Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ary_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N ASP 129.A O no hydrogen 2.901 N/A GLY 7.A N LYS 4.A O no hydrogen 3.001 N/A GLN 8.A N TYR 5.A O no hydrogen 3.177 N/A GLN 8.A NE2 ASP 26.A OD1 no hydrogen 2.770 N/A GLN 12.A N ASP 9.A OD1 no hydrogen 3.339 N/A LEU 13.A N ASP 9.A O no hydrogen 2.821 N/A ARG 14.A N TYR 10.A O no hydrogen 2.792 N/A ARG 14.A NE GLY 112.A O no hydrogen 3.141 N/A ARG 14.A NH1 GLU 11.A OE1 no hydrogen 2.744 N/A ARG 14.A NH2 GLY 112.A O no hydrogen 3.208 N/A VAL 15.A N GLU 11.A O no hydrogen 3.076 N/A ARG 16.A N GLN 12.A O no hydrogen 3.299 N/A CYS 17.A N LEU 13.A O no hydrogen 3.216 N/A CYS 17.A SG LEU 13.A O no hydrogen 3.312 N/A LEU 18.A N ARG 14.A O no hydrogen 2.954 N/A GLN 19.A N VAL 15.A O no hydrogen 2.806 N/A SER 20.A N ARG 16.A O no hydrogen 3.114 N/A SER 20.A OG ARG 16.A O no hydrogen 3.153 N/A SER 20.A OG CYS 17.A O no hydrogen 3.507 N/A GLY 21.A N LEU 18.A O no hydrogen 2.994 N/A THR 22.A N CYS 17.A O no hydrogen 2.750 N/A PHE 24.A N ALA 114.A O no hydrogen 2.785 N/A ASP 26.A N ASP 133.A OD2 no hydrogen 2.702 N/A ALA 28.A N ASP 26.A OD1 no hydrogen 3.105 N/A SER 35.A N VAL 32.A O no hydrogen 2.780 N/A SER 35.A OG PRO 30.A O no hydrogen 2.605 N/A LEU 36.A N PRO 33.A O no hydrogen 3.152 N/A GLY 37.A N PRO 33.A O no hydrogen 3.254 N/A TYR 38.A N GLU 171.A OE2 no hydrogen 2.984 N/A LYS 39.A N GLU 171.A OE2 no hydrogen 2.937 N/A ASP 40.A N GLU 171.A OE1 no hydrogen 2.693 N/A LEU 41.A N GLU 171.A OE2 no hydrogen 2.624 N/A GLY 42.A N LYS 39.A O no hydrogen 3.211 N/A SER 45.A N GLY 42.A O no hydrogen 3.012 N/A SER 45.A OG ASP 40.A O no hydrogen 3.466 N/A SER 45.A OG GLY 42.A O no hydrogen 3.152 N/A SER 45.A OG THR 48.A OG1 no hydrogen 2.728 N/A THR 48.A N SER 45.A O no hydrogen 3.179 N/A THR 48.A N SER 45.A OG no hydrogen 3.067 N/A THR 48.A OG1 SER 45.A O no hydrogen 2.998 N/A THR 48.A OG1 SER 45.A OG no hydrogen 2.728 N/A TYR 49.A N SER 46.A O no hydrogen 3.255 N/A ILE 51.A N THR 48.A O no hydrogen 3.122 N/A LYS 52.A N ILE 138.A O no hydrogen 2.950 N/A LYS 54.A N LEU 136.A O no hydrogen 2.955 N/A ARG 55.A N GLU 58.A OE1 no hydrogen 2.909 N/A ARG 55.A NH1 PHE 24.A O no hydrogen 3.117 N/A ARG 55.A NH1 ASP 134.A OD1 no hydrogen 2.703 N/A ARG 55.A NH2 PHE 24.A O no hydrogen 2.775 N/A THR 57.A OG1 TYR 113.A OH no hydrogen 2.816 N/A GLU 58.A N ARG 55.A O no hydrogen 2.864 N/A LEU 59.A N ARG 55.A O no hydrogen 3.250 N/A LEU 59.A N PRO 56.A O no hydrogen 3.015 N/A LEU 60.A N PRO 56.A O no hydrogen 2.963 N/A GLN 64.A N ASN 152.A O no hydrogen 2.642 N/A GLN 64.A NE2 ILE 66.A O no hydrogen 3.443 N/A VAL 67.A N GLU 153.A OE2 no hydrogen 2.718 N/A THR 71.A N ASP 74.A OD2 no hydrogen 2.878 N/A THR 71.A OG1 THR 73.A OG1 no hydrogen 3.024 N/A ARG 72.A NH1 GLU 301.A OE1 no hydrogen 2.684 N/A ARG 72.A NH1 GLU 301.A OE2 no hydrogen 3.402 N/A THR 73.A OG1 THR 71.A OG1 no hydrogen 3.024 N/A THR 73.A OG1 ASP 74.A OD1 no hydrogen 3.104 N/A ASP 74.A N THR 71.A O no hydrogen 2.856 N/A ILE 75.A N ARG 72.A O no hydrogen 3.173 N/A CYS 76.A N HIS 147.A O no hydrogen 2.780 N/A CYS 76.A SG THR 73.A O no hydrogen 3.953 N/A GLN 77.A N PRO 265.A O no hydrogen 2.905 N/A GLN 77.A NE2 LEU 80.A O no hydrogen 2.728 N/A ALA 79.A N VAL 144.A O no hydrogen 2.769 N/A ASP 82.A N LEU 80.A O no hydrogen 2.792 N/A TRP 84.A NE1 GLU 317.A OE1 no hydrogen 3.197 N/A LEU 86.A N ASP 82.A O no hydrogen 2.981 N/A ALA 87.A N CYS 83.A O no hydrogen 2.882 N/A ALA 88.A N TRP 84.A O no hydrogen 3.014 N/A ILE 89.A N LEU 85.A O no hydrogen 2.903 N/A ALA 90.A N LEU 86.A O no hydrogen 2.959 N/A SER 91.A N ALA 87.A O no hydrogen 2.934 N/A SER 91.A OG ALA 87.A O no hydrogen 3.175 N/A SER 91.A OG LEU 216.A O no hydrogen 3.250 N/A LEU 92.A N ALA 88.A O no hydrogen 2.779 N/A THR 93.A N ILE 89.A O no hydrogen 3.128 N/A THR 93.A OG1 ALA 90.A O no hydrogen 2.645 N/A LEU 94.A N SER 91.A O no hydrogen 3.229 N/A ASN 95.A N LEU 92.A O no hydrogen 3.005 N/A ASN 95.A ND2 GLY 213.A O no hydrogen 2.828 N/A LEU 98.A N ASN 95.A OD1 no hydrogen 3.263 N/A LEU 99.A N ASN 95.A O no hydrogen 2.800 N/A HIS 100.A N ASP 96.A O no hydrogen 3.197 N/A ARG 101.A N THR 97.A O no hydrogen 3.152 N/A ARG 101.A N LEU 98.A O no hydrogen 3.102 N/A ARG 101.A NE GLN 120.A OE1 no hydrogen 2.725 N/A ARG 101.A NH2 GLN 120.A OE1 no hydrogen 2.644 N/A VAL 102.A N LEU 98.A O no hydrogen 3.014 N/A VAL 103.A N LEU 99.A O no hydrogen 2.842 N/A HIS 105.A ND1 VAL 103.A O no hydrogen 2.784 N/A GLN 107.A NE2 PRO 104.A O no hydrogen 2.930 N/A GLN 107.A NE2 HIS 118.A O no hydrogen 3.041 N/A GLN 110.A N SER 108.A OG no hydrogen 3.337 N/A TYR 113.A OH THR 57.A OG1 no hydrogen 2.816 N/A TYR 113.A OH ASP 134.A OD1 no hydrogen 3.398 N/A TYR 113.A OH ASP 134.A OD2 no hydrogen 2.550 N/A PHE 117.A N VAL 132.A O no hydrogen 2.914 N/A HIS 118.A N GLN 107.A OE1 no hydrogen 2.893 N/A PHE 119.A N VAL 130.A O no hydrogen 2.913 N/A GLN 120.A N VAL 102.A O no hydrogen 3.135 N/A GLN 120.A NE2 ASP 129.A OD1 no hydrogen 2.873 N/A LEU 121.A N VAL 128.A O no hydrogen 2.779 N/A GLN 123.A N GLU 126.A O no hydrogen 2.944 N/A GLU 126.A N GLN 123.A O no hydrogen 3.170 N/A VAL 128.A N LEU 121.A O no hydrogen 2.787 N/A ASP 129.A N ILE 3.A O no hydrogen 2.754 N/A VAL 130.A N PHE 119.A O no hydrogen 2.725 N/A VAL 132.A N PHE 117.A O no hydrogen 2.840 N/A ASP 134.A N GLY 115.A O no hydrogen 3.120 N/A LEU 135.A N ASP 133.A OD1 no hydrogen 3.115 N/A LEU 136.A N LYS 54.A O no hydrogen 2.952 N/A ILE 138.A N LYS 52.A O no hydrogen 2.729 N/A LYS 139.A N LYS 142.A O no hydrogen 2.810 N/A LYS 139.A NZ SER 46.A O no hydrogen 3.497 N/A LYS 139.A NZ LYS 47.A O no hydrogen 2.738 N/A LYS 139.A NZ TYR 49.A O no hydrogen 2.856 N/A LYS 142.A N LYS 139.A O no hydrogen 3.044 N/A VAL 144.A N PRO 137.A O no hydrogen 3.201 N/A VAL 146.A N GLU 160.A OE2 no hydrogen 2.976 N/A HIS 147.A N CYS 76.A O no hydrogen 2.974 N/A SER 148.A OG ASP 74.A OD1 no hydrogen 3.443 N/A SER 148.A OG GLU 150.A O no hydrogen 3.568 N/A SER 148.A OG GLU 153.A OE1 no hydrogen 2.672 N/A GLU 150.A N SER 148.A OG no hydrogen 3.166 N/A GLU 153.A N GLU 150.A O no hydrogen 3.137 N/A PHE 154.A N PHE 65.A O no hydrogen 3.394 N/A TRP 155.A N PHE 65.A O no hydrogen 2.998 N/A TRP 155.A NE1 ASP 74.A OD2 no hydrogen 2.875 N/A SER 156.A OG ASP 74.A O no hydrogen 2.716 N/A LEU 158.A N PHE 154.A O no hydrogen 3.050 N/A LEU 159.A N TRP 155.A O no hydrogen 2.770 N/A GLU 160.A N SER 156.A O no hydrogen 2.859 N/A LYS 161.A N ALA 157.A O no hydrogen 2.975 N/A LYS 161.A NZ ASP 133.A O no hydrogen 2.681 N/A LYS 161.A NZ LEU 135.A O no hydrogen 2.662 N/A ALA 162.A N LEU 158.A O no hydrogen 3.022 N/A TYR 163.A N LEU 159.A O no hydrogen 3.176 N/A ALA 164.A N GLU 160.A O no hydrogen 2.902 N/A LYS 165.A N LYS 161.A O no hydrogen 2.857 N/A LYS 165.A NZ GLN 8.A OE1 no hydrogen 2.579 N/A LYS 165.A NZ ASP 26.A OD1 no hydrogen 3.512 N/A LYS 165.A NZ ASP 26.A OD2 no hydrogen 2.656 N/A LYS 165.A NZ VAL 131.A O no hydrogen 2.825 N/A VAL 166.A N ALA 162.A O no hydrogen 3.155 N/A ASN 167.A N TYR 163.A O no hydrogen 3.239 N/A ASN 167.A N ALA 164.A O no hydrogen 3.257 N/A ASN 167.A ND2 TYR 163.A O no hydrogen 2.654 N/A GLY 168.A N LYS 165.A O no hydrogen 3.147 N/A TYR 170.A N SER 35.A O no hydrogen 2.834 N/A GLU 171.A N LEU 36.A O no hydrogen 2.866 N/A ALA 172.A N SER 169.A OG no hydrogen 3.086 N/A LEU 173.A N TYR 170.A O no hydrogen 2.779 N/A SER 174.A N GLU 171.A O no hydrogen 2.907 N/A SER 179.A OG GLU 317.A OE1 no hydrogen 3.280 N/A SER 179.A OG GLU 317.A OE2 no hydrogen 2.559 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.819 N/A THR 186.A OG1 ASN 320.A O no hydrogen 3.434 N/A GLU 191.A N ILE 318.A O no hydrogen 2.729 N/A TYR 193.A N LEU 316.A O no hydrogen 2.904 N/A TYR 193.A OH GLU 191.A OE2 no hydrogen 2.671 N/A LEU 195.A N THR 314.A O no hydrogen 2.840 N/A LYS 197.A N GLU 194.A O no hydrogen 3.171 N/A LEU 202.A N PRO 199.A O no hydrogen 3.100 N/A TYR 203.A OH LEU 259.A O no hydrogen 3.401 N/A ILE 205.A N ASP 201.A O no hydrogen 3.015 N/A ILE 206.A N LEU 202.A O no hydrogen 2.865 N/A LEU 207.A N TYR 203.A O no hydrogen 2.993 N/A LYS 208.A N GLN 204.A O no hydrogen 3.103 N/A LYS 208.A NZ GLN 204.A OE1 no hydrogen 3.477 N/A ALA 209.A N ILE 205.A O no hydrogen 3.005 N/A LEU 210.A N ILE 206.A O no hydrogen 3.040 N/A GLU 211.A N LEU 207.A O no hydrogen 3.070 N/A ARG 212.A N LYS 208.A O no hydrogen 3.161 N/A ARG 212.A NH2 ASN 320.A OD1 no hydrogen 2.692 N/A GLY 213.A N LEU 210.A O no hydrogen 3.168 N/A SER 214.A N ALA 209.A O no hydrogen 2.930 N/A SER 214.A OG ASN 320.A OD1 no hydrogen 2.982 N/A LEU 215.A N CYS 319.A O no hydrogen 2.991 N/A GLY 217.A N GLU 317.A O no hydrogen 3.004 N/A CYS 218.A N TYR 242.A O no hydrogen 3.048 N/A SER 219.A N ARG 315.A O no hydrogen 3.213 N/A ASP 221.A N THR 314.A OG1 no hydrogen 2.944 N/A SER 224.A OG ASP 227.A OD1 no hydrogen 2.699 N/A THR 232.A N LEU 236.A O no hydrogen 2.672 N/A LYS 235.A N THR 232.A O no hydrogen 3.302 N/A VAL 237.A N TYR 242.A OH no hydrogen 2.982 N/A LYS 238.A N ALA 230.A O no hydrogen 2.922 N/A GLY 239.A N ILE 220.A O no hydrogen 2.609 N/A HIS 240.A NE2 ASN 264.A OD1 no hydrogen 2.665 N/A TYR 242.A N CYS 218.A O no hydrogen 2.891 N/A SER 243.A N ARG 263.A O no hydrogen 2.946 N/A SER 243.A OG ALA 87.A O no hydrogen 2.668 N/A VAL 244.A N LEU 216.A O no hydrogen 2.941 N/A THR 245.A N ARG 261.A O no hydrogen 2.773 N/A THR 245.A OG1 GLU 301.A OE2 no hydrogen 2.671 N/A GLY 246.A N ARG 261.A O no hydrogen 3.342 N/A LYS 248.A N LEU 259.A O no hydrogen 3.006 N/A GLN 249.A NE2 SER 258.A OG no hydrogen 2.997 N/A VAL 250.A N VAL 257.A O no hydrogen 2.819 N/A ASN 251.A N GLU 289.A OE1 no hydrogen 3.166 N/A ASN 251.A N GLU 289.A OE2 no hydrogen 3.369 N/A TYR 252.A N GLN 255.A O no hydrogen 2.772 N/A ARG 253.A N ASN 284.A O no hydrogen 3.167 N/A ARG 253.A NE TYR 252.A OH no hydrogen 3.259 N/A GLN 255.A N TYR 252.A O no hydrogen 2.739 N/A VAL 257.A N VAL 250.A O no hydrogen 2.869 N/A LEU 259.A N LYS 248.A O no hydrogen 2.738 N/A ILE 260.A N MET 304.A O no hydrogen 2.828 N/A ARG 261.A N GLY 246.A O no hydrogen 2.668 N/A ARG 261.A NE THR 245.A OG1 no hydrogen 2.961 N/A ARG 261.A NH2 THR 245.A O no hydrogen 2.914 N/A MET 262.A N PHE 302.A O no hydrogen 2.911 N/A ARG 263.A N SER 243.A O no hydrogen 2.802 N/A ARG 263.A NH1 ILE 75.A O no hydrogen 3.000 N/A ARG 263.A NH2 ILE 75.A O no hydrogen 2.854 N/A ASN 264.A N GLY 300.A O no hydrogen 2.780 N/A ASN 264.A ND2 VAL 269.A O no hydrogen 2.992 N/A TRP 266.A N ASN 264.A OD1 no hydrogen 2.970 N/A GLY 267.A N ASN 264.A O no hydrogen 2.891 N/A VAL 269.A N GLU 298.A OE2 no hydrogen 2.601 N/A TRP 271.A NE1 ALA 274.A O no hydrogen 2.941 N/A THR 272.A N LYS 234.A O no hydrogen 2.936 N/A TRP 275.A N GLU 281.A OE1 no hydrogen 3.092 N/A SER 276.A N GLY 273.A O no hydrogen 2.996 N/A SER 276.A OG GLY 273.A O no hydrogen 2.557 N/A SER 279.A N SER 276.A O no hydrogen 3.125 N/A SER 279.A OG SER 276.A O no hydrogen 2.876 N/A SER 279.A OG GLU 281.A OE1 no hydrogen 3.000 N/A GLU 281.A N GLU 281.A OE1 no hydrogen 2.894 N/A TRP 282.A NE1 SER 276.A O no hydrogen 2.956 N/A ASN 283.A N SER 280.A O no hydrogen 3.044 N/A ASN 284.A N GLU 281.A O no hydrogen 3.145 N/A TYR 288.A N ASP 286.A OD1 no hydrogen 3.005 N/A ARG 290.A N ASP 286.A O no hydrogen 3.005 N/A ARG 290.A NE ASP 291.A OD1 no hydrogen 2.995 N/A ARG 290.A NH2 ASP 291.A OD1 no hydrogen 2.888 N/A ASP 291.A N PRO 287.A O no hydrogen 3.016 N/A GLN 292.A N TYR 288.A O no hydrogen 3.206 N/A LEU 293.A N GLU 289.A O no hydrogen 2.964 N/A LEU 293.A N ARG 290.A O no hydrogen 3.254 N/A ARG 294.A N ARG 290.A O no hydrogen 2.868 N/A MET 297.A N ASP 277.A OD2 no hydrogen 3.061 N/A ASP 299.A N GLU 270.A OE2 no hydrogen 2.668 N/A GLY 300.A N GLU 270.A OE2 no hydrogen 2.838 N/A GLU 301.A N ASP 299.A OD1 no hydrogen 3.018 N/A PHE 302.A N MET 262.A O no hydrogen 3.010 N/A TRP 303.A NE1 LEU 293.A O no hydrogen 2.916 N/A MET 304.A N ILE 260.A O no hydrogen 2.833 N/A PHE 306.A N SER 258.A O no hydrogen 2.789 N/A ASP 308.A N SER 305.A OG no hydrogen 3.162 N/A PHE 309.A N SER 305.A O no hydrogen 2.851 N/A MET 310.A N PHE 306.A O no hydrogen 2.971 N/A ARG 311.A N ARG 307.A O no hydrogen 3.283 N/A ARG 311.A NH1 ASP 308.A OD1 no hydrogen 2.857 N/A ARG 311.A NH2 GLU 312.A OE2 no hydrogen 2.481 N/A GLU 312.A N ASP 308.A O no hydrogen 2.971 N/A PHE 313.A N PHE 309.A O no hydrogen 2.918 N/A THR 314.A N SER 219.A O no hydrogen 3.056 N/A THR 314.A OG1 SER 219.A O no hydrogen 2.911 N/A ARG 315.A N SER 219.A O no hydrogen 3.267 N/A LEU 316.A N TYR 193.A O no hydrogen 2.933 N/A GLU 317.A N GLY 217.A O no hydrogen 2.790 N/A ILE 318.A N GLU 191.A O no hydrogen 2.833 N/A CYS 319.A N LEU 215.A O no hydrogen 2.799 N/A CYS 319.A SG GLU 317.A OE2 no hydrogen 3.631 N/A ASN 320.A N VAL 189.A O no hydrogen 3.134 N/A ASN 320.A ND2 VAL 189.A O no hydrogen 2.576 N/A ASN 320.A ND2 GLU 191.A OE1 no hydrogen 2.747 N/A