Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jff_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N GLY 104.A O no hydrogen 2.363 N/A CYS 3.A SG ILE 4.A O no hydrogen 3.490 N/A CYS 3.A SG GLY 107.A O no hydrogen 3.401 N/A ILE 6.A N SER 109.A O no hydrogen 3.048 N/A HIS 7.A N VAL 39.A O no hydrogen 3.099 N/A HIS 7.A ND1 VAL 39.A O no hydrogen 3.220 N/A VAL 8.A N PHE 111.A O no hydrogen 2.614 N/A GLY 9.A N VAL 41.A O no hydrogen 3.027 N/A VAL 13.A N GLY 9.A O no hydrogen 2.883 N/A VAL 13.A N GLN 10.A O no hydrogen 2.790 N/A GLN 14.A N GLN 10.A O no hydrogen 2.777 N/A ILE 15.A N ALA 11.A O no hydrogen 2.781 N/A ASN 17.A N VAL 13.A O no hydrogen 2.687 N/A ALA 18.A N GLN 14.A O no hydrogen 3.055 N/A CYS 19.A N ILE 15.A O no hydrogen 2.766 N/A TRP 20.A N GLY 16.A O no hydrogen 2.663 N/A GLU 21.A N ALA 18.A O no hydrogen 2.751 N/A LEU 22.A N ALA 18.A O no hydrogen 2.958 N/A TYR 23.A N CYS 19.A O no hydrogen 3.323 N/A CYS 24.A SG GLU 21.A O no hydrogen 3.454 N/A CYS 24.A SG TYR 56.A OH no hydrogen 3.291 N/A LEU 25.A N GLU 21.A O no hydrogen 3.265 N/A GLU 26.A N LEU 22.A O no hydrogen 3.224 N/A GLU 26.A N TYR 23.A O no hydrogen 2.706 N/A HIS 27.A N CYS 24.A O no hydrogen 2.826 N/A ILE 29.A N CYS 24.A O no hydrogen 3.330 N/A VAL 39.A N SER 5.A O no hydrogen 2.897 N/A PHE 40.A N GLN 64.A O no hydrogen 2.725 N/A VAL 41.A N HIS 7.A O no hydrogen 3.093 N/A LEU 43.A N THR 118.A OG1 no hydrogen 3.392 N/A GLU 44.A N ASP 42.A OD2 no hydrogen 3.090 N/A VAL 47.A N GLU 44.A O no hydrogen 3.488 N/A ASP 49.A N PRO 45.A O no hydrogen 2.950 N/A GLU 50.A N VAL 47.A O no hydrogen 2.986 N/A VAL 51.A N ILE 48.A O no hydrogen 2.898 N/A ARG 52.A N ASP 49.A O no hydrogen 2.519 N/A THR 53.A OG1 ASP 49.A O no hydrogen 3.513 N/A GLY 54.A N GLU 50.A O no hydrogen 2.961 N/A GLN 64.A N HIS 61.A O no hydrogen 2.632 N/A ILE 66.A N PHE 40.A O no hydrogen 2.630 N/A GLY 68.A N ASP 42.A O no hydrogen 3.038 N/A ASN 75.A N ALA 73.A O no hydrogen 2.494 N/A TYR 76.A N ASN 159.A OD1 no hydrogen 2.542 N/A TYR 76.A OH HIS 80.A ND1 no hydrogen 3.279 N/A GLY 79.A N ASN 75.A O no hydrogen 3.186 N/A HIS 80.A N TYR 76.A O no hydrogen 2.803 N/A TYR 81.A N ALA 77.A O no hydrogen 2.644 N/A GLY 84.A N ARG 78.A O no hydrogen 3.149 N/A LYS 85.A N TYR 81.A O no hydrogen 3.035 N/A ILE 88.A N GLY 84.A O no hydrogen 3.390 N/A VAL 91.A N ILE 87.A O no hydrogen 2.891 N/A LEU 92.A N ILE 88.A O no hydrogen 2.636 N/A ASP 93.A N ASP 89.A O no hydrogen 2.820 N/A ARG 94.A N LEU 90.A O no hydrogen 3.417 N/A ARG 94.A N VAL 91.A O no hydrogen 2.861 N/A ARG 94.A NE GLU 63.A O no hydrogen 2.761 N/A ILE 95.A N VAL 91.A O no hydrogen 3.456 N/A ARG 96.A N ASP 93.A O no hydrogen 3.256 N/A LYS 97.A N ARG 94.A O no hydrogen 3.018 N/A LEU 98.A N ARG 94.A O no hydrogen 2.495 N/A CYS 102.A SG ALA 99.A O no hydrogen 2.877 N/A GLN 106.A N GLU 2.A O no hydrogen 2.699 N/A GLN 106.A NE2 ASP 224.A OD1 no hydrogen 2.792 N/A GLN 106.A NE2 ASP 224.A OD2 no hydrogen 3.415 N/A PHE 108.A N SER 138.A O no hydrogen 3.233 N/A SER 109.A N ILE 4.A O no hydrogen 2.396 N/A SER 109.A OG ILE 4.A O no hydrogen 3.222 N/A VAL 110.A N LEU 140.A O no hydrogen 3.185 N/A PHE 111.A N ILE 6.A O no hydrogen 2.806 N/A HIS 112.A N PHE 142.A O no hydrogen 3.423 N/A THR 118.A OG1 ASP 42.A OD2 no hydrogen 3.442 N/A SER 120.A OG GLY 116.A O no hydrogen 2.329 N/A GLY 121.A N SER 120.A OG no hydrogen 2.542 N/A THR 123.A OG1 GLY 119.A O no hydrogen 2.446 N/A SER 124.A N SER 120.A O no hydrogen 3.123 N/A SER 124.A OG SER 120.A O no hydrogen 2.429 N/A LEU 125.A N PHE 122.A O no hydrogen 2.593 N/A LEU 126.A N PHE 122.A O no hydrogen 3.013 N/A MET 127.A N THR 123.A O no hydrogen 2.698 N/A GLU 128.A N SER 124.A O no hydrogen 3.125 N/A ARG 129.A N LEU 125.A O no hydrogen 2.657 N/A LEU 130.A N LEU 126.A O no hydrogen 3.006 N/A LEU 130.A N MET 127.A O no hydrogen 3.146 N/A SER 131.A N MET 127.A O no hydrogen 2.999 N/A SER 131.A OG MET 127.A O no hydrogen 3.191 N/A SER 131.A OG HIS 170.A O no hydrogen 2.684 N/A ASP 133.A N ARG 129.A O no hydrogen 3.329 N/A TYR 134.A N LEU 130.A O no hydrogen 2.741 N/A LYS 137.A NZ LEU 105.A O no hydrogen 3.172 N/A SER 138.A N GLN 106.A O no hydrogen 2.879 N/A GLU 141.A N CYS 173.A O no hydrogen 2.962 N/A PHE 142.A N VAL 110.A O no hydrogen 2.680 N/A SER 143.A N PHE 175.A O no hydrogen 2.745 N/A SER 143.A OG PHE 175.A O no hydrogen 2.918 N/A SER 151.A OG ALA 153.A O no hydrogen 3.550 N/A TYR 158.A N VAL 155.A O no hydrogen 2.649 N/A ASN 159.A ND2 ASN 74.A O no hydrogen 2.924 N/A SER 160.A N PRO 157.A O no hydrogen 2.866 N/A SER 160.A OG GLU 156.A O no hydrogen 2.992 N/A SER 160.A OG PRO 157.A O no hydrogen 3.208 N/A ILE 161.A N PRO 157.A O no hydrogen 2.722 N/A THR 163.A OG1 PHE 114.A O no hydrogen 3.252 N/A THR 163.A OG1 ASN 159.A O no hydrogen 2.404 N/A THR 167.A N THR 163.A O no hydrogen 3.258 N/A THR 167.A OG1 GLU 141.A OE1 no hydrogen 2.949 N/A THR 167.A OG1 GLU 141.A OE2 no hydrogen 3.333 N/A LEU 168.A N THR 164.A O no hydrogen 2.770 N/A HIS 170.A N THR 167.A O no hydrogen 2.679 N/A HIS 170.A ND1 GLU 128.A O no hydrogen 3.148 N/A SER 171.A N THR 167.A O no hydrogen 2.979 N/A SER 171.A OG LYS 139.A O no hydrogen 2.570 N/A SER 171.A OG GLU 141.A OE1 no hydrogen 2.724 N/A ASP 172.A N LYS 139.A O no hydrogen 2.519 N/A CYS 173.A N LYS 139.A O no hydrogen 3.305 N/A ALA 174.A N GLY 238.A O no hydrogen 3.207 N/A ALA 174.A N HIS 239.A O no hydrogen 2.954 N/A PHE 175.A N GLU 141.A O no hydrogen 2.827 N/A MET 176.A N PRO 241.A O no hydrogen 3.131 N/A VAL 177.A N SER 143.A O no hydrogen 3.027 N/A ASP 178.A N MET 275.A O no hydrogen 2.648 N/A ALA 181.A N ASP 178.A OD1 no hydrogen 3.371 N/A ILE 182.A N ASN 179.A O no hydrogen 3.360 N/A TYR 183.A N GLU 180.A O no hydrogen 2.513 N/A ASP 184.A N GLU 180.A O no hydrogen 3.309 N/A CYS 186.A N ILE 182.A O no hydrogen 3.109 N/A CYS 186.A SG ILE 182.A O no hydrogen 3.055 N/A ARG 187.A N TYR 183.A O no hydrogen 2.773 N/A ARG 187.A N ASP 184.A O no hydrogen 2.796 N/A ARG 187.A NH2 ASP 184.A OD1 no hydrogen 3.349 N/A ARG 188.A N ASP 184.A O no hydrogen 2.550 N/A ASN 189.A N ILE 185.A O no hydrogen 2.864 N/A ASN 199.A N THR 196.A O no hydrogen 2.580 N/A ASN 201.A N TYR 197.A O no hydrogen 3.067 N/A ARG 202.A NH1 GLU 21.A OE1 no hydrogen 3.196 N/A ARG 202.A NH2 GLU 21.A OE1 no hydrogen 3.092 N/A LEU 203.A N ASN 199.A O no hydrogen 2.886 N/A ILE 204.A N LEU 200.A O no hydrogen 2.947 N/A GLY 205.A N ASN 201.A O no hydrogen 2.562 N/A GLN 206.A N LEU 203.A O no hydrogen 2.353 N/A ILE 207.A N LEU 203.A O no hydrogen 2.953 N/A VAL 208.A N ILE 204.A O no hydrogen 2.694 N/A SER 209.A OG GLU 26.A OE1 no hydrogen 3.469 N/A SER 209.A OG GLU 26.A OE2 no hydrogen 2.521 N/A SER 210.A N GLN 206.A O no hydrogen 3.156 N/A SER 210.A N ILE 207.A O no hydrogen 3.284 N/A SER 210.A OG ILE 207.A O no hydrogen 2.522 N/A ILE 211.A N VAL 208.A O no hydrogen 2.817 N/A SER 214.A N SER 209.A O no hydrogen 3.220 N/A SER 214.A OG SER 209.A O no hydrogen 3.346 N/A ARG 216.A N THR 212.A O no hydrogen 2.897 N/A ARG 216.A NH1 ARG 1.A O no hydrogen 2.727 N/A PHE 217.A N SER 214.A O no hydrogen 2.937 N/A LEU 221.A N ILE 328.A O no hydrogen 3.040 N/A THR 226.A N ASP 224.A OD1 no hydrogen 2.960 N/A THR 226.A OG1 ASP 224.A OD1 no hydrogen 2.714 N/A GLN 229.A NE2 ASP 172.A OD2 no hydrogen 2.463 N/A THR 230.A N THR 226.A O no hydrogen 3.095 N/A THR 230.A OG1 THR 226.A O no hydrogen 3.295 N/A ASN 231.A N GLU 227.A O no hydrogen 2.687 N/A ASN 231.A ND2 GLU 227.A O no hydrogen 3.231 N/A LEU 232.A N PHE 228.A O no hydrogen 2.501 N/A VAL 233.A N GLN 229.A O no hydrogen 2.828 N/A HIS 239.A N ARG 237.A O no hydrogen 2.088 N/A PHE 240.A N TYR 405.A OH no hydrogen 3.067 N/A LEU 242.A N SER 352.A O no hydrogen 2.654 N/A ALA 243.A N MET 176.A O no hydrogen 3.241 N/A VAL 248.A N ALA 246.A O no hydrogen 2.541 N/A ALA 251.A N ASP 340.A O no hydrogen 3.320 N/A LYS 253.A NZ ASP 191.A OD1 no hydrogen 3.515 N/A HIS 256.A ND1 HIS 256.A O no hydrogen 2.494 N/A SER 260.A OG GLU 263.A OE1 no hydrogen 2.518 N/A SER 260.A OG GLU 263.A OE2 no hydrogen 2.653 N/A GLU 263.A N SER 260.A O no hydrogen 2.607 N/A THR 265.A N VAL 261.A O no hydrogen 3.157 N/A THR 265.A OG1 TYR 292.A OH no hydrogen 2.481 N/A ASN 266.A N GLU 263.A O no hydrogen 2.941 N/A ALA 267.A N GLU 263.A O no hydrogen 3.070 N/A CYS 268.A N THR 265.A O no hydrogen 3.347 N/A CYS 268.A SG ILE 264.A O no hydrogen 3.603 N/A CYS 268.A SG VAL 348.A O no hydrogen 3.414 N/A ASN 273.A ND2 ASN 273.A O no hydrogen 2.927 N/A GLN 274.A NE2 VAL 276.A O no hydrogen 3.596 N/A LYS 277.A N ASP 178.A OD2 no hydrogen 3.219 N/A ARG 281.A N ASP 279.A O no hydrogen 2.203 N/A LYS 284.A NZ GLN 315.A OE1 no hydrogen 2.555 N/A MET 286.A N ASN 353.A O no hydrogen 3.000 N/A CYS 288.A N GLY 323.A O no hydrogen 3.054 N/A CYS 288.A SG GLY 323.A O no hydrogen 3.812 N/A CYS 289.A N LEU 351.A O no hydrogen 2.945 N/A CYS 289.A SG LYS 325.A O no hydrogen 3.994 N/A LEU 291.A N CYS 349.A O no hydrogen 3.390 N/A TYR 292.A N GLY 327.A O no hydrogen 2.456 N/A TYR 292.A OH THR 265.A OG1 no hydrogen 2.481 N/A ARG 293.A N ALA 347.A O no hydrogen 3.255 N/A ASP 295.A N GLN 345.A O no hydrogen 3.430 N/A VAL 301.A N VAL 297.A O no hydrogen 3.177 N/A ASN 302.A N PRO 298.A O no hydrogen 2.680 N/A ALA 303.A N VAL 301.A O no hydrogen 2.384 N/A ALA 304.A N ASP 300.A O no hydrogen 2.850 N/A ILE 305.A N VAL 301.A O no hydrogen 2.852 N/A THR 307.A N ALA 303.A O no hydrogen 2.751 N/A LYS 309.A N ILE 305.A O no hydrogen 2.737 N/A LYS 309.A NZ PRO 321.A O no hydrogen 2.693 N/A THR 310.A N THR 307.A O no hydrogen 3.280 N/A THR 310.A OG1 ALA 306.A O no hydrogen 3.149 N/A THR 310.A OG1 THR 307.A O no hydrogen 2.900 N/A LYS 311.A N ILE 308.A O no hydrogen 2.663 N/A THR 313.A N LYS 311.A O no hydrogen 2.337 N/A THR 313.A OG1 LYS 311.A O no hydrogen 3.171 N/A GLN 315.A N ARG 312.A O no hydrogen 2.593 N/A VAL 317.A N TYR 285.A O no hydrogen 2.836 N/A TRP 319.A NE1 VAL 408.A O no hydrogen 2.742 N/A CYS 320.A SG MET 286.A O no hydrogen 3.708 N/A LYS 325.A N CYS 288.A O no hydrogen 2.813 N/A LYS 325.A NZ GLU 227.A OE1 no hydrogen 3.509 N/A LYS 325.A NZ VAL 326.A O no hydrogen 3.443 N/A GLY 327.A N LEU 290.A O no hydrogen 2.838 N/A ASN 329.A N TYR 292.A O no hydrogen 2.980 N/A THR 334.A OG1 GLU 26.A OE1 no hydrogen 3.514 N/A ALA 342.A N ILE 249.A O no hydrogen 2.712 N/A LYS 343.A NZ PRO 333.A O no hydrogen 2.836 N/A ALA 347.A N ARG 293.A O no hydrogen 3.187 N/A CYS 349.A N LEU 291.A O no hydrogen 2.894 N/A CYS 349.A SG LEU 291.A O no hydrogen 2.787 N/A SER 352.A N LEU 242.A O no hydrogen 3.146 N/A ASN 353.A N ALA 287.A O no hydrogen 3.179 N/A ASN 353.A ND2 TYR 405.A OH no hydrogen 3.154 N/A THR 355.A N LYS 284.A O no hydrogen 2.986 N/A THR 355.A OG1 LYS 284.A O no hydrogen 3.286 N/A ALA 356.A N THR 354.A OG1 no hydrogen 3.276 N/A ILE 357.A N THR 354.A O no hydrogen 3.127 N/A ALA 358.A N THR 355.A O no hydrogen 3.239 N/A GLU 359.A N ALA 356.A O no hydrogen 2.682 N/A TRP 361.A N ILE 357.A O no hydrogen 2.896 N/A ALA 362.A N ALA 358.A O no hydrogen 3.295 N/A ARG 363.A N GLU 359.A O no hydrogen 3.172 N/A LEU 364.A N TRP 361.A O no hydrogen 2.905 N/A ASP 365.A N TRP 361.A O no hydrogen 2.753 N/A ASP 365.A N ALA 362.A O no hydrogen 2.708 N/A HIS 366.A N ALA 362.A O no hydrogen 2.932 N/A ASP 369.A N ASP 365.A O no hydrogen 3.243 N/A LEU 370.A N HIS 366.A O no hydrogen 3.222 N/A MET 371.A N LYS 367.A O no hydrogen 3.486 N/A TYR 372.A N PHE 368.A O no hydrogen 2.820 N/A TYR 372.A OH SER 392.A OG no hydrogen 2.764 N/A ALA 373.A N ASP 369.A O no hydrogen 2.460 N/A LYS 374.A N MET 371.A O no hydrogen 2.727 N/A ARG 375.A N TYR 372.A O no hydrogen 2.636 N/A VAL 378.A N ARG 375.A O no hydrogen 2.487 N/A VAL 378.A N ALA 376.A O no hydrogen 2.676 N/A TYR 381.A N VAL 378.A O no hydrogen 2.709 N/A TYR 381.A OH ASN 159.A OD1 no hydrogen 2.970 N/A VAL 382.A N VAL 378.A O no hydrogen 3.212 N/A GLY 383.A N HIS 379.A O no hydrogen 3.461 N/A GLU 384.A N TYR 381.A O no hydrogen 2.390 N/A GLY 385.A N VAL 382.A O no hydrogen 2.986 N/A SER 392.A N GLU 388.A O no hydrogen 3.180 N/A SER 392.A OG TYR 372.A OH no hydrogen 2.764 N/A GLU 393.A N GLY 389.A O no hydrogen 2.611 N/A ALA 394.A N PHE 391.A O no hydrogen 2.691 N/A ARG 395.A N PHE 391.A O no hydrogen 2.927 N/A ARG 395.A NE ASP 369.A OD1 no hydrogen 2.869 N/A ARG 395.A NE ASP 369.A OD2 no hydrogen 3.152 N/A ARG 395.A NH1 ARG 395.A O no hydrogen 3.114 N/A ARG 395.A NH2 ASP 369.A OD2 no hydrogen 2.860 N/A GLU 396.A N SER 392.A O no hydrogen 3.209 N/A MET 398.A N ALA 394.A O no hydrogen 3.375 N/A ALA 399.A N ARG 395.A O no hydrogen 2.890 N/A ALA 400.A N GLU 396.A O no hydrogen 3.387 N/A ALA 400.A N ASP 397.A O no hydrogen 2.996 N/A LEU 401.A N MET 398.A O no hydrogen 2.448 N/A GLU 402.A N MET 398.A O no hydrogen 3.007 N/A GLU 402.A N ALA 399.A O no hydrogen 2.923 N/A LYS 403.A N ALA 399.A O no hydrogen 3.206 N/A TYR 405.A N LEU 401.A O no hydrogen 3.319 N/A GLU 406.A N LYS 403.A O no hydrogen 3.104 N/A GLU 407.A N LYS 403.A O no hydrogen 2.707 N/A VAL 408.A N ASP 404.A O no hydrogen 3.012 N/A GLY 409.A N GLU 406.A O no hydrogen 3.247 N/A