Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fe4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 THR 3.A O no hydrogen 2.487 N/A HIS 6.A N GLU 36.A O no hydrogen 2.964 N/A ARG 7.A NH2 LEU 47.A O no hydrogen 3.313 N/A THR 9.A N GLY 50.A O no hydrogen 2.822 N/A THR 9.A OG1 GLY 50.A O no hydrogen 3.531 N/A LEU 10.A N PHE 40.A O no hydrogen 2.986 N/A LEU 11.A N ILE 52.A O no hydrogen 2.584 N/A ASN 13.A N ASP 19.A OD2 no hydrogen 2.911 N/A ASN 13.A ND2 ASN 15.A OD1 no hydrogen 3.458 N/A TYR 18.A OH ASP 56.A OD2 no hydrogen 3.010 N/A ASP 19.A N LYS 16.A O no hydrogen 3.082 N/A ARG 20.A N LYS 16.A O no hydrogen 3.193 N/A GLN 21.A N ALA 17.A O no hydrogen 2.553 N/A VAL 23.A N ASP 19.A O no hydrogen 3.173 N/A GLY 25.A N GLN 21.A O no hydrogen 2.925 N/A VAL 26.A N VAL 22.A O no hydrogen 3.016 N/A VAL 26.A N VAL 23.A O no hydrogen 2.944 N/A GLY 27.A N VAL 23.A O no hydrogen 3.104 N/A GLU 28.A N GLY 25.A O no hydrogen 2.919 N/A TYR 29.A N GLY 25.A O no hydrogen 3.237 N/A LEU 30.A N VAL 26.A O no hydrogen 3.043 N/A GLN 31.A N GLU 28.A O no hydrogen 3.165 N/A SER 33.A N TYR 29.A O no hydrogen 3.293 N/A SER 33.A OG TYR 29.A O no hydrogen 2.469 N/A SER 33.A OG SER 35.A OG no hydrogen 2.823 N/A GLN 34.A N LEU 30.A O no hydrogen 2.746 N/A ASP 38.A N HIS 6.A O no hydrogen 3.027 N/A PHE 40.A N ILE 8.A O no hydrogen 2.732 N/A ASP 49.A N ARG 7.A O no hydrogen 2.873 N/A VAL 51.A N PRO 70.A O no hydrogen 2.910 N/A ALA 53.A N VAL 72.A O no hydrogen 3.452 N/A ASP 54.A N LEU 11.A O no hydrogen 2.955 N/A PHE 55.A N VAL 74.A O no hydrogen 2.786 N/A GLN 59.A NE2 ASP 57.A OD1 no hydrogen 2.860 N/A ILE 60.A N ASP 57.A O no hydrogen 3.188 N/A GLU 61.A N LYS 58.A O no hydrogen 2.921 N/A GLN 62.A N LYS 58.A O no hydrogen 3.045 N/A GLY 73.A N HIS 88.A O no hydrogen 3.183 N/A VAL 74.A N ALA 53.A O no hydrogen 2.765 N/A GLY 76.A N ASP 56.A OD1 no hydrogen 2.523 N/A SER 77.A N THR 92.A O no hydrogen 2.531 N/A SER 77.A OG ASP 93.A OD1 no hydrogen 2.862 N/A TYR 78.A N TYR 84.A OH no hydrogen 3.084 N/A HIS 79.A N GLU 129.A OE2 no hydrogen 3.288 N/A SER 83.A N LEU 80.A O no hydrogen 2.917 N/A ILE 90.A N GLY 73.A O no hydrogen 2.834 N/A ALA 91.A N ILE 255.A O no hydrogen 3.179 N/A THR 92.A N GLY 75.A O no hydrogen 2.798 N/A THR 92.A OG1 GLN 228.A OE1 no hydrogen 3.113 N/A ASP 93.A N VAL 257.A O no hydrogen 3.226 N/A ASN 94.A ND2 SER 77.A O no hydrogen 2.687 N/A TYR 95.A OH GLU 99.A OE2 no hydrogen 3.323 N/A LEU 97.A N ASP 93.A O no hydrogen 3.122 N/A LEU 97.A N ASN 94.A O no hydrogen 2.487 N/A VAL 98.A N ASN 94.A O no hydrogen 3.298 N/A GLU 99.A N TYR 95.A O no hydrogen 3.220 N/A SER 100.A N LEU 97.A O no hydrogen 2.738 N/A ALA 101.A N LEU 97.A O no hydrogen 3.172 N/A PHE 102.A N VAL 98.A O no hydrogen 2.981 N/A LEU 103.A N GLU 99.A O no hydrogen 3.349 N/A HIS 104.A N SER 100.A O no hydrogen 3.485 N/A LEU 105.A N ALA 101.A O no hydrogen 2.997 N/A LEU 105.A N PHE 102.A O no hydrogen 2.975 N/A LYS 106.A N PHE 102.A O no hydrogen 3.150 N/A GLU 107.A N LEU 103.A O no hydrogen 2.616 N/A LYS 108.A N HIS 104.A O no hydrogen 3.140 N/A LYS 108.A NZ GLU 264.A OE2 no hydrogen 2.936 N/A GLY 109.A N LEU 105.A O no hydrogen 2.777 N/A ALA 114.A N GLY 177.A O no hydrogen 2.834 N/A PHE 115.A N VAL 146.A O no hydrogen 2.842 N/A TYR 116.A N ILE 179.A O no hydrogen 2.637 N/A TYR 116.A OH HIS 188.A ND1 no hydrogen 3.184 N/A GLY 117.A N TYR 148.A O no hydrogen 2.990 N/A SER 122.A N PRO 119.A O no hydrogen 3.109 N/A ARG 125.A NH1 TYR 78.A OH no hydrogen 3.110 N/A THR 128.A OG1 GLU 120.A OE1 no hydrogen 3.027 N/A THR 128.A OG1 GLU 120.A OE2 no hydrogen 3.073 N/A ARG 130.A N TRP 126.A O no hydrogen 2.913 N/A ARG 130.A N ALA 127.A O no hydrogen 2.939 N/A ARG 130.A NE ASN 94.A OD1 no hydrogen 2.891 N/A GLU 131.A N THR 128.A O no hydrogen 2.637 N/A TYR 132.A N THR 128.A O no hydrogen 3.156 N/A ALA 133.A N GLU 129.A O no hydrogen 3.328 N/A PHE 134.A N ARG 130.A O no hydrogen 3.116 N/A ARG 135.A N GLU 131.A O no hydrogen 2.980 N/A ARG 135.A NH2 GLU 131.A OE2 no hydrogen 3.464 N/A GLN 136.A N TYR 132.A O no hydrogen 3.087 N/A LEU 137.A N PHE 134.A O no hydrogen 3.054 N/A VAL 138.A N PHE 134.A O no hydrogen 3.160 N/A VAL 138.A N ARG 135.A O no hydrogen 3.056 N/A ALA 139.A N ARG 135.A O no hydrogen 3.178 N/A GLU 141.A N VAL 138.A O no hydrogen 2.795 N/A TYR 148.A N PHE 115.A O no hydrogen 3.043 N/A TRP 158.A N GLU 156.A O no hydrogen 2.555 N/A GLN 159.A NE2 ASN 163.A OD1 no hydrogen 2.965 N/A HIS 160.A N ASN 157.A O no hydrogen 2.710 N/A ALA 161.A N ASN 157.A O no hydrogen 3.405 N/A ASN 163.A N HIS 160.A O no hydrogen 2.974 N/A ARG 164.A N HIS 160.A O no hydrogen 2.747 N/A ARG 164.A NH2 ASP 167.A OD2 no hydrogen 3.499 N/A LEU 165.A N ALA 161.A O no hydrogen 2.914 N/A ASP 167.A N ASN 163.A O no hydrogen 3.318 N/A LEU 169.A N LEU 165.A O no hydrogen 3.215 N/A GLN 170.A N ALA 166.A O no hydrogen 3.186 N/A THR 171.A N ASP 167.A O no hydrogen 3.064 N/A THR 171.A OG1 ASP 167.A O no hydrogen 2.728 N/A GLN 175.A N LYS 203.A O no hydrogen 2.436 N/A GLN 175.A NE2 GLU 202.A O no hydrogen 3.601 N/A THR 176.A OG1 PRO 173.A O no hydrogen 2.269 N/A GLY 177.A N ARG 112.A O no hydrogen 2.930 N/A ILE 178.A N CYS 205.A O no hydrogen 2.438 N/A ILE 179.A N ALA 114.A O no hydrogen 2.859 N/A ALA 180.A N ILE 207.A O no hydrogen 2.668 N/A VAL 181.A N TYR 116.A O no hydrogen 3.208 N/A ARG 185.A N THR 182.A OG1 no hydrogen 3.151 N/A ARG 185.A NH1 GLU 152.A O no hydrogen 3.425 N/A ALA 186.A N THR 182.A O no hydrogen 3.020 N/A ARG 187.A N ALA 184.A O no hydrogen 3.131 N/A ARG 187.A NH1 LEU 218.A O no hydrogen 2.717 N/A HIS 188.A ND1 TYR 116.A OH no hydrogen 3.184 N/A LEU 190.A N ALA 186.A O no hydrogen 3.296 N/A GLN 191.A N ARG 187.A O no hydrogen 3.129 N/A VAL 192.A N HIS 188.A O no hydrogen 3.036 N/A CYS 193.A N ILE 189.A O no hydrogen 2.714 N/A HIS 195.A N GLN 191.A O no hydrogen 3.150 N/A HIS 195.A N VAL 192.A O no hydrogen 2.798 N/A LEU 196.A N VAL 192.A O no hydrogen 2.671 N/A ILE 198.A N CYS 193.A O no hydrogen 2.626 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 2.648 N/A LYS 203.A N PRO 199.A O no hydrogen 2.796 N/A LEU 204.A N PRO 199.A O no hydrogen 3.302 N/A CYS 205.A N THR 176.A O no hydrogen 2.512 N/A CYS 205.A SG PRO 201.A O no hydrogen 3.883 N/A CYS 205.A SG SER 267.A O no hydrogen 3.984 N/A VAL 206.A N SER 267.A O no hydrogen 3.263 N/A THR 215.A OG1 GLU 212.A OE1 no hydrogen 2.526 N/A LEU 218.A N THR 215.A O no hydrogen 2.753 N/A SER 219.A OG VAL 221.A O no hydrogen 3.462 N/A ARG 220.A NH2 GLU 194.A OE2 no hydrogen 3.424 N/A SER 224.A N SER 267.A OG no hydrogen 2.588 N/A SER 224.A OG ILE 263.A O no hydrogen 3.163 N/A SER 224.A OG THR 268.A OG1 no hydrogen 2.797 N/A SER 225.A N ILE 263.A O no hydrogen 3.012 N/A SER 225.A OG ASP 183.A OD1 no hydrogen 2.730 N/A SER 225.A OG GLY 208.A O no hydrogen 2.477 N/A SER 225.A OG ILE 209.A O no hydrogen 2.926 N/A SER 225.A OG VAL 226.A O no hydrogen 3.151 N/A VAL 226.A N GLY 208.A O no hydrogen 2.918 N/A ARG 231.A NH2 GLU 24.A OE1 no hydrogen 2.328 N/A MET 233.A N GLY 229.A O no hydrogen 2.738 N/A GLY 234.A N ALA 230.A O no hydrogen 2.942 N/A GLY 234.A N ARG 231.A O no hydrogen 2.982 N/A TYR 235.A N GLN 232.A O no hydrogen 3.228 N/A GLN 236.A N GLN 232.A O no hydrogen 2.920 N/A ALA 237.A N MET 233.A O no hydrogen 3.308 N/A LYS 239.A N TYR 235.A O no hydrogen 3.345 N/A LYS 239.A NZ TYR 235.A OH no hydrogen 3.525 N/A LEU 240.A N GLN 236.A O no hydrogen 2.862 N/A LEU 241.A N ALA 237.A O no hydrogen 2.952 N/A HIS 242.A N ALA 238.A O no hydrogen 3.058 N/A ARG 243.A N LYS 239.A O no hydrogen 3.197 N/A ARG 243.A N LEU 240.A O no hydrogen 2.971 N/A ARG 243.A NH2 GLN 253.A OE1 no hydrogen 3.348 N/A LEU 244.A N LEU 241.A O no hydrogen 2.967 N/A LEU 245.A N HIS 242.A O no hydrogen 3.330 N/A ASP 246.A N HIS 242.A O no hydrogen 3.419 N/A GLU 248.A N ARG 243.A O no hydrogen 3.041 N/A ARG 254.A NE LEU 252.A O no hydrogen 3.316 N/A ARG 254.A NH2 PRO 85.A O no hydrogen 3.362 N/A VAL 257.A N ALA 91.A O no hydrogen 2.848 N/A VAL 260.A N ALA 227.A O no hydrogen 2.690 N/A ARG 265.A N SER 224.A OG no hydrogen 2.956 N/A ARG 265.A NH1 ASN 211.A OD1 no hydrogen 3.533 N/A ARG 265.A NH2 ASN 211.A OD1 no hydrogen 3.318 N/A ARG 266.A NE VAL 200.A O no hydrogen 3.181 N/A SER 267.A N ALA 222.A O no hydrogen 2.743 N/A SER 267.A OG VAL 206.A O no hydrogen 2.982 N/A THR 268.A N ARG 265.A O no hydrogen 3.360 N/A THR 268.A OG1 ARG 265.A O no hydrogen 3.223 N/A ASP 269.A N ARG 266.A O no hydrogen 2.630 N/A ARG 271.A NE ASP 269.A O no hydrogen 2.875 N/A THR 274.A N GLU 316.A OE1 no hydrogen 3.028 N/A THR 274.A OG1 GLU 316.A OE1 no hydrogen 3.400 N/A VAL 278.A N ASP 275.A O no hydrogen 2.800 N/A ILE 279.A N ASP 275.A O no hydrogen 2.656 N/A MET 282.A N VAL 278.A O no hydrogen 2.796 N/A MET 282.A N ILE 279.A O no hydrogen 2.751 N/A HIS 283.A N ILE 279.A O no hydrogen 3.068 N/A TYR 284.A N GLN 280.A O no hydrogen 2.920 N/A ILE 285.A N ALA 281.A O no hydrogen 3.213 N/A ARG 286.A N MET 282.A O no hydrogen 3.070 N/A ARG 286.A NH2 ASP 269.A O no hydrogen 3.062 N/A ASN 287.A N HIS 283.A O no hydrogen 3.113 N/A HIS 288.A N TYR 284.A O no hydrogen 3.047 N/A CYS 290.A SG MET 350.A O no hydrogen 3.207 N/A LYS 291.A N HIS 288.A O no hydrogen 2.824 N/A GLY 292.A N ALA 289.A O no hydrogen 3.018 N/A LEU 299.A N VAL 295.A O no hydrogen 2.813 N/A ASP 300.A N ASP 296.A O no hydrogen 3.327 N/A VAL 302.A N LEU 299.A O no hydrogen 3.110 N/A ILE 304.A N LEU 299.A O no hydrogen 2.661 N/A LEU 309.A N ARG 306.A O no hydrogen 3.319 N/A GLU 310.A N ARG 306.A O no hydrogen 2.777 N/A LYS 311.A N SER 307.A O no hydrogen 2.773 N/A GLU 315.A N ARG 312.A O no hydrogen 2.829 N/A ALA 323.A N THR 320.A OG1 no hydrogen 2.735 N/A MET 324.A N THR 320.A O no hydrogen 2.866 N/A MET 324.A N ILE 321.A O no hydrogen 3.095 N/A ILE 325.A N ILE 321.A O no hydrogen 2.688 N/A GLU 328.A N MET 324.A O no hydrogen 3.291 N/A LYS 329.A N HIS 326.A O no hydrogen 2.815 N/A GLU 331.A N ALA 327.A O no hydrogen 2.977 N/A LYS 332.A NZ ASN 287.A O no hydrogen 3.162 N/A ALA 333.A N LEU 330.A O no hydrogen 2.687 N/A ARG 334.A N LEU 330.A O no hydrogen 2.536 N/A SER 335.A N GLU 331.A O no hydrogen 2.683 N/A SER 335.A OG GLU 331.A O no hydrogen 3.317 N/A ILE 338.A N ARG 334.A O no hydrogen 3.457 N/A ASN 345.A N SER 343.A OG no hydrogen 3.106 N/A GLU 346.A N SER 343.A OG no hydrogen 2.657 N/A MET 350.A N GLU 346.A O no hydrogen 3.306 N/A CYS 351.A SG MET 350.A O no hydrogen 3.461 N/A GLY 352.A N GLN 349.A O no hydrogen 3.283 N/A SER 355.A OG GLN 357.A OE1 no hydrogen 3.354 N/A GLN 357.A N GLN 357.A OE1 no hydrogen 3.350 N/A TYR 358.A N SER 355.A OG no hydrogen 3.226 N/A PHE 359.A N LEU 356.A O no hydrogen 2.540 N/A TYR 360.A N LEU 356.A O no hydrogen 2.662 N/A SER 361.A N GLN 357.A O no hydrogen 2.495 N/A SER 361.A OG GLN 357.A O no hydrogen 2.763 N/A PHE 363.A N TYR 360.A O no hydrogen 3.019 N/A LYS 364.A N TYR 360.A O no hydrogen 3.442 N/A LYS 364.A NZ SER 361.A O no hydrogen 3.350 N/A ALA 366.A N PHE 363.A O no hydrogen 2.806 N/A TYR 367.A N PHE 363.A O no hydrogen 2.788 N/A GLU 373.A N THR 370.A O no hydrogen 3.149 N/A TYR 374.A N THR 370.A O no hydrogen 2.913 N/A ARG 375.A N PRO 371.A O no hydrogen 2.674 N/A ARG 375.A NH1 LEU 336.A O no hydrogen 2.843 N/A SER 379.A OG ILE 338.A O no hydrogen 2.535 N/A SER 379.A OG ARG 375.A O no hydrogen 3.262 N/A