Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7un7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N HIS 1.A ND1 no hydrogen 2.741 N/A ILE 5.A N ASN 2.A O no hydrogen 2.910 N/A THR 6.A N ASN 2.A O no hydrogen 3.135 N/A GLU 7.A N LEU 3.A O no hydrogen 3.264 N/A LEU 9.A N ILE 5.A O no hydrogen 2.932 N/A GLU 10.A N THR 6.A O no hydrogen 2.633 N/A ALA 13.A N LEU 9.A O no hydrogen 2.857 N/A LYS 14.A N GLU 10.A O no hydrogen 2.942 N/A ALA 15.A N VAL 11.A O no hydrogen 2.930 N/A TYR 16.A N LEU 12.A O no hydrogen 2.976 N/A SER 17.A N ALA 13.A O no hydrogen 2.973 N/A VAL 18.A N LYS 14.A O no hydrogen 2.925 N/A GLN 19.A N ALA 15.A O no hydrogen 3.269 N/A GLY 20.A N SER 17.A O no hydrogen 2.986 N/A ASP 21.A N TYR 16.A O no hydrogen 2.896 N/A ALA 25.A N ASP 21.A O no hydrogen 2.939 N/A LEU 26.A N LYS 22.A O no hydrogen 2.574 N/A GLY 27.A N TRP 23.A O no hydrogen 2.763 N/A TYR 28.A N ARG 24.A O no hydrogen 2.934 N/A ALA 29.A N ALA 25.A O no hydrogen 2.850 N/A LYS 30.A N LEU 26.A O no hydrogen 2.946 N/A ALA 31.A N GLY 27.A O no hydrogen 3.032 N/A ILE 32.A N TYR 28.A O no hydrogen 2.851 N/A ASN 33.A N ALA 29.A O no hydrogen 2.972 N/A ASN 33.A ND2 TRP 319.A O no hydrogen 3.393 N/A ALA 34.A N LYS 30.A O no hydrogen 2.986 N/A LEU 35.A N ALA 31.A O no hydrogen 2.827 N/A LYS 36.A N ILE 32.A O no hydrogen 3.074 N/A LYS 36.A N ASN 33.A O no hydrogen 2.798 N/A SER 37.A N ALA 34.A O no hydrogen 2.714 N/A GLN 46.A N SER 44.A OG no hydrogen 2.880 N/A ALA 48.A N SER 44.A O no hydrogen 3.207 N/A CYS 49.A N TYR 45.A O no hydrogen 3.177 N/A CYS 49.A SG TYR 45.A O no hydrogen 3.581 N/A SER 50.A N GLN 46.A O no hydrogen 3.183 N/A SER 50.A N GLU 47.A O no hydrogen 3.146 N/A ILE 51.A N ALA 48.A O no hydrogen 2.664 N/A ILE 54.A N ILE 51.A O no hydrogen 3.257 N/A ALA 59.A N GLY 55.A O no hydrogen 2.562 N/A GLU 60.A N LYS 56.A O no hydrogen 2.690 N/A LYS 61.A N ARG 57.A O no hydrogen 2.993 N/A LYS 61.A NZ TYR 28.A OH no hydrogen 2.979 N/A ILE 62.A N MET 58.A O no hydrogen 3.024 N/A ILE 63.A N ALA 59.A O no hydrogen 2.875 N/A GLU 64.A N GLU 60.A O no hydrogen 2.824 N/A ILE 65.A N LYS 61.A O no hydrogen 3.008 N/A ILE 65.A N ILE 62.A O no hydrogen 3.129 N/A LEU 66.A N ILE 62.A O no hydrogen 3.172 N/A LEU 66.A N ILE 63.A O no hydrogen 3.112 N/A GLU 67.A N ILE 63.A O no hydrogen 3.242 N/A SER 68.A N GLU 64.A O no hydrogen 2.956 N/A GLY 69.A N ILE 65.A O no hydrogen 2.951 N/A ARG 72.A N GLU 64.A OE2 no hydrogen 3.169 N/A ASP 75.A N ARG 72.A O no hydrogen 2.937 N/A HIS 76.A N LYS 73.A O no hydrogen 3.011 N/A SER 78.A OG SER 80.A OG no hydrogen 2.851 N/A SER 80.A N SER 78.A OG no hydrogen 2.911 N/A SER 80.A OG SER 78.A OG no hydrogen 2.851 N/A VAL 81.A N SER 78.A O no hydrogen 3.379 N/A LEU 84.A N SER 80.A O no hydrogen 2.854 N/A GLU 85.A N VAL 81.A O no hydrogen 2.845 N/A LEU 86.A N PRO 82.A O no hydrogen 2.980 N/A PHE 87.A N VAL 83.A O no hydrogen 2.891 N/A SER 88.A N LEU 84.A O no hydrogen 2.838 N/A SER 88.A OG LEU 84.A O no hydrogen 2.256 N/A SER 88.A OG GLU 85.A O no hydrogen 3.086 N/A ASN 89.A N GLU 85.A O no hydrogen 3.002 N/A ASN 89.A N LEU 86.A O no hydrogen 3.330 N/A ILE 90.A N PHE 87.A O no hydrogen 2.916 N/A ALA 93.A N ILE 90.A O no hydrogen 2.939 N/A THR 95.A OG1.A VAL 18.A O no hydrogen 3.078 N/A THR 95.A OG1.A GLN 99.A OE1 no hydrogen 3.527 N/A THR 95.A OG1.B SER 17.A O no hydrogen 3.218 N/A THR 95.A OG1.B VAL 18.A O no hydrogen 3.483 N/A ALA 98.A N GLY 94.A O no hydrogen 2.915 N/A GLN 99.A N THR 95.A O no hydrogen 2.834 N/A MET 100.A N LYS 96.A O no hydrogen 3.164 N/A TRP 101.A N THR 97.A O no hydrogen 2.982 N/A TYR 102.A N ALA 98.A O no hydrogen 2.988 N/A GLN 103.A N GLN 99.A O no hydrogen 2.810 N/A GLN 104.A N MET 100.A O no hydrogen 2.865 N/A GLY 105.A N TYR 102.A O no hydrogen 2.894 N/A PHE 106.A N TRP 101.A O no hydrogen 2.925 N/A ARG 107.A N ASP 111.A OD2 no hydrogen 2.910 N/A ARG 107.A NH1 TYR 102.A O no hydrogen 2.922 N/A ARG 107.A NH1 PHE 106.A O no hydrogen 3.017 N/A ASP 111.A N SER 108.A OG no hydrogen 3.023 N/A ILE 112.A N SER 108.A O no hydrogen 3.084 N/A ARG 113.A N LEU 109.A O no hydrogen 2.793 N/A ARG 113.A NE GLU 110.A OE1 no hydrogen 2.976 N/A ARG 113.A NE GLU 110.A OE2 no hydrogen 3.198 N/A ARG 113.A NH2 GLU 110.A OE2 no hydrogen 2.478 N/A SER 114.A N GLU 110.A O no hydrogen 3.041 N/A SER 114.A OG GLU 110.A O no hydrogen 2.804 N/A SER 114.A OG ASP 111.A O no hydrogen 3.325 N/A GLN 115.A N ASP 111.A O no hydrogen 2.754 N/A ALA 116.A N ILE 112.A O no hydrogen 3.060 N/A THR 119.A N GLN 122.A OE1 no hydrogen 2.941 N/A GLN 121.A NE2 LEU 210.A O no hydrogen 2.902 N/A GLN 122.A N THR 119.A OG1 no hydrogen 3.037 N/A GLN 122.A NE2 GLY 92.A O no hydrogen 2.930 N/A ALA 123.A N THR 119.A O no hydrogen 2.828 N/A ILE 124.A N THR 120.A O no hydrogen 3.208 N/A GLY 125.A N GLN 121.A O no hydrogen 2.912 N/A LEU 126.A N GLN 122.A O no hydrogen 2.792 N/A LYS 127.A N ALA 123.A O no hydrogen 3.161 N/A LYS 127.A NZ ASP 208.A OD1 no hydrogen 3.017 N/A HIS 128.A N ILE 124.A O no hydrogen 3.220 N/A HIS 128.A NE2 ASP 208.A OD2 no hydrogen 3.122 N/A TYR 129.A N LEU 126.A O no hydrogen 3.044 N/A TYR 129.A OH LEU 86.A O no hydrogen 2.875 N/A PHE 132.A N HIS 128.A O no hydrogen 2.901 N/A LEU 133.A N SER 130.A O no hydrogen 3.328 N/A GLU 134.A N ASP 131.A O no hydrogen 2.993 N/A ARG 135.A NE THR 173.A OG1 no hydrogen 2.724 N/A ARG 135.A NH2 THR 173.A O no hydrogen 2.702 N/A MET 136.A N CYS 174.A O no hydrogen 2.835 N/A ARG 138.A N ALA 172.A O no hydrogen 2.901 N/A ARG 138.A NH1 TYR 167.A O no hydrogen 2.788 N/A ARG 138.A NH1 LYS 171.A O no hydrogen 3.026 N/A ARG 138.A NH2 TYR 167.A O no hydrogen 2.886 N/A GLU 140.A N PRO 137.A O no hydrogen 2.847 N/A ALA 141.A N PRO 137.A O no hydrogen 3.208 N/A THR 142.A N ARG 138.A O no hydrogen 3.005 N/A THR 142.A OG1 ARG 138.A O no hydrogen 3.115 N/A THR 142.A OG1 TYR 167.A OH no hydrogen 2.729 N/A GLU 143.A N GLU 139.A O no hydrogen 3.312 N/A ILE 144.A N GLU 140.A O no hydrogen 3.080 N/A GLU 145.A N ALA 141.A O no hydrogen 2.987 N/A GLN 146.A N THR 142.A O no hydrogen 2.968 N/A THR 147.A N GLU 143.A O no hydrogen 3.007 N/A THR 147.A OG1 GLU 143.A O no hydrogen 2.648 N/A VAL 148.A N ILE 144.A O no hydrogen 3.089 N/A GLN 149.A N GLU 145.A O no hydrogen 2.848 N/A GLN 149.A NE2 GLN 153.A OE1 no hydrogen 3.336 N/A LYS 150.A N GLN 146.A O no hydrogen 2.984 N/A ALA 151.A N THR 147.A O no hydrogen 3.365 N/A ALA 152.A N VAL 148.A O no hydrogen 2.848 N/A GLN 153.A N GLN 149.A O no hydrogen 2.661 N/A GLN 153.A NE2 LEU 159.A O no hydrogen 3.417 N/A PHE 155.A N ALA 152.A O no hydrogen 3.177 N/A ASN 156.A N ALA 152.A O no hydrogen 3.222 N/A GLY 158.A N ASN 156.A OD1 no hydrogen 2.612 N/A LEU 159.A N ASN 156.A O no hydrogen 3.266 N/A LEU 160.A N THR 182.A O no hydrogen 2.825 N/A VAL 162.A N LEU 180.A O no hydrogen 2.822 N/A ALA 163.A N GLU 145.A OE2 no hydrogen 3.119 N/A CYS 164.A N ASP 178.A O no hydrogen 2.631 N/A CYS 164.A SG VAL 162.A O no hydrogen 3.601 N/A GLY 165.A N PHE 250.A O no hydrogen 2.748 N/A TYR 167.A OH THR 142.A OG1 no hydrogen 2.729 N/A ARG 168.A N CYS 164.A O no hydrogen 3.270 N/A ARG 168.A NH1 THR 251.A OG1 no hydrogen 2.857 N/A ARG 168.A NH1 GLU 300.A OE1 no hydrogen 3.087 N/A ARG 168.A NH1 GLU 300.A OE2 no hydrogen 3.488 N/A ARG 168.A NH2 GLU 300.A OE2 no hydrogen 3.437 N/A ARG 169.A N GLY 165.A O no hydrogen 3.175 N/A ARG 169.A NH1 THR 251.A O no hydrogen 2.769 N/A ARG 169.A NH2 ASP 318.A OD2 no hydrogen 3.341 N/A GLY 170.A N TYR 167.A O no hydrogen 2.847 N/A LYS 171.A N SER 166.A O no hydrogen 3.137 N/A CYS 174.A N MET 136.A O no hydrogen 2.901 N/A CYS 174.A SG SER 166.A OG no hydrogen 3.415 N/A VAL 177.A N ARG 232.A O no hydrogen 3.138 N/A VAL 179.A N ASP 234.A O no hydrogen 2.781 N/A LEU 180.A N VAL 162.A O no hydrogen 2.660 N/A ILE 181.A N ILE 236.A O no hydrogen 2.871 N/A THR 182.A N LEU 160.A O no hydrogen 2.914 N/A THR 182.A OG1 VAL 238.A O no hydrogen 2.989 N/A HIS 183.A NE2 ASN 156.A OD1 no hydrogen 3.032 N/A ASP 185.A N HIS 183.A ND1 no hydrogen 3.158 N/A GLY 186.A N HIS 183.A O no hydrogen 3.134 N/A ARG 187.A N ASP 185.A OD1 no hydrogen 2.896 N/A SER 188.A N ASP 185.A OD1 no hydrogen 2.535 N/A ARG 190.A N ARG 187.A O no hydrogen 3.484 N/A ARG 195.A N ILE 192.A O no hydrogen 3.194 N/A LEU 196.A N ILE 192.A O no hydrogen 2.796 N/A LEU 197.A N PHE 193.A O no hydrogen 2.797 N/A ASP 198.A N SER 194.A O no hydrogen 3.447 N/A SER 199.A N ARG 195.A O no hydrogen 2.807 N/A LEU 200.A N LEU 196.A O no hydrogen 3.036 N/A ARG 201.A N LEU 197.A O no hydrogen 2.816 N/A ARG 201.A N ASP 198.A O no hydrogen 3.070 N/A ARG 201.A NH2 ASP 209.A OD2 no hydrogen 2.832 N/A GLN 202.A N ASP 198.A O no hydrogen 2.960 N/A GLY 204.A N ARG 201.A O no hydrogen 2.794 N/A LEU 206.A N LEU 200.A O no hydrogen 3.075 N/A THR 207.A N VAL 220.A O no hydrogen 2.843 N/A THR 207.A OG1 ASP 208.A OD2 no hydrogen 3.017 N/A THR 207.A OG1 VAL 220.A O no hydrogen 3.309 N/A ASP 208.A N VAL 220.A O no hydrogen 3.512 N/A LEU 210.A N LEU 218.A O no hydrogen 2.815 N/A VAL 211.A N LEU 218.A O no hydrogen 2.830 N/A GLY 213.A N LYS 216.A O no hydrogen 2.742 N/A TYR 217.A N ILE 235.A O no hydrogen 2.793 N/A TYR 217.A OH ASP 209.A OD1 no hydrogen 2.694 N/A LEU 218.A N VAL 211.A O no hydrogen 2.891 N/A GLY 219.A N LEU 233.A O no hydrogen 2.890 N/A VAL 220.A N ASP 208.A O no hydrogen 2.805 N/A CYS 221.A N ARG 231.A O no hydrogen 2.803 N/A CYS 221.A SG ARG 231.A O no hydrogen 3.597 N/A ARG 222.A N PHE 205.A O no hydrogen 2.954 N/A ARG 228.A NE PRO 224.A O no hydrogen 3.556 N/A ARG 228.A NH2 GLU 143.A OE1 no hydrogen 2.922 N/A ARG 229.A NE ASP 131.A OD1 no hydrogen 3.114 N/A ARG 229.A NH2 ASP 131.A OD1 no hydrogen 3.433 N/A HIS 230.A N ASP 131.A OD2 no hydrogen 3.177 N/A ARG 231.A N CYS 221.A O no hydrogen 2.684 N/A ARG 231.A NE GLU 140.A OE1 no hydrogen 3.364 N/A ARG 231.A NE GLU 140.A OE2 no hydrogen 2.729 N/A ARG 231.A NH2 GLU 140.A OE1 no hydrogen 2.938 N/A ARG 231.A NH2 GLU 140.A OE2 no hydrogen 3.559 N/A ARG 232.A NH1 GLY 219.A O no hydrogen 3.202 N/A ARG 232.A NH1 LEU 233.A O no hydrogen 3.184 N/A ARG 232.A NH1 ASP 234.A OD1 no hydrogen 2.719 N/A ARG 232.A NH2 ASP 234.A OD1 no hydrogen 2.823 N/A ARG 232.A NH2 ASP 234.A OD2 no hydrogen 3.508 N/A LEU 233.A N GLY 219.A O no hydrogen 2.835 N/A ASP 234.A N VAL 177.A O no hydrogen 2.804 N/A ILE 235.A N TYR 217.A O no hydrogen 2.878 N/A ILE 236.A N VAL 179.A O no hydrogen 2.986 N/A VAL 237.A N THR 215.A O no hydrogen 2.971 N/A VAL 238.A N ILE 181.A O no hydrogen 3.107 N/A GLU 242.A N PRO 239.A O no hydrogen 3.090 N/A PHE 243.A N TYR 240.A O no hydrogen 3.159 N/A CYS 245.A SG THR 297.A OG1 no hydrogen 3.780 N/A ALA 246.A N GLU 242.A O no hydrogen 2.952 N/A LEU 247.A N PHE 243.A O no hydrogen 2.832 N/A LEU 248.A N ALA 244.A O no hydrogen 2.953 N/A TYR 249.A N CYS 245.A O no hydrogen 2.926 N/A PHE 250.A N ALA 246.A O no hydrogen 2.725 N/A THR 251.A N LEU 247.A O no hydrogen 2.900 N/A THR 251.A OG1 LEU 247.A O no hydrogen 2.557 N/A GLY 252.A N LEU 248.A O no hydrogen 3.196 N/A SER 253.A N ARG 317.A O no hydrogen 3.135 N/A SER 253.A OG ARG 317.A O no hydrogen 3.456 N/A SER 253.A OG TRP 319.A OXT no hydrogen 2.787 N/A PHE 256.A N SER 253.A OG no hydrogen 3.243 N/A ASN 257.A N SER 253.A O no hydrogen 2.909 N/A ASN 257.A ND2 TYR 249.A O no hydrogen 2.811 N/A ARG 258.A N ALA 254.A O no hydrogen 2.998 N/A SER 259.A N HIS 255.A O no hydrogen 3.086 N/A MET 260.A N PHE 256.A O no hydrogen 3.027 N/A ARG 261.A N ASN 257.A O no hydrogen 2.940 N/A ARG 261.A NH2 GLU 273.A OE2 no hydrogen 3.297 N/A ALA 262.A N ARG 258.A O no hydrogen 2.985 N/A LEU 263.A N SER 259.A O no hydrogen 2.949 N/A ALA 264.A N MET 260.A O no hydrogen 2.910 N/A LYS 265.A N ARG 261.A O no hydrogen 3.109 N/A LYS 265.A NZ GLY 286.A O no hydrogen 2.953 N/A THR 266.A N ALA 262.A O no hydrogen 3.203 N/A THR 266.A OG1 LEU 263.A O no hydrogen 2.345 N/A LYS 267.A N LEU 263.A O no hydrogen 3.146 N/A GLY 268.A N LYS 265.A O no hydrogen 3.144 N/A MET 269.A N ALA 264.A O no hydrogen 2.658 N/A SER 270.A N SER 277.A O no hydrogen 2.849 N/A SER 272.A N ALA 275.A O no hydrogen 2.867 N/A SER 272.A OG ALA 275.A O no hydrogen 3.560 N/A GLU 273.A N GLU 273.A OE2 no hydrogen 3.147 N/A HIS 274.A N SER 272.A OG no hydrogen 2.776 N/A HIS 274.A ND1 GLU 242.A OE1 no hydrogen 3.224 N/A ALA 275.A N SER 272.A OG no hydrogen 3.272 N/A SER 277.A N SER 270.A O no hydrogen 2.636 N/A THR 278.A N ARG 293.A O no hydrogen 2.778 N/A ARG 282.A NH1 MET 269.A O no hydrogen 3.301 N/A ARG 282.A NH2 MET 269.A O no hydrogen 2.612 N/A ASN 283.A N ALA 287.A O no hydrogen 2.455 N/A GLY 290.A N VAL 281.A O no hydrogen 3.362 N/A ARG 293.A N THR 278.A O no hydrogen 2.685 N/A LEU 295.A N LEU 276.A O no hydrogen 2.812 N/A THR 299.A N ASP 302.A OD2 no hydrogen 2.814 N/A THR 299.A OG1 ASP 302.A OD2 no hydrogen 2.778 N/A ASP 302.A N THR 299.A O no hydrogen 3.031 N/A ASP 302.A N THR 299.A OG1 no hydrogen 3.197 N/A PHE 304.A N GLU 300.A O no hydrogen 3.312 N/A ARG 305.A N LYS 301.A O no hydrogen 2.800 N/A ARG 305.A NH2 ASP 302.A OD1 no hydrogen 2.853 N/A LEU 306.A N ASP 302.A O no hydrogen 2.638 N/A LEU 307.A N VAL 303.A O no hydrogen 2.880 N/A LEU 307.A N PHE 304.A O no hydrogen 3.181 N/A GLY 308.A N ARG 305.A O no hydrogen 2.711 N/A LEU 309.A N PHE 304.A O no hydrogen 2.731 N/A GLU 316.A N GLU 313.A O no hydrogen 2.540 N/A ARG 317.A N PRO 314.A O no hydrogen 2.793 N/A ARG 317.A NE ARG 312.A O no hydrogen 2.800 N/A ARG 317.A NH1 GLU 300.A OE1 no hydrogen 3.132 N/A ARG 317.A NH1 GLU 300.A OE2 no hydrogen 3.202 N/A ARG 317.A NH2 GLU 300.A OE2 no hydrogen 2.596 N/A ARG 317.A NH2 ARG 312.A O no hydrogen 3.076 N/A TRP 319.A N ARG 317.A O no hydrogen 2.896 N/A TRP 319.A NE1 GLU 316.A O no hydrogen 3.090 N/A