Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ut1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A SG SER 6.A OG.A no hydrogen 3.117 N/A CYS 3.A SG SER 6.A OG.B no hydrogen 3.416 N/A TRP 4.A NE1 GLU 250.A OE2 no hydrogen 2.962 N/A SER 6.A OG.B CYS 3.A O no hydrogen 3.282 N/A TYR 7.A N CYS 3.A O no hydrogen 3.007 N/A TYR 7.A OH ASP 278.A OD2 no hydrogen 2.589 N/A LEU 8.A N TRP 4.A O no hydrogen 2.822 N/A GLU 9.A N ALA 5.A O no hydrogen 3.218 N/A GLU 10.A N SER 6.A O no hydrogen 2.952 N/A GLU 11.A N TYR 7.A O no hydrogen 3.037 N/A LYS 12.A N GLU 9.A O no hydrogen 2.704 N/A ALA 13.A N LEU 8.A O no hydrogen 3.043 N/A VAL 16.A N LYS 248.A O no hydrogen 2.788 N/A LEU 20.A N PRO 17.A O no hydrogen 2.978 N/A PHE 21.A N ALA 18.A O no hydrogen 2.837 N/A LYS 22.A N GLN 25.A OE1 no hydrogen 2.716 N/A HIS 24.A ND1 ASP 82.A OD2 no hydrogen 2.956 N/A GLN 25.A N LYS 22.A O no hydrogen 2.812 N/A GLN 25.A NE2 ALA 290.A O no hydrogen 2.840 N/A GLN 25.A NE2 SER 292.A O no hydrogen 2.995 N/A SER 26.A N LYS 22.A O no hydrogen 2.932 N/A ASN 30.A ND2 LYS 31.A O no hydrogen 2.730 N/A ASN 32.A ND2 GLY 61.A O no hydrogen 2.987 N/A ASN 32.A ND2 ARG 63.A O no hydrogen 3.383 N/A PHE 34.A N ASN 32.A OD1 no hydrogen 2.876 N/A GLY 37.A N VAL 56.A O no hydrogen 2.870 N/A MET 38.A N LYS 35.A O no hydrogen 3.012 N/A LYS 39.A N GLN 122.A O no hydrogen 3.030 N/A LYS 39.A NZ THR 55.A OG1 no hydrogen 2.721 N/A LYS 39.A NZ ASP 69.A OD2 no hydrogen 2.786 N/A LEU 40.A N LEU 54.A O no hydrogen 2.895 N/A GLU 41.A N HIS 87.A O no hydrogen 2.850 N/A GLY 42.A N CYS 52.A O no hydrogen 2.977 N/A VAL 43.A N ASP 85.A O no hydrogen 2.981 N/A ASP 44.A N VAL 50.A O no hydrogen 2.879 N/A GLU 46.A N ASP 44.A OD1 no hydrogen 3.112 N/A HIS 47.A N ASP 44.A O no hydrogen 2.638 N/A HIS 47.A ND1 ASP 44.A OD2 no hydrogen 3.192 N/A GLN 48.A NE2 PRO 45.A O no hydrogen 3.582 N/A SER 49.A OG GLU 180.A OE1 no hydrogen 3.136 N/A VAL 50.A N HIS 47.A O no hydrogen 2.896 N/A CYS 52.A N GLY 42.A O no hydrogen 2.682 N/A VAL 53.A N HIS 100.A O no hydrogen 3.276 N/A LEU 54.A N LEU 40.A O no hydrogen 3.004 N/A THR 55.A N HIS 67.A O no hydrogen 3.037 N/A THR 55.A OG1 ASP 69.A OD1 no hydrogen 2.493 N/A THR 55.A OG1 ASP 69.A OD2 no hydrogen 3.100 N/A VAL 56.A N MET 38.A O no hydrogen 2.757 N/A ALA 57.A N LYS 65.A O no hydrogen 2.888 N/A GLU 58.A N LYS 65.A O no hydrogen 3.442 N/A CYS 60.A N ARG 63.A O no hydrogen 2.845 N/A ARG 63.A N CYS 60.A O no hydrogen 2.796 N/A ARG 63.A NH1 PRO 257.A O no hydrogen 2.949 N/A ARG 63.A NH1 HIS 306.A NE2 no hydrogen 3.115 N/A ARG 63.A NH2 PRO 257.A O no hydrogen 2.807 N/A ILE 64.A N VAL 79.A O no hydrogen 2.890 N/A LYS 65.A N GLU 58.A O no hydrogen 2.863 N/A LYS 65.A NZ GLU 58.A OE2 no hydrogen 2.291 N/A LEU 66.A N PHE 77.A O no hydrogen 2.711 N/A HIS 67.A N THR 55.A O no hydrogen 2.929 N/A HIS 67.A ND1 ASP 76.A OD1 no hydrogen 2.707 N/A ASP 69.A N VAL 53.A O no hydrogen 3.319 N/A TYR 71.A N PHE 68.A O no hydrogen 2.880 N/A CYS 74.A N SER 72.A OG no hydrogen 3.203 N/A CYS 74.A SG SER 72.A OG no hydrogen 3.126 N/A TYR 75.A N SER 72.A O no hydrogen 3.367 N/A ASP 76.A N ASP 73.A O no hydrogen 3.054 N/A PHE 77.A N LEU 66.A O no hydrogen 3.059 N/A VAL 79.A N ILE 64.A O no hydrogen 3.010 N/A ASN 80.A ND2 PRO 293.A O no hydrogen 2.983 N/A ALA 81.A N TYR 62.A O no hydrogen 2.735 N/A ALA 83.A N ASN 80.A O no hydrogen 2.970 N/A HIS 87.A N GLU 41.A O no hydrogen 2.789 N/A HIS 87.A ND1 ASN 131.A OD1 no hydrogen 3.183 N/A GLY 90.A N GLU 41.A OE2 no hydrogen 3.064 N/A TRP 91.A N PRO 88.A O no hydrogen 3.054 N/A CYS 92.A N GLU 41.A OE1 no hydrogen 2.758 N/A CYS 92.A SG GLU 41.A OE1 no hydrogen 3.543 N/A CYS 92.A SG LYS 98.A O no hydrogen 4.013 N/A LYS 94.A N GLY 90.A O no hydrogen 2.875 N/A THR 95.A N TRP 91.A O no hydrogen 2.894 N/A THR 95.A OG1 TRP 91.A O no hydrogen 2.730 N/A THR 95.A OG1 CYS 92.A O no hydrogen 3.439 N/A THR 95.A OG1 HIS 97.A ND1 no hydrogen 2.730 N/A HIS 97.A N CYS 92.A O no hydrogen 2.983 N/A HIS 97.A ND1 THR 95.A OG1 no hydrogen 2.730 N/A HIS 97.A NE2 ASP 165.A OD2 no hydrogen 2.665 N/A HIS 100.A N TYR 51.A O no hydrogen 2.711 N/A HIS 100.A ND1 PRO 101.A O no hydrogen 2.944 N/A LYS 103.A N ASP 69.A O no hydrogen 3.291 N/A TYR 105.A N PRO 102.A O no hydrogen 3.316 N/A PHE 110.A N LYS 106.A O no hydrogen 3.067 N/A TRP 112.A NE1 GLU 41.A OE2 no hydrogen 2.779 N/A THR 114.A OG1 ASN 111.A O no hydrogen 3.067 N/A TYR 115.A N ASN 111.A O no hydrogen 2.965 N/A TYR 115.A OH ASP 69.A OD2 no hydrogen 2.463 N/A LEU 116.A N TRP 112.A O no hydrogen 2.837 N/A LYS 117.A N THR 114.A O no hydrogen 3.206 N/A THR 118.A N THR 114.A O no hydrogen 3.066 N/A THR 118.A OG1 THR 114.A O no hydrogen 3.040 N/A CYS 119.A N TYR 115.A O no hydrogen 3.130 N/A CYS 119.A SG TYR 115.A O no hydrogen 3.295 N/A LYS 120.A N LYS 117.A O no hydrogen 2.643 N/A ALA 121.A N LEU 116.A O no hydrogen 2.831 N/A ALA 124.A N LYS 39.A O no hydrogen 2.906 N/A LEU 128.A N PRO 125.A O no hydrogen 3.278 N/A PHE 129.A N LYS 126.A O no hydrogen 3.184 N/A ASN 131.A ND2 ALA 83.A O no hydrogen 3.361 N/A ASN 131.A ND2 ILE 86.A O no hydrogen 2.818 N/A GLN 132.A N PHE 129.A O no hydrogen 3.225 N/A ILE 137.A N ASN 169.A OD1 no hydrogen 2.976 N/A PHE 141.A N SER 139.A OG no hydrogen 2.765 N/A GLY 144.A N VAL 163.A O no hydrogen 2.740 N/A MET 145.A N ARG 142.A O no hydrogen 3.191 N/A LYS 146.A N LEU 228.A O no hydrogen 2.947 N/A LYS 146.A NZ THR 162.A OG1 no hydrogen 2.765 N/A LYS 146.A NZ ASP 176.A OD2 no hydrogen 2.682 N/A LEU 147.A N ALA 161.A O no hydrogen 2.919 N/A GLU 148.A N HIS 194.A O no hydrogen 2.791 N/A ALA 149.A N CYS 159.A O no hydrogen 2.853 N/A VAL 150.A N HIS 192.A O no hydrogen 2.750 N/A ASP 151.A N PHE 157.A O no hydrogen 2.997 N/A LYS 153.A N ASP 151.A OD1 no hydrogen 2.916 N/A LYS 153.A NZ GLU 46.A O no hydrogen 3.090 N/A LYS 153.A NZ SER 181.A O no hydrogen 2.638 N/A ASN 154.A N ASP 151.A O no hydrogen 2.882 N/A ASN 154.A ND2 ASP 151.A OD2 no hydrogen 2.805 N/A PHE 157.A N ASN 154.A O no hydrogen 3.026 N/A CYS 159.A N ALA 149.A O no hydrogen 2.843 N/A VAL 160.A N ILE 207.A O no hydrogen 3.217 N/A ALA 161.A N LEU 147.A O no hydrogen 2.891 N/A THR 162.A N HIS 174.A O no hydrogen 2.830 N/A THR 162.A OG1 ASP 176.A OD1 no hydrogen 2.719 N/A VAL 163.A N MET 145.A O no hydrogen 2.918 N/A THR 164.A N LEU 172.A O no hydrogen 2.953 N/A THR 164.A OG1 LEU 172.A O no hydrogen 3.440 N/A MET 166.A N ASP 165.A OD1 no hydrogen 2.553 N/A VAL 167.A N ARG 170.A O no hydrogen 2.959 N/A ASN 169.A ND2 THR 135.A O no hydrogen 3.091 N/A ARG 170.A N VAL 167.A O no hydrogen 3.007 N/A ARG 170.A NE ASP 85.A OD1 no hydrogen 3.291 N/A PHE 171.A N CYS 186.A O no hydrogen 2.812 N/A LEU 172.A N ASP 165.A O no hydrogen 2.742 N/A VAL 173.A N TYR 184.A O no hydrogen 2.743 N/A HIS 174.A N THR 162.A O no hydrogen 2.908 N/A HIS 174.A ND1 ASP 183.A OD1 no hydrogen 2.955 N/A ASP 176.A N VAL 160.A O no hydrogen 3.374 N/A ASN 177.A ND2 PRO 210.A O no hydrogen 2.598 N/A TRP 178.A N PHE 175.A O no hydrogen 2.876 N/A SER 181.A N ASP 179.A OD1 no hydrogen 2.770 N/A SER 181.A OG ASP 179.A OD1 no hydrogen 2.591 N/A ASP 183.A N GLU 180.A O no hydrogen 2.772 N/A TYR 184.A N VAL 173.A O no hydrogen 3.074 N/A TYR 184.A OH VAL 150.A O no hydrogen 2.692 N/A TRP 185.A N GLN 48.A OE1 no hydrogen 2.994 N/A TRP 185.A NE1 GLN 48.A O no hydrogen 2.778 N/A CYS 186.A N PHE 171.A O no hydrogen 2.958 N/A CYS 186.A SG GLU 187.A O no hydrogen 3.722 N/A SER 190.A N GLU 187.A O no hydrogen 3.198 N/A HIS 192.A N SER 190.A OG no hydrogen 2.897 N/A HIS 194.A N GLU 148.A O no hydrogen 2.662 N/A GLY 197.A N GLU 148.A OE2 no hydrogen 2.893 N/A TRP 198.A N PRO 195.A O no hydrogen 3.225 N/A CYS 199.A N GLU 148.A OE1 no hydrogen 2.829 N/A CYS 199.A SG GLU 148.A OE1 no hydrogen 3.527 N/A GLU 201.A N TRP 198.A O no hydrogen 3.177 N/A HIS 202.A N TRP 198.A O no hydrogen 3.052 N/A HIS 202.A N CYS 199.A O no hydrogen 3.105 N/A HIS 202.A ND1 TRP 198.A O no hydrogen 2.673 N/A ARG 204.A N CYS 199.A O no hydrogen 2.842 N/A ILE 207.A N ILE 158.A O no hydrogen 2.921 N/A THR 208.A OG1 TYR 212.A O no hydrogen 3.538 N/A TYR 212.A N PRO 209.A O no hydrogen 3.295 N/A TRP 218.A NE1 GLU 148.A OE2 no hydrogen 2.790 N/A LYS 220.A N SER 217.A OG no hydrogen 3.164 N/A TYR 221.A N SER 217.A O no hydrogen 3.069 N/A TYR 221.A OH ASP 176.A OD2 no hydrogen 2.617 N/A LEU 222.A N TRP 218.A O no hydrogen 2.819 N/A GLU 223.A N ASP 219.A O no hydrogen 2.989 N/A GLU 224.A N LYS 220.A O no hydrogen 2.857 N/A THR 225.A N TYR 221.A O no hydrogen 3.025 N/A THR 225.A OG1 TYR 221.A O no hydrogen 2.542 N/A THR 225.A OG1 LEU 222.A O no hydrogen 3.527 N/A ASN 226.A N GLU 223.A O no hydrogen 3.047 N/A SER 227.A N LEU 222.A O no hydrogen 2.768 N/A SER 227.A OG THR 225.A O no hydrogen 2.905 N/A ALA 230.A N LYS 146.A O no hydrogen 2.876 N/A ALA 234.A N PRO 231.A O no hydrogen 3.041 N/A PHE 235.A N ALA 232.A O no hydrogen 3.075 N/A LYS 236.A N ALA 188.A O no hydrogen 3.025 N/A LYS 238.A NZ ASP 291.A OD2 no hydrogen 3.200 N/A HIS 241.A NE2 ASP 269.A O no hydrogen 2.976 N/A PHE 243.A N HIS 241.A ND1 no hydrogen 2.878 N/A LYS 246.A N VAL 265.A O no hydrogen 2.739 N/A MET 247.A N GLN 244.A O no hydrogen 3.383 N/A LYS 248.A N VAL 14.A O no hydrogen 2.743 N/A LYS 248.A NZ THR 264.A OG1 no hydrogen 2.515 N/A LYS 248.A NZ ASP 278.A OD2 no hydrogen 2.587 N/A LEU 249.A N ALA 263.A O no hydrogen 3.114 N/A GLU 250.A N HIS 296.A O no hydrogen 2.977 N/A VAL 251.A N ARG 261.A O no hydrogen 3.199 N/A VAL 252.A N ASP 294.A O no hydrogen 2.980 N/A ASP 253.A N PHE 259.A O no hydrogen 2.831 N/A LYS 254.A N TYR 286.A OH no hydrogen 3.014 N/A ARG 255.A N ASP 253.A OD1 no hydrogen 2.954 N/A ARG 255.A NH1 TYR 284.A O no hydrogen 2.848 N/A ARG 255.A NH2 TYR 284.A O no hydrogen 2.993 N/A ARG 255.A NH2 ASP 285.A O no hydrogen 3.087 N/A ASN 256.A N ASP 253.A OD1 no hydrogen 2.977 N/A PHE 259.A N ASN 256.A O no hydrogen 2.946 N/A ARG 261.A N VAL 251.A O no hydrogen 2.948 N/A ARG 261.A NE ASP 253.A OD2 no hydrogen 2.640 N/A ARG 261.A NH2 ASP 253.A OD2 no hydrogen 3.029 N/A VAL 262.A N GLN 309.A O no hydrogen 3.271 N/A ALA 263.A N LEU 249.A O no hydrogen 2.914 N/A THR 264.A N HIS 276.A O no hydrogen 2.737 N/A THR 264.A OG1 ASP 278.A OD1 no hydrogen 2.512 N/A VAL 265.A N MET 247.A O no hydrogen 2.945 N/A ALA 266.A N LYS 274.A O no hydrogen 2.648 N/A ASP 267.A N LYS 274.A O no hydrogen 3.405 N/A THR 268.A N ASP 267.A OD1 no hydrogen 2.847 N/A ASP 269.A N ARG 272.A O no hydrogen 3.007 N/A HIS 271.A N ASP 269.A OD1 no hydrogen 2.875 N/A HIS 271.A ND1 ASP 270.A OD1 no hydrogen 3.032 N/A HIS 271.A ND1 ASP 270.A OD2 no hydrogen 2.850 N/A ARG 272.A N ASP 269.A OD1 no hydrogen 2.643 N/A ARG 272.A NE ASP 269.A OD2 no hydrogen 2.779 N/A ARG 272.A NH1 ASP 269.A OD2 no hydrogen 3.284 N/A VAL 273.A N ILE 288.A O no hydrogen 2.793 N/A LYS 274.A N ASP 267.A O no hydrogen 2.921 N/A VAL 275.A N TYR 286.A O no hydrogen 2.769 N/A HIS 276.A N THR 264.A O no hydrogen 2.837 N/A HIS 276.A ND1 ASP 285.A OD1 no hydrogen 2.711 N/A ASP 278.A N VAL 262.A O no hydrogen 3.215 N/A TRP 280.A N PHE 277.A O no hydrogen 3.008 N/A CYS 283.A N ASN 281.A OD1 no hydrogen 3.321 N/A CYS 283.A SG ASN 281.A OD1 no hydrogen 3.325 N/A TYR 284.A N ASN 281.A O no hydrogen 3.120 N/A ASP 285.A N ASN 282.A O no hydrogen 3.052 N/A TYR 286.A N VAL 275.A O no hydrogen 3.022 N/A ILE 288.A N VAL 273.A O no hydrogen 2.780 N/A ALA 290.A N HIS 271.A O no hydrogen 2.961 N/A SER 292.A N ASP 289.A O no hydrogen 3.007 N/A ASP 294.A N SER 292.A OG no hydrogen 2.927 N/A ILE 295.A N SER 292.A O no hydrogen 3.440 N/A HIS 296.A N GLU 250.A O no hydrogen 2.754 N/A HIS 296.A ND1 GLN 25.A O no hydrogen 2.856 N/A GLY 299.A N GLU 250.A OE2 no hydrogen 2.800 N/A TRP 300.A N PRO 297.A O no hydrogen 3.077 N/A TRP 300.A NE1 SER 26.A O no hydrogen 3.154 N/A CYS 301.A N GLU 250.A OE1 no hydrogen 2.901 N/A CYS 301.A SG GLU 250.A OE1 no hydrogen 3.188 N/A CYS 301.A SG PRO 307.A O no hydrogen 3.796 N/A LYS 303.A N GLY 299.A O no hydrogen 3.028 N/A THR 304.A N TRP 300.A O no hydrogen 3.027 N/A THR 304.A N CYS 301.A O no hydrogen 3.282 N/A THR 304.A OG1 TRP 300.A O no hydrogen 2.783 N/A THR 304.A OG1 CYS 301.A O no hydrogen 3.559 N/A GLY 305.A N SER 302.A O no hydrogen 3.414 N/A HIS 306.A N CYS 301.A O no hydrogen 2.975 N/A HIS 306.A ND1 PRO 307.A O no hydrogen 2.942 N/A GLN 309.A N ILE 260.A O no hydrogen 2.832 N/A LEU 312.A N ASP 278.A O no hydrogen 3.352 N/A