Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n41_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A ND2 ASP 56.A O no hydrogen 2.724 N/A ALA 7.A N VAL 4.A O no hydrogen 3.388 N/A THR 8.A N VAL 4.A O no hydrogen 3.432 N/A THR 8.A OG1 VAL 4.A O no hydrogen 3.557 N/A TYR 11.A N SER 47.A O no hydrogen 3.053 N/A TYR 11.A OH GLU 31.A OE2 no hydrogen 2.800 N/A ALA 13.A N SER 26.A O no hydrogen 3.147 N/A CYS 15.A N CYS 24.A O no hydrogen 3.195 N/A CYS 15.A SG ASP 17.A O no hydrogen 3.346 N/A CYS 18.A N HIS 22.A O no hydrogen 2.901 N/A GLY 19.A N ASP 17.A OD2 no hydrogen 2.999 N/A GLY 21.A N ASP 17.A OD2 no hydrogen 3.029 N/A HIS 22.A N GLY 19.A O no hydrogen 3.439 N/A SER 23.A OG HIS 14.A NE2 no hydrogen 3.091 N/A SER 23.A OG CYS 15.A O no hydrogen 3.016 N/A CYS 24.A N CYS 15.A O no hydrogen 3.266 N/A SER 26.A N ALA 13.A O no hydrogen 2.922 N/A VAL 28.A N SER 26.A OG no hydrogen 3.105 N/A ALA 29.A N SER 47.A OG no hydrogen 3.183 N/A GLU 31.A N GLN 45.A O no hydrogen 2.936 N/A ARG 34.A N LYS 43.A O no hydrogen 2.785 N/A ARG 34.A NE GLU 36.A OE1 no hydrogen 3.018 N/A ARG 34.A NE GLU 36.A OE2 no hydrogen 3.111 N/A ARG 34.A NH1 GLU 161.A OE1 no hydrogen 2.741 N/A ARG 34.A NH2 GLU 36.A OE1 no hydrogen 3.013 N/A ARG 34.A NH2 GLU 161.A OE1 no hydrogen 3.477 N/A ARG 34.A NH2 GLU 161.A OE2 no hydrogen 3.057 N/A GLU 36.A N TYR 152.A OH no hydrogen 3.177 N/A THR 38.A N SER 150.A OG no hydrogen 3.064 N/A THR 38.A OG1 SER 150.A OG no hydrogen 3.287 N/A ASP 39.A N SER 150.A O no hydrogen 3.319 N/A GLY 40.A N ALA 37.A O no hydrogen 3.309 N/A THR 41.A N ASP 39.A OD1 no hydrogen 3.377 N/A THR 41.A OG1 ASP 39.A OD1 no hydrogen 3.015 N/A THR 41.A OG1 ASP 39.A OD2 no hydrogen 2.970 N/A THR 41.A OG1 THR 151.A OG1 no hydrogen 3.330 N/A LEU 42.A N ALA 99.A O no hydrogen 2.942 N/A LYS 43.A N ARG 34.A O no hydrogen 2.914 N/A LYS 43.A NZ GLU 161.A OE1 no hydrogen 2.719 N/A LYS 43.A NZ PRO 254.A O no hydrogen 2.910 N/A LYS 43.A NZ PHE 255.A O no hydrogen 2.782 N/A ILE 44.A N ILE 97.A O no hydrogen 2.831 N/A GLN 45.A N ARG 32.A O no hydrogen 2.835 N/A VAL 46.A N HIS 95.A O no hydrogen 2.765 N/A SER 47.A N ALA 29.A O no hydrogen 2.911 N/A SER 47.A OG TYR 11.A O no hydrogen 2.907 N/A SER 47.A OG SER 26.A O no hydrogen 3.540 N/A GLN 49.A N ARG 64.A O no hydrogen 2.906 N/A GLN 49.A NE2 THR 8.A OG1 no hydrogen 3.233 N/A GLN 49.A NE2 HIS 95.A NE2 no hydrogen 3.155 N/A ILE 50.A N GLY 94.A O no hydrogen 2.814 N/A GLY 51.A N LYS 62.A O no hydrogen 2.990 N/A LYS 53.A N SER 57.A O no hydrogen 2.896 N/A THR 54.A N ASP 73.A OD1 no hydrogen 3.031 N/A THR 54.A OG1 ASP 73.A OD2 no hydrogen 3.543 N/A ASP 56.A N LYS 53.A O no hydrogen 3.008 N/A SER 57.A N ASP 55.A OD1 no hydrogen 3.371 N/A SER 57.A OG ASP 55.A OD1 no hydrogen 2.639 N/A ASP 59.A N GLY 51.A O no hydrogen 2.821 N/A THR 61.A N ASP 59.A OD1 no hydrogen 3.325 N/A THR 61.A OG1 ASP 59.A OD1 no hydrogen 2.649 N/A LYS 62.A N ASP 59.A O no hydrogen 3.046 N/A LYS 62.A NZ THR 61.A OG1 no hydrogen 3.406 N/A LYS 62.A NZ GLU 75.A OE1 no hydrogen 3.490 N/A LYS 62.A NZ GLU 75.A OE2 no hydrogen 3.213 N/A LEU 63.A N ALA 74.A O no hydrogen 2.771 N/A ARG 64.A N GLN 49.A O no hydrogen 2.787 N/A ARG 64.A NE GLN 49.A OE1 no hydrogen 2.802 N/A ARG 64.A NH1 LYS 53.A O no hydrogen 3.041 N/A ARG 64.A NH1 ASP 56.A OD1 no hydrogen 2.944 N/A ARG 64.A NH2 TYR 5.A O no hydrogen 2.733 N/A ARG 64.A NH2 GLN 49.A OE1 no hydrogen 2.814 N/A TYR 65.A N ALA 72.A O no hydrogen 3.108 N/A TYR 65.A OH ASP 67.A OD2 no hydrogen 2.870 N/A ASP 67.A N MET 70.A O no hydrogen 3.055 N/A MET 70.A N ASP 67.A O no hydrogen 3.203 N/A ALA 72.A N TYR 65.A O no hydrogen 2.839 N/A ALA 74.A N LEU 63.A O no hydrogen 2.689 N/A ARG 76.A N THR 61.A O no hydrogen 3.042 N/A ARG 76.A NH1 ARG 76.A O no hydrogen 2.912 N/A LEU 79.A N ARG 76.A O no hydrogen 3.149 N/A PHE 80.A N GLY 110.A O no hydrogen 2.879 N/A ARG 82.A N THR 108.A O no hydrogen 2.829 N/A THR 83.A N ALA 85.A O no hydrogen 3.130 N/A THR 83.A OG1 PRO 102.A O no hydrogen 3.054 N/A SER 84.A OG LYS 103.A O no hydrogen 2.667 N/A CYS 87.A N VAL 81.A O no hydrogen 2.780 N/A THR 88.A N ARG 100.A O no hydrogen 2.972 N/A THR 90.A N LEU 98.A O no hydrogen 2.785 N/A MET 93.A N PHE 96.A O no hydrogen 3.119 N/A GLY 94.A N ILE 50.A O no hydrogen 2.819 N/A HIS 95.A ND1 VAL 46.A O no hydrogen 2.791 N/A PHE 96.A N MET 93.A O no hydrogen 3.136 N/A ILE 97.A N ILE 44.A O no hydrogen 2.912 N/A LEU 98.A N GLY 91.A O no hydrogen 2.724 N/A ALA 99.A N LEU 42.A O no hydrogen 3.095 N/A ARG 100.A N THR 88.A O no hydrogen 2.905 N/A ARG 100.A NH1 ASP 39.A O no hydrogen 3.002 N/A ARG 100.A NH2 ASP 39.A O no hydrogen 2.827 N/A GLY 104.A N HIS 127.A O no hydrogen 2.903 N/A LEU 107.A N HIS 123.A O no hydrogen 2.886 N/A THR 108.A N ARG 82.A O no hydrogen 2.738 N/A THR 108.A OG1 THR 122.A OG1 no hydrogen 2.757 N/A VAL 109.A N CYS 121.A O no hydrogen 3.246 N/A GLY 110.A N PHE 80.A O no hydrogen 2.880 N/A PHE 111.A N HIS 119.A O no hydrogen 2.987 N/A ASP 113.A N LYS 116.A O no hydrogen 2.802 N/A SER 114.A OG ASP 73.A O no hydrogen 3.401 N/A HIS 119.A N PHE 111.A O no hydrogen 3.012 N/A HIS 119.A NE2 ASP 113.A OD2 no hydrogen 2.765 N/A CYS 121.A N VAL 109.A O no hydrogen 3.014 N/A THR 122.A N ASP 17.A O no hydrogen 2.794 N/A THR 122.A OG1 THR 108.A OG1 no hydrogen 2.757 N/A HIS 123.A N LEU 107.A O no hydrogen 3.038 N/A PHE 125.A N GLU 105.A O no hydrogen 2.956 N/A HIS 126.A ND1 GLU 105.A OE1 no hydrogen 3.215 N/A HIS 126.A ND1 GLU 105.A OE2 no hydrogen 2.880 N/A HIS 127.A N GLY 104.A O no hydrogen 2.941 N/A HIS 127.A NE2 CYS 101.A O no hydrogen 2.864 N/A ARG 134.A N ASN 328.A OD1 no hydrogen 2.812 N/A ARG 134.A NE GLY 327.A O no hydrogen 2.965 N/A ARG 134.A NH2 SER 292.A OG no hydrogen 2.763 N/A LYS 136.A N PRO 288.A O no hydrogen 2.848 N/A LYS 145.A N VAL 264.A O no hydrogen 2.903 N/A LEU 147.A N CYS 262.A O no hydrogen 3.323 N/A CYS 149.A N VAL 260.A O no hydrogen 3.222 N/A SER 150.A N THR 38.A OG1 no hydrogen 2.876 N/A SER 150.A OG THR 38.A OG1 no hydrogen 3.287 N/A THR 151.A N ALA 258.A O no hydrogen 3.174 N/A THR 151.A OG1 ASP 39.A OD1 no hydrogen 3.144 N/A THR 151.A OG1 ASP 39.A OD2 no hydrogen 2.836 N/A THR 151.A OG1 THR 41.A OG1 no hydrogen 3.330 N/A TYR 152.A OH GLU 36.A OE1 no hydrogen 2.732 N/A VAL 153.A N PRO 256.A O no hydrogen 3.242 N/A THR 160.A OG1 THR 159.A O no hydrogen 2.739 N/A ILE 163.A N ILE 251.A O no hydrogen 3.073 N/A VAL 165.A N GLY 249.A O no hydrogen 2.740 N/A HIS 166.A N GLN 232.A O no hydrogen 2.794 N/A HIS 166.A ND1 MET 167.A O no hydrogen 3.060 N/A HIS 166.A NE2 ASN 234.A OD1 no hydrogen 2.859 N/A THR 171.A N VAL 225.A O no hydrogen 2.863 N/A ASP 173.A N ALA 223.A O no hydrogen 3.023 N/A ARG 174.A NH1 VAL 218.A O no hydrogen 3.469 N/A ARG 174.A NH1 CYS 221.A O no hydrogen 2.927 N/A ARG 174.A NH2 CYS 221.A O no hydrogen 3.429 N/A THR 175.A OG1 ASP 173.A OD1 no hydrogen 2.730 N/A THR 175.A OG1 ASP 173.A OD2 no hydrogen 3.006 N/A MET 177.A N ARG 174.A O no hydrogen 3.326 N/A SER 178.A N LYS 185.A O no hydrogen 2.929 N/A SER 178.A OG LYS 185.A O no hydrogen 3.487 N/A GLN 180.A N ASN 183.A O no hydrogen 3.349 N/A ASN 183.A ND2 GLN 180.A O no hydrogen 3.155 N/A VAL 184.A N ILE 213.A O no hydrogen 2.876 N/A LYS 185.A N SER 178.A O no hydrogen 2.772 N/A ILE 186.A N LYS 211.A O no hydrogen 2.896 N/A THR 187.A N LEU 176.A O no hydrogen 3.026 N/A VAL 188.A N ASP 210.A OD1 no hydrogen 2.807 N/A GLN 191.A N VAL 188.A O no hydrogen 3.289 N/A VAL 193.A N THR 207.A O no hydrogen 3.082 N/A ARG 194.A N ALA 224.A O no hydrogen 2.725 N/A ARG 194.A NE ASP 170.A OD2 no hydrogen 2.990 N/A TYR 195.A N GLY 205.A O no hydrogen 2.713 N/A LYS 196.A N HIS 222.A O no hydrogen 2.919 N/A ASN 198.A N GLN 220.A O no hydrogen 2.896 N/A CYS 199.A SG ASN 215.A O no hydrogen 3.777 N/A THR 207.A N VAL 193.A O no hydrogen 3.012 N/A THR 207.A OG1 VAL 193.A O no hydrogen 3.320 N/A LYS 211.A N ILE 186.A O no hydrogen 3.192 N/A LYS 211.A NZ TYR 195.A OH no hydrogen 3.542 N/A ILE 213.A N VAL 184.A O no hydrogen 2.731 N/A ASN 215.A N ASN 183.A OD1 no hydrogen 2.749 N/A LYS 217.A N GLN 220.A OE1 no hydrogen 3.413 N/A GLN 220.A N LYS 217.A O no hydrogen 3.139 N/A CYS 221.A N VAL 218.A O no hydrogen 3.491 N/A CYS 221.A SG LYS 217.A O no hydrogen 3.895 N/A HIS 222.A N LYS 196.A O no hydrogen 2.778 N/A ALA 224.A N ARG 194.A O no hydrogen 2.922 N/A VAL 225.A N THR 171.A O no hydrogen 2.812 N/A THR 226.A N THR 192.A O no hydrogen 2.856 N/A THR 226.A OG1 THR 192.A O no hydrogen 2.947 N/A LYS 229.A N ASN 227.A O no hydrogen 2.749 N/A LYS 230.A NZ LYS 6.A O no hydrogen 2.787 N/A TRP 231.A N ALA 7.A O no hydrogen 2.653 N/A GLN 232.A N HIS 166.A O no hydrogen 2.776 N/A ASN 234.A N GLU 164.A O no hydrogen 2.808 N/A ASN 234.A ND2 GLU 164.A OE1 no hydrogen 2.991 N/A SER 235.A N TYR 233.A O no hydrogen 2.693 N/A SER 235.A OG GLU 31.A OE1 no hydrogen 3.091 N/A SER 235.A OG GLU 31.A OE2 no hydrogen 2.674 N/A LEU 237.A N SER 235.A OG no hydrogen 3.096 N/A VAL 238.A N SER 235.A O no hydrogen 3.345 N/A ASN 241.A ND2 PRO 168.A O no hydrogen 2.896 N/A LYS 248.A NZ GLU 164.A OE1 no hydrogen 3.377 N/A GLY 249.A N VAL 165.A O no hydrogen 2.625 N/A ILE 251.A N ILE 163.A O no hydrogen 3.125 N/A HIS 252.A ND1 GLU 161.A O no hydrogen 3.122 N/A ILE 253.A N GLU 161.A O no hydrogen 3.049 N/A LEU 257.A N GLU 161.A OE2 no hydrogen 3.275 N/A ALA 258.A N THR 151.A O no hydrogen 3.066 N/A VAL 260.A N CYS 149.A O no hydrogen 2.735 N/A THR 261.A OG1 GLU 146.A OE2 no hydrogen 3.503 N/A CYS 262.A N LEU 147.A O no hydrogen 3.072 N/A ARG 263.A NE GLN 142.A O no hydrogen 3.463 N/A VAL 264.A N LYS 145.A O no hydrogen 3.216 N/A ALA 267.A N GLU 135.A OE2 no hydrogen 3.076 N/A THR 273.A N ILE 280.A O no hydrogen 3.011 N/A THR 273.A OG1 ILE 280.A O no hydrogen 3.206 N/A GLY 275.A N GLN 278.A O no hydrogen 2.993 N/A GLN 278.A N GLY 275.A O no hydrogen 3.399 N/A VAL 279.A N LEU 315.A O no hydrogen 2.722 N/A ILE 280.A N THR 273.A O no hydrogen 2.858 N/A MET 281.A N VAL 313.A O no hydrogen 3.030 N/A LEU 282.A N THR 271.A O no hydrogen 3.373 N/A LEU 283.A N LYS 311.A O no hydrogen 3.023 N/A HIS 287.A NE2 GLU 135.A OE1 no hydrogen 2.781 N/A THR 289.A N VAL 307.A O no hydrogen 2.934 N/A THR 289.A OG1 HIS 287.A O no hydrogen 2.839 N/A LEU 290.A N ARG 134.A O no hydrogen 2.956 N/A LEU 291.A N GLU 305.A O no hydrogen 2.924 N/A SER 292.A N THR 325.A O no hydrogen 2.965 N/A TYR 293.A N GLN 303.A O no hydrogen 3.123 N/A ARG 294.A N GLU 323.A O no hydrogen 3.037 N/A ARG 294.A NE GLU 323.A OE1 no hydrogen 2.811 N/A ARG 294.A NH2 GLU 323.A OE1 no hydrogen 3.157 N/A ARG 294.A NH2 GLU 323.A OE2 no hydrogen 3.185 N/A ASN 295.A N PRO 300.A O no hydrogen 2.746 N/A ASN 295.A ND2 GLU 299.A O no hydrogen 3.155 N/A MET 296.A N.B GLY 321.A O no hydrogen 2.761 N/A TYR 302.A OH GLU 304.A OE2 no hydrogen 2.731 N/A GLN 303.A N TYR 293.A O no hydrogen 3.246 N/A GLU 305.A N LEU 291.A O no hydrogen 3.001 N/A VAL 307.A N THR 289.A O no hydrogen 2.775 N/A LYS 311.A N LEU 283.A O no hydrogen 3.271 N/A LYS 311.A NZ GLU 305.A OE1 no hydrogen 2.772 N/A VAL 313.A N MET 281.A O no hydrogen 2.932 N/A LEU 315.A N VAL 279.A O no hydrogen 2.899 N/A VAL 317.A N ASN 277.A O no hydrogen 2.767 N/A THR 319.A OG1 GLU 320.A OE1 no hydrogen 3.142 N/A GLU 320.A N GLU 320.A OE1 no hydrogen 2.875 N/A GLY 321.A N PRO 318.A O no hydrogen 2.933 N/A LEU 322.A N TYR 334.A O no hydrogen 2.847 N/A GLU 323.A N ARG 294.A O no hydrogen 2.893 N/A VAL 324.A N TYR 332.A O no hydrogen 2.765 N/A THR 325.A N SER 292.A O no hydrogen 2.775 N/A TRP 326.A NE1 ARG 268.A O no hydrogen 3.274 N/A GLY 327.A N LEU 290.A O no hydrogen 2.842 N/A ASN 328.A N GLU 135.A OE2 no hydrogen 2.803 N/A ASN 328.A ND2 PRO 265.A O no hydrogen 2.817 N/A ASN 329.A N TRP 326.A O no hydrogen 3.419 N/A ASN 329.A ND2 ALA 267.A O no hydrogen 2.682 N/A ASN 329.A ND2 TRP 326.A O no hydrogen 2.788 N/A TYR 332.A N VAL 324.A O no hydrogen 2.691 N/A TYR 332.A OH ASN 269.A OD1 no hydrogen 2.804 N/A LYS 333.A NZ GLU 323.A OE2 no hydrogen 3.486 N/A TYR 334.A N LEU 322.A O no hydrogen 2.771 N/A