Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5erg_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N GLY 148.A O no hydrogen 3.326 N/A CYS 2.A N HIS 147.A O no hydrogen 3.048 N/A CYS 2.A SG HIS 147.A O no hydrogen 3.774 N/A SER 4.A N ASN 1.A O no hydrogen 3.132 N/A LYS 7.A N GLN 69.A OE1 no hydrogen 2.886 N/A ILE 10.A N LYS 51.A O no hydrogen 2.818 N/A LYS 11.A N ASP 14.A OD2 no hydrogen 2.854 N/A GLY 13.A N MET 30.A O no hydrogen 2.793 N/A ASP 14.A N LYS 11.A O no hydrogen 2.976 N/A THR 16.A N VAL 28.A O no hydrogen 2.876 N/A THR 16.A OG1 VAL 28.A O no hydrogen 2.840 N/A LEU 17.A N LEU 68.A O no hydrogen 2.895 N/A ILE 18.A N LYS 26.A O no hydrogen 2.686 N/A TRP 19.A N HIS 66.A O no hydrogen 2.757 N/A VAL 20.A N ASN 24.A O no hydrogen 2.804 N/A SER 21.A N ASN 24.A O no hydrogen 3.171 N/A SER 21.A OG ASP 23.A OD1 no hydrogen 2.671 N/A ASN 24.A N SER 21.A O no hydrogen 2.974 N/A LYS 26.A N ILE 18.A O no hydrogen 2.850 N/A LYS 26.A NZ ASN 24.A OD1 no hydrogen 2.536 N/A VAL 28.A N THR 16.A O no hydrogen 2.842 N/A ARG 29.A NE GLY 13.A O no hydrogen 3.323 N/A MET 30.A N ASP 14.A O no hydrogen 2.913 N/A HIS 31.A N HIS 45.A ND1 no hydrogen 3.099 N/A SER 32.A N GLU 12.A OE2 no hydrogen 2.818 N/A SER 32.A OG GLU 12.A OE2 no hydrogen 3.143 N/A GLU 33.A N HIS 31.A ND1 no hydrogen 3.404 N/A GLU 34.A N HIS 31.A O no hydrogen 2.941 N/A PHE 36.A N PHE 43.A O no hydrogen 2.741 N/A THR 38.A N GLY 41.A O no hydrogen 2.833 N/A GLY 41.A N THR 38.A O no hydrogen 3.131 N/A SER 42.A OG ASN 37.A OD1 no hydrogen 2.353 N/A PHE 43.A N PHE 36.A O no hydrogen 2.600 N/A HIS 45.A N GLU 34.A O no hydrogen 2.978 N/A ASP 47.A N PRO 44.A O no hydrogen 3.085 N/A ILE 48.A N HIS 45.A O no hydrogen 2.874 N/A ILE 49.A N HIS 45.A O no hydrogen 2.911 N/A GLY 50.A N ILE 10.A O no hydrogen 2.701 N/A LYS 51.A N ILE 48.A O no hydrogen 2.939 N/A LYS 51.A NZ ASP 47.A O no hydrogen 2.817 N/A TYR 53.A N ASP 8.A O no hydrogen 2.997 N/A TYR 53.A OH ASP 14.A OD2 no hydrogen 2.894 N/A GLY 54.A N VAL 67.A O no hydrogen 2.838 N/A SER 55.A N PRO 52.A O no hydrogen 3.107 N/A SER 55.A OG PRO 52.A O no hydrogen 2.534 N/A ILE 57.A N VAL 65.A O no hydrogen 2.696 N/A ILE 59.A N ALA 63.A O no hydrogen 3.072 N/A ALA 63.A N ILE 59.A O no hydrogen 2.927 N/A VAL 65.A N ILE 57.A O no hydrogen 3.021 N/A HIS 66.A N TRP 19.A O no hydrogen 3.094 N/A VAL 67.A N SER 55.A O no hydrogen 3.087 N/A LEU 68.A N LEU 17.A O no hydrogen 2.817 N/A GLN 69.A NE2 CYS 2.A O no hydrogen 3.202 N/A GLN 69.A NE2 GLY 5.A O no hydrogen 3.057 N/A TRP 75.A N THR 71.A O no hydrogen 2.955 N/A THR 76.A N PRO 72.A O no hydrogen 2.885 N/A THR 76.A OG1 PRO 72.A O no hydrogen 3.007 N/A THR 76.A OG1 SER 115.A OG no hydrogen 2.805 N/A LEU 77.A N GLU 73.A O no hydrogen 3.235 N/A SER 78.A N TRP 75.A O no hydrogen 3.032 N/A SER 78.A OG TRP 75.A O no hydrogen 2.575 N/A LEU 79.A N THR 76.A O no hydrogen 3.378 N/A THR 83.A N PRO 80.A O no hydrogen 3.414 N/A THR 83.A OG1 PRO 80.A O no hydrogen 2.637 N/A SER 91.A N TYR 87.A O no hydrogen 3.113 N/A SER 91.A OG TYR 87.A O no hydrogen 3.290 N/A SER 91.A OG THR 88.A O no hydrogen 3.527 N/A SER 92.A N THR 88.A O no hydrogen 2.838 N/A SER 92.A OG THR 88.A O no hydrogen 2.649 N/A SER 92.A OG PRO 89.A O no hydrogen 3.475 N/A TYR 93.A N PRO 89.A O no hydrogen 3.384 N/A ILE 94.A N ASP 90.A O no hydrogen 2.933 N/A MET 95.A N SER 91.A O no hydrogen 2.911 N/A GLN 96.A N SER 92.A O no hydrogen 3.158 N/A ARG 97.A N TYR 93.A O no hydrogen 2.932 N/A ARG 97.A NH1 TYR 93.A OH no hydrogen 2.960 N/A ARG 97.A NH1 GLU 244.A OE2 no hydrogen 3.016 N/A ARG 97.A NH2 GLU 244.A OE2 no hydrogen 2.787 N/A LEU 98.A N ILE 94.A O no hydrogen 3.060 N/A ASN 99.A N GLN 96.A O no hydrogen 2.981 N/A CYS 100.A N MET 95.A O no hydrogen 2.788 N/A SER 101.A N SER 104.A OG no hydrogen 3.029 N/A HIS 103.A N SER 101.A OG no hydrogen 3.046 N/A HIS 103.A NE2 GLU 214.A OE2 no hydrogen 2.835 N/A SER 104.A N SER 101.A O no hydrogen 2.828 N/A SER 104.A OG SER 101.A O no hydrogen 3.328 N/A ARG 105.A N ASN 190.A OD1 no hydrogen 2.746 N/A ARG 105.A NH1 LEU 187.A O no hydrogen 2.578 N/A VAL 106.A N HIS 126.A O no hydrogen 2.955 N/A ILE 107.A N VAL 191.A O no hydrogen 2.869 N/A GLU 108.A N PHE 128.A O no hydrogen 2.892 N/A ALA 109.A N PHE 193.A O no hydrogen 3.191 N/A GLY 110.A N ASP 195.A O no hydrogen 3.100 N/A THR 111.A OG1 SER 129.A OG no hydrogen 2.882 N/A GLY 112.A N GLU 131.A OE2 no hydrogen 3.132 N/A GLY 114.A N THR 111.A O no hydrogen 2.997 N/A SER 115.A OG THR 76.A OG1 no hydrogen 2.805 N/A SER 115.A OG VAL 86.A O no hydrogen 2.873 N/A SER 117.A OG GLU 108.A OE1 no hydrogen 2.591 N/A SER 117.A OG GLU 108.A OE2 no hydrogen 3.354 N/A HIS 118.A N GLY 114.A O no hydrogen 3.218 N/A HIS 118.A ND1 GLY 114.A O no hydrogen 2.883 N/A HIS 118.A NE2 HIS 147.A ND1 no hydrogen 2.820 N/A PHE 120.A N PHE 116.A O no hydrogen 2.911 N/A ALA 121.A N SER 117.A O no hydrogen 2.900 N/A ARG 122.A N HIS 118.A O no hydrogen 3.344 N/A ARG 122.A NH1 GLU 73.A OE1 no hydrogen 2.832 N/A ARG 122.A NH1 GLU 73.A OE2 no hydrogen 3.285 N/A ARG 122.A NH2 GLU 73.A OE2 no hydrogen 2.852 N/A SER 123.A N PHE 120.A O no hydrogen 2.947 N/A HIS 126.A N SER 104.A O no hydrogen 3.307 N/A HIS 126.A NE2 THR 155.A OG1 no hydrogen 2.700 N/A LEU 127.A N ASN 153.A O no hydrogen 2.767 N/A PHE 128.A N VAL 106.A O no hydrogen 2.799 N/A SER 129.A N THR 155.A O no hydrogen 2.704 N/A SER 129.A OG GLU 108.A OE1 no hydrogen 2.610 N/A SER 129.A OG THR 111.A OG1 no hydrogen 2.882 N/A PHE 130.A N GLU 108.A O no hydrogen 2.840 N/A GLU 131.A N THR 157.A O no hydrogen 3.037 N/A HIS 133.A N GLU 131.A OE1 no hydrogen 2.883 N/A ARG 136.A N HIS 133.A ND1 no hydrogen 3.403 N/A TYR 137.A N HIS 133.A O no hydrogen 2.746 N/A GLU 138.A N HIS 134.A O no hydrogen 2.962 N/A GLN 139.A N ILE 135.A O no hydrogen 2.997 N/A ALA 140.A N ARG 136.A O no hydrogen 2.888 N/A LEU 141.A N TYR 137.A O no hydrogen 2.829 N/A GLU 142.A N GLU 138.A O no hydrogen 2.951 N/A GLU 143.A N GLN 139.A O no hydrogen 2.973 N/A PHE 144.A N ALA 140.A O no hydrogen 2.712 N/A LYS 145.A N LEU 141.A O no hydrogen 2.915 N/A GLU 146.A N GLU 142.A O no hydrogen 2.957 N/A HIS 147.A N GLU 143.A O no hydrogen 2.851 N/A HIS 147.A ND1 HIS 118.A NE2 no hydrogen 2.820 N/A GLY 148.A N LYS 145.A O no hydrogen 2.988 N/A LEU 149.A N PHE 144.A O no hydrogen 2.781 N/A ILE 150.A N PHE 144.A O no hydrogen 3.359 N/A ASP 152.A N LEU 149.A O no hydrogen 3.041 N/A ASN 153.A N LEU 149.A O no hydrogen 3.240 N/A ASN 153.A ND2 ALA 121.A O no hydrogen 2.883 N/A ASN 153.A ND2 VAL 124.A O no hydrogen 2.851 N/A VAL 154.A N LEU 149.A O no hydrogen 3.240 N/A THR 155.A N LEU 127.A O no hydrogen 2.717 N/A THR 155.A OG1 HIS 126.A NE2 no hydrogen 2.700 N/A ILE 156.A N SER 175.A OG no hydrogen 3.173 N/A THR 157.A N SER 129.A O no hydrogen 2.880 N/A THR 157.A OG1 THR 174.A OG1 no hydrogen 2.725 N/A HIS 158.A N THR 173.A O no hydrogen 2.839 N/A HIS 158.A NE2 PHE 132.A O no hydrogen 2.956 N/A ARG 159.A N GLU 131.A O no hydrogen 3.046 N/A ARG 159.A NH1 GLY 165.A O no hydrogen 3.110 N/A ARG 159.A NH1 LEU 167.A O no hydrogen 2.683 N/A ARG 159.A NH2 LEU 167.A O no hydrogen 2.866 N/A CYS 162.A N ASP 160.A OD1 no hydrogen 3.075 N/A CYS 162.A SG ALA 198.A O no hydrogen 3.646 N/A GLN 163.A N ASP 160.A OD1 no hydrogen 3.199 N/A GLY 164.A N ASP 160.A O no hydrogen 2.679 N/A GLY 165.A N VAL 161.A O no hydrogen 3.088 N/A LYS 169.A N ASP 172.A OD2 no hydrogen 2.709 N/A LYS 170.A N THR 183.A O no hydrogen 3.018 N/A ASP 172.A N LYS 169.A O no hydrogen 2.888 N/A THR 174.A OG1 ILE 156.A O no hydrogen 3.236 N/A THR 174.A OG1 THR 157.A OG1 no hydrogen 2.725 N/A SER 175.A N ILE 156.A O no hydrogen 2.926 N/A TYR 176.A N THR 174.A OG1 no hydrogen 3.059 N/A TYR 176.A OH GLU 182.A OE1 no hydrogen 3.136 N/A TYR 176.A OH GLU 182.A OE2 no hydrogen 2.781 N/A GLY 179.A N GLU 182.A OE1 no hydrogen 2.657 N/A GLU 182.A N GLY 179.A O no hydrogen 2.985 N/A ALA 185.A N ILE 168.A O no hydrogen 2.890 N/A ALA 189.A N VAL 209.A O no hydrogen 2.994 N/A ASN 190.A N ARG 105.A O no hydrogen 2.983 N/A ASN 190.A ND2 HIS 103.A O no hydrogen 3.165 N/A ASN 190.A ND2 GLU 214.A OE2 no hydrogen 3.204 N/A VAL 191.A N ARG 105.A O no hydrogen 3.040 N/A VAL 192.A N GLY 217.A O no hydrogen 2.795 N/A PHE 193.A N ILE 107.A O no hydrogen 2.855 N/A LEU 194.A N CYS 219.A O no hydrogen 2.932 N/A ASP 195.A N ALA 109.A O no hydrogen 2.634 N/A ASP 201.A N ALA 198.A O no hydrogen 2.974 N/A ALA 202.A N PRO 199.A O no hydrogen 2.963 N/A ILE 203.A N PRO 199.A O no hydrogen 3.075 N/A HIS 205.A N ALA 202.A O no hydrogen 3.059 N/A HIS 205.A NE2 CYS 162.A O no hydrogen 2.946 N/A LEU 206.A N ILE 203.A O no hydrogen 3.128 N/A VAL 209.A N LEU 206.A O no hydrogen 2.998 N/A ILE 210.A N LEU 206.A O no hydrogen 3.076 N/A SER 211.A N ALA 189.A O no hydrogen 2.860 N/A SER 211.A OG ASN 188.A OD1 no hydrogen 3.137 N/A SER 211.A OG GLU 214.A OE1 no hydrogen 2.930 N/A VAL 216.A N LYS 309.A O no hydrogen 2.779 N/A GLY 217.A N ASN 190.A O no hydrogen 2.919 N/A LEU 218.A N ALA 307.A O no hydrogen 2.847 N/A CYS 219.A N VAL 192.A O no hydrogen 2.869 N/A CYS 220.A N THR 305.A O no hydrogen 2.856 N/A PHE 221.A N LEU 194.A O no hydrogen 2.885 N/A SER 222.A N TYR 303.A O no hydrogen 3.088 N/A CYS 224.A N GLN 227.A OE1 no hydrogen 2.859 N/A GLN 227.A N CYS 224.A O no hydrogen 3.076 N/A GLN 227.A NE2 PRO 197.A O no hydrogen 3.331 N/A VAL 228.A N CYS 224.A O no hydrogen 3.254 N/A ASP 229.A N ILE 225.A O no hydrogen 3.012 N/A LYS 230.A N GLU 226.A O no hydrogen 3.125 N/A THR 231.A N GLN 227.A O no hydrogen 3.069 N/A THR 231.A OG1 GLN 227.A O no hydrogen 2.924 N/A LEU 232.A N VAL 228.A O no hydrogen 2.926 N/A ASP 233.A N ASP 229.A O no hydrogen 3.271 N/A VAL 234.A N LYS 230.A O no hydrogen 3.256 N/A LEU 235.A N THR 231.A O no hydrogen 2.885 N/A GLU 236.A N LEU 232.A O no hydrogen 3.266 N/A LYS 237.A N ASP 233.A O no hydrogen 3.175 N/A LYS 237.A NZ ASP 233.A OD2 no hydrogen 2.862 N/A TYR 238.A N VAL 234.A O no hydrogen 3.054 N/A GLY 239.A N GLU 236.A O no hydrogen 3.355 N/A TRP 240.A N LEU 235.A O no hydrogen 2.899 N/A THR 241.A N PHE 308.A O no hydrogen 2.776 N/A THR 241.A OG1 PHE 308.A O no hydrogen 3.395 N/A GLU 244.A N PHE 306.A O no hydrogen 2.972 N/A VAL 246.A N LEU 304.A O no hydrogen 2.905 N/A GLN 249.A NE2 ILE 248.A O no hydrogen 3.278 N/A GLN 249.A NE2 LYS 298.A O no hydrogen 3.680 N/A ARG 251.A NH1 GLN 249.A OE1 no hydrogen 2.891 N/A ARG 251.A NH1 GLY 250.A O no hydrogen 2.900 N/A ARG 251.A NH2 GLN 249.A OE1 no hydrogen 2.715 N/A GLN 252.A N GLU 294.A OE1 no hydrogen 3.074 N/A GLU 254.A N LYS 292.A O no hydrogen 2.914 N/A ARG 256.A N VAL 290.A O no hydrogen 2.853 N/A ARG 256.A NE GLU 254.A OE1 no hydrogen 3.042 N/A ARG 256.A NH1 GLU 280.A OE1 no hydrogen 3.570 N/A ARG 257.A N GLU 280.A OE1 no hydrogen 2.888 N/A GLN 258.A N LYS 288.A O no hydrogen 2.801 N/A VAL 260.A N LYS 286.A O no hydrogen 2.998 N/A ASP 265.A N SER 262.A OG no hydrogen 3.171 N/A ALA 266.A N SER 262.A O no hydrogen 3.276 N/A LEU 267.A N LEU 263.A O no hydrogen 2.797 N/A GLU 268.A N ASN 264.A O no hydrogen 2.901 N/A ARG 269.A N ASP 265.A O no hydrogen 3.232 N/A ARG 269.A NE ASP 265.A O no hydrogen 3.220 N/A LEU 270.A N ALA 266.A O no hydrogen 3.139 N/A ARG 271.A N LEU 267.A O no hydrogen 2.767 N/A ARG 271.A NH1 GLU 268.A OE2 no hydrogen 2.934 N/A ASP 272.A N GLU 268.A O no hydrogen 3.086 N/A ILE 273.A N ARG 269.A O no hydrogen 3.035 N/A LYS 274.A N LEU 270.A O no hydrogen 3.004 N/A ARG 275.A N ARG 271.A O no hydrogen 2.907 N/A HIS 276.A N ASP 272.A O no hydrogen 3.277 N/A LYS 277.A N LYS 274.A O no hydrogen 2.787 N/A ASP 282.A N LYS 279.A O no hydrogen 2.936 N/A ASN 284.A N ASP 282.A OD1 no hydrogen 2.992 N/A TYR 285.A N ASP 282.A O no hydrogen 2.941 N/A TRP 287.A NE1 ASP 282.A O no hydrogen 2.722 N/A LYS 288.A N GLN 258.A O no hydrogen 2.842 N/A VAL 290.A N ARG 256.A O no hydrogen 2.942 N/A LYS 292.A N GLU 254.A O no hydrogen 3.013 N/A GLU 294.A N GLN 252.A O no hydrogen 3.034 N/A HIS 300.A NE2 PRO 223.A O no hydrogen 2.929 N/A THR 301.A OG1 ASP 90.A OD1 no hydrogen 3.471 N/A THR 301.A OG1 ASP 90.A OD2 no hydrogen 2.442 N/A SER 302.A OG THR 301.A O no hydrogen 2.712 N/A TYR 303.A N SER 222.A O no hydrogen 2.779 N/A LEU 304.A N VAL 246.A O no hydrogen 2.888 N/A THR 305.A N CYS 220.A O no hydrogen 2.894 N/A PHE 306.A N GLU 244.A O no hydrogen 2.823 N/A ALA 307.A N LEU 218.A O no hydrogen 2.955 N/A PHE 308.A N THR 241.A O no hydrogen 2.942 N/A LYS 309.A N VAL 216.A O no hydrogen 2.979 N/A LYS 309.A NZ ASP 207.A OD1 no hydrogen 2.533 N/A LYS 309.A NZ TYR 238.A O no hydrogen 2.692 N/A ASN 312.A N VAL 212.A O no hydrogen 2.899 N/A ASN 312.A ND2 ASP 213.A OD1 no hydrogen 3.073 N/A ARG 315.A NE ASP 317.A OD1 no hydrogen 3.199 N/A LYS 319.A N ASP 316.A OD1 no hydrogen 3.052 N/A VAL 320.A N ASP 316.A O no hydrogen 3.283 N/A ASN 321.A N ASP 317.A O no hydrogen 3.260 N/A GLU 322.A N GLU 318.A O no hydrogen 2.668 N/A ILE 323.A N VAL 320.A O no hydrogen 3.428 N/A