Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3x1d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N SER 81.A OG no hydrogen 2.734 N/A VAL 6.A N MET 79.A O no hydrogen 2.644 N/A SER 10.A N VAL 16.A O no hydrogen 3.388 N/A PHE 15.A N THR 14.A OG1 no hydrogen 2.183 N/A ASN 18.A N ASN 8.A O no hydrogen 2.793 N/A LEU 22.A N ASN 18.A O no hydrogen 2.992 N/A SER 23.A N GLU 19.A O no hydrogen 2.986 N/A SER 23.A OG ASP 20.A O no hydrogen 2.498 N/A GLU 24.A N ASP 20.A O no hydrogen 2.287 N/A LEU 26.A N LEU 22.A O no hydrogen 3.282 N/A MET 27.A N SER 23.A O no hydrogen 3.465 N/A ARG 28.A N VAL 25.A O no hydrogen 3.289 N/A GLU 30.A N ARG 28.A O no hydrogen 2.316 N/A PHE 35.A N VAL 267.A O no hydrogen 2.402 N/A CYS 37.A N SER 119.A OG no hydrogen 2.803 N/A CYS 37.A SG VAL 258.A O no hydrogen 3.137 N/A VAL 39.A N ILE 97.A O no hydrogen 3.118 N/A SER 40.A N VAL 120.A O no hydrogen 2.725 N/A SER 40.A OG SER 114.A OG no hydrogen 2.539 N/A VAL 41.A N LEU 99.A O no hydrogen 3.454 N/A ALA 42.A N ILE 122.A O no hydrogen 2.748 N/A LYS 47.A NZ ARG 46.A O no hydrogen 2.836 N/A SER 50.A OG ASP 100.A OD1 no hydrogen 2.726 N/A PHE 51.A N LYS 49.A O no hydrogen 2.468 N/A LEU 53.A N LYS 49.A O no hydrogen 3.286 N/A PHE 55.A N LEU 52.A O no hydrogen 3.335 N/A PHE 56.A N LEU 52.A O no hydrogen 3.155 N/A PHE 56.A N LEU 53.A O no hydrogen 2.686 N/A LEU 57.A N LEU 53.A O no hydrogen 3.258 N/A TYR 59.A N LEU 57.A O no hydrogen 2.360 N/A MET 60.A N LEU 57.A O no hydrogen 2.611 N/A TYR 61.A N LEU 57.A O no hydrogen 2.869 N/A SER 62.A N MET 60.A O no hydrogen 2.367 N/A LYS 63.A N MET 60.A O no hydrogen 2.945 N/A THR 74.A N GLU 71.A O no hydrogen 3.161 N/A MET 79.A N VAL 6.A O no hydrogen 3.071 N/A TRP 80.A N LEU 98.A O no hydrogen 3.374 N/A SER 81.A N VAL 4.A O no hydrogen 2.598 N/A SER 81.A OG VAL 4.A O no hydrogen 2.876 N/A PHE 84.A N ILE 96.A O no hydrogen 3.208 N/A TYR 88.A N ASP 92.A O no hydrogen 2.531 N/A LYS 93.A NZ HIS 86.A O no hydrogen 2.506 N/A ILE 97.A N CYS 37.A O no hydrogen 2.297 N/A LEU 99.A N VAL 39.A O no hydrogen 3.212 N/A THR 101.A N VAL 41.A O no hydrogen 3.453 N/A THR 109.A OG1 ALA 108.A O no hydrogen 2.491 N/A THR 115.A N LEU 113.A O no hydrogen 2.384 N/A THR 115.A OG1 PHE 111.A O no hydrogen 2.271 N/A THR 115.A OG1 SER 114.A O no hydrogen 2.435 N/A MET 116.A N ALA 112.A O no hydrogen 2.527 N/A LEU 117.A N LEU 113.A O no hydrogen 2.727 N/A SER 119.A N VAL 38.A O no hydrogen 2.827 N/A SER 119.A OG VAL 38.A O no hydrogen 2.750 N/A SER 119.A OG VAL 258.A O no hydrogen 2.942 N/A VAL 120.A N VAL 38.A O no hydrogen 3.054 N/A GLN 121.A N ARG 158.A O no hydrogen 2.880 N/A ILE 122.A N SER 40.A O no hydrogen 2.804 N/A TYR 123.A N GLN 160.A O no hydrogen 2.854 N/A TYR 123.A OH ASP 133.A O no hydrogen 2.966 N/A ASN 124.A N ALA 42.A O no hydrogen 2.416 N/A ASN 124.A ND2 LYS 47.A O no hydrogen 3.152 N/A LEU 125.A N LEU 162.A O no hydrogen 2.925 N/A GLN 127.A N ARG 164.A O no hydrogen 3.074 N/A GLN 130.A N ASP 133.A OD2 no hydrogen 3.222 N/A GLN 135.A N ASP 132.A O no hydrogen 2.830 N/A LEU 137.A N LEU 134.A O no hydrogen 3.426 N/A PHE 140.A N GLN 138.A O no hydrogen 2.418 N/A THR 141.A N GLN 138.A O no hydrogen 2.794 N/A THR 141.A OG1 GLN 138.A O no hydrogen 2.925 N/A TYR 143.A OH THR 298.A OG1 no hydrogen 3.260 N/A GLY 144.A N PHE 140.A O no hydrogen 2.641 N/A ARG 145.A N GLU 142.A O no hydrogen 2.565 N/A ARG 145.A NH1 GLU 142.A OE2 no hydrogen 2.384 N/A LEU 146.A N GLU 142.A O no hydrogen 2.979 N/A ALA 147.A N TYR 143.A O no hydrogen 3.389 N/A LEU 148.A N GLY 144.A O no hydrogen 2.418 N/A ALA 149.A N ARG 145.A O no hydrogen 3.010 N/A ASP 150.A N LEU 146.A O no hydrogen 2.611 N/A THR 151.A OG1 ALA 147.A O no hydrogen 3.245 N/A THR 151.A OG1 LYS 153.A O no hydrogen 2.848 N/A GLY 152.A N ALA 147.A O no hydrogen 3.149 N/A LYS 153.A N THR 151.A OG1 no hydrogen 2.436 N/A LYS 154.A NZ SER 205.A O no hydrogen 3.316 N/A LYS 154.A NZ PHE 208.A O no hydrogen 2.957 N/A GLN 157.A NE2 TYR 259.A O no hydrogen 3.393 N/A LEU 159.A N GLU 210.A O no hydrogen 2.898 N/A GLN 160.A N GLN 121.A O no hydrogen 2.512 N/A PHE 161.A N ALA 212.A O no hydrogen 2.843 N/A LEU 162.A N TYR 123.A O no hydrogen 3.067 N/A VAL 163.A N PHE 214.A O no hydrogen 2.566 N/A ARG 164.A N LEU 125.A O no hydrogen 2.933 N/A ARG 164.A NH1 GLY 48.A O no hydrogen 3.351 N/A ARG 164.A NH2 GLY 48.A O no hydrogen 2.728 N/A TRP 166.A NE1 ALA 172.A O no hydrogen 2.819 N/A SER 167.A OG ASP 165.A O no hydrogen 2.827 N/A GLU 171.A N PHE 168.A O no hydrogen 3.090 N/A ALA 172.A N PHE 168.A O no hydrogen 3.147 N/A TYR 174.A N GLU 173.A OE2 no hydrogen 3.106 N/A GLY 175.A N LEU 215.A O no hydrogen 3.211 N/A GLY 178.A N GLY 175.A O no hydrogen 3.035 N/A GLY 179.A N GLY 175.A O no hydrogen 2.688 N/A ASP 180.A N ALA 176.A O no hydrogen 3.193 N/A LYS 181.A N GLY 178.A O no hydrogen 3.147 N/A ILE 182.A N GLY 178.A O no hydrogen 3.081 N/A LEU 183.A N GLY 179.A O no hydrogen 3.106 N/A ARG 185.A N LYS 181.A O no hydrogen 3.086 N/A ARG 186.A N ILE 182.A O no hydrogen 3.137 N/A GLU 188.A N ARG 185.A O no hydrogen 2.369 N/A SER 190.A OG GLU 131.A OE2 no hydrogen 2.694 N/A SER 190.A OG SER 190.A O no hydrogen 2.335 N/A ASP 191.A N GLU 188.A O no hydrogen 2.390 N/A LYS 192.A N VAL 189.A O no hydrogen 2.614 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.487 N/A LEU 197.A N GLU 196.A OE1 no hydrogen 3.088 N/A GLN 198.A NE2 GLN 138.A OE1 no hydrogen 3.655 N/A SER 199.A N GLU 196.A O no hydrogen 3.305 N/A SER 199.A OG ASP 191.A OD1 no hydrogen 3.375 N/A ARG 201.A NE GLN 198.A O no hydrogen 3.508 N/A HIS 203.A N LEU 200.A O no hydrogen 3.226 N/A ILE 204.A N LEU 200.A O no hydrogen 3.215 N/A SER 206.A OG HIS 203.A O no hydrogen 2.256 N/A CYS 207.A N ILE 204.A O no hydrogen 2.819 N/A CYS 207.A SG THR 141.A O no hydrogen 3.983 N/A CYS 207.A SG HIS 203.A O no hydrogen 3.465 N/A CYS 207.A SG SER 206.A OG no hydrogen 3.048 N/A PHE 208.A N SER 205.A O no hydrogen 2.981 N/A THR 209.A N PHE 156.A O no hydrogen 3.282 N/A GLU 210.A N GLN 157.A O no hydrogen 2.573 N/A ALA 212.A N LEU 159.A O no hydrogen 3.093 N/A CYS 213.A SG PHE 161.A O no hydrogen 3.784 N/A PHE 214.A N PHE 161.A O no hydrogen 2.608 N/A MET 216.A N VAL 163.A O no hydrogen 2.397 N/A ASN 222.A N ASN 222.A OD1 no hydrogen 2.405 N/A ASN 222.A ND2 ASP 235.A O no hydrogen 3.053 N/A VAL 223.A N ASN 222.A OD1 no hydrogen 3.256 N/A ALA 224.A N GLY 220.A O no hydrogen 2.990 N/A THR 225.A N LEU 221.A O no hydrogen 3.028 N/A THR 225.A OG1 LEU 221.A O no hydrogen 2.046 N/A ASN 226.A N VAL 223.A O no hydrogen 3.405 N/A ASN 226.A ND2 ASN 222.A O no hydrogen 2.350 N/A ASP 235.A N ASP 235.A OD1 no hydrogen 2.153 N/A ILE 236.A N LEU 233.A O no hydrogen 3.445 N/A THR 237.A OG1 PRO 219.A O no hydrogen 2.278 N/A LYS 241.A N THR 237.A O no hydrogen 3.329 N/A LYS 241.A NZ LEU 233.A O no hydrogen 2.266 N/A LYS 241.A NZ ILE 236.A O no hydrogen 3.227 N/A SER 242.A N PRO 238.A O no hydrogen 2.945 N/A SER 243.A N PHE 240.A O no hydrogen 2.815 N/A LEU 244.A N PHE 240.A O no hydrogen 3.060 N/A ARG 245.A N LYS 241.A O no hydrogen 3.254 N/A LEU 247.A N SER 243.A O no hydrogen 2.464 N/A VAL 248.A N LEU 244.A O no hydrogen 2.787 N/A LEU 251.A N LEU 247.A O no hydrogen 3.266 N/A LEU 251.A N VAL 248.A O no hydrogen 3.259 N/A LEU 252.A N VAL 248.A O no hydrogen 2.946 N/A ASN 256.A N ALA 253.A O no hydrogen 2.921 N/A ASN 256.A ND2 PRO 249.A O no hydrogen 3.666 N/A ASN 256.A ND2 LEU 252.A O no hydrogen 3.395 N/A SER 263.A OG ASN 302.A OD1 no hydrogen 2.990 N/A GLY 264.A N ILE 262.A O no hydrogen 2.379 N/A GLN 265.A N ILE 262.A O no hydrogen 2.666 N/A GLN 265.A NE2 ARG 353.A O no hydrogen 2.748 N/A ARG 266.A NH1 GLU 261.A OE2 no hydrogen 3.515 N/A LEU 272.A N ALA 269.A O no hydrogen 3.165 N/A GLN 274.A N ASP 271.A O no hydrogen 2.951 N/A TYR 275.A N ASP 271.A O no hydrogen 3.044 N/A PHE 276.A N LEU 272.A O no hydrogen 2.626 N/A GLN 277.A NE2 GLN 274.A OE1 no hydrogen 3.590 N/A SER 278.A N GLN 274.A O no hydrogen 3.023 N/A SER 278.A OG GLN 274.A O no hydrogen 2.494 N/A SER 278.A OG GLN 274.A OE1 no hydrogen 3.359 N/A TYR 279.A N TYR 275.A O no hydrogen 3.366 N/A TYR 279.A OH THR 298.A OG1 no hydrogen 3.259 N/A MET 280.A N PHE 276.A O no hydrogen 3.377 N/A ASN 281.A N SER 278.A O no hydrogen 3.110 N/A ASN 281.A ND2 GLU 287.A OE2 no hydrogen 3.357 N/A TYR 283.A N ASN 281.A O no hydrogen 2.509 N/A GLY 285.A N GLU 290.A OE2 no hydrogen 2.505 N/A ASN 286.A ND2 ASN 286.A O no hydrogen 2.617 N/A LYS 292.A NZ GLU 290.A O no hydrogen 3.237 N/A SER 293.A N PRO 291.A O no hydrogen 2.112 N/A THR 298.A N MET 294.A O no hydrogen 2.769 N/A THR 298.A OG1 TYR 143.A OH no hydrogen 3.260 N/A THR 298.A OG1 TYR 279.A OH no hydrogen 3.259 N/A ALA 299.A N LEU 295.A O no hydrogen 3.373 N/A GLU 300.A N VAL 296.A O no hydrogen 3.019 N/A ALA 301.A N THR 298.A O no hydrogen 3.039 N/A ASN 302.A N THR 298.A O no hydrogen 2.486 N/A ASN 302.A ND2 TYR 275.A OH no hydrogen 3.540 N/A THR 305.A OG1 ALA 301.A O no hydrogen 2.530 N/A ALA 306.A N HIS 303.A O no hydrogen 3.024 N/A VAL 307.A N HIS 303.A O no hydrogen 3.357 N/A ALA 308.A N LEU 304.A O no hydrogen 3.370 N/A ALA 310.A N ALA 306.A O no hydrogen 2.609 N/A TYR 314.A OH HIS 338.A ND1 no hydrogen 2.590 N/A GLY 315.A N LYS 311.A O no hydrogen 3.384 N/A GLN 316.A N GLU 312.A O no hydrogen 2.981 N/A LEU 317.A N GLY 315.A O no hydrogen 2.631 N/A MET 318.A N TYR 314.A O no hydrogen 2.839 N/A MET 318.A N GLY 315.A O no hydrogen 2.856 N/A GLU 319.A N GLU 319.A OE1 no hydrogen 2.769 N/A CYS 322.A N MET 318.A O no hydrogen 2.403 N/A CYS 322.A SG GLU 337.A OE1 no hydrogen 3.344 N/A LEU 329.A N PRO 327.A O no hydrogen 3.022 N/A THR 331.A OG1 HIS 333.A ND1 no hydrogen 2.300 N/A HIS 333.A N THR 331.A OG1 no hydrogen 2.419 N/A HIS 333.A ND1 THR 331.A OG1 no hydrogen 2.300 N/A GLU 337.A N HIS 333.A O no hydrogen 3.089 N/A HIS 338.A N LEU 334.A O no hydrogen 2.396 N/A LEU 339.A N GLN 335.A O no hydrogen 2.556 N/A ARG 340.A N THR 336.A O no hydrogen 3.414 N/A VAL 341.A N GLU 337.A O no hydrogen 3.386 N/A LYS 342.A N HIS 338.A O no hydrogen 2.778 N/A LYS 342.A NZ GLU 373.A OE1 no hydrogen 2.384 N/A ASP 343.A N LEU 339.A O no hydrogen 2.594 N/A LYS 344.A N ARG 340.A O no hydrogen 2.673 N/A ALA 345.A N VAL 341.A O no hydrogen 2.664 N/A LEU 346.A N ASP 343.A O no hydrogen 2.559 N/A PHE 347.A N ASP 343.A O no hydrogen 2.242 N/A GLN 348.A N LYS 344.A O no hydrogen 2.748 N/A PHE 349.A N LEU 346.A O no hydrogen 3.134 N/A ALA 350.A N LEU 346.A O no hydrogen 3.426 N/A ARG 353.A N GLN 265.A OE1 no hydrogen 3.382 N/A GLU 362.A N GLU 358.A O no hydrogen 3.302 N/A PHE 364.A N THR 361.A O no hydrogen 2.594 N/A LYS 366.A N GLU 362.A O no hydrogen 3.239 N/A LEU 368.A N ARG 365.A O no hydrogen 2.994 N/A GLU 369.A N ARG 365.A O no hydrogen 3.001 N/A ASP 370.A N LYS 366.A O no hydrogen 3.314 N/A ASP 371.A N LEU 368.A O no hydrogen 2.720 N/A LEU 372.A N LEU 368.A O no hydrogen 2.352 N/A GLU 373.A N GLU 369.A O no hydrogen 2.437 N/A THR 377.A OG1 GLU 373.A O no hydrogen 3.156 N/A THR 377.A OG1 GLU 374.A OE1 no hydrogen 2.978 N/A ASN 378.A ND2 GLU 374.A O no hydrogen 3.004 N/A