ARG 44.A NH1 GLU 318.A O no hydrogen 3.362 N/A ARG 44.A NH2 GLU 318.A OE1 no hydrogen 3.190 N/A VAL 45.A N GLY 38.A O no hydrogen 2.904 N/A MET 46.A N MET 59.A O no hydrogen 2.848 N/A LEU 47.A N LYS 35.A O no hydrogen 2.740 N/A VAL 48.A N TYR 57.A O no hydrogen 2.899 N/A LYS 49.A N GLU 32.A O no hydrogen 2.740 N/A HIS 50.A N ASN 55.A O no hydrogen 2.648 N/A MET 51.A N GLN 30.A O no hydrogen 3.310 N/A THR 53.A N HIS 50.A O no hydrogen 3.206 N/A GLY 54.A N HIS 50.A O no hydrogen 2.587 N/A ASN 55.A N THR 53.A OG1 no hydrogen 3.073 N/A ASN 55.A ND2 TYR 57.A OH no hydrogen 3.310 N/A TYR 57.A N VAL 48.A O no hydrogen 2.879 N/A ALA 58.A N MET 108.A O no hydrogen 2.808 N/A MET 59.A N MET 46.A O no hydrogen 2.659 N/A LYS 60.A N MET 106.A O no hydrogen 2.786 N/A LYS 60.A NZ GLU 79.A OE2 no hydrogen 2.735 N/A LYS 60.A NZ ASP 172.A OD1 no hydrogen 2.809 N/A ILE 61.A N ARG 44.A O no hydrogen 2.719 N/A LEU 62.A N LEU 104.A O no hydrogen 2.819 N/A ASP 63.A N PHE 42.A O no hydrogen 2.715 N/A LYS 64.A N SER 102.A O no hydrogen 3.091 N/A LYS 64.A NZ ASP 100.A O no hydrogen 2.729 N/A LYS 64.A NZ ASN 101.A O no hydrogen 3.235 N/A LYS 64.A NZ LYS 328.A O no hydrogen 2.872 N/A LYS 66.A N ASP 63.A OD1 no hydrogen 3.215 N/A VAL 67.A N ASP 63.A O no hydrogen 2.876 N/A VAL 68.A N LYS 64.A O no hydrogen 2.954 N/A LYS 69.A N GLN 65.A O no hydrogen 3.006 N/A LEU 70.A N LYS 66.A O no hydrogen 2.906 N/A LYS 71.A N VAL 68.A O no hydrogen 2.890 N/A GLN 72.A N VAL 67.A O no hydrogen 2.945 N/A GLN 72.A NE2 LEU 70.A O no hydrogen 3.205 N/A HIS 75.A ND1 GLN 72.A OE1 no hydrogen 2.714 N/A THR 76.A N GLN 72.A O no hydrogen 2.932 N/A THR 76.A OG1 GLN 72.A O no hydrogen 2.853 N/A LEU 77.A N ILE 73.A O no hydrogen 3.024 N/A ASN 78.A N GLU 74.A O no hydrogen 2.844 N/A GLU 79.A N HIS 75.A O no hydrogen 2.947 N/A LYS 80.A N THR 76.A O no hydrogen 3.210 N/A LYS 80.A NZ ALA 22.A O no hydrogen 2.971 N/A LYS 80.A NZ GLU 335.A O no hydrogen 3.447 N/A LYS 80.A NZ PHE 336.A OXT no hydrogen 2.718 N/A ARG 81.A N LEU 77.A O no hydrogen 2.955 N/A ARG 81.A NE TRP 18.A O no hydrogen 2.928 N/A ARG 81.A NH2 TRP 18.A O no hydrogen 3.150 N/A ILE 82.A N ASN 78.A O no hydrogen 2.868 N/A LEU 83.A N GLU 79.A O no hydrogen 2.978 N/A GLN 84.A N LYS 80.A O no hydrogen 2.968 N/A GLN 84.A NE2 LYS 17.A O no hydrogen 2.833 N/A GLN 84.A NE2 ARG 81.A O no hydrogen 2.832 N/A ALA 85.A N ILE 82.A O no hydrogen 2.826 N/A VAL 86.A N ILE 82.A O no hydrogen 3.092 N/A ASN 87.A N TYR 144.A OH no hydrogen 2.846 N/A LEU 91.A N PHE 88.A O no hydrogen 3.284 N/A VAL 92.A N VAL 170.A O no hydrogen 2.957 N/A GLU 95.A N VAL 107.A O no hydrogen 2.748 N/A PHE 96.A N VAL 107.A O no hydrogen 3.177 N/A SER 97.A N THR 25.A OG1 no hydrogen 3.126 N/A PHE 98.A N TYR 105.A O no hydrogen 3.190 N/A LYS 99.A NZ PHE 333.A O no hydrogen 2.937 N/A LYS 99.A NZ PHE 336.A O no hydrogen 2.884 N/A ASP 100.A N ASN 103.A O no hydrogen 2.980 N/A SER 102.A N ASP 100.A OD1 no hydrogen 2.941 N/A ASN 103.A N ASP 100.A OD1 no hydrogen 2.841 N/A ASN 103.A ND2 TYR 105.A OH no hydrogen 3.025 N/A LEU 104.A N LEU 62.A O no hydrogen 2.792 N/A TYR 105.A N PHE 98.A O no hydrogen 2.830 N/A TYR 105.A OH ASP 100.A OD2 no hydrogen 2.454 N/A MET 106.A N LYS 60.A O no hydrogen 2.969 N/A VAL 107.A N PHE 96.A O no hydrogen 2.808 N/A MET 108.A N ALA 58.A O no hydrogen 2.856 N/A GLU 109.A N LYS 93.A O no hydrogen 2.943 N/A TYR 110.A OH ASP 310.A O no hydrogen 2.654 N/A MET 116.A N LEU 160.A O no hydrogen 2.771 N/A PHE 117.A N PRO 157.A O no hydrogen 3.275 N/A SER 118.A N GLU 115.A O no hydrogen 3.225 N/A HIS 119.A NE2 GLY 113.A O no hydrogen 2.682 N/A LEU 120.A N MET 116.A O no hydrogen 2.843 N/A ARG 121.A N PHE 117.A O no hydrogen 2.970 N/A ARG 121.A NH1 GLU 217.A OE2 no hydrogen 2.969 N/A ARG 121.A NH2 GLU 217.A OE2 no hydrogen 2.818 N/A ARG 122.A N SER 118.A O no hydrogen 3.048 N/A ARG 122.A NH2 HIS 119.A ND1 no hydrogen 2.909 N/A ILE 123.A N HIS 119.A O no hydrogen 2.882 N/A GLY 124.A N LEU 120.A O no hydrogen 2.698 N/A PHE 126.A N MET 218.A O no hydrogen 2.795 N/A HIS 130.A N SER 127.A OG no hydrogen 3.139 N/A HIS 130.A NE2 TYR 134.A OH no hydrogen 2.766 N/A ALA 131.A N SER 127.A O no hydrogen 2.867 N/A ARG 132.A N GLU 128.A O no hydrogen 2.819 N/A ARG 132.A NE TRP 283.A O no hydrogen 2.950 N/A ARG 132.A NH2 TRP 283.A O no hydrogen 3.463 N/A PHE 133.A N PRO 129.A O no hydrogen 3.022 N/A TYR 134.A N HIS 130.A O no hydrogen 3.404 N/A TYR 134.A OH HIS 130.A NE2 no hydrogen 2.766 N/A ALA 135.A N ALA 131.A O no hydrogen 2.780 N/A ALA 136.A N ARG 132.A O no hydrogen 2.845 N/A GLN 137.A NE2 PHE 133.A O no hydrogen 3.088 N/A ILE 138.A N TYR 134.A O no hydrogen 3.209 N/A VAL 139.A N ALA 135.A O no hydrogen 2.849 N/A LEU 140.A N ALA 136.A O no hydrogen 3.012 N/A THR 141.A N GLN 137.A O no hydrogen 2.959 N/A THR 141.A OG1 GLN 137.A O no hydrogen 2.566 N/A PHE 142.A N ILE 138.A O no hydrogen 2.938 N/A GLU 143.A N VAL 139.A O no hydrogen 3.017 N/A TYR 144.A N LEU 140.A O no hydrogen 2.933 N/A LEU 145.A N THR 141.A O no hydrogen 2.751 N/A HIS 146.A N PHE 142.A O no hydrogen 2.732 N/A HIS 146.A NE2 ASP 207.A OD2 no hydrogen 2.746 N/A SER 147.A N GLU 143.A O no hydrogen 3.146 N/A SER 147.A OG GLU 143.A O no hydrogen 3.480 N/A SER 147.A OG TYR 144.A O no hydrogen 2.589 N/A LEU 148.A N LEU 145.A O no hydrogen 2.907 N/A ASP 149.A N HIS 146.A O no hydrogen 2.929 N/A LEU 150.A N LEU 145.A O no hydrogen 3.151 N/A ILE 151.A N LYS 177.A O no hydrogen 2.864 N/A TYR 152.A N ASP 207.A OD2 no hydrogen 2.847 N/A TYR 152.A OH THR 171.A O no hydrogen 2.606 N/A TYR 152.A OH ASP 172.A O no hydrogen 3.152 N/A ARG 153.A N ASP 207.A OD1 no hydrogen 2.835 N/A ARG 153.A NE PHE 175.A O no hydrogen 2.592 N/A ARG 153.A NH1 TYR 202.A OH no hydrogen 2.906 N/A ARG 153.A NH2 PHE 175.A O no hydrogen 2.886 N/A LYS 156.A NZ THR 188.A OG1 no hydrogen 2.737 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.770 N/A ASN 159.A N LYS 156.A O no hydrogen 3.099 N/A ASN 159.A ND2 ASP 154.A O no hydrogen 2.757 N/A ASN 159.A ND2 ASP 154.A OD2 no hydrogen 3.026 N/A LEU 160.A N PRO 157.A O no hydrogen 3.162 N/A LEU 161.A N GLN 169.A O no hydrogen 2.915 N/A ILE 162.A N GLY 114.A O no hydrogen 2.867 N/A ASP 163.A N TYR 167.A O no hydrogen 2.812 N/A GLN 165.A N ASP 163.A OD1 no hydrogen 2.852 N/A GLY 166.A N ASP 163.A O no hydrogen 2.816 N/A TYR 167.A N ASP 163.A OD1 no hydrogen 2.912 N/A TYR 167.A OH VAL 297.A O no hydrogen 2.581 N/A ILE 168.A N GLN 137.A OE1 no hydrogen 2.766 N/A GLN 169.A N LEU 161.A O no hydrogen 2.770 N/A GLN 169.A NE2 PRO 89.A O no hydrogen 2.871 N/A VAL 170.A N PHE 90.A O no hydrogen 2.704 N/A THR 171.A N ASN 159.A O no hydrogen 2.863 N/A ALA 176.A N PHE 173.A O no hydrogen 3.018 N/A LYS 177.A N ILE 151.A O no hydrogen 3.061 N/A ARG 178.A NE LEU 148.A O no hydrogen 2.812 N/A ARG 178.A NH2 ASP 149.A OD2 no hydrogen 2.898 N/A VAL 179.A N ASP 149.A O no hydrogen 2.880 N/A THR 183.A N TYR 202.A O no hydrogen 2.843 N/A THR 188.A OG1 ASP 154.A OD1 no hydrogen 2.742 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.714 N/A TYR 191.A N THR 188.A O no hydrogen 2.803 N/A TYR 191.A OH GLU 217.A OE1 no hydrogen 2.524 N/A LEU 192.A N PRO 189.A O no hydrogen 3.262 N/A GLU 195.A N GLU 195.A OE2 no hydrogen 2.608 N/A ILE 196.A N ALA 193.A O no hydrogen 2.970 N/A ILE 197.A N ALA 193.A O no hydrogen 3.329 N/A LEU 198.A N PRO 194.A O no hydrogen 3.015 N/A SER 199.A N ILE 196.A O no hydrogen 3.158 N/A LYS 200.A N GLU 195.A O no hydrogen 3.061 N/A TYR 202.A N THR 183.A O no hydrogen 2.831 N/A LYS 204.A NZ GLY 181.A O no hydrogen 3.492 N/A ALA 205.A N ASN 203.A OD1 no hydrogen 2.951 N/A VAL 206.A N ASN 203.A O no hydrogen 3.085 N/A ASP 207.A N LYS 204.A O no hydrogen 2.878 N/A TRP 209.A N ALA 205.A O no hydrogen 2.993 N/A ALA 210.A N VAL 206.A O no hydrogen 3.027 N/A LEU 211.A N ASP 207.A O no hydrogen 2.878 N/A GLY 212.A N TRP 208.A O no hydrogen 3.184 N/A VAL 213.A N TRP 209.A O no hydrogen 3.121 N/A LEU 214.A N ALA 210.A O no hydrogen 2.879 N/A ILE 215.A N LEU 211.A O no hydrogen 2.930 N/A TYR 216.A N GLY 212.A O no hydrogen 2.954 N/A TYR 216.A OH ARG 243.A O no hydrogen 2.533 N/A GLU 217.A N VAL 213.A O no hydrogen 2.821 N/A MET 218.A N LEU 214.A O no hydrogen 2.701 N/A ALA 219.A N ILE 215.A O no hydrogen 2.966 N/A ALA 220.A N TYR 216.A O no hydrogen 2.724 N/A GLY 221.A N GLU 217.A O no hydrogen 2.754 N/A GLN 229.A N GLN 232.A OE1 no hydrogen 2.789 N/A GLN 232.A N GLN 229.A O no hydrogen 3.012 N/A ILE 233.A N GLN 229.A O no hydrogen 3.203 N/A TYR 234.A N PRO 230.A O no hydrogen 2.811 N/A GLU 235.A N ILE 231.A O no hydrogen 3.194 N/A LYS 236.A N GLN 232.A O no hydrogen 3.300 N/A ILE 237.A N ILE 233.A O no hydrogen 2.978 N/A VAL 238.A N TYR 234.A O no hydrogen 3.156 N/A SER 239.A N GLU 235.A O no hydrogen 3.106 N/A SER 239.A N LYS 236.A O no hydrogen 3.160 N/A SER 239.A OG LYS 236.A O no hydrogen 2.703 N/A LYS 241.A N SER 239.A OG no hydrogen 2.953 N/A PHE 248.A N PRO 245.A O no hydrogen 3.052 N/A SER 249.A N GLU 128.A OE2 no hydrogen 2.761 N/A SER 249.A OG GLU 128.A OE1 no hydrogen 2.623 N/A SER 249.A OG GLU 128.A OE2 no hydrogen 3.483 N/A LEU 252.A N SER 249.A OG no hydrogen 3.139 N/A LYS 253.A N SER 249.A O no hydrogen 2.948 N/A LYS 253.A NZ PRO 245.A O no hydrogen 3.040 N/A LYS 253.A NZ SER 246.A O no hydrogen 3.553 N/A LYS 253.A NZ PHE 248.A O no hydrogen 2.704 N/A ASP 254.A N SER 250.A O no hydrogen 3.047 N/A LEU 255.A N ASP 251.A O no hydrogen 2.994 N/A LEU 256.A N LEU 252.A O no hydrogen 3.083 N/A ARG 257.A N LYS 253.A O no hydrogen 2.967 N/A ASN 258.A N ASP 254.A O no hydrogen 3.295 N/A LEU 259.A N LEU 255.A O no hydrogen 2.786 N/A LEU 260.A N LEU 256.A O no hydrogen 2.770 N/A ASP 263.A N GLN 261.A OE1 no hydrogen 2.857 N/A THR 265.A OG1 ASP 263.A OD1 no hydrogen 3.026 N/A LYS 266.A N ASP 263.A O no hydrogen 2.979 N/A ARG 267.A NE GLN 261.A O no hydrogen 2.779 N/A ARG 267.A NH1 GLU 195.A OE1 no hydrogen 2.808 N/A ARG 267.A NH1 ALA 205.A O no hydrogen 3.067 N/A ARG 267.A NH2 GLU 195.A OE1 no hydrogen 3.520 N/A ARG 267.A NH2 GLU 195.A OE2 no hydrogen 3.161 N/A ARG 267.A NH2 GLN 261.A O no hydrogen 2.913 N/A PHE 268.A N ASN 258.A O no hydrogen 2.948 N/A ASN 270.A N ARG 267.A O no hydrogen 2.943 N/A ASN 270.A ND2 LEU 264.A O no hydrogen 2.897 N/A GLY 274.A N LEU 271.A O no hydrogen 2.712 N/A ASN 276.A N ASP 273.A O no hydrogen 3.078 N/A ASP 277.A N GLY 274.A O no hydrogen 3.287 N/A ILE 278.A N VAL 275.A O no hydrogen 2.937 N/A LYS 279.A N VAL 275.A O no hydrogen 2.890 N/A LYS 279.A NZ GLU 143.A OE1 no hydrogen 3.251 N/A LYS 279.A NZ GLU 143.A OE2 no hydrogen 3.241 N/A ASN 280.A N ASN 276.A O no hydrogen 2.841 N/A HIS 281.A N ILE 278.A O no hydrogen 2.961 N/A HIS 281.A NE2 ASP 254.A OD1 no hydrogen 2.740 N/A TRP 283.A N HIS 281.A ND1 no hydrogen 2.849 N/A TRP 283.A NE1 GLU 128.A OE1 no hydrogen 2.852 N/A PHE 284.A N HIS 281.A O no hydrogen 2.926 N/A ALA 285.A N LYS 282.A O no hydrogen 2.864 N/A THR 287.A N PHE 284.A O no hydrogen 2.896 N/A THR 287.A OG1 PHE 284.A O no hydrogen 3.431 N/A ALA 291.A N ASP 288.A OD1 no hydrogen 2.701 N/A ILE 292.A N ASP 288.A O no hydrogen 2.991 N/A TYR 293.A N TRP 289.A O no hydrogen 3.041 N/A GLN 294.A N ILE 290.A O no hydrogen 2.891 N/A ARG 295.A N ILE 292.A O no hydrogen 2.833 N/A LYS 296.A N ALA 291.A O no hydrogen 2.756 N/A LYS 304.A NZ ASN 313.A OD1 no hydrogen 3.362 N/A ASP 310.A N GLY 307.A O no hydrogen 3.469 N/A SER 312.A N ASP 310.A OD1 no hydrogen 3.323 N/A SER 312.A N ASP 310.A OD2 no hydrogen 3.280 N/A SER 312.A OG ASP 310.A OD1 no hydrogen 3.041 N/A SER 312.A OG ASP 310.A OD2 no hydrogen 2.868 N/A ASN 313.A ND2 PRO 112.A O no hydrogen 3.283 N/A ASN 313.A ND2 LYS 304.A O no hydrogen 3.549 N/A PHE 314.A N THR 311.A O no hydrogen 2.925 N/A LYS 328.A N ASN 101.A O no hydrogen 2.919 N/A LYS 331.A NZ GLU 332.A OE1 no hydrogen 2.632 N/A LYS 331.A NZ GLU 332.A OE2 no hydrogen 3.259 N/A GLU 332.A N GLU 332.A OE1 no hydrogen 2.573 N/A PHE 333.A N CYS 329.A O no hydrogen 3.295 N/A PHE 333.A N GLY 330.A O no hydrogen 3.253 N/A SER 334.A N LYS 331.A O no hydrogen 3.449 N/A SER 334.A OG LYS 331.A O no hydrogen 3.399 N/A PHE 336.A N PHE 333.A O no hydrogen 2.865 N/A