Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q6p_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N ARG 359.A O no hydrogen 3.143 N/A TYR 6.A N LEU 358.A O no hydrogen 2.751 N/A LYS 7.A N HIS 69.A O no hydrogen 2.822 N/A TRP 8.A N TYR 356.A O no hydrogen 2.937 N/A TRP 8.A NE1 PRO 71.A O no hydrogen 2.867 N/A LYS 9.A NZ ASP 352.A O no hydrogen 3.411 N/A TYR 13.A N TYR 21.A OH no hydrogen 2.978 N/A TYR 13.A OH TYR 52.A O no hydrogen 2.835 N/A ASN 14.A N LEU 73.A O no hydrogen 2.780 N/A ASN 14.A ND2 ASN 74.A OD1 no hydrogen 3.413 N/A SER 20.A N THR 17.A O no hydrogen 3.219 N/A SER 20.A OG THR 17.A O no hydrogen 2.616 N/A ASP 24.A N ASN 22.A OD1 no hydrogen 2.989 N/A ASN 25.A N ASN 22.A O no hydrogen 2.813 N/A SER 27.A OG ALA 42.A O no hydrogen 2.928 N/A THR 28.A N ALA 42.A O no hydrogen 3.036 N/A THR 28.A OG1 TYR 89.A O no hydrogen 2.766 N/A PHE 30.A N ASP 325.A OD1 no hydrogen 2.839 N/A ALA 31.A N PHE 40.A O no hydrogen 2.783 N/A TYR 32.A OH THR 59.A OG1 no hydrogen 3.104 N/A ASP 33.A N LYS 38.A O no hydrogen 2.895 N/A GLU 37.A N ALA 34.A O no hydrogen 3.347 N/A LYS 38.A N ASP 33.A O no hydrogen 3.224 N/A LYS 38.A NZ GLU 56.A OE2 no hydrogen 2.474 N/A LYS 38.A NZ TYR 134.A OH no hydrogen 3.231 N/A LEU 39.A N VAL 57.A O no hydrogen 2.781 N/A PHE 40.A N ALA 31.A O no hydrogen 2.799 N/A LEU 41.A N ALA 55.A O no hydrogen 2.932 N/A ALA 42.A N ALA 29.A O no hydrogen 2.995 N/A VAL 43.A N THR 53.A O no hydrogen 2.739 N/A ARG 45.A N SER 87.A OG no hydrogen 2.915 N/A ARG 45.A NE THR 86.A O no hydrogen 2.738 N/A ARG 45.A NH1 VAL 50.A O no hydrogen 2.527 N/A ARG 45.A NH2 GLY 82.A O no hydrogen 2.863 N/A ARG 45.A NH2 LEU 85.A O no hydrogen 2.716 N/A ARG 45.A NH2 THR 86.A O no hydrogen 3.314 N/A LYS 46.A NZ TYR 89.A OH no hydrogen 2.644 N/A LYS 46.A NZ GLU 108.A OE1 no hydrogen 3.012 N/A THR 53.A OG1 VAL 43.A O no hydrogen 2.766 N/A ALA 55.A N LEU 41.A O no hydrogen 2.998 N/A GLU 56.A N ASN 74.A O no hydrogen 2.865 N/A VAL 57.A N LEU 39.A O no hydrogen 2.893 N/A THR 59.A N GLU 37.A O no hydrogen 2.930 N/A THR 59.A OG1 TYR 32.A OH no hydrogen 3.104 N/A THR 59.A OG1 GLU 37.A O no hydrogen 3.026 N/A LYS 60.A N ASP 58.A OD1 no hydrogen 3.483 N/A LEU 63.A N THR 59.A O no hydrogen 3.134 N/A VAL 65.A N SER 62.A O no hydrogen 3.359 N/A SER 70.A OG LYS 7.A O no hydrogen 2.747 N/A LEU 73.A N LEU 12.A O no hydrogen 2.887 N/A ASN 74.A N GLU 56.A O no hydrogen 2.951 N/A ASN 74.A ND2 GLU 56.A O no hydrogen 3.233 N/A LYS 75.A NZ HIS 79.A O no hydrogen 2.780 N/A SER 77.A N GLU 56.A OE1 no hydrogen 2.981 N/A SER 77.A OG GLU 56.A OE1 no hydrogen 3.036 N/A SER 77.A OG GLU 56.A OE2 no hydrogen 3.178 N/A HIS 79.A N PHE 76.A O no hydrogen 2.780 N/A HIS 79.A NE2 TYR 127.A OH no hydrogen 2.780 N/A LYS 80.A N GLU 84.A OE2 no hydrogen 2.844 N/A THR 81.A N GLU 84.A OE2 no hydrogen 3.103 N/A THR 81.A OG1 GLU 84.A OE1 no hydrogen 3.084 N/A THR 81.A OG1 GLU 84.A OE2 no hydrogen 3.423 N/A GLY 82.A N GLU 84.A OE1 no hydrogen 2.740 N/A LYS 83.A N THR 81.A OG1 no hydrogen 3.179 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.591 N/A THR 86.A N ASP 103.A OD1 no hydrogen 3.368 N/A THR 86.A N ASP 103.A OD2 no hydrogen 3.117 N/A THR 86.A OG1 HIS 120.A NE2 no hydrogen 2.831 N/A SER 87.A N ASP 103.A OD1 no hydrogen 3.197 N/A ILE 88.A N THR 53.A OG1 no hydrogen 3.058 N/A TYR 89.A OH GLU 108.A OE2 no hydrogen 2.309 N/A GLN 90.A NE2 PRO 91.A O no hydrogen 2.974 N/A GLN 90.A NE2 ASP 325.A OD1 no hydrogen 2.967 N/A VAL 92.A N TRP 100.A O no hydrogen 2.966 N/A ASP 94.A N ARG 98.A O no hydrogen 3.152 N/A CYS 96.A N ASP 94.A OD1 no hydrogen 3.103 N/A CYS 96.A SG ASP 94.A OD1 no hydrogen 3.356 N/A CYS 96.A SG ASP 94.A OD2 no hydrogen 3.215 N/A ARG 97.A N ASP 94.A O no hydrogen 3.123 N/A ARG 97.A NE ASP 33.A OD1 no hydrogen 3.117 N/A ARG 97.A NH2 ASP 33.A OD2 no hydrogen 3.043 N/A ARG 98.A N ASP 94.A OD1 no hydrogen 2.622 N/A ARG 98.A NE ASP 94.A OD2 no hydrogen 2.678 N/A ARG 98.A NH1 CYS 167.A O no hydrogen 2.828 N/A ARG 98.A NH2 ASP 94.A OD2 no hydrogen 3.021 N/A ARG 98.A NH2 CYS 167.A O no hydrogen 3.153 N/A ARG 98.A NH2 THR 170.A OG1 no hydrogen 3.087 N/A LEU 99.A N TYR 127.A O no hydrogen 2.766 N/A TRP 100.A N VAL 92.A O no hydrogen 2.731 N/A TRP 100.A NE1 ASP 94.A OD2 no hydrogen 3.063 N/A VAL 101.A N VAL 125.A O no hydrogen 2.939 N/A ASP 103.A N ALA 123.A O no hydrogen 2.812 N/A ILE 104.A N SER 87.A O no hydrogen 2.805 N/A GLY 105.A N ASP 103.A OD1 no hydrogen 2.848 N/A GLU 108.A N ARG 45.A O no hydrogen 3.109 N/A ALA 114.A N SER 111.A O no hydrogen 3.131 N/A ASP 116.A N GLY 113.A O no hydrogen 2.920 N/A TYR 117.A N ALA 114.A O no hydrogen 3.103 N/A SER 119.A OG GLY 105.A O no hydrogen 3.500 N/A HIS 120.A N GLY 105.A O no hydrogen 2.791 N/A HIS 120.A ND1 ARG 121.A O no hydrogen 2.665 N/A ARG 121.A NE PHE 142.A O no hydrogen 2.809 N/A ALA 123.A N ASP 103.A O no hydrogen 2.936 N/A ILE 124.A N TYR 140.A O no hydrogen 2.866 N/A VAL 125.A N VAL 101.A O no hydrogen 3.070 N/A ALA 126.A N VAL 138.A O no hydrogen 3.021 N/A TYR 127.A N LEU 99.A O no hydrogen 2.864 N/A ASP 128.A N PRO 135.A O no hydrogen 3.027 N/A LEU 129.A N ARG 97.A O no hydrogen 3.142 N/A LYS 130.A N ASP 128.A OD1 no hydrogen 3.411 N/A LYS 130.A NZ CYS 96.A O no hydrogen 2.794 N/A LYS 130.A NZ ASP 128.A OD1 no hydrogen 2.527 N/A GLN 131.A NE2 ASP 128.A OD2 no hydrogen 2.832 N/A TYR 134.A N GLN 131.A O no hydrogen 3.258 N/A VAL 137.A N ALA 126.A O no hydrogen 2.848 N/A VAL 138.A N ALA 126.A O no hydrogen 3.305 N/A ARG 139.A NE GLU 136.A OE1 no hydrogen 2.609 N/A ARG 139.A NE GLU 136.A OE2 no hydrogen 3.052 N/A ARG 139.A NH1 TYR 141.A OH no hydrogen 3.062 N/A ARG 139.A NH2 GLU 84.A O no hydrogen 3.470 N/A ARG 139.A NH2 GLU 136.A OE1 no hydrogen 3.025 N/A TYR 140.A N ILE 124.A O no hydrogen 2.824 N/A TYR 140.A OH SER 192.A OG no hydrogen 2.651 N/A PHE 142.A N PRO 122.A O no hydrogen 2.870 N/A LEU 146.A N PRO 143.A O no hydrogen 2.941 N/A VAL 147.A N THR 144.A O no hydrogen 3.351 N/A TYR 152.A N LYS 149.A O no hydrogen 3.136 N/A PHE 153.A N PRO 150.A O no hydrogen 3.414 N/A GLY 154.A N THR 175.A O no hydrogen 2.963 N/A GLY 155.A N PHE 222.A O no hydrogen 2.736 N/A ALA 157.A N TYR 173.A O no hydrogen 2.895 N/A ASP 159.A N PHE 171.A O no hydrogen 2.660 N/A ALA 161.A N GLU 169.A O no hydrogen 2.926 N/A ASN 162.A ND2 ASP 166.A OD1 no hydrogen 2.810 N/A CYS 167.A SG ASN 162.A O no hydrogen 3.744 N/A CYS 167.A SG PRO 163.A O no hydrogen 3.565 N/A CYS 167.A SG GLY 165.A O no hydrogen 3.864 N/A SER 168.A N ASP 166.A OD1 no hydrogen 3.254 N/A SER 168.A OG ASP 166.A OD1 no hydrogen 2.975 N/A SER 168.A OG ASP 166.A OD2 no hydrogen 3.200 N/A GLU 169.A N ASN 162.A OD1 no hydrogen 3.167 N/A THR 170.A N SER 168.A O no hydrogen 2.851 N/A THR 170.A OG1 CYS 167.A O no hydrogen 2.647 N/A PHE 171.A N ASP 159.A O no hydrogen 2.784 N/A VAL 172.A N TYR 185.A O no hydrogen 3.099 N/A TYR 173.A N ALA 157.A O no hydrogen 2.900 N/A TYR 173.A OH ASP 159.A OD2 no hydrogen 2.725 N/A ILE 174.A N PHE 183.A O no hydrogen 2.940 N/A THR 175.A N GLY 155.A O no hydrogen 2.961 N/A THR 175.A OG1 GLY 155.A O no hydrogen 2.777 N/A ASN 176.A ND2 LYS 149.A O no hydrogen 3.082 N/A PHE 177.A N TYR 152.A O no hydrogen 2.975 N/A LEU 178.A N ASN 176.A OD1 no hydrogen 3.224 N/A ALA 181.A N ASN 176.A O no hydrogen 3.332 N/A LEU 182.A N VAL 195.A O no hydrogen 2.842 N/A PHE 183.A N ILE 174.A O no hydrogen 2.875 N/A ILE 184.A N TRP 193.A O no hydrogen 2.795 N/A TYR 185.A N VAL 172.A O no hydrogen 3.011 N/A TYR 185.A OH HIS 187.A ND1 no hydrogen 2.877 N/A ASP 186.A N ASP 191.A O no hydrogen 2.662 N/A HIS 187.A N THR 170.A O no hydrogen 3.053 N/A HIS 187.A ND1 TYR 185.A OH no hydrogen 2.877 N/A LYS 188.A NZ SER 168.A OG no hydrogen 3.081 N/A LYS 189.A N ASP 186.A OD1 no hydrogen 3.040 N/A GLN 190.A N HIS 187.A O no hydrogen 3.271 N/A GLN 190.A NE2 HIS 187.A O no hydrogen 3.324 N/A ASP 191.A N ASP 186.A O no hydrogen 3.119 N/A SER 192.A OG TYR 140.A OH no hydrogen 2.651 N/A TRP 193.A N ILE 184.A O no hydrogen 2.774 N/A VAL 195.A N LEU 182.A O no hydrogen 2.957 N/A THR 199.A N HIS 197.A ND1 no hydrogen 2.885 N/A PHE 200.A N HIS 197.A O no hydrogen 3.026 N/A GLU 203.A N SER 243.A O no hydrogen 2.899 N/A ARG 204.A NE ARG 204.A O no hydrogen 3.022 N/A ARG 204.A NH2 ARG 204.A O no hydrogen 3.558 N/A THR 206.A N PHE 217.A O no hydrogen 2.661 N/A THR 206.A OG1 SER 243.A OG no hydrogen 2.649 N/A THR 206.A OG1 ASP 275.A OD1 no hydrogen 2.611 N/A LYS 207.A NZ GLU 216.A OE2 no hydrogen 2.878 N/A PHE 208.A N TYR 215.A O no hydrogen 2.826 N/A ASP 209.A N ASN 294.A OD1 no hydrogen 2.705 N/A TYR 210.A N LYS 213.A O no hydrogen 3.086 N/A TYR 210.A OH LYS 350.A O no hydrogen 3.379 N/A LYS 213.A N TYR 210.A O no hydrogen 2.922 N/A TYR 215.A N PHE 208.A O no hydrogen 2.771 N/A PHE 217.A N THR 206.A O no hydrogen 3.180 N/A ALA 219.A N SER 243.A OG no hydrogen 2.843 N/A GLY 220.A N PHE 177.A O no hydrogen 2.704 N/A ILE 221.A N PHE 200.A O no hydrogen 2.821 N/A PHE 222.A N LEU 240.A O no hydrogen 3.098 N/A THR 225.A N TYR 238.A O no hydrogen 2.824 N/A GLY 227.A N PRO 236.A O no hydrogen 2.716 N/A ARG 229.A NH1 ASP 95.A OD2 no hydrogen 3.458 N/A ARG 229.A NH2 ASP 95.A OD2 no hydrogen 2.847 N/A ASP 230.A N ASN 234.A O no hydrogen 2.961 N/A GLU 232.A N ASP 230.A OD2 no hydrogen 2.901 N/A GLY 233.A N ASP 230.A O no hydrogen 3.471 N/A ASN 234.A N ASP 230.A OD2 no hydrogen 3.230 N/A ARG 235.A N THR 252.A OG1 no hydrogen 2.647 N/A ARG 235.A NE GLY 227.A O no hydrogen 2.865 N/A ARG 235.A NH1 ASP 159.A OD1 no hydrogen 2.960 N/A ARG 235.A NH2 GLY 227.A O no hydrogen 2.825 N/A ALA 237.A N VAL 250.A O no hydrogen 2.957 N/A TYR 238.A N THR 225.A O no hydrogen 2.788 N/A TYR 239.A N TYR 248.A O no hydrogen 2.981 N/A LEU 240.A N GLY 223.A O no hydrogen 3.280 N/A GLY 242.A N GLY 220.A O no hydrogen 3.124 N/A SER 243.A N ALA 219.A O no hydrogen 3.017 N/A SER 243.A OG THR 206.A OG1 no hydrogen 2.649 N/A SER 243.A OG PHE 217.A O no hydrogen 3.000 N/A ILE 245.A N GLU 203.A OE1 no hydrogen 3.129 N/A LYS 246.A N GLU 203.A OE2 no hydrogen 3.362 N/A VAL 247.A N GLY 268.A O no hydrogen 3.082 N/A TYR 248.A N TYR 239.A O no hydrogen 3.128 N/A SER 249.A N GLU 265.A O no hydrogen 3.181 N/A VAL 250.A N ALA 237.A O no hydrogen 3.335 N/A THR 252.A N ARG 235.A O no hydrogen 2.965 N/A THR 252.A OG1 ARG 235.A O no hydrogen 2.895 N/A LYS 253.A N ASN 251.A OD1 no hydrogen 2.686 N/A LEU 255.A N ASN 251.A O no hydrogen 3.240 N/A LYS 256.A N THR 252.A O no hydrogen 2.782 N/A LYS 256.A NZ ASP 159.A OD2 no hydrogen 3.474 N/A GLN 257.A NE2 LYS 258.A O no hydrogen 3.370 N/A GLY 260.A N GLN 257.A O no hydrogen 3.128 N/A ASN 263.A N GLU 254.A OE1 no hydrogen 2.570 N/A ASN 263.A ND2 GLU 254.A OE2 no hydrogen 3.506 N/A GLU 265.A N SER 249.A O no hydrogen 2.941 N/A GLY 268.A N LEU 307.A O no hydrogen 3.199 N/A ASN 269.A N LEU 307.A O no hydrogen 3.267 N/A ARG 270.A N ILE 245.A O no hydrogen 2.870 N/A ARG 270.A NH2 ASN 274.A O no hydrogen 2.331 N/A ASN 274.A ND2 ARG 270.A O no hydrogen 2.802 N/A ALA 280.A N PHE 289.A O no hydrogen 2.963 N/A TYR 281.A N THR 225.A OG1 no hydrogen 3.118 N/A TYR 281.A OH ASP 228.A OD1 no hydrogen 2.931 N/A ASP 282.A N VAL 287.A O no hydrogen 2.881 N/A LYS 284.A N ASP 282.A OD1 no hydrogen 3.105 N/A LYS 284.A NZ GLN 363.A OE1 no hydrogen 3.309 N/A THR 285.A N ASP 282.A OD2 no hydrogen 3.129 N/A THR 285.A OG1 ASP 282.A OD2 no hydrogen 2.681 N/A LYS 286.A NZ ASP 228.A OD2 no hydrogen 3.120 N/A LYS 286.A NZ PRO 283.A O no hydrogen 2.730 N/A ILE 288.A N TRP 301.A O no hydrogen 2.774 N/A PHE 289.A N ALA 280.A O no hydrogen 2.826 N/A PHE 290.A N SER 299.A O no hydrogen 2.700 N/A ALA 291.A N ALA 278.A O no hydrogen 3.165 N/A GLU 292.A N GLN 297.A O no hydrogen 3.276 N/A ALA 293.A N ASP 275.A O no hydrogen 2.958 N/A ASN 294.A ND2 ASP 209.A OD2 no hydrogen 2.803 N/A THR 295.A OG1 GLU 292.A OE1 no hydrogen 2.564 N/A LYS 296.A NZ ASN 294.A O no hydrogen 3.426 N/A GLN 297.A NE2 THR 316.A OG1 no hydrogen 3.062 N/A VAL 298.A N TYR 315.A O no hydrogen 3.058 N/A SER 299.A N PHE 290.A O no hydrogen 2.871 N/A SER 299.A OG GLU 292.A OE2 no hydrogen 2.652 N/A CYS 300.A N ASP 312.A O no hydrogen 2.945 N/A CYS 300.A SG ASP 312.A O no hydrogen 3.684 N/A TRP 301.A N ILE 288.A O no hydrogen 2.971 N/A TRP 301.A NE1 LYS 305.A O no hydrogen 2.831 N/A ASN 302.A ND2 CYS 371.A O no hydrogen 2.702 N/A ASN 302.A ND2 ASP 372.A O no hydrogen 3.261 N/A THR 303.A N LYS 286.A O no hydrogen 3.005 N/A THR 303.A OG1 LYS 286.A O no hydrogen 2.479 N/A GLN 304.A N ASN 302.A OD1 no hydrogen 3.281 N/A LYS 305.A N ASN 302.A O no hydrogen 3.082 N/A LYS 305.A NZ ALA 370.A O no hydrogen 3.055 N/A LEU 307.A N LEU 267.A O no hydrogen 2.671 N/A ASN 310.A N ARG 308.A O no hydrogen 2.777 N/A ASP 312.A N CYS 300.A O no hydrogen 3.135 N/A VAL 313.A N ASP 312.A OD2 no hydrogen 2.785 N/A VAL 314.A N VAL 298.A O no hydrogen 2.839 N/A TYR 315.A N VAL 298.A O no hydrogen 3.354 N/A SER 317.A N LYS 296.A O no hydrogen 3.208 N/A ARG 319.A N SER 317.A OG no hydrogen 3.291 N/A PHE 320.A N SER 317.A O no hydrogen 2.989 N/A GLY 323.A N GLU 292.A O no hydrogen 3.116 N/A THR 324.A OG1 THR 28.A O no hydrogen 2.884 N/A SER 327.A N TRP 335.A O no hydrogen 2.975 N/A ASP 329.A N GLY 333.A O no hydrogen 2.865 N/A GLY 332.A N ASP 329.A O no hydrogen 3.358 N/A GLY 333.A N ASP 329.A OD1 no hydrogen 2.678 N/A LEU 334.A N ILE 360.A O no hydrogen 2.912 N/A TRP 335.A N SER 327.A O no hydrogen 2.898 N/A TRP 335.A NE1 ASP 329.A OD2 no hydrogen 2.981 N/A SER 337.A N ARG 357.A O no hydrogen 2.801 N/A ASN 338.A N PHE 322.A O no hydrogen 3.150 N/A ASN 338.A ND2 SER 27.A O no hydrogen 2.807 N/A GLY 339.A N VAL 321.A O no hydrogen 2.867 N/A PHE 340.A N ASN 338.A OD1 no hydrogen 2.802 N/A ILE 343.A N PRO 341.A O no hydrogen 2.835 N/A SER 346.A N ILE 343.A O no hydrogen 3.162 N/A SER 346.A OG PRO 341.A O no hydrogen 2.746 N/A SER 346.A OG ILE 343.A O no hydrogen 3.393 N/A LYS 348.A N LYS 345.A O no hydrogen 2.981 N/A PHE 349.A N SER 346.A O no hydrogen 3.134 N/A LYS 350.A N TYR 210.A OH no hydrogen 2.967 N/A TYR 351.A OH GLY 339.A O no hydrogen 2.794 N/A ARG 355.A NE ASN 338.A O no hydrogen 2.814 N/A ARG 355.A NH1 GLU 347.A O no hydrogen 3.186 N/A ARG 355.A NH2 GLY 339.A O no hydrogen 3.061 N/A ARG 355.A NH2 SER 346.A O no hydrogen 2.917 N/A TYR 356.A N TRP 8.A O no hydrogen 3.110 N/A ARG 357.A N SER 337.A O no hydrogen 2.949 N/A ARG 357.A NH1 PRO 354.A O no hydrogen 3.509 N/A LEU 358.A N TYR 6.A O no hydrogen 3.075 N/A ARG 359.A NH2 GLN 4.A OE1 no hydrogen 2.972 N/A ILE 360.A N LEU 334.A O no hydrogen 2.807 N/A THR 362.A OG1 ASP 282.A OD2 no hydrogen 2.658 N/A ALA 365.A N ASP 361.A O no hydrogen 3.243 N/A ILE 366.A N THR 362.A O no hydrogen 3.091 N/A THR 369.A N ILE 366.A O no hydrogen 3.006 N/A THR 369.A OG1 ILE 366.A O no hydrogen 2.510 N/A ALA 370.A N ASP 312.A OD1 no hydrogen 3.061 N/A CYS 371.A N THR 369.A OG1 no hydrogen 3.266 N/A ASP 372.A N THR 369.A O no hydrogen 2.936 N/A