Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bb5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 12.A N ASP 9.A O no hydrogen 2.708 N/A VAL 13.A N ASP 9.A O no hydrogen 3.433 N/A GLU 14.A N SER 10.A O no hydrogen 3.224 N/A LYS 15.A N HIS 11.A O no hydrogen 3.000 N/A LEU 16.A N LEU 12.A O no hydrogen 3.301 N/A GLY 17.A N VAL 13.A O no hydrogen 3.025 N/A GLN 18.A N GLU 14.A O no hydrogen 3.008 N/A HIS 19.A N LEU 16.A O no hydrogen 3.017 N/A LEU 20.A N GLY 17.A O no hydrogen 3.069 N/A LEU 21.A N GLY 17.A O no hydrogen 3.274 N/A TRP 23.A N LEU 20.A O no hydrogen 2.879 N/A MET 24.A N LEU 21.A O no hydrogen 3.365 N/A ARG 26.A N TRP 23.A O no hydrogen 3.105 N/A ARG 26.A NH1 PRO 22.A O no hydrogen 3.170 N/A GLU 30.A N SER 28.A OG no hydrogen 3.385 N/A HIS 31.A N SER 28.A O no hydrogen 2.765 N/A LEU 32.A N SER 28.A O no hydrogen 2.948 N/A ASN 33.A N TYR 54.A OH no hydrogen 2.781 N/A SER 35.A N ASN 33.A OD1 no hydrogen 3.114 N/A ILE 36.A N ASN 33.A O no hydrogen 3.004 N/A VAL 38.A N PRO 34.A O no hydrogen 3.090 N/A GLY 39.A N SER 35.A O no hydrogen 2.762 N/A LEU 40.A N ILE 36.A O no hydrogen 2.878 N/A ARG 41.A N TYR 37.A O no hydrogen 3.055 N/A ARG 41.A NH1 ASN 97.A OD1 no hydrogen 3.407 N/A LEU 42.A N VAL 38.A O no hydrogen 3.204 N/A SER 43.A N LEU 40.A O no hydrogen 2.743 N/A SER 43.A OG LEU 40.A O no hydrogen 2.559 N/A SER 43.A OG LEU 45.A O no hydrogen 2.873 N/A LEU 45.A N SER 43.A OG no hydrogen 3.072 N/A GLN 46.A N VAL 296.A O no hydrogen 2.955 N/A ALA 47.A N GLU 51.A OE2 no hydrogen 2.873 N/A LYS 50.A NZ ASP 25.A OD1 no hydrogen 2.752 N/A GLU 51.A N GLY 48.A O no hydrogen 3.222 N/A TYR 54.A N LYS 50.A O no hydrogen 2.924 N/A LEU 55.A N GLU 51.A O no hydrogen 2.921 N/A HIS 56.A N ASP 52.A O no hydrogen 2.975 N/A SER 57.A N LEU 53.A O no hydrogen 3.045 N/A SER 57.A OG LEU 53.A O no hydrogen 2.878 N/A LEU 58.A N TYR 54.A O no hydrogen 3.038 N/A LYS 59.A N LEU 55.A O no hydrogen 2.907 N/A LYS 59.A NZ GLU 99.A OE1 no hydrogen 3.493 N/A LYS 59.A NZ GLU 99.A OE2 no hydrogen 3.211 N/A LEU 60.A N HIS 56.A O no hydrogen 2.883 N/A GLY 61.A N SER 57.A O no hydrogen 2.783 N/A TYR 62.A N LEU 58.A O no hydrogen 2.914 N/A GLN 63.A N LYS 59.A O no hydrogen 3.251 N/A GLN 64.A N LEU 60.A O no hydrogen 2.745 N/A CYS 65.A N GLY 61.A O no hydrogen 3.024 N/A CYS 65.A SG GLY 61.A O no hydrogen 3.224 N/A LEU 66.A N TYR 62.A O no hydrogen 3.364 N/A LEU 67.A N GLN 63.A O no hydrogen 2.912 N/A SER 72.A OG PHE 71.A O no hydrogen 2.809 N/A GLN 79.A NE2 CYS 65.A O no hydrogen 3.231 N/A GLN 86.A N SER 83.A OG no hydrogen 2.833 N/A LEU 87.A N SER 83.A O no hydrogen 2.836 N/A ALA 88.A N MET 84.A O no hydrogen 3.058 N/A TYR 90.A N GLN 86.A O no hydrogen 3.066 N/A LEU 91.A N LEU 87.A O no hydrogen 3.095 N/A LEU 91.A N ALA 88.A O no hydrogen 3.117 N/A LEU 92.A N ALA 88.A O no hydrogen 3.387 N/A ALA 93.A N LEU 89.A O no hydrogen 2.984 N/A LEU 94.A N TYR 90.A O no hydrogen 2.991 N/A ARG 95.A N LEU 91.A O no hydrogen 3.132 N/A ARG 95.A NE LEU 286.A O no hydrogen 3.183 N/A ARG 95.A NH1 GLU 99.A O no hydrogen 3.237 N/A ARG 95.A NH2 LEU 286.A O no hydrogen 3.350 N/A ARG 95.A NH2 ILE 287.A O no hydrogen 2.920 N/A ALA 96.A N LEU 92.A O no hydrogen 2.874 N/A ASN 97.A N LEU 94.A O no hydrogen 2.967 N/A CYS 98.A N ARG 95.A O no hydrogen 2.722 N/A CYS 98.A SG PRO 289.A O no hydrogen 3.728 N/A GLU 99.A N LEU 94.A O no hydrogen 3.136 N/A VAL 101.A N HIS 149.A ND1 no hydrogen 3.209 N/A ASP 107.A N GLY 103.A O no hydrogen 3.095 N/A ARG 108.A N HIS 104.A O no hydrogen 2.666 N/A LEU 109.A N LYS 105.A O no hydrogen 3.060 N/A VAL 110.A N GLY 106.A O no hydrogen 3.007 N/A SER 111.A N ASP 107.A O no hydrogen 2.992 N/A GLN 112.A N ARG 108.A O no hydrogen 2.815 N/A GLN 112.A NE2 LEU 66.A O no hydrogen 3.439 N/A LEU 113.A N LEU 109.A O no hydrogen 2.961 N/A LYS 114.A N VAL 110.A O no hydrogen 2.984 N/A LYS 114.A NZ ARG 152.A O no hydrogen 3.123 N/A TRP 115.A N SER 111.A O no hydrogen 3.096 N/A PHE 116.A N GLN 112.A O no hydrogen 3.060 N/A LEU 117.A N LEU 113.A O no hydrogen 3.304 N/A GLU 118.A N LYS 114.A O no hydrogen 3.164 N/A ASP 119.A N TRP 115.A O no hydrogen 2.883 N/A GLU 120.A N PHE 116.A O no hydrogen 2.941 N/A LYS 121.A N GLU 118.A O no hydrogen 3.197 N/A LYS 121.A NZ GLU 118.A OE1 no hydrogen 2.572 N/A LYS 121.A NZ SER 156.A OG no hydrogen 3.024 N/A ARG 122.A N GLU 118.A O no hydrogen 3.127 N/A ALA 123.A N ASP 119.A O no hydrogen 2.829 N/A GLY 125.A N LYS 121.A O no hydrogen 3.185 N/A THR 134.A N GLU 120.A OE2 no hydrogen 2.886 N/A THR 134.A OG1 GLU 120.A OE2 no hydrogen 3.104 N/A TYR 139.A N SER 135.A O no hydrogen 3.044 N/A TYR 139.A OH VAL 157.A O no hydrogen 2.598 N/A GLY 140.A N TYR 136.A O no hydrogen 2.828 N/A LEU 141.A N TYR 137.A O no hydrogen 2.913 N/A GLY 142.A N GLN 138.A O no hydrogen 2.621 N/A ILE 143.A N TYR 139.A O no hydrogen 3.196 N/A LEU 144.A N GLY 140.A O no hydrogen 3.011 N/A ALA 145.A N LEU 141.A O no hydrogen 2.947 N/A LEU 146.A N GLY 142.A O no hydrogen 3.223 N/A CYS 147.A N ILE 143.A O no hydrogen 3.086 N/A LEU 148.A N LEU 144.A O no hydrogen 3.064 N/A LEU 148.A N ALA 145.A O no hydrogen 2.987 N/A HIS 149.A N LEU 146.A O no hydrogen 3.114 N/A HIS 149.A NE2 LEU 91.A O no hydrogen 2.694 N/A GLN 150.A N CYS 147.A O no hydrogen 3.405 N/A LYS 151.A N LEU 146.A O no hydrogen 2.849 N/A SER 156.A OG HIS 154.A ND1 no hydrogen 2.590 N/A VAL 157.A N HIS 154.A O no hydrogen 2.978 N/A VAL 158.A N HIS 154.A O no hydrogen 3.460 N/A ASP 159.A N ASP 155.A O no hydrogen 2.814 N/A LYS 160.A N VAL 157.A O no hydrogen 3.312 N/A LYS 160.A NZ HIS 126.A O no hydrogen 2.691 N/A LEU 162.A N VAL 158.A O no hydrogen 2.872 N/A TYR 163.A N ASP 159.A O no hydrogen 3.015 N/A ALA 164.A N LYS 160.A O no hydrogen 3.260 N/A VAL 165.A N LEU 162.A O no hydrogen 3.377 N/A SER 174.A N GLY 171.A O no hydrogen 3.213 N/A VAL 175.A N HIS 172.A O no hydrogen 3.234 N/A ASP 176.A N HIS 173.A O no hydrogen 2.714 N/A THR 177.A N HIS 173.A O no hydrogen 3.164 N/A THR 177.A OG1 HIS 173.A O no hydrogen 3.474 N/A ALA 178.A N SER 174.A O no hydrogen 2.796 N/A ALA 179.A N VAL 175.A O no hydrogen 3.196 N/A MET 180.A N ASP 176.A O no hydrogen 2.788 N/A ALA 181.A N THR 177.A O no hydrogen 2.816 N/A GLY 182.A N ALA 178.A O no hydrogen 2.627 N/A LEU 183.A N ALA 179.A O no hydrogen 2.808 N/A ALA 184.A N MET 180.A O no hydrogen 2.945 N/A PHE 185.A N ALA 181.A O no hydrogen 3.068 N/A THR 186.A N GLY 182.A O no hydrogen 3.089 N/A THR 186.A OG1 GLY 182.A O no hydrogen 3.145 N/A CYS 187.A N LEU 183.A O no hydrogen 3.012 N/A LEU 188.A N ALA 184.A O no hydrogen 3.062 N/A LYS 189.A N PHE 185.A O no hydrogen 2.799 N/A LYS 189.A NZ THR 202.A OG1 no hydrogen 3.099 N/A ARG 190.A N THR 186.A O no hydrogen 2.889 N/A ARG 190.A N CYS 187.A O no hydrogen 3.037 N/A SER 191.A N LEU 188.A O no hydrogen 3.214 N/A PHE 193.A N LEU 188.A O no hydrogen 3.126 N/A ASN 194.A ND2 VAL 153.A O no hydrogen 2.934 N/A ARG 197.A N ASN 194.A O no hydrogen 2.927 N/A ARG 197.A NE ASP 159.A OD1 no hydrogen 2.720 N/A ARG 197.A NH1 GLY 196.A O no hydrogen 3.163 N/A ARG 197.A NH2 ASP 159.A OD2 no hydrogen 3.323 N/A ARG 198.A N PRO 195.A O no hydrogen 2.701 N/A ARG 198.A NH1 LYS 189.A O no hydrogen 3.376 N/A ILE 201.A N ARG 197.A O no hydrogen 2.657 N/A THR 202.A N ARG 198.A O no hydrogen 3.243 N/A THR 202.A OG1 ARG 198.A O no hydrogen 3.282 N/A MET 203.A N GLN 199.A O no hydrogen 3.384 N/A ALA 204.A N ARG 200.A O no hydrogen 3.251 N/A ILE 205.A N ILE 201.A O no hydrogen 3.012 N/A ARG 206.A N THR 202.A O no hydrogen 3.114 N/A ARG 206.A NE GLU 210.A OE2 no hydrogen 3.368 N/A THR 207.A N MET 203.A O no hydrogen 2.791 N/A THR 207.A OG1 MET 203.A O no hydrogen 2.931 N/A VAL 208.A N ALA 204.A O no hydrogen 2.803 N/A ARG 209.A N ILE 205.A O no hydrogen 3.282 N/A ARG 209.A NH2 MET 240.A O no hydrogen 3.193 N/A GLU 211.A N THR 207.A O no hydrogen 3.130 N/A ILE 212.A N VAL 208.A O no hydrogen 2.844 N/A LEU 213.A N ARG 209.A O no hydrogen 2.707 N/A LYS 214.A N GLU 210.A O no hydrogen 2.723 N/A ALA 215.A N ILE 212.A O no hydrogen 2.778 N/A GLN 216.A NE2 GLY 220.A O no hydrogen 2.688 N/A GLN 216.A NE2 ALA 248.A O no hydrogen 2.771 N/A THR 217.A N HIS 221.A O no hydrogen 2.807 N/A THR 217.A OG1 GLU 219.A OE1 no hydrogen 3.194 N/A THR 217.A OG1 HIS 221.A O no hydrogen 3.502 N/A GLY 220.A N THR 217.A O no hydrogen 2.864 N/A HIS 221.A ND1 THR 228.A OG1 no hydrogen 3.053 N/A HIS 221.A NE2 SER 259.A OG no hydrogen 3.127 N/A PHE 222.A N THR 228.A OG1 no hydrogen 3.380 N/A GLY 223.A N ALA 215.A O no hydrogen 3.063 N/A ASN 224.A N PHE 222.A O no hydrogen 2.878 N/A TYR 226.A OH ALA 264.A O no hydrogen 2.594 N/A SER 227.A N ASN 224.A O no hydrogen 3.341 N/A SER 227.A N ASN 224.A OD1 no hydrogen 2.589 N/A SER 227.A OG ASP 176.A OD1 no hydrogen 2.555 N/A SER 227.A OG ASP 176.A OD2 no hydrogen 3.397 N/A SER 227.A OG ASN 224.A OD1 no hydrogen 2.939 N/A THR 228.A OG1 HIS 221.A ND1 no hydrogen 3.053 N/A THR 228.A OG1 ASN 224.A O no hydrogen 2.565 N/A THR 228.A OG1 VAL 225.A O no hydrogen 3.451 N/A ALA 231.A N SER 227.A O no hydrogen 3.155 N/A LEU 232.A N THR 228.A O no hydrogen 2.797 N/A GLN 233.A N PRO 229.A O no hydrogen 2.827 N/A GLN 233.A NE2 GLN 273.A O no hydrogen 3.222 N/A PHE 234.A N LEU 230.A O no hydrogen 3.118 N/A LEU 235.A N ALA 231.A O no hydrogen 2.926 N/A MET 236.A N LEU 232.A O no hydrogen 2.851 N/A THR 237.A N PHE 234.A O no hydrogen 3.112 N/A THR 237.A OG1 PHE 234.A O no hydrogen 2.616 N/A ALA 248.A N GLU 244.A O no hydrogen 3.297 N/A CYS 249.A N LEU 245.A O no hydrogen 2.670 N/A LEU 250.A N GLY 246.A O no hydrogen 3.009 N/A LYS 251.A N THR 247.A O no hydrogen 2.748 N/A ALA 252.A N ALA 248.A O no hydrogen 3.146 N/A ARG 253.A N CYS 249.A O no hydrogen 3.362 N/A ARG 253.A NH1 GLU 7.A O no hydrogen 3.195 N/A ALA 255.A N LYS 251.A O no hydrogen 3.107 N/A LEU 256.A N ALA 252.A O no hydrogen 2.733 N/A LEU 257.A N ARG 253.A O no hydrogen 2.704 N/A ALA 258.A N VAL 254.A O no hydrogen 2.955 N/A SER 259.A N ALA 255.A O no hydrogen 3.332 N/A SER 259.A OG HIS 221.A NE2 no hydrogen 3.127 N/A SER 259.A OG ALA 255.A O no hydrogen 3.001 N/A LEU 260.A N LEU 256.A O no hydrogen 2.746 N/A GLN 261.A N LEU 257.A O no hydrogen 3.140 N/A ASP 262.A N SER 259.A O no hydrogen 3.090 N/A GLY 263.A N LEU 260.A O no hydrogen 3.221 N/A ALA 264.A N SER 259.A O no hydrogen 3.044 N/A ASN 267.A ND2 SER 359.A O no hydrogen 3.076 N/A MET 270.A N ASN 267.A OD1 no hydrogen 3.202 N/A ILE 271.A N ASN 267.A O no hydrogen 2.940 N/A SER 272.A N ALA 268.A O no hydrogen 3.076 N/A SER 272.A OG ALA 268.A O no hydrogen 3.243 N/A SER 272.A OG LEU 269.A O no hydrogen 2.367 N/A GLN 273.A N MET 270.A O no hydrogen 3.377 N/A GLN 273.A NE2 TYR 137.A OH no hydrogen 3.497 N/A LEU 274.A N MET 270.A O no hydrogen 3.305 N/A LEU 274.A N ILE 271.A O no hydrogen 3.241 N/A LEU 275.A N ILE 271.A O no hydrogen 2.910 N/A LEU 278.A N LEU 274.A O no hydrogen 2.788 N/A ASN 279.A N PRO 276.A O no hydrogen 2.904 N/A ASN 279.A ND2 LEU 42.A O no hydrogen 3.094 N/A HIS 280.A N VAL 277.A O no hydrogen 2.827 N/A LYS 281.A N PRO 276.A O no hydrogen 2.662 N/A THR 282.A N ASP 285.A OD2 no hydrogen 2.653 N/A THR 282.A OG1 ASP 285.A OD2 no hydrogen 3.124 N/A ILE 284.A N THR 282.A OG1 no hydrogen 3.159 N/A ASP 285.A N THR 282.A O no hydrogen 3.263 N/A LEU 286.A N TYR 283.A O no hydrogen 3.190 N/A ILE 287.A N ILE 284.A O no hydrogen 3.037 N/A CYS 291.A SG ALA 96.A O no hydrogen 3.883 N/A LEU 292.A N ASP 290.A OD1 no hydrogen 2.907 N/A ALA 293.A N ASP 290.A OD1 no hydrogen 2.655 N/A ARG 295.A NH1 LEU 45.A O no hydrogen 2.919 N/A ARG 295.A NH1 GLU 51.A OE2 no hydrogen 2.912 N/A ARG 295.A NH2 GLU 51.A OE1 no hydrogen 2.664 N/A ARG 295.A NH2 GLU 51.A OE2 no hydrogen 3.174 N/A VAL 296.A N SER 44.A O no hydrogen 3.053 N/A GLN 307.A NE2 ALA 333.A O no hydrogen 3.318 N/A ILE 312.A N VAL 331.A O no hydrogen 2.887 N/A SER 313.A N ASP 398.A OD1 no hydrogen 2.890 N/A SER 313.A OG SER 328.A OG no hydrogen 3.059 N/A VAL 314.A N ILE 329.A O no hydrogen 2.752 N/A THR 315.A N GLU 400.A O no hydrogen 2.856 N/A LEU 316.A N GLN 327.A O no hydrogen 3.174 N/A GLN 317.A N ILE 402.A O no hydrogen 2.787 N/A VAL 318.A N TYR 325.A O no hydrogen 2.654 N/A TYR 325.A N VAL 318.A O no hydrogen 2.915 N/A GLN 327.A N LEU 316.A O no hydrogen 2.967 N/A SER 328.A OG SER 313.A OG no hydrogen 3.059 N/A ILE 329.A N VAL 314.A O no hydrogen 2.858 N/A VAL 331.A N ILE 312.A O no hydrogen 3.017 N/A ALA 333.A N GLU 310.A O no hydrogen 3.009 N/A SER 335.A N LEU 332.A O no hydrogen 3.161 N/A SER 335.A OG LEU 332.A O no hydrogen 2.270 N/A THR 336.A N ASP 339.A OD2 no hydrogen 2.607 N/A THR 336.A OG1 ILE 391.A O no hydrogen 2.648 N/A THR 336.A OG1 TYR 394.A O no hydrogen 3.204 N/A VAL 337.A N TYR 394.A O no hydrogen 2.998 N/A GLU 338.A N ILE 391.A O no hydrogen 2.703 N/A ASP 339.A N THR 336.A O no hydrogen 2.839 N/A VAL 340.A N THR 336.A O no hydrogen 3.266 N/A LEU 341.A N VAL 337.A O no hydrogen 2.816 N/A LYS 342.A N GLU 338.A O no hydrogen 2.678 N/A LYS 343.A N ASP 339.A O no hydrogen 2.806 N/A ALA 344.A N VAL 340.A O no hydrogen 3.072 N/A HIS 345.A N LEU 341.A O no hydrogen 3.228 N/A GLU 346.A N LYS 342.A O no hydrogen 3.374 N/A LEU 347.A N LYS 343.A O no hydrogen 2.754 N/A GLY 348.A N ALA 344.A O no hydrogen 3.057 N/A PHE 350.A N GLY 348.A O no hydrogen 3.052 N/A GLU 353.A N SER 365.A O no hydrogen 2.845 N/A GLN 355.A N TYR 362.A O no hydrogen 2.766 N/A SER 357.A OG GLY 360.A O no hydrogen 2.501 N/A GLY 360.A N SER 357.A O no hydrogen 2.680 N/A TYR 362.A N GLN 355.A O no hydrogen 2.700 N/A THR 364.A N GLU 353.A O no hydrogen 2.867 N/A THR 364.A OG1 GLU 353.A O no hydrogen 3.059 N/A SER 365.A N GLU 353.A O no hydrogen 3.222 N/A VAL 366.A N LYS 369.A O no hydrogen 3.229 N/A MET 367.A N THR 351.A O no hydrogen 2.987 N/A LYS 369.A N VAL 366.A O no hydrogen 2.856 N/A ALA 371.A N THR 364.A O no hydrogen 2.824 N/A ARG 374.A NE TRP 409.A O no hydrogen 3.207 N/A ARG 374.A NE TRP 409.A OXT no hydrogen 3.283 N/A ARG 374.A NH2 TRP 409.A OXT no hydrogen 3.142 N/A PHE 376.A N VAL 407.A O no hydrogen 2.888 N/A TRP 377.A NE1 LYS 369.A O no hydrogen 2.841 N/A GLN 378.A N ARG 405.A O no hydrogen 2.554 N/A LEU 380.A N GLU 403.A O no hydrogen 2.985 N/A ARG 381.A N THR 385.A O no hydrogen 2.843 N/A ASP 382.A N THR 401.A O no hydrogen 3.056 N/A THR 385.A N ARG 381.A O no hydrogen 3.195 N/A THR 385.A OG1 ARG 381.A O no hydrogen 2.775 N/A LEU 387.A N LEU 379.A O no hydrogen 2.849 N/A ASP 393.A N GLY 390.A O no hydrogen 2.833 N/A TYR 394.A N GLY 390.A O no hydrogen 3.032 N/A TYR 394.A OH GLU 400.A OE1 no hydrogen 2.472 N/A TYR 394.A OH GLU 400.A OE2 no hydrogen 3.264 N/A LYS 397.A N GLU 400.A OE2 no hydrogen 3.220 N/A GLY 399.A N SER 313.A O no hydrogen 2.654 N/A GLU 400.A N LYS 397.A O no hydrogen 3.273 N/A ILE 402.A N THR 315.A O no hydrogen 2.818 N/A GLU 403.A N LEU 380.A O no hydrogen 2.952 N/A LEU 404.A N GLN 317.A O no hydrogen 3.196 N/A ARG 405.A N GLN 378.A O no hydrogen 2.929 N/A ARG 405.A NE GLU 403.A OE2 no hydrogen 3.505 N/A ARG 405.A NH2 ASN 384.A OD1 no hydrogen 2.599 N/A ARG 405.A NH2 GLU 403.A OE1 no hydrogen 2.832 N/A LEU 406.A N SER 320.A OG no hydrogen 3.429 N/A VAL 407.A N PHE 376.A O no hydrogen 3.205 N/A TRP 409.A N ARG 374.A O no hydrogen 2.685 N/A