Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xnn_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 14.A NH1 HIS 30.A ND1 no hydrogen 2.893 N/A LEU 15.A N PHE 4.A O no hydrogen 2.763 N/A LEU 17.A N LEU 2.A O no hydrogen 2.917 N/A GLU 18.A N LYS 26.A O no hydrogen 2.984 N/A VAL 24.A N HIS 360.A O no hydrogen 2.994 N/A ARG 25.A N GLU 18.A O no hydrogen 2.944 N/A CYS 27.A SG SER 357.A OG no hydrogen 3.382 N/A ASP 28.A N VAL 16.A O no hydrogen 2.691 N/A HIS 30.A N ARG 14.A O no hydrogen 2.774 N/A HIS 35.A N GLY 32.A O no hydrogen 3.466 N/A ARG 36.A NH2 ARG 56.A O no hydrogen 2.460 N/A LYS 40.A N GLY 37.A O no hydrogen 3.149 N/A LEU 41.A N GLY 37.A O no hydrogen 3.040 N/A ILE 42.A N THR 38.A O no hydrogen 3.412 N/A TYR 44.A N LEU 41.A O no hydrogen 3.064 N/A LYS 45.A N ILE 42.A O no hydrogen 2.910 N/A THR 46.A OG1 GLU 305.A O no hydrogen 3.347 N/A THR 46.A OG1 SER 335.A O no hydrogen 3.160 N/A TYR 47.A N SER 335.A O no hydrogen 3.330 N/A TYR 47.A OH SER 331.A OG no hydrogen 2.806 N/A ALA 50.A N TYR 47.A O no hydrogen 3.437 N/A LEU 51.A N LEU 48.A O no hydrogen 3.170 N/A TYR 53.A N ALA 50.A O no hydrogen 3.081 N/A PHE 54.A N LEU 51.A O no hydrogen 2.769 N/A ASP 55.A N PRO 52.A O no hydrogen 2.916 N/A ARG 56.A N TYR 53.A O no hydrogen 3.150 N/A ARG 56.A NH1 PRO 52.A O no hydrogen 2.567 N/A SER 61.A OG ASP 58.A OD2 no hydrogen 2.456 N/A SER 61.A OG SER 61.A O no hydrogen 2.541 N/A SER 61.A OG ASN 65.A OD1 no hydrogen 3.085 N/A CYS 64.A SG GLY 93.A O no hydrogen 2.988 N/A CYS 64.A SG THR 96.A OG1 no hydrogen 2.319 N/A ASN 65.A N MET 62.A O no hydrogen 3.078 N/A ASN 65.A ND2 PHE 54.A O no hydrogen 3.612 N/A GLU 66.A N MET 62.A O no hydrogen 3.093 N/A GLN 67.A N CYS 64.A O no hydrogen 3.300 N/A ALA 68.A N ASN 65.A O no hydrogen 3.053 N/A TYR 69.A OH TYR 47.A O no hydrogen 2.937 N/A SER 70.A OG GLU 66.A O no hydrogen 2.696 N/A SER 70.A OG ILE 145.A O no hydrogen 3.206 N/A SER 70.A OG ARG 146.A O no hydrogen 3.035 N/A ILE 71.A N GLN 67.A O no hydrogen 3.041 N/A ALA 72.A N ALA 68.A O no hydrogen 3.033 N/A VAL 73.A N TYR 69.A O no hydrogen 2.894 N/A GLU 74.A N SER 70.A O no hydrogen 3.048 N/A LYS 75.A N ILE 71.A O no hydrogen 2.925 N/A LYS 75.A NZ THR 316.A OG1 no hydrogen 2.811 N/A LEU 76.A N ALA 72.A O no hydrogen 3.035 N/A LEU 77.A N GLU 74.A O no hydrogen 3.248 N/A ASN 78.A N LYS 75.A O no hydrogen 2.934 N/A ILE 79.A N GLU 74.A O no hydrogen 3.180 N/A ARG 84.A NE ASP 153.A OD1 no hydrogen 2.969 N/A ARG 84.A NH1 ASP 153.A OD2 no hydrogen 3.487 N/A ARG 84.A NH2 PRO 270.A O no hydrogen 3.278 N/A GLN 86.A N PRO 82.A O no hydrogen 3.313 N/A TRP 87.A N PRO 83.A O no hydrogen 3.368 N/A ILE 88.A N ARG 84.A O no hydrogen 3.002 N/A ARG 89.A N ALA 85.A O no hydrogen 2.923 N/A ARG 89.A NH2 GLY 149.A O no hydrogen 2.718 N/A VAL 90.A N GLN 86.A O no hydrogen 3.047 N/A LEU 91.A N TRP 87.A O no hydrogen 2.671 N/A PHE 92.A N ILE 88.A O no hydrogen 2.765 N/A GLY 93.A N ARG 89.A O no hydrogen 2.722 N/A GLU 94.A N VAL 90.A O no hydrogen 3.171 N/A ILE 95.A N LEU 91.A O no hydrogen 3.276 N/A THR 96.A N PHE 92.A O no hydrogen 2.996 N/A THR 96.A OG1 PHE 92.A O no hydrogen 3.533 N/A THR 96.A OG1 GLY 93.A O no hydrogen 2.510 N/A ARG 97.A N GLY 93.A O no hydrogen 3.096 N/A ARG 97.A NH1 GLU 94.A OE1 no hydrogen 2.802 N/A ARG 97.A NH1 GLU 94.A OE2 no hydrogen 2.648 N/A ILE 98.A N GLU 94.A O no hydrogen 2.907 N/A LEU 99.A N ILE 95.A O no hydrogen 2.865 N/A ASN 100.A N THR 96.A O no hydrogen 2.652 N/A HIS 101.A N ARG 97.A O no hydrogen 2.892 N/A ILE 102.A N ILE 98.A O no hydrogen 2.887 N/A MET 103.A N LEU 99.A O no hydrogen 3.139 N/A ALA 104.A N ASN 100.A O no hydrogen 2.616 N/A VAL 105.A N HIS 101.A O no hydrogen 2.758 N/A THR 106.A N ILE 102.A O no hydrogen 3.162 N/A THR 106.A OG1 ILE 102.A O no hydrogen 2.622 N/A THR 107.A N MET 103.A O no hydrogen 3.057 N/A THR 107.A OG1 MET 103.A O no hydrogen 2.597 N/A HIS 108.A N ALA 104.A O no hydrogen 3.157 N/A ALA 109.A N VAL 105.A O no hydrogen 3.195 N/A LEU 110.A N THR 106.A O no hydrogen 2.894 N/A ASP 111.A N THR 107.A O no hydrogen 2.991 N/A ILE 112.A N HIS 108.A O no hydrogen 2.952 N/A GLY 113.A N ALA 109.A O no hydrogen 2.713 N/A TRP 120.A N THR 116.A O no hydrogen 3.193 N/A MET 121.A N PRO 117.A O no hydrogen 3.243 N/A PHE 122.A N PHE 118.A O no hydrogen 2.886 N/A GLU 123.A N PHE 119.A O no hydrogen 3.357 N/A ARG 125.A N PHE 122.A O no hydrogen 3.035 N/A GLU 126.A N PHE 122.A O no hydrogen 3.132 N/A LYS 127.A N GLU 123.A O no hydrogen 3.345 N/A LYS 127.A NZ GLU 124.A OE1 no hydrogen 3.248 N/A MET 128.A N GLU 124.A O no hydrogen 3.404 N/A PHE 129.A N ARG 125.A O no hydrogen 2.924 N/A GLU 130.A N GLU 126.A O no hydrogen 3.229 N/A PHE 131.A N MET 128.A O no hydrogen 2.760 N/A TYR 132.A N MET 128.A O no hydrogen 3.341 N/A GLU 133.A N PHE 129.A O no hydrogen 2.650 N/A ARG 134.A N GLU 130.A O no hydrogen 2.642 N/A VAL 135.A N TYR 132.A O no hydrogen 3.027 N/A SER 136.A N TYR 132.A O no hydrogen 2.798 N/A SER 136.A OG TYR 132.A O no hydrogen 2.979 N/A GLY 137.A N GLU 133.A O no hydrogen 2.782 N/A ALA 138.A N SER 136.A OG no hydrogen 2.911 N/A ALA 143.A N ASP 55.A OD2 no hydrogen 3.046 N/A TYR 144.A OH GLN 152.A O no hydrogen 2.635 N/A ARG 146.A NE ALA 143.A O no hydrogen 2.351 N/A GLY 149.A N GLU 74.A OE2 no hydrogen 3.019 N/A VAL 150.A N ILE 274.A O no hydrogen 2.937 N/A HIS 151.A N TYR 144.A O no hydrogen 2.794 N/A LEU 158.A N PRO 155.A O no hydrogen 3.424 N/A ASP 161.A N GLY 157.A O no hydrogen 3.328 N/A ILE 162.A N LEU 158.A O no hydrogen 2.780 N/A TYR 163.A N LEU 159.A O no hydrogen 2.972 N/A GLU 164.A N ASP 160.A O no hydrogen 3.076 N/A PHE 165.A N ASP 161.A O no hydrogen 3.048 N/A SER 166.A N ILE 162.A O no hydrogen 2.884 N/A SER 166.A OG ILE 162.A O no hydrogen 2.796 N/A SER 166.A OG TYR 163.A O no hydrogen 2.958 N/A LYS 167.A N TYR 163.A O no hydrogen 2.601 N/A LYS 167.A NZ ASN 168.A OD1 no hydrogen 3.046 N/A ASN 168.A N GLU 164.A O no hydrogen 3.420 N/A PHE 169.A N SER 166.A O no hydrogen 3.348 N/A ILE 173.A N PHE 169.A O no hydrogen 3.108 N/A ASP 174.A N SER 170.A O no hydrogen 2.805 N/A GLU 175.A N LEU 171.A O no hydrogen 2.764 N/A VAL 176.A N ARG 172.A O no hydrogen 3.435 N/A GLU 177.A N ILE 173.A O no hydrogen 2.769 N/A GLU 178.A N ASP 174.A O no hydrogen 2.802 N/A MET 179.A N GLU 175.A O no hydrogen 3.252 N/A LEU 180.A N VAL 176.A O no hydrogen 2.869 N/A THR 181.A OG1 GLU 177.A O no hydrogen 2.936 N/A THR 181.A OG1 TYR 248.A OH no hydrogen 2.783 N/A ARG 187.A N ASN 183.A O no hydrogen 2.946 N/A ASN 188.A N ARG 184.A O no hydrogen 2.785 N/A ARG 189.A N ILE 185.A O no hydrogen 3.112 N/A ARG 189.A NH1 ILE 112.A O no hydrogen 3.073 N/A THR 190.A N TRP 186.A O no hydrogen 2.627 N/A THR 190.A OG1 TRP 186.A O no hydrogen 2.910 N/A VAL 191.A N ARG 187.A O no hydrogen 2.473 N/A ASP 192.A N ASP 243.A OD2 no hydrogen 3.479 N/A GLY 194.A N HIS 360.A NE2 no hydrogen 3.322 N/A THR 197.A OG1 ASP 200.A OD2 no hydrogen 2.493 N/A ALA 201.A N THR 197.A O no hydrogen 3.003 N/A LEU 202.A N ALA 198.A O no hydrogen 3.236 N/A ASN 203.A N GLU 199.A O no hydrogen 2.904 N/A TYR 204.A N ASP 200.A O no hydrogen 2.864 N/A GLY 205.A N LEU 202.A O no hydrogen 3.009 N/A PHE 206.A N ALA 201.A O no hydrogen 2.999 N/A SER 207.A OG GLY 205.A O no hydrogen 3.352 N/A SER 207.A OG PHE 206.A O no hydrogen 2.746 N/A SER 207.A OG SER 207.A O no hydrogen 2.660 N/A ARG 212.A N GLY 208.A O no hydrogen 2.989 N/A ARG 212.A NH1 TRP 218.A O no hydrogen 2.893 N/A ARG 212.A NH1 GLU 319.A OE2 no hydrogen 3.184 N/A ARG 212.A NH2 GLU 254.A OE2 no hydrogen 2.856 N/A ARG 212.A NH2 GLU 319.A OE2 no hydrogen 3.158 N/A GLY 213.A N VAL 209.A O no hydrogen 2.633 N/A SER 214.A OG VAL 196.A O no hydrogen 2.849 N/A SER 214.A OG MET 210.A O no hydrogen 3.534 N/A GLY 215.A N ARG 212.A O no hydrogen 3.015 N/A LYS 222.A N ASP 219.A O no hydrogen 3.045 N/A LYS 222.A NZ PHE 234.A O no hydrogen 3.377 N/A THR 223.A N ASP 219.A O no hydrogen 2.839 N/A THR 223.A OG1 ASP 219.A O no hydrogen 2.922 N/A TYR 229.A OH GLU 94.A OE2 no hydrogen 3.352 N/A GLU 233.A N GLN 264.A OE1 no hydrogen 2.673 N/A ASP 235.A N GLN 257.A OE1 no hydrogen 3.102 N/A ILE 238.A N VAL 236.A O no hydrogen 3.038 N/A GLY 239.A N ARG 212.A O no hydrogen 3.201 N/A SER 240.A N ASP 246.A OD2 no hydrogen 2.885 N/A SER 240.A OG ASP 246.A OD2 no hydrogen 3.477 N/A ARG 241.A NH1 ASP 192.A OD1 no hydrogen 2.618 N/A ARG 241.A NH2 ASP 192.A OD1 no hydrogen 3.136 N/A CYS 244.A N ILE 193.A O no hydrogen 3.151 N/A CYS 244.A SG ILE 193.A O no hydrogen 3.076 N/A CYS 244.A SG THR 371.A OG1 no hydrogen 3.147 N/A TYR 245.A OH THR 181.A O no hydrogen 2.522 N/A ASP 246.A N ASP 243.A OD1 no hydrogen 2.677 N/A ARG 247.A N ASP 243.A O no hydrogen 3.226 N/A ARG 247.A NH2 GLY 194.A O no hydrogen 3.082 N/A TYR 248.A N CYS 244.A O no hydrogen 3.181 N/A TYR 248.A OH THR 181.A OG1 no hydrogen 2.783 N/A LEU 249.A N TYR 245.A O no hydrogen 2.691 N/A CYS 250.A N ASP 246.A O no hydrogen 2.923 N/A CYS 250.A SG PRO 237.A O no hydrogen 3.153 N/A CYS 250.A SG ASP 246.A O no hydrogen 3.075 N/A CYS 250.A SG ASP 246.A OD1 no hydrogen 3.635 N/A ARG 251.A N ARG 247.A O no hydrogen 3.051 N/A ARG 251.A NH1 THR 371.A O no hydrogen 3.117 N/A ARG 251.A NH2 THR 371.A O no hydrogen 2.507 N/A VAL 252.A N TYR 248.A O no hydrogen 2.929 N/A GLU 253.A N LEU 249.A O no hydrogen 2.945 N/A GLU 254.A N CYS 250.A O no hydrogen 2.875 N/A MET 255.A N ARG 251.A O no hydrogen 3.203 N/A ARG 256.A N VAL 252.A O no hydrogen 3.214 N/A ARG 256.A NH1 ASP 174.A OD1 no hydrogen 2.581 N/A ARG 256.A NH2 ASP 174.A OD1 no hydrogen 2.498 N/A GLN 257.A N GLU 253.A O no hydrogen 2.695 N/A SER 258.A N GLU 254.A O no hydrogen 2.733 N/A SER 258.A OG GLU 254.A O no hydrogen 3.012 N/A SER 258.A OG MET 255.A O no hydrogen 2.558 N/A LEU 259.A N MET 255.A O no hydrogen 3.154 N/A ARG 260.A N ARG 256.A O no hydrogen 3.241 N/A ARG 260.A NH1 ASP 235.A OD2 no hydrogen 2.979 N/A ARG 260.A NH1 GLN 257.A OE1 no hydrogen 3.060 N/A ILE 261.A N GLN 257.A O no hydrogen 3.035 N/A ILE 262.A N SER 258.A O no hydrogen 2.745 N/A GLU 263.A N LEU 259.A O no hydrogen 2.981 N/A GLN 264.A N ARG 260.A O no hydrogen 3.278 N/A CYS 265.A N ILE 261.A O no hydrogen 3.001 N/A CYS 265.A SG ILE 261.A O no hydrogen 3.174 N/A LEU 266.A N ILE 262.A O no hydrogen 3.042 N/A ASN 267.A N GLU 263.A O no hydrogen 2.970 N/A LYS 268.A N GLN 264.A O no hydrogen 2.753 N/A LYS 268.A NZ GLN 231.A O no hydrogen 2.773 N/A GLU 273.A N GLU 273.A OE1 no hydrogen 3.047 N/A LYS 275.A NZ HIS 151.A O no hydrogen 2.707 N/A LYS 280.A NZ HIS 298.A NE2 no hydrogen 3.032 N/A VAL 281.A N ASP 278.A O no hydrogen 2.987 N/A SER 282.A N ASP 278.A O no hydrogen 3.002 N/A SER 282.A OG GLY 148.A O no hydrogen 2.981 N/A MET 289.A N LYS 285.A O no hydrogen 3.104 N/A LYS 290.A N ALA 287.A O no hydrogen 3.289 N/A THR 291.A N GLU 288.A O no hydrogen 3.052 N/A THR 291.A OG1 ALA 287.A O no hydrogen 2.823 N/A THR 291.A OG1 GLU 288.A O no hydrogen 3.549 N/A SER 292.A N GLU 288.A O no hydrogen 2.823 N/A SER 292.A OG GLU 288.A O no hydrogen 2.656 N/A SER 292.A OG SER 295.A OG no hydrogen 2.462 N/A GLU 294.A N GLU 294.A OE1 no hydrogen 2.580 N/A SER 295.A OG SER 292.A OG no hydrogen 2.462 N/A LEU 296.A N SER 292.A O no hydrogen 3.166 N/A ILE 297.A N MET 293.A O no hydrogen 3.038 N/A HIS 298.A N GLU 294.A O no hydrogen 3.105 N/A HIS 299.A N SER 295.A O no hydrogen 2.802 N/A PHE 300.A N LEU 296.A O no hydrogen 2.746 N/A LYS 301.A N ILE 297.A O no hydrogen 2.889 N/A LEU 302.A N HIS 298.A O no hydrogen 3.023 N/A TYR 303.A N HIS 299.A O no hydrogen 3.084 N/A THR 304.A N PHE 300.A O no hydrogen 3.013 N/A THR 304.A OG1 PHE 300.A O no hydrogen 2.926 N/A THR 304.A OG1 LYS 301.A O no hydrogen 3.431 N/A GLU 305.A N LYS 301.A O no hydrogen 2.759 N/A GLY 306.A N LYS 301.A O no hydrogen 3.199 N/A GLY 312.A N SER 331.A O no hydrogen 2.861 N/A THR 314.A N LEU 329.A O no hydrogen 3.149 N/A TYR 315.A OH GLU 324.A OE2 no hydrogen 3.084 N/A THR 316.A N VAL 327.A O no hydrogen 3.305 N/A ILE 318.A N PHE 325.A O no hydrogen 3.091 N/A ALA 320.A N ILE 318.A O no hydrogen 3.062 N/A LYS 322.A NZ ASP 373.A O no hydrogen 2.715 N/A GLU 324.A N SER 207.A O no hydrogen 3.133 N/A PHE 325.A N ILE 318.A O no hydrogen 3.151 N/A GLY 326.A N LYS 343.A O no hydrogen 3.315 N/A VAL 327.A N THR 316.A O no hydrogen 3.185 N/A TYR 328.A N LYS 341.A O no hydrogen 2.879 N/A LEU 329.A N THR 314.A O no hydrogen 3.030 N/A VAL 330.A N ARG 339.A O no hydrogen 2.996 N/A SER 331.A N GLY 312.A O no hydrogen 2.613 N/A SER 331.A OG TYR 47.A OH no hydrogen 2.806 N/A SER 331.A OG ASP 332.A O no hydrogen 2.759 N/A SER 334.A OG ARG 336.A O no hydrogen 3.000 N/A SER 335.A OG GLU 305.A O no hydrogen 3.393 N/A TYR 338.A N VAL 330.A O no hydrogen 3.204 N/A ARG 339.A N VAL 330.A O no hydrogen 3.472 N/A LYS 341.A N TYR 328.A O no hydrogen 2.948 N/A ILE 342.A N GLU 39.A OE2 no hydrogen 2.975 N/A LYS 343.A N GLY 326.A O no hydrogen 2.610 N/A PHE 347.A N ALA 344.A O no hydrogen 3.122 N/A HIS 349.A NE2 PHE 206.A O no hydrogen 2.820 N/A LEU 350.A N GLY 346.A O no hydrogen 2.943 N/A ALA 351.A N PHE 347.A O no hydrogen 3.430 N/A GLY 352.A N ALA 348.A O no hydrogen 3.305 N/A LEU 353.A N LEU 350.A O no hydrogen 3.105 N/A MET 356.A N GLY 352.A O no hydrogen 2.699 N/A SER 357.A N LEU 353.A O no hydrogen 2.715 N/A SER 357.A OG LEU 353.A O no hydrogen 2.677 N/A SER 357.A OG SER 357.A O no hydrogen 2.565 N/A MET 361.A N ASP 364.A OD2 no hydrogen 3.338 N/A VAL 365.A N MET 361.A O no hydrogen 3.414 N/A VAL 365.A N LEU 362.A O no hydrogen 3.190 N/A ILE 368.A N ASP 364.A O no hydrogen 2.773 N/A ILE 369.A N VAL 365.A O no hydrogen 2.993 N/A GLY 370.A N VAL 366.A O no hydrogen 3.279 N/A THR 371.A N ALA 367.A O no hydrogen 2.955 N/A THR 371.A N ILE 368.A O no hydrogen 3.296 N/A THR 371.A OG1 ALA 367.A O no hydrogen 3.038 N/A THR 371.A OG1 ILE 368.A O no hydrogen 2.994 N/A GLN 372.A N ILE 369.A O no hydrogen 3.139 N/A ASP 373.A N GLY 370.A O no hydrogen 3.367 N/A VAL 375.A N GLU 378.A OE2 no hydrogen 3.200 N/A ASP 380.A N PHE 376.A O no hydrogen 2.775 N/A ARG 381.A N GLY 377.A O no hydrogen 2.839 N/A