Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wj1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N TYR 242.A OH no hydrogen 2.905 N/A ASP 3.A N ASN 270.A O no hydrogen 2.918 N/A ARG 5.A N ASP 3.A OD2 no hydrogen 2.858 N/A ARG 5.A NH1 ASP 3.A OD2 no hydrogen 2.977 N/A ILE 6.A N ASP 3.A O no hydrogen 2.876 N/A LYS 7.A N ASP 3.A O no hydrogen 3.109 N/A LYS 8.A N PRO 4.A O no hydrogen 2.916 N/A LEU 9.A N ARG 5.A O no hydrogen 3.113 N/A LEU 10.A N ILE 6.A O no hydrogen 2.906 N/A GLU 11.A N LYS 7.A O no hydrogen 2.904 N/A SER 12.A N LEU 9.A O no hydrogen 3.103 N/A SER 12.A OG LYS 8.A O no hydrogen 3.544 N/A SER 12.A OG LEU 9.A O no hydrogen 2.562 N/A GLY 13.A N LEU 10.A O no hydrogen 3.186 N/A ILE 18.A N VAL 16.A O no hydrogen 2.750 N/A LYS 20.A N PRO 17.A O no hydrogen 2.954 N/A LYS 20.A NZ GLU 200.A OE2 no hydrogen 3.359 N/A GLU 25.A N SER 22.A OG no hydrogen 2.879 N/A VAL 26.A N SER 22.A O no hydrogen 2.977 N/A ARG 27.A N VAL 23.A O no hydrogen 2.952 N/A ARG 27.A NE VAL 82.A O no hydrogen 2.885 N/A ARG 27.A NH1 GLU 114.A OE2 no hydrogen 2.921 N/A ARG 27.A NH2 VAL 82.A O no hydrogen 2.944 N/A ARG 27.A NH2 GLU 114.A OE1 no hydrogen 2.893 N/A LYS 28.A N ASP 24.A O no hydrogen 2.961 N/A ILE 29.A N GLU 25.A O no hydrogen 2.938 N/A PHE 30.A N VAL 26.A O no hydrogen 3.002 N/A ARG 31.A N ARG 27.A O no hydrogen 2.940 N/A GLN 32.A N LYS 28.A O no hydrogen 3.085 N/A LEU 33.A N ILE 29.A O no hydrogen 3.022 N/A ALA 34.A N PHE 30.A O no hydrogen 2.907 N/A SER 35.A N ARG 31.A O no hydrogen 2.905 N/A SER 35.A OG ARG 31.A O no hydrogen 2.648 N/A ARG 43.A N PHE 63.A O no hydrogen 2.888 N/A ARG 43.A NE PRO 64.A O no hydrogen 2.931 N/A ARG 43.A NH2 TYR 70.A OH no hydrogen 2.946 N/A LYS 44.A NZ GLU 46.A OE2 no hydrogen 3.445 N/A GLU 46.A N VAL 61.A O no hydrogen 2.910 N/A ILE 48.A N ALA 59.A O no hydrogen 2.881 N/A LYS 49.A NZ SER 56.A OG no hydrogen 2.811 N/A ILE 50.A N ILE 57.A O no hydrogen 2.755 N/A GLY 52.A N THR 55.A O no hydrogen 2.897 N/A SER 53.A N ASP 126.A OD2 no hydrogen 2.799 N/A SER 53.A OG ASP 126.A OD2 no hydrogen 2.650 N/A THR 55.A OG1 SER 56.A O no hydrogen 3.375 N/A ILE 57.A N ILE 50.A O no hydrogen 2.793 N/A ALA 59.A N ILE 48.A O no hydrogen 3.031 N/A ARG 60.A N SER 106.A O no hydrogen 2.915 N/A ARG 60.A NE ASP 47.A OD1 no hydrogen 2.790 N/A ARG 60.A NH1 ASP 90.A OD1 no hydrogen 3.178 N/A ARG 60.A NH2 ASP 47.A OD1 no hydrogen 3.423 N/A ARG 60.A NH2 ASP 47.A OD2 no hydrogen 3.109 N/A VAL 61.A N GLU 46.A O no hydrogen 2.721 N/A TYR 62.A N VAL 104.A O no hydrogen 2.818 N/A TYR 62.A OH ASP 90.A OD1 no hydrogen 2.819 N/A PHE 63.A N LYS 44.A O no hydrogen 2.821 N/A LYS 65.A NZ GLU 41.A OE1 no hydrogen 2.808 N/A TYR 70.A N ASP 139.A O no hydrogen 2.842 N/A TYR 70.A OH ALA 66.A O no hydrogen 2.591 N/A GLY 71.A N TYR 301.A OH no hydrogen 3.051 N/A VAL 72.A N GLY 143.A O no hydrogen 2.791 N/A LEU 73.A N VAL 103.A O no hydrogen 2.770 N/A VAL 74.A N ALA 145.A O no hydrogen 2.881 N/A TYR 75.A N VAL 105.A O no hydrogen 2.792 N/A TYR 75.A OH ASP 149.A OD1 no hydrogen 2.741 N/A LEU 76.A N ALA 147.A O no hydrogen 2.885 N/A HIS 77.A ND1 GLY 78.A O no hydrogen 2.647 N/A GLY 78.A N ASP 149.A OD1 no hydrogen 2.927 N/A VAL 82.A N GLY 79.A O no hydrogen 2.999 N/A ILE 83.A N GLY 79.A O no hydrogen 2.793 N/A ASP 85.A N SER 88.A OG no hydrogen 3.168 N/A VAL 86.A N ASP 108.A OD2 no hydrogen 2.983 N/A SER 88.A N ASP 85.A OD1 no hydrogen 2.730 N/A SER 88.A OG ASP 85.A O no hydrogen 3.108 N/A SER 88.A OG ASP 85.A OD1 no hydrogen 2.664 N/A TYR 89.A N ASP 85.A O no hydrogen 3.371 N/A TYR 89.A N VAL 86.A O no hydrogen 3.229 N/A TYR 89.A OH ASP 149.A OD2 no hydrogen 2.672 N/A ASP 90.A N GLU 87.A O no hydrogen 3.216 N/A CYS 93.A N TYR 89.A O no hydrogen 2.831 N/A CYS 93.A SG TYR 89.A O no hydrogen 3.660 N/A CYS 93.A SG SER 106.A OG no hydrogen 3.764 N/A ARG 94.A N ASP 90.A O no hydrogen 2.898 N/A ARG 94.A NE ASP 90.A OD2 no hydrogen 2.688 N/A ARG 94.A NH1 ALA 40.A O no hydrogen 2.820 N/A ALA 95.A N PRO 91.A O no hydrogen 3.073 N/A ILE 96.A N LEU 92.A O no hydrogen 2.868 N/A THR 97.A N CYS 93.A O no hydrogen 2.907 N/A THR 97.A OG1 CYS 93.A O no hydrogen 2.738 N/A ASN 98.A N ARG 94.A O no hydrogen 3.055 N/A ASN 98.A ND2 GLU 41.A O no hydrogen 2.945 N/A ALA 99.A N ALA 95.A O no hydrogen 2.965 N/A CYS 100.A N ILE 96.A O no hydrogen 2.892 N/A CYS 100.A SG.A ILE 96.A O no hydrogen 3.280 N/A CYS 100.A SG.B ILE 96.A O no hydrogen 2.995 N/A CYS 100.A SG.B THR 97.A O no hydrogen 3.888 N/A CYS 102.A SG VAL 103.A O no hydrogen 3.626 N/A VAL 103.A N GLY 71.A O no hydrogen 3.029 N/A VAL 104.A N TYR 62.A O no hydrogen 3.080 N/A VAL 105.A N LEU 73.A O no hydrogen 2.844 N/A SER 106.A N ARG 60.A O no hydrogen 2.805 N/A VAL 107.A N TYR 75.A O no hydrogen 3.024 N/A ASP 108.A N ASN 58.A O no hydrogen 2.915 N/A TYR 109.A OH HIS 77.A O no hydrogen 2.595 N/A ARG 110.A N ASP 123.A OD2 no hydrogen 2.875 N/A ARG 110.A NE ASP 123.A OD1 no hydrogen 3.231 N/A ARG 110.A NE ASP 123.A OD2 no hydrogen 2.818 N/A ARG 110.A NH1 GLU 54.A OE1.A no hydrogen 3.495 N/A ARG 110.A NH2 GLU 54.A OE1.A no hydrogen 2.798 N/A ARG 110.A NH2 ASP 123.A OD1 no hydrogen 2.876 N/A ALA 112.A N PHE 81.A O no hydrogen 2.878 N/A GLU 114.A N GLU 114.A OE1 no hydrogen 2.822 N/A TYR 115.A N LEU 111.A O no hydrogen 2.883 N/A LYS 116.A NZ PRO 113.A O no hydrogen 3.139 N/A LYS 116.A NZ GLN 208.A O no hydrogen 3.087 N/A PHE 117.A N TYR 209.A O no hydrogen 2.805 N/A SER 119.A N LYS 116.A O no hydrogen 2.877 N/A SER 119.A OG LYS 116.A O no hydrogen 2.870 N/A ILE 122.A N PRO 118.A O no hydrogen 2.943 N/A ASP 123.A N SER 119.A O no hydrogen 2.987 N/A SER 124.A N ALA 120.A O no hydrogen 2.949 N/A SER 124.A OG ALA 120.A O no hydrogen 2.762 N/A PHE 125.A N VAL 121.A O no hydrogen 2.855 N/A ASP 126.A N ILE 122.A O no hydrogen 2.822 N/A ALA 127.A N ASP 123.A O no hydrogen 2.898 N/A THR 128.A N SER 124.A O no hydrogen 3.077 N/A THR 128.A OG1 SER 124.A O no hydrogen 2.813 N/A ASN 129.A N PHE 125.A O no hydrogen 2.864 N/A TRP 130.A N ASP 126.A O no hydrogen 2.971 N/A ILE 131.A N ALA 127.A O no hydrogen 2.885 N/A TYR 132.A N THR 128.A O no hydrogen 2.950 N/A ASN 133.A N ASN 129.A O no hydrogen 3.109 N/A ASN 134.A N ILE 131.A O no hydrogen 2.995 N/A ASN 134.A ND2 TRP 130.A O no hydrogen 2.827 N/A LYS 137.A N ASN 134.A O no hydrogen 2.923 N/A PHE 138.A N LEU 135.A O no hydrogen 2.996 N/A ASP 139.A N ASP 136.A O no hydrogen 3.295 N/A GLY 140.A N LEU 135.A O no hydrogen 2.883 N/A MET 142.A N TYR 70.A O no hydrogen 2.937 N/A GLY 143.A N GLY 140.A O no hydrogen 3.180 N/A ALA 145.A N VAL 72.A O no hydrogen 2.867 N/A ILE 146.A N TYR 171.A O no hydrogen 3.048 N/A ALA 147.A N VAL 74.A O no hydrogen 2.821 N/A GLY 148.A N ILE 173.A O no hydrogen 3.067 N/A SER 150.A N ILE 175.A O no hydrogen 2.803 N/A SER 150.A OG HIS 273.A NE2 no hydrogen 2.767 N/A GLY 152.A N ASP 149.A O no hydrogen 2.769 N/A ASN 154.A N SER 150.A O no hydrogen 2.972 N/A ASN 154.A ND2 ALA 178.A O no hydrogen 3.015 N/A ASN 154.A ND2 PHE 221.A O no hydrogen 2.865 N/A LEU 155.A N ALA 151.A O no hydrogen 3.005 N/A ALA 156.A N GLY 152.A O no hydrogen 2.875 N/A ALA 157.A N GLY 153.A O no hydrogen 2.932 N/A VAL 158.A N ASN 154.A O no hydrogen 2.945 N/A VAL 159.A N LEU 155.A O no hydrogen 2.798 N/A ALA 160.A N ALA 156.A O no hydrogen 2.939 N/A LEU 161.A N ALA 157.A O no hydrogen 3.125 N/A LEU 162.A N VAL 158.A O no hydrogen 2.865 N/A SER 163.A N VAL 159.A O no hydrogen 2.843 N/A SER 163.A N ALA 160.A O no hydrogen 3.291 N/A SER 163.A OG VAL 159.A O no hydrogen 2.670 N/A LYS 164.A N LEU 161.A O no hydrogen 3.348 N/A LYS 164.A NZ SER 230.A O no hydrogen 2.550 N/A LYS 166.A N SER 163.A O no hydrogen 2.951 N/A LEU 167.A N SER 163.A O no hydrogen 3.070 N/A LYS 170.A N ILE 144.A O no hydrogen 2.769 N/A GLN 172.A N PRO 234.A O no hydrogen 2.897 N/A GLN 172.A NE2 PRO 233.A O no hydrogen 2.897 N/A ILE 173.A N ILE 146.A O no hydrogen 2.817 N/A LEU 174.A N LEU 236.A O no hydrogen 2.882 N/A ILE 175.A N GLY 148.A O no hydrogen 2.953 N/A TYR 176.A N ILE 238.A O no hydrogen 2.651 N/A ALA 178.A N SER 150.A O no hydrogen 3.331 N/A VAL 184.A N ASP 182.A OD1 no hydrogen 2.899 N/A SER 185.A N ASP 182.A OD1 no hydrogen 2.821 N/A SER 185.A OG ASP 182.A OD1 no hydrogen 3.500 N/A SER 185.A OG ASP 182.A OD2 no hydrogen 2.575 N/A SER 187.A N ASP 247.A OD2 no hydrogen 2.993 N/A SER 187.A OG PRO 244.A O no hydrogen 2.814 N/A MET 188.A N SER 185.A OG no hydrogen 3.223 N/A ILE 189.A N SER 185.A O no hydrogen 3.141 N/A GLU 190.A N ARG 186.A O no hydrogen 2.736 N/A TYR 191.A N SER 187.A O no hydrogen 2.948 N/A SER 192.A N ILE 189.A O no hydrogen 3.495 N/A SER 192.A OG ILE 189.A O no hydrogen 3.209 N/A LEU 197.A N PHE 195.A O no hydrogen 2.820 N/A ARG 199.A N SER 192.A O no hydrogen 2.858 N/A HIS 201.A N THR 198.A OG1 no hydrogen 3.078 N/A ILE 202.A N THR 198.A O no hydrogen 2.946 N/A GLU 203.A N ARG 199.A O no hydrogen 2.851 N/A TRP 204.A N GLU 200.A O no hydrogen 2.999 N/A PHE 205.A N HIS 201.A O no hydrogen 2.846 N/A GLY 206.A N ILE 202.A O no hydrogen 2.949 N/A SER 207.A N GLU 203.A O no hydrogen 2.930 N/A SER 207.A OG TRP 204.A O no hydrogen 2.710 N/A GLN 208.A N TRP 204.A O no hydrogen 3.079 N/A GLN 208.A N PHE 205.A O no hydrogen 3.152 N/A GLN 208.A NE2 SER 207.A OG no hydrogen 3.414 N/A TYR 209.A N PHE 205.A O no hydrogen 2.979 N/A LEU 210.A N GLY 206.A O no hydrogen 3.005 N/A ARG 211.A N ASP 215.A OD2 no hydrogen 2.793 N/A ARG 211.A NE ASP 215.A OD2 no hydrogen 3.032 N/A ARG 211.A NH2 ASP 215.A OD1 no hydrogen 2.909 N/A ASP 215.A N SER 212.A O no hydrogen 3.117 N/A LEU 216.A N PRO 213.A O no hydrogen 2.950 N/A LEU 217.A N ALA 214.A O no hydrogen 3.004 N/A ASP 218.A N ASP 215.A O no hydrogen 3.143 N/A ARG 220.A N ASP 218.A OD1 no hydrogen 2.960 N/A ARG 220.A NE ASP 218.A OD1 no hydrogen 3.087 N/A ARG 220.A NH2 ASP 218.A OD2 no hydrogen 2.928 N/A PHE 221.A N ASP 218.A O no hydrogen 2.870 N/A SER 222.A N ASP 218.A O no hydrogen 2.876 N/A SER 222.A OG LEU 216.A O no hydrogen 2.792 N/A ILE 224.A N VAL 179.A O no hydrogen 3.259 N/A ILE 225.A N SER 222.A O no hydrogen 3.004 N/A ALA 226.A N PRO 223.A O no hydrogen 2.946 N/A SER 230.A N ASP 228.A OD1 no hydrogen 2.884 N/A SER 230.A OG ASP 228.A OD1 no hydrogen 2.756 N/A SER 230.A OG ASP 228.A OD2 no hydrogen 3.485 N/A ALA 235.A N PRO 262.A O no hydrogen 2.912 N/A LEU 236.A N GLN 172.A O no hydrogen 2.976 N/A ILE 237.A N THR 264.A O no hydrogen 2.872 N/A ILE 238.A N LEU 174.A O no hydrogen 2.961 N/A THR 239.A N VAL 266.A O no hydrogen 2.909 N/A THR 239.A OG1 GLU 250.A OE2 no hydrogen 2.782 N/A GLU 241.A N PHE 268.A O no hydrogen 2.962 N/A TYR 242.A N VAL 271.A O no hydrogen 3.068 N/A ASP 243.A N ALA 240.A O no hydrogen 3.299 N/A LEU 245.A N ASP 243.A OD1 no hydrogen 2.883 N/A ARG 246.A N ASP 243.A O no hydrogen 2.955 N/A ARG 246.A NE ASP 247.A OD1 no hydrogen 2.927 N/A ARG 246.A NH1 GLU 241.A O no hydrogen 2.891 N/A ARG 246.A NH2 ASP 247.A OD1 no hydrogen 2.994 N/A ASP 247.A N SER 187.A OG no hydrogen 2.911 N/A GLN 248.A NE2 GLY 180.A O no hydrogen 3.660 N/A GLY 249.A N LEU 245.A O no hydrogen 3.161 N/A GLU 250.A N ARG 246.A O no hydrogen 3.044 N/A ALA 251.A N ASP 247.A O no hydrogen 2.818 N/A TYR 252.A N GLN 248.A O no hydrogen 3.002 N/A ALA 253.A N GLY 249.A O no hydrogen 3.064 N/A ASN 254.A N GLU 250.A O no hydrogen 3.019 N/A ARG 255.A N ALA 251.A O no hydrogen 2.881 N/A LEU 256.A N TYR 252.A O no hydrogen 2.943 N/A LEU 257.A N ALA 253.A O no hydrogen 2.944 N/A GLN 258.A N ASN 254.A O no hydrogen 2.927 N/A ALA 259.A N ARG 255.A O no hydrogen 3.072 N/A ALA 259.A N LEU 256.A O no hydrogen 3.043 N/A GLY 260.A N LEU 257.A O no hydrogen 3.034 N/A VAL 261.A N LEU 256.A O no hydrogen 2.996 N/A THR 264.A N ALA 235.A O no hydrogen 2.900 N/A VAL 266.A N ILE 237.A O no hydrogen 2.897 N/A ARG 267.A NE GLU 250.A OE2 no hydrogen 2.891 N/A ARG 267.A NH2 GLU 250.A OE1 no hydrogen 2.849 N/A ARG 267.A NH2 GLU 250.A OE2 no hydrogen 3.518 N/A PHE 268.A N THR 239.A O no hydrogen 2.824 N/A ASN 270.A N GLU 241.A OE1 no hydrogen 2.822 N/A ASN 270.A ND2 PRO 1.A O no hydrogen 3.063 N/A HIS 273.A ND1 ASP 243.A OD2 no hydrogen 2.632 N/A HIS 273.A NE2 SER 150.A OG no hydrogen 2.767 N/A LEU 276.A N TYR 176.A OH no hydrogen 2.963 N/A SER 277.A N GLY 274.A O no hydrogen 2.872 N/A PHE 278.A N PHE 275.A O no hydrogen 3.151 N/A PHE 279.A N LEU 276.A O no hydrogen 3.314 N/A LEU 281.A N PHE 278.A O no hydrogen 3.093 N/A ILE 282.A N PHE 278.A O no hydrogen 2.828 N/A GLN 284.A N GLN 284.A OE1 no hydrogen 2.849 N/A GLN 284.A NE2 ASP 3.A OD1 no hydrogen 2.906 N/A GLY 285.A N ILE 282.A O no hydrogen 2.847 N/A ASP 287.A N ASP 283.A O no hydrogen 3.217 N/A ALA 288.A N GLN 284.A O no hydrogen 2.922 N/A ILE 289.A N GLY 285.A O no hydrogen 3.038 N/A GLY 290.A N LYS 286.A O no hydrogen 2.930 N/A LEU 291.A N ASP 287.A O no hydrogen 2.887 N/A ILE 292.A N ALA 288.A O no hydrogen 2.986 N/A GLY 293.A N ILE 289.A O no hydrogen 2.885 N/A SER 294.A N GLY 290.A O no hydrogen 2.925 N/A VAL 295.A N LEU 291.A O no hydrogen 3.076 N/A LEU 296.A N ILE 292.A O no hydrogen 3.056 N/A ARG 297.A N GLY 293.A O no hydrogen 2.883 N/A ARG 297.A NE SER 304.A O no hydrogen 2.921 N/A ARG 297.A NH1 ALA 99.A O no hydrogen 2.705 N/A ARG 297.A NH2 SER 304.A OXT no hydrogen 2.818 N/A ARG 298.A N SER 294.A O no hydrogen 3.027 N/A ARG 298.A NH1 ASP 302.A OD1 no hydrogen 3.085 N/A THR 299.A N VAL 295.A O no hydrogen 3.038 N/A THR 299.A OG1.B VAL 295.A O no hydrogen 2.868 N/A PHE 300.A N LEU 296.A O no hydrogen 2.912 N/A TYR 301.A N ARG 297.A O no hydrogen 2.951 N/A TYR 301.A OH ASN 101.A O no hydrogen 2.644 N/A ASP 302.A N ARG 298.A O no hydrogen 2.921 N/A LYS 303.A N ARG 297.A O no hydrogen 3.362 N/A