Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7wuq_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N LEU 1.A O no hydrogen 2.849 N/A GLN 7.A N GLU 4.A O no hydrogen 2.975 N/A LEU 8.A N GLU 4.A O no hydrogen 3.453 N/A LYS 9.A N ALA 5.A O no hydrogen 3.110 N/A LYS 9.A NZ GLU 6.A OE1 no hydrogen 3.170 N/A ASN 10.A N GLU 6.A O no hydrogen 2.807 N/A GLN 11.A N GLN 7.A O no hydrogen 2.822 N/A ILE 12.A N LEU 8.A O no hydrogen 2.932 N/A ARG 13.A N LYS 9.A O no hydrogen 3.187 N/A ARG 13.A NE LYS 9.A O no hydrogen 3.246 N/A ARG 13.A NE ASN 10.A OD1 no hydrogen 3.264 N/A ASP 14.A N ASN 10.A O no hydrogen 3.350 N/A ALA 15.A N GLN 11.A O no hydrogen 3.120 N/A ARG 16.A N ILE 12.A O no hydrogen 2.924 N/A ARG 16.A NE ASP 252.A O no hydrogen 2.919 N/A LYS 17.A N ARG 13.A O no hydrogen 3.086 N/A ALA 18.A N ASP 14.A O no hydrogen 2.579 N/A CYS 19.A N ALA 15.A O no hydrogen 3.322 N/A ALA 20.A N LYS 17.A O no hydrogen 3.344 N/A ILE 27.A N THR 23.A O no hydrogen 3.357 N/A THR 28.A N LEU 24.A O no hydrogen 3.238 N/A THR 28.A OG1 LEU 24.A O no hydrogen 3.045 N/A VAL 34.A N ASP 292.A OD2 no hydrogen 3.277 N/A ILE 37.A N ALA 299.A O no hydrogen 2.997 N/A ARG 40.A N ASN 334.A OXT no hydrogen 3.411 N/A ARG 42.A N ILE 332.A O no hydrogen 2.711 N/A ARG 42.A NH2 ASN 334.A OXT no hydrogen 3.458 N/A ARG 43.A NH1 SER 78.A O no hydrogen 3.421 N/A ARG 43.A NH1 TYR 79.A O no hydrogen 2.408 N/A LEU 45.A N LEU 330.A O no hydrogen 2.651 N/A HIS 48.A NE2 SER 66.A OG no hydrogen 2.366 N/A LEU 49.A N ASP 70.A OD2 no hydrogen 3.099 N/A ILE 52.A N SER 325.A O no hydrogen 3.094 N/A ALA 54.A N ALA 67.A O no hydrogen 3.245 N/A HIS 56.A N VAL 65.A O no hydrogen 2.760 N/A TRP 57.A NE1 GLY 313.A O no hydrogen 2.915 N/A THR 59.A OG1 PRO 101.A O no hydrogen 2.510 N/A SER 61.A N GLY 58.A O no hydrogen 3.212 N/A SER 61.A OG GLY 58.A O no hydrogen 3.518 N/A SER 61.A OG THR 59.A O no hydrogen 3.401 N/A SER 61.A OG ASP 317.A OD1 no hydrogen 2.846 N/A ARG 62.A N ASP 60.A OD1 no hydrogen 2.902 N/A LEU 63.A N ASP 60.A OD1 no hydrogen 3.004 N/A LEU 64.A N TRP 76.A O no hydrogen 2.813 N/A VAL 65.A N HIS 56.A O no hydrogen 2.708 N/A SER 66.A N ILE 74.A O no hydrogen 3.181 N/A SER 66.A OG HIS 48.A NE2 no hydrogen 2.366 N/A ALA 67.A N ALA 54.A O no hydrogen 2.606 N/A SER 68.A N LYS 72.A O no hydrogen 3.450 N/A SER 68.A OG ALA 50.A O no hydrogen 2.801 N/A SER 68.A OG LYS 51.A O no hydrogen 2.652 N/A GLN 69.A N LYS 51.A O no hydrogen 3.080 N/A GLY 71.A N SER 68.A O no hydrogen 3.187 N/A LYS 72.A N ASP 70.A OD1 no hydrogen 2.649 N/A ILE 74.A N SER 66.A O no hydrogen 3.345 N/A ILE 75.A N VAL 84.A O no hydrogen 3.071 N/A ILE 75.A N HIS 85.A O no hydrogen 3.474 N/A TRP 76.A N LEU 64.A O no hydrogen 2.506 N/A TRP 76.A NE1 HIS 48.A NE2 no hydrogen 3.342 N/A TRP 76.A NE1 SER 66.A OG no hydrogen 2.642 N/A ASP 77.A N ASN 82.A O no hydrogen 2.669 N/A SER 78.A N ARG 62.A O no hydrogen 2.887 N/A SER 78.A OG ARG 62.A O no hydrogen 2.964 N/A THR 80.A OG1 ASP 77.A OD2 no hydrogen 2.326 N/A THR 80.A OG1 ASN 82.A OD1 no hydrogen 2.389 N/A ASN 82.A N ASP 77.A O no hydrogen 3.118 N/A LYS 83.A NZ ARG 46.A O no hydrogen 2.497 N/A VAL 84.A N ILE 75.A O no hydrogen 3.275 N/A ILE 87.A N LEU 73.A O no hydrogen 2.722 N/A LEU 89.A N GLY 71.A O no hydrogen 2.973 N/A SER 91.A OG TRP 93.A O no hydrogen 3.263 N/A SER 92.A OG GLN 69.A O no hydrogen 3.544 N/A MET 95.A N GLY 109.A O no hydrogen 2.691 N/A THR 96.A N GLY 109.A O no hydrogen 3.082 N/A CYS 97.A SG CYS 97.A O no hydrogen 2.788 N/A ALA 100.A N TYR 105.A O no hydrogen 3.048 N/A SER 102.A OG ASP 148.A OD1 no hydrogen 3.018 N/A ASN 104.A N SER 102.A OG no hydrogen 3.164 N/A ASN 104.A ND2 ASP 148.A OD1 no hydrogen 3.130 N/A VAL 106.A N TYR 118.A O no hydrogen 2.544 N/A ALA 107.A N ALA 98.A O no hydrogen 3.266 N/A CYS 108.A N SER 116.A O no hydrogen 3.005 N/A CYS 108.A SG SER 116.A O no hydrogen 3.286 N/A CYS 108.A SG SER 116.A OG no hydrogen 2.615 N/A GLY 110.A N ASP 112.A OD1 no hydrogen 3.215 N/A LEU 111.A N TRP 93.A O no hydrogen 3.298 N/A ASN 113.A N GLY 110.A O no hydrogen 3.445 N/A ILE 114.A N ASP 112.A OD1 no hydrogen 3.293 N/A CYS 115.A N LEU 133.A O no hydrogen 3.478 N/A CYS 115.A SG CYS 108.A O no hydrogen 3.282 N/A SER 116.A OG TYR 118.A OH no hydrogen 3.321 N/A ILE 117.A N ARG 131.A O no hydrogen 3.193 N/A TYR 118.A N VAL 106.A O no hydrogen 2.538 N/A TYR 118.A OH SER 116.A OG no hydrogen 3.321 N/A LEU 120.A N ASN 104.A O no hydrogen 2.666 N/A LYS 121.A NZ GLY 103.A O no hydrogen 2.799 N/A THR 122.A OG1 ASN 126.A O no hydrogen 2.865 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 3.091 N/A SER 130.A N ILE 117.A O no hydrogen 2.804 N/A SER 130.A OG ILE 117.A O no hydrogen 3.182 N/A ARG 131.A NH2 THR 167.A O no hydrogen 3.429 N/A LEU 133.A N CYS 115.A O no hydrogen 2.914 N/A ALA 134.A N GLU 132.A O no hydrogen 3.018 N/A HIS 136.A ND1 ASP 157.A OD2 no hydrogen 3.117 N/A HIS 136.A NE2 THR 153.A OG1 no hydrogen 3.134 N/A TYR 139.A OH ASP 180.A OD2 no hydrogen 2.787 N/A LEU 140.A N GLY 110.A O no hydrogen 2.862 N/A SER 141.A N SER 154.A O no hydrogen 3.329 N/A SER 141.A OG VAL 181.A O no hydrogen 2.419 N/A SER 141.A OG MET 182.A O no hydrogen 2.644 N/A CYS 142.A SG LEU 184.A O no hydrogen 3.799 N/A CYS 143.A SG CYS 108.A O no hydrogen 3.987 N/A ARG 144.A N VAL 152.A O no hydrogen 2.995 N/A LEU 146.A N GLN 150.A O no hydrogen 2.710 N/A ASP 147.A N GLN 150.A O no hydrogen 3.325 N/A GLN 150.A N ASP 147.A OD1 no hydrogen 2.867 N/A ILE 151.A N TRP 163.A O no hydrogen 3.458 N/A THR 153.A N ALA 161.A O no hydrogen 2.717 N/A THR 153.A OG1 HIS 136.A NE2 no hydrogen 3.134 N/A THR 153.A OG1 ALA 161.A O no hydrogen 3.338 N/A SER 154.A OG SER 141.A OG no hydrogen 3.090 N/A SER 154.A OG VAL 181.A O no hydrogen 3.181 N/A SER 155.A OG GLY 138.A O no hydrogen 3.087 N/A SER 155.A OG TYR 139.A O no hydrogen 3.201 N/A SER 155.A OG ASP 157.A OD1 no hydrogen 3.127 N/A GLY 156.A N TYR 139.A O no hydrogen 2.412 N/A THR 158.A OG1 ASP 157.A O no hydrogen 2.496 N/A THR 159.A N ASP 157.A OD1 no hydrogen 3.313 N/A THR 159.A OG1 ASP 157.A OD1 no hydrogen 2.877 N/A THR 159.A OG1 ASP 157.A OD2 no hydrogen 2.873 N/A CYS 160.A SG SER 195.A OG no hydrogen 3.192 N/A ALA 161.A N THR 153.A O no hydrogen 2.934 N/A LEU 162.A N THR 172.A O no hydrogen 2.803 N/A TRP 163.A N ILE 151.A O no hydrogen 3.408 N/A TRP 163.A NE1 THR 153.A OG1 no hydrogen 2.580 N/A ASP 164.A N GLN 169.A O no hydrogen 3.132 N/A ILE 165.A N ASN 149.A O no hydrogen 3.178 N/A GLU 166.A N ASP 164.A OD1 no hydrogen 3.222 N/A GLY 168.A N ASP 164.A O no hydrogen 2.738 N/A THR 171.A N LEU 162.A O no hydrogen 2.472 N/A THR 172.A N LEU 162.A O no hydrogen 3.208 N/A THR 173.A OG1 GLN 170.A OE1 no hydrogen 2.395 N/A PHE 174.A N CYS 160.A O no hydrogen 2.653 N/A HIS 177.A NE2 SER 195.A O no hydrogen 3.067 N/A THR 178.A N ASP 199.A OD2 no hydrogen 3.217 N/A VAL 181.A N SER 155.A O no hydrogen 3.061 N/A MET 182.A N GLY 196.A O no hydrogen 2.914 N/A SER 183.A N GLY 196.A O no hydrogen 3.172 N/A ALA 187.A N LEU 192.A O no hydrogen 3.431 N/A THR 190.A N ALA 187.A O no hydrogen 2.978 N/A THR 190.A OG1 THR 190.A O no hydrogen 2.610 N/A PHE 193.A N TRP 205.A O no hydrogen 3.304 N/A SER 195.A OG HIS 177.A NE2 no hydrogen 3.370 N/A GLY 196.A N SER 183.A O no hydrogen 3.114 N/A CYS 198.A N ASP 180.A O no hydrogen 3.092 N/A CYS 198.A SG ASP 180.A O no hydrogen 3.435 N/A CYS 198.A SG ASP 180.A OD1 no hydrogen 3.188 N/A SER 201.A OG ASP 199.A OD2 no hydrogen 3.545 N/A ALA 202.A N PHE 216.A O no hydrogen 2.747 N/A LYS 203.A NZ GLY 176.A O no hydrogen 3.067 N/A LYS 203.A NZ HIS 177.A ND1 no hydrogen 2.953 N/A LYS 203.A NZ SER 201.A OG no hydrogen 3.362 N/A LEU 204.A N GLN 214.A O no hydrogen 2.544 N/A TRP 205.A N PHE 193.A O no hydrogen 2.623 N/A TRP 205.A NE1 SER 195.A OG no hydrogen 2.681 N/A GLU 209.A N ASP 206.A OD2 no hydrogen 3.047 N/A GLY 210.A N ASP 206.A O no hydrogen 2.988 N/A CYS 212.A SG LEU 204.A O no hydrogen 3.264 N/A CYS 212.A SG GLN 214.A O no hydrogen 3.573 N/A CYS 212.A SG THR 215.A OG1 no hydrogen 3.413 N/A ARG 213.A N LEU 204.A O no hydrogen 3.298 N/A GLN 214.A NE2 ALA 251.A O no hydrogen 2.578 N/A GLN 214.A NE2 ASP 252.A OD1 no hydrogen 2.548 N/A HIS 219.A N ALA 200.A O no hydrogen 3.327 N/A GLU 220.A N ASP 241.A OD2 no hydrogen 3.146 N/A SER 221.A OG ASP 222.A OD2 no hydrogen 3.510 N/A ILE 223.A N ALA 197.A O no hydrogen 2.882 N/A ASN 224.A ND2 ILE 267.A O no hydrogen 3.009 N/A ALA 225.A N GLY 238.A O no hydrogen 3.056 N/A CYS 227.A N ALA 236.A O no hydrogen 3.026 N/A CYS 227.A SG PHE 228.A O no hydrogen 3.610 N/A PHE 228.A N SER 185.A OG no hydrogen 3.305 N/A PHE 229.A N ALA 234.A O no hydrogen 2.735 N/A GLY 232.A N PHE 229.A O no hydrogen 2.838 N/A ASN 233.A N ASN 231.A OD1 no hydrogen 2.613 N/A PHE 235.A N PHE 247.A O no hydrogen 2.735 N/A ALA 236.A N CYS 227.A O no hydrogen 2.850 N/A THR 237.A N ARG 245.A O no hydrogen 2.966 N/A GLY 238.A N ALA 225.A O no hydrogen 2.845 N/A SER 239.A OG ASP 241.A OD1 no hydrogen 2.364 N/A THR 243.A N ASP 241.A OD1 no hydrogen 3.220 N/A THR 243.A OG1 ASP 241.A OD1 no hydrogen 2.963 N/A THR 243.A OG1 ASP 241.A OD2 no hydrogen 2.810 N/A CYS 244.A N TYR 258.A O no hydrogen 3.486 N/A CYS 244.A SG TYR 258.A O no hydrogen 3.928 N/A ARG 245.A N HIS 219.A NE2 no hydrogen 3.137 N/A ARG 245.A N THR 237.A O no hydrogen 3.155 N/A ARG 245.A NH1 GLU 254.A OE2 no hydrogen 2.786 N/A PHE 247.A N PHE 235.A O no hydrogen 2.632 N/A LEU 249.A N ASN 233.A O no hydrogen 2.717 N/A ARG 250.A N ASP 248.A OD1 no hydrogen 3.191 N/A LEU 255.A N LEU 246.A O no hydrogen 2.915 N/A THR 257.A OG1 GLU 254.A OE2 no hydrogen 2.347 N/A TYR 258.A N CYS 244.A O no hydrogen 2.951 N/A TYR 258.A OH ALA 293.A O no hydrogen 2.345 N/A ASN 262.A N HIS 260.A ND1 no hydrogen 3.038 N/A ILE 263.A N HIS 260.A O no hydrogen 3.177 N/A CYS 265.A SG GLY 266.A O no hydrogen 3.758 N/A ILE 267.A N SER 239.A O no hydrogen 2.948 N/A THR 268.A N GLY 282.A O no hydrogen 2.862 N/A THR 268.A OG1 VAL 309.A O no hydrogen 2.500 N/A SER 269.A OG THR 268.A O no hydrogen 2.874 N/A SER 269.A OG SER 310.A O no hydrogen 2.892 N/A SER 271.A N LEU 280.A O no hydrogen 2.680 N/A LYS 274.A NZ ASP 317.A O no hydrogen 3.105 N/A LEU 278.A N GLY 276.A O no hydrogen 2.733 N/A LEU 279.A N TRP 291.A O no hydrogen 3.112 N/A LEU 280.A N SER 271.A O no hydrogen 2.910 N/A GLY 282.A N SER 269.A O no hydrogen 2.484 N/A TYR 283.A N ASN 287.A O no hydrogen 3.160 N/A VAL 290.A N GLY 300.A O no hydrogen 3.000 N/A TRP 291.A N LEU 279.A O no hydrogen 2.891 N/A TRP 291.A NE1 TYR 283.A OH no hydrogen 3.027 N/A ASP 292.A N ASP 297.A O no hydrogen 2.779 N/A LYS 295.A NZ THR 28.A O no hydrogen 3.565 N/A LYS 295.A NZ ASN 29.A O no hydrogen 3.527 N/A GLY 300.A N VAL 290.A O no hydrogen 3.118 N/A LEU 302.A N CYS 288.A O no hydrogen 3.180 N/A HIS 305.A ND1 ASP 327.A OD2 no hydrogen 3.355 N/A HIS 305.A NE2 THR 323.A O no hydrogen 2.606 N/A HIS 305.A NE2 THR 323.A OG1 no hydrogen 2.870 N/A ASP 306.A N ASP 327.A OD2 no hydrogen 3.368 N/A ARG 308.A N ASN 307.A OD1 no hydrogen 2.707 N/A ARG 308.A NH1 ASP 284.A OD1 no hydrogen 3.447 N/A ARG 308.A NH1 ASP 284.A OD2 no hydrogen 3.549 N/A SER 310.A N GLY 324.A O no hydrogen 3.220 N/A SER 310.A OG ILE 52.A O no hydrogen 2.275 N/A CYS 311.A N GLY 324.A O no hydrogen 3.119 N/A CYS 311.A SG ILE 52.A O no hydrogen 3.739 N/A CYS 311.A SG CYS 311.A O no hydrogen 2.785 N/A CYS 311.A SG GLY 324.A O no hydrogen 3.526 N/A GLY 313.A N ALA 322.A O no hydrogen 3.252 N/A VAL 314.A N SER 271.A OG no hydrogen 3.043 N/A THR 315.A N ALA 320.A O no hydrogen 3.053 N/A THR 315.A OG1 ASP 317.A OD1 no hydrogen 3.557 N/A THR 315.A OG1 ALA 320.A O no hydrogen 3.273 N/A GLY 318.A N THR 315.A O no hydrogen 3.050 N/A ALA 320.A N THR 315.A OG1 no hydrogen 2.914 N/A VAL 321.A N TRP 333.A O no hydrogen 2.883 N/A ALA 322.A N GLY 313.A O no hydrogen 3.128 N/A THR 323.A N LYS 331.A O no hydrogen 3.075 N/A THR 323.A OG1 HIS 305.A NE2 no hydrogen 2.870 N/A THR 323.A OG1 THR 323.A O no hydrogen 2.397 N/A GLY 324.A N CYS 311.A O no hydrogen 2.862 N/A SER 325.A OG ASN 307.A O no hydrogen 2.863 N/A SER 325.A OG ARG 308.A O no hydrogen 2.719 N/A SER 325.A OG ASP 327.A OD1 no hydrogen 3.119 N/A TRP 326.A N ARG 308.A O no hydrogen 2.632 N/A SER 328.A OG HIS 48.A O no hydrogen 3.464 N/A SER 328.A OG ASP 327.A O no hydrogen 2.672 N/A LEU 330.A N LEU 45.A O no hydrogen 3.282 N/A LYS 331.A N THR 323.A O no hydrogen 3.426 N/A ILE 332.A N ARG 43.A O no hydrogen 2.646 N/A TRP 333.A N VAL 321.A O no hydrogen 2.493 N/A ASN 334.A ND2 MET 319.A O no hydrogen 2.360 N/A