Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7e1r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N GLU 365.A OE1 no hydrogen 3.396 N/A SER 6.A OG THR 364.A O no hydrogen 3.021 N/A THR 7.A N GLY 366.A O no hydrogen 2.526 N/A THR 7.A OG1 GLY 366.A O no hydrogen 2.344 N/A LEU 8.A N SER 6.A OG no hydrogen 2.982 N/A LEU 11.A N ILE 18.A O no hydrogen 2.854 N/A ILE 13.A N HIS 16.A O no hydrogen 3.215 N/A LYS 15.A NZ LYS 15.A O no hydrogen 3.397 N/A LYS 15.A NZ HIS 16.A ND1 no hydrogen 2.959 N/A HIS 16.A NE2 ASP 144.A O no hydrogen 3.177 N/A ILE 18.A N LEU 11.A O no hydrogen 2.742 N/A PHE 20.A N GLY 44.A O no hydrogen 3.147 N/A ILE 22.A N PHE 20.A O no hydrogen 2.772 N/A PHE 23.A N VAL 242.A O no hydrogen 2.728 N/A GLN 24.A N LEU 46.A O no hydrogen 2.900 N/A GLN 24.A NE2 GLY 25.A O no hydrogen 2.889 N/A GLN 24.A NE2 VAL 48.A O no hydrogen 2.992 N/A GLY 25.A N MET 244.A O no hydrogen 2.616 N/A MET 27.A N SER 32.A OG no hydrogen 2.879 N/A SER 32.A N MET 27.A O no hydrogen 3.461 N/A SER 32.A OG MET 27.A O no hydrogen 3.426 N/A SER 32.A OG SER 32.A O no hydrogen 2.653 N/A SER 32.A OG VAL 48.A O no hydrogen 3.115 N/A TRP 33.A N ASP 255.A OD2 no hydrogen 3.287 N/A TRP 33.A NE1 SER 50.A O no hydrogen 2.725 N/A GLU 35.A N ASP 255.A OD1 no hydrogen 3.433 N/A LEU 36.A N ASP 255.A OD2 no hydrogen 3.155 N/A ALA 37.A N TRP 33.A O no hydrogen 2.936 N/A GLY 38.A N ASP 34.A O no hydrogen 2.864 N/A ASN 39.A N GLU 35.A O no hydrogen 2.997 N/A ASN 39.A ND2 GLU 35.A O no hydrogen 2.862 N/A VAL 40.A N LEU 36.A O no hydrogen 2.882 N/A ALA 41.A N ALA 37.A O no hydrogen 2.918 N/A LYS 42.A N GLY 38.A O no hydrogen 2.885 N/A GLU 43.A N ASN 39.A O no hydrogen 2.989 N/A GLU 43.A N VAL 40.A O no hydrogen 3.149 N/A GLY 44.A N ALA 41.A O no hydrogen 2.990 N/A ALA 45.A N VAL 40.A O no hydrogen 3.258 N/A LEU 46.A N ILE 22.A O no hydrogen 3.019 N/A VAL 48.A N GLN 24.A OE1 no hydrogen 2.886 N/A ILE 49.A N GLY 100.A O no hydrogen 2.804 N/A SER 50.A N SER 32.A O no hydrogen 3.075 N/A ALA 51.A N ASN 102.A O no hydrogen 2.963 N/A THR 54.A OG1 SER 79.A O no hydrogen 3.416 N/A GLY 55.A N PHE 77.A O no hydrogen 2.898 N/A TYR 56.A N GLY 53.A O no hydrogen 3.120 N/A TYR 57.A N THR 54.A O no hydrogen 2.882 N/A TYR 57.A OH ASP 34.A OD2 no hydrogen 2.911 N/A LYS 58.A N TYR 332.A OH no hydrogen 2.840 N/A MET 60.A N TYR 56.A O no hydrogen 3.261 N/A ARG 61.A N TYR 57.A O no hydrogen 3.181 N/A GLU 64.A N ASN 76.A OD1 no hydrogen 3.070 N/A VAL 67.A N LYS 70.A O no hydrogen 2.946 N/A LYS 70.A N VAL 67.A O no hydrogen 2.923 N/A LYS 70.A NZ ASP 326.A OD2 no hydrogen 3.004 N/A PHE 72.A N ARG 65.A O no hydrogen 3.360 N/A GLU 73.A N VAL 304.A O no hydrogen 2.754 N/A ASN 76.A N GLU 73.A O no hydrogen 3.118 N/A ASN 76.A ND2 PHE 72.A O no hydrogen 2.952 N/A PHE 77.A N GLU 73.A O no hydrogen 2.958 N/A TYR 78.A N ALA 74.A O no hydrogen 2.914 N/A TYR 78.A OH CYS 307.A O no hydrogen 2.689 N/A SER 79.A N THR 54.A OG1 no hydrogen 3.087 N/A SER 79.A OG PHE 62.A O no hydrogen 2.920 N/A LYS 80.A NZ ASP 116.A O no hydrogen 3.352 N/A LEU 83.A N SER 79.A O no hydrogen 2.988 N/A ASN 84.A N LYS 80.A O no hydrogen 2.928 N/A GLU 85.A N LYS 81.A O no hydrogen 3.044 N/A ILE 86.A N ALA 82.A O no hydrogen 2.867 N/A PHE 87.A N LEU 83.A O no hydrogen 2.947 N/A ALA 88.A N ASN 84.A O no hydrogen 2.916 N/A ASN 89.A N GLU 85.A O no hydrogen 3.174 N/A ALA 90.A N ILE 86.A O no hydrogen 2.911 N/A ARG 91.A N PHE 87.A O no hydrogen 2.882 N/A ARG 91.A NH1 GLY 95.A O no hydrogen 2.648 N/A ARG 91.A NH1 ASN 97.A O no hydrogen 2.874 N/A ARG 91.A NH2 GLY 121.A O no hydrogen 3.061 N/A ARG 91.A NH2 ASN 123.A OD1 no hydrogen 3.095 N/A LYS 92.A N ALA 88.A O no hydrogen 2.999 N/A ILE 93.A N ALA 90.A O no hydrogen 3.020 N/A CYS 94.A N ALA 90.A O no hydrogen 2.975 N/A CYS 94.A SG ALA 90.A O no hydrogen 3.230 N/A CYS 94.A SG GLY 95.A O no hydrogen 3.677 N/A GLY 95.A N ARG 91.A O no hydrogen 2.771 N/A ASN 97.A N CYS 94.A O no hydrogen 3.228 N/A ASN 97.A ND2 ALA 41.A O no hydrogen 3.094 N/A LEU 99.A N ASN 123.A OD1 no hydrogen 3.041 N/A GLY 100.A N GLY 47.A O no hydrogen 2.754 N/A ALA 101.A N ILE 124.A O no hydrogen 2.806 N/A ASN 102.A N ILE 49.A O no hydrogen 2.795 N/A ILE 103.A N ILE 126.A O no hydrogen 3.009 N/A TYR 105.A N GLY 128.A O no hydrogen 2.942 N/A ILE 107.A N LEU 104.A O no hydrogen 3.386 N/A ASN 108.A N CYS 307.A O no hydrogen 3.185 N/A ASN 108.A ND2 ASN 306.A O no hydrogen 3.092 N/A TYR 110.A OH THR 127.A OG1 no hydrogen 2.655 N/A ARG 112.A NE ASP 109.A OD2 no hydrogen 2.964 N/A ARG 112.A NH1 TYR 78.A O no hydrogen 3.165 N/A ARG 112.A NH2 TYR 78.A O no hydrogen 3.202 N/A VAL 113.A N ASP 109.A O no hydrogen 3.070 N/A LEU 114.A N TYR 110.A O no hydrogen 2.920 N/A ARG 115.A N GLY 111.A O no hydrogen 2.959 N/A ASP 116.A N ARG 112.A O no hydrogen 2.778 N/A SER 117.A N VAL 113.A O no hydrogen 2.861 N/A SER 117.A OG VAL 113.A O no hydrogen 2.919 N/A CYS 118.A N LEU 114.A O no hydrogen 3.004 N/A CYS 118.A SG LEU 114.A O no hydrogen 3.485 N/A GLU 119.A N ARG 115.A O no hydrogen 2.865 N/A ALA 120.A N ASP 116.A O no hydrogen 2.716 N/A GLY 121.A N CYS 118.A O no hydrogen 2.869 N/A ALA 122.A N SER 117.A O no hydrogen 2.970 N/A ASN 123.A N LEU 99.A O no hydrogen 2.961 N/A ILE 124.A N LEU 99.A O no hydrogen 3.052 N/A ILE 125.A N ALA 146.A O no hydrogen 2.855 N/A ILE 126.A N ALA 101.A O no hydrogen 2.921 N/A THR 127.A N ILE 148.A O no hydrogen 2.995 N/A THR 127.A OG1 ILE 103.A O no hydrogen 2.881 N/A THR 127.A OG1 TYR 110.A OH no hydrogen 2.655 N/A THR 133.A N LEU 131.A O no hydrogen 2.818 N/A ASN 134.A N TYR 105.A OH no hydrogen 3.342 N/A MET 135.A N PRO 132.A O no hydrogen 3.521 N/A GLU 137.A N ASN 134.A O no hydrogen 3.371 N/A ALA 139.A N PRO 136.A O no hydrogen 3.041 N/A PHE 142.A N ALA 139.A O no hydrogen 2.809 N/A VAL 145.A N PHE 142.A O no hydrogen 2.765 N/A ALA 146.A N ASN 123.A O no hydrogen 3.072 N/A LEU 147.A N ASP 173.A OD2 no hydrogen 2.733 N/A ILE 148.A N ILE 125.A O no hydrogen 2.888 N/A ILE 150.A N THR 127.A O no hydrogen 2.863 N/A ILE 151.A N ILE 176.A O no hydrogen 2.850 N/A SER 152.A OG GLY 187.A O no hydrogen 3.447 N/A ALA 156.A N SER 153.A OG no hydrogen 3.040 N/A LEU 157.A N SER 153.A O no hydrogen 3.374 N/A LYS 158.A N ALA 154.A O no hydrogen 2.983 N/A LYS 158.A NZ GLU 213.A OE1 no hydrogen 2.696 N/A ILE 159.A N LYS 155.A O no hydrogen 3.118 N/A LEU 160.A N ALA 156.A O no hydrogen 2.892 N/A CYS 161.A N LEU 157.A O no hydrogen 2.942 N/A CYS 161.A SG LEU 157.A O no hydrogen 3.363 N/A LYS 162.A N LYS 158.A O no hydrogen 3.016 N/A ARG 163.A N ILE 159.A O no hydrogen 2.954 N/A TRP 164.A N LEU 160.A O no hydrogen 2.843 N/A TRP 164.A NE1 PRO 132.A O no hydrogen 3.073 N/A SER 165.A N CYS 161.A O no hydrogen 2.949 N/A SER 165.A OG LYS 162.A O no hydrogen 3.114 N/A ASP 166.A N LYS 162.A O no hydrogen 3.103 N/A ARG 167.A N ARG 163.A O no hydrogen 2.978 N/A TYR 168.A N TRP 164.A O no hydrogen 2.847 N/A TYR 168.A OH ASN 134.A OD1 no hydrogen 2.703 N/A LYS 169.A N SER 165.A O no hydrogen 3.087 N/A ARG 170.A NH1 VAL 145.A O no hydrogen 3.504 N/A ARG 170.A NH2 VAL 145.A O no hydrogen 3.481 N/A ASP 173.A N LEU 147.A O no hydrogen 3.081 N/A PHE 175.A N PRO 218.A O no hydrogen 2.981 N/A ILE 176.A N PRO 149.A O no hydrogen 2.995 N/A VAL 177.A N ILE 220.A O no hydrogen 2.859 N/A GLU 178.A N ILE 151.A O no hydrogen 2.996 N/A GLY 179.A N ALA 222.A O no hydrogen 2.750 N/A SER 182.A OG GLY 179.A O no hydrogen 2.823 N/A SER 182.A OG GLN 186.A OE1 no hydrogen 3.442 N/A HIS 185.A NE2 SER 276.A OG no hydrogen 2.654 N/A GLN 186.A N PRO 281.A O no hydrogen 2.601 N/A GLN 186.A NE2 SER 182.A O no hydrogen 2.622 N/A GLN 186.A NE2 GLY 184.A O no hydrogen 2.917 N/A ASP 192.A N LYS 189.A O no hydrogen 2.640 N/A CYS 193.A N TYR 190.A O no hydrogen 3.090 N/A CYS 193.A SG PHE 188.A O no hydrogen 3.873 N/A CYS 193.A SG LYS 189.A O no hydrogen 3.853 N/A LYS 195.A N ASP 192.A O no hydrogen 3.416 N/A ARG 199.A N GLU 196.A O no hydrogen 3.480 N/A GLU 201.A N GLU 201.A OE2 no hydrogen 3.015 N/A ASN 202.A N ARG 199.A O no hydrogen 3.249 N/A ASN 202.A ND2 GLU 196.A O no hydrogen 2.797 N/A ASN 202.A ND2 GLU 196.A OE2 no hydrogen 3.317 N/A LEU 203.A N ARG 199.A O no hydrogen 3.197 N/A VAL 204.A N LEU 200.A O no hydrogen 2.995 N/A VAL 207.A N LEU 203.A O no hydrogen 3.000 N/A VAL 208.A N VAL 204.A O no hydrogen 2.887 N/A GLU 209.A N PRO 205.A O no hydrogen 2.877 N/A ALA 210.A N LYS 206.A O no hydrogen 3.029 N/A SER 211.A N VAL 207.A O no hydrogen 2.851 N/A SER 211.A OG ILE 217.A O no hydrogen 2.999 N/A LYS 212.A N VAL 208.A O no hydrogen 3.150 N/A LYS 212.A N GLU 209.A O no hydrogen 3.326 N/A GLU 213.A N ALA 210.A O no hydrogen 3.339 N/A TRP 214.A N SER 211.A O no hydrogen 2.845 N/A GLY 215.A N LYS 212.A O no hydrogen 3.199 N/A ILE 220.A N PHE 175.A O no hydrogen 2.884 N/A ALA 221.A N GLY 241.A O no hydrogen 2.922 N/A ALA 222.A N VAL 177.A O no hydrogen 2.882 N/A ARG 228.A NE ASP 232.A OD1 no hydrogen 3.450 N/A ARG 228.A NE ASP 232.A OD2 no hydrogen 2.786 N/A ARG 228.A NH1 LEU 363.A O no hydrogen 3.266 N/A ARG 228.A NH1 GLY 366.A O no hydrogen 3.144 N/A ARG 228.A NH2 THR 7.A OG1 no hydrogen 3.113 N/A ARG 228.A NH2 GLY 366.A O no hydrogen 2.713 N/A ASP 230.A N ASP 227.A O no hydrogen 3.009 N/A ILE 231.A N ASP 227.A O no hydrogen 3.101 N/A ASP 232.A N ARG 228.A O no hydrogen 2.917 N/A THR 233.A N LYS 229.A O no hydrogen 3.398 N/A THR 233.A OG1 LYS 229.A O no hydrogen 2.861 N/A MET 234.A N ASP 230.A O no hydrogen 3.141 N/A LEU 235.A N ILE 231.A O no hydrogen 2.893 N/A SER 236.A N ASP 232.A O no hydrogen 2.907 N/A SER 236.A OG ASP 232.A O no hydrogen 2.625 N/A SER 236.A OG THR 233.A O no hydrogen 2.342 N/A LEU 237.A N THR 233.A O no hydrogen 3.318 N/A LEU 237.A N MET 234.A O no hydrogen 3.158 N/A GLY 238.A N LEU 235.A O no hydrogen 3.110 N/A ALA 239.A N MET 234.A O no hydrogen 3.206 N/A SER 240.A N ILE 219.A O no hydrogen 2.569 N/A GLY 241.A N ILE 219.A O no hydrogen 3.024 N/A VAL 242.A N PRO 21.A O no hydrogen 3.129 N/A GLN 243.A N ALA 221.A O no hydrogen 2.849 N/A MET 244.A N PHE 23.A O no hydrogen 2.882 N/A ARG 247.A NH2 TRP 226.A O no hydrogen 2.608 N/A LEU 249.A N ALA 245.A O no hydrogen 2.647 N/A GLY 250.A N THR 246.A O no hydrogen 2.982 N/A GLY 250.A N ARG 247.A O no hydrogen 2.984 N/A THR 251.A N PHE 248.A O no hydrogen 3.012 N/A THR 251.A OG1 PHE 248.A O no hydrogen 2.617 N/A LYS 252.A N ILE 354.A O no hydrogen 3.131 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 2.739 N/A CYS 254.A N THR 251.A O no hydrogen 3.278 N/A CYS 254.A SG ILE 31.A O no hydrogen 3.725 N/A CYS 254.A SG ALA 256.A O no hydrogen 3.945 N/A ASP 255.A N ILE 31.A O no hydrogen 2.809 N/A LYS 257.A NZ GLU 35.A OE1 no hydrogen 3.218 N/A LYS 257.A NZ LYS 252.A O no hydrogen 2.651 N/A LYS 257.A NZ CYS 254.A O no hydrogen 3.189 N/A TYR 259.A N ALA 256.A O no hydrogen 3.061 N/A TYR 259.A OH PHE 342.A O no hydrogen 3.246 N/A ALA 260.A N LYS 257.A O no hydrogen 2.965 N/A ASP 261.A N VAL 258.A O no hydrogen 2.873 N/A LEU 262.A N VAL 258.A O no hydrogen 3.065 N/A LEU 263.A N TYR 259.A O no hydrogen 3.193 N/A THR 265.A OG1 LEU 262.A O no hydrogen 3.460 N/A LEU 266.A N LEU 263.A O no hydrogen 3.159 N/A ASP 270.A N LYS 267.A O no hydrogen 3.102 N/A ILE 271.A N LYS 268.A O no hydrogen 3.138 N/A LEU 272.A N ALA 284.A O no hydrogen 2.943 N/A ILE 274.A N ALA 282.A O no hydrogen 2.870 N/A SER 276.A OG HIS 185.A NE2 no hydrogen 2.654 N/A VAL 278.A N SER 276.A OG no hydrogen 3.012 N/A GLY 279.A N SER 276.A O no hydrogen 3.104 N/A ALA 282.A N ILE 274.A O no hydrogen 2.905 N/A ARG 283.A N GLY 184.A O no hydrogen 2.968 N/A ARG 283.A NH1 PRO 180.A O no hydrogen 3.013 N/A ARG 283.A NH1 SER 182.A O no hydrogen 2.772 N/A ARG 283.A NH2 PRO 180.A O no hydrogen 3.039 N/A ALA 284.A N LEU 272.A O no hydrogen 2.882 N/A ILE 285.A N TYR 341.A O no hydrogen 2.918 N/A ASN 286.A N ASP 270.A O no hydrogen 2.744 N/A THR 287.A N ILE 285.A O no hydrogen 2.824 N/A VAL 289.A N GLY 339.A O no hydrogen 2.824 N/A ILE 290.A N THR 287.A O no hydrogen 3.304 N/A ARG 292.A N GLY 288.A O no hydrogen 3.114 N/A ARG 292.A NE GLU 295.A OE2 no hydrogen 3.428 N/A ARG 292.A NH1 GLU 295.A OE1 no hydrogen 2.882 N/A ARG 292.A NH2 GLU 337.A O no hydrogen 2.955 N/A ILE 293.A N VAL 289.A O no hydrogen 2.844 N/A GLU 294.A N ILE 290.A O no hydrogen 3.396 N/A GLU 295.A N LYS 291.A O no hydrogen 2.994 N/A GLU 295.A N ARG 292.A O no hydrogen 3.074 N/A GLY 296.A N ILE 293.A O no hydrogen 3.146 N/A ASN 297.A N ARG 292.A O no hydrogen 2.867 N/A LYS 300.A NZ ALA 298.A O no hydrogen 3.377 N/A SER 305.A OG PRO 71.A O no hydrogen 2.798 N/A ASN 306.A ND2 GLU 73.A OE1 no hydrogen 3.284 N/A ASN 306.A ND2 GLU 73.A OE2 no hydrogen 3.204 N/A ALA 309.A N ALA 106.A O no hydrogen 2.823 N/A ASN 312.A N ALA 309.A O no hydrogen 3.154 N/A GLU 316.A N CYS 311.A O no hydrogen 3.073 N/A LYS 318.A N GLY 314.A O no hydrogen 3.048 N/A LYS 318.A N GLU 315.A O no hydrogen 3.277 N/A LYS 318.A NZ GLY 314.A O no hydrogen 3.260 N/A LYS 319.A N GLU 315.A O no hydrogen 3.173 N/A VAL 320.A N GLU 316.A O no hydrogen 3.102 N/A VAL 320.A N ALA 317.A O no hydrogen 3.104 N/A GLY 321.A N ALA 317.A O no hydrogen 2.632 N/A TYR 322.A OH LYS 275.A O no hydrogen 2.360 N/A GLY 327.A N CYS 323.A O no hydrogen 2.893 N/A LEU 328.A N ILE 324.A O no hydrogen 2.927 N/A GLY 329.A N ALA 325.A O no hydrogen 2.942 N/A ARG 330.A N ASP 326.A O no hydrogen 2.862 N/A SER 331.A N GLY 327.A O no hydrogen 2.945 N/A SER 331.A OG GLY 327.A O no hydrogen 3.200 N/A SER 331.A OG LEU 340.A O no hydrogen 2.463 N/A TYR 332.A N LEU 328.A O no hydrogen 3.041 N/A LEU 333.A N GLY 329.A O no hydrogen 3.027 N/A GLY 334.A N SER 331.A O no hydrogen 2.801 N/A ASN 335.A N ARG 330.A O no hydrogen 2.856 N/A ASN 335.A ND2 GLU 338.A OE1 no hydrogen 3.382 N/A GLU 337.A N ASN 335.A OD1 no hydrogen 2.997 N/A GLU 338.A N ASN 335.A OD1 no hydrogen 2.799 N/A GLY 339.A N ASN 335.A O no hydrogen 2.989 N/A LEU 340.A N GLY 327.A O no hydrogen 3.002 N/A TYR 341.A OH ASN 335.A O no hydrogen 2.580 N/A PHE 342.A N TYR 259.A OH no hydrogen 2.852 N/A THR 343.A N ARG 283.A O no hydrogen 3.443 N/A THR 343.A OG1 GLY 344.A O no hydrogen 2.855 N/A ALA 345.A N LEU 181.A O no hydrogen 3.179 N/A ASN 346.A ND2 GLY 224.A O no hydrogen 2.990 N/A GLY 347.A N GLY 344.A O no hydrogen 2.966 N/A ARG 349.A N ASN 346.A O no hydrogen 2.911 N/A ARG 349.A NH1 ASN 346.A OD1 no hydrogen 3.484 N/A VAL 350.A N GLY 347.A O no hydrogen 3.099 N/A ILE 354.A N GLY 250.A O no hydrogen 3.400 N/A VAL 356.A N GLU 253.A OE1 no hydrogen 2.953 N/A HIS 357.A ND1 GLU 43.A OE1 no hydrogen 2.705 N/A GLU 358.A N SER 355.A OG no hydrogen 2.972 N/A LEU 359.A N SER 355.A O no hydrogen 2.875 N/A ILE 360.A N VAL 356.A O no hydrogen 2.892 N/A LYS 361.A N HIS 357.A O no hydrogen 3.287 N/A GLU 362.A N GLU 358.A O no hydrogen 3.233 N/A LEU 363.A N LEU 359.A O no hydrogen 3.013 N/A THR 364.A N ILE 360.A O no hydrogen 2.967 N/A THR 364.A N LYS 361.A O no hydrogen 3.064 N/A THR 364.A OG1 ILE 360.A O no hydrogen 2.633 N/A THR 364.A OG1 LYS 361.A O no hydrogen 3.509 N/A GLU 365.A N LYS 361.A O no hydrogen 3.160 N/A GLY 366.A N VAL 5.A O no hydrogen 3.061 N/A