Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2a4m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE GLU 33.A O no hydrogen 2.714 N/A VAL 5.A N GLU 35.A O no hydrogen 2.948 N/A LEU 6.A N LEU 145.A O no hydrogen 3.266 N/A THR 7.A N PHE 37.A O no hydrogen 2.950 N/A THR 7.A OG1 PHE 37.A O no hydrogen 3.320 N/A ASP 9.A N LEU 39.A O no hydrogen 3.020 N/A ARG 10.A NH1 ASP 48.A OD2 no hydrogen 2.890 N/A ARG 10.A NH2 GLN 44.A O no hydrogen 3.525 N/A THR 12.A OG1 ARG 10.A O no hydrogen 3.361 N/A LEU 15.A N ASP 66.A OD1 no hydrogen 2.683 N/A HIS 16.A N HIS 19.A ND1 no hydrogen 2.962 N/A LEU 17.A N ILE 204.A O no hydrogen 2.978 N/A HIS 19.A N HIS 16.A O no hydrogen 3.072 N/A LEU 20.A N HIS 16.A O no hydrogen 3.248 N/A ALA 21.A N LEU 17.A O no hydrogen 2.911 N/A GLY 22.A N GLY 18.A O no hydrogen 2.603 N/A SER 23.A N HIS 19.A O no hydrogen 2.588 N/A SER 23.A OG HIS 19.A O no hydrogen 3.430 N/A LEU 24.A N HIS 19.A O no hydrogen 2.779 N/A GLN 25.A N LEU 20.A O no hydrogen 3.332 N/A ASN 26.A N SER 23.A O no hydrogen 2.615 N/A ARG 27.A N SER 23.A O no hydrogen 3.038 N/A VAL 28.A N LEU 24.A O no hydrogen 2.970 N/A ARG 29.A N ASN 26.A O no hydrogen 3.182 N/A LEU 30.A N ASN 26.A O no hydrogen 3.089 N/A GLU 33.A N LEU 30.A O no hydrogen 3.194 N/A GLU 35.A N PRO 3.A O no hydrogen 2.845 N/A PHE 37.A N VAL 5.A O no hydrogen 2.788 N/A VAL 38.A N THR 78.A O no hydrogen 2.925 N/A LEU 39.A N THR 7.A O no hydrogen 2.723 N/A LEU 40.A N VAL 80.A O no hydrogen 2.775 N/A ALA 41.A N ASP 9.A O no hydrogen 2.836 N/A ASP 42.A N LEU 40.A O no hydrogen 2.683 N/A ALA 45.A N ALA 41.A O no hydrogen 2.910 N/A LEU 46.A N VAL 43.A O no hydrogen 3.091 N/A THR 47.A N GLN 44.A O no hydrogen 3.160 N/A THR 47.A OG1 GLN 44.A O no hydrogen 2.794 N/A ASP 48.A N ALA 45.A O no hydrogen 3.215 N/A HIS 49.A N ALA 45.A O no hydrogen 2.760 N/A ARG 52.A N HIS 49.A O no hydrogen 2.864 N/A ARG 52.A NH1 GLN 55.A OE1 no hydrogen 3.240 N/A GLN 55.A NE2 THR 12.A O no hydrogen 2.513 N/A ARG 57.A N PRO 53.A O no hydrogen 3.014 N/A GLU 58.A N GLU 54.A O no hydrogen 3.092 N/A ASN 59.A N GLN 55.A O no hydrogen 3.350 N/A ASN 59.A ND2 GLN 55.A O no hydrogen 2.784 N/A VAL 60.A N ARG 57.A O no hydrogen 3.338 N/A VAL 63.A N ASN 59.A O no hydrogen 2.848 N/A ALA 64.A N VAL 60.A O no hydrogen 2.966 N/A LEU 65.A N LEU 61.A O no hydrogen 2.899 N/A ASP 66.A N ALA 62.A O no hydrogen 3.103 N/A TYR 67.A N VAL 63.A O no hydrogen 2.819 N/A TYR 67.A OH ASP 9.A OD1 no hydrogen 2.368 N/A LEU 68.A N ALA 64.A O no hydrogen 2.956 N/A ALA 69.A N LEU 65.A O no hydrogen 2.819 N/A ALA 70.A N ASP 66.A O no hydrogen 2.841 N/A ALA 70.A N TYR 67.A O no hydrogen 3.258 N/A GLY 71.A N LEU 68.A O no hydrogen 3.177 N/A LEU 72.A N TYR 67.A O no hydrogen 3.207 N/A GLN 75.A N ASP 73.A OD2 no hydrogen 2.704 N/A LYS 76.A N ASP 73.A O no hydrogen 2.983 N/A THR 77.A N ASP 73.A O no hydrogen 3.047 N/A THR 78.A N LEU 36.A O no hydrogen 2.955 N/A VAL 80.A N VAL 38.A O no hydrogen 2.930 N/A VAL 81.A N THR 308.A OG1 no hydrogen 2.974 N/A GLN 82.A N LEU 40.A O no hydrogen 3.187 N/A SER 83.A OG ASP 42.A OD1 no hydrogen 2.275 N/A ALA 84.A N VAL 81.A O no hydrogen 3.041 N/A VAL 85.A N GLN 82.A O no hydrogen 3.022 N/A GLU 87.A N GLU 87.A OE2 no hydrogen 2.731 N/A LEU 88.A N VAL 85.A O no hydrogen 3.056 N/A ALA 89.A N PRO 86.A O no hydrogen 3.056 N/A GLU 90.A N PRO 86.A O no hydrogen 3.121 N/A LEU 91.A N GLU 87.A O no hydrogen 3.017 N/A THR 92.A N LEU 88.A O no hydrogen 3.018 N/A THR 92.A OG1 LEU 88.A O no hydrogen 2.664 N/A VAL 93.A N ALA 89.A O no hydrogen 2.981 N/A TYR 94.A N GLU 90.A O no hydrogen 3.375 N/A TYR 94.A OH GLU 90.A OE1 no hydrogen 2.894 N/A PHE 95.A N LEU 91.A O no hydrogen 2.896 N/A LEU 96.A N THR 92.A O no hydrogen 2.981 N/A LEU 96.A N VAL 93.A O no hydrogen 3.167 N/A ASN 97.A N TYR 94.A O no hydrogen 3.169 N/A LEU 98.A N PHE 95.A O no hydrogen 2.871 N/A HIS 103.A N THR 100.A OG1 no hydrogen 3.083 N/A LEU 104.A N THR 100.A O no hydrogen 3.094 N/A ARG 105.A N VAL 101.A O no hydrogen 2.872 N/A GLN 106.A N HIS 103.A O no hydrogen 3.206 N/A ASN 107.A N LEU 104.A O no hydrogen 3.352 N/A THR 109.A OG1 ASP 151.A O no hydrogen 2.561 N/A VAL 110.A N ASN 107.A OD1 no hydrogen 3.021 N/A LYS 111.A N ASN 107.A O no hydrogen 2.939 N/A ALA 112.A N PRO 108.A O no hydrogen 3.143 N/A GLU 113.A N THR 109.A O no hydrogen 2.960 N/A ILE 114.A N VAL 110.A O no hydrogen 2.879 N/A ALA 115.A N LYS 111.A O no hydrogen 2.990 N/A GLN 116.A N ALA 112.A O no hydrogen 2.848 N/A LYS 117.A N GLU 113.A O no hydrogen 2.989 N/A LYS 117.A NZ ASP 48.A OD2 no hydrogen 2.764 N/A GLY 118.A N ILE 114.A O no hydrogen 3.018 N/A GLY 118.A N ALA 115.A O no hydrogen 3.346 N/A TYR 119.A OH ASP 48.A OD1 no hydrogen 3.386 N/A ARG 122.A N TYR 119.A O no hydrogen 3.216 N/A PHE 127.A N PRO 124.A O no hydrogen 3.116 N/A PHE 128.A N PRO 124.A O no hydrogen 3.068 N/A VAL 129.A N ALA 125.A O no hydrogen 2.973 N/A TYR 130.A N PHE 127.A O no hydrogen 3.084 N/A TYR 130.A OH GLU 113.A OE1 no hydrogen 3.325 N/A TYR 130.A OH GLU 113.A OE2 no hydrogen 2.590 N/A VAL 132.A N VAL 129.A O no hydrogen 3.110 N/A GLN 134.A N TYR 130.A O no hydrogen 2.886 N/A ALA 135.A N PRO 131.A O no hydrogen 3.019 N/A ALA 136.A N VAL 132.A O no hydrogen 2.970 N/A ASP 137.A N SER 133.A O no hydrogen 3.076 N/A ILE 138.A N GLN 134.A O no hydrogen 3.016 N/A ALA 139.A N ALA 135.A O no hydrogen 3.051 N/A ALA 140.A N ALA 136.A O no hydrogen 2.854 N/A PHE 141.A N ASP 137.A O no hydrogen 3.290 N/A GLY 142.A N ALA 139.A O no hydrogen 3.192 N/A ALA 143.A N ILE 138.A O no hydrogen 3.151 N/A THR 144.A N ARG 4.A O no hydrogen 2.878 N/A LEU 145.A N ARG 4.A O no hydrogen 3.125 N/A VAL 146.A N GLN 178.A O no hydrogen 2.929 N/A VAL 148.A N GLN 180.A O no hydrogen 3.020 N/A GLN 152.A N GLY 149.A O no hydrogen 2.784 N/A LEU 156.A N GLN 152.A O no hydrogen 3.338 N/A GLU 157.A N LEU 153.A O no hydrogen 2.795 N/A GLN 158.A N PRO 154.A O no hydrogen 2.851 N/A GLN 158.A NE2 HIS 103.A ND1 no hydrogen 2.995 N/A THR 159.A N MET 155.A O no hydrogen 2.935 N/A THR 159.A OG1 MET 155.A O no hydrogen 2.788 N/A ARG 160.A N LEU 156.A O no hydrogen 3.040 N/A ARG 160.A NH1 PRO 177.A O no hydrogen 2.904 N/A GLU 161.A N GLU 157.A O no hydrogen 3.050 N/A ILE 162.A N GLN 158.A O no hydrogen 2.900 N/A VAL 163.A N THR 159.A O no hydrogen 2.767 N/A ARG 164.A N ARG 160.A O no hydrogen 2.919 N/A ARG 164.A NE GLU 176.A OE1 no hydrogen 2.480 N/A ARG 164.A NH1 GLU 176.A OE1 no hydrogen 2.755 N/A ARG 165.A N GLU 161.A O no hydrogen 3.047 N/A PHE 166.A N ILE 162.A O no hydrogen 2.923 N/A ASN 167.A N VAL 163.A O no hydrogen 2.995 N/A ASN 167.A ND2 LEU 174.A O no hydrogen 3.002 N/A ALA 168.A N ARG 164.A O no hydrogen 3.044 N/A LEU 169.A N ARG 165.A O no hydrogen 2.915 N/A TYR 170.A N PHE 166.A O no hydrogen 2.970 N/A VAL 173.A N ALA 171.A O no hydrogen 2.704 N/A LEU 174.A N ASN 167.A OD1 no hydrogen 3.050 N/A GLN 178.A N THR 144.A O no hydrogen 2.648 N/A GLN 180.A N VAL 146.A O no hydrogen 3.242 N/A SER 182.A OG VAL 184.A O no hydrogen 3.558 N/A LEU 190.A N ASN 202.A O no hydrogen 2.998 N/A GLY 192.A N GLY 189.A O no hydrogen 3.282 N/A SER 197.A N ASN 202.A OD1 no hydrogen 2.856 N/A SER 199.A N SER 197.A OG no hydrogen 3.253 N/A SER 199.A OG SER 197.A OG no hydrogen 3.398 N/A GLY 201.A N LYS 198.A O no hydrogen 2.995 N/A ASN 202.A ND2 LYS 195.A O no hydrogen 2.728 N/A ALA 205.A N ASP 208.A OD1 no hydrogen 2.911 N/A LEU 206.A N LEU 15.A O no hydrogen 3.098 N/A ASP 208.A N ALA 205.A O no hydrogen 3.100 N/A GLU 212.A N SER 209.A OG no hydrogen 3.334 N/A VAL 213.A N SER 209.A O no hydrogen 2.961 N/A ALA 214.A N ALA 210.A O no hydrogen 3.299 N/A ARG 215.A N ASP 211.A O no hydrogen 2.781 N/A LYS 216.A N GLU 212.A O no hydrogen 2.747 N/A LYS 216.A NZ ALA 203.A O no hydrogen 2.976 N/A LYS 216.A NZ ASP 208.A OD1 no hydrogen 2.895 N/A VAL 217.A N VAL 213.A O no hydrogen 3.090 N/A MET 218.A N ALA 214.A O no hydrogen 2.961 N/A GLY 219.A N ARG 215.A O no hydrogen 3.066 N/A GLY 219.A N LYS 216.A O no hydrogen 3.312 N/A MET 220.A N VAL 217.A O no hydrogen 3.239 N/A TYR 221.A N LEU 190.A O no hydrogen 2.937 N/A HIS 226.A N ASP 223.A O no hydrogen 3.373 N/A HIS 226.A ND1 TYR 261.A OH no hydrogen 3.158 N/A HIS 226.A NE2 ASP 231.A O no hydrogen 2.872 N/A GLY 233.A N TYR 261.A O no hydrogen 2.885 N/A ARG 234.A NH1 GLU 236.A O no hydrogen 3.135 N/A GLU 236.A N GLU 236.A OE1 no hydrogen 2.569 N/A ASN 238.A N VAL 235.A O no hydrogen 2.831 N/A VAL 240.A N ASN 238.A OD1 no hydrogen 3.456 N/A PHE 241.A N ASN 238.A O no hydrogen 3.300 N/A LEU 244.A N VAL 240.A O no hydrogen 2.971 N/A ASP 245.A N PHE 241.A O no hydrogen 2.817 N/A ALA 246.A N PHE 243.A O no hydrogen 3.078 N/A PHE 247.A N PHE 243.A O no hydrogen 3.030 N/A ASP 248.A N LEU 244.A O no hydrogen 2.860 N/A ARG 253.A N ASP 250.A O no hydrogen 2.978 N/A ARG 253.A NH1 ASP 248.A OD1 no hydrogen 2.723 N/A ARG 253.A NH1 ASP 250.A OD1 no hydrogen 2.632 N/A ARG 253.A NH2 ASP 248.A OD1 no hydrogen 2.716 N/A VAL 254.A N ASP 250.A O no hydrogen 2.940 N/A GLN 255.A N PRO 251.A O no hydrogen 2.616 N/A ALA 256.A N ARG 253.A O no hydrogen 3.239 N/A LEU 257.A N ARG 253.A O no hydrogen 3.380 N/A LYS 258.A N VAL 254.A O no hydrogen 3.157 N/A ASP 259.A N ALA 256.A O no hydrogen 2.785 N/A GLN 260.A N ALA 256.A O no hydrogen 3.277 N/A TYR 261.A N LEU 257.A O no hydrogen 2.808 N/A TYR 261.A OH ASP 268.A OD1 no hydrogen 2.548 N/A ARG 262.A N LYS 258.A O no hydrogen 3.379 N/A ALA 263.A N GLN 260.A O no hydrogen 2.826 N/A VAL 271.A N GLY 267.A O no hydrogen 3.257 N/A LYS 272.A N ASP 268.A O no hydrogen 2.888 N/A LYS 272.A NZ MET 218.A O no hydrogen 2.780 N/A LYS 272.A NZ MET 220.A O no hydrogen 3.008 N/A LYS 273.A N VAL 269.A O no hydrogen 2.536 N/A HIS 274.A N LYS 270.A O no hydrogen 2.966 N/A LEU 275.A N VAL 271.A O no hydrogen 2.900 N/A ILE 276.A N LYS 272.A O no hydrogen 2.798 N/A ASP 277.A N HIS 274.A O no hydrogen 3.041 N/A VAL 278.A N HIS 274.A O no hydrogen 3.172 N/A LEU 279.A N LEU 275.A O no hydrogen 2.958 N/A ASN 280.A N ILE 276.A O no hydrogen 2.890 N/A GLY 281.A N ASP 277.A O no hydrogen 2.886 N/A VAL 282.A N VAL 278.A O no hydrogen 3.332 N/A LEU 283.A N LEU 279.A O no hydrogen 3.035 N/A ALA 284.A N ASN 280.A O no hydrogen 2.832 N/A ARG 287.A N LEU 283.A O no hydrogen 3.034 N/A ARG 287.A NE ASP 208.A O no hydrogen 3.277 N/A ARG 287.A NH2 ASN 280.A OD1 no hydrogen 3.390 N/A THR 288.A N ALA 284.A O no hydrogen 3.477 N/A THR 288.A OG1 PRO 285.A O no hydrogen 2.646 N/A ARG 289.A N PRO 285.A O no hydrogen 2.904 N/A ARG 290.A N ILE 286.A O no hydrogen 2.925 N/A ARG 290.A NH2 ASP 66.A OD2 no hydrogen 2.952 N/A ALA 291.A N ARG 287.A O no hydrogen 3.039 N/A GLU 292.A N THR 288.A O no hydrogen 3.186 N/A TYR 293.A N ARG 289.A O no hydrogen 3.178 N/A GLU 294.A N ARG 290.A O no hydrogen 2.757 N/A ARG 295.A N ALA 291.A O no hydrogen 3.065 N/A ASP 296.A N TYR 293.A O no hydrogen 2.814 N/A ALA 299.A N ASP 296.A O no hydrogen 2.957 N/A LEU 301.A N PRO 297.A O no hydrogen 3.231 N/A ARG 302.A N ASP 298.A O no hydrogen 3.003 N/A PHE 303.A N ALA 299.A O no hydrogen 2.959 N/A VAL 304.A N VAL 300.A O no hydrogen 3.191 N/A THR 305.A N LEU 301.A O no hydrogen 2.842 N/A THR 305.A OG1 LEU 301.A O no hydrogen 3.108 N/A THR 305.A OG1 ARG 302.A O no hydrogen 3.188 N/A GLU 306.A N ARG 302.A O no hydrogen 2.835 N/A GLY 307.A N PHE 303.A O no hydrogen 3.055 N/A THR 308.A N VAL 304.A O no hydrogen 3.025 N/A THR 308.A OG1 VAL 304.A O no hydrogen 2.796 N/A ALA 309.A N THR 305.A O no hydrogen 3.029 N/A ARG 310.A N GLU 306.A O no hydrogen 3.091 N/A GLY 311.A N GLY 307.A O no hydrogen 2.773 N/A ARG 312.A N THR 308.A O no hydrogen 2.831 N/A ARG 312.A NE GLU 87.A OE1 no hydrogen 2.895 N/A ARG 312.A NE GLU 87.A OE2 no hydrogen 2.952 N/A ARG 312.A NH2 GLU 87.A OE1 no hydrogen 2.928 N/A GLU 313.A N ALA 309.A O no hydrogen 3.141 N/A VAL 314.A N ARG 310.A O no hydrogen 3.297 N/A ALA 315.A N GLY 311.A O no hydrogen 2.879 N/A ALA 316.A N ARG 312.A O no hydrogen 2.714 N/A GLN 317.A N GLU 313.A O no hydrogen 3.139 N/A GLN 317.A NE2 GLU 313.A O no hydrogen 2.956 N/A THR 318.A N VAL 314.A O no hydrogen 2.996 N/A THR 318.A OG1 ALA 140.A O no hydrogen 2.748 N/A THR 318.A OG1 VAL 314.A O no hydrogen 3.191 N/A LEU 319.A N ALA 315.A O no hydrogen 2.878 N/A GLY 320.A N ALA 316.A O no hydrogen 2.975 N/A GLN 321.A N GLN 317.A O no hydrogen 3.210 N/A VAL 322.A N THR 318.A O no hydrogen 2.846 N/A ARG 323.A N LEU 319.A O no hydrogen 2.723 N/A ARG 323.A NH1 GLU 90.A OE1 no hydrogen 3.215 N/A ARG 324.A N GLY 320.A O no hydrogen 3.341 N/A ALA 325.A N GLN 321.A O no hydrogen 3.018 N/A MET 326.A N VAL 322.A O no hydrogen 2.871 N/A ARG 327.A N ARG 324.A O no hydrogen 3.066 N/A ARG 327.A NH2 TYR 170.A O no hydrogen 3.219 N/A LEU 328.A N ARG 323.A O no hydrogen 3.114 N/A HIS 331.A N LEU 328.A O no hydrogen 3.245 N/A