Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dup_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A N SER 3.A OG no hydrogen 2.963 N/A LYS 6.A NZ ASP 10.A OD1 no hydrogen 2.742 N/A LYS 6.A NZ ASP 10.A OD2 no hydrogen 3.423 N/A HIS 7.A N SER 3.A O no hydrogen 3.335 N/A HIS 7.A NE2 VAL 237.A O no hydrogen 2.682 N/A VAL 8.A N PHE 4.A O no hydrogen 3.200 N/A GLN 9.A N LEU 5.A O no hydrogen 2.812 N/A ASP 10.A N LYS 6.A O no hydrogen 2.839 N/A CYS 11.A N HIS 7.A O no hydrogen 3.102 N/A CYS 11.A SG HIS 7.A O no hydrogen 3.550 N/A CYS 11.A SG PHE 245.A O no hydrogen 3.691 N/A ASN 12.A N GLN 9.A O no hydrogen 3.094 N/A ASN 12.A ND2 VAL 8.A O no hydrogen 3.031 N/A ASN 12.A ND2 GLY 275.A O no hydrogen 3.046 N/A THR 13.A N ASP 10.A O no hydrogen 3.379 N/A THR 13.A OG1 GLN 9.A O no hydrogen 2.730 N/A HIS 14.A ND1 CYS 193.A O no hydrogen 2.669 N/A SER 17.A N ASP 15.A OD1 no hydrogen 3.046 N/A SER 17.A OG ASP 15.A OD1 no hydrogen 2.773 N/A PHE 19.A N LEU 16.A O no hydrogen 3.007 N/A VAL 20.A N VAL 32.A O no hydrogen 2.812 N/A PHE 22.A N GLY 30.A O no hydrogen 2.858 N/A VAL 23.A N VAL 54.A O no hydrogen 2.883 N/A ILE 24.A N ARG 27.A O no hydrogen 2.917 N/A ARG 27.A N ILE 24.A O no hydrogen 2.933 N/A ARG 27.A NH1 GLN 95.A OE1 no hydrogen 3.484 N/A ARG 28.A NH1 GLY 30.A O no hydrogen 3.183 N/A VAL 29.A N PHE 22.A O no hydrogen 2.745 N/A GLY 30.A N PHE 22.A O no hydrogen 3.112 N/A TRP 31.A N PHE 112.A O no hydrogen 2.889 N/A VAL 32.A N VAL 20.A O no hydrogen 2.793 N/A ARG 33.A NH1 ASN 18.A OD1 no hydrogen 3.039 N/A ARG 33.A NH2 GLU 194.A OE2 no hydrogen 2.858 N/A LYS 34.A N ASN 18.A O no hydrogen 2.838 N/A LYS 34.A NZ SER 17.A O no hydrogen 2.985 N/A ALA 37.A N ARG 33.A O no hydrogen 2.950 N/A GLN 38.A N LYS 34.A O no hydrogen 3.154 N/A ARG 39.A N ALA 35.A O no hydrogen 3.223 N/A LEU 40.A N LEU 36.A O no hydrogen 2.907 N/A LYS 41.A N ALA 37.A O no hydrogen 3.025 N/A LYS 41.A NZ GLN 38.A OE1 no hydrogen 2.951 N/A ALA 42.A N ARG 39.A O no hydrogen 3.290 N/A HIS 43.A N LEU 40.A O no hydrogen 2.866 N/A VAL 46.A N HIS 43.A O no hydrogen 3.025 N/A PHE 47.A N HIS 43.A O no hydrogen 3.043 N/A ASP 48.A N LEU 55.A O no hydrogen 2.721 N/A THR 50.A N ALA 53.A O no hydrogen 2.843 N/A THR 50.A OG1 ALA 53.A O no hydrogen 3.261 N/A VAL 54.A N ARG 21.A O no hydrogen 2.849 N/A LEU 55.A N ASP 48.A O no hydrogen 2.746 N/A LEU 56.A N VAL 23.A O no hydrogen 2.988 N/A SER 57.A N VAL 46.A O no hydrogen 2.801 N/A SER 57.A OG SER 59.A OG no hydrogen 2.815 N/A SER 59.A N SER 57.A OG no hydrogen 3.259 N/A SER 59.A OG SER 57.A OG no hydrogen 2.815 N/A LEU 60.A N SER 57.A O no hydrogen 3.095 N/A ARG 61.A NH1 ALA 58.A O no hydrogen 2.922 N/A THR 62.A N SER 65.A OG no hydrogen 3.260 N/A SER 65.A N THR 62.A OG1 no hydrogen 2.951 N/A SER 65.A OG THR 62.A O no hydrogen 2.918 N/A SER 65.A OG THR 62.A OG1 no hydrogen 3.349 N/A ARG 66.A N THR 62.A O no hydrogen 3.073 N/A ARG 66.A NE LEU 60.A O no hydrogen 3.131 N/A ARG 66.A NH1 LEU 102.A O no hydrogen 2.975 N/A ARG 66.A NH2 GLU 25.A OE2 no hydrogen 3.004 N/A THR 67.A N PRO 63.A O no hydrogen 2.908 N/A THR 67.A OG1 PRO 63.A O no hydrogen 2.888 N/A ARG 68.A N GLN 64.A O no hydrogen 3.084 N/A ALA 69.A N SER 65.A O no hydrogen 2.980 N/A VAL 70.A N ARG 66.A O no hydrogen 2.946 N/A ALA 71.A N THR 67.A O no hydrogen 2.879 N/A ASP 72.A N ARG 68.A O no hydrogen 3.207 N/A VAL 73.A N ALA 69.A O no hydrogen 3.294 N/A VAL 74.A N VAL 70.A O no hydrogen 2.873 N/A ASP 75.A N ALA 71.A O no hydrogen 2.933 N/A ARG 76.A N ASP 72.A O no hydrogen 3.120 N/A ARG 76.A NE ASP 72.A OD1 no hydrogen 3.097 N/A ARG 76.A NH2 ASP 72.A OD2 no hydrogen 2.856 N/A LEU 77.A N VAL 73.A O no hydrogen 2.843 N/A ALA 78.A N VAL 74.A O no hydrogen 2.810 N/A ASP 79.A N ASP 75.A O no hydrogen 2.956 N/A GLU 80.A N ARG 76.A O no hydrogen 2.998 N/A GLY 81.A N ALA 78.A O no hydrogen 2.944 N/A VAL 82.A N LEU 77.A O no hydrogen 2.812 N/A ARG 87.A N ASP 105.A OD1 no hydrogen 3.071 N/A GLY 88.A N ASP 105.A OD2 no hydrogen 2.872 N/A TYR 91.A N LEU 104.A O no hydrogen 2.803 N/A ARG 92.A NH2 PRO 157.A O no hydrogen 2.962 N/A ARG 92.A NH2 LEU 160.A O no hydrogen 2.822 N/A GLU 99.A N SER 96.A O no hydrogen 3.025 N/A LEU 102.A N VAL 93.A O no hydrogen 2.822 N/A LEU 103.A N THR 67.A OG1 no hydrogen 2.797 N/A LEU 104.A N TYR 91.A O no hydrogen 2.950 N/A ARG 106.A N GLU 89.A O no hydrogen 2.821 N/A ARG 106.A NH1 GLU 89.A OE1 no hydrogen 2.942 N/A ALA 107.A N ASP 105.A OD1 no hydrogen 2.948 N/A VAL 108.A N ASP 105.A O no hydrogen 3.003 N/A VAL 109.A N ARG 106.A O no hydrogen 3.041 N/A PHE 112.A N VAL 108.A O no hydrogen 3.153 N/A PHE 112.A N VAL 109.A O no hydrogen 3.138 N/A GLY 113.A N PRO 110.A O no hydrogen 3.022 N/A VAL 114.A N VAL 109.A O no hydrogen 3.186 N/A ARG 115.A NE.A TYR 117.A OH no hydrogen 3.398 N/A ARG 115.A NH1.A TYR 117.A OH no hydrogen 3.514 N/A ARG 115.A NH1.A THR 203.A OG1 no hydrogen 3.366 N/A ARG 115.A NH2.B ARG 28.A O no hydrogen 3.363 N/A ALA 116.A N PRO 201.A O no hydrogen 3.289 N/A TYR 117.A OH ASN 94.A OD1 no hydrogen 2.543 N/A GLY 118.A N THR 203.A O no hydrogen 3.109 N/A VAL 119.A N GLY 154.A O no hydrogen 2.935 N/A HIS 120.A N PHE 205.A O no hydrogen 2.933 N/A HIS 120.A ND1 ASN 151.A OD1 no hydrogen 2.695 N/A LEU 121.A N VAL 152.A O no hydrogen 2.837 N/A ASN 122.A N TYR 207.A O no hydrogen 2.770 N/A ASN 122.A ND2 TYR 207.A O no hydrogen 3.367 N/A ASN 122.A ND2 ASP 208.A OD1 no hydrogen 3.023 N/A TYR 124.A N LEU 209.A O no hydrogen 3.024 N/A VAL 125.A N HIS 132.A O no hydrogen 2.873 N/A ASP 130.A N ALA 127.A O no hydrogen 3.006 N/A LEU 131.A N GLY 128.A O no hydrogen 3.263 N/A HIS 132.A N VAL 125.A O no hydrogen 2.823 N/A LEU 133.A N TRP 228.A O no hydrogen 2.713 N/A TRP 134.A N GLY 123.A O no hydrogen 2.864 N/A GLY 136.A N ASP 150.A O no hydrogen 3.057 N/A ARG 137.A N ASP 225.A O no hydrogen 2.845 N/A ARG 137.A NE.A ASP 225.A OD1.A no hydrogen 2.527 N/A ARG 137.A NH1.A ASP 225.A OD1.A no hydrogen 2.920 N/A ARG 137.A NH1.B GLY 147.A O no hydrogen 2.883 N/A ARG 138.A N LYS 148.A O no hydrogen 2.829 N/A ARG 138.A NE VAL 144.A O no hydrogen 3.347 N/A ARG 138.A NE ALA 145.A O no hydrogen 3.049 N/A ARG 138.A NH1 ASP 150.A OD2 no hydrogen 2.884 N/A ARG 138.A NH2 VAL 144.A O no hydrogen 2.835 N/A SER 139.A N GLU 223.A O no hydrogen 2.971 N/A ASP 141.A N SER 139.A OG no hydrogen 3.131 N/A LYS 142.A N SER 139.A O no hydrogen 3.227 N/A LYS 142.A NZ GLU 223.A OE1 no hydrogen 2.627 N/A GLY 147.A N SER 139.A O no hydrogen 3.427 N/A LYS 148.A N ALA 145.A O no hydrogen 3.216 N/A LYS 148.A NZ GLU 241.A O no hydrogen 2.599 N/A LEU 149.A N ALA 242.A O no hydrogen 2.985 N/A ASP 150.A N GLY 136.A O no hydrogen 2.885 N/A ASN 151.A N ASP 150.A OD1 no hydrogen 2.910 N/A ASN 151.A ND2 THR 250.A OG1 no hydrogen 3.025 N/A ALA 153.A N GLU 173.A OE1 no hydrogen 3.054 N/A GLY 154.A N VAL 119.A O no hydrogen 2.933 N/A GLN 156.A N TYR 117.A O no hydrogen 2.943 N/A GLN 156.A NE2 PRO 157.A O no hydrogen 3.661 N/A GLN 156.A NE2 LEU 160.A O no hydrogen 2.862 N/A GLN 156.A NE2 SER 161.A O no hydrogen 2.882 N/A ALA 158.A N LEU 90.A O no hydrogen 2.908 N/A SER 161.A N GLN 164.A OE1 no hydrogen 3.054 N/A ARG 163.A NH1 ALA 181.A O no hydrogen 3.350 N/A ARG 163.A NH1 ALA 184.A O no hydrogen 2.728 N/A ARG 163.A NH2 ALA 184.A O no hydrogen 2.975 N/A GLN 164.A N SER 161.A OG no hydrogen 2.975 N/A ASN 165.A N SER 161.A O no hydrogen 3.027 N/A ASN 165.A ND2 GLY 155.A O no hydrogen 2.880 N/A ASN 165.A ND2 GLN 156.A OE1 no hydrogen 3.054 N/A LEU 166.A N LEU 162.A O no hydrogen 2.807 N/A ILE 167.A N ARG 163.A O no hydrogen 2.923 N/A LYS 168.A N GLN 164.A O no hydrogen 3.010 N/A GLU 169.A N ASN 165.A O no hydrogen 2.868 N/A CYS 170.A N LEU 166.A O no hydrogen 2.896 N/A CYS 170.A SG LEU 166.A O no hydrogen 3.270 N/A ALA 171.A N ILE 167.A O no hydrogen 3.198 N/A GLU 172.A N LYS 168.A O no hydrogen 2.964 N/A GLU 173.A N GLU 169.A O no hydrogen 2.803 N/A ALA 174.A N CYS 170.A O no hydrogen 3.261 N/A ASP 175.A N ALA 171.A O no hydrogen 3.119 N/A LEU 176.A N CYS 170.A O no hydrogen 2.860 N/A ALA 181.A N PRO 177.A O no hydrogen 2.939 N/A ARG 182.A N GLU 178.A O no hydrogen 2.888 N/A ARG 182.A NE GLU 178.A OE2 no hydrogen 2.974 N/A ARG 182.A NH2 GLU 178.A OE2 no hydrogen 2.836 N/A GLN 183.A N LEU 180.A O no hydrogen 2.891 N/A GLN 183.A NE2 ALA 179.A O no hydrogen 3.409 N/A ALA 184.A N ALA 181.A O no hydrogen 3.253 N/A ILE 185.A N ASP 208.A O no hydrogen 2.877 N/A VAL 187.A N LEU 206.A O no hydrogen 2.915 N/A ILE 190.A N LEU 204.A O no hydrogen 2.868 N/A THR 191.A N LEU 276.A O no hydrogen 2.968 N/A THR 191.A OG1.A THR 203.A OG1 no hydrogen 3.115 N/A THR 191.A OG1.B GLY 278.A O no hydrogen 3.082 N/A TYR 192.A N ASP 202.A O no hydrogen 2.996 N/A TYR 192.A OH ASP 202.A OD2 no hydrogen 2.663 N/A CYS 193.A N ASN 12.A OD1 no hydrogen 3.066 N/A CYS 193.A SG HIS 14.A ND1 no hydrogen 3.806 N/A SER 195.A N GLY 198.A O no hydrogen 2.784 N/A GLY 198.A N SER 195.A O no hydrogen 3.357 N/A ILE 199.A N PRO 110.A O no hydrogen 3.195 N/A LYS 200.A NZ ASP 202.A OD2 no hydrogen 3.188 N/A ASP 202.A N TYR 192.A O no hydrogen 2.909 N/A THR 203.A N ALA 116.A O no hydrogen 2.912 N/A THR 203.A OG1 THR 191.A OG1.A no hydrogen 3.115 N/A LEU 204.A N ILE 190.A O no hydrogen 2.768 N/A PHE 205.A N GLY 118.A O no hydrogen 2.857 N/A LEU 206.A N GLY 188.A O no hydrogen 2.911 N/A TYR 207.A N HIS 120.A O no hydrogen 2.913 N/A ASP 208.A N ILE 185.A O no hydrogen 2.970 N/A LEU 209.A N ASN 122.A O no hydrogen 2.917 N/A LEU 211.A N TYR 124.A O no hydrogen 2.691 N/A PHE 215.A N PRO 212.A O no hydrogen 3.049 N/A ARG 216.A NH1 GLU 213.A O no hydrogen 2.864 N/A ARG 216.A NH1 PHE 215.A O no hydrogen 2.973 N/A HIS 218.A N ALA 174.A O no hydrogen 2.985 N/A THR 220.A N HIS 218.A O no hydrogen 2.913 N/A ASP 221.A N GLU 172.A O no hydrogen 2.904 N/A GLY 222.A N ASN 219.A O no hydrogen 2.873 N/A GLU 223.A N ASP 221.A OD1 no hydrogen 3.149 N/A ALA 224.A N ARG 137.A O no hydrogen 2.642 N/A PHE 226.A N ASP 225.A OD1.B no hydrogen 2.732 N/A TRP 228.A N LEU 133.A O no hydrogen 2.871 N/A ALA 230.A N LEU 131.A O no hydrogen 2.769 N/A VAL 233.A N PRO 229.A O no hydrogen 3.337 N/A VAL 234.A N ALA 230.A O no hydrogen 3.015 N/A GLU 235.A N ALA 231.A O no hydrogen 2.875 N/A ALA 236.A N LYS 232.A O no hydrogen 2.918 N/A VAL 237.A N VAL 233.A O no hydrogen 3.066 N/A ARG 238.A N VAL 234.A O no hydrogen 2.917 N/A ARG 238.A NE GLU 235.A OE1 no hydrogen 2.979 N/A ARG 238.A NH1 GLU 266.A OE2 no hydrogen 2.856 N/A ARG 238.A NH2 GLU 266.A OE1 no hydrogen 3.227 N/A THR 239.A N GLU 235.A O no hydrogen 3.043 N/A THR 239.A OG1 GLU 235.A O no hydrogen 2.946 N/A THR 240.A N ALA 236.A O no hydrogen 2.924 N/A THR 240.A OG1 ALA 236.A O no hydrogen 2.573 N/A ALA 242.A N THR 240.A OG1 no hydrogen 3.199 N/A LYS 244.A N LEU 149.A O no hydrogen 2.813 N/A LYS 244.A NZ ASN 246.A OD1 no hydrogen 2.860 N/A ASN 246.A ND2 TYR 192.A OH no hydrogen 2.737 N/A ASN 248.A N LYS 244.A O no hydrogen 3.350 N/A ASN 248.A ND2 PHE 243.A O no hydrogen 3.661 N/A ASN 248.A ND2 PHE 245.A O no hydrogen 3.122 N/A THR 250.A OG1 VAL 247.A O no hydrogen 2.748 N/A VAL 251.A N VAL 247.A O no hydrogen 2.986 N/A ILE 252.A N ASN 248.A O no hydrogen 3.015 N/A ASP 253.A N LEU 249.A O no hydrogen 2.967 N/A PHE 254.A N THR 250.A O no hydrogen 2.946 N/A ALA 255.A N VAL 251.A O no hydrogen 2.866 N/A ILE 256.A N ILE 252.A O no hydrogen 2.964 N/A ARG 257.A N ASP 253.A O no hydrogen 2.949 N/A ARG 257.A NE ASP 253.A OD2 no hydrogen 2.668 N/A ARG 257.A NH1 ASP 208.A OD1 no hydrogen 3.564 N/A ARG 257.A NH1 ASP 208.A OD2 no hydrogen 2.836 N/A ARG 257.A NH2 ASP 208.A OD1 no hydrogen 2.909 N/A ARG 257.A NH2 ASP 253.A OD2 no hydrogen 3.468 N/A HIS 258.A N PHE 254.A O no hydrogen 2.905 N/A HIS 258.A NE2 ASP 208.A OD2 no hydrogen 2.748 N/A GLY 259.A N ILE 256.A O no hydrogen 3.333 N/A LEU 260.A N ALA 255.A O no hydrogen 2.706 N/A ILE 261.A N ALA 255.A O no hydrogen 3.433 N/A ASP 264.A N ASP 262.A OD1 no hydrogen 2.894 N/A ASN 265.A N ASP 262.A O no hydrogen 2.987 N/A GLU 266.A N ASP 262.A O no hydrogen 2.887 N/A ILE 272.A N ASP 268.A O no hydrogen 2.924 N/A LEU 273.A N TYR 269.A O no hydrogen 3.065 N/A ALA 274.A N GLN 270.A O no hydrogen 2.956 N/A GLY 275.A N GLU 271.A O no hydrogen 3.015 N/A LEU 276.A N ILE 272.A O no hydrogen 3.124 N/A LEU 276.A N LEU 273.A O no hydrogen 3.226 N/A ARG 277.A N ALA 274.A O no hydrogen 3.148 N/A GLY 278.A N GLY 275.A O no hydrogen 3.184 N/A