Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r5a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 SER 2.A O no hydrogen 2.603 N/A SER 5.A N LEU 92.A O no hydrogen 3.232 N/A SER 5.A OG LEU 28.A O no hydrogen 2.696 N/A LEU 6.A N LEU 28.A O no hydrogen 3.080 N/A ALA 7.A N THR 90.A O no hydrogen 3.038 N/A GLY 9.A N VAL 88.A O no hydrogen 2.913 N/A VAL 10.A N PHE 23.A O no hydrogen 3.148 N/A GLY 11.A N PRO 86.A O no hydrogen 3.013 N/A THR 12.A N GLU 21.A O no hydrogen 2.935 N/A THR 12.A OG1 GLU 21.A OE1 no hydrogen 2.819 N/A ASN 14.A N ALA 18.A O no hydrogen 2.858 N/A ASN 14.A ND2 ASP 142.A OD2 no hydrogen 3.101 N/A ARG 15.A N GLU 145.A OE2 no hydrogen 2.904 N/A GLN 16.A N ASN 14.A OD1 no hydrogen 3.200 N/A GLU 17.A N ASN 14.A O no hydrogen 2.980 N/A ALA 18.A N ASN 14.A OD1 no hydrogen 2.965 N/A LEU 20.A N THR 12.A O no hydrogen 2.722 N/A PHE 23.A N VAL 10.A O no hydrogen 3.025 N/A TYR 24.A N HIS 109.A NE2 no hydrogen 2.941 N/A TYR 24.A OH ALA 102.A O no hydrogen 2.810 N/A LEU 28.A N LEU 6.A O no hydrogen 2.841 N/A LYS 30.A N PHE 4.A O no hydrogen 2.716 N/A SER 33.A OG GLU 34.A OE1 no hydrogen 3.348 N/A ILE 35.A N SER 32.A OG no hydrogen 2.967 N/A VAL 36.A N SER 32.A O no hydrogen 3.088 N/A ALA 37.A N SER 33.A O no hydrogen 2.689 N/A ALA 38.A N GLU 34.A O no hydrogen 3.241 N/A VAL 39.A N ILE 35.A O no hydrogen 3.362 N/A ALA 40.A N VAL 36.A O no hydrogen 2.946 N/A LEU 43.A N VAL 39.A O no hydrogen 2.990 N/A GLY 44.A N PRO 41.A O no hydrogen 3.307 N/A TYR 45.A N ALA 40.A O no hydrogen 2.900 N/A TYR 45.A OH GLY 48.A O no hydrogen 2.675 N/A ASN 49.A ND2 GLU 94.A O no hydrogen 3.272 N/A GLN 50.A N LEU 91.A O no hydrogen 2.898 N/A LEU 52.A N ALA 89.A O no hydrogen 2.941 N/A PHE 54.A N LEU 87.A O no hydrogen 3.405 N/A SER 56.A OG ALA 81.A O no hydrogen 2.505 N/A GLN 58.A N THR 55.A OG1 no hydrogen 3.034 N/A GLN 58.A NE2 THR 55.A OG1 no hydrogen 3.227 N/A ALA 59.A N THR 55.A O no hydrogen 2.915 N/A TYR 60.A N SER 56.A O no hydrogen 3.452 N/A GLN 61.A N GLN 57.A O no hydrogen 3.259 N/A LEU 62.A N GLN 58.A O no hydrogen 2.802 N/A ALA 63.A N ALA 59.A O no hydrogen 2.749 N/A ASP 64.A N TYR 60.A O no hydrogen 2.822 N/A ALA 65.A N GLN 61.A O no hydrogen 2.947 N/A LEU 66.A N LEU 62.A O no hydrogen 3.061 N/A LEU 66.A N ALA 63.A O no hydrogen 3.093 N/A LYS 67.A N ALA 63.A O no hydrogen 3.155 N/A ILE 69.A N LEU 66.A O no hydrogen 3.093 N/A ASP 70.A N LEU 66.A O no hydrogen 2.995 N/A GLN 73.A N ASP 70.A OD1 no hydrogen 2.930 N/A GLN 73.A NE2 LEU 26.A O no hydrogen 2.943 N/A SER 74.A N ASP 70.A O no hydrogen 3.152 N/A SER 74.A OG ALA 63.A O no hydrogen 2.372 N/A ALA 75.A N ALA 71.A O no hydrogen 2.631 N/A LEU 76.A N ALA 72.A O no hydrogen 2.729 N/A LEU 77.A N GLN 73.A O no hydrogen 3.032 N/A SER 78.A N SER 74.A O no hydrogen 3.090 N/A LEU 80.A N LEU 76.A O no hydrogen 2.883 N/A ALA 81.A N LEU 77.A O no hydrogen 2.781 N/A GLU 82.A N ARG 79.A O no hydrogen 2.932 N/A SER 83.A N LEU 80.A O no hydrogen 2.930 N/A SER 83.A OG LYS 85.A O no hydrogen 3.541 N/A LYS 85.A N SER 83.A OG no hydrogen 3.110 N/A LYS 85.A NZ THR 12.A OG1 no hydrogen 2.762 N/A VAL 88.A N GLY 9.A O no hydrogen 3.004 N/A ALA 89.A N LEU 52.A O no hydrogen 2.823 N/A THR 90.A N ALA 7.A O no hydrogen 3.035 N/A THR 90.A OG1 ALA 7.A O no hydrogen 3.545 N/A LEU 91.A N GLN 50.A O no hydrogen 2.922 N/A LEU 92.A N SER 5.A O no hydrogen 2.812 N/A ALA 93.A N GLY 48.A O no hydrogen 3.224 N/A GLU 94.A N ASN 49.A OD1 no hydrogen 3.208 N/A SER 99.A N GLU 103.A OE2 no hydrogen 2.893 N/A THR 101.A OG1 LEU 129.A O no hydrogen 2.966 N/A GLU 103.A N SER 100.A OG no hydrogen 3.073 N/A ALA 104.A N SER 100.A O no hydrogen 2.966 N/A TYR 105.A N THR 101.A O no hydrogen 3.009 N/A TYR 105.A OH LEU 20.A O no hydrogen 3.417 N/A LEU 106.A N ALA 102.A O no hydrogen 3.045 N/A LYS 107.A N GLU 103.A O no hydrogen 3.105 N/A LYS 107.A NZ ASP 95.A OD1 no hydrogen 2.865 N/A LYS 107.A NZ ALA 96.A O no hydrogen 2.439 N/A LYS 107.A NZ ASN 122.A O no hydrogen 2.627 N/A LEU 108.A N ALA 104.A O no hydrogen 3.181 N/A HIS 109.A N TYR 105.A O no hydrogen 2.884 N/A HIS 109.A ND1 TYR 105.A O no hydrogen 2.876 N/A LEU 110.A N LEU 106.A O no hydrogen 2.736 N/A LEU 111.A N LYS 107.A O no hydrogen 3.154 N/A SER 112.A N LEU 108.A O no hydrogen 2.909 N/A SER 112.A OG ALA 192.A O no hydrogen 2.735 N/A HIS 113.A N HIS 109.A O no hydrogen 2.977 N/A HIS 113.A ND1 HIS 109.A O no hydrogen 2.923 N/A ARG 114.A N LEU 111.A O no hydrogen 2.912 N/A ARG 114.A NE ILE 194.A O no hydrogen 3.307 N/A ARG 114.A NH1 ALA 178.A O no hydrogen 2.956 N/A ARG 114.A NH1 GLU 196.A OE1 no hydrogen 3.554 N/A ARG 114.A NH2 ALA 178.A O no hydrogen 2.739 N/A ARG 114.A NH2 ILE 194.A O no hydrogen 2.807 N/A LEU 115.A N LEU 110.A O no hydrogen 2.851 N/A VAL 116.A N LEU 110.A O no hydrogen 3.351 N/A HIS 119.A N ASN 209.A OD1 no hydrogen 3.094 N/A ALA 120.A N LYS 117.A O no hydrogen 3.032 N/A ASN 122.A N ASP 95.A OD1 no hydrogen 2.742 N/A ASN 122.A N ASP 95.A OD2 no hydrogen 3.134 N/A SER 124.A N ASN 122.A OD1 no hydrogen 3.051 N/A LEU 129.A N ILE 126.A O no hydrogen 3.214 N/A LEU 130.A N PHE 127.A O no hydrogen 3.300 N/A VAL 133.A N ASP 166.A O no hydrogen 3.296 N/A ALA 134.A N VAL 141.A O no hydrogen 2.955 N/A TRP 135.A N SER 164.A O no hydrogen 2.727 N/A TRP 135.A NE1 ASP 166.A O no hydrogen 2.954 N/A THR 136.A N GLY 139.A O no hydrogen 3.041 N/A THR 136.A OG1 GLY 139.A O no hydrogen 2.621 N/A ASN 137.A N GLU 161.A O no hydrogen 3.252 N/A ASN 137.A ND2 GLU 161.A O no hydrogen 3.686 N/A ILE 138.A N THR 136.A OG1 no hydrogen 3.107 N/A GLY 139.A N THR 136.A O no hydrogen 3.148 N/A VAL 141.A N ALA 134.A O no hydrogen 2.859 N/A ALA 144.A N ASP 142.A OD1 no hydrogen 2.797 N/A GLU 145.A N ASP 142.A O no hydrogen 2.883 N/A GLN 150.A N LEU 146.A O no hydrogen 2.808 N/A LEU 151.A N ALA 147.A O no hydrogen 2.964 N/A GLU 152.A N GLU 148.A O no hydrogen 3.166 N/A ALA 153.A N LEU 149.A O no hydrogen 3.090 N/A ARG 154.A N GLN 150.A O no hydrogen 3.513 N/A LEU 155.A N LEU 151.A O no hydrogen 3.176 N/A LYS 156.A N GLU 152.A O no hydrogen 3.221 N/A GLY 157.A N ARG 154.A O no hydrogen 3.116 N/A LYS 158.A N ALA 153.A O no hydrogen 2.714 N/A PHE 163.A N TRP 135.A O no hydrogen 3.029 N/A ASP 166.A N VAL 133.A O no hydrogen 3.073 N/A LYS 167.A N ASP 166.A OD1 no hydrogen 2.724 N/A LYS 167.A NZ LEU 130.A O no hydrogen 2.606 N/A LYS 170.A NZ ASP 173.A OD2 no hydrogen 2.848 N/A MET 171.A N VAL 188.A O no hydrogen 2.911 N/A TYR 174.A N MET 171.A O no hydrogen 2.742 N/A TYR 174.A OH GLU 21.A OE2 no hydrogen 2.637 N/A VAL 175.A N MET 171.A O no hydrogen 2.881 N/A ARG 181.A N THR 198.A O no hydrogen 3.080 N/A ALA 183.A N VAL 200.A O no hydrogen 2.746 N/A ALA 186.A N ASP 184.A OD1 no hydrogen 3.322 N/A ARG 187.A N ASP 184.A O no hydrogen 3.059 N/A VAL 188.A N THR 185.A O no hydrogen 3.204 N/A ARG 189.A N VAL 206.A O no hydrogen 3.126 N/A ARG 189.A NH1 ASN 207.A OD1 no hydrogen 2.750 N/A ARG 189.A NH2 ASP 166.A OD2 no hydrogen 3.009 N/A LEU 190.A N PRO 169.A O no hydrogen 2.915 N/A GLY 191.A N SER 112.A OG no hydrogen 2.928 N/A ALA 192.A N ARG 189.A O no hydrogen 2.854 N/A TYR 193.A N ALA 210.A O no hydrogen 2.907 N/A GLY 195.A N THR 212.A O no hydrogen 3.035 N/A GLY 195.A N THR 212.A OG1 no hydrogen 3.278 N/A GLY 197.A N GLY 179.A O no hydrogen 2.633 N/A THR 198.A N GLY 195.A O no hydrogen 3.137 N/A THR 198.A OG1 GLY 195.A O no hydrogen 2.579 N/A THR 198.A OG1 THR 212.A OG1 no hydrogen 2.954 N/A THR 199.A N GLY 216.A O no hydrogen 3.066 N/A VAL 200.A N ARG 181.A O no hydrogen 3.018 N/A MET 201.A N ILE 218.A O no hydrogen 2.847 N/A GLY 204.A N MET 201.A O no hydrogen 2.953 N/A PHE 205.A N GLY 220.A O no hydrogen 3.112 N/A VAL 206.A N ARG 187.A O no hydrogen 2.982 N/A ASN 207.A N VAL 222.A O no hydrogen 3.202 N/A PHE 208.A N ASN 207.A OD1 no hydrogen 2.784 N/A ASN 209.A N GLY 191.A O no hydrogen 2.927 N/A GLY 211.A N VAL 226.A O no hydrogen 2.989 N/A THR 212.A N TYR 193.A O no hydrogen 2.861 N/A THR 212.A OG1 THR 198.A OG1 no hydrogen 2.954 N/A GLU 213.A N VAL 228.A O no hydrogen 3.020 N/A GLY 216.A N GLY 197.A O no hydrogen 3.300 N/A MET 217.A N ASP 233.A OD1 no hydrogen 3.209 N/A ILE 218.A N THR 199.A O no hydrogen 2.776 N/A GLU 219.A N LEU 234.A O no hydrogen 2.740 N/A ARG 221.A N CYS 238.A O no hydrogen 3.124 N/A VAL 222.A N PHE 205.A O no hydrogen 2.702 N/A SER 223.A N THR 240.A OG1 no hydrogen 2.963 N/A SER 223.A OG THR 240.A O no hydrogen 2.836 N/A GLY 225.A N ASN 209.A O no hydrogen 2.895 N/A VAL 226.A N SER 223.A O no hydrogen 3.105 N/A VAL 228.A N GLY 211.A O no hydrogen 2.925 N/A GLY 229.A N VAL 250.A O no hydrogen 2.723 N/A LYS 230.A N GLU 213.A OE1 no hydrogen 2.850 N/A GLY 231.A N PRO 215.A O no hydrogen 2.912 N/A SER 232.A OG GLY 229.A O no hydrogen 3.310 N/A SER 232.A OG GLY 251.A O no hydrogen 2.668 N/A ASP 233.A N CYS 254.A O no hydrogen 2.859 N/A LEU 234.A N MET 217.A O no hydrogen 3.008 N/A GLY 235.A N ILE 256.A O no hydrogen 2.791 N/A GLY 237.A N GLU 219.A O no hydrogen 3.236 N/A CYS 238.A N GLY 235.A O no hydrogen 3.090 N/A CYS 238.A SG GLY 235.A O no hydrogen 3.289 N/A SER 239.A N ALA 260.A O no hydrogen 2.812 N/A SER 239.A OG TYR 277.A OH no hydrogen 2.622 N/A THR 240.A OG1 ARG 221.A O no hydrogen 2.889 N/A MET 241.A N ILE 262.A O no hydrogen 3.098 N/A THR 243.A OG1 THR 243.A O no hydrogen 2.577 N/A VAL 250.A N PHE 227.A O no hydrogen 3.155 N/A GLY 251.A N LEU 266.A O no hydrogen 2.932 N/A GLU 252.A N ASP 268.A OD1 no hydrogen 2.792 N/A GLY 253.A N LYS 230.A O no hydrogen 2.865 N/A CYS 254.A N SER 232.A OG no hydrogen 2.703 N/A CYS 254.A SG GLY 251.A O no hydrogen 3.317 N/A CYS 254.A SG GLU 252.A O no hydrogen 3.873 N/A CYS 254.A SG GLY 267.A O no hydrogen 2.803 N/A LEU 255.A N ASN 270.A O no hydrogen 2.765 N/A ILE 256.A N ASP 233.A O no hydrogen 3.107 N/A GLY 257.A N VAL 272.A O no hydrogen 2.881 N/A ASN 259.A N GLY 236.A O no hydrogen 3.055 N/A ALA 260.A N GLY 257.A O no hydrogen 3.206 N/A GLY 261.A N LEU 276.A O no hydrogen 2.930 N/A ILE 262.A N SER 239.A O no hydrogen 2.713 N/A GLY 263.A N ILE 278.A O no hydrogen 2.875 N/A LEU 266.A N SER 249.A O no hydrogen 3.015 N/A ARG 269.A N GLU 252.A O no hydrogen 2.714 N/A ARG 269.A NE ASP 305.A OD1 no hydrogen 2.762 N/A ARG 269.A NE ASP 305.A OD2 no hydrogen 3.347 N/A ARG 269.A NH2 ASP 305.A OD2 no hydrogen 2.841 N/A ILE 271.A N LEU 306.A O no hydrogen 2.911 N/A VAL 272.A N LEU 255.A O no hydrogen 2.866 N/A GLU 273.A N PHE 308.A O no hydrogen 3.234 N/A GLY 275.A N ALA 258.A O no hydrogen 2.662 N/A LEU 276.A N GLU 273.A O no hydrogen 3.069 N/A TYR 277.A OH SER 239.A OG no hydrogen 2.622 N/A ILE 278.A N GLY 261.A O no hydrogen 2.790 N/A THR 279.A N THR 282.A OG1 no hydrogen 2.999 N/A THR 279.A OG1 THR 282.A OG1 no hydrogen 2.621 N/A THR 282.A N THR 279.A O no hydrogen 3.291 N/A THR 282.A OG1 THR 279.A O no hydrogen 3.431 N/A THR 282.A OG1 THR 279.A OG1 no hydrogen 2.621 N/A VAL 284.A N VAL 295.A O no hydrogen 2.912 N/A ALA 285.A N VAL 317.A O no hydrogen 2.660 N/A LEU 286.A N LYS 293.A O no hydrogen 3.357 N/A LEU 287.A N CYS 319.A O no hydrogen 3.115 N/A ASP 288.A N ALA 290.A O no hydrogen 3.201 N/A ALA 290.A N ASP 288.A OD1 no hydrogen 3.269 N/A VAL 292.A N LEU 286.A O no hydrogen 3.134 N/A VAL 295.A N VAL 284.A O no hydrogen 3.261 N/A ALA 297.A N THR 282.A O no hydrogen 3.006 N/A ARG 298.A N ALA 280.A O no hydrogen 3.081 N/A ASP 299.A N LYS 296.A O no hydrogen 3.106 N/A LEU 300.A N ALA 297.A O no hydrogen 2.963 N/A ALA 301.A N ALA 297.A O no hydrogen 3.180 N/A GLN 303.A N LEU 300.A O no hydrogen 2.792 N/A ASP 305.A N ASP 268.A O no hydrogen 2.984 N/A PHE 308.A N ILE 271.A O no hydrogen 2.959 N/A ARG 309.A N GLU 318.A O no hydrogen 3.393 N/A ARG 310.A NE GLY 315.A O no hydrogen 3.401 N/A ASN 311.A N ALA 316.A O no hydrogen 2.700 N/A ALA 316.A N ASN 314.A OD1 no hydrogen 2.994 N/A GLU 318.A N ARG 309.A O no hydrogen 2.802 N/A CYS 319.A N ALA 285.A O no hydrogen 3.191 N/A LYS 320.A N LEU 307.A O no hydrogen 3.159 N/A