Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8kd5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH2 ILE 287.A O no hydrogen 3.131 N/A ARG 4.A NE LYS 122.A O no hydrogen 3.375 N/A ALA 6.A N VAL 125.A O no hydrogen 2.883 N/A TYR 7.A N GLU 46.A O no hydrogen 3.400 N/A PHE 8.A N VAL 127.A O no hydrogen 2.925 N/A ASP 12.A N ASP 10.A OD1 no hydrogen 3.089 N/A VAL 13.A N ASP 10.A O no hydrogen 3.432 N/A ASN 15.A N ASP 12.A O no hydrogen 3.235 N/A TYR 18.A OH PHE 144.A O no hydrogen 3.294 N/A LYS 25.A NZ HIS 22.A O no hydrogen 3.229 N/A ARG 28.A NE GLY 295.A O no hydrogen 3.495 N/A ARG 28.A NH1 LYS 25.A O no hydrogen 2.382 N/A ARG 28.A NH2 GLY 295.A O no hydrogen 3.362 N/A ALA 32.A N ARG 28.A O no hydrogen 2.959 N/A HIS 33.A N ILE 29.A O no hydrogen 2.916 N/A SER 34.A N ARG 30.A O no hydrogen 2.895 N/A SER 34.A OG GLU 326.A OE1 no hydrogen 2.830 N/A SER 34.A OG GLU 326.A OE2 no hydrogen 3.231 N/A SER 34.A OG ALA 386.A O no hydrogen 3.460 N/A LEU 35.A N MET 31.A O no hydrogen 2.860 N/A ILE 36.A N ALA 32.A O no hydrogen 2.930 N/A MET 37.A N HIS 33.A O no hydrogen 2.912 N/A ASN 38.A N SER 34.A O no hydrogen 2.883 N/A ASN 38.A ND2 SER 34.A O no hydrogen 2.513 N/A ASN 38.A ND2 ALA 386.A O no hydrogen 3.309 N/A TYR 39.A N LEU 35.A O no hydrogen 3.130 N/A GLY 40.A N MET 37.A O no hydrogen 3.293 N/A TYR 48.A N TYR 7.A O no hydrogen 3.062 N/A ARG 49.A N THR 379.A O no hydrogen 3.121 N/A ARG 49.A NE ASP 10.A OD1 no hydrogen 3.158 N/A ARG 49.A NH2 ASP 10.A OD1 no hydrogen 3.160 N/A LYS 51.A NZ PRO 52.A O no hydrogen 3.375 N/A LYS 51.A NZ ASP 372.A OD1 no hydrogen 3.049 N/A ALA 53.A N SER 105.A O no hydrogen 2.931 N/A THR 54.A OG1 GLU 57.A OE2 no hydrogen 2.723 N/A MET 58.A N LYS 55.A O no hydrogen 3.433 N/A CYS 59.A N GLN 56.A O no hydrogen 3.316 N/A CYS 59.A SG HIS 62.A O no hydrogen 3.300 N/A CYS 59.A SG ASP 64.A OD1 no hydrogen 3.396 N/A GLN 60.A N GLN 60.A OE1 no hydrogen 2.562 N/A GLN 60.A NE2 GLU 57.A O no hydrogen 3.095 N/A THR 63.A OG1 SER 139.A OG no hydrogen 2.864 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.399 N/A TYR 66.A OH TYR 146.A O no hydrogen 2.363 N/A ILE 67.A N THR 63.A O no hydrogen 3.390 N/A ASP 68.A N ASP 64.A O no hydrogen 2.922 N/A PHE 69.A N GLU 65.A O no hydrogen 2.851 N/A LEU 70.A N TYR 66.A O no hydrogen 2.912 N/A SER 71.A N ILE 67.A O no hydrogen 2.888 N/A SER 71.A OG ILE 67.A O no hydrogen 3.250 N/A SER 71.A OG ASP 68.A O no hydrogen 2.748 N/A ARG 72.A N ASP 68.A O no hydrogen 2.933 N/A ARG 72.A NE ASP 68.A OD1 no hydrogen 2.939 N/A ARG 72.A NE ASP 68.A OD2 no hydrogen 2.828 N/A ARG 72.A NH2 ASP 68.A OD2 no hydrogen 2.692 N/A THR 74.A OG1 VAL 73.A O no hydrogen 2.763 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.641 N/A SER 85.A OG VAL 90.A O no hydrogen 2.418 N/A ASN 89.A ND2 GLU 140.A OE2 no hydrogen 2.820 N/A VAL 90.A N SER 85.A O no hydrogen 2.463 N/A GLY 91.A N CYS 94.A O no hydrogen 2.557 N/A CYS 94.A SG ALA 141.A O no hydrogen 3.620 N/A GLU 102.A N GLU 102.A OE2 no hydrogen 2.631 N/A TYR 103.A N GLY 99.A O no hydrogen 2.860 N/A CYS 104.A N LEU 100.A O no hydrogen 2.935 N/A CYS 104.A SG LEU 100.A O no hydrogen 3.343 N/A SER 105.A N TYR 101.A O no hydrogen 2.908 N/A SER 105.A OG TYR 101.A O no hydrogen 3.296 N/A SER 105.A OG GLU 102.A O no hydrogen 2.682 N/A ILE 106.A N GLU 102.A O no hydrogen 2.895 N/A SER 107.A N TYR 103.A O no hydrogen 2.937 N/A SER 107.A OG ASP 149.A OD2 no hydrogen 2.566 N/A GLY 108.A N CYS 104.A O no hydrogen 2.918 N/A GLY 109.A N SER 105.A O no hydrogen 2.884 N/A GLY 110.A N ILE 106.A O no hydrogen 2.928 N/A SER 111.A N SER 107.A O no hydrogen 2.952 N/A SER 111.A OG ASP 149.A O no hydrogen 3.510 N/A SER 111.A OG ASP 149.A OD2 no hydrogen 2.773 N/A MET 112.A N GLY 108.A O no hydrogen 2.932 N/A GLU 113.A N GLY 109.A O no hydrogen 2.864 N/A GLY 114.A N GLY 110.A O no hydrogen 2.939 N/A ALA 115.A N SER 111.A O no hydrogen 2.977 N/A ALA 116.A N MET 112.A O no hydrogen 2.848 N/A ARG 117.A N GLU 113.A O no hydrogen 2.904 N/A LEU 118.A N GLY 114.A O no hydrogen 2.941 N/A ASN 119.A N ALA 115.A O no hydrogen 2.895 N/A ASN 119.A ND2 GLU 156.A O no hydrogen 2.585 N/A ARG 120.A N ALA 116.A O no hydrogen 2.902 N/A GLY 121.A N ARG 117.A O no hydrogen 3.421 N/A CYS 123.A SG GLU 46.A OE2 no hydrogen 3.253 N/A ASP 124.A N ARG 4.A O no hydrogen 3.232 N/A VAL 125.A N ARG 4.A O no hydrogen 3.419 N/A ALA 126.A N MET 289.A O no hydrogen 2.839 N/A VAL 127.A N ALA 6.A O no hydrogen 2.840 N/A ASN 128.A N VAL 291.A O no hydrogen 2.659 N/A ASN 128.A ND2 SER 107.A O no hydrogen 3.634 N/A TYR 129.A OH TRP 306.A O no hydrogen 3.058 N/A TYR 129.A OH THR 310.A OG1 no hydrogen 3.275 N/A HIS 134.A ND1 TYR 166.A OH no hydrogen 3.231 N/A HIS 135.A NE2 HIS 172.A O no hydrogen 2.487 N/A LYS 137.A N GLU 140.A O no hydrogen 2.774 N/A LYS 137.A NZ GLU 179.A OE1 no hydrogen 2.514 N/A LYS 138.A NZ PHE 61.A O no hydrogen 2.782 N/A SER 139.A OG THR 63.A OG1 no hydrogen 2.864 N/A ALA 141.A N PHE 88.A O no hydrogen 2.713 N/A SER 142.A OG HIS 135.A O no hydrogen 2.710 N/A CYS 145.A N SER 142.A O no hydrogen 2.893 N/A CYS 145.A SG GLY 143.A O no hydrogen 3.213 N/A ASN 148.A N HIS 62.A NE2 no hydrogen 3.393 N/A ASN 148.A ND2 ALA 136.A O no hydrogen 2.844 N/A VAL 151.A N ASN 148.A OD1 no hydrogen 3.241 N/A GLY 153.A N ASP 149.A O no hydrogen 2.910 N/A ILE 154.A N ILE 150.A O no hydrogen 2.865 N/A ILE 155.A N VAL 151.A O no hydrogen 2.940 N/A GLU 156.A N LEU 152.A O no hydrogen 2.920 N/A LEU 157.A N GLY 153.A O no hydrogen 2.897 N/A LEU 158.A N ILE 154.A O no hydrogen 2.858 N/A ARG 159.A N ILE 155.A O no hydrogen 2.950 N/A ARG 159.A N GLU 156.A O no hydrogen 3.307 N/A ARG 159.A NH1 GLU 156.A OE1 no hydrogen 2.519 N/A TYR 160.A N LEU 157.A O no hydrogen 3.021 N/A HIS 161.A N LEU 157.A O no hydrogen 2.500 N/A VAL 164.A N ARG 186.A O no hydrogen 3.237 N/A LEU 165.A N ALA 250.A O no hydrogen 2.938 N/A TYR 166.A N MET 188.A O no hydrogen 3.072 N/A ILE 167.A N VAL 252.A O no hydrogen 2.628 N/A ASP 168.A N CYS 190.A O no hydrogen 2.926 N/A HIS 172.A ND1 ASP 258.A OD2 no hydrogen 3.346 N/A ASP 175.A N ASP 175.A OD2 no hydrogen 2.417 N/A GLU 179.A N ASP 175.A O no hydrogen 2.905 N/A ALA 180.A N GLY 176.A O no hydrogen 2.867 N/A PHE 181.A N VAL 177.A O no hydrogen 2.922 N/A PHE 181.A N GLU 178.A O no hydrogen 3.269 N/A TYR 182.A OH ASP 207.A OD2 no hydrogen 2.675 N/A ARG 186.A NE PRO 162.A O no hydrogen 3.082 N/A ARG 186.A NH2 PRO 162.A O no hydrogen 3.164 N/A MET 188.A N VAL 164.A O no hydrogen 3.241 N/A THR 189.A N TYR 216.A O no hydrogen 3.163 N/A CYS 190.A N TYR 166.A O no hydrogen 2.798 N/A SER 191.A N VAL 218.A O no hydrogen 3.030 N/A SER 191.A OG ASP 168.A OD2 no hydrogen 3.271 N/A SER 191.A OG HIS 193.A ND1 no hydrogen 3.418 N/A PHE 192.A N ASP 168.A O no hydrogen 2.732 N/A HIS 193.A N VAL 220.A O no hydrogen 3.263 N/A LYS 194.A NZ TYR 195.A O no hydrogen 2.493 N/A LYS 194.A NZ GLY 196.A O no hydrogen 3.444 N/A TYR 195.A N LEU 222.A O no hydrogen 3.356 N/A TYR 195.A OH GLY 201.A O no hydrogen 3.262 N/A TYR 195.A OH GLU 204.A OE2 no hydrogen 2.493 N/A THR 202.A OG1 PRO 200.A O no hydrogen 3.184 N/A ASP 207.A N GLU 204.A O no hydrogen 3.158 N/A GLY 213.A N VAL 210.A O no hydrogen 3.231 N/A LYS 214.A N GLY 211.A O no hydrogen 3.345 N/A TYR 216.A N ILE 208.A O no hydrogen 3.074 N/A TYR 216.A N GLY 213.A O no hydrogen 3.271 N/A TYR 216.A OH ASP 185.A OD2 no hydrogen 3.150 N/A VAL 218.A N THR 189.A O no hydrogen 2.497 N/A VAL 220.A N SER 191.A O no hydrogen 3.150 N/A LEU 222.A N HIS 193.A O no hydrogen 2.539 N/A ARG 223.A N ASN 348.A OD1 no hydrogen 2.904 N/A ARG 223.A NH1 VAL 347.A O no hydrogen 3.305 N/A GLY 225.A N CYS 267.A O no hydrogen 3.020 N/A ASP 227.A N ASP 227.A OD2 no hydrogen 2.491 N/A THR 230.A OG1 ASP 227.A OD2 no hydrogen 2.998 N/A TYR 231.A N ASP 227.A O no hydrogen 3.228 N/A ARG 232.A N ASP 228.A O no hydrogen 2.874 N/A SER 233.A N ALA 229.A O no hydrogen 2.939 N/A SER 233.A OG THR 230.A O no hydrogen 2.759 N/A VAL 234.A N THR 230.A O no hydrogen 2.892 N/A PHE 235.A N ARG 232.A O no hydrogen 3.217 N/A GLU 236.A N ARG 232.A O no hydrogen 2.945 N/A ILE 239.A N PHE 235.A O no hydrogen 2.858 N/A LYS 240.A N GLU 236.A O no hydrogen 2.935 N/A LYS 241.A N PRO 237.A O no hydrogen 2.911 N/A ILE 242.A N VAL 238.A O no hydrogen 2.897 N/A MET 243.A N ILE 239.A O no hydrogen 2.949 N/A GLU 244.A N LYS 240.A O no hydrogen 2.895 N/A TRP 245.A N LYS 241.A O no hydrogen 2.921 N/A TYR 246.A N ILE 242.A O no hydrogen 2.814 N/A TYR 246.A OH VAL 164.A O no hydrogen 3.252 N/A SER 249.A N ARG 163.A O no hydrogen 2.997 N/A VAL 251.A N PRO 288.A O no hydrogen 3.128 N/A VAL 252.A N LEU 165.A O no hydrogen 2.710 N/A LEU 253.A N MET 290.A O no hydrogen 2.665 N/A GLN 254.A N ILE 167.A O no hydrogen 2.981 N/A GLN 254.A NE2 GLY 132.A O no hydrogen 2.635 N/A SER 259.A OG ILE 169.A O no hydrogen 3.449 N/A LEU 260.A N GLY 257.A O no hydrogen 3.263 N/A SER 261.A OG ARG 340.A O no hydrogen 3.063 N/A ASN 269.A N ILE 226.A O no hydrogen 3.221 N/A ASN 269.A ND2 SER 342.A O no hydrogen 2.732 N/A SER 271.A N ASP 228.A OD1 no hydrogen 3.108 N/A SER 271.A OG ASP 228.A OD2 no hydrogen 2.919 N/A GLY 274.A N SER 271.A OG no hydrogen 3.316 N/A HIS 275.A N SER 271.A O no hydrogen 2.967 N/A ALA 276.A N GLU 273.A O no hydrogen 3.323 N/A ASN 277.A N GLU 273.A O no hydrogen 2.870 N/A CYS 278.A SG GLY 274.A O no hydrogen 3.275 N/A ASN 280.A N ALA 276.A O no hydrogen 2.928 N/A TYR 281.A N ASN 277.A O no hydrogen 2.864 N/A TYR 281.A OH GLU 236.A O no hydrogen 3.412 N/A VAL 282.A N CYS 278.A O no hydrogen 2.975 N/A LYS 283.A N VAL 279.A O no hydrogen 2.891 N/A LYS 283.A NZ ASN 280.A OD1 no hydrogen 3.217 N/A LYS 283.A NZ LEU 312.A O no hydrogen 3.128 N/A LYS 283.A NZ ASN 315.A OD1 no hydrogen 2.870 N/A SER 284.A N ASN 280.A O no hydrogen 2.916 N/A SER 284.A N TYR 281.A O no hydrogen 3.247 N/A SER 284.A OG ASN 280.A O no hydrogen 2.667 N/A PHE 285.A N VAL 282.A O no hydrogen 3.387 N/A GLY 286.A N LYS 283.A O no hydrogen 3.280 N/A MET 289.A N ASP 124.A O no hydrogen 3.107 N/A MET 290.A N VAL 251.A O no hydrogen 2.488 N/A VAL 291.A N ALA 126.A O no hydrogen 2.497 N/A VAL 292.A N LEU 253.A O no hydrogen 2.883 N/A GLY 293.A N ASN 128.A O no hydrogen 3.362 N/A TYR 297.A N ASP 263.A OD1 no hydrogen 3.358 N/A TYR 297.A OH HIS 172.A ND1 no hydrogen 3.191 N/A THR 298.A OG1 ASN 301.A OD1 no hydrogen 3.049 N/A ARG 300.A NE TYR 330.A O no hydrogen 2.761 N/A ALA 303.A N MET 299.A O no hydrogen 2.998 N/A THR 305.A N ASN 301.A O no hydrogen 2.928 N/A THR 305.A OG1 GLU 309.A OE2 no hydrogen 3.260 N/A TRP 306.A N VAL 302.A O no hydrogen 2.902 N/A CYS 307.A N ALA 303.A O no hydrogen 2.961 N/A CYS 307.A SG LEU 35.A O no hydrogen 4.029 N/A PHE 308.A N ARG 304.A O no hydrogen 2.932 N/A GLU 309.A N THR 305.A O no hydrogen 2.914 N/A THR 310.A N TRP 306.A O no hydrogen 2.958 N/A THR 310.A OG1 TYR 129.A OH no hydrogen 3.275 N/A THR 310.A OG1 TRP 306.A O no hydrogen 2.539 N/A GLY 311.A N CYS 307.A O no hydrogen 2.878 N/A LEU 312.A N PHE 308.A O no hydrogen 2.957 N/A LEU 313.A N GLU 309.A O no hydrogen 2.885 N/A ASN 314.A N THR 310.A O no hydrogen 2.950 N/A ASN 314.A ND2 LEU 41.A O no hydrogen 3.473 N/A ASN 315.A N LEU 312.A O no hydrogen 3.135 N/A VAL 316.A N GLY 311.A O no hydrogen 3.234 N/A LYS 320.A NZ GLU 273.A OE2 no hydrogen 3.145 N/A ASN 325.A ND2 TYR 331.A OH no hydrogen 2.786 N/A GLU 326.A N GLU 326.A OE1 no hydrogen 2.350 N/A TYR 328.A OH LEU 322.A O no hydrogen 3.319 N/A TYR 330.A N TYR 327.A O no hydrogen 3.524 N/A TYR 335.A N GLY 332.A O no hydrogen 3.034 N/A LYS 336.A NZ ASP 321.A OD1 no hydrogen 3.155 N/A LEU 337.A N LYS 320.A O no hydrogen 3.094 N/A ARG 340.A NH1 ASP 334.A OD2 no hydrogen 3.128 N/A SER 342.A N ASN 269.A OD1 no hydrogen 2.883 N/A SER 342.A OG ASN 269.A OD1 no hydrogen 2.369 N/A VAL 347.A N ASP 224.A O no hydrogen 3.441 N/A TYR 352.A N THR 349.A OG1 no hydrogen 3.208 N/A TYR 352.A OH PRO 221.A O no hydrogen 2.827 N/A LEU 353.A N THR 349.A O no hydrogen 3.356 N/A ASP 354.A N PRO 350.A O no hydrogen 2.896 N/A LYS 355.A N GLU 351.A O no hydrogen 2.889 N/A VAL 356.A N TYR 352.A O no hydrogen 2.953 N/A MET 357.A N LEU 353.A O no hydrogen 2.878 N/A THR 358.A N ASP 354.A O no hydrogen 2.892 N/A THR 358.A OG1 ASP 354.A O no hydrogen 3.285 N/A THR 358.A OG1 LYS 355.A O no hydrogen 2.609 N/A ASN 359.A N LYS 355.A O no hydrogen 2.961 N/A ILE 360.A N VAL 356.A O no hydrogen 2.909 N/A PHE 361.A N MET 357.A O no hydrogen 2.906 N/A ALA 362.A N THR 358.A O no hydrogen 2.903 N/A ASN 363.A N ASN 359.A O no hydrogen 2.933 N/A ASN 363.A ND2 LEU 205.A O no hydrogen 3.645 N/A LEU 364.A N ILE 360.A O no hydrogen 2.870 N/A GLU 365.A N PHE 361.A O no hydrogen 2.922 N/A THR 367.A N LEU 364.A O no hydrogen 3.112 N/A THR 367.A OG1 LEU 364.A O no hydrogen 2.392 N/A ASP 372.A N VAL 369.A O no hydrogen 2.834 N/A SER 373.A N GLU 370.A O no hydrogen 3.337 N/A SER 373.A OG GLU 370.A OE2 no hydrogen 3.266 N/A LYS 377.A N GLU 113.A OE2 no hydrogen 2.933 N/A THR 379.A N ARG 49.A O no hydrogen 3.098 N/A THR 379.A OG1 ARG 49.A O no hydrogen 3.335 N/A GLN 384.A NE2 GLY 381.A O no hydrogen 2.767 N/A ARG 387.A NE TYR 42.A OH no hydrogen 2.891 N/A ASP 388.A N ASN 38.A OD1 no hydrogen 2.662 N/A