Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6rq4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N TYR 84.A OH no hydrogen 3.496 N/A ARG 6.A NE ASP 26.A OD1 no hydrogen 2.888 N/A TYR 7.A N GLY 4.A O no hydrogen 3.435 N/A TYR 7.A OH ASP 70.A OD2 no hydrogen 3.222 N/A THR 8.A N TYR 25.A O no hydrogen 3.070 N/A THR 8.A OG1 ASN 27.A OD1 no hydrogen 3.317 N/A GLY 14.A N VAL 21.A O no hydrogen 2.756 N/A GLY 16.A N GLY 19.A O no hydrogen 2.812 N/A MET 20.A N LYS 37.A O no hydrogen 2.759 N/A VAL 21.A N GLY 14.A O no hydrogen 3.357 N/A CYS 22.A N ILE 35.A O no hydrogen 2.701 N/A SER 23.A OG VAL 33.A O no hydrogen 3.065 N/A ALA 24.A N VAL 33.A O no hydrogen 3.093 N/A TYR 25.A N THR 8.A O no hydrogen 2.692 N/A ASP 26.A N VAL 31.A O no hydrogen 2.760 N/A LYS 30.A NZ ASN 27.A O no hydrogen 2.980 N/A ARG 32.A NH1 ASN 9.A O no hydrogen 3.002 N/A VAL 33.A N ALA 24.A O no hydrogen 2.806 N/A ALA 34.A N GLN 87.A O no hydrogen 2.916 N/A ILE 35.A N CYS 22.A O no hydrogen 2.753 N/A LYS 36.A N ILE 85.A O no hydrogen 2.903 N/A LYS 36.A NZ GLU 53.A OE2 no hydrogen 2.821 N/A ILE 38.A N VAL 83.A O no hydrogen 2.819 N/A SER 39.A N TYR 18.A O no hydrogen 3.141 N/A SER 39.A OG ASP 82.A OD2 no hydrogen 2.755 N/A HIS 43.A N PRO 40.A O no hydrogen 3.385 N/A CYS 47.A N HIS 43.A O no hydrogen 3.079 N/A CYS 47.A SG PRO 40.A O no hydrogen 3.014 N/A CYS 47.A SG HIS 43.A O no hydrogen 3.214 N/A GLN 48.A N GLN 44.A O no hydrogen 2.834 N/A ARG 49.A N THR 45.A O no hydrogen 3.046 N/A ARG 49.A N TYR 46.A O no hydrogen 3.283 N/A ARG 49.A NH2 THR 45.A OG1 no hydrogen 3.305 N/A THR 50.A N TYR 46.A O no hydrogen 2.865 N/A THR 50.A OG1 TYR 46.A O no hydrogen 2.957 N/A LEU 51.A N CYS 47.A O no hydrogen 2.863 N/A ARG 52.A N GLN 48.A O no hydrogen 2.852 N/A GLU 53.A N ARG 49.A O no hydrogen 3.116 N/A ILE 54.A N THR 50.A O no hydrogen 3.045 N/A LYS 55.A N LEU 51.A O no hydrogen 2.897 N/A ILE 56.A N ARG 52.A O no hydrogen 2.975 N/A LEU 57.A N GLU 53.A O no hydrogen 2.838 N/A LEU 58.A N ILE 54.A O no hydrogen 3.027 N/A ARG 59.A N LYS 55.A O no hydrogen 3.241 N/A ARG 59.A N ILE 56.A O no hydrogen 3.158 N/A ARG 59.A NH1 PRO 309.A O no hydrogen 3.565 N/A PHE 60.A N ILE 56.A O no hydrogen 2.956 N/A ARG 61.A N TYR 121.A OH no hydrogen 3.179 N/A ASN 64.A N HIS 62.A ND1 no hydrogen 3.014 N/A ASN 64.A ND2 LEU 144.A O no hydrogen 2.959 N/A ILE 65.A N HIS 62.A O no hydrogen 3.195 N/A ILE 66.A N ILE 146.A O no hydrogen 2.940 N/A ASN 69.A N VAL 86.A O no hydrogen 2.919 N/A ASN 69.A ND2 ASP 88.A OD2 no hydrogen 2.784 N/A ASP 70.A N VAL 86.A O no hydrogen 3.476 N/A ILE 72.A N TYR 84.A O no hydrogen 2.710 N/A ARG 73.A NE THR 325.A OG1 no hydrogen 2.731 N/A ARG 73.A NH1 ALA 74.A O no hydrogen 2.770 N/A ARG 73.A NH2 PHE 322.A O no hydrogen 3.038 N/A THR 76.A OG1 GLN 79.A OE1 no hydrogen 2.710 N/A GLU 78.A N GLU 78.A OE2 no hydrogen 2.901 N/A GLN 79.A N THR 76.A OG1 no hydrogen 3.343 N/A MET 80.A N ILE 77.A O no hydrogen 3.130 N/A VAL 83.A N ILE 38.A O no hydrogen 2.788 N/A TYR 84.A N ILE 72.A O no hydrogen 2.853 N/A ILE 85.A N LYS 36.A O no hydrogen 3.109 N/A VAL 86.A N ASP 70.A O no hydrogen 2.749 N/A GLN 87.A N ALA 34.A O no hydrogen 2.862 N/A GLN 87.A NE2 GLY 67.A O no hydrogen 3.380 N/A THR 92.A N LEU 139.A O no hydrogen 2.873 N/A THR 92.A OG1 ASP 93.A O no hydrogen 3.468 N/A ASP 93.A N THR 92.A OG1 no hydrogen 2.829 N/A LEU 94.A N LEU 137.A O no hydrogen 2.901 N/A LYS 96.A N ASP 93.A OD1 no hydrogen 2.735 N/A LEU 97.A N ASP 93.A O no hydrogen 3.074 N/A LEU 98.A N LEU 94.A O no hydrogen 2.874 N/A LYS 99.A N TYR 95.A O no hydrogen 3.211 N/A LYS 99.A N LYS 96.A O no hydrogen 3.336 N/A THR 100.A N LEU 97.A O no hydrogen 3.249 N/A THR 100.A OG1 LYS 96.A O no hydrogen 3.300 N/A THR 100.A OG1 LEU 97.A O no hydrogen 3.444 N/A GLN 101.A N LEU 97.A O no hydrogen 2.824 N/A GLN 101.A NE2 THR 100.A OG1 no hydrogen 3.219 N/A SER 104.A OG HIS 107.A ND1 no hydrogen 2.783 N/A HIS 107.A N SER 104.A OG no hydrogen 3.130 N/A HIS 107.A ND1 SER 104.A OG no hydrogen 2.783 N/A ILE 108.A N SER 104.A O no hydrogen 3.040 N/A CYS 109.A N ASN 105.A O no hydrogen 2.875 N/A CYS 109.A SG TYR 293.A O no hydrogen 3.408 N/A TYR 110.A N ASP 106.A O no hydrogen 3.181 N/A TYR 110.A OH ASP 143.A OD1 no hydrogen 3.092 N/A PHE 111.A N HIS 107.A O no hydrogen 2.828 N/A LEU 112.A N ILE 108.A O no hydrogen 2.930 N/A TYR 113.A N CYS 109.A O no hydrogen 2.922 N/A TYR 113.A OH GLU 303.A OE1 no hydrogen 2.694 N/A GLN 114.A N TYR 110.A O no hydrogen 3.108 N/A GLN 114.A NE2 TYR 110.A O no hydrogen 3.479 N/A ILE 115.A N PHE 111.A O no hydrogen 3.018 N/A LEU 116.A N LEU 112.A O no hydrogen 2.996 N/A ARG 117.A N TYR 113.A O no hydrogen 2.818 N/A ARG 117.A NE ASP 302.A O no hydrogen 2.827 N/A ARG 117.A NH1 GLU 63.A OE2 no hydrogen 3.270 N/A ARG 117.A NH1 ASP 302.A O no hydrogen 2.844 N/A ARG 117.A NH1 ASP 302.A OD2 no hydrogen 3.511 N/A ARG 117.A NH2 GLU 63.A OE2 no hydrogen 3.210 N/A ARG 117.A NH2 ASN 64.A OD1 no hydrogen 3.017 N/A GLY 118.A N GLN 114.A O no hydrogen 2.938 N/A LEU 119.A N ILE 115.A O no hydrogen 2.816 N/A LYS 120.A N LEU 116.A O no hydrogen 2.762 N/A LYS 120.A NZ GLU 303.A O no hydrogen 2.761 N/A ILE 122.A N GLY 118.A O no hydrogen 3.081 N/A HIS 123.A N LEU 119.A O no hydrogen 2.987 N/A HIS 123.A NE2 ASP 191.A OD2 no hydrogen 2.862 N/A SER 124.A N LYS 120.A O no hydrogen 2.925 N/A SER 124.A OG LYS 120.A O no hydrogen 3.391 N/A SER 124.A OG TYR 121.A O no hydrogen 2.707 N/A ALA 125.A N TYR 121.A O no hydrogen 3.087 N/A ALA 125.A N ILE 122.A O no hydrogen 2.996 N/A ASN 126.A N HIS 123.A O no hydrogen 3.057 N/A ASN 126.A ND2 PHE 310.A O no hydrogen 3.558 N/A VAL 127.A N ILE 122.A O no hydrogen 3.338 N/A LEU 128.A N ARG 153.A O no hydrogen 2.827 N/A HIS 129.A N ASP 191.A OD2 no hydrogen 2.983 N/A HIS 129.A NE2 CYS 147.A O no hydrogen 2.883 N/A ARG 130.A N ASP 191.A OD1 no hydrogen 2.981 N/A ARG 130.A NE GLY 185.A O no hydrogen 2.946 N/A ARG 130.A NH1 LYS 184.A O no hydrogen 3.380 N/A ARG 130.A NH2 LEU 151.A O no hydrogen 2.775 N/A ASP 131.A N HIS 129.A ND1 no hydrogen 3.053 N/A LYS 133.A NZ THR 171.A OG1 no hydrogen 2.775 N/A ASN 136.A N LYS 133.A O no hydrogen 2.890 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.667 N/A LEU 137.A N PRO 134.A O no hydrogen 3.172 N/A LEU 138.A N LYS 145.A O no hydrogen 2.869 N/A LEU 139.A N THR 92.A O no hydrogen 2.893 N/A ASN 140.A N ASP 143.A O no hydrogen 3.034 N/A ASN 140.A ND2 ASP 143.A OD2 no hydrogen 3.105 N/A THR 142.A N ASN 140.A OD1 no hydrogen 3.283 N/A THR 142.A OG1 ASN 140.A OD1 no hydrogen 3.145 N/A THR 142.A OG1 ASP 143.A OD2 no hydrogen 3.142 N/A LEU 144.A N GLN 114.A OE1 no hydrogen 2.948 N/A LYS 145.A N LEU 138.A O no hydrogen 2.843 N/A LYS 145.A NZ GLU 63.A O no hydrogen 3.127 N/A ILE 146.A N ASN 64.A O no hydrogen 2.828 N/A CYS 147.A N ASN 136.A O no hydrogen 2.888 N/A CYS 147.A SG ASN 136.A O no hydrogen 3.583 N/A PHE 149.A N GLU 53.A OE1 no hydrogen 2.993 N/A ALA 152.A N PHE 149.A O no hydrogen 3.250 N/A ARG 153.A N LEU 128.A O no hydrogen 3.072 N/A ALA 155.A N ASN 126.A O no hydrogen 2.853 N/A ASP 156.A N TYR 186.A O no hydrogen 2.840 N/A HIS 159.A N ASP 156.A O no hydrogen 2.962 N/A THR 162.A N ASN 182.A O no hydrogen 2.995 N/A THR 162.A OG1 THR 166.A OG1 no hydrogen 2.905 N/A LEU 165.A N MET 180.A O no hydrogen 3.251 N/A THR 166.A OG1 THR 162.A OG1 no hydrogen 2.905 N/A THR 166.A OG1 GLY 163.A O no hydrogen 2.916 N/A THR 171.A N ASP 131.A OD1 no hydrogen 3.068 N/A THR 171.A OG1 ASP 131.A OD1 no hydrogen 2.787 N/A ARG 172.A NH1 GLY 211.A O no hydrogen 3.300 N/A TRP 173.A NE1 GLY 211.A O no hydrogen 2.888 N/A TYR 174.A N THR 171.A O no hydrogen 3.272 N/A TYR 174.A OH GLU 201.A OE1 no hydrogen 2.655 N/A ARG 175.A N ARG 172.A O no hydrogen 3.122 N/A ARG 175.A NE ALA 170.A O no hydrogen 2.789 N/A ARG 175.A NH2 ALA 170.A O no hydrogen 2.977 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.825 N/A ILE 179.A N ALA 176.A O no hydrogen 3.062 N/A MET 180.A N PRO 177.A O no hydrogen 3.125 N/A LEU 181.A N GLU 178.A O no hydrogen 3.079 N/A ASN 182.A N GLU 178.A O no hydrogen 2.752 N/A SER 183.A OG ASP 160.A OD1 no hydrogen 3.103 N/A SER 183.A OG ASP 160.A OD2 no hydrogen 2.778 N/A LYS 184.A N ASP 160.A O no hydrogen 2.744 N/A LYS 184.A NZ HIS 159.A O no hydrogen 3.034 N/A LYS 184.A NZ HIS 161.A O no hydrogen 3.228 N/A GLY 185.A N SER 183.A OG no hydrogen 3.041 N/A TYR 186.A N ASP 160.A OD1 no hydrogen 2.736 N/A THR 187.A OG1 SER 189.A OG no hydrogen 2.790 N/A LYS 188.A NZ HIS 123.A O no hydrogen 2.950 N/A SER 189.A OG THR 187.A OG1 no hydrogen 2.790 N/A ILE 190.A N THR 187.A O no hydrogen 3.120 N/A ASP 191.A N LYS 188.A O no hydrogen 3.125 N/A TRP 193.A N SER 189.A O no hydrogen 3.203 N/A SER 194.A N ILE 190.A O no hydrogen 3.259 N/A SER 194.A OG TYR 174.A O no hydrogen 2.950 N/A SER 194.A OG ILE 190.A O no hydrogen 3.251 N/A VAL 195.A N ASP 191.A O no hydrogen 2.948 N/A GLY 196.A N ILE 192.A O no hydrogen 2.940 N/A CYS 197.A N TRP 193.A O no hydrogen 3.054 N/A CYS 197.A SG TRP 173.A O no hydrogen 3.897 N/A CYS 197.A SG TRP 193.A O no hydrogen 3.590 N/A ILE 198.A N SER 194.A O no hydrogen 3.084 N/A LEU 199.A N VAL 195.A O no hydrogen 2.896 N/A ALA 200.A N GLY 196.A O no hydrogen 3.036 N/A GLU 201.A N CYS 197.A O no hydrogen 3.005 N/A MET 202.A N ILE 198.A O no hydrogen 2.839 N/A LEU 203.A N LEU 199.A O no hydrogen 3.079 N/A SER 204.A N GLU 201.A O no hydrogen 3.290 N/A SER 204.A OG ALA 200.A O no hydrogen 3.447 N/A ASN 205.A N GLU 201.A O no hydrogen 2.677 N/A ASN 205.A ND2 LEU 98.A O no hydrogen 2.886 N/A ASN 205.A ND2 GLN 101.A O no hydrogen 2.737 N/A ARG 206.A N SER 204.A OG no hydrogen 3.377 N/A GLY 211.A N PHE 209.A O no hydrogen 2.895 N/A LYS 212.A N ASP 216.A OD2 no hydrogen 2.939 N/A TYR 214.A OH THR 166.A O no hydrogen 2.618 N/A GLN 217.A N HIS 213.A O no hydrogen 3.280 N/A GLN 217.A NE2 PHE 209.A O no hydrogen 2.919 N/A ASN 219.A N LEU 215.A O no hydrogen 3.392 N/A HIS 220.A N ASP 216.A O no hydrogen 2.967 N/A ILE 221.A N GLN 217.A O no hydrogen 3.184 N/A LEU 222.A N LEU 218.A O no hydrogen 2.879 N/A GLY 223.A N ASN 219.A O no hydrogen 2.951 N/A ILE 224.A N ILE 221.A O no hydrogen 3.170 N/A LEU 225.A N ILE 221.A O no hydrogen 3.004 N/A GLY 226.A N LEU 222.A O no hydrogen 2.842 N/A SER 227.A N LYS 251.A O no hydrogen 2.868 N/A SER 227.A OG LYS 251.A O no hydrogen 3.418 N/A ASP 232.A N SER 229.A OG no hydrogen 3.211 N/A LEU 233.A N SER 229.A O no hydrogen 2.964 N/A ASN 234.A N GLN 230.A O no hydrogen 2.779 N/A CYS 235.A N GLU 231.A O no hydrogen 3.319 N/A CYS 235.A SG GLU 231.A O no hydrogen 3.371 N/A ILE 236.A N LEU 233.A O no hydrogen 2.958 N/A ALA 241.A N ASN 238.A OD1 no hydrogen 3.172 N/A ARG 242.A N ASN 238.A O no hydrogen 2.907 N/A ARG 242.A NE.B ILE 236.A O no hydrogen 3.235 N/A ARG 242.A NH1.B ASN 234.A OD1 no hydrogen 3.361 N/A ARG 242.A NH2.B ILE 236.A O no hydrogen 3.002 N/A ASN 243.A N LEU 239.A O no hydrogen 2.772 N/A TYR 244.A N LYS 240.A O no hydrogen 3.059 N/A TYR 244.A OH ASN 219.A OD1 no hydrogen 2.860 N/A LEU 245.A N ALA 241.A O no hydrogen 3.212 N/A LEU 246.A N ARG 242.A O no hydrogen 2.982 N/A SER 247.A N ASN 243.A O no hydrogen 3.011 N/A SER 247.A N TYR 244.A O no hydrogen 3.223 N/A SER 247.A OG TYR 244.A O no hydrogen 2.663 N/A LEU 248.A N LEU 245.A O no hydrogen 3.334 N/A LYS 251.A N SER 227.A OG no hydrogen 2.846 N/A LYS 253.A NZ ASP 272.A OD1 no hydrogen 3.387 N/A VAL 254.A N ILE 224.A O no hydrogen 2.773 N/A TRP 256.A NE1 ASP 272.A OD1 no hydrogen 2.952 N/A ARG 258.A N PRO 255.A O no hydrogen 3.189 N/A LEU 259.A N PRO 255.A O no hydrogen 3.344 N/A PHE 260.A N TRP 256.A O no hydrogen 2.744 N/A ALA 263.A N PHE 260.A O no hydrogen 3.241 N/A ALA 267.A N ASP 264.A OD2 no hydrogen 3.096 N/A LEU 268.A N ASP 264.A O no hydrogen 3.207 N/A ASP 269.A N SER 265.A O no hydrogen 3.036 N/A LEU 270.A N LYS 266.A O no hydrogen 3.084 N/A LEU 271.A N ALA 267.A O no hydrogen 2.885 N/A ASP 272.A N LEU 268.A O no hydrogen 3.064 N/A LYS 273.A N ASP 269.A O no hydrogen 3.430 N/A LYS 273.A NZ ASP 269.A OD2 no hydrogen 3.264 N/A MET 274.A N LEU 270.A O no hydrogen 2.996 N/A LEU 275.A N LEU 271.A O no hydrogen 2.860 N/A THR 276.A OG1 ASP 272.A O no hydrogen 3.091 N/A THR 276.A OG1 LYS 273.A O no hydrogen 3.083 N/A ASN 278.A ND2 ASP 232.A OD2 no hydrogen 2.885 N/A HIS 280.A N ASN 278.A OD1 no hydrogen 3.232 N/A LYS 281.A N ASN 278.A O no hydrogen 2.976 N/A LYS 281.A NZ GLU 231.A OE1 no hydrogen 2.783 N/A LYS 281.A NZ ASP 232.A OD2 no hydrogen 3.032 N/A ARG 282.A NE THR 276.A O no hydrogen 3.095 N/A ARG 282.A NH1 GLU 178.A OE2 no hydrogen 2.854 N/A ARG 282.A NH1 SER 189.A O no hydrogen 2.758 N/A ARG 282.A NH2 GLU 178.A OE1 no hydrogen 2.968 N/A ARG 282.A NH2 GLU 178.A OE2 no hydrogen 3.468 N/A ARG 282.A NH2 THR 276.A O no hydrogen 2.992 N/A ARG 282.A NH2 PHE 277.A O no hydrogen 3.313 N/A ILE 283.A N LYS 273.A O no hydrogen 3.087 N/A GLU 284.A N GLN 287.A OE1 no hydrogen 2.933 N/A ALA 288.A N GLU 284.A O no hydrogen 2.821 N/A LEU 289.A N VAL 285.A O no hydrogen 2.987 N/A ALA 290.A N GLU 286.A O no hydrogen 3.199 N/A HIS 291.A N ALA 288.A O no hydrogen 3.127 N/A HIS 291.A NE2 ASP 269.A OD2 no hydrogen 2.752 N/A TYR 293.A N HIS 291.A ND1 no hydrogen 3.067 N/A TYR 293.A OH ASN 105.A OD1 no hydrogen 2.777 N/A LEU 294.A N HIS 291.A O no hydrogen 2.939 N/A GLU 295.A N PRO 292.A O no hydrogen 3.191 N/A TYR 297.A N LEU 294.A O no hydrogen 2.948 N/A TYR 298.A N LEU 294.A O no hydrogen 2.935 N/A ASP 299.A N GLU 303.A OE1 no hydrogen 2.778 N/A SER 301.A OG ASP 299.A OD1 no hydrogen 2.957 N/A ASP 302.A N ASP 299.A O no hydrogen 2.903 N/A GLU 303.A N PRO 300.A O no hydrogen 3.225 N/A ALA 306.A N SER 124.A OG no hydrogen 2.861 N/A PHE 310.A N ALA 125.A O no hydrogen 2.847 N/A LYS 314.A NZ GLU 42.A O no hydrogen 3.434 N/A LEU 317.A N PRO 313.A O no hydrogen 3.027 N/A LYS 318.A N LYS 314.A O no hydrogen 3.158 N/A LYS 318.A NZ ILE 77.A O no hydrogen 2.903 N/A LYS 318.A NZ MET 80.A O no hydrogen 2.938 N/A LEU 320.A N LYS 316.A O no hydrogen 3.047 N/A ILE 321.A N LEU 317.A O no hydrogen 2.768 N/A PHE 322.A N LYS 318.A O no hydrogen 2.688 N/A GLU 323.A N GLU 319.A O no hydrogen 2.847 N/A GLU 324.A N LEU 320.A O no hydrogen 2.750 N/A THR 325.A N ILE 321.A O no hydrogen 3.184 N/A THR 325.A OG1 ILE 321.A O no hydrogen 3.011 N/A THR 325.A OG1 PHE 322.A O no hydrogen 3.199 N/A ALA 326.A N GLU 323.A O no hydrogen 3.486 N/A PHE 328.A N THR 325.A O no hydrogen 3.283 N/A GLN 329.A N ALA 326.A O no hydrogen 3.185 N/A GLN 329.A NE2 ARG 73.A O no hydrogen 3.687 N/A