Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1rer_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N MET 280.A O no hydrogen 3.058 N/A HIS 3.A ND1 ASP 284.A OD2 no hydrogen 2.923 N/A SER 4.A OG VAL 278.A O no hydrogen 3.504 N/A THR 5.A N VAL 278.A O no hydrogen 2.961 N/A THR 5.A OG1 HIS 3.A NE2 no hydrogen 3.027 N/A MET 7.A N ILE 276.A O no hydrogen 2.945 N/A ASN 9.A N GLY 274.A O no hydrogen 3.147 N/A ASN 9.A ND2 VAL 273.A O no hydrogen 3.014 N/A TYR 15.A N MET 31.A O no hydrogen 3.227 N/A LYS 16.A NZ GLU 292.A OE1 no hydrogen 3.327 N/A ALA 17.A N LEU 29.A O no hydrogen 2.983 N/A HIS 18.A N THR 288.A O no hydrogen 2.679 N/A GLU 20.A N ALA 286.A O no hydrogen 2.846 N/A LEU 27.A N ILE 19.A O no hydrogen 3.015 N/A GLN 30.A N MET 136.A O no hydrogen 3.185 N/A MET 31.A N TYR 15.A O no hydrogen 3.201 N/A GLN 32.A N ARG 134.A O no hydrogen 3.167 N/A VAL 34.A N LYS 132.A O no hydrogen 2.832 N/A THR 36.A OG1 GLU 35.A O no hydrogen 2.988 N/A SER 37.A N LYS 130.A O no hydrogen 2.908 N/A SER 37.A OG GLU 39.A OE1 no hydrogen 2.680 N/A LEU 38.A N ALA 268.A O no hydrogen 3.065 N/A GLU 39.A N SER 128.A O no hydrogen 3.044 N/A THR 41.A N HIS 125.A O no hydrogen 2.831 N/A ASN 43.A N LYS 123.A O no hydrogen 2.865 N/A GLU 45.A N ALA 121.A O no hydrogen 2.834 N/A TYR 46.A N ALA 121.A O no hydrogen 3.445 N/A TYR 46.A OH PRO 190.A O no hydrogen 2.773 N/A ILE 47.A N SER 205.A O no hydrogen 2.743 N/A THR 48.A OG1 ILE 203.A O no hydrogen 2.621 N/A TYR 51.A OH THR 236.A O no hydrogen 2.880 N/A LYS 52.A N ASP 109.A O no hydrogen 2.928 N/A VAL 54.A N TYR 107.A O no hydrogen 3.000 N/A LYS 61.A N THR 101.A O no hydrogen 3.264 N/A CYS 68.A SG GLU 67.A OE2 no hydrogen 3.561 N/A TYR 76.A N LYS 73.A O no hydrogen 2.657 N/A TYR 76.A OH GLU 105.A OE2 no hydrogen 2.710 N/A GLN 77.A N ALA 106.A O no hydrogen 3.167 N/A CYS 78.A SG SER 69.A O no hydrogen 3.487 N/A LYS 79.A N SER 104.A O no hydrogen 2.897 N/A TYR 81.A N GLN 102.A O no hydrogen 2.547 N/A GLY 83.A N SER 98.A OG no hydrogen 3.222 N/A GLY 83.A N ASN 100.A O no hydrogen 2.804 N/A VAL 84.A N ASN 100.A O no hydrogen 3.221 N/A GLY 91.A N TRP 89.A O no hydrogen 3.188 N/A CYS 94.A SG GLU 99.A O no hydrogen 3.134 N/A CYS 94.A SG ASN 100.A OD1 no hydrogen 3.354 N/A CYS 96.A SG CYS 94.A O no hydrogen 3.966 N/A GLU 99.A N ASP 97.A O no hydrogen 2.540 N/A THR 101.A N CYS 62.A O no hydrogen 3.318 N/A GLN 102.A N TYR 81.A O no hydrogen 2.798 N/A GLN 102.A NE2 TYR 59.A O no hydrogen 3.047 N/A LEU 103.A N TYR 59.A O no hydrogen 3.465 N/A SER 104.A N LYS 79.A O no hydrogen 3.333 N/A SER 104.A OG LYS 79.A O no hydrogen 3.134 N/A ALA 106.A N GLN 77.A O no hydrogen 3.447 N/A TYR 107.A N VAL 54.A O no hydrogen 2.944 N/A VAL 108.A N PRO 74.A O no hydrogen 2.965 N/A ASP 109.A N LYS 52.A O no hydrogen 3.232 N/A ARG 110.A NE VAL 208.A O no hydrogen 2.825 N/A ARG 110.A NH2 VAL 208.A O no hydrogen 2.699 N/A ARG 110.A NH2 SER 210.A O no hydrogen 2.585 N/A SER 111.A N GLU 50.A O no hydrogen 2.909 N/A VAL 113.A N SER 111.A OG no hydrogen 3.426 N/A CYS 114.A N SER 111.A O no hydrogen 3.150 N/A CYS 114.A SG GLU 50.A O no hydrogen 3.878 N/A CYS 114.A SG SER 111.A O no hydrogen 3.465 N/A HIS 116.A N VAL 113.A O no hydrogen 3.229 N/A ASP 117.A N CYS 114.A O no hydrogen 2.845 N/A HIS 118.A ND1 CYS 114.A O no hydrogen 2.983 N/A ALA 119.A N THR 48.A O no hydrogen 3.234 N/A SER 120.A N VAL 179.A O no hydrogen 2.701 N/A ALA 121.A N TYR 46.A O no hydrogen 3.039 N/A TYR 122.A N ILE 177.A O no hydrogen 3.054 N/A LYS 123.A N ASN 43.A O no hydrogen 3.236 N/A ALA 127.A N GLU 39.A O no hydrogen 3.019 N/A SER 128.A N GLU 39.A O no hydrogen 3.346 N/A SER 128.A OG ASN 149.A OD1 no hydrogen 2.692 N/A LYS 130.A N SER 37.A O no hydrogen 3.081 N/A LYS 130.A NZ GLU 39.A OE1 no hydrogen 2.899 N/A ALA 131.A N VAL 146.A O no hydrogen 2.761 N/A LYS 132.A N GLU 35.A O no hydrogen 3.336 N/A VAL 133.A N VAL 144.A O no hydrogen 2.941 N/A ARG 134.A N GLN 32.A O no hydrogen 2.967 N/A VAL 135.A N GLN 142.A O no hydrogen 2.832 N/A MET 136.A N GLN 30.A O no hydrogen 2.633 N/A TYR 137.A OH THR 159.A OG1 no hydrogen 2.971 N/A VAL 140.A N TYR 137.A O no hydrogen 2.766 N/A GLN 142.A N VAL 135.A O no hydrogen 2.999 N/A VAL 144.A N VAL 133.A O no hydrogen 2.840 N/A VAL 146.A N ALA 131.A O no hydrogen 2.876 N/A VAL 154.A N PHE 161.A O no hydrogen 2.736 N/A ILE 156.A N THR 159.A O no hydrogen 2.849 N/A THR 159.A N ILE 156.A O no hydrogen 3.285 N/A THR 159.A OG1 TYR 137.A OH no hydrogen 2.971 N/A THR 159.A OG1 GLY 157.A O no hydrogen 3.369 N/A PHE 161.A N VAL 154.A O no hydrogen 2.686 N/A ILE 162.A N SER 279.A O no hydrogen 3.093 N/A PHE 163.A N HIS 152.A O no hydrogen 2.847 N/A LEU 166.A N TYR 147.A O no hydrogen 2.748 N/A SER 167.A N ASN 275.A O no hydrogen 3.027 N/A SER 167.A OG ASN 275.A O no hydrogen 3.326 N/A PHE 173.A N THR 171.A OG1 no hydrogen 3.174 N/A ASP 174.A N ASN 186.A OD1 no hydrogen 2.970 N/A LYS 176.A NZ ASP 188.A OD1 no hydrogen 2.936 N/A LYS 176.A NZ PHE 189.A O no hydrogen 3.360 N/A ILE 177.A N TYR 122.A O no hydrogen 3.133 N/A VAL 178.A N PHE 185.A O no hydrogen 2.885 N/A VAL 179.A N SER 120.A O no hydrogen 2.656 N/A TYR 180.A N GLU 183.A O no hydrogen 3.216 N/A TYR 180.A OH ASP 117.A OD2 no hydrogen 3.306 N/A LYS 181.A NZ HIS 116.A O no hydrogen 3.226 N/A LYS 181.A NZ ASP 117.A OD2 no hydrogen 3.367 N/A VAL 184.A N ASN 252.A OD1 no hydrogen 3.041 N/A PHE 185.A N VAL 178.A O no hydrogen 2.879 N/A ASN 186.A ND2 PRO 172.A O no hydrogen 3.401 N/A TYR 192.A OH ASP 212.A O no hydrogen 2.670 N/A SER 194.A N TYR 192.A O no hydrogen 2.604 N/A GLY 198.A N ASP 202.A OD2 no hydrogen 3.184 N/A GLN 204.A N TYR 214.A O no hydrogen 2.608 N/A GLN 204.A NE2 PRO 191.A O no hydrogen 2.750 N/A SER 205.A N ILE 47.A O no hydrogen 3.227 N/A SER 205.A OG THR 207.A O no hydrogen 2.800 N/A ARG 206.A N ASP 212.A OD1 no hydrogen 3.030 N/A ARG 206.A N ASP 212.A OD2 no hydrogen 3.451 N/A ARG 206.A NH1 LEU 44.A O no hydrogen 3.207 N/A SER 210.A N THR 207.A O no hydrogen 3.110 N/A SER 210.A OG ASP 212.A OD1 no hydrogen 2.441 N/A ASP 212.A N SER 210.A OG no hydrogen 3.015 N/A TYR 214.A N GLN 204.A O no hydrogen 2.694 N/A ASN 216.A N ASP 202.A O no hydrogen 3.266 N/A ASN 216.A ND2 GLY 195.A O no hydrogen 3.379 N/A THR 217.A N ASP 75.A OD2 no hydrogen 2.892 N/A THR 217.A OG1 ASP 75.A OD2 no hydrogen 3.062 N/A THR 217.A OG1 GLN 235.A OE1 no hydrogen 3.139 N/A LYS 220.A N THR 234.A O no hydrogen 2.737 N/A ALA 222.A N PRO 232.A O no hydrogen 2.907 N/A THR 234.A N LYS 220.A O no hydrogen 2.706 N/A THR 234.A OG1 LYS 220.A O no hydrogen 3.530 N/A GLN 235.A NE2 THR 53.A OG1 no hydrogen 3.044 N/A THR 236.A OG1 THR 217.A O no hydrogen 2.895 N/A GLY 239.A N ASP 202.A OD2 no hydrogen 2.512 N/A LYS 241.A N SER 238.A OG no hydrogen 3.295 N/A TYR 242.A N SER 238.A O no hydrogen 3.161 N/A TYR 242.A OH ILE 387.A O no hydrogen 3.067 N/A TRP 243.A N GLY 239.A O no hydrogen 2.710 N/A TRP 243.A NE1 GLN 187.A OE1 no hydrogen 3.066 N/A LEU 244.A N PHE 240.A O no hydrogen 3.057 N/A GLU 246.A N TYR 242.A O no hydrogen 3.004 N/A LYS 247.A N TRP 243.A O no hydrogen 2.902 N/A LEU 251.A N VAL 184.A O no hydrogen 2.858 N/A ASN 252.A ND2 ASP 182.A O no hydrogen 2.934 N/A THR 253.A N ALA 250.A O no hydrogen 3.455 N/A LYS 254.A N LEU 251.A O no hydrogen 2.643 N/A GLY 258.A N GLN 340.A O no hydrogen 3.018 N/A CYS 259.A N PRO 256.A O no hydrogen 2.881 N/A CYS 259.A SG MET 269.A O no hydrogen 4.043 N/A GLN 260.A N MET 269.A O no hydrogen 2.974 N/A LYS 262.A N ARG 267.A O no hydrogen 3.030 N/A THR 263.A OG1 ASP 182.A O no hydrogen 3.403 N/A ARG 267.A N LYS 262.A O no hydrogen 3.346 N/A ALA 268.A N LEU 38.A O no hydrogen 3.166 N/A MET 269.A N GLN 260.A O no hydrogen 2.671 N/A ASN 270.A N THR 36.A O no hydrogen 2.914 N/A ALA 272.A N PHE 257.A O no hydrogen 3.273 N/A ASN 275.A N SER 167.A OG no hydrogen 2.800 N/A ILE 276.A N MET 7.A O no hydrogen 2.757 N/A VAL 278.A N THR 5.A O no hydrogen 3.132 N/A MET 280.A N HIS 3.A O no hydrogen 3.090 N/A ALA 286.A N PRO 283.A O no hydrogen 3.027 N/A ILE 290.A N LYS 16.A O no hydrogen 2.735 N/A THR 295.A N ASN 323.A OD1 no hydrogen 2.761 N/A ILE 297.A N LYS 321.A O no hydrogen 3.018 N/A THR 300.A N THR 319.A O no hydrogen 3.013 N/A ALA 304.A N VAL 315.A O no hydrogen 3.148 N/A CYS 306.A SG THR 307.A O no hydrogen 3.858 N/A THR 307.A N GLY 313.A O no hydrogen 2.993 N/A HIS 308.A N GLU 381.A O no hydrogen 2.598 N/A SER 310.A N HIS 308.A O no hydrogen 3.105 N/A GLY 314.A N PHE 356.A O no hydrogen 3.116 N/A VAL 315.A N THR 305.A O no hydrogen 2.994 N/A LEU 316.A N LEU 354.A O no hydrogen 2.758 N/A THR 317.A N THR 302.A O no hydrogen 3.093 N/A LEU 318.A N VAL 352.A O no hydrogen 2.716 N/A THR 319.A N THR 300.A O no hydrogen 2.910 N/A TYR 320.A N GLY 350.A O no hydrogen 3.301 N/A TYR 320.A OH LYS 347.A O no hydrogen 2.875 N/A LYS 321.A N ILE 297.A O no hydrogen 3.080 N/A THR 322.A OG1 LYS 324.A O no hydrogen 2.937 N/A LYS 324.A N THR 322.A OG1 no hydrogen 2.914 N/A GLY 326.A N VAL 346.A O no hydrogen 2.839 N/A CYS 328.A N ALA 344.A O no hydrogen 2.961 N/A CYS 328.A SG PRO 294.A O no hydrogen 3.989 N/A HIS 331.A N SER 368.A O no hydrogen 3.345 N/A SER 332.A OG SER 334.A O no hydrogen 3.404 N/A SER 332.A OG ALA 337.A O no hydrogen 2.876 N/A HIS 333.A N VAL 366.A O no hydrogen 3.067 N/A ALA 337.A N SER 334.A O no hydrogen 2.901 N/A THR 338.A N SER 357.A O no hydrogen 2.861 N/A THR 338.A OG1 SER 357.A O no hydrogen 2.976 N/A GLN 340.A N HIS 355.A O no hydrogen 2.901 N/A THR 343.A OG1 CYS 328.A O no hydrogen 2.997 N/A ALA 344.A N CYS 328.A O no hydrogen 2.955 N/A VAL 346.A N GLY 326.A O no hydrogen 3.010 N/A GLY 350.A N LYS 347.A O no hydrogen 3.265 N/A VAL 352.A N LEU 318.A O no hydrogen 3.118 N/A LEU 354.A N LEU 316.A O no hydrogen 2.941 N/A HIS 355.A N GLU 341.A OE2 no hydrogen 2.511 N/A PHE 356.A N GLY 314.A O no hydrogen 3.098 N/A SER 357.A N THR 338.A O no hydrogen 2.679 N/A THR 358.A OG1 VAL 336.A O no hydrogen 2.768 N/A SER 360.A N THR 358.A OG1 no hydrogen 2.928 N/A SER 360.A OG ALA 361.A O no hydrogen 3.460 N/A SER 362.A OG SER 379.A OG no hydrogen 3.282 N/A SER 368.A N HIS 331.A O no hydrogen 2.824 N/A SER 368.A OG HIS 331.A O no hydrogen 3.536 N/A LEU 369.A N ALA 372.A O no hydrogen 2.926 N/A CYS 370.A N SER 329.A O no hydrogen 2.942 N/A CYS 370.A SG PRO 294.A O no hydrogen 4.042 N/A ALA 372.A N LEU 369.A O no hydrogen 3.085 N/A ALA 374.A N VAL 367.A O no hydrogen 3.222 N/A CYS 376.A N PHE 365.A O no hydrogen 2.750 N/A SER 379.A OG SER 362.A OG no hydrogen 3.282 N/A GLU 381.A N CYS 306.A O no hydrogen 3.166 N/A