Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3meg_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLU 1.A OE1 no hydrogen 2.774 N/A VAL 5.A N ASP 116.A OD2 no hydrogen 2.775 N/A LYS 8.A N ARG 78.A O no hydrogen 3.246 N/A GLY 13.A N ASP 12.A OD2 no hydrogen 2.651 N/A VAL 16.A N ASN 52.A O no hydrogen 2.789 N/A GLN 18.A NE2 VAL 55.A O no hydrogen 2.614 N/A THR 22.A OG1 GLU 24.A OE2 no hydrogen 3.072 N/A ILE 26.A N THR 22.A O no hydrogen 2.904 N/A LYS 27.A N GLU 23.A O no hydrogen 3.087 N/A ALA 28.A N GLU 24.A O no hydrogen 2.991 N/A LEU 29.A N LYS 25.A O no hydrogen 2.766 N/A VAL 30.A N ILE 26.A O no hydrogen 2.793 N/A GLU 31.A N LYS 27.A O no hydrogen 3.289 N/A GLU 31.A N ALA 28.A O no hydrogen 3.153 N/A ILE 32.A N ALA 28.A O no hydrogen 3.169 N/A CYS 33.A N LEU 29.A O no hydrogen 3.005 N/A THR 34.A N VAL 30.A O no hydrogen 3.196 N/A THR 34.A N GLU 31.A O no hydrogen 2.789 N/A THR 34.A OG1 VAL 30.A O no hydrogen 3.014 N/A THR 34.A OG1 GLU 31.A O no hydrogen 2.991 N/A GLU 35.A N GLU 31.A O no hydrogen 3.093 N/A MET 36.A N ILE 32.A O no hydrogen 2.960 N/A LYS 38.A N THR 34.A O no hydrogen 3.174 N/A GLY 40.A N GLU 37.A O no hydrogen 3.079 N/A LYS 41.A N MET 36.A O no hydrogen 2.808 N/A LYS 41.A NZ GLU 39.A OE1 no hydrogen 2.389 N/A ILE 42.A N MET 36.A O no hydrogen 3.439 N/A SER 43.A N GLN 140.A O no hydrogen 3.025 N/A ILE 45.A N ARG 138.A O no hydrogen 3.118 N/A GLU 48.A N GLU 48.A OE2 no hydrogen 2.516 N/A ASN 49.A N GLY 46.A O no hydrogen 3.416 N/A ASN 49.A ND2 LYS 121.A O no hydrogen 2.962 N/A ASN 49.A ND2 GLN 140.A OE1 no hydrogen 2.998 N/A TYR 51.A N ASN 49.A OD1 no hydrogen 3.070 N/A TYR 51.A OH ASP 12.A OD2 no hydrogen 2.588 N/A ASN 52.A N PRO 14.A O no hydrogen 2.863 N/A ASN 52.A ND2 VAL 16.A O no hydrogen 3.313 N/A THR 53.A N ALA 124.A O no hydrogen 2.879 N/A VAL 55.A N GLN 18.A OE1 no hydrogen 2.964 N/A PHE 56.A N LEU 69.A O no hydrogen 2.919 N/A ILE 58.A N ARG 67.A O no hydrogen 3.171 N/A ARG 67.A N ILE 58.A O no hydrogen 2.715 N/A LEU 69.A N PHE 56.A O no hydrogen 2.778 N/A ASP 71.A N PRO 54.A O no hydrogen 2.776 N/A ARG 73.A N ASP 71.A OD2 no hydrogen 3.021 N/A ARG 73.A NE ASP 71.A OD1 no hydrogen 3.151 N/A ARG 73.A NE ASP 71.A OD2 no hydrogen 3.095 N/A ARG 73.A NH1 PRO 387.A O no hydrogen 2.864 N/A ARG 73.A NH2 ASP 71.A OD1 no hydrogen 3.025 N/A ASN 76.A N PHE 72.A O no hydrogen 2.834 N/A ASN 76.A ND2 GLY 147.A O no hydrogen 3.178 N/A LYS 77.A N ARG 73.A O no hydrogen 3.090 N/A LYS 77.A NZ GLU 74.A OE2 no hydrogen 3.552 N/A LYS 77.A NZ GLU 388.A OE2 no hydrogen 2.855 N/A ARG 78.A N GLU 74.A O no hydrogen 2.847 N/A ARG 78.A N LEU 75.A O no hydrogen 2.794 N/A ARG 78.A NE ASP 12.A O no hydrogen 2.789 N/A ARG 78.A NH1 GLU 74.A OE1 no hydrogen 3.251 N/A THR 79.A N ASN 76.A O no hydrogen 3.345 N/A THR 79.A OG1 LEU 75.A O no hydrogen 2.896 N/A THR 79.A OG1 ASN 76.A O no hydrogen 3.173 N/A PHE 82.A N THR 79.A O no hydrogen 2.730 N/A TRP 83.A NE1 ASN 76.A O no hydrogen 2.854 N/A GLU 84.A N ASP 81.A O no hydrogen 3.452 N/A VAL 85.A N ASP 81.A O no hydrogen 3.041 N/A LYS 96.A NZ ALA 93.A O no hydrogen 2.534 N/A LYS 97.A N GLY 94.A O no hydrogen 2.685 N/A ASN 98.A N LEU 95.A O no hydrogen 3.402 N/A ASN 98.A ND2 ASP 187.A OD1 no hydrogen 3.318 N/A ASN 98.A ND2 ASP 187.A OD2 no hydrogen 3.484 N/A LYS 99.A N ASP 187.A OD1 no hydrogen 2.807 N/A SER 100.A N SER 186.A O no hydrogen 2.943 N/A SER 100.A OG HIS 214.A ND1 no hydrogen 2.956 N/A VAL 101.A N LEU 213.A O no hydrogen 2.707 N/A THR 102.A N VAL 184.A O no hydrogen 2.489 N/A THR 102.A OG1 HIS 193.A NE2 no hydrogen 2.935 N/A VAL 103.A N TYR 211.A O no hydrogen 3.149 N/A LEU 104.A N LEU 182.A O no hydrogen 3.116 N/A VAL 106.A N ASP 180.A O no hydrogen 2.748 N/A GLY 107.A N ASP 105.A OD1 no hydrogen 2.718 N/A ALA 109.A N VAL 106.A O no hydrogen 3.148 N/A TYR 110.A N GLY 107.A O no hydrogen 2.828 N/A TYR 110.A OH MET 179.A O no hydrogen 2.492 N/A PHE 111.A N ASP 108.A O no hydrogen 2.844 N/A SER 112.A N ALA 109.A O no hydrogen 3.189 N/A SER 112.A OG ALA 109.A O no hydrogen 2.643 N/A VAL 113.A N TYR 110.A O no hydrogen 3.201 N/A LEU 115.A N ASN 142.A O no hydrogen 2.587 N/A ASP 118.A N ASP 116.A OD1 no hydrogen 2.815 N/A PHE 119.A N ASP 116.A O no hydrogen 2.878 N/A ARG 120.A N ASP 116.A O no hydrogen 3.196 N/A ARG 120.A NE LEU 115.A O no hydrogen 2.726 N/A ARG 120.A NH1 ASN 142.A OD1 no hydrogen 3.330 N/A ARG 120.A NH2 LEU 115.A O no hydrogen 2.821 N/A TYR 122.A N PHE 119.A O no hydrogen 3.014 N/A THR 123.A N ARG 120.A O no hydrogen 3.031 N/A THR 123.A OG1 ARG 120.A O no hydrogen 2.890 N/A PHE 125.A N TYR 139.A O no hydrogen 3.126 N/A THR 126.A OG1 ASN 52.A OD1 no hydrogen 2.656 N/A ILE 127.A N ILE 137.A O no hydrogen 2.874 N/A SER 129.A OG THR 134.A O no hydrogen 2.864 N/A SER 129.A OG THR 134.A OG1 no hydrogen 3.253 N/A ASN 131.A ND2 GLU 133.A OE2 no hydrogen 3.211 N/A ASN 132.A N SER 129.A O no hydrogen 3.152 N/A GLU 133.A N ILE 130.A O no hydrogen 3.408 N/A THR 134.A N SER 129.A OG no hydrogen 3.259 N/A THR 134.A OG1 SER 129.A OG no hydrogen 3.253 N/A ILE 137.A N ILE 127.A O no hydrogen 3.006 N/A ARG 138.A NE THR 126.A OG1 no hydrogen 3.370 N/A ARG 138.A NH1 ASN 49.A O no hydrogen 2.731 N/A ARG 138.A NH2 ASN 52.A OD1 no hydrogen 3.221 N/A TYR 139.A N PHE 125.A O no hydrogen 3.205 N/A GLN 140.A N SER 43.A O no hydrogen 2.881 N/A TYR 141.A N THR 123.A OG1 no hydrogen 2.935 N/A ASN 142.A N LYS 41.A O no hydrogen 2.757 N/A ASN 142.A ND2 GLY 40.A O no hydrogen 2.958 N/A ASN 142.A ND2 SER 43.A OG no hydrogen 2.429 N/A VAL 143.A N LYS 41.A O no hydrogen 3.461 N/A LEU 144.A N VAL 113.A O no hydrogen 3.126 N/A GLY 147.A N ASP 180.A OD1 no hydrogen 3.443 N/A LYS 149.A N ASN 76.A OD1 no hydrogen 2.925 N/A SER 151.A N TRP 148.A O no hydrogen 3.012 N/A SER 151.A OG PRO 145.A O no hydrogen 2.550 N/A ILE 154.A N GLY 150.A O no hydrogen 2.701 N/A PHE 155.A N SER 151.A O no hydrogen 3.092 N/A PHE 155.A N PRO 152.A O no hydrogen 3.113 N/A MET 159.A N PHE 155.A O no hydrogen 2.778 N/A THR 160.A N GLN 156.A O no hydrogen 3.288 N/A ILE 162.A N SER 158.A O no hydrogen 3.174 N/A LEU 163.A N MET 159.A O no hydrogen 3.015 N/A LEU 163.A N THR 160.A O no hydrogen 3.206 N/A GLU 164.A N LYS 161.A O no hydrogen 3.370 N/A ARG 167.A N LEU 163.A O no hydrogen 2.897 N/A ARG 167.A NH2 ILE 175.A O no hydrogen 3.190 N/A LYS 168.A N GLU 164.A O no hydrogen 2.996 N/A GLN 169.A N PRO 165.A O no hydrogen 2.770 N/A ASN 170.A N PHE 166.A O no hydrogen 2.964 N/A ASN 170.A ND2 PHE 166.A O no hydrogen 2.617 N/A ILE 173.A N ASN 170.A O no hydrogen 3.214 N/A VAL 174.A N GLY 185.A O no hydrogen 2.930 N/A TYR 176.A N TYR 183.A O no hydrogen 2.794 N/A GLN 177.A NE2 MET 179.A O no hydrogen 3.552 N/A TYR 178.A N ASP 181.A O no hydrogen 2.985 N/A TYR 178.A OH THR 361.A OG1 no hydrogen 2.811 N/A ASP 181.A N TYR 178.A O no hydrogen 3.085 N/A LEU 182.A N LEU 104.A O no hydrogen 2.933 N/A TYR 183.A N TYR 176.A O no hydrogen 2.643 N/A VAL 184.A N THR 102.A O no hydrogen 2.830 N/A GLY 185.A N VAL 174.A O no hydrogen 2.763 N/A SER 186.A N SER 100.A O no hydrogen 2.863 N/A SER 186.A OG HIS 193.A ND1 no hydrogen 2.669 N/A GLY 191.A N GLU 189.A OE2 no hydrogen 2.775 N/A HIS 193.A N GLU 189.A O no hydrogen 2.861 N/A HIS 193.A ND1 SER 186.A OG no hydrogen 2.669 N/A HIS 193.A NE2 THR 102.A OG1 no hydrogen 2.935 N/A ARG 194.A N ILE 190.A O no hydrogen 2.963 N/A ARG 194.A NE GLU 212.A OE1 no hydrogen 3.390 N/A ARG 194.A NE GLU 212.A OE2 no hydrogen 2.579 N/A ARG 194.A NH2 GLU 212.A OE1 no hydrogen 2.916 N/A THR 195.A N GLY 191.A O no hydrogen 3.153 N/A THR 195.A OG1 GLY 191.A O no hydrogen 2.592 N/A LYS 196.A N GLN 192.A O no hydrogen 3.196 N/A LYS 196.A NZ ASN 170.A OD1 no hydrogen 2.776 N/A LYS 196.A NZ GLU 199.A OE2 no hydrogen 2.913 N/A ILE 197.A N HIS 193.A O no hydrogen 3.169 N/A ILE 197.A N ARG 194.A O no hydrogen 3.015 N/A GLU 198.A N ARG 194.A O no hydrogen 3.161 N/A GLU 199.A N THR 195.A O no hydrogen 3.074 N/A LEU 200.A N LYS 196.A O no hydrogen 3.195 N/A ARG 201.A N ILE 197.A O no hydrogen 2.776 N/A GLN 202.A N GLU 198.A O no hydrogen 3.056 N/A GLN 202.A NE2 GLU 198.A OE1 no hydrogen 2.636 N/A LEU 204.A N LEU 200.A O no hydrogen 3.118 N/A LEU 205.A N ARG 201.A O no hydrogen 2.649 N/A ARG 206.A N HIS 203.A O no hydrogen 3.162 N/A ARG 206.A NH1 GLN 202.A O no hydrogen 3.188 N/A ARG 206.A NH1 GLN 202.A OE1 no hydrogen 2.606 N/A TRP 207.A N LEU 204.A O no hydrogen 2.745 N/A LEU 213.A N VAL 101.A O no hydrogen 2.678 N/A TRP 218.A N PRO 215.A O no hydrogen 3.148 N/A GLN 221.A N THR 330.A O no hydrogen 3.460 N/A SER 230.A N ASP 229.A OD1 no hydrogen 2.975 N/A THR 232.A N ASP 235.A OD2 no hydrogen 3.213 N/A ASN 234.A N LEU 268.A O no hydrogen 3.141 N/A ASP 235.A N THR 232.A OG1 no hydrogen 2.924 N/A ILE 236.A N THR 232.A O no hydrogen 3.009 N/A GLN 237.A N VAL 233.A O no hydrogen 2.745 N/A LYS 238.A N ASN 234.A O no hydrogen 2.843 N/A LYS 238.A NZ ASN 234.A OD1 no hydrogen 3.284 N/A LEU 239.A N ASP 235.A O no hydrogen 3.059 N/A VAL 240.A N ILE 236.A O no hydrogen 2.698 N/A GLY 241.A N GLN 237.A O no hydrogen 3.036 N/A LYS 242.A N LYS 238.A O no hydrogen 3.225 N/A LYS 242.A NZ VAL 224.A O no hydrogen 3.033 N/A LEU 243.A N LEU 239.A O no hydrogen 2.929 N/A ASN 244.A N VAL 240.A O no hydrogen 2.712 N/A ASN 244.A ND2 GLY 241.A O no hydrogen 3.209 N/A TRP 245.A N GLY 241.A O no hydrogen 2.911 N/A ALA 246.A N LYS 242.A O no hydrogen 3.343 N/A SER 247.A N LEU 243.A O no hydrogen 3.217 N/A SER 247.A OG LEU 243.A O no hydrogen 2.970 N/A GLN 248.A N TRP 245.A O no hydrogen 2.860 N/A ILE 249.A N ALA 246.A O no hydrogen 2.770 N/A TYR 250.A N ALA 246.A O no hydrogen 2.731 N/A ILE 253.A N TYR 250.A O no hydrogen 3.468 N/A GLN 257.A N GLU 281.A OE1 no hydrogen 3.015 N/A LEU 258.A N VAL 255.A O no hydrogen 2.993 N/A CYS 259.A N VAL 255.A O no hydrogen 3.311 N/A CYS 259.A SG VAL 255.A O no hydrogen 3.582 N/A CYS 259.A SG ARG 256.A O no hydrogen 3.515 N/A LEU 261.A N LEU 258.A O no hydrogen 2.982 N/A ARG 263.A N LEU 261.A O no hydrogen 2.981 N/A GLU 270.A N ALA 267.A O no hydrogen 2.948 N/A ILE 272.A N TRP 231.A O no hydrogen 2.901 N/A GLU 279.A N THR 275.A O no hydrogen 2.812 N/A LEU 280.A N GLU 277.A O no hydrogen 3.287 N/A GLU 281.A N GLU 277.A O no hydrogen 2.837 N/A LEU 282.A N ALA 278.A O no hydrogen 2.753 N/A GLU 284.A N LEU 280.A O no hydrogen 2.964 N/A ASN 285.A N GLU 281.A O no hydrogen 3.371 N/A ASN 285.A ND2 LYS 254.A O no hydrogen 3.017 N/A ASN 285.A ND2 GLU 281.A O no hydrogen 3.036 N/A ARG 286.A N LEU 282.A O no hydrogen 3.270 N/A GLU 287.A N GLU 284.A O no hydrogen 3.232 N/A LEU 289.A N ASN 285.A O no hydrogen 2.956 N/A LYS 290.A N ARG 286.A O no hydrogen 3.398 N/A GLU 291.A N ILE 288.A O no hydrogen 2.874 N/A VAL 296.A N VAL 293.A O no hydrogen 3.520 N/A ASP 299.A N GLN 322.A OE1 no hydrogen 2.805 N/A SER 301.A N ASP 299.A OD1 no hydrogen 2.848 N/A SER 301.A OG ASP 299.A OD1 no hydrogen 2.955 N/A SER 301.A OG ASP 299.A OD2 no hydrogen 3.090 N/A LYS 302.A N ASP 299.A O no hydrogen 3.140 N/A LYS 302.A NZ GLU 323.A OE1 no hydrogen 3.180 N/A ILE 305.A N TYR 321.A O no hydrogen 2.735 N/A ALA 306.A N LYS 363.A O no hydrogen 3.071 N/A GLU 307.A N GLN 319.A O no hydrogen 3.071 N/A GLN 309.A N THR 317.A O no hydrogen 3.075 N/A GLN 309.A NE2 GLN 319.A OE1 no hydrogen 2.692 N/A LYS 310.A NZ ASP 339.A OD1 no hydrogen 2.631 N/A GLN 311.A N GLN 315.A O no hydrogen 3.109 N/A GLN 311.A NE2 THR 317.A OG1 no hydrogen 3.014 N/A GLN 311.A NE2 LYS 399.A O no hydrogen 2.958 N/A GLN 315.A N GLY 312.A O no hydrogen 3.077 N/A TRP 316.A N TYR 333.A O no hydrogen 3.018 N/A THR 317.A OG1 GLN 309.A OE1 no hydrogen 2.453 N/A TYR 318.A N GLY 331.A O no hydrogen 2.890 N/A TYR 318.A OH GLU 353.A OE2 no hydrogen 3.218 N/A GLN 319.A N GLU 307.A O no hydrogen 3.063 N/A GLN 319.A NE2 GLN 309.A OE1 no hydrogen 2.754 N/A ILE 320.A N LYS 329.A O no hydrogen 2.678 N/A TYR 321.A N ILE 305.A O no hydrogen 2.831 N/A TYR 321.A OH GLU 307.A OE1 no hydrogen 2.376 N/A GLN 322.A NE2 ASP 299.A O no hydrogen 2.529 N/A GLN 322.A NE2 LYS 302.A O no hydrogen 2.758 N/A LYS 326.A N GLU 323.A O no hydrogen 3.183 N/A LEU 328.A N ILE 320.A O no hydrogen 2.812 N/A LYS 329.A N ILE 320.A O no hydrogen 3.434 N/A LYS 329.A NZ THR 330.A O no hydrogen 3.111 N/A THR 330.A OG1 GLN 221.A O no hydrogen 2.956 N/A GLY 331.A N TYR 318.A O no hydrogen 2.962 N/A ARG 335.A N GLY 314.A O no hydrogen 3.062 N/A LYS 341.A N ASN 338.A OD1 no hydrogen 2.878 N/A LYS 341.A NZ HIS 336.A O no hydrogen 3.108 N/A GLN 342.A N ASN 338.A O no hydrogen 3.076 N/A LEU 343.A N ASP 339.A O no hydrogen 3.410 N/A THR 344.A N VAL 340.A O no hydrogen 3.004 N/A THR 344.A OG1 VAL 340.A O no hydrogen 2.704 N/A GLU 345.A N LYS 341.A O no hydrogen 2.931 N/A ALA 346.A N GLN 342.A O no hydrogen 2.740 N/A VAL 347.A N LEU 343.A O no hydrogen 2.634 N/A GLN 348.A N THR 344.A O no hydrogen 3.261 N/A GLN 348.A NE2 THR 344.A O no hydrogen 2.705 N/A LYS 349.A N GLU 345.A O no hydrogen 2.779 N/A LYS 349.A NZ GLU 353.A OE1 no hydrogen 3.093 N/A ILE 350.A N ALA 346.A O no hydrogen 2.778 N/A THR 351.A N VAL 347.A O no hydrogen 2.750 N/A THR 351.A OG1 VAL 347.A O no hydrogen 2.649 N/A THR 352.A N GLN 348.A O no hydrogen 2.918 N/A THR 352.A OG1 GLN 348.A O no hydrogen 2.980 N/A GLU 353.A N LYS 349.A O no hydrogen 3.028 N/A SER 354.A N ILE 350.A O no hydrogen 2.797 N/A SER 354.A OG LYS 360.A O no hydrogen 2.740 N/A ILE 355.A N THR 351.A O no hydrogen 2.871 N/A ILE 355.A N THR 352.A O no hydrogen 3.023 N/A VAL 356.A N THR 352.A O no hydrogen 3.106 N/A ILE 357.A N GLU 353.A O no hydrogen 3.030 N/A TRP 358.A N SER 354.A O no hydrogen 3.105 N/A GLY 359.A N ILE 355.A O no hydrogen 2.688 N/A LYS 360.A NZ PRO 300.A O no hydrogen 3.213 N/A LYS 360.A NZ LYS 302.A O no hydrogen 2.925 N/A THR 361.A OG1 TYR 178.A OH no hydrogen 2.811 N/A LYS 363.A N LEU 304.A O no hydrogen 2.804 N/A LYS 363.A NZ GLU 390.A OE1 no hydrogen 3.403 N/A PHE 364.A N GLU 388.A O no hydrogen 2.598 N/A LYS 365.A N ALA 306.A O no hydrogen 2.813 N/A LEU 366.A N GLU 390.A O no hydrogen 2.773 N/A ILE 368.A N LEU 366.A O no hydrogen 2.886 N/A GLU 371.A N GLU 371.A OE2 no hydrogen 2.585 N/A TRP 373.A N GLN 369.A O no hydrogen 3.148 N/A GLU 374.A N LYS 370.A O no hydrogen 3.075 N/A THR 375.A N GLU 371.A O no hydrogen 3.148 N/A THR 375.A OG1 GLU 371.A O no hydrogen 2.992 N/A TRP 376.A N THR 372.A O no hydrogen 3.228 N/A TRP 376.A N TRP 373.A O no hydrogen 3.112 N/A TRP 377.A N TRP 373.A O no hydrogen 2.824 N/A GLU 379.A N TRP 376.A O no hydrogen 2.747 N/A TYR 380.A N TRP 377.A O no hydrogen 3.035 N/A TRP 381.A N TRP 377.A O no hydrogen 3.166 N/A GLN 382.A N GLN 348.A OE1 no hydrogen 2.660 N/A GLU 390.A N PHE 364.A O no hydrogen 2.725 N/A VAL 392.A N LEU 366.A O no hydrogen 2.992 N/A LEU 400.A N LEU 397.A O no hydrogen 2.863 N/A TRP 401.A N LEU 397.A O no hydrogen 3.111 N/A TYR 402.A N VAL 398.A O no hydrogen 3.202 N/A TYR 402.A OH ASN 327.A OD1 no hydrogen 3.364 N/A GLN 403.A N LEU 400.A O no hydrogen 3.009 N/A