Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6uj8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A N VAL 102.A O no hydrogen 2.940 N/A HIS 2.A ND1 ASP 28.A OD2 no hydrogen 2.786 N/A HIS 2.A NE2 GLU 179.A OE2 no hydrogen 3.039 N/A SER 3.A N ASP 28.A OD1 no hydrogen 2.924 N/A SER 3.A OG ASP 28.A OD1 no hydrogen 3.533 N/A MET 4.A N CYS 100.A O no hydrogen 2.987 N/A ARG 5.A N TYR 26.A O no hydrogen 2.777 N/A ARG 5.A NH1 MET 4.A O no hydrogen 3.365 N/A ARG 5.A NH1 CYS 100.A O no hydrogen 3.392 N/A ARG 5.A NH1 ASP 101.A OD1 no hydrogen 2.774 N/A ARG 5.A NH2 ASP 101.A OD1 no hydrogen 2.921 N/A TYR 6.A N TYR 98.A O no hydrogen 2.992 N/A PHE 7.A N VAL 24.A O no hydrogen 2.956 N/A TYR 8.A N SER 96.A O no hydrogen 2.792 N/A THR 9.A N ILE 22.A O no hydrogen 2.814 N/A SER 10.A N LEU 94.A O no hydrogen 2.761 N/A SER 10.A OG ASP 73.A OD2 no hydrogen 3.031 N/A VAL 11.A N ARG 20.A O no hydrogen 3.064 N/A SER 12.A N HIS 92.A O no hydrogen 2.899 N/A ARG 13.A NH1 GLU 18.A O no hydrogen 2.519 N/A ARG 13.A NH2 ASP 38.A OD1 no hydrogen 3.180 N/A GLU 18.A N GLU 18.A OE1 no hydrogen 2.535 N/A ARG 20.A N VAL 11.A O no hydrogen 3.154 N/A ARG 20.A NE ASP 36.A OD1 no hydrogen 3.099 N/A ARG 20.A NH2 ASP 36.A OD1 no hydrogen 3.542 N/A PHE 21.A N SER 37.A OG no hydrogen 2.830 N/A ILE 22.A N THR 9.A O no hydrogen 2.969 N/A SER 23.A N PHE 35.A O no hydrogen 2.833 N/A VAL 24.A N PHE 7.A O no hydrogen 3.082 N/A GLY 25.A N VAL 33.A O no hydrogen 3.248 N/A TYR 26.A N ARG 5.A O no hydrogen 2.867 N/A VAL 27.A N THR 30.A O no hydrogen 2.793 N/A ASP 28.A N SER 3.A O no hydrogen 2.848 N/A ASP 29.A N TYR 208.A OH no hydrogen 3.309 N/A THR 30.A N VAL 27.A O no hydrogen 3.014 N/A THR 30.A OG1 TYR 208.A OH no hydrogen 2.941 N/A GLN 31.A NE2 VAL 33.A O no hydrogen 3.114 N/A PHE 32.A N GLY 25.A O no hydrogen 3.028 N/A ARG 34.A N GLU 45.A O no hydrogen 3.029 N/A ARG 34.A NE GLU 45.A OE1 no hydrogen 2.998 N/A ARG 34.A NH2 GLU 45.A OE1 no hydrogen 2.696 N/A PHE 35.A N SER 23.A O no hydrogen 3.015 N/A SER 37.A N PHE 21.A O no hydrogen 2.873 N/A SER 37.A OG PHE 21.A O no hydrogen 3.502 N/A ASP 38.A N ASP 36.A OD1 no hydrogen 2.845 N/A ALA 39.A N ASP 36.A O no hydrogen 3.262 N/A GLU 44.A N THR 63.A OG1 no hydrogen 3.126 N/A GLU 45.A N ARG 34.A O no hydrogen 2.865 N/A ARG 47.A N PHE 32.A O no hydrogen 2.682 N/A ILE 51.A N ALA 48.A O no hydrogen 3.512 N/A GLU 52.A N PRO 49.A O no hydrogen 3.334 N/A GLU 54.A N ILE 51.A O no hydrogen 3.132 N/A GLU 57.A N GLU 57.A OE1 no hydrogen 2.809 N/A TYR 58.A N GLY 55.A O no hydrogen 3.012 N/A TYR 58.A OH TYR 170.A OH no hydrogen 2.810 N/A TRP 59.A NE1 GLU 54.A O no hydrogen 3.338 N/A ASP 60.A N PRO 56.A O no hydrogen 3.270 N/A ARG 61.A N GLU 57.A O no hydrogen 3.344 N/A ASN 62.A N TYR 58.A O no hydrogen 3.171 N/A ASN 62.A ND2 GLU 44.A OE1 no hydrogen 2.958 N/A THR 63.A N TRP 59.A O no hydrogen 3.033 N/A THR 63.A OG1 TRP 59.A O no hydrogen 2.469 N/A GLN 64.A N ASP 60.A O no hydrogen 3.365 N/A GLN 64.A N ARG 61.A O no hydrogen 3.057 N/A ILE 65.A N ARG 61.A O no hydrogen 3.430 N/A TYR 66.A N ASN 62.A O no hydrogen 3.055 N/A TYR 66.A OH GLU 44.A OE2 no hydrogen 2.643 N/A LYS 67.A N THR 63.A O no hydrogen 3.123 N/A ALA 68.A N GLN 64.A O no hydrogen 3.038 N/A GLN 69.A N ILE 65.A O no hydrogen 2.924 N/A GLN 69.A NE2 GLN 69.A O no hydrogen 3.515 N/A GLN 69.A NE2 ASP 73.A OD1 no hydrogen 2.830 N/A ALA 70.A N TYR 66.A O no hydrogen 2.716 N/A GLN 71.A N LYS 67.A O no hydrogen 3.229 N/A THR 72.A N ALA 68.A O no hydrogen 2.868 N/A THR 72.A OG1 ALA 68.A O no hydrogen 2.643 N/A ASP 73.A N GLN 69.A O no hydrogen 2.742 N/A ARG 74.A N ALA 70.A O no hydrogen 3.032 N/A GLU 75.A N GLN 71.A O no hydrogen 3.208 N/A SER 76.A N THR 72.A O no hydrogen 2.972 N/A SER 76.A OG THR 72.A O no hydrogen 2.966 N/A LEU 77.A N ASP 73.A O no hydrogen 2.784 N/A ARG 78.A N ARG 74.A O no hydrogen 3.209 N/A ASN 79.A N GLU 75.A O no hydrogen 3.110 N/A LEU 80.A N SER 76.A O no hydrogen 2.924 N/A ARG 81.A N LEU 77.A O no hydrogen 3.167 N/A GLY 82.A N ARG 78.A O no hydrogen 3.451 N/A TYR 83.A N ASN 79.A O no hydrogen 2.922 N/A TYR 84.A N LEU 80.A O no hydrogen 3.111 N/A TYR 84.A OH ASP 136.A OD1 no hydrogen 3.221 N/A TYR 84.A OH ASP 136.A OD2 no hydrogen 2.481 N/A ASN 85.A N GLY 82.A O no hydrogen 3.169 N/A GLN 86.A N ARG 81.A O no hydrogen 2.853 N/A SER 91.A OG SER 12.A O no hydrogen 2.601 N/A HIS 92.A N SER 12.A OG no hydrogen 2.786 N/A THR 93.A N ASP 118.A OD1 no hydrogen 2.963 N/A LEU 94.A N SER 10.A O no hydrogen 2.941 N/A GLN 95.A N ALA 116.A O no hydrogen 2.855 N/A SER 96.A N TYR 8.A O no hydrogen 2.864 N/A MET 97.A N GLN 114.A O no hydrogen 3.015 N/A TYR 98.A N TYR 6.A O no hydrogen 3.164 N/A TYR 98.A OH TYR 8.A OH no hydrogen 2.659 N/A GLY 99.A N HIS 112.A O no hydrogen 2.986 N/A CYS 100.A N MET 4.A O no hydrogen 3.231 N/A ASP 101.A N ARG 110.A O no hydrogen 2.822 N/A VAL 102.A N HIS 2.A O no hydrogen 2.825 N/A GLY 103.A N ARG 107.A O no hydrogen 3.106 N/A GLY 106.A N GLY 103.A O no hydrogen 3.049 N/A ARG 107.A N ASP 105.A OD1 no hydrogen 3.352 N/A LEU 109.A N ASP 101.A O no hydrogen 2.732 N/A ARG 110.A NE GLY 111.A O no hydrogen 3.066 N/A HIS 112.A N GLY 99.A O no hydrogen 2.791 N/A HIS 112.A NE2 ASP 101.A OD2 no hydrogen 3.283 N/A GLN 114.A N MET 97.A O no hydrogen 2.964 N/A TYR 115.A N ILE 123.A O no hydrogen 2.879 N/A ALA 116.A N GLN 95.A O no hydrogen 2.905 N/A TYR 117.A N LYS 120.A O no hydrogen 2.977 N/A TYR 117.A OH GLN 86.A OE1 no hydrogen 2.408 N/A ASP 118.A N THR 93.A O no hydrogen 2.789 N/A LYS 120.A N TYR 117.A O no hydrogen 3.087 N/A TYR 122.A N TYR 115.A O no hydrogen 2.909 N/A TYR 122.A OH THR 142.A OG1 no hydrogen 2.933 N/A ALA 124.A N THR 133.A O no hydrogen 3.185 N/A LEU 125.A N ASP 113.A O no hydrogen 2.791 N/A ASN 126.A N SER 131.A O no hydrogen 2.757 N/A ASN 126.A ND2 SER 131.A OG no hydrogen 2.909 N/A LEU 129.A N ASN 126.A O no hydrogen 2.803 N/A ARG 130.A N ASP 128.A OD1 no hydrogen 2.660 N/A SER 131.A N ASP 128.A OD1 no hydrogen 3.157 N/A SER 131.A OG ASP 128.A OD1 no hydrogen 3.291 N/A SER 131.A OG ASP 128.A OD2 no hydrogen 3.204 N/A THR 133.A N ALA 124.A O no hydrogen 2.954 N/A THR 133.A OG1 ASN 126.A OD1 no hydrogen 2.636 N/A ALA 135.A N TYR 122.A O no hydrogen 3.162 N/A ALA 139.A N ASP 136.A OD1 no hydrogen 2.910 N/A GLN 140.A N ASP 136.A O no hydrogen 3.308 N/A ILE 141.A N ALA 138.A O no hydrogen 3.102 N/A THR 142.A OG1 TYR 122.A OH no hydrogen 2.933 N/A GLN 143.A N ALA 139.A O no hydrogen 2.740 N/A ARG 144.A N GLN 140.A O no hydrogen 2.772 N/A LYS 145.A N ILE 141.A O no hydrogen 3.019 N/A LYS 145.A NZ TYR 83.A OH no hydrogen 2.830 N/A TRP 146.A N THR 142.A O no hydrogen 2.902 N/A GLU 147.A N GLN 143.A O no hydrogen 2.789 N/A ALA 148.A N ARG 144.A O no hydrogen 3.057 N/A ALA 149.A N LYS 145.A O no hydrogen 2.929 N/A ARG 150.A N GLU 147.A O no hydrogen 3.284 N/A GLU 151.A N TRP 146.A O no hydrogen 3.043 N/A ARG 155.A N GLU 151.A O no hydrogen 3.095 N/A ARG 155.A NE GLU 151.A OE1 no hydrogen 2.699 N/A ARG 155.A NH1 ASP 113.A OD2 no hydrogen 3.105 N/A ARG 155.A NH1 TYR 115.A OH no hydrogen 2.721 N/A ARG 155.A NH2 GLU 151.A OE1 no hydrogen 2.605 N/A ARG 156.A N ALA 152.A O no hydrogen 2.724 N/A ALA 157.A N GLU 153.A O no hydrogen 2.999 N/A TYR 158.A N GLN 154.A O no hydrogen 3.303 N/A LEU 159.A N ARG 155.A O no hydrogen 2.951 N/A GLU 160.A N ARG 156.A O no hydrogen 3.039 N/A CYS 163.A N TYR 158.A O no hydrogen 2.801 N/A GLU 165.A N GLY 161.A O no hydrogen 2.990 N/A TRP 166.A N GLU 162.A O no hydrogen 2.899 N/A LEU 167.A N CYS 163.A O no hydrogen 3.101 N/A ARG 168.A N VAL 164.A O no hydrogen 2.985 N/A ARG 168.A NE GLY 106.A O no hydrogen 2.665 N/A ARG 168.A NH1 GLY 106.A O no hydrogen 3.128 N/A ARG 169.A N GLU 165.A O no hydrogen 3.100 N/A ARG 169.A NE GLU 54.A OE2 no hydrogen 2.517 N/A ARG 169.A NH1 GLU 54.A OE1 no hydrogen 3.228 N/A ARG 169.A NH1 GLU 54.A OE2 no hydrogen 3.095 N/A TYR 170.A N TRP 166.A O no hydrogen 3.005 N/A LEU 171.A N LEU 167.A O no hydrogen 3.019 N/A GLU 172.A N ARG 168.A O no hydrogen 3.086 N/A ASN 173.A N ARG 169.A O no hydrogen 3.014 N/A GLY 174.A N TYR 170.A O no hydrogen 2.693 N/A LYS 177.A N GLY 174.A O no hydrogen 3.188 N/A LEU 178.A N GLY 174.A O no hydrogen 2.772 N/A GLU 179.A N LYS 175.A O no hydrogen 2.815 N/A ARG 180.A NE ASP 182.A OD1 no hydrogen 3.146 N/A ARG 180.A NH2 LYS 177.A O no hydrogen 3.278 N/A LYS 185.A N LEU 205.A O no hydrogen 2.823 N/A HIS 187.A N TRP 203.A O no hydrogen 3.332 N/A THR 189.A N ARG 201.A O no hydrogen 2.952 N/A THR 189.A OG1 HIS 191.A NE2 no hydrogen 3.005 N/A THR 189.A OG1 ARG 201.A O no hydrogen 3.468 N/A HIS 190.A NE2 GLU 253.A OE2 no hydrogen 2.775 N/A HIS 191.A N THR 199.A O no hydrogen 2.949 N/A HIS 191.A NE2 THR 189.A OG1 no hydrogen 3.005 N/A ILE 193.A N GLU 197.A O no hydrogen 2.933 N/A SER 194.A N GLU 197.A O no hydrogen 3.288 N/A HIS 196.A N SER 194.A OG no hydrogen 3.099 N/A GLU 197.A N SER 194.A OG no hydrogen 3.217 N/A ALA 198.A N VAL 248.A O no hydrogen 2.804 N/A THR 199.A N HIS 191.A O no hydrogen 2.777 N/A LEU 200.A N VAL 246.A O no hydrogen 2.950 N/A ARG 201.A N THR 189.A O no hydrogen 3.070 N/A CYS 202.A N ALA 244.A O no hydrogen 2.596 N/A TRP 203.A N HIS 187.A O no hydrogen 2.794 N/A ALA 204.A N LYS 242.A O no hydrogen 2.943 N/A LEU 205.A N LYS 185.A O no hydrogen 2.994 N/A PHE 207.A N PHE 240.A O no hydrogen 3.230 N/A TYR 208.A N ASP 182.A O no hydrogen 3.262 N/A TYR 208.A OH THR 30.A OG1 no hydrogen 2.941 N/A ALA 210.A N ASP 29.A OD2 no hydrogen 3.037 N/A THR 213.A N GLN 261.A O no hydrogen 3.051 N/A THR 215.A N HIS 259.A O no hydrogen 2.860 N/A TRP 216.A NE1 ALA 244.A O no hydrogen 3.079 N/A GLN 217.A N THR 257.A O no hydrogen 2.589 N/A GLN 217.A NE2 ASP 222.A OD1 no hydrogen 3.285 N/A ARG 218.A N GLU 221.A O no hydrogen 2.917 N/A ARG 218.A NH1 TYR 256.A OH no hydrogen 3.156 N/A ASP 219.A N ARG 255.A O no hydrogen 3.061 N/A GLU 221.A N ARG 218.A O no hydrogen 3.089 N/A GLN 223.A N TRP 216.A O no hydrogen 3.187 N/A GLN 223.A NE2 GLU 221.A O no hydrogen 3.181 N/A ASP 226.A N GLN 223.A O no hydrogen 2.784 N/A THR 227.A N THR 224.A O no hydrogen 3.399 N/A THR 227.A OG1 GLN 223.A O no hydrogen 2.756 N/A GLU 228.A N ALA 245.A O no hydrogen 2.813 N/A VAL 230.A N TRP 243.A O no hydrogen 3.292 N/A ARG 233.A N GLN 241.A O no hydrogen 3.122 N/A ARG 233.A NE GLN 241.A OE1 no hydrogen 2.721 N/A ARG 233.A NH2 GLN 241.A OE1 no hydrogen 3.000 N/A ALA 235.A N THR 239.A O no hydrogen 2.941 N/A THR 239.A N ASP 237.A OD1 no hydrogen 3.127 N/A THR 239.A OG1 ASP 237.A OD1 no hydrogen 2.665 N/A THR 239.A OG1 ASP 237.A OD2 no hydrogen 3.457 N/A PHE 240.A N PHE 207.A O no hydrogen 2.783 N/A GLN 241.A N ARG 233.A O no hydrogen 2.959 N/A LYS 242.A N ALA 204.A O no hydrogen 2.900 N/A LYS 242.A NZ VAL 230.A O no hydrogen 2.792 N/A LYS 242.A NZ THR 232.A OG1 no hydrogen 3.307 N/A ALA 244.A N CYS 202.A O no hydrogen 2.862 N/A ALA 245.A N GLU 228.A O no hydrogen 2.904 N/A VAL 246.A N LEU 200.A O no hydrogen 2.924 N/A VAL 248.A N ALA 198.A O no hydrogen 2.801 N/A SER 250.A N HIS 196.A O no hydrogen 2.862 N/A SER 250.A OG ASP 195.A O no hydrogen 3.547 N/A GLU 252.A N PRO 249.A O no hydrogen 3.140 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 2.584 N/A ARG 255.A N GLU 252.A O no hydrogen 2.991 N/A ARG 255.A NE ASP 219.A OD2 no hydrogen 2.814 N/A ARG 255.A NH1 ASP 219.A OD2 no hydrogen 2.837 N/A ARG 255.A NH2 GLU 252.A OE2 no hydrogen 3.419 N/A TYR 256.A N GLU 253.A O no hydrogen 2.863 N/A THR 257.A N GLN 217.A O no hydrogen 2.738 N/A THR 257.A OG1 GLN 217.A O no hydrogen 3.563 N/A CYS 258.A N LEU 271.A O no hydrogen 2.857 N/A HIS 259.A N THR 215.A O no hydrogen 2.593 N/A VAL 260.A N LEU 269.A O no hydrogen 3.054 N/A GLN 261.A N THR 213.A O no hydrogen 2.883 N/A HIS 262.A NE2 PRO 209.A O no hydrogen 2.934 N/A GLY 264.A N HIS 262.A ND1 no hydrogen 3.086 N/A LEU 265.A N HIS 262.A O no hydrogen 2.725 N/A LEU 269.A N VAL 260.A O no hydrogen 3.075 N/A THR 270.A OG1 HIS 259.A NE2 no hydrogen 2.324 N/A LEU 271.A N CYS 258.A O no hydrogen 2.977 N/A