Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1lwe_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLU 1.A OE1 no hydrogen 2.536 N/A VAL 5.A N ASP 110.A OD2 no hydrogen 3.457 N/A LYS 6.A N GLN 80.A OE1 no hydrogen 2.538 N/A LYS 8.A N ARG 78.A O no hydrogen 2.984 N/A LYS 8.A NZ LYS 77.A O no hydrogen 2.849 N/A MET 11.A N LYS 8.A O no hydrogen 3.249 N/A GLN 18.A NE2 TRP 19.A O no hydrogen 2.809 N/A GLN 18.A NE2 VAL 55.A O no hydrogen 2.976 N/A THR 22.A OG1 GLU 24.A OE2 no hydrogen 3.440 N/A LYS 25.A NZ THR 22.A OG1 no hydrogen 3.283 N/A LYS 25.A NZ GLU 377.A OE1 no hydrogen 3.273 N/A LYS 25.A NZ GLU 377.A OE2 no hydrogen 3.329 N/A ILE 26.A N THR 22.A O no hydrogen 3.071 N/A ILE 26.A N GLU 23.A O no hydrogen 2.610 N/A LYS 27.A N GLU 23.A O no hydrogen 3.093 N/A ALA 28.A N GLU 24.A O no hydrogen 3.374 N/A VAL 30.A N ILE 26.A O no hydrogen 3.084 N/A VAL 30.A N LYS 27.A O no hydrogen 2.939 N/A GLU 31.A N LYS 27.A O no hydrogen 3.126 N/A ILE 32.A N ALA 28.A O no hydrogen 3.000 N/A CYS 33.A N LEU 29.A O no hydrogen 2.727 N/A THR 34.A N VAL 30.A O no hydrogen 2.797 N/A THR 34.A OG1 VAL 30.A O no hydrogen 3.056 N/A GLU 35.A N GLU 31.A O no hydrogen 3.253 N/A LEU 36.A N ILE 32.A O no hydrogen 3.360 N/A GLU 37.A N CYS 33.A O no hydrogen 3.187 N/A GLU 37.A N THR 34.A O no hydrogen 2.714 N/A LYS 38.A N THR 34.A O no hydrogen 3.031 N/A GLU 39.A N GLU 35.A O no hydrogen 3.125 N/A GLY 40.A N GLU 37.A O no hydrogen 2.684 N/A LYS 41.A N LEU 36.A O no hydrogen 2.805 N/A ILE 42.A N LEU 36.A O no hydrogen 3.463 N/A SER 43.A N GLN 134.A O no hydrogen 3.350 N/A SER 43.A OG ASN 136.A OD1 no hydrogen 2.487 N/A ILE 45.A N ARG 132.A O no hydrogen 3.118 N/A GLU 48.A N GLU 48.A OE1 no hydrogen 2.450 N/A ASN 49.A N GLY 46.A O no hydrogen 3.071 N/A TYR 51.A OH ASP 12.A OD1 no hydrogen 2.793 N/A ASN 52.A N PRO 14.A O no hydrogen 3.025 N/A THR 53.A N ALA 118.A O no hydrogen 3.133 N/A VAL 55.A N GLN 18.A OE1 no hydrogen 3.121 N/A PHE 56.A N LEU 69.A O no hydrogen 2.901 N/A ILE 58.A N ARG 67.A O no hydrogen 3.091 N/A LYS 59.A NZ THR 64.A O no hydrogen 3.221 N/A SER 63.A OG ASP 62.A O no hydrogen 2.942 N/A ARG 67.A N ILE 58.A O no hydrogen 2.796 N/A ARG 67.A NE ASP 99.A OD1 no hydrogen 3.399 N/A ARG 67.A NH1 LYS 68.A O no hydrogen 3.127 N/A ARG 67.A NH2 ASP 174.A OD1 no hydrogen 3.568 N/A LYS 68.A NZ TYR 135.A OH no hydrogen 2.531 N/A LEU 69.A N PHE 56.A O no hydrogen 2.981 N/A ASP 71.A N PRO 54.A O no hydrogen 2.912 N/A PHE 72.A N VAL 70.A O no hydrogen 3.117 N/A ARG 73.A N ASP 71.A OD2 no hydrogen 3.123 N/A ARG 73.A NE ASP 71.A OD1 no hydrogen 3.339 N/A ARG 73.A NE ASP 71.A OD2 no hydrogen 3.083 N/A ARG 73.A NH1 PRO 385.A O no hydrogen 2.832 N/A ARG 73.A NH2 ASP 71.A OD1 no hydrogen 2.931 N/A ASN 76.A N PHE 72.A O no hydrogen 2.768 N/A ASN 76.A ND2 GLY 141.A O no hydrogen 3.256 N/A LYS 77.A N ARG 73.A O no hydrogen 3.352 N/A LYS 77.A NZ GLU 74.A OE1 no hydrogen 3.356 N/A ARG 78.A N GLU 74.A O no hydrogen 3.375 N/A ARG 78.A N LEU 75.A O no hydrogen 3.121 N/A ARG 78.A NE GLU 74.A OE2 no hydrogen 3.567 N/A ARG 78.A NH1 ASP 12.A O no hydrogen 3.246 N/A ARG 78.A NH2 GLU 74.A OE2 no hydrogen 3.433 N/A THR 79.A N ASN 76.A O no hydrogen 3.285 N/A THR 79.A OG1 LEU 75.A O no hydrogen 2.751 N/A GLN 80.A N LYS 6.A O no hydrogen 2.931 N/A GLN 80.A NE2 ASP 81.A O no hydrogen 3.406 N/A LYS 92.A N LEU 89.A O no hydrogen 3.014 N/A LYS 92.A NZ ASP 166.A O no hydrogen 3.143 N/A LYS 92.A NZ ASP 181.A OD1 no hydrogen 2.947 N/A LYS 93.A N SER 180.A O no hydrogen 3.293 N/A LYS 93.A NZ ASP 181.A OD2 no hydrogen 3.461 N/A SER 94.A N SER 180.A O no hydrogen 3.245 N/A SER 94.A OG LYS 93.A O no hydrogen 2.660 N/A THR 96.A N VAL 178.A O no hydrogen 3.093 N/A THR 96.A OG1 HIS 187.A NE2 no hydrogen 3.373 N/A THR 96.A OG1 GLU 206.A OE2 no hydrogen 2.617 N/A LEU 98.A N LEU 176.A O no hydrogen 3.156 N/A VAL 100.A N ASP 174.A O no hydrogen 2.743 N/A GLY 101.A N ASP 99.A OD2 no hydrogen 2.932 N/A ALA 103.A N VAL 100.A O no hydrogen 3.155 N/A TYR 104.A N GLY 101.A O no hydrogen 3.224 N/A TYR 104.A OH MET 173.A O no hydrogen 2.924 N/A PHE 105.A N ASP 102.A O no hydrogen 2.630 N/A SER 106.A N ALA 103.A O no hydrogen 3.308 N/A SER 106.A OG ALA 103.A O no hydrogen 2.533 N/A VAL 107.A N TYR 104.A O no hydrogen 3.187 N/A LEU 109.A N ASN 136.A O no hydrogen 3.123 N/A PHE 113.A N ASP 110.A O no hydrogen 2.781 N/A ARG 114.A NE ASN 136.A O no hydrogen 3.387 N/A ARG 114.A NH2 ASN 136.A O no hydrogen 3.226 N/A LYS 115.A NZ TYR 116.A OH no hydrogen 3.126 N/A TYR 116.A N PHE 113.A O no hydrogen 3.188 N/A THR 117.A N ARG 114.A O no hydrogen 3.030 N/A THR 117.A OG1 ARG 114.A O no hydrogen 3.507 N/A ALA 118.A N LYS 115.A O no hydrogen 3.042 N/A PHE 119.A N TYR 133.A O no hydrogen 2.988 N/A ILE 121.A N ILE 131.A O no hydrogen 2.922 N/A SER 123.A OG THR 128.A O no hydrogen 2.636 N/A ASN 126.A N SER 123.A O no hydrogen 3.356 N/A GLU 127.A N ILE 124.A O no hydrogen 3.217 N/A THR 128.A N SER 123.A OG no hydrogen 3.057 N/A ILE 131.A N ILE 121.A O no hydrogen 2.990 N/A ARG 132.A NH1 TYR 51.A O no hydrogen 2.683 N/A ARG 132.A NH2 TYR 51.A O no hydrogen 3.229 N/A TYR 133.A N PHE 119.A O no hydrogen 3.185 N/A GLN 134.A N SER 43.A O no hydrogen 3.146 N/A TYR 135.A N THR 117.A OG1 no hydrogen 2.796 N/A ASN 136.A N LYS 41.A O no hydrogen 2.792 N/A LEU 138.A N VAL 107.A O no hydrogen 2.761 N/A GLY 141.A N ASP 174.A OD2 no hydrogen 3.460 N/A TRP 142.A N PRO 139.A O no hydrogen 3.427 N/A TRP 142.A NE1 THR 79.A OG1 no hydrogen 3.227 N/A LYS 143.A N ASN 76.A OD1 no hydrogen 2.780 N/A LYS 143.A NZ ASN 76.A O no hydrogen 3.324 N/A LYS 143.A NZ THR 79.A O no hydrogen 2.785 N/A LYS 143.A NZ GLN 80.A O no hydrogen 2.915 N/A SER 145.A OG PRO 139.A O no hydrogen 2.877 N/A ILE 148.A N GLY 144.A O no hydrogen 3.033 N/A PHE 149.A N SER 145.A O no hydrogen 3.000 N/A THR 154.A N GLN 150.A O no hydrogen 2.882 N/A THR 154.A OG1 SER 151.A O no hydrogen 3.534 N/A ILE 156.A N SER 152.A O no hydrogen 3.136 N/A ILE 156.A N MET 153.A O no hydrogen 3.146 N/A LEU 157.A N MET 153.A O no hydrogen 2.947 N/A ARG 161.A N LEU 157.A O no hydrogen 3.102 N/A LYS 162.A N GLU 158.A O no hydrogen 3.298 N/A GLN 163.A N PRO 159.A O no hydrogen 2.892 N/A ASN 164.A N PHE 160.A O no hydrogen 2.930 N/A VAL 168.A N GLY 179.A O no hydrogen 2.890 N/A TYR 170.A N TYR 177.A O no hydrogen 2.660 N/A TYR 170.A OH GLY 357.A O no hydrogen 3.390 N/A GLN 171.A NE2 MET 173.A O no hydrogen 3.127 N/A TYR 172.A N ASP 175.A O no hydrogen 2.760 N/A ASP 175.A N TYR 172.A O no hydrogen 2.738 N/A LEU 176.A N LEU 98.A O no hydrogen 2.848 N/A TYR 177.A N TYR 170.A O no hydrogen 2.520 N/A VAL 178.A N THR 96.A O no hydrogen 3.318 N/A GLY 179.A N VAL 168.A O no hydrogen 2.755 N/A SER 180.A N SER 94.A O no hydrogen 3.244 N/A SER 180.A OG HIS 187.A ND1 no hydrogen 2.442 N/A GLY 185.A N GLU 183.A O no hydrogen 2.478 N/A HIS 187.A ND1 SER 180.A OG no hydrogen 2.442 N/A LYS 190.A NZ GLU 193.A OE1 no hydrogen 3.217 N/A LYS 190.A NZ GLU 193.A OE2 no hydrogen 2.513 N/A ILE 191.A N HIS 187.A O no hydrogen 3.174 N/A GLU 192.A N ARG 188.A O no hydrogen 3.505 N/A GLU 193.A N THR 189.A O no hydrogen 2.702 N/A LEU 194.A N LYS 190.A O no hydrogen 3.227 N/A ARG 195.A N ILE 191.A O no hydrogen 2.877 N/A GLN 196.A N GLU 192.A O no hydrogen 2.937 N/A GLN 196.A N GLU 193.A O no hydrogen 3.254 N/A HIS 197.A N GLU 193.A O no hydrogen 3.005 N/A HIS 197.A NE2 ILE 156.A O no hydrogen 2.874 N/A LEU 198.A N LEU 194.A O no hydrogen 2.575 N/A LEU 199.A N ARG 195.A O no hydrogen 3.212 N/A ARG 200.A N HIS 197.A O no hydrogen 3.131 N/A TRP 201.A N LEU 198.A O no hydrogen 3.485 N/A GLY 202.A N LEU 198.A O no hydrogen 3.100 N/A LEU 207.A N VAL 95.A O no hydrogen 2.842 N/A LYS 211.A N HIS 208.A O no hydrogen 3.457 N/A LYS 211.A NZ HIS 208.A O no hydrogen 3.077 N/A TRP 212.A N PRO 209.A O no hydrogen 3.042 N/A LYS 222.A NZ ASP 229.A OD1 no hydrogen 3.334 N/A VAL 227.A N GLU 264.A O no hydrogen 3.310 N/A ASN 228.A N LEU 262.A O no hydrogen 3.140 N/A ASP 229.A N THR 226.A OG1 no hydrogen 3.163 N/A ILE 230.A N THR 226.A O no hydrogen 2.872 N/A GLN 231.A N VAL 227.A O no hydrogen 2.853 N/A LYS 232.A N ASN 228.A O no hydrogen 2.930 N/A LEU 233.A N ASP 229.A O no hydrogen 3.098 N/A VAL 234.A N ILE 230.A O no hydrogen 2.934 N/A GLY 235.A N GLN 231.A O no hydrogen 2.920 N/A LYS 236.A N LYS 232.A O no hydrogen 3.159 N/A LYS 236.A NZ VAL 218.A O no hydrogen 3.079 N/A LYS 236.A NZ TRP 399.A O no hydrogen 3.147 N/A LEU 237.A N LEU 233.A O no hydrogen 2.819 N/A ASN 238.A N VAL 234.A O no hydrogen 2.771 N/A TRP 239.A N GLY 235.A O no hydrogen 3.173 N/A ALA 240.A N LYS 236.A O no hydrogen 3.109 N/A SER 241.A N LEU 237.A O no hydrogen 2.974 N/A SER 241.A N ASN 238.A O no hydrogen 3.041 N/A SER 241.A OG ASN 238.A O no hydrogen 2.349 N/A GLN 242.A N TRP 239.A O no hydrogen 2.768 N/A TYR 244.A N ALA 240.A O no hydrogen 2.987 N/A TYR 244.A OH GLU 285.A O no hydrogen 2.747 N/A ILE 247.A N TYR 244.A O no hydrogen 3.261 N/A LYS 248.A N ASN 279.A OD1 no hydrogen 3.047 N/A GLN 251.A N GLU 275.A OE1 no hydrogen 2.594 N/A LEU 252.A N GLU 275.A OE2 no hydrogen 3.138 N/A CYS 253.A N VAL 249.A O no hydrogen 3.204 N/A LYS 254.A N ARG 250.A O no hydrogen 3.217 N/A LEU 256.A N CYS 253.A O no hydrogen 2.816 N/A ARG 257.A N LYS 254.A O no hydrogen 3.302 N/A ILE 266.A N TRP 225.A O no hydrogen 2.908 N/A GLU 271.A N THR 269.A OG1 no hydrogen 3.244 N/A ALA 272.A N THR 269.A OG1 no hydrogen 2.917 N/A GLU 273.A N THR 269.A O no hydrogen 3.253 N/A LEU 274.A N GLU 270.A O no hydrogen 3.343 N/A GLU 275.A N GLU 271.A O no hydrogen 3.074 N/A LEU 276.A N ALA 272.A O no hydrogen 2.960 N/A ALA 277.A N GLU 273.A O no hydrogen 2.961 N/A GLU 278.A N LEU 274.A O no hydrogen 2.739 N/A ASN 279.A N GLU 275.A O no hydrogen 2.823 N/A ASN 279.A ND2 LYS 248.A O no hydrogen 2.641 N/A ARG 280.A N LEU 276.A O no hydrogen 2.739 N/A ARG 280.A NH2 PRO 220.A O no hydrogen 3.555 N/A GLU 281.A N ALA 277.A O no hydrogen 2.873 N/A ILE 282.A N GLU 278.A O no hydrogen 2.857 N/A ILE 282.A N ASN 279.A O no hydrogen 3.093 N/A LEU 283.A N ASN 279.A O no hydrogen 3.276 N/A LEU 283.A N ARG 280.A O no hydrogen 3.240 N/A LYS 284.A NZ GLU 281.A OE1 no hydrogen 3.190 N/A ASP 293.A N GLN 316.A OE1 no hydrogen 2.683 N/A SER 295.A N ASP 293.A OD1 no hydrogen 2.977 N/A SER 295.A OG ASP 293.A OD1 no hydrogen 3.038 N/A LYS 296.A NZ GLU 317.A OE2 no hydrogen 3.002 N/A ILE 299.A N TYR 315.A O no hydrogen 3.000 N/A ALA 300.A N LYS 361.A O no hydrogen 3.254 N/A GLU 301.A N GLN 313.A O no hydrogen 3.300 N/A GLN 303.A N THR 311.A O no hydrogen 2.912 N/A GLN 303.A NE2 GLN 313.A OE1 no hydrogen 3.125 N/A LYS 304.A NZ ASP 337.A OD1 no hydrogen 2.967 N/A GLN 305.A N GLN 309.A O no hydrogen 2.895 N/A GLN 309.A N GLY 306.A O no hydrogen 2.999 N/A TRP 310.A N TYR 327.A O no hydrogen 3.075 N/A TRP 310.A NE1 GLN 340.A OE1 no hydrogen 3.145 N/A THR 311.A N GLN 303.A O no hydrogen 3.026 N/A THR 311.A OG1 GLN 303.A OE1 no hydrogen 2.604 N/A TYR 312.A N GLY 325.A O no hydrogen 2.910 N/A GLN 313.A N GLU 301.A O no hydrogen 3.128 N/A GLN 313.A NE2 GLN 303.A OE1 no hydrogen 2.606 N/A ILE 314.A N LYS 323.A O no hydrogen 2.743 N/A TYR 315.A N ILE 299.A O no hydrogen 2.999 N/A TYR 315.A OH GLU 301.A OE1 no hydrogen 3.219 N/A GLN 316.A NE2 ASP 293.A O no hydrogen 2.825 N/A LYS 320.A N GLU 317.A O no hydrogen 3.055 N/A LEU 322.A N ILE 314.A O no hydrogen 2.885 N/A LYS 323.A N ILE 314.A O no hydrogen 3.296 N/A LYS 323.A NZ TRP 212.A O no hydrogen 2.560 N/A GLY 325.A N TYR 312.A O no hydrogen 3.178 N/A TYR 327.A N TRP 310.A O no hydrogen 2.964 N/A TYR 327.A OH GLU 343.A OE1 no hydrogen 3.053 N/A HIS 334.A ND1 GLY 332.A O no hydrogen 3.241 N/A THR 335.A OG1 HIS 334.A O no hydrogen 2.329 N/A ASN 336.A ND2 TYR 378.A OH no hydrogen 2.919 N/A LYS 339.A N ASN 336.A OD1 no hydrogen 2.741 N/A LYS 339.A NZ GLU 343.A OE2 no hydrogen 2.932 N/A GLN 340.A N ASN 336.A O no hydrogen 3.156 N/A LEU 341.A N ASP 337.A O no hydrogen 2.862 N/A THR 342.A N VAL 338.A O no hydrogen 3.157 N/A THR 342.A N LYS 339.A O no hydrogen 2.997 N/A THR 342.A OG1 VAL 338.A O no hydrogen 2.965 N/A GLU 343.A N LYS 339.A O no hydrogen 2.986 N/A ALA 344.A N GLN 340.A O no hydrogen 2.859 N/A VAL 345.A N LEU 341.A O no hydrogen 3.069 N/A GLN 346.A N THR 342.A O no hydrogen 3.138 N/A GLN 346.A NE2 THR 342.A O no hydrogen 3.159 N/A LYS 347.A N GLU 343.A O no hydrogen 2.925 N/A ILE 348.A N ALA 344.A O no hydrogen 3.044 N/A THR 349.A N VAL 345.A O no hydrogen 3.018 N/A THR 349.A OG1 VAL 345.A O no hydrogen 2.708 N/A THR 350.A N GLN 346.A O no hydrogen 3.060 N/A THR 350.A OG1 GLN 346.A O no hydrogen 2.542 N/A GLU 351.A N LYS 347.A O no hydrogen 3.371 N/A SER 352.A N ILE 348.A O no hydrogen 3.132 N/A SER 352.A OG ILE 348.A O no hydrogen 2.912 N/A ILE 353.A N THR 350.A O no hydrogen 2.881 N/A VAL 354.A N THR 350.A O no hydrogen 2.901 N/A ILE 355.A N GLU 351.A O no hydrogen 2.852 N/A LYS 358.A N SER 352.A O no hydrogen 3.034 N/A LYS 358.A NZ TYR 292.A OH no hydrogen 3.398 N/A LYS 361.A N LEU 298.A O no hydrogen 2.983 N/A PHE 362.A N GLU 386.A O no hydrogen 2.953 N/A LYS 363.A N ALA 300.A O no hydrogen 2.984 N/A LEU 364.A N GLU 388.A O no hydrogen 2.779 N/A ILE 366.A N LEU 364.A O no hydrogen 2.861 N/A LYS 368.A NZ GLU 372.A OE1 no hydrogen 3.175 N/A TRP 371.A N GLN 367.A O no hydrogen 2.987 N/A GLU 372.A N LYS 368.A O no hydrogen 2.791 N/A THR 373.A N GLU 369.A O no hydrogen 3.039 N/A THR 373.A OG1 GLU 369.A O no hydrogen 2.882 N/A TRP 374.A N THR 370.A O no hydrogen 3.408 N/A TRP 375.A N TRP 371.A O no hydrogen 2.998 N/A GLU 377.A N TRP 374.A O no hydrogen 2.878 N/A TYR 378.A N TRP 375.A O no hydrogen 3.100 N/A TRP 379.A N THR 376.A O no hydrogen 3.392 N/A TRP 379.A NE1 TRP 383.A O no hydrogen 3.096 N/A GLU 388.A N PHE 362.A O no hydrogen 3.053 N/A VAL 390.A N LEU 364.A O no hydrogen 2.939 N/A LYS 397.A NZ GLN 401.A OE1 no hydrogen 3.527 N/A LEU 398.A N PRO 394.A O no hydrogen 3.427 N/A TRP 399.A N LEU 395.A O no hydrogen 2.948 N/A TYR 400.A N VAL 396.A O no hydrogen 3.199 N/A GLN 401.A N LEU 398.A O no hydrogen 3.395 N/A