Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2irm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N TRP 2.A O no hydrogen 3.017 N/A CYS 9.A N LEU 40.A O no hydrogen 3.359 N/A CYS 9.A SG THR 12.A OG1 no hydrogen 3.216 N/A CYS 9.A SG TYR 50.A OH no hydrogen 2.942 N/A THR 12.A N CYS 9.A O no hydrogen 3.278 N/A GLY 13.A N ILE 334.A O no hydrogen 2.953 N/A GLY 15.A N LEU 332.A O no hydrogen 3.013 N/A ALA 17.A N VAL 330.A O no hydrogen 2.993 N/A ASN 19.A N ASP 329.A OD1 no hydrogen 3.105 N/A ASN 19.A ND2 GLU 33.A O no hydrogen 3.380 N/A ASN 19.A ND2 ASP 329.A OD1 no hydrogen 3.248 N/A ASN 19.A ND2 ASP 329.A OD2 no hydrogen 3.325 N/A GLN 20.A N ARG 327.A O no hydrogen 2.835 N/A ILE 21.A N CYS 29.A O no hydrogen 3.045 N/A TYR 22.A N ASN 325.A O no hydrogen 3.010 N/A TYR 22.A OH HIS 308.A ND1 no hydrogen 2.698 N/A LYS 23.A N ARG 27.A O no hydrogen 2.991 N/A GLY 26.A N LYS 23.A O no hydrogen 2.995 N/A ARG 27.A N ASP 25.A OD2 no hydrogen 3.399 N/A ARG 28.A NH1 GLN 20.A OE1 no hydrogen 3.487 N/A CYS 29.A N ILE 21.A O no hydrogen 2.865 N/A GLY 31.A N ASN 19.A O no hydrogen 3.058 N/A SER 34.A OG ASP 36.A O no hydrogen 3.564 N/A SER 34.A OG ASP 329.A OD1 no hydrogen 3.361 N/A ARG 35.A N ASP 329.A OD2 no hydrogen 2.999 N/A ASP 36.A N SER 34.A OG no hydrogen 3.383 N/A LYS 37.A N LEU 53.A O no hydrogen 2.782 N/A CYS 39.A N ALA 51.A O no hydrogen 2.965 N/A CYS 39.A SG LEU 49.A O no hydrogen 3.417 N/A CYS 41.A N LEU 49.A O no hydrogen 2.780 N/A ILE 42.A N LYS 7.A O no hydrogen 3.231 N/A SER 43.A N THR 47.A O no hydrogen 3.006 N/A SER 43.A OG LEU 74.A O no hydrogen 3.085 N/A ASP 44.A N THR 47.A O no hydrogen 3.147 N/A ASN 46.A N ASP 44.A OD2 no hydrogen 2.858 N/A THR 47.A N ASP 44.A OD2 no hydrogen 3.302 N/A SER 48.A N ILE 144.A O no hydrogen 3.187 N/A LEU 49.A N CYS 41.A O no hydrogen 2.747 N/A TYR 50.A N ALA 142.A O no hydrogen 2.783 N/A ALA 51.A N CYS 39.A O no hydrogen 3.076 N/A ILE 52.A N VAL 140.A O no hydrogen 2.901 N/A LEU 53.A N LYS 37.A O no hydrogen 2.727 N/A SER 54.A N SER 138.A O no hydrogen 2.909 N/A SER 54.A OG ASP 36.A OD1 no hydrogen 2.822 N/A GLY 55.A N ARG 35.A O no hydrogen 2.918 N/A HIS 56.A N GLY 136.A O no hydrogen 2.746 N/A ASN 57.A ND2 SER 134.A O no hydrogen 3.198 N/A GLU 63.A N VAL 59.A O no hydrogen 2.974 N/A ASN 64.A N THR 60.A O no hydrogen 3.050 N/A ALA 65.A N VAL 61.A O no hydrogen 2.861 N/A LEU 66.A N ALA 62.A O no hydrogen 3.065 N/A GLN 67.A N GLU 63.A O no hydrogen 3.211 N/A GLU 68.A N ASN 64.A O no hydrogen 3.198 N/A MET 69.A N ALA 65.A O no hydrogen 3.058 N/A ALA 70.A N LEU 66.A O no hydrogen 2.986 N/A ALA 71.A N GLN 67.A O no hydrogen 3.168 N/A GLU 72.A N GLU 68.A O no hydrogen 2.850 N/A LEU 73.A N MET 69.A O no hydrogen 3.050 N/A CYS 81.A N LEU 78.A O no hydrogen 3.409 N/A CYS 81.A SG GLN 77.A O no hydrogen 4.002 N/A CYS 81.A SG LEU 78.A O no hydrogen 3.502 N/A GLU 85.A N THR 83.A OG1 no hydrogen 3.049 N/A VAL 87.A N THR 83.A O no hydrogen 3.150 N/A LYS 88.A N ASP 84.A O no hydrogen 2.851 N/A GLU 89.A N GLU 85.A O no hydrogen 2.916 N/A LEU 90.A N ALA 86.A O no hydrogen 2.873 N/A ILE 91.A N VAL 87.A O no hydrogen 3.125 N/A ARG 92.A N LYS 88.A O no hydrogen 2.825 N/A GLN 93.A N GLU 89.A O no hydrogen 2.908 N/A SER 94.A N LEU 90.A O no hydrogen 3.141 N/A SER 94.A OG GLU 72.A OE1 no hydrogen 3.419 N/A PHE 95.A N ILE 91.A O no hydrogen 3.199 N/A MET 96.A N ARG 92.A O no hydrogen 3.176 N/A SER 97.A N GLN 93.A O no hydrogen 3.069 N/A SER 97.A OG GLU 72.A OE1 no hydrogen 3.047 N/A SER 97.A OG GLN 93.A O no hydrogen 3.191 N/A SER 97.A OG SER 94.A O no hydrogen 3.447 N/A VAL 98.A N PHE 95.A O no hydrogen 3.055 N/A GLU 99.A N PHE 95.A O no hydrogen 3.040 N/A LYS 100.A N MET 96.A O no hydrogen 2.943 N/A GLY 101.A N SER 97.A O no hydrogen 3.279 N/A TYR 102.A N VAL 98.A O no hydrogen 3.149 N/A TYR 102.A OH VAL 135.A O no hydrogen 3.394 N/A PHE 103.A N GLU 99.A O no hydrogen 3.067 N/A ASP 104.A N LYS 100.A O no hydrogen 3.100 N/A SER 105.A N GLY 101.A O no hydrogen 3.074 N/A ILE 106.A N TYR 102.A O no hydrogen 2.972 N/A VAL 110.A N ILE 106.A O no hydrogen 3.147 N/A ALA 111.A N ASN 107.A O no hydrogen 3.474 N/A THR 112.A N PRO 108.A O no hydrogen 2.771 N/A THR 112.A N HIS 109.A O no hydrogen 3.136 N/A THR 112.A OG1 PRO 108.A O no hydrogen 3.204 N/A LYS 113.A N HIS 109.A O no hydrogen 2.922 N/A LYS 113.A NZ ASP 222.A OD2 no hydrogen 3.062 N/A THR 114.A N VAL 110.A O no hydrogen 2.816 N/A ALA 115.A N ALA 111.A O no hydrogen 3.289 N/A ILE 116.A N THR 112.A O no hydrogen 3.131 N/A GLN 117.A N LYS 113.A O no hydrogen 2.869 N/A GLN 117.A NE2 ASP 222.A OD1 no hydrogen 3.338 N/A LEU 118.A N THR 114.A O no hydrogen 2.857 N/A LYS 125.A N LEU 123.A O no hydrogen 2.550 N/A ASP 127.A N GLN 124.A O no hydrogen 3.075 N/A SER 128.A N LYS 125.A O no hydrogen 2.835 N/A SER 128.A OG LYS 125.A O no hydrogen 3.479 N/A ASN 130.A N LEU 126.A O no hydrogen 2.633 N/A ASN 131.A N ASP 127.A O no hydrogen 3.225 N/A ASN 131.A N SER 128.A O no hydrogen 2.916 N/A VAL 135.A N ALA 132.A O no hydrogen 3.026 N/A GLY 136.A N HIS 56.A O no hydrogen 3.279 N/A SER 137.A N ILE 211.A O no hydrogen 2.945 N/A SER 137.A OG SER 54.A O no hydrogen 2.877 N/A SER 137.A OG SER 138.A O no hydrogen 2.685 N/A SER 138.A N SER 54.A O no hydrogen 2.881 N/A ALA 139.A N ILE 154.A O no hydrogen 2.873 N/A VAL 140.A N ILE 52.A O no hydrogen 2.805 N/A LEU 141.A N GLY 152.A O no hydrogen 2.855 N/A ALA 142.A N TYR 50.A O no hydrogen 2.631 N/A LEU 143.A N TYR 150.A O no hydrogen 2.762 N/A ILE 144.A N SER 48.A O no hydrogen 3.071 N/A HIS 145.A N HIS 148.A O no hydrogen 2.798 N/A ARG 146.A N ASN 46.A O no hydrogen 3.447 N/A LEU 149.A N ILE 244.A O no hydrogen 2.774 N/A TYR 150.A N LEU 143.A O no hydrogen 3.058 N/A LEU 151.A N VAL 241.A O no hydrogen 2.930 N/A GLY 152.A N LEU 141.A O no hydrogen 3.044 N/A ASN 153.A N GLU 239.A O no hydrogen 2.918 N/A ILE 154.A N ALA 139.A O no hydrogen 2.972 N/A GLY 155.A N HIS 179.A ND1 no hydrogen 3.068 N/A ASN 156.A N SER 138.A OG no hydrogen 2.618 N/A ASN 156.A ND2 LEU 205.A O no hydrogen 2.820 N/A ASN 156.A ND2 SER 258.A OG no hydrogen 3.354 N/A CYS 157.A SG ILE 52.A O no hydrogen 3.651 N/A CYS 157.A SG SER 54.A OG no hydrogen 3.375 N/A ARG 158.A N MET 256.A O no hydrogen 2.660 N/A ARG 158.A NE ASP 178.A OD1 no hydrogen 2.924 N/A ARG 158.A NH1 ASN 276.A OD1 no hydrogen 2.723 N/A LEU 160.A N VAL 254.A O no hydrogen 2.887 N/A LEU 161.A N THR 173.A O no hydrogen 3.113 N/A CYS 162.A N PHE 252.A O no hydrogen 3.130 N/A LYS 163.A N THR 171.A O no hydrogen 3.033 N/A THR 164.A N ALA 249.A O no hydrogen 3.266 N/A THR 164.A OG1 ASP 168.A OD1 no hydrogen 3.442 N/A THR 164.A OG1 THR 169.A O no hydrogen 2.850 N/A HIS 167.A N ASP 165.A OD2 no hydrogen 3.237 N/A HIS 167.A ND1 ASP 165.A OD2 no hydrogen 3.251 N/A ASP 168.A N ASP 165.A O no hydrogen 3.124 N/A THR 171.A N LYS 163.A O no hydrogen 2.700 N/A THR 171.A OG1 LYS 163.A O no hydrogen 2.901 N/A THR 173.A N LEU 161.A O no hydrogen 2.959 N/A GLN 174.A NE2 SER 176.A O no hydrogen 2.981 N/A GLN 174.A NE2 ASP 178.A OD2 no hydrogen 3.098 N/A LEU 175.A N ALA 159.A O no hydrogen 2.979 N/A SER 176.A N ALA 159.A O no hydrogen 3.456 N/A HIS 179.A N GLY 155.A O no hydrogen 3.121 N/A ASN 183.A N ASN 180.A O no hydrogen 3.008 N/A ALA 187.A N ASN 183.A O no hydrogen 2.982 N/A ALA 188.A N ALA 184.A O no hydrogen 2.654 N/A ARG 189.A N GLU 185.A O no hydrogen 2.893 N/A ARG 189.A NE GLU 186.A OE1 no hydrogen 3.061 N/A ARG 189.A NH1 PRO 233.A O no hydrogen 2.642 N/A ARG 189.A NH2 GLU 186.A OE2 no hydrogen 2.682 N/A ARG 189.A NH2 PRO 233.A O no hydrogen 3.124 N/A LEU 190.A N GLU 186.A O no hydrogen 3.123 N/A PHE 191.A N ALA 187.A O no hydrogen 2.877 N/A ARG 192.A N ALA 188.A O no hydrogen 3.165 N/A ARG 192.A N ARG 189.A O no hydrogen 3.233 N/A LEU 193.A N LEU 190.A O no hydrogen 2.605 N/A GLY 194.A N LEU 190.A O no hydrogen 3.089 N/A GLY 194.A N PHE 191.A O no hydrogen 3.221 N/A LEU 195.A N LEU 190.A O no hydrogen 3.089 N/A ASN 199.A N MET 196.A O no hydrogen 3.029 N/A PHE 200.A N ALA 197.A O no hydrogen 2.802 N/A GLU 201.A N GLN 198.A O no hydrogen 3.501 N/A SER 207.A OG ARG 209.A O no hydrogen 3.328 N/A THR 208.A N HIS 179.A O no hydrogen 2.711 N/A THR 208.A OG1 GLU 186.A OE2 no hydrogen 2.473 N/A ARG 209.A NE GLU 186.A OE2 no hydrogen 3.527 N/A ARG 209.A NH1 GLU 237.A O no hydrogen 2.727 N/A ARG 209.A NH2 GLU 186.A OE1 no hydrogen 2.984 N/A CYS 210.A SG ILE 211.A O no hydrogen 3.817 N/A ILE 211.A N SER 137.A O no hydrogen 2.885 N/A GLY 212.A N GLU 99.A OE1 no hydrogen 2.852 N/A ASN 213.A N VAL 135.A O no hydrogen 3.065 N/A ASN 213.A ND2 TYR 206.A OH no hydrogen 3.177 N/A TYR 214.A N TYR 102.A OH no hydrogen 2.997 N/A LEU 215.A N LEU 133.A O no hydrogen 3.134 N/A GLY 216.A N ASN 213.A O no hydrogen 3.170 N/A LYS 217.A N TYR 214.A O no hydrogen 2.943 N/A LYS 217.A NZ GLU 99.A OE1 no hydrogen 3.299 N/A LYS 217.A NZ GLU 99.A OE2 no hydrogen 2.571 N/A LYS 217.A NZ CYS 210.A O no hydrogen 3.197 N/A LYS 217.A NZ GLY 212.A O no hydrogen 2.501 N/A ALA 218.A N TYR 214.A O no hydrogen 3.167 N/A TYR 220.A OH ALA 229.A O no hydrogen 3.265 N/A LYS 221.A NZ SER 227.A O no hydrogen 3.412 N/A LYS 221.A NZ ALA 229.A O no hydrogen 3.561 N/A CYS 223.A N TYR 220.A O no hydrogen 3.065 N/A CYS 223.A SG ASN 224.A O no hydrogen 3.023 N/A CYS 223.A SG ASN 224.A OD1 no hydrogen 3.906 N/A PHE 225.A N SER 227.A OG no hydrogen 3.272 N/A THR 230.A N LEU 193.A O no hydrogen 2.686 N/A THR 230.A OG1 LEU 193.A O no hydrogen 2.944 N/A VAL 234.A N GLY 216.A O no hydrogen 3.121 N/A GLU 239.A N ASN 153.A O no hydrogen 2.798 N/A VAL 241.A N LEU 151.A O no hydrogen 2.853 N/A ILE 244.A N LEU 149.A O no hydrogen 2.966 N/A CYS 250.A N THR 247.A O no hydrogen 2.940 N/A CYS 250.A SG THR 247.A OG1 no hydrogen 3.450 N/A ARG 251.A N CYS 162.A O no hydrogen 2.837 N/A LEU 253.A N ARG 335.A O no hydrogen 2.672 N/A VAL 254.A N LEU 160.A O no hydrogen 2.825 N/A LEU 255.A N LEU 333.A O no hydrogen 2.738 N/A MET 256.A N ARG 158.A O no hydrogen 2.667 N/A SER 257.A N THR 331.A O no hydrogen 3.281 N/A SER 257.A OG ASP 36.A OD2 no hydrogen 3.041 N/A SER 257.A OG ASP 329.A O no hydrogen 3.363 N/A SER 257.A OG THR 331.A O no hydrogen 3.424 N/A SER 258.A N SER 54.A OG no hydrogen 3.086 N/A CYS 261.A N SER 257.A O no hydrogen 2.988 N/A CYS 261.A SG ASN 156.A O no hydrogen 3.665 N/A CYS 261.A SG SER 257.A O no hydrogen 3.444 N/A ARG 262.A N SER 258.A O no hydrogen 2.842 N/A ARG 262.A NE GLU 266.A OE2 no hydrogen 3.108 N/A ARG 262.A NH1 SER 326.A OG no hydrogen 3.333 N/A ARG 262.A NH1 ASP 328.A OD2 no hydrogen 2.868 N/A ARG 262.A NH2 GLU 266.A OE2 no hydrogen 3.501 N/A ARG 262.A NH2 SER 326.A OG no hydrogen 3.140 N/A ALA 263.A N GLY 259.A O no hydrogen 2.993 N/A LEU 264.A N LEU 260.A O no hydrogen 3.035 N/A HIS 265.A N CYS 261.A O no hydrogen 3.045 N/A GLU 266.A N ARG 262.A O no hydrogen 3.061 N/A ILE 267.A N ALA 263.A O no hydrogen 3.117 N/A ILE 267.A N LEU 264.A O no hydrogen 3.252 N/A SER 273.A OG ASP 271.A O no hydrogen 3.129 N/A SER 273.A OG ASP 271.A OD2 no hydrogen 3.162 N/A THR 274.A OG1 GLY 270.A O no hydrogen 2.646 N/A ASN 276.A ND2 GLN 174.A OE1 no hydrogen 3.589 N/A ASN 276.A ND2 ALA 272.A O no hydrogen 3.511 N/A ARG 277.A N SER 273.A O no hydrogen 3.314 N/A GLU 278.A N THR 274.A O no hydrogen 3.078 N/A LEU 279.A N GLY 275.A O no hydrogen 2.900 N/A VAL 280.A N ASN 276.A O no hydrogen 2.856 N/A ARG 281.A N ARG 277.A O no hydrogen 2.737 N/A MET 282.A N GLU 278.A O no hydrogen 3.233 N/A ILE 283.A N LEU 279.A O no hydrogen 2.928 N/A SER 284.A N VAL 280.A O no hydrogen 3.386 N/A SER 284.A OG VAL 280.A O no hydrogen 3.206 N/A SER 284.A OG ARG 281.A O no hydrogen 2.889 N/A GLU 285.A N ARG 281.A O no hydrogen 2.880 N/A GLU 286.A N ILE 283.A O no hydrogen 2.714 N/A PHE 287.A N ILE 283.A O no hydrogen 3.063 N/A GLN 288.A NE2 SER 284.A O no hydrogen 3.566 N/A ASN 289.A N GLU 286.A O no hydrogen 3.095 N/A GLN 290.A N GLU 286.A O no hydrogen 2.674 N/A GLY 295.A N THR 292.A OG1 no hydrogen 3.364 N/A VAL 296.A N THR 292.A O no hydrogen 2.977 N/A ALA 297.A N LEU 293.A O no hydrogen 3.198 N/A GLN 298.A N GLY 294.A O no hydrogen 3.003 N/A GLN 298.A NE2 GLU 16.A O no hydrogen 2.806 N/A SER 299.A N GLY 295.A O no hydrogen 2.916 N/A SER 299.A OG GLU 286.A OE1 no hydrogen 3.451 N/A VAL 300.A N VAL 296.A O no hydrogen 3.180 N/A VAL 301.A N ALA 297.A O no hydrogen 3.204 N/A HIS 302.A N GLN 298.A O no hydrogen 3.179 N/A ARG 303.A N SER 299.A O no hydrogen 2.980 N/A ILE 304.A N VAL 300.A O no hydrogen 3.197 N/A VAL 305.A N VAL 301.A O no hydrogen 3.099 N/A GLN 306.A N ARG 303.A O no hydrogen 3.177 N/A ALA 307.A N ARG 303.A O no hydrogen 2.746 N/A HIS 308.A N ILE 304.A O no hydrogen 2.551 N/A HIS 308.A ND1 TYR 22.A OH no hydrogen 2.698 N/A HIS 308.A NE2 GLU 266.A OE1 no hydrogen 2.859 N/A HIS 309.A N VAL 305.A O no hydrogen 3.076 N/A ASP 310.A N GLN 306.A O no hydrogen 2.809 N/A THR 311.A N ALA 307.A O no hydrogen 3.168 N/A THR 311.A OG1 ALA 307.A O no hydrogen 2.717 N/A TYR 312.A N HIS 308.A O no hydrogen 3.001 N/A MET 313.A N HIS 309.A O no hydrogen 2.831 N/A GLN 314.A N ASP 310.A O no hydrogen 2.567 N/A LEU 315.A N TYR 312.A O no hydrogen 3.080 N/A VAL 316.A N TYR 312.A O no hydrogen 2.987 N/A GLU 317.A N MET 313.A O no hydrogen 2.966 N/A SER 321.A N HIS 319.A O no hydrogen 2.662 N/A SER 321.A OG HIS 319.A O no hydrogen 2.890 N/A ARG 327.A N GLN 20.A O no hydrogen 2.699 N/A ARG 327.A NH2 ILE 18.A O no hydrogen 2.950 N/A VAL 330.A N ALA 17.A O no hydrogen 2.819 N/A THR 331.A N SER 257.A OG no hydrogen 2.900 N/A THR 331.A OG1 ASP 36.A OD2 no hydrogen 3.019 N/A LEU 332.A N GLY 15.A O no hydrogen 2.895 N/A LEU 333.A N LEU 255.A O no hydrogen 3.043 N/A ILE 334.A N GLY 13.A O no hydrogen 3.023 N/A ARG 335.A N LEU 253.A O no hydrogen 2.875 N/A ARG 335.A NE TYR 50.A OH no hydrogen 2.759 N/A ASN 336.A N GLN 11.A O no hydrogen 2.827 N/A PHE 337.A N ARG 251.A O no hydrogen 2.890 N/A ASN 338.A N ARG 251.A O no hydrogen 2.719 N/A ASN 338.A ND2 PRO 248.A O no hydrogen 2.991 N/A