Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qp9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLN 5.A O no hydrogen 2.523 N/A VAL 2.A N GLN 5.A O no hydrogen 2.910 N/A GLN 5.A N VAL 2.A O no hydrogen 3.067 N/A ASP 8.A N TYR 90.A OH no hydrogen 2.936 N/A VAL 9.A N PHE 7.A O no hydrogen 3.250 N/A ARG 12.A NE ASP 32.A OD1 no hydrogen 2.930 N/A ARG 12.A NH2 ASP 32.A OD2 no hydrogen 2.946 N/A TYR 13.A N VAL 9.A O no hydrogen 3.447 N/A TYR 13.A OH ASP 76.A OD2 no hydrogen 2.785 N/A THR 14.A N TYR 31.A O no hydrogen 2.991 N/A THR 14.A OG1 ASN 15.A OD1 no hydrogen 3.218 N/A SER 17.A N SER 29.A O no hydrogen 2.896 N/A ILE 19.A N VAL 27.A O no hydrogen 2.996 N/A GLY 20.A N VAL 27.A O no hydrogen 3.109 N/A GLY 22.A N GLY 25.A O no hydrogen 2.928 N/A GLY 25.A N GLY 22.A O no hydrogen 3.061 N/A MET 26.A N LYS 43.A O no hydrogen 3.080 N/A VAL 27.A N GLY 20.A O no hydrogen 2.758 N/A CYS 28.A N ILE 41.A O no hydrogen 2.974 N/A SER 29.A N SER 17.A O no hydrogen 2.784 N/A ALA 30.A N VAL 39.A O no hydrogen 2.887 N/A TYR 31.A N THR 14.A O no hydrogen 2.733 N/A ASP 32.A N VAL 37.A O no hydrogen 2.747 N/A ASN 33.A N ARG 12.A O no hydrogen 2.916 N/A ASN 33.A ND2 ARG 12.A O no hydrogen 2.841 N/A ASN 33.A ND2 THR 14.A OG1 no hydrogen 2.917 N/A VAL 34.A N ASP 32.A OD1 no hydrogen 2.906 N/A ASN 35.A N ASP 32.A OD1 no hydrogen 3.294 N/A LYS 36.A NZ VAL 34.A O no hydrogen 3.231 N/A ARG 38.A NH1 ASN 15.A O no hydrogen 3.041 N/A ARG 38.A NH2 ASN 15.A O no hydrogen 2.957 N/A ARG 38.A NH2 SER 29.A OG no hydrogen 2.847 N/A VAL 39.A N ALA 30.A O no hydrogen 2.708 N/A ALA 40.A N GLN 93.A O no hydrogen 2.790 N/A ILE 41.A N CYS 28.A O no hydrogen 2.821 N/A LYS 42.A N ILE 91.A O no hydrogen 2.765 N/A LYS 42.A NZ GLU 59.A OE1 no hydrogen 2.512 N/A LYS 43.A N MET 26.A O no hydrogen 2.750 N/A LYS 43.A NZ VAL 6.A O no hydrogen 2.378 N/A ILE 44.A N VAL 89.A O no hydrogen 2.688 N/A SER 45.A OG ASP 88.A OD1 no hydrogen 2.780 N/A HIS 49.A N PRO 46.A O no hydrogen 3.251 N/A GLN 50.A NE2 LEU 313.A O no hydrogen 3.677 N/A GLN 50.A NE2 ASP 314.A O no hydrogen 3.558 N/A GLN 50.A NE2 LEU 316.A O no hydrogen 2.326 N/A CYS 53.A N HIS 49.A O no hydrogen 3.136 N/A CYS 53.A SG PRO 46.A O no hydrogen 3.334 N/A CYS 53.A SG HIS 49.A O no hydrogen 3.499 N/A GLN 54.A N GLN 50.A O no hydrogen 3.048 N/A GLN 54.A NE2 GLN 50.A OE1 no hydrogen 2.585 N/A ARG 55.A N THR 51.A O no hydrogen 3.171 N/A THR 56.A N TYR 52.A O no hydrogen 2.914 N/A THR 56.A OG1 TYR 52.A O no hydrogen 2.856 N/A LEU 57.A N CYS 53.A O no hydrogen 3.108 N/A ARG 58.A N GLN 54.A O no hydrogen 2.855 N/A ARG 58.A NH1 ASP 314.A OD1 no hydrogen 3.504 N/A ARG 58.A NH2 GLN 54.A OE1 no hydrogen 2.922 N/A GLU 59.A N ARG 55.A O no hydrogen 2.835 N/A ILE 60.A N THR 56.A O no hydrogen 2.943 N/A LYS 61.A N LEU 57.A O no hydrogen 2.889 N/A ILE 62.A N ARG 58.A O no hydrogen 2.946 N/A LEU 63.A N GLU 59.A O no hydrogen 2.936 N/A LEU 64.A N ILE 60.A O no hydrogen 2.947 N/A ARG 65.A N LYS 61.A O no hydrogen 3.247 N/A ARG 65.A N ILE 62.A O no hydrogen 3.080 N/A ARG 65.A NH1 PRO 308.A O no hydrogen 3.511 N/A PHE 66.A N ILE 62.A O no hydrogen 2.892 N/A ARG 67.A N TYR 127.A OH no hydrogen 3.105 N/A ASN 70.A N HIS 68.A ND1 no hydrogen 2.884 N/A ASN 70.A ND2 GLN 120.A OE1 no hydrogen 3.418 N/A ASN 70.A ND2 LEU 151.A O no hydrogen 2.879 N/A ILE 71.A N HIS 68.A O no hydrogen 3.089 N/A ILE 72.A N ILE 153.A O no hydrogen 2.886 N/A ASN 75.A N VAL 92.A O no hydrogen 2.781 N/A ASN 75.A ND2 ASP 94.A OD1 no hydrogen 3.251 N/A ILE 77.A N ASP 76.A OD1 no hydrogen 2.751 N/A ILE 78.A N TYR 90.A O no hydrogen 2.894 N/A ARG 79.A NE THR 329.A OG1 no hydrogen 2.681 N/A ARG 79.A NH1 ALA 80.A O no hydrogen 2.934 N/A ARG 79.A NH2 PHE 326.A O no hydrogen 2.825 N/A ARG 79.A NH2 THR 329.A OG1 no hydrogen 3.417 N/A GLN 85.A N THR 82.A OG1 no hydrogen 3.284 N/A MET 86.A N THR 82.A O no hydrogen 2.989 N/A VAL 89.A N ILE 44.A O no hydrogen 2.774 N/A TYR 90.A N ILE 78.A O no hydrogen 3.035 N/A ILE 91.A N LYS 42.A O no hydrogen 2.799 N/A VAL 92.A N ASP 76.A O no hydrogen 2.938 N/A GLN 93.A N ALA 40.A O no hydrogen 2.699 N/A GLU 97.A N LEU 145.A O no hydrogen 2.918 N/A THR 98.A N LEU 145.A O no hydrogen 3.000 N/A THR 98.A OG1 ASP 99.A O no hydrogen 3.459 N/A LEU 100.A N LEU 143.A O no hydrogen 2.890 N/A TYR 101.A N PRO 140.A O no hydrogen 3.109 N/A LYS 102.A N ASP 99.A OD1 no hydrogen 2.732 N/A LEU 103.A N ASP 99.A O no hydrogen 3.111 N/A LEU 104.A N LEU 100.A O no hydrogen 2.859 N/A LYS 105.A N TYR 101.A O no hydrogen 3.056 N/A LYS 105.A N LYS 102.A O no hydrogen 3.281 N/A THR 106.A N LEU 103.A O no hydrogen 3.394 N/A THR 106.A OG1 GLN 107.A OE1 no hydrogen 2.862 N/A GLN 107.A N LEU 103.A O no hydrogen 2.771 N/A SER 110.A OG HIS 113.A ND1 no hydrogen 2.681 N/A ASN 111.A ND2 ASP 263.A OD1 no hydrogen 3.189 N/A HIS 113.A N SER 110.A OG no hydrogen 3.273 N/A HIS 113.A ND1 SER 110.A OG no hydrogen 2.681 N/A ILE 114.A N SER 110.A O no hydrogen 3.061 N/A CYS 115.A N ASN 111.A O no hydrogen 2.876 N/A CYS 115.A SG TYR 292.A O no hydrogen 3.228 N/A TYR 116.A N ASP 112.A O no hydrogen 3.085 N/A PHE 117.A N HIS 113.A O no hydrogen 2.844 N/A LEU 118.A N ILE 114.A O no hydrogen 2.966 N/A TYR 119.A N CYS 115.A O no hydrogen 3.077 N/A TYR 119.A OH GLU 302.A OE2 no hydrogen 2.618 N/A GLN 120.A N TYR 116.A O no hydrogen 3.163 N/A GLN 120.A NE2 TYR 116.A O no hydrogen 3.347 N/A GLN 120.A NE2 CYS 149.A O no hydrogen 2.935 N/A ILE 121.A N PHE 117.A O no hydrogen 2.987 N/A LEU 122.A N LEU 118.A O no hydrogen 2.956 N/A ARG 123.A N TYR 119.A O no hydrogen 2.708 N/A ARG 123.A NE ASP 301.A O no hydrogen 2.958 N/A ARG 123.A NH1 GLU 69.A OE2 no hydrogen 3.244 N/A ARG 123.A NH1 ASN 70.A OD1 no hydrogen 2.908 N/A ARG 123.A NH2 ASP 301.A O no hydrogen 2.760 N/A GLY 124.A N GLN 120.A O no hydrogen 2.986 N/A LEU 125.A N ILE 121.A O no hydrogen 2.820 N/A LYS 126.A N LEU 122.A O no hydrogen 2.756 N/A LYS 126.A NZ GLU 285.A OE1 no hydrogen 3.217 N/A LYS 126.A NZ GLU 302.A O no hydrogen 3.228 N/A TYR 127.A N ARG 123.A O no hydrogen 3.448 N/A ILE 128.A N GLY 124.A O no hydrogen 3.059 N/A HIS 129.A N LEU 125.A O no hydrogen 2.840 N/A HIS 129.A NE2 ASP 190.A OD2 no hydrogen 2.771 N/A SER 130.A N LYS 126.A O no hydrogen 2.925 N/A SER 130.A OG TYR 127.A O no hydrogen 2.607 N/A ALA 131.A N TYR 127.A O no hydrogen 3.075 N/A ALA 131.A N ILE 128.A O no hydrogen 3.057 N/A ASN 132.A N HIS 129.A O no hydrogen 2.874 N/A ASN 132.A ND2 ASP 163.A OD2 no hydrogen 2.609 N/A VAL 133.A N ILE 128.A O no hydrogen 3.217 N/A LEU 134.A N ARG 160.A O no hydrogen 2.699 N/A HIS 135.A N ASP 190.A OD2 no hydrogen 2.974 N/A HIS 135.A NE2 CYS 154.A O no hydrogen 3.117 N/A ARG 136.A N ASP 190.A OD1 no hydrogen 2.973 N/A ARG 136.A NH1 LEU 158.A O no hydrogen 2.768 N/A ARG 136.A NH2 TYR 185.A OH no hydrogen 2.918 N/A ASP 137.A N HIS 135.A ND1 no hydrogen 2.969 N/A LYS 139.A N ASN 142.A OD1 no hydrogen 3.116 N/A ASN 142.A N LYS 139.A O no hydrogen 3.002 N/A ASN 142.A ND2 ASP 137.A O no hydrogen 2.865 N/A ASN 142.A ND2 ASP 155.A OD2 no hydrogen 3.475 N/A LEU 143.A N PRO 140.A O no hydrogen 3.343 N/A LEU 144.A N LYS 152.A O no hydrogen 2.757 N/A LEU 145.A N THR 98.A O no hydrogen 2.836 N/A ASN 146.A N ASP 150.A O no hydrogen 3.089 N/A THR 148.A N ASN 146.A OD1 no hydrogen 3.161 N/A THR 148.A OG1 ASN 146.A OD1 no hydrogen 3.030 N/A THR 148.A OG1 ASP 150.A OD2 no hydrogen 3.003 N/A CYS 149.A N ASN 146.A O no hydrogen 3.047 N/A ASP 150.A N ASN 146.A OD1 no hydrogen 3.107 N/A LEU 151.A N GLN 120.A OE1 no hydrogen 2.864 N/A LYS 152.A N LEU 144.A O no hydrogen 2.810 N/A LYS 152.A NZ GLU 69.A O no hydrogen 2.571 N/A ILE 153.A N ASN 70.A O no hydrogen 2.888 N/A CYS 154.A N ASN 142.A O no hydrogen 3.032 N/A CYS 154.A SG ASN 142.A O no hydrogen 3.641 N/A PHE 156.A N GLU 59.A OE2 no hydrogen 2.763 N/A ALA 159.A N PHE 156.A O no hydrogen 3.152 N/A ARG 160.A N LEU 134.A O no hydrogen 2.994 N/A ALA 162.A N ASN 132.A O no hydrogen 2.809 N/A ASP 163.A N VAL 161.A O no hydrogen 2.919 N/A ARG 171.A NH2 THR 165.A OG1 no hydrogen 2.231 N/A TRP 172.A N THR 170.A OG1 no hydrogen 3.225 N/A TRP 172.A NE1 GLY 210.A O no hydrogen 3.106 N/A TYR 173.A OH GLU 200.A OE1 no hydrogen 2.491 N/A ARG 174.A N ARG 171.A O no hydrogen 3.190 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.610 N/A MET 179.A N ALA 175.A O no hydrogen 3.392 N/A LEU 180.A N PRO 176.A O no hydrogen 2.992 N/A ASN 181.A N ILE 178.A O no hydrogen 2.707 N/A SER 182.A N GLU 177.A O no hydrogen 2.910 N/A THR 186.A OG1 SER 188.A OG no hydrogen 3.156 N/A LYS 187.A NZ HIS 129.A O no hydrogen 3.216 N/A SER 188.A N THR 186.A OG1 no hydrogen 3.264 N/A SER 188.A OG THR 186.A OG1 no hydrogen 3.156 N/A ILE 189.A N THR 186.A O no hydrogen 3.053 N/A ASP 190.A N LYS 187.A O no hydrogen 3.014 N/A TRP 192.A N SER 188.A O no hydrogen 3.182 N/A SER 193.A N ILE 189.A O no hydrogen 3.206 N/A SER 193.A OG TYR 173.A O no hydrogen 2.709 N/A SER 193.A OG ILE 189.A O no hydrogen 3.284 N/A VAL 194.A N ASP 190.A O no hydrogen 2.975 N/A GLY 195.A N ILE 191.A O no hydrogen 2.869 N/A CYS 196.A N TRP 192.A O no hydrogen 2.916 N/A CYS 196.A SG TRP 172.A O no hydrogen 3.909 N/A CYS 196.A SG TRP 192.A O no hydrogen 3.548 N/A ILE 197.A N SER 193.A O no hydrogen 3.004 N/A LEU 198.A N VAL 194.A O no hydrogen 2.843 N/A ALA 199.A N GLY 195.A O no hydrogen 2.959 N/A GLU 200.A N CYS 196.A O no hydrogen 3.032 N/A MET 201.A N ILE 197.A O no hydrogen 2.903 N/A LEU 202.A N LEU 198.A O no hydrogen 3.111 N/A SER 203.A N ALA 199.A O no hydrogen 3.251 N/A SER 203.A N GLU 200.A O no hydrogen 3.348 N/A SER 203.A OG ALA 199.A O no hydrogen 3.110 N/A SER 203.A OG ARG 205.A O no hydrogen 3.198 N/A ASN 204.A N GLU 200.A O no hydrogen 2.646 N/A ASN 204.A ND2 LEU 104.A O no hydrogen 2.611 N/A ASN 204.A ND2 GLN 107.A O no hydrogen 2.749 N/A ARG 205.A N SER 203.A OG no hydrogen 3.358 N/A LYS 211.A N ASP 215.A OD2 no hydrogen 3.169 N/A ASP 215.A N HIS 212.A ND1 no hydrogen 3.172 N/A GLN 216.A N HIS 212.A O no hydrogen 2.802 N/A GLN 216.A NE2 ARG 171.A O no hydrogen 2.846 N/A LEU 217.A N TYR 213.A O no hydrogen 2.803 N/A ASN 218.A N LEU 214.A O no hydrogen 3.097 N/A HIS 219.A N ASP 215.A O no hydrogen 3.066 N/A HIS 219.A ND1 ASP 215.A O no hydrogen 2.643 N/A ILE 220.A N GLN 216.A O no hydrogen 2.915 N/A LEU 221.A N LEU 217.A O no hydrogen 2.819 N/A GLY 222.A N ASN 218.A O no hydrogen 2.879 N/A ILE 223.A N ILE 220.A O no hydrogen 3.136 N/A LEU 224.A N ILE 220.A O no hydrogen 2.875 N/A GLY 225.A N LEU 221.A O no hydrogen 2.909 N/A SER 226.A N LYS 250.A O no hydrogen 3.030 N/A SER 226.A OG LYS 250.A O no hydrogen 3.515 N/A SER 228.A N ASP 231.A OD1 no hydrogen 3.222 N/A ASP 231.A N SER 228.A OG no hydrogen 3.247 N/A LEU 232.A N GLN 229.A O no hydrogen 2.981 N/A ASN 233.A N GLU 230.A O no hydrogen 3.265 N/A LYS 239.A N ASN 237.A OD1 no hydrogen 3.010 N/A ALA 240.A N ASN 237.A OD1 no hydrogen 3.241 N/A ARG 241.A N ASN 237.A O no hydrogen 2.702 N/A ARG 241.A NE LEU 232.A O no hydrogen 2.705 N/A ARG 241.A NH1 GLN 229.A O no hydrogen 3.405 N/A ARG 241.A NH1 LEU 232.A O no hydrogen 3.450 N/A ASN 242.A N LEU 238.A O no hydrogen 2.707 N/A TYR 243.A N LYS 239.A O no hydrogen 2.820 N/A LEU 244.A N ALA 240.A O no hydrogen 3.010 N/A LEU 245.A N ARG 241.A O no hydrogen 3.075 N/A SER 246.A N TYR 243.A O no hydrogen 2.983 N/A SER 246.A OG ASN 242.A O no hydrogen 2.498 N/A LEU 247.A N LEU 244.A O no hydrogen 3.298 N/A LYS 250.A N SER 226.A OG no hydrogen 2.811 N/A LYS 252.A NZ ASP 271.A OD1 no hydrogen 3.329 N/A VAL 253.A N ILE 223.A O no hydrogen 2.853 N/A TRP 255.A NE1 ASP 271.A OD1 no hydrogen 2.786 N/A ARG 257.A N PRO 254.A O no hydrogen 3.030 N/A LEU 258.A N PRO 254.A O no hydrogen 3.353 N/A PHE 259.A N TRP 255.A O no hydrogen 2.719 N/A ALA 262.A N PHE 259.A O no hydrogen 3.339 N/A LYS 265.A N ASP 263.A OD2 no hydrogen 2.803 N/A LYS 265.A NZ GLU 294.A OE2 no hydrogen 3.200 N/A LEU 267.A N ASP 263.A O no hydrogen 3.133 N/A ASP 268.A N SER 264.A O no hydrogen 3.043 N/A LEU 269.A N LYS 265.A O no hydrogen 3.131 N/A LEU 270.A N ALA 266.A O no hydrogen 2.796 N/A ASP 271.A N LEU 267.A O no hydrogen 2.941 N/A LYS 272.A NZ ASP 268.A OD1 no hydrogen 3.530 N/A MET 273.A N LEU 269.A O no hydrogen 3.111 N/A MET 273.A N LEU 270.A O no hydrogen 3.093 N/A LEU 274.A N LEU 270.A O no hydrogen 2.970 N/A THR 275.A OG1 ASN 277.A O no hydrogen 2.938 N/A HIS 279.A N ASN 277.A OD1 no hydrogen 2.924 N/A LYS 280.A N ASN 277.A O no hydrogen 3.134 N/A ARG 281.A N PRO 278.A O no hydrogen 3.347 N/A ARG 281.A NE THR 275.A O no hydrogen 2.840 N/A ARG 281.A NH1 GLU 177.A OE2 no hydrogen 2.817 N/A ARG 281.A NH1 SER 188.A O no hydrogen 3.003 N/A ARG 281.A NH2 GLU 177.A OE1 no hydrogen 2.949 N/A ARG 281.A NH2 GLU 177.A OE2 no hydrogen 3.447 N/A ARG 281.A NH2 THR 275.A O no hydrogen 3.096 N/A ARG 281.A NH2 PHE 276.A O no hydrogen 2.827 N/A ILE 282.A N LYS 272.A O no hydrogen 2.973 N/A GLU 283.A N GLN 286.A OE1 no hydrogen 3.098 N/A ALA 287.A N GLU 283.A O no hydrogen 2.868 N/A LEU 288.A N VAL 284.A O no hydrogen 2.875 N/A ALA 289.A N GLU 285.A O no hydrogen 3.073 N/A ALA 289.A N GLN 286.A O no hydrogen 3.142 N/A HIS 290.A N ALA 287.A O no hydrogen 2.983 N/A HIS 290.A NE2 ASP 268.A OD2 no hydrogen 2.641 N/A TYR 292.A N HIS 290.A ND1 no hydrogen 3.029 N/A TYR 292.A OH ASN 111.A OD1 no hydrogen 2.827 N/A LEU 293.A N HIS 290.A O no hydrogen 2.962 N/A GLU 294.A N PRO 291.A O no hydrogen 3.365 N/A TYR 296.A N LEU 293.A O no hydrogen 2.946 N/A TYR 297.A N LEU 293.A O no hydrogen 2.897 N/A ASP 298.A N GLU 302.A OE2 no hydrogen 2.959 N/A SER 300.A N ASP 298.A OD1 no hydrogen 3.274 N/A ASP 301.A N ASP 298.A O no hydrogen 2.701 N/A ALA 305.A N SER 130.A OG no hydrogen 2.712 N/A PHE 309.A N ALA 131.A O no hydrogen 2.637 N/A GLU 312.A N GLU 312.A OE2 no hydrogen 2.459 N/A LEU 316.A N LEU 313.A O no hydrogen 3.121 N/A LYS 318.A NZ GLU 319.A OE2 no hydrogen 2.533 N/A GLU 319.A N GLU 319.A OE1 no hydrogen 2.788 N/A LYS 320.A N PRO 317.A O no hydrogen 2.918 N/A LYS 320.A NZ GLU 323.A OE1 no hydrogen 3.362 N/A LEU 321.A N PRO 317.A O no hydrogen 3.100 N/A LYS 322.A N LYS 318.A O no hydrogen 2.706 N/A LYS 322.A NZ ILE 83.A O no hydrogen 3.027 N/A LYS 322.A NZ MET 86.A O no hydrogen 2.847 N/A GLU 323.A N GLU 319.A O no hydrogen 3.229 N/A LEU 324.A N LYS 320.A O no hydrogen 3.031 N/A ILE 325.A N LEU 321.A O no hydrogen 2.748 N/A PHE 326.A N LYS 322.A O no hydrogen 2.826 N/A GLU 327.A N GLU 323.A O no hydrogen 2.934 N/A GLU 328.A N LEU 324.A O no hydrogen 2.939 N/A THR 329.A N ILE 325.A O no hydrogen 3.050 N/A THR 329.A OG1 ILE 325.A O no hydrogen 3.017 N/A THR 329.A OG1 PHE 326.A O no hydrogen 3.136 N/A ALA 330.A N GLU 327.A O no hydrogen 3.282 N/A PHE 332.A N THR 329.A O no hydrogen 3.239 N/A GLN 333.A N ALA 330.A O no hydrogen 3.078 N/A GLN 333.A NE2 ARG 79.A O no hydrogen 2.928 N/A