Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pa1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A ND1 ASP 28.A OD2 no hydrogen 2.975 N/A SER 3.A N ASP 28.A OD1 no hydrogen 3.250 N/A SER 3.A OG ASP 101.A OD1 no hydrogen 2.630 N/A MET 4.A N CYS 100.A O no hydrogen 2.924 N/A ARG 5.A N TYR 26.A O no hydrogen 2.938 N/A TYR 6.A N SER 98.A O no hydrogen 2.875 N/A PHE 7.A N VAL 24.A O no hydrogen 2.913 N/A ASP 8.A N ARG 96.A O no hydrogen 2.894 N/A THR 9.A N ILE 22.A O no hydrogen 2.894 N/A ALA 10.A N LEU 94.A O no hydrogen 2.874 N/A VAL 11.A N ARG 20.A O no hydrogen 2.893 N/A SER 12.A N HIS 92.A O no hydrogen 2.865 N/A ARG 13.A NH2 SER 91.A OG no hydrogen 2.922 N/A ARG 20.A N VAL 11.A O no hydrogen 2.906 N/A ARG 20.A NH2 ASP 36.A OD2 no hydrogen 2.745 N/A PHE 21.A N SER 37.A OG no hydrogen 2.924 N/A ILE 22.A N THR 9.A O no hydrogen 2.903 N/A SER 23.A N PHE 35.A O no hydrogen 3.127 N/A SER 23.A OG PHE 7.A O no hydrogen 3.566 N/A SER 23.A OG ASP 8.A OD2 no hydrogen 2.700 N/A VAL 24.A N PHE 7.A O no hydrogen 2.920 N/A GLY 25.A N VAL 33.A O no hydrogen 3.330 N/A TYR 26.A N ARG 5.A O no hydrogen 2.862 N/A VAL 27.A N THR 30.A O no hydrogen 2.843 N/A ASP 28.A N SER 3.A O no hydrogen 2.985 N/A THR 30.A N VAL 27.A O no hydrogen 2.906 N/A PHE 32.A N GLY 25.A O no hydrogen 2.912 N/A ARG 34.A N GLU 45.A O no hydrogen 2.922 N/A PHE 35.A N SER 23.A O no hydrogen 2.928 N/A SER 37.A N PHE 21.A O no hydrogen 2.968 N/A SER 37.A OG PHE 21.A O no hydrogen 3.409 N/A SER 37.A OG ASP 38.A OD1 no hydrogen 3.366 N/A ASP 38.A N ASP 36.A OD1 no hydrogen 2.870 N/A ARG 43.A NH1 GLU 45.A OE2 no hydrogen 2.954 N/A GLY 44.A N THR 63.A OG1 no hydrogen 3.154 N/A GLU 45.A N ARG 34.A O no hydrogen 2.892 N/A ARG 47.A N PHE 32.A O no hydrogen 2.824 N/A ARG 47.A NE PRO 46.A O no hydrogen 3.089 N/A VAL 51.A N ALA 48.A O no hydrogen 3.432 N/A GLU 54.A N VAL 51.A O no hydrogen 3.092 N/A TYR 58.A OH TYR 170.A OH no hydrogen 2.436 N/A TRP 59.A N GLY 55.A O no hydrogen 3.434 N/A ASP 60.A N PRO 56.A O no hydrogen 2.906 N/A ARG 61.A N GLU 57.A O no hydrogen 2.894 N/A ARG 61.A NH1 ARG 61.A O no hydrogen 3.568 N/A GLU 62.A N TYR 58.A O no hydrogen 2.911 N/A THR 63.A N TRP 59.A O no hydrogen 2.914 N/A THR 63.A OG1 TRP 59.A O no hydrogen 2.845 N/A GLN 64.A N ASP 60.A O no hydrogen 2.922 N/A GLN 64.A NE2 ASP 60.A O no hydrogen 3.387 N/A LYS 65.A N ARG 61.A O no hydrogen 2.978 N/A TYR 66.A N GLU 62.A O no hydrogen 2.943 N/A LYS 67.A N THR 63.A O no hydrogen 2.916 N/A LYS 67.A NZ PRO 42.A O no hydrogen 2.330 N/A ARG 68.A N GLN 64.A O no hydrogen 2.982 N/A GLN 69.A N LYS 65.A O no hydrogen 2.939 N/A GLN 69.A NE2 GLN 69.A O no hydrogen 3.534 N/A ALA 70.A N TYR 66.A O no hydrogen 2.902 N/A GLN 71.A N LYS 67.A O no hydrogen 3.000 N/A GLN 71.A NE2 ARG 68.A O no hydrogen 3.393 N/A ALA 72.A N ARG 68.A O no hydrogen 2.946 N/A ASP 73.A N GLN 69.A O no hydrogen 2.904 N/A ARG 74.A N ALA 70.A O no hydrogen 2.979 N/A VAL 75.A N GLN 71.A O no hydrogen 2.954 N/A SER 76.A N ALA 72.A O no hydrogen 2.904 N/A SER 76.A OG ALA 72.A O no hydrogen 2.757 N/A LEU 77.A N ASP 73.A O no hydrogen 2.886 N/A ARG 78.A N ARG 74.A O no hydrogen 3.021 N/A ASN 79.A N VAL 75.A O no hydrogen 2.898 N/A LEU 80.A N SER 76.A O no hydrogen 2.875 N/A ARG 81.A N LEU 77.A O no hydrogen 2.911 N/A GLY 82.A N ASN 79.A O no hydrogen 2.867 N/A TYR 83.A N LEU 80.A O no hydrogen 2.870 N/A TYR 84.A OH ASP 136.A OD2 no hydrogen 3.100 N/A SER 87.A OG ASP 89.A OD1 no hydrogen 2.181 N/A SER 91.A OG SER 12.A O no hydrogen 2.431 N/A HIS 92.A N SER 12.A O no hydrogen 2.989 N/A HIS 92.A N SER 12.A OG no hydrogen 3.059 N/A THR 93.A N ASP 118.A OD1 no hydrogen 2.482 N/A LEU 94.A N ALA 10.A O no hydrogen 2.903 N/A GLN 95.A N ALA 116.A O no hydrogen 2.919 N/A ARG 96.A N ASP 8.A O no hydrogen 2.931 N/A ARG 96.A NH1 ASP 73.A OD1 no hydrogen 3.202 N/A ARG 96.A NH1 ASP 73.A OD2 no hydrogen 3.171 N/A MET 97.A N GLN 114.A O no hydrogen 2.893 N/A SER 98.A N TYR 6.A O no hydrogen 2.942 N/A GLY 99.A N TYR 112.A O no hydrogen 2.947 N/A CYS 100.A N MET 4.A O no hydrogen 2.917 N/A ASP 101.A N ARG 110.A O no hydrogen 2.885 N/A LEU 102.A N HIS 2.A O no hydrogen 2.890 N/A GLY 103.A N ARG 107.A O no hydrogen 3.009 N/A ASP 105.A N ASP 105.A OD1 no hydrogen 2.518 N/A ARG 107.A NH1 ASP 105.A OD2 no hydrogen 3.359 N/A LEU 109.A N ASP 101.A O no hydrogen 2.894 N/A ARG 110.A N ASP 101.A O no hydrogen 2.933 N/A TYR 112.A N GLY 99.A O no hydrogen 2.879 N/A GLN 114.A N MET 97.A O no hydrogen 2.899 N/A SER 115.A N ILE 123.A O no hydrogen 2.871 N/A ALA 116.A N GLN 95.A O no hydrogen 2.896 N/A TYR 117.A N LYS 120.A O no hydrogen 3.002 N/A TYR 117.A OH GLN 86.A OE1 no hydrogen 3.221 N/A TYR 117.A OH HIS 92.A ND1 no hydrogen 2.764 N/A ASP 118.A N THR 93.A O no hydrogen 2.851 N/A TYR 122.A N SER 115.A O no hydrogen 2.784 N/A TYR 122.A OH THR 142.A OG1 no hydrogen 2.419 N/A ILE 123.A N SER 115.A O no hydrogen 2.947 N/A ALA 124.A N THR 133.A O no hydrogen 2.930 N/A LEU 125.A N ASP 113.A O no hydrogen 2.927 N/A ASN 126.A N SER 131.A O no hydrogen 2.819 N/A LEU 129.A N ASN 126.A O no hydrogen 2.792 N/A SER 131.A N ASP 128.A OD1 no hydrogen 2.858 N/A SER 131.A OG ASP 128.A OD1 no hydrogen 3.219 N/A SER 131.A OG ASP 128.A OD2 no hydrogen 3.479 N/A THR 133.A N ALA 124.A O no hydrogen 2.903 N/A THR 133.A OG1 ALA 124.A O no hydrogen 3.383 N/A ALA 135.A N TYR 122.A O no hydrogen 2.944 N/A ALA 139.A N ASP 136.A OD1 no hydrogen 2.920 N/A GLN 140.A N THR 137.A O no hydrogen 2.789 N/A ILE 141.A N THR 137.A O no hydrogen 2.961 N/A THR 142.A N ALA 138.A O no hydrogen 2.921 N/A THR 142.A OG1 TYR 122.A OH no hydrogen 2.419 N/A THR 142.A OG1 ALA 138.A O no hydrogen 3.524 N/A GLN 143.A N ALA 139.A O no hydrogen 2.878 N/A GLN 143.A NE2 GLU 147.A OE2 no hydrogen 3.269 N/A ARG 144.A N GLN 140.A O no hydrogen 2.901 N/A LYS 145.A N ILE 141.A O no hydrogen 2.954 N/A LEU 146.A N THR 142.A O no hydrogen 2.857 N/A GLU 147.A N GLN 143.A O no hydrogen 2.890 N/A ALA 148.A N ARG 144.A O no hydrogen 2.916 N/A ALA 149.A N LEU 146.A O no hydrogen 3.243 N/A ARG 150.A N GLU 147.A O no hydrogen 3.152 N/A ALA 151.A N LEU 146.A O no hydrogen 3.375 N/A LEU 155.A N ALA 151.A O no hydrogen 2.886 N/A ARG 156.A N ALA 152.A O no hydrogen 2.899 N/A ALA 157.A N GLU 153.A O no hydrogen 2.968 N/A TYR 158.A N GLN 154.A O no hydrogen 2.892 N/A LEU 159.A N LEU 155.A O no hydrogen 2.812 N/A GLU 160.A N ARG 156.A O no hydrogen 2.974 N/A GLY 161.A N ALA 157.A O no hydrogen 3.349 N/A CYS 163.A N TYR 158.A O no hydrogen 2.703 N/A GLU 165.A N GLY 161.A O no hydrogen 2.766 N/A TRP 166.A N THR 162.A O no hydrogen 3.086 N/A LEU 167.A N CYS 163.A O no hydrogen 2.915 N/A ARG 168.A N VAL 164.A O no hydrogen 2.903 N/A ARG 169.A N GLU 165.A O no hydrogen 2.918 N/A TYR 170.A N TRP 166.A O no hydrogen 2.889 N/A TYR 170.A OH TYR 58.A OH no hydrogen 2.436 N/A LEU 171.A N LEU 167.A O no hydrogen 2.919 N/A GLU 172.A N ARG 168.A O no hydrogen 2.913 N/A ASN 173.A N ARG 169.A O no hydrogen 2.901 N/A GLY 174.A N TYR 170.A O no hydrogen 2.863 N/A LYS 175.A N GLU 172.A O no hydrogen 3.484 N/A LYS 175.A NZ GLU 172.A O no hydrogen 2.997 N/A THR 177.A N GLY 174.A O no hydrogen 3.224 N/A LEU 178.A N GLY 174.A O no hydrogen 2.740 N/A ARG 180.A NE THR 177.A O no hydrogen 2.749 N/A ARG 180.A NH2 THR 177.A O no hydrogen 3.421 N/A GLU 182.A N TYR 208.A O no hydrogen 2.543 N/A LYS 185.A N LEU 205.A O no hydrogen 2.895 N/A HIS 187.A N TRP 203.A O no hydrogen 2.949 N/A THR 189.A N ARG 201.A O no hydrogen 2.916 N/A HIS 191.A N THR 199.A O no hydrogen 2.906 N/A LEU 193.A N GLU 197.A O no hydrogen 3.257 N/A SER 194.A N GLU 197.A O no hydrogen 3.192 N/A ASP 195.A N SER 194.A OG no hydrogen 2.532 N/A ALA 198.A N VAL 243.A O no hydrogen 2.904 N/A THR 199.A N HIS 191.A O no hydrogen 2.890 N/A THR 199.A OG1 HIS 191.A O no hydrogen 3.070 N/A LEU 200.A N VAL 241.A O no hydrogen 2.895 N/A ARG 201.A N THR 189.A O no hydrogen 2.917 N/A CYS 202.A N ALA 239.A O no hydrogen 2.868 N/A TRP 203.A N HIS 187.A O no hydrogen 2.820 N/A TRP 203.A NE1 THR 189.A OG1 no hydrogen 2.897 N/A ALA 204.A N LYS 237.A O no hydrogen 2.879 N/A LEU 205.A N LYS 185.A O no hydrogen 2.888 N/A TYR 208.A N GLU 182.A O no hydrogen 3.127 N/A THR 213.A N GLN 256.A O no hydrogen 2.960 N/A THR 213.A OG1 GLN 256.A O no hydrogen 2.991 N/A THR 215.A N HIS 254.A O no hydrogen 2.948 N/A TRP 216.A NE1 ALA 239.A O no hydrogen 2.557 N/A GLN 217.A N THR 252.A O no hydrogen 2.890 N/A ARG 218.A N GLU 221.A O no hydrogen 3.334 N/A THR 224.A OG1 ALA 240.A O no hydrogen 3.544 N/A GLN 225.A NE2 LEU 214.A O no hydrogen 3.596 N/A ARG 228.A N GLN 236.A O no hydrogen 2.916 N/A ARG 228.A NE GLN 236.A OE1 no hydrogen 2.710 N/A ARG 228.A NH2 GLN 236.A OE1 no hydrogen 3.189 N/A ALA 230.A N THR 234.A O no hydrogen 2.931 N/A THR 234.A N ASP 232.A OD1 no hydrogen 3.205 N/A THR 234.A OG1 ASP 232.A OD1 no hydrogen 2.285 N/A PHE 235.A N PHE 207.A O no hydrogen 3.148 N/A GLN 236.A N ARG 228.A O no hydrogen 2.880 N/A LYS 237.A N ALA 204.A O no hydrogen 2.915 N/A ALA 239.A N CYS 202.A O no hydrogen 2.922 N/A VAL 241.A N LEU 200.A O no hydrogen 2.917 N/A VAL 243.A N ALA 198.A O no hydrogen 2.879 N/A SER 245.A N HIS 196.A O no hydrogen 3.038 N/A GLU 248.A N GLU 248.A OE1 no hydrogen 2.819 N/A GLN 249.A N GLN 249.A OE1 no hydrogen 2.612 N/A THR 252.A N GLN 217.A O no hydrogen 2.742 N/A CYS 253.A N LEU 266.A O no hydrogen 2.896 N/A CYS 253.A SG HIS 254.A O no hydrogen 4.030 N/A HIS 254.A N THR 215.A O no hydrogen 2.861 N/A MET 255.A N LEU 264.A O no hydrogen 2.917 N/A GLN 256.A N THR 213.A O no hydrogen 2.908 N/A HIS 257.A NE2 TYR 208.A O no hydrogen 3.201 N/A LEU 260.A N HIS 257.A O no hydrogen 3.186 N/A GLN 261.A N GLN 261.A OE1 no hydrogen 2.579 N/A LEU 264.A N MET 255.A O no hydrogen 2.913 N/A LEU 266.A N CYS 253.A O no hydrogen 2.890 N/A SER 267.A OG GLU 269.A OE2 no hydrogen 2.800 N/A SER 271.A OG GLU 269.A O no hydrogen 3.360 N/A