Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pdx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 8.A N ASN 5.A O no hydrogen 3.308 N/A ILE 11.A N SER 337.A O no hydrogen 2.614 N/A LEU 13.A N HIS 339.A O no hydrogen 2.693 N/A SER 14.A OG HIS 339.A O no hydrogen 3.555 N/A THR 19.A N ASP 17.A OD1 no hydrogen 3.049 N/A THR 19.A OG1 ASP 17.A OD1 no hydrogen 2.610 N/A VAL 20.A N ASP 17.A O no hydrogen 3.285 N/A ASN 23.A ND2 THR 357.A O no hydrogen 2.841 N/A THR 26.A OG1 TRP 218.A O no hydrogen 3.165 N/A GLU 29.A N ASP 27.A OD2 no hydrogen 2.766 N/A VAL 30.A N ASP 27.A O no hydrogen 2.721 N/A THR 31.A N ASP 27.A O no hydrogen 3.464 N/A GLN 32.A N PRO 28.A O no hydrogen 3.175 N/A GLN 32.A NE2 ASP 36.A OD1 no hydrogen 3.558 N/A ALA 33.A N GLU 29.A O no hydrogen 3.217 N/A MET 34.A N VAL 30.A O no hydrogen 3.394 N/A LYS 35.A N THR 31.A O no hydrogen 3.252 N/A ASP 36.A N GLN 32.A O no hydrogen 2.540 N/A ALA 37.A N ALA 33.A O no hydrogen 2.639 N/A LEU 38.A N MET 34.A O no hydrogen 2.646 N/A ASP 39.A N LYS 35.A O no hydrogen 2.662 N/A SER 40.A N ASP 36.A O no hydrogen 3.033 N/A SER 40.A OG ALA 37.A O no hydrogen 3.093 N/A GLY 41.A N LEU 38.A O no hydrogen 2.735 N/A LYS 42.A N SER 40.A OG no hydrogen 3.157 N/A GLY 51.A N PRO 48.A O no hydrogen 2.677 N/A TYR 52.A N GLN 260.A OE1 no hydrogen 3.167 N/A SER 55.A OG GLN 260.A O no hydrogen 2.616 N/A ARG 56.A N TYR 52.A O no hydrogen 2.795 N/A ARG 56.A NH1 VAL 75.A O no hydrogen 3.264 N/A GLU 57.A N LEU 53.A O no hydrogen 2.621 N/A GLU 58.A N SER 54.A O no hydrogen 2.923 N/A GLU 58.A N SER 55.A O no hydrogen 2.951 N/A VAL 59.A N SER 55.A O no hydrogen 3.199 N/A ALA 60.A N ARG 56.A O no hydrogen 3.174 N/A SER 61.A N GLU 57.A O no hydrogen 3.242 N/A TYR 62.A N GLU 58.A O no hydrogen 3.232 N/A CYS 65.A SG ALA 68.A O no hydrogen 3.719 N/A GLU 67.A N GLU 67.A OE1 no hydrogen 2.754 N/A GLU 71.A N ASP 74.A OD2 no hydrogen 2.715 N/A ASP 74.A N GLU 71.A O no hydrogen 2.994 N/A ILE 76.A N ILE 228.A O no hydrogen 3.138 N/A LEU 77.A N ILE 50.A O no hydrogen 2.835 N/A THR 78.A N GLY 226.A O no hydrogen 2.635 N/A THR 78.A OG1 GLY 80.A O no hydrogen 3.136 N/A THR 78.A OG1 GLY 226.A O no hydrogen 3.484 N/A SER 79.A N GLN 83.A OE1 no hydrogen 2.630 N/A SER 79.A OG SER 79.A O no hydrogen 2.544 N/A SER 79.A OG GLN 83.A OE1 no hydrogen 2.758 N/A GLY 80.A N THR 78.A O no hydrogen 2.582 N/A CYS 81.A SG ASP 184.A OD2 no hydrogen 3.777 N/A ALA 84.A N GLY 80.A O no hydrogen 3.069 N/A ILE 85.A N CYS 81.A O no hydrogen 2.703 N/A GLU 86.A N SER 82.A O no hydrogen 3.075 N/A LEU 87.A N GLN 83.A O no hydrogen 2.725 N/A LEU 89.A N ILE 85.A O no hydrogen 2.753 N/A ALA 90.A N GLU 86.A O no hydrogen 3.113 N/A VAL 91.A N LEU 87.A O no hydrogen 3.262 N/A LEU 92.A N LEU 89.A O no hydrogen 2.812 N/A ASN 94.A N GLN 97.A OE1 no hydrogen 3.488 N/A GLY 96.A N GLY 117.A O no hydrogen 3.189 N/A GLN 97.A NE2 LYS 145.A O no hydrogen 3.031 N/A ASN 98.A N LYS 145.A O no hydrogen 2.566 N/A LEU 100.A N CYS 148.A O no hydrogen 2.653 N/A ILE 101.A N LYS 121.A O no hydrogen 2.870 N/A GLY 105.A N PHE 346.A O no hydrogen 3.124 N/A TYR 109.A N PHE 106.A O no hydrogen 3.361 N/A THR 111.A OG1 SER 107.A O no hydrogen 2.761 N/A LEU 112.A N LEU 108.A O no hydrogen 3.022 N/A ALA 113.A N TYR 109.A O no hydrogen 2.982 N/A GLU 114.A N ARG 110.A O no hydrogen 3.090 N/A SER 115.A OG THR 111.A O no hydrogen 2.272 N/A MET 116.A N LEU 112.A O no hydrogen 2.485 N/A MET 116.A N ALA 113.A O no hydrogen 3.134 N/A GLY 117.A N GLU 114.A O no hydrogen 3.174 N/A ILE 118.A N ALA 113.A O no hydrogen 2.535 N/A GLU 119.A N GLN 97.A O no hydrogen 3.008 N/A LYS 121.A N ILE 99.A O no hydrogen 3.249 N/A TYR 123.A N ILE 101.A O no hydrogen 2.607 N/A TYR 123.A OH VAL 150.A O no hydrogen 2.542 N/A ASN 124.A ND2 GLN 137.A OE1 no hydrogen 2.691 N/A LEU 125.A N ARG 103.A O no hydrogen 2.735 N/A LEU 126.A N GLU 132.A O no hydrogen 2.563 N/A LYS 129.A N LEU 126.A O no hydrogen 3.056 N/A GLU 132.A N LYS 129.A O no hydrogen 2.846 N/A ILE 133.A N HIS 166.A NE2 no hydrogen 3.006 N/A ASP 134.A N ASN 124.A O no hydrogen 2.607 N/A LYS 136.A N ASP 134.A OD1 no hydrogen 3.084 N/A LYS 136.A NZ ASP 134.A OD1 no hydrogen 2.990 N/A LEU 138.A N ASP 134.A O no hydrogen 3.195 N/A GLU 139.A N LEU 135.A O no hydrogen 3.083 N/A SER 140.A N LYS 136.A O no hydrogen 3.276 N/A SER 140.A OG LYS 136.A O no hydrogen 2.930 N/A LEU 141.A N LEU 138.A O no hydrogen 3.007 N/A GLU 144.A N ASP 143.A OD2 no hydrogen 3.192 N/A THR 146.A OG1 ASN 98.A OD1 no hydrogen 2.437 N/A ALA 147.A N ASN 98.A O no hydrogen 2.589 N/A CYS 148.A SG LEU 149.A O no hydrogen 3.437 N/A CYS 148.A SG PRO 180.A O no hydrogen 3.221 N/A LEU 149.A N PRO 180.A O no hydrogen 2.685 N/A VAL 150.A N LEU 100.A O no hydrogen 2.609 N/A VAL 151.A N LEU 182.A O no hydrogen 2.895 N/A ASN 152.A ND2 ASP 184.A O no hydrogen 3.298 N/A ASN 153.A N ASP 184.A O no hydrogen 3.102 N/A SER 155.A N SER 160.A O no hydrogen 3.075 N/A ASN 156.A N ASN 152.A OD1 no hydrogen 3.211 N/A CYS 158.A SG SER 155.A OG no hydrogen 3.480 N/A GLY 159.A N SER 155.A O no hydrogen 3.262 N/A PHE 162.A N ASN 153.A OD1 no hydrogen 2.742 N/A HIS 166.A N SER 163.A OG no hydrogen 2.768 N/A LEU 167.A N SER 163.A O no hydrogen 3.315 N/A LYS 169.A N ARG 165.A O no hydrogen 2.856 N/A ILE 170.A N HIS 166.A O no hydrogen 2.730 N/A LEU 171.A N LEU 167.A O no hydrogen 2.795 N/A ALA 172.A N GLN 168.A O no hydrogen 2.682 N/A VAL 173.A N LYS 169.A O no hydrogen 3.186 N/A VAL 173.A N ILE 170.A O no hydrogen 3.244 N/A GLN 177.A N ALA 174.A O no hydrogen 3.371 N/A VAL 179.A N ALA 174.A O no hydrogen 3.136 N/A ILE 181.A N PRO 208.A O no hydrogen 3.218 N/A ALA 183.A N LEU 210.A O no hydrogen 2.989 N/A ILE 186.A N ASP 184.A OD1 no hydrogen 3.407 N/A GLY 188.A N GLU 185.A O no hydrogen 2.976 N/A MET 190.A N TYR 187.A O no hydrogen 2.873 N/A PHE 192.A N SER 305.A O no hydrogen 3.351 N/A SER 193.A N SER 305.A O no hydrogen 3.167 N/A CYS 195.A N SER 193.A OG no hydrogen 3.294 N/A CYS 195.A SG SER 193.A OG no hydrogen 2.356 N/A MET 200.A N GLU 185.A OE2 no hydrogen 2.875 N/A THR 202.A OG1 PRO 199.A O no hydrogen 2.822 N/A LEU 203.A N MET 200.A O no hydrogen 3.411 N/A SER 204.A N ALA 201.A O no hydrogen 2.935 N/A SER 204.A OG VAL 207.A O no hydrogen 2.802 N/A ASN 206.A ND2 GLU 175.A OE1 no hydrogen 2.950 N/A ILE 209.A N HIS 231.A O no hydrogen 3.305 N/A SER 211.A N LEU 229.A O no hydrogen 2.565 N/A CYS 212.A N ALA 183.A O no hydrogen 3.255 N/A ARG 217.A NH1 TYR 62.A OH no hydrogen 3.502 N/A ARG 217.A NH2 TYR 62.A OH no hydrogen 2.897 N/A TRP 218.A N LEU 215.A O no hydrogen 2.968 N/A TRP 223.A N VAL 220.A O no hydrogen 3.006 N/A TRP 227.A N GLY 213.A O no hydrogen 2.785 N/A ILE 228.A N ILE 76.A O no hydrogen 2.727 N/A LEU 229.A N SER 211.A O no hydrogen 2.617 N/A ILE 230.A N ASP 74.A O no hydrogen 2.761 N/A HIS 231.A N ILE 209.A O no hydrogen 2.816 N/A ARG 233.A NH1 GLU 67.A O no hydrogen 2.825 N/A ARG 233.A NH2 GLU 67.A O no hydrogen 2.719 N/A PHE 237.A N ASP 232.A OD1 no hydrogen 3.030 N/A GLY 238.A N ASP 232.A OD2 no hydrogen 2.922 N/A ARG 242.A N GLY 238.A O no hydrogen 3.463 N/A ARG 242.A NH1 ASP 74.A OD1 no hydrogen 2.725 N/A ASP 243.A N ASN 239.A O no hydrogen 3.338 N/A GLY 244.A N ILE 241.A O no hydrogen 2.822 N/A LEU 245.A N ARG 242.A O no hydrogen 3.203 N/A VAL 246.A N ARG 242.A O no hydrogen 3.160 N/A LYS 247.A N ASP 243.A O no hydrogen 2.733 N/A LEU 248.A N GLY 244.A O no hydrogen 3.134 N/A SER 249.A N LEU 245.A O no hydrogen 2.670 N/A ARG 251.A N LEU 248.A O no hydrogen 2.932 N/A LEU 253.A N SER 249.A O no hydrogen 3.078 N/A THR 257.A OG1 TYR 43.A O no hydrogen 2.579 N/A VAL 259.A N CYS 256.A O no hydrogen 3.133 N/A GLN 260.A N CYS 256.A O no hydrogen 3.170 N/A GLN 260.A NE2 CYS 256.A O no hydrogen 3.335 N/A GLY 261.A N THR 257.A O no hydrogen 2.696 N/A ALA 262.A N ILE 258.A O no hydrogen 2.902 N/A LEU 263.A N GLN 260.A O no hydrogen 3.207 N/A ILE 266.A N ALA 262.A O no hydrogen 2.869 N/A LEU 267.A N LEU 263.A O no hydrogen 3.099 N/A GLN 268.A N LYS 264.A O no hydrogen 3.340 N/A GLN 268.A NE2 GLU 58.A OE2 no hydrogen 3.279 N/A ARG 269.A N SER 265.A O no hydrogen 2.923 N/A THR 270.A OG1 ILE 266.A O no hydrogen 2.793 N/A PHE 274.A N PRO 271.A O no hydrogen 2.866 N/A GLN 276.A N GLN 272.A O no hydrogen 2.819 N/A ASP 277.A N GLU 273.A O no hydrogen 3.378 N/A THR 278.A N PHE 274.A O no hydrogen 3.161 N/A THR 278.A OG1 PHE 274.A O no hydrogen 2.597 N/A LEU 279.A N TYR 275.A O no hydrogen 2.982 N/A SER 280.A N GLN 276.A O no hydrogen 2.778 N/A SER 280.A OG GLN 276.A O no hydrogen 3.082 N/A PHE 281.A N ASP 277.A O no hydrogen 2.950 N/A LEU 282.A N LEU 279.A O no hydrogen 3.045 N/A LYS 283.A N LEU 279.A O no hydrogen 2.921 N/A LYS 283.A N SER 280.A O no hydrogen 3.307 N/A LYS 283.A NZ ASP 287.A OD1 no hydrogen 3.454 N/A LYS 283.A NZ ASP 287.A OD2 no hydrogen 2.776 N/A SER 284.A N SER 280.A O no hydrogen 3.334 N/A ASP 287.A N LYS 283.A O no hydrogen 2.675 N/A LEU 288.A N SER 284.A O no hydrogen 2.869 N/A CYS 289.A N ASN 285.A O no hydrogen 2.894 N/A TYR 290.A N ALA 286.A O no hydrogen 2.679 N/A GLY 291.A N ASP 287.A O no hydrogen 2.833 N/A ALA 292.A N LEU 288.A O no hydrogen 3.209 N/A LEU 293.A N CYS 289.A O no hydrogen 3.174 N/A SER 294.A N TYR 290.A O no hydrogen 2.878 N/A ALA 295.A N GLY 291.A O no hydrogen 2.767 N/A ILE 296.A N ALA 292.A O no hydrogen 3.143 N/A GLN 300.A N GLY 313.A O no hydrogen 2.842 N/A VAL 302.A N MET 311.A O no hydrogen 2.716 N/A SER 305.A N GLY 159.A O no hydrogen 2.864 N/A GLY 306.A N GLY 159.A O no hydrogen 3.142 N/A ALA 307.A N MET 190.A O no hydrogen 3.091 N/A TYR 309.A OH TYR 187.A OH no hydrogen 2.604 N/A LEU 310.A N VAL 354.A O no hydrogen 3.181 N/A VAL 312.A N PHE 352.A O no hydrogen 3.282 N/A GLY 313.A N GLN 300.A O no hydrogen 3.060 N/A ILE 314.A N ASN 350.A O no hydrogen 2.875 N/A GLU 315.A N GLY 298.A O no hydrogen 3.069 N/A GLU 317.A N GLU 315.A O no hydrogen 2.306 N/A HIS 318.A N GLU 315.A O no hydrogen 3.391 N/A GLU 323.A N GLU 327.A OE1 no hydrogen 3.168 N/A PHE 328.A N ASN 324.A O no hydrogen 2.944 N/A THR 329.A N ASP 325.A O no hydrogen 3.068 N/A THR 329.A OG1 ASP 325.A O no hydrogen 3.291 N/A THR 329.A OG1 VAL 326.A O no hydrogen 3.082 N/A ARG 331.A N GLU 327.A O no hydrogen 2.936 N/A LEU 332.A N PHE 328.A O no hydrogen 2.963 N/A ILE 333.A N THR 329.A O no hydrogen 2.691 N/A ALA 334.A N GLU 330.A O no hydrogen 3.050 N/A GLU 335.A N ARG 331.A O no hydrogen 2.786 N/A GLN 336.A N LEU 332.A O no hydrogen 2.856 N/A GLN 336.A NE2 GLU 335.A O no hydrogen 3.557 N/A SER 337.A N LEU 332.A O no hydrogen 3.265 N/A SER 337.A OG ASN 5.A O no hydrogen 2.870 N/A SER 337.A OG LYS 8.A O no hydrogen 3.351 N/A HIS 339.A N ILE 11.A O no hydrogen 2.736 N/A LEU 341.A N ARG 353.A O no hydrogen 3.393 N/A ALA 343.A N PHE 351.A O no hydrogen 2.688 N/A THR 344.A N ASP 325.A OD2 no hydrogen 3.325 N/A THR 344.A OG1 ASP 325.A OD1 no hydrogen 3.238 N/A THR 344.A OG1 ASP 325.A OD2 no hydrogen 3.171 N/A CYS 345.A N PRO 342.A O no hydrogen 3.310 N/A CYS 345.A SG PRO 342.A O no hydrogen 3.428 N/A PHE 346.A N ALA 343.A O no hydrogen 3.080 N/A GLU 347.A N THR 344.A O no hydrogen 2.572 N/A TYR 348.A N ALA 343.A O no hydrogen 3.022 N/A ASN 350.A N ASP 325.A OD1 no hydrogen 2.873 N/A PHE 352.A N VAL 312.A O no hydrogen 3.367 N/A ARG 353.A N LEU 341.A O no hydrogen 2.833 N/A ARG 353.A NH1 ASN 156.A OD1 no hydrogen 2.790 N/A ARG 353.A NH2 SER 14.A O no hydrogen 2.463 N/A VAL 354.A N LEU 310.A O no hydrogen 3.381 N/A VAL 355.A N LEU 13.A O no hydrogen 2.876 N/A ILE 356.A N MET 308.A O no hydrogen 3.004 N/A MET 362.A N PRO 359.A O no hydrogen 2.908 N/A MET 363.A N PRO 359.A O no hydrogen 2.628 N/A LEU 364.A N GLU 360.A O no hydrogen 2.598 N/A ALA 366.A N MET 362.A O no hydrogen 2.757 N/A CYS 367.A N MET 363.A O no hydrogen 2.778 N/A CYS 367.A SG MET 363.A O no hydrogen 3.380 N/A SER 368.A N LEU 364.A O no hydrogen 3.363 N/A SER 368.A OG GLU 365.A O no hydrogen 3.089 N/A ARG 369.A N GLU 365.A O no hydrogen 3.382 N/A ARG 369.A NH1 THR 9.A O no hydrogen 2.646 N/A ILE 370.A N ALA 366.A O no hydrogen 3.197 N/A GLN 371.A N CYS 367.A O no hydrogen 3.086 N/A GLU 372.A N SER 368.A O no hydrogen 2.658 N/A PHE 373.A N ARG 369.A O no hydrogen 3.013 N/A CYS 374.A N GLN 371.A O no hydrogen 3.035 N/A CYS 374.A SG ILE 370.A O no hydrogen 3.433 N/A GLU 375.A N GLN 371.A O no hydrogen 3.003 N/A HIS 377.A ND1 PHE 373.A O no hydrogen 2.826 N/A TYR 378.A N CYS 374.A O no hydrogen 3.338 N/A