Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2i69_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A N ASP 42.A OD2 no hydrogen 2.852 N/A CYS 3.A SG THR 32.A OG1 no hydrogen 3.477 N/A MET 6.A N CYS 3.A O no hydrogen 3.020 N/A ARG 9.A NE THR 32.A OG1 no hydrogen 3.245 N/A ARG 9.A NH1 GLU 374.A OE2 no hydrogen 2.697 N/A ARG 9.A NH2 THR 32.A OG1 no hydrogen 3.178 N/A ARG 9.A NH2 GLU 374.A OE1 no hydrogen 2.768 N/A ARG 9.A NH2 GLU 374.A OE2 no hydrogen 3.330 N/A ASP 10.A N CYS 30.A O no hydrogen 2.890 N/A LEU 12.A N THR 32.A O no hydrogen 2.795 N/A GLY 14.A N MET 34.A O no hydrogen 3.145 N/A VAL 21.A N VAL 290.A O no hydrogen 3.003 N/A LEU 23.A N CYS 288.A O no hydrogen 2.804 N/A LEU 25.A N LEU 286.A O no hydrogen 2.651 N/A SER 29.A OG GLU 26.A O no hydrogen 3.192 N/A CYS 30.A N ASN 8.A O no hydrogen 2.939 N/A CYS 30.A SG VAL 43.A O no hydrogen 3.710 N/A VAL 31.A N VAL 43.A O no hydrogen 2.753 N/A THR 32.A N ASP 10.A O no hydrogen 2.922 N/A THR 32.A OG1 ASP 42.A OD1 no hydrogen 2.959 N/A ILE 33.A N ILE 41.A O no hydrogen 2.752 N/A MET 34.A N LEU 12.A O no hydrogen 2.760 N/A LYS 36.A NZ SER 16.A OG no hydrogen 3.377 N/A LYS 38.A N SER 35.A O no hydrogen 3.160 N/A LYS 38.A NZ LEU 295.A O no hydrogen 2.827 N/A THR 40.A OG1 VAL 356.A O no hydrogen 2.577 N/A ILE 41.A N ILE 33.A O no hydrogen 3.263 N/A ASP 42.A N PHE 142.A O no hydrogen 2.874 N/A VAL 43.A N VAL 31.A O no hydrogen 2.561 N/A LYS 44.A N ALA 140.A O no hydrogen 2.935 N/A MET 45.A N SER 29.A O no hydrogen 3.336 N/A MET 46.A N GLU 138.A O no hydrogen 2.702 N/A GLU 49.A N LYS 136.A O no hydrogen 2.817 N/A ALA 50.A N VAL 279.A O no hydrogen 3.167 N/A ALA 51.A N ASN 134.A O no hydrogen 2.988 N/A VAL 56.A N GLY 127.A O no hydrogen 3.040 N/A ARG 57.A NE TYR 59.A OH no hydrogen 3.160 N/A ARG 57.A NH2 TYR 59.A OH no hydrogen 3.422 N/A SER 58.A OG GLU 55.A OE1 no hydrogen 2.982 N/A SER 58.A OG ARG 57.A O no hydrogen 2.569 N/A TYR 59.A N ALA 125.A O no hydrogen 2.971 N/A TYR 59.A OH PHE 218.A O no hydrogen 2.756 N/A CYS 60.A N PRO 224.A O no hydrogen 2.842 N/A CYS 60.A SG LEU 62.A O no hydrogen 3.527 N/A CYS 60.A SG THR 123.A O no hydrogen 3.952 N/A TYR 61.A N THR 123.A O no hydrogen 3.058 N/A LEU 62.A N THR 123.A O no hydrogen 3.508 N/A THR 64.A N ALA 120.A O no hydrogen 2.754 N/A SER 66.A N LYS 118.A O no hydrogen 2.903 N/A SER 66.A OG ASP 67.A OD2 no hydrogen 2.998 N/A SER 69.A N CYS 116.A O no hydrogen 2.958 N/A THR 70.A OG1 THR 115.A OG1 no hydrogen 3.370 N/A LYS 71.A N ASP 114.A O no hydrogen 3.090 N/A ALA 73.A N SER 112.A O no hydrogen 2.893 N/A THR 76.A OG1 PRO 75.A O no hydrogen 2.757 N/A MET 77.A N CYS 74.A O no hydrogen 3.011 N/A ALA 80.A N SER 112.A OG no hydrogen 2.958 N/A ASN 82.A N ASP 114.A OD1 no hydrogen 2.814 N/A ASN 82.A ND2 SER 69.A OG no hydrogen 2.730 N/A ASN 82.A ND2 ASP 114.A O no hydrogen 2.916 N/A LYS 84.A N ASN 82.A OD1 no hydrogen 3.379 N/A ARG 85.A N ASN 82.A O no hydrogen 3.181 N/A ARG 85.A NE ASP 114.A OD1 no hydrogen 3.432 N/A ARG 85.A NH2 ASP 114.A OD1 no hydrogen 3.416 N/A ARG 85.A NH2 ASP 114.A OD2 no hydrogen 2.614 N/A ALA 86.A N ASP 83.A O no hydrogen 3.062 N/A ASP 87.A N LYS 84.A O no hydrogen 3.127 N/A ALA 89.A N ASP 87.A OD1 no hydrogen 3.387 N/A PHE 90.A N ASP 87.A O no hydrogen 3.191 N/A VAL 91.A N ALA 117.A O no hydrogen 2.833 N/A ARG 93.A N THR 115.A O no hydrogen 2.918 N/A GLY 95.A N ILE 113.A O no hydrogen 2.813 N/A VAL 97.A N GLY 111.A O no hydrogen 2.982 N/A ARG 99.A N GLY 109.A O no hydrogen 2.838 N/A ARG 99.A NE ASN 103.A OD1 no hydrogen 2.892 N/A ARG 99.A NH2 ASN 103.A O no hydrogen 2.951 N/A ASN 103.A N GLY 100.A O no hydrogen 2.614 N/A GLY 104.A N TRP 101.A O no hydrogen 3.488 N/A GLY 109.A N ARG 99.A O no hydrogen 3.202 N/A LYS 110.A NZ ASP 98.A OD1 no hydrogen 2.797 N/A GLY 111.A N VAL 97.A O no hydrogen 2.791 N/A SER 112.A N ALA 73.A O no hydrogen 2.780 N/A ASP 114.A N LYS 71.A O no hydrogen 2.865 N/A THR 115.A N ARG 93.A O no hydrogen 2.936 N/A THR 115.A OG1 THR 70.A OG1 no hydrogen 3.370 N/A THR 115.A OG1 GLN 250.A OE1 no hydrogen 2.561 N/A CYS 116.A N SER 69.A O no hydrogen 3.064 N/A ALA 117.A N VAL 91.A O no hydrogen 3.163 N/A LYS 118.A N SER 66.A O no hydrogen 2.621 N/A PHE 119.A N ALA 89.A O no hydrogen 3.243 N/A ALA 120.A N THR 64.A O no hydrogen 2.811 N/A CYS 121.A SG THR 123.A O no hydrogen 3.409 N/A SER 122.A N LEU 62.A O no hydrogen 2.750 N/A SER 122.A OG THR 64.A OG1 no hydrogen 3.355 N/A ALA 125.A N TYR 59.A O no hydrogen 2.809 N/A ILE 126.A N THR 205.A O no hydrogen 3.391 N/A ARG 128.A N VAL 203.A O no hydrogen 2.560 N/A ARG 128.A NH1 THR 205.A OG1 no hydrogen 3.373 N/A THR 129.A N ALA 54.A O no hydrogen 3.023 N/A THR 129.A OG1 ASN 199.A OD1 no hydrogen 3.127 N/A LYS 132.A NZ ILE 196.A O no hydrogen 2.460 N/A ASN 134.A N LEU 131.A O no hydrogen 3.258 N/A ILE 135.A N LYS 132.A O no hydrogen 3.099 N/A LYS 136.A N GLU 49.A O no hydrogen 2.866 N/A TYR 137.A N ILE 169.A O no hydrogen 2.834 N/A GLU 138.A N ASN 47.A O no hydrogen 2.651 N/A VAL 139.A N PHE 167.A O no hydrogen 2.739 N/A ALA 140.A N LYS 44.A O no hydrogen 2.784 N/A ILE 141.A N GLY 165.A O no hydrogen 2.706 N/A PHE 142.A N ASP 42.A O no hydrogen 3.183 N/A VAL 143.A N GLN 163.A O no hydrogen 2.701 N/A HIS 144.A N THR 40.A O no hydrogen 2.826 N/A HIS 144.A NE2 ASP 42.A OD1 no hydrogen 2.643 N/A THR 147.A OG1 HIS 152.A ND1 no hydrogen 2.762 N/A THR 148.A N SER 151.A OG no hydrogen 3.201 N/A VAL 149.A N GLU 326.A OE2 no hydrogen 3.184 N/A SER 151.A N THR 148.A O no hydrogen 2.762 N/A SER 151.A OG GLN 158.A OE1 no hydrogen 3.229 N/A HIS 152.A N THR 148.A O no hydrogen 2.668 N/A GLN 158.A N ASN 154.A O no hydrogen 3.246 N/A GLN 158.A NE2 GLN 163.A OE1 no hydrogen 3.225 N/A VAL 159.A N TYR 155.A O no hydrogen 3.103 N/A GLY 160.A N SER 156.A O no hydrogen 2.903 N/A ALA 161.A N THR 157.A O no hydrogen 2.916 N/A THR 162.A N VAL 159.A O no hydrogen 2.960 N/A GLN 163.A N GLN 158.A O no hydrogen 3.013 N/A ALA 164.A N GLN 158.A O no hydrogen 3.356 N/A PHE 167.A N VAL 139.A O no hydrogen 2.885 N/A ILE 169.A N TYR 137.A O no hydrogen 2.725 N/A THR 170.A N ALA 173.A O no hydrogen 3.292 N/A ALA 173.A N THR 170.A OG1 no hydrogen 3.252 N/A SER 175.A OG VAL 188.A O no hydrogen 3.068 N/A TYR 176.A N VAL 188.A O no hydrogen 2.823 N/A THR 177.A OG1 THR 187.A OG1 no hydrogen 2.875 N/A LEU 178.A N VAL 186.A O no hydrogen 2.760 N/A LYS 179.A NZ GLU 185.A OE1 no hydrogen 3.461 N/A LEU 180.A N GLY 184.A O no hydrogen 2.772 N/A TYR 183.A N LEU 180.A O no hydrogen 3.087 N/A GLY 184.A N GLY 181.A O no hydrogen 3.149 N/A GLU 185.A N LYS 294.A O no hydrogen 2.913 N/A VAL 186.A N LEU 178.A O no hydrogen 3.021 N/A THR 187.A N LYS 291.A O no hydrogen 3.267 N/A THR 187.A OG1 THR 177.A OG1 no hydrogen 2.875 N/A VAL 188.A N TYR 176.A O no hydrogen 2.551 N/A ASP 189.A N ARG 289.A O no hydrogen 2.956 N/A CYS 190.A N PRO 174.A O no hydrogen 3.047 N/A GLU 191.A N LYS 287.A O no hydrogen 3.050 N/A ARG 193.A NH1 PRO 192.A O no hydrogen 3.495 N/A SER 194.A OG HIS 285.A O no hydrogen 2.712 N/A TYR 202.A N VAL 213.A O no hydrogen 2.985 N/A VAL 203.A N ARG 128.A O no hydrogen 2.917 N/A MET 204.A N PHE 211.A O no hydrogen 2.925 N/A THR 205.A N ILE 126.A O no hydrogen 2.801 N/A VAL 206.A N LYS 209.A O no hydrogen 3.033 N/A PHE 211.A N MET 204.A O no hydrogen 2.817 N/A LEU 212.A N ILE 270.A O no hydrogen 2.784 N/A VAL 213.A N TYR 202.A O no hydrogen 2.788 N/A ARG 215.A NH1 ASN 199.A O no hydrogen 3.357 N/A TRP 217.A N HIS 214.A O no hydrogen 2.818 N/A PHE 218.A N HIS 214.A O no hydrogen 3.140 N/A MET 219.A N ARG 215.A O no hydrogen 3.335 N/A ASP 220.A N TRP 217.A O no hydrogen 3.204 N/A LEU 221.A N PHE 218.A O no hydrogen 3.294 N/A ASN 222.A ND2 ASN 222.A O no hydrogen 2.893 N/A LEU 223.A N LEU 221.A O no hydrogen 2.913 N/A TRP 225.A N ARG 234.A O no hydrogen 2.932 N/A SER 226.A OG SER 230.A O no hydrogen 3.306 N/A ARG 234.A N TRP 225.A O no hydrogen 2.844 N/A ARG 234.A NH2 SER 227.A OG no hydrogen 2.729 N/A ASN 235.A ND2 LEU 223.A O no hydrogen 3.131 N/A ARG 236.A NH1 PRO 88.A O no hydrogen 3.197 N/A ARG 236.A NH2 PRO 88.A O no hydrogen 3.499 N/A THR 238.A OG1 ASN 235.A O no hydrogen 3.307 N/A THR 238.A OG1 ARG 236.A O no hydrogen 3.525 N/A LEU 239.A N ARG 236.A O no hydrogen 2.784 N/A GLU 241.A N ILE 253.A O no hydrogen 3.204 N/A GLU 243.A N SER 251.A O no hydrogen 2.716 N/A GLN 250.A NE2 GLU 243.A O no hydrogen 2.882 N/A SER 251.A OG GLU 243.A OE1 no hydrogen 2.475 N/A ILE 253.A N GLU 241.A O no hydrogen 3.143 N/A LEU 255.A N LEU 239.A O no hydrogen 2.918 N/A GLN 258.A NE2 GLY 256.A O no hydrogen 3.244 N/A GLU 259.A N SER 257.A OG no hydrogen 3.177 N/A LEU 262.A N GLN 258.A O no hydrogen 3.054 N/A LEU 262.A N GLU 259.A O no hydrogen 3.289 N/A HIS 263.A N GLU 259.A O no hydrogen 3.072 N/A GLN 264.A N GLY 260.A O no hydrogen 3.113 N/A GLN 264.A NE2 ALA 261.A O no hydrogen 3.513 N/A ALA 265.A N ALA 261.A O no hydrogen 3.011 N/A ALA 267.A N GLN 264.A O no hydrogen 3.007 N/A ALA 269.A N LEU 266.A O no hydrogen 3.154 N/A VAL 272.A N THR 210.A O no hydrogen 2.848 N/A SER 275.A OG GLU 273.A OE1 no hydrogen 3.204 N/A VAL 279.A N ALA 50.A O no hydrogen 2.957 N/A LEU 281.A N MET 48.A O no hydrogen 3.123 N/A LEU 286.A N LEU 25.A O no hydrogen 2.989 N/A CYS 288.A N LEU 23.A O no hydrogen 2.768 N/A ARG 289.A N ASP 189.A O no hydrogen 2.713 N/A ARG 289.A NE ASP 22.A OD1 no hydrogen 2.754 N/A ARG 289.A NH2 ASP 22.A OD1 no hydrogen 3.299 N/A ARG 289.A NH2 ASP 22.A OD2 no hydrogen 2.799 N/A VAL 290.A N VAL 21.A O no hydrogen 2.684 N/A LYS 291.A N THR 187.A O no hydrogen 2.813 N/A LYS 291.A NZ ASP 189.A OD1 no hydrogen 2.882 N/A LEU 295.A N MET 292.A O no hydrogen 3.008 N/A GLN 296.A N TYR 183.A O no hydrogen 2.728 N/A GLN 296.A NE2 LYS 294.A O no hydrogen 3.063 N/A CYS 305.A N LYS 337.A O no hydrogen 2.909 N/A CYS 305.A SG LYS 337.A O no hydrogen 3.312 N/A SER 306.A N ASP 333.A OD2 no hydrogen 3.265 N/A SER 306.A OG ASP 333.A OD2 no hydrogen 3.050 N/A LYS 307.A N TYR 329.A OH no hydrogen 3.010 N/A LYS 310.A N GLN 328.A O no hydrogen 2.866 N/A LYS 310.A NZ GLN 328.A OE1 no hydrogen 3.251 N/A LEU 312.A N GLU 326.A O no hydrogen 3.167 N/A ALA 316.A N VAL 324.A O no hydrogen 2.775 N/A THR 318.A N THR 322.A O no hydrogen 3.059 N/A THR 318.A OG1 THR 322.A O no hydrogen 3.023 N/A THR 318.A OG1 THR 322.A OG1 no hydrogen 2.720 N/A GLY 319.A N ASP 317.A OD2 no hydrogen 2.908 N/A HIS 320.A N THR 318.A OG1 no hydrogen 3.041 N/A HIS 320.A NE2 MET 6.A O no hydrogen 2.708 N/A THR 322.A OG1 THR 318.A OG1 no hydrogen 2.720 N/A THR 322.A OG1 GLU 374.A OE2 no hydrogen 2.727 N/A VAL 323.A N LEU 375.A O no hydrogen 2.694 N/A VAL 324.A N ALA 316.A O no hydrogen 2.809 N/A LEU 325.A N ILE 373.A O no hydrogen 2.921 N/A LEU 327.A N VAL 371.A O no hydrogen 2.829 N/A GLN 328.A N LYS 310.A O no hydrogen 2.991 N/A GLN 328.A NE2 ASN 368.A O no hydrogen 2.809 N/A TYR 329.A N ALA 369.A O no hydrogen 2.790 N/A TYR 329.A OH ASP 333.A OD1 no hydrogen 2.361 N/A TYR 329.A OH ASP 333.A OD2 no hydrogen 3.234 N/A THR 330.A N ALA 308.A O no hydrogen 3.146 N/A THR 330.A OG1 ALA 308.A O no hydrogen 2.512 N/A ASP 333.A N ASP 333.A OD1 no hydrogen 2.625 N/A GLY 334.A N THR 332.A O no hydrogen 2.881 N/A CYS 336.A N VAL 362.A O no hydrogen 2.931 N/A LYS 337.A N GLY 303.A O no hydrogen 2.920 N/A LYS 337.A NZ THR 300.A O no hydrogen 3.053 N/A VAL 338.A N PRO 360.A O no hydrogen 3.106 N/A ILE 340.A N VAL 338.A O no hydrogen 2.825 N/A SER 341.A N VAL 385.A O no hydrogen 3.102 N/A VAL 343.A N TYR 383.A O no hydrogen 2.912 N/A SER 345.A N ASP 348.A OD1 no hydrogen 3.165 N/A ASP 348.A N SER 345.A O no hydrogen 2.883 N/A VAL 352.A N SER 342.A O no hydrogen 2.600 N/A ARG 354.A N GLU 376.A O no hydrogen 3.176 N/A VAL 356.A N GLU 374.A O no hydrogen 2.805 N/A THR 357.A N GLU 374.A O no hydrogen 2.919 N/A VAL 358.A N VAL 356.A O no hydrogen 2.633 N/A VAL 362.A N CYS 336.A O no hydrogen 2.833 N/A VAL 371.A N LEU 327.A O no hydrogen 3.198 N/A LEU 372.A N THR 147.A O no hydrogen 3.115 N/A ILE 373.A N LEU 325.A O no hydrogen 2.827 N/A GLU 374.A N THR 357.A OG1 no hydrogen 3.025 N/A LEU 375.A N VAL 323.A O no hydrogen 2.807 N/A GLU 376.A N ARG 354.A O no hydrogen 2.770 N/A GLY 380.A N LYS 399.A O no hydrogen 2.958 N/A SER 382.A N TRP 397.A O no hydrogen 2.925 N/A TYR 383.A N VAL 343.A O no hydrogen 2.893 N/A ILE 384.A N HIS 395.A O no hydrogen 2.621 N/A VAL 385.A N SER 341.A O no hydrogen 2.922 N/A VAL 386.A N ILE 393.A O no hydrogen 3.248 N/A GLY 387.A N PRO 339.A O no hydrogen 3.031 N/A GLN 391.A NE2 SER 306.A O no hydrogen 3.488 N/A GLN 392.A N GLY 389.A O no hydrogen 2.939 N/A GLN 392.A NE2 GLY 387.A O no hydrogen 2.585 N/A ILE 393.A N VAL 386.A O no hydrogen 3.089 N/A HIS 395.A N ILE 384.A O no hydrogen 2.911 N/A HIS 395.A ND1 HIS 396.A O no hydrogen 2.845 N/A TRP 397.A N SER 382.A O no hydrogen 2.737 N/A LYS 399.A N GLY 380.A O no hydrogen 2.993 N/A LYS 399.A NZ GLY 321.A O no hydrogen 3.229 N/A LYS 399.A NZ PRO 377.A O no hydrogen 3.198 N/A