Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jcp_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N GLU 220.A OE1 no hydrogen 2.543 N/A TYR 2.A N GLU 220.A OE1 no hydrogen 3.479 N/A TYR 2.A OH SER 223.A OG no hydrogen 2.667 N/A SER 5.A N ASN 1.A O no hydrogen 3.180 N/A SER 5.A OG PHE 157.A O no hydrogen 2.870 N/A SER 5.A OG PHE 158.A O no hydrogen 2.308 N/A GLU 6.A N TYR 2.A O no hydrogen 3.319 N/A LYS 7.A N GLU 3.A O no hydrogen 2.243 N/A LYS 7.A NZ GLU 3.A OE1 no hydrogen 2.382 N/A ALA 8.A N VAL 4.A O no hydrogen 2.374 N/A PHE 9.A N SER 5.A O no hydrogen 2.697 N/A LEU 10.A N GLU 6.A O no hydrogen 2.173 N/A LEU 11.A N LYS 7.A O no hydrogen 2.935 N/A THR 12.A N ALA 8.A O no hydrogen 2.605 N/A THR 12.A OG1 ALA 8.A O no hydrogen 3.110 N/A THR 12.A OG1 PHE 9.A O no hydrogen 2.650 N/A GLN 13.A N PHE 9.A O no hydrogen 2.774 N/A GLN 13.A N LEU 10.A O no hydrogen 3.122 N/A SER 14.A N LEU 11.A O no hydrogen 2.838 N/A SER 14.A OG SER 17.A O no hydrogen 2.971 N/A LYS 15.A N GLN 20.A OE1 no hydrogen 2.581 N/A GLN 20.A N SER 17.A OG no hydrogen 2.405 N/A ARG 21.A N SER 17.A O no hydrogen 3.426 N/A LYS 22.A N ILE 18.A O no hydrogen 2.095 N/A GLU 23.A N GLU 19.A O no hydrogen 2.607 N/A GLU 26.A N LYS 22.A O no hydrogen 2.914 N/A VAL 28.A N ALA 24.A O no hydrogen 3.175 N/A LEU 29.A N ALA 25.A O no hydrogen 2.248 N/A ALA 30.A N GLU 26.A O no hydrogen 3.034 N/A LYS 31.A N PHE 27.A O no hydrogen 2.258 N/A ILE 32.A N VAL 28.A O no hydrogen 2.376 N/A LYS 33.A N LEU 29.A O no hydrogen 3.376 N/A LYS 33.A NZ GLU 79.A OE1 no hydrogen 3.129 N/A GLU 34.A N ALA 30.A O no hydrogen 2.651 N/A GLU 35.A N LYS 31.A O no hydrogen 2.473 N/A TYR 41.A N MET 37.A O no hydrogen 2.791 N/A TYR 41.A OH TRP 69.A O no hydrogen 3.022 N/A TYR 41.A OH LYS 71.A O no hydrogen 2.485 N/A LYS 42.A N ALA 38.A O no hydrogen 1.987 N/A LEU 44.A N TYR 40.A O no hydrogen 2.152 N/A CYS 45.A N TYR 41.A O no hydrogen 2.611 N/A CYS 45.A SG TYR 41.A O no hydrogen 2.937 N/A CYS 45.A SG ILE 70.A O no hydrogen 2.948 N/A GLU 46.A N LYS 42.A O no hydrogen 2.844 N/A TYR 48.A N LEU 44.A O no hydrogen 3.367 N/A ASN 51.A N TYR 48.A O no hydrogen 3.208 N/A ASN 52.A ND2 TYR 48.A OH no hydrogen 3.078 N/A GLY 53.A N TYR 48.A O no hydrogen 2.892 N/A GLU 58.A N ASP 56.A OD1 no hydrogen 2.873 N/A HIS 59.A N ASP 56.A OD2 no hydrogen 2.803 N/A SER 65.A N LYS 62.A O no hydrogen 3.084 N/A SER 65.A OG ASN 52.A O no hydrogen 2.155 N/A SER 65.A OG ASN 67.A O no hydrogen 2.133 N/A LEU 66.A N ASN 52.A OD1 no hydrogen 2.939 N/A ASN 67.A N ASN 52.A O no hydrogen 3.087 N/A TRP 69.A N ASN 67.A OD1 no hydrogen 2.939 N/A LYS 71.A N GLU 68.A O no hydrogen 2.985 N/A LEU 76.A N ASP 73.A OD1 no hydrogen 2.396 N/A TYR 77.A OH GLU 58.A OE1 no hydrogen 1.998 N/A ASN 78.A N GLN 74.A O no hydrogen 2.769 N/A GLU 79.A N GLU 75.A O no hydrogen 2.297 N/A LEU 80.A N LEU 76.A O no hydrogen 2.219 N/A CYS 81.A N TYR 77.A O no hydrogen 2.183 N/A CYS 81.A SG TYR 77.A O no hydrogen 3.098 N/A LYS 82.A N ASN 78.A O no hydrogen 2.786 N/A LYS 83.A N GLU 79.A O no hydrogen 2.676 N/A LYS 83.A NZ LYS 33.A O no hydrogen 2.842 N/A LYS 83.A NZ GLU 34.A O no hydrogen 3.394 N/A LYS 83.A NZ GLU 79.A OE2 no hydrogen 3.329 N/A ASN 84.A N LEU 80.A O no hydrogen 2.287 N/A GLU 85.A N CYS 81.A O no hydrogen 2.506 N/A SER 86.A N LYS 82.A O no hydrogen 2.417 N/A SER 86.A OG GLU 90.A OE2 no hydrogen 2.950 N/A LYS 87.A N LYS 83.A O no hydrogen 2.498 N/A LYS 87.A NZ GLU 35.A OE1 no hydrogen 3.549 N/A LYS 87.A NZ GLU 36.A OE2 no hydrogen 2.510 N/A LYS 87.A NZ GLN 121.A OE1 no hydrogen 3.022 N/A ILE 88.A N ASN 84.A O no hydrogen 2.489 N/A LYS 89.A N GLU 85.A O no hydrogen 2.315 N/A GLU 90.A N SER 86.A O no hydrogen 2.974 N/A LEU 91.A N LYS 87.A O no hydrogen 2.940 N/A ASN 92.A N ILE 88.A O no hydrogen 2.594 N/A GLU 93.A N LYS 89.A O no hydrogen 3.307 N/A LYS 94.A N GLU 90.A O no hydrogen 2.977 N/A ILE 95.A N LEU 91.A O no hydrogen 2.336 N/A GLN 96.A N ASN 92.A O no hydrogen 2.334 N/A LYS 97.A N GLU 93.A O no hydrogen 2.158 N/A LEU 98.A N LYS 94.A O no hydrogen 2.606 N/A GLU 99.A N ILE 95.A O no hydrogen 2.597 N/A GLU 100.A N GLN 96.A O no hydrogen 2.289 N/A ASP 101.A N LYS 97.A O no hydrogen 2.347 N/A ASP 102.A N GLU 99.A O no hydrogen 3.272 N/A GLU 103.A N LEU 98.A O no hydrogen 2.724 N/A ALA 109.A N GLU 105.A O no hydrogen 2.437 N/A TRP 112.A N GLN 108.A O no hydrogen 3.366 N/A ILE 113.A N ALA 109.A O no hydrogen 2.739 N/A ASN 114.A N GLN 110.A O no hydrogen 2.881 N/A LEU 115.A N ALA 111.A O no hydrogen 2.358 N/A GLY 116.A N TRP 112.A O no hydrogen 2.359 N/A GLU 117.A N ILE 113.A O no hydrogen 2.765 N/A TYR 118.A N ASN 114.A O no hydrogen 3.452 N/A TYR 119.A N GLY 116.A O no hydrogen 2.905 N/A GLN 121.A N GLU 117.A O no hydrogen 2.860 N/A ILE 122.A N TYR 118.A O no hydrogen 2.154 N/A GLY 123.A N TYR 119.A O no hydrogen 2.648 N/A LYS 125.A NZ ASP 161.A OD2 no hydrogen 3.343 N/A ASN 127.A ND2 TYR 119.A OH no hydrogen 3.407 N/A GLU 129.A N ASP 126.A O no hydrogen 2.216 N/A LYS 130.A NZ ASN 127.A OD1 no hydrogen 3.111 N/A THR 131.A N ASN 127.A O no hydrogen 2.101 N/A THR 131.A OG1 ASN 127.A O no hydrogen 2.603 N/A LEU 132.A N ALA 128.A O no hydrogen 2.295 N/A GLY 133.A N GLU 129.A O no hydrogen 2.690 N/A LYS 134.A N LYS 130.A O no hydrogen 2.675 N/A LYS 134.A NZ LYS 130.A O no hydrogen 2.792 N/A SER 135.A N THR 131.A O no hydrogen 2.138 N/A SER 135.A OG THR 131.A O no hydrogen 2.510 N/A LEU 136.A N LEU 132.A O no hydrogen 2.258 N/A SER 137.A N GLY 133.A O no hydrogen 2.321 N/A SER 137.A OG GLY 133.A O no hydrogen 2.405 N/A ALA 139.A N LEU 136.A O no hydrogen 2.895 N/A ALA 144.A N SER 141.A O no hydrogen 2.881 N/A ALA 144.A N SER 141.A OG no hydrogen 2.602 N/A LYS 145.A N SER 141.A O no hydrogen 2.874 N/A LYS 145.A NZ VAL 172.A O no hydrogen 2.565 N/A ILE 146.A N THR 142.A O no hydrogen 2.236 N/A ASP 147.A N ALA 144.A O no hydrogen 2.630 N/A VAL 148.A N ALA 144.A O no hydrogen 3.327 N/A LEU 150.A N ILE 146.A O no hydrogen 3.020 N/A THR 151.A N ASP 147.A O no hydrogen 2.345 N/A THR 151.A OG1 ASP 147.A O no hydrogen 2.555 N/A ILE 152.A N VAL 148.A O no hydrogen 2.343 N/A ALA 153.A N MET 149.A O no hydrogen 2.468 N/A ARG 154.A N LEU 150.A O no hydrogen 2.776 N/A LEU 155.A N THR 151.A O no hydrogen 2.479 N/A GLY 156.A N ILE 152.A O no hydrogen 2.601 N/A PHE 157.A N ALA 153.A O no hydrogen 2.989 N/A PHE 158.A N ARG 154.A O no hydrogen 3.123 N/A PHE 158.A N LEU 155.A O no hydrogen 3.293 N/A TYR 159.A N GLY 156.A O no hydrogen 3.160 N/A TYR 159.A OH GLY 123.A O no hydrogen 2.784 N/A ASP 161.A N GLY 156.A O no hydrogen 2.471 N/A GLN 162.A NE2 ASN 160.A O no hydrogen 3.380 N/A TYR 164.A OH ASP 161.A OD2 no hydrogen 2.490 N/A GLU 167.A N LEU 163.A O no hydrogen 2.106 N/A LYS 168.A N TYR 164.A O no hydrogen 2.090 N/A LEU 169.A N VAL 165.A O no hydrogen 2.108 N/A GLU 170.A N LYS 166.A O no hydrogen 2.313 N/A ALA 171.A N GLU 167.A O no hydrogen 2.228 N/A VAL 172.A N LYS 168.A O no hydrogen 2.241 N/A ASN 173.A N LEU 169.A O no hydrogen 2.499 N/A SER 174.A N GLU 170.A O no hydrogen 2.517 N/A SER 174.A OG GLU 170.A O no hydrogen 2.821 N/A SER 174.A OG ALA 171.A O no hydrogen 2.643 N/A MET 175.A N ALA 171.A O no hydrogen 3.024 N/A GLY 179.A N ILE 176.A O no hydrogen 3.432 N/A GLU 183.A N GLY 180.A O no hydrogen 2.719 N/A ARG 184.A N GLY 180.A O no hydrogen 3.272 N/A ARG 185.A N GLY 179.A O no hydrogen 2.346 N/A ARG 187.A N GLU 183.A O no hydrogen 2.980 N/A TYR 188.A N ARG 184.A O no hydrogen 2.185 N/A TYR 188.A OH GLU 170.A OE1 no hydrogen 2.964 N/A TYR 188.A OH GLU 170.A OE2 no hydrogen 2.447 N/A LYS 189.A N ARG 185.A O no hydrogen 2.315 N/A LYS 189.A NZ ASN 186.A OD1 no hydrogen 2.617 N/A THR 190.A N ASN 186.A O no hydrogen 2.159 N/A THR 190.A OG1 ASN 186.A O no hydrogen 2.581 N/A TYR 191.A N ARG 187.A O no hydrogen 2.899 N/A TYR 192.A N TYR 188.A O no hydrogen 2.535 N/A GLY 193.A N LYS 189.A O no hydrogen 2.410 N/A ILE 194.A N TYR 191.A O no hydrogen 2.623 N/A HIS 195.A N TYR 191.A O no hydrogen 2.348 N/A HIS 195.A ND1 GLN 162.A O no hydrogen 2.467 N/A CYS 196.A N TYR 192.A O no hydrogen 2.817 N/A ALA 198.A N HIS 195.A O no hydrogen 2.539 N/A ASN 201.A N CYS 196.A O no hydrogen 2.374 N/A ASN 201.A ND2 GLY 193.A O no hydrogen 2.092 N/A LYS 203.A NZ THR 238.A O no hydrogen 2.540 N/A ALA 206.A N ASN 201.A O no hydrogen 3.258 N/A LYS 207.A NZ ASP 211.A OD2 no hydrogen 2.535 N/A LEU 209.A N ALA 205.A O no hydrogen 2.296 N/A VAL 210.A N ALA 206.A O no hydrogen 2.513 N/A ASP 211.A N LYS 207.A O no hydrogen 2.206 N/A SER 212.A N LEU 208.A O no hydrogen 2.893 N/A THR 215.A OG1 SER 212.A OG no hydrogen 2.952 N/A SER 218.A N THR 217.A OG1 no hydrogen 2.482 N/A SER 218.A N THR 222.A O no hydrogen 3.247 N/A SER 218.A OG ILE 219.A O no hydrogen 2.691 N/A SER 218.A OG THR 222.A O no hydrogen 2.957 N/A THR 222.A N ILE 219.A O no hydrogen 2.589 N/A THR 222.A OG1 SER 223.A O no hydrogen 2.926 N/A THR 222.A OG1 SER 226.A OG no hydrogen 3.286 N/A SER 223.A OG TYR 2.A OH no hydrogen 2.667 N/A TYR 224.A OH GLU 253.A OE1 no hydrogen 2.381 N/A SER 226.A N SER 223.A OG no hydrogen 3.144 N/A SER 226.A OG THR 222.A OG1 no hydrogen 3.286 N/A ILE 227.A N SER 223.A O no hydrogen 3.400 N/A ALA 228.A N TYR 224.A O no hydrogen 3.100 N/A THR 229.A N GLU 225.A O no hydrogen 2.471 N/A THR 229.A OG1 GLU 225.A O no hydrogen 2.740 N/A TYR 230.A N SER 226.A O no hydrogen 2.676 N/A ALA 231.A N ILE 227.A O no hydrogen 2.472 N/A SER 232.A N ALA 228.A O no hydrogen 2.695 N/A SER 232.A OG ALA 228.A O no hydrogen 2.992 N/A SER 232.A OG THR 229.A O no hydrogen 2.168 N/A VAL 233.A N THR 229.A O no hydrogen 3.021 N/A THR 234.A N TYR 230.A O no hydrogen 3.258 N/A GLY 235.A N ALA 231.A O no hydrogen 3.141 N/A LEU 236.A N SER 232.A O no hydrogen 2.406 N/A PHE 237.A N VAL 233.A O no hydrogen 2.385 N/A THR 238.A N THR 234.A O no hydrogen 2.379 N/A THR 238.A N GLY 235.A O no hydrogen 3.189 N/A THR 238.A OG1 PHE 202.A O no hydrogen 2.966 N/A THR 238.A OG1 THR 234.A O no hydrogen 2.533 N/A THR 238.A OG1 GLY 235.A O no hydrogen 3.161 N/A LEU 239.A N GLY 235.A O no hydrogen 2.358 N/A LEU 244.A N GLU 240.A O no hydrogen 2.571 N/A LYS 245.A N ARG 241.A O no hydrogen 2.146 N/A SER 246.A OG THR 242.A O no hydrogen 2.491 N/A LYS 247.A N ASP 243.A O no hydrogen 2.206 N/A ILE 249.A N LEU 244.A O no hydrogen 2.339 N/A SER 251.A OG LYS 247.A O no hydrogen 3.039 N/A LEU 255.A N SER 251.A O no hydrogen 2.519 N/A SER 256.A N PRO 252.A O no hydrogen 2.482 N/A SER 256.A OG PRO 252.A O no hydrogen 2.505 N/A LEU 257.A N GLU 253.A O no hydrogen 3.149 N/A ILE 258.A N LEU 254.A O no hydrogen 2.582 N/A THR 260.A N LEU 257.A O no hydrogen 2.899 N/A THR 260.A OG1 SER 256.A O no hydrogen 2.840 N/A THR 260.A OG1 ILE 258.A O no hydrogen 3.148 N/A THR 261.A OG1 GLU 225.A OE1 no hydrogen 2.771 N/A THR 261.A OG1 GLU 225.A OE2 no hydrogen 2.512 N/A THR 261.A OG1 THR 261.A O no hydrogen 2.467 N/A ALA 262.A N SER 259.A O no hydrogen 2.650 N/A ALA 263.A N THR 261.A O no hydrogen 1.933 N/A SER 266.A OG LEU 264.A O no hydrogen 2.595 N/A THR 271.A N SER 266.A O no hydrogen 2.855 N/A THR 271.A OG1 ILE 267.A O no hydrogen 2.232 N/A ILE 272.A N SER 268.A O no hydrogen 2.025 N/A SER 273.A N SER 269.A O no hydrogen 2.775 N/A SER 273.A OG SER 281.A OG no hydrogen 3.099 N/A LEU 274.A N LEU 270.A O no hydrogen 2.705 N/A TYR 275.A N THR 271.A O no hydrogen 2.070 N/A SER 277.A N LEU 274.A O no hydrogen 2.132 N/A SER 281.A OG SER 273.A OG no hydrogen 3.099 N/A SER 281.A OG ASP 278.A OD2 no hydrogen 2.085 N/A PHE 283.A N ALA 280.A O no hydrogen 2.236 N/A TYR 285.A N SER 281.A O no hydrogen 2.915 N/A LEU 286.A N TYR 282.A O no hydrogen 2.669 N/A GLU 288.A N PRO 284.A O no hydrogen 2.960 N/A THR 289.A N TYR 285.A O no hydrogen 2.373 N/A THR 289.A OG1 TYR 285.A O no hydrogen 2.469 N/A TYR 290.A N LEU 286.A O no hydrogen 2.478 N/A ALA 291.A N LEU 287.A O no hydrogen 2.962 N/A VAL 293.A N TYR 290.A O no hydrogen 2.791 N/A LEU 294.A N TYR 290.A O no hydrogen 2.391 N/A CYS 297.A N LEU 294.A O no hydrogen 3.200 N/A CYS 297.A SG VAL 293.A O no hydrogen 3.844 N/A LYS 298.A N TYR 230.A OH no hydrogen 3.050 N/A LYS 298.A NZ ASN 160.A OD1 no hydrogen 3.100 N/A ASN 301.A N CYS 297.A O no hydrogen 2.896 N/A HIS 303.A N TYR 299.A O no hydrogen 3.097 N/A PHE 306.A N HIS 303.A O no hydrogen 3.286 N/A VAL 308.A N ALA 304.A O no hydrogen 3.395 N/A ARG 309.A N ASP 305.A O no hydrogen 2.672 N/A GLU 310.A N PHE 306.A O no hydrogen 3.087 N/A MET 311.A N PHE 307.A O no hydrogen 2.431 N/A ARG 312.A N VAL 308.A O no hydrogen 2.361 N/A ARG 313.A N ARG 309.A O no hydrogen 2.273 N/A ARG 313.A NE GLU 310.A OE1 no hydrogen 3.080 N/A LYS 314.A N GLU 310.A O no hydrogen 2.129 N/A VAL 315.A N MET 311.A O no hydrogen 2.429 N/A TYR 316.A N ARG 313.A O no hydrogen 2.346 N/A ALA 317.A N ARG 313.A O no hydrogen 2.856 N/A ALA 317.A N LYS 314.A O no hydrogen 3.285 N/A GLN 318.A N LYS 314.A O no hydrogen 3.300 N/A LEU 320.A N VAL 315.A O no hydrogen 2.786 N/A SER 327.A OG GLY 364.A O no hydrogen 3.239 N/A LYS 329.A N SER 327.A OG no hydrogen 3.200 N/A MET 331.A N SER 327.A O no hydrogen 3.322 N/A ALA 332.A N LEU 328.A O no hydrogen 2.191 N/A SER 333.A N LYS 329.A O no hydrogen 2.171 N/A ALA 334.A N LYS 329.A O no hydrogen 3.163 N/A PHE 335.A N MET 331.A O no hydrogen 3.110 N/A GLY 336.A N SER 333.A O no hydrogen 2.310 N/A LEU 342.A N SER 338.A O no hydrogen 3.265 N/A LEU 342.A N SER 338.A OG no hydrogen 2.984 N/A ASP 343.A N VAL 339.A O no hydrogen 2.848 N/A ASN 344.A N ALA 340.A O no hydrogen 2.641 N/A ASP 345.A N PHE 341.A O no hydrogen 3.386 N/A LEU 346.A N LEU 342.A O no hydrogen 2.904 N/A GLY 347.A N ASP 343.A O no hydrogen 2.187 N/A LYS 348.A NZ ASP 345.A OD1 no hydrogen 2.693 N/A PHE 349.A N LEU 346.A O no hydrogen 2.924 N/A ILE 350.A N GLY 347.A O no hydrogen 2.663 N/A CYS 357.A SG SER 322.A O no hydrogen 4.030 N/A VAL 358.A N GLU 367.A O no hydrogen 2.646 N/A ASP 360.A N ILE 365.A O no hydrogen 2.452 N/A ASN 363.A N ASP 360.A OD2 no hydrogen 2.890 N/A GLY 364.A N ARG 361.A O no hydrogen 2.910 N/A ILE 365.A N ASP 360.A O no hydrogen 3.202 N/A ASN 375.A ND2 ASP 372.A O no hydrogen 3.503 N/A ASN 375.A ND2 ASN 373.A O no hydrogen 2.540 N/A GLN 377.A N LYS 374.A O no hydrogen 3.187 N/A LEU 381.A N TYR 378.A O no hydrogen 1.929 N/A LYS 383.A N LEU 380.A O no hydrogen 2.763 N/A GLN 384.A N LEU 381.A O no hydrogen 3.417 N/A ASP 386.A N VAL 382.A O no hydrogen 3.277 N/A GLY 387.A N LYS 383.A O no hydrogen 2.662 N/A LEU 388.A N GLN 384.A O no hydrogen 2.143 N/A LEU 389.A N GLY 385.A O no hydrogen 2.294 N/A THR 390.A N ASP 386.A O no hydrogen 2.462 N/A THR 390.A OG1 ASP 386.A O no hydrogen 3.257 N/A LYS 391.A N GLY 387.A O no hydrogen 3.431 N/A LEU 392.A N LEU 388.A O no hydrogen 2.189 N/A GLN 393.A N LEU 389.A O no hydrogen 2.819 N/A LYS 394.A N THR 390.A O no hydrogen 2.496 N/A TYR 395.A N LYS 391.A O no hydrogen 2.142 N/A GLY 396.A N LEU 392.A O no hydrogen 3.026 N/A ALA 397.A N GLN 393.A O no hydrogen 2.236 N/A ALA 398.A N TYR 395.A O no hydrogen 2.384 N/A