Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c5x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLU 151.A O no hydrogen 2.918 N/A GLN 3.A NE2 SER 149.A OG no hydrogen 2.629 N/A MET 5.A N PHE 2.A O no hydrogen 3.062 N/A ARG 6.A NE GLU 48.A OE1 no hydrogen 3.411 N/A ARG 6.A NE GLU 48.A OE2 no hydrogen 2.594 N/A ARG 6.A NH2 GLU 48.A OE1 no hydrogen 2.856 N/A CYS 7.A SG THR 36.A OG1 no hydrogen 3.533 N/A ILE 8.A N GLY 4.A O no hydrogen 3.274 N/A GLY 9.A N MET 5.A O no hydrogen 2.859 N/A MET 10.A N CYS 7.A O no hydrogen 3.086 N/A ARG 13.A NE THR 36.A OG1 no hydrogen 2.826 N/A ARG 13.A NH1 GLU 364.A OE1 no hydrogen 3.553 N/A ARG 13.A NH1 GLU 364.A OE2 no hydrogen 2.762 N/A ARG 13.A NH2 THR 36.A OG1 no hydrogen 3.178 N/A ARG 13.A NH2 GLU 364.A OE1 no hydrogen 2.840 N/A ASP 14.A N CYS 34.A O no hydrogen 2.997 N/A VAL 16.A N THR 36.A O no hydrogen 2.820 N/A SER 23.A OG TRP 24.A O no hydrogen 3.235 N/A VAL 25.A N LEU 283.A O no hydrogen 2.856 N/A ILE 27.A N CYS 281.A O no hydrogen 2.828 N/A LEU 29.A N LEU 279.A O no hydrogen 2.852 N/A HIS 31.A NE2 THR 52.A OG1 no hydrogen 2.884 N/A SER 33.A N GLU 30.A O no hydrogen 3.353 N/A SER 33.A OG GLU 30.A O no hydrogen 3.164 N/A CYS 34.A N ASN 12.A O no hydrogen 2.911 N/A CYS 34.A SG CYS 7.A O no hydrogen 3.474 N/A CYS 34.A SG ASN 12.A O no hydrogen 4.037 N/A VAL 35.A N PHE 47.A O no hydrogen 2.996 N/A THR 36.A N ASP 14.A O no hydrogen 2.738 N/A THR 36.A OG1 ASP 46.A OD2 no hydrogen 2.917 N/A THR 37.A N LEU 45.A O no hydrogen 2.834 N/A MET 38.A N VAL 16.A O no hydrogen 3.101 N/A LYS 42.A N ALA 39.A O no hydrogen 3.112 N/A LYS 42.A NZ MET 285.A O no hydrogen 2.514 N/A LYS 42.A NZ LEU 288.A O no hydrogen 2.547 N/A THR 44.A OG1 ILE 348.A O no hydrogen 2.762 N/A LEU 45.A N THR 37.A O no hydrogen 3.055 N/A ASP 46.A N THR 146.A O no hydrogen 2.883 N/A PHE 47.A N VAL 35.A O no hydrogen 2.791 N/A GLU 48.A N VAL 144.A O no hydrogen 3.044 N/A ILE 50.A N THR 142.A O no hydrogen 2.854 N/A LYS 51.A N THR 142.A O no hydrogen 3.494 N/A LYS 51.A NZ GLU 53.A OE2 no hydrogen 2.949 N/A THR 52.A OG1 HIS 31.A NE2 no hydrogen 2.884 N/A GLU 53.A N GLU 140.A O no hydrogen 3.014 N/A ALA 54.A N LEU 273.A O no hydrogen 2.967 N/A LYS 55.A NZ GLU 140.A OE1 no hydrogen 2.970 N/A THR 59.A OG1 GLU 130.A OE2 no hydrogen 3.116 N/A LEU 60.A N GLY 131.A O no hydrogen 2.669 N/A ARG 61.A N GLY 131.A O no hydrogen 3.310 N/A ARG 61.A NE TYR 63.A OH no hydrogen 3.452 N/A ARG 61.A NH2 TYR 63.A OH no hydrogen 3.140 N/A LYS 62.A N LEU 217.A O no hydrogen 2.928 N/A TYR 63.A N MET 129.A O no hydrogen 2.944 N/A TYR 63.A OH PHE 209.A O no hydrogen 2.713 N/A CYS 64.A N PRO 215.A O no hydrogen 2.865 N/A CYS 64.A SG GLU 66.A O no hydrogen 3.150 N/A CYS 64.A SG LYS 127.A O no hydrogen 3.857 N/A ILE 65.A N LYS 127.A O no hydrogen 2.828 N/A GLU 66.A N LYS 127.A O no hydrogen 3.237 N/A LYS 68.A N ARG 124.A O no hydrogen 2.789 N/A THR 70.A N MET 122.A O no hydrogen 3.114 N/A ASN 71.A ND2 THR 70.A OG1 no hydrogen 2.746 N/A THR 73.A N CYS 120.A O no hydrogen 2.785 N/A THR 73.A OG1 ASN 71.A O no hydrogen 3.406 N/A THR 74.A OG1 THR 119.A OG1 no hydrogen 2.853 N/A GLU 75.A N VAL 118.A O no hydrogen 2.848 N/A SER 76.A OG ALA 241.A O no hydrogen 2.792 N/A ARG 77.A N GLY 116.A O no hydrogen 2.750 N/A ARG 77.A NH1 GLN 81.A O no hydrogen 3.159 N/A CYS 78.A N GLN 81.A OE1 no hydrogen 3.143 N/A CYS 78.A SG GLY 108.A O no hydrogen 3.953 N/A THR 80.A OG1 PRO 79.A O no hydrogen 2.467 N/A GLN 81.A N CYS 78.A O no hydrogen 3.138 N/A SER 85.A OG PRO 84.A O no hydrogen 2.971 N/A SER 85.A OG GLU 89.A OE2 no hydrogen 3.476 N/A LEU 86.A N GLU 89.A OE2 no hydrogen 2.896 N/A GLU 88.A N GLU 88.A OE1 no hydrogen 2.558 N/A GLU 89.A N LEU 86.A O no hydrogen 3.034 N/A GLN 90.A N ASN 87.A O no hydrogen 2.723 N/A ASP 91.A N GLU 88.A O no hydrogen 2.990 N/A ARG 93.A N ASP 91.A OD1 no hydrogen 2.709 N/A ARG 93.A NE ASP 91.A OD1 no hydrogen 3.138 N/A ARG 93.A NE ASP 91.A OD2 no hydrogen 3.095 N/A ARG 93.A NH2 ASP 91.A OD2 no hydrogen 2.741 N/A PHE 94.A N ASP 91.A O no hydrogen 3.031 N/A VAL 95.A N ALA 121.A O no hydrogen 2.901 N/A LYS 97.A N THR 119.A O no hydrogen 3.032 N/A HIS 98.A NE2 GLU 89.A OE1 no hydrogen 2.618 N/A SER 99.A N ILE 117.A O no hydrogen 2.796 N/A VAL 101.A N GLY 115.A O no hydrogen 2.916 N/A ARG 103.A N GLY 113.A O no hydrogen 2.689 N/A ARG 103.A NE ASN 107.A OD1 no hydrogen 2.796 N/A ARG 103.A NH2 ASN 107.A O no hydrogen 2.797 N/A GLY 104.A N ASN 107.A OD1 no hydrogen 2.972 N/A TRP 105.A NE1 GLY 110.A O no hydrogen 3.189 N/A ASN 107.A N GLY 104.A O no hydrogen 3.067 N/A CYS 109.A N GLY 104.A O no hydrogen 2.991 N/A GLY 113.A N ARG 103.A O no hydrogen 3.177 N/A LYS 114.A NZ ASP 102.A OD2 no hydrogen 2.542 N/A GLY 115.A N VAL 101.A O no hydrogen 2.803 N/A ILE 117.A N SER 99.A O no hydrogen 2.904 N/A VAL 118.A N GLU 75.A O no hydrogen 2.720 N/A THR 119.A N LYS 97.A O no hydrogen 3.086 N/A THR 119.A OG1 THR 74.A OG1 no hydrogen 2.853 N/A THR 119.A OG1 GLN 244.A OE1 no hydrogen 2.743 N/A CYS 120.A N THR 73.A O no hydrogen 2.895 N/A ALA 121.A N VAL 95.A O no hydrogen 3.025 N/A MET 122.A N THR 70.A O no hydrogen 2.628 N/A PHE 123.A N ARG 93.A O no hydrogen 2.768 N/A ARG 124.A N LYS 68.A O no hydrogen 2.943 N/A CYS 125.A SG GLU 66.A O no hydrogen 3.383 N/A CYS 125.A SG LYS 127.A O no hydrogen 3.277 N/A LYS 126.A N GLU 66.A O no hydrogen 2.651 N/A LYS 127.A N GLU 66.A O no hydrogen 3.276 N/A LYS 127.A NZ GLU 198.A OE2 no hydrogen 3.305 N/A LYS 127.A NZ GLU 253.A OE1 no hydrogen 2.655 N/A MET 129.A N TYR 63.A O no hydrogen 2.873 N/A GLU 130.A N GLN 196.A O no hydrogen 2.781 N/A GLY 131.A N ARG 61.A O no hydrogen 2.932 N/A LYS 132.A N LEU 194.A O no hydrogen 2.939 N/A LYS 132.A NZ GLN 196.A OE1 no hydrogen 3.471 N/A VAL 133.A N ALA 58.A O no hydrogen 2.847 N/A ASN 138.A N GLN 135.A O no hydrogen 2.738 N/A LEU 139.A N PRO 136.A O no hydrogen 3.298 N/A GLU 140.A N GLU 53.A O no hydrogen 2.784 N/A TYR 141.A N ILE 162.A O no hydrogen 2.732 N/A THR 142.A N LYS 51.A O no hydrogen 2.739 N/A ILE 143.A N ILE 160.A O no hydrogen 2.857 N/A VAL 144.A N GLU 48.A O no hydrogen 2.840 N/A ILE 145.A N LYS 158.A O no hydrogen 2.775 N/A THR 146.A N ASP 46.A O no hydrogen 2.820 N/A HIS 148.A N THR 44.A O no hydrogen 2.799 N/A SER 149.A N PRO 147.A O no hydrogen 2.825 N/A GLY 150.A N GLN 3.A O no hydrogen 2.802 N/A GLU 151.A N SER 149.A OG no hydrogen 3.009 N/A LYS 155.A NZ HIS 153.A O no hydrogen 2.498 N/A LYS 158.A N ILE 145.A O no hydrogen 2.844 N/A ILE 160.A N ILE 143.A O no hydrogen 2.844 N/A LYS 161.A NZ THR 142.A OG1 no hydrogen 2.740 N/A ILE 162.A N TYR 141.A O no hydrogen 2.966 N/A THR 163.A N SER 166.A OG no hydrogen 2.757 N/A THR 163.A OG1 SER 166.A OG no hydrogen 3.242 N/A GLN 165.A N THR 163.A OG1 no hydrogen 3.191 N/A SER 166.A N THR 163.A O no hydrogen 2.998 N/A SER 166.A OG THR 163.A O no hydrogen 3.092 N/A SER 166.A OG THR 163.A OG1 no hydrogen 3.242 N/A THR 169.A N MET 181.A O no hydrogen 2.779 N/A ALA 171.A N VAL 179.A O no hydrogen 2.948 N/A LEU 173.A N GLY 177.A O no hydrogen 2.658 N/A TYR 176.A N LEU 173.A O no hydrogen 2.825 N/A GLY 177.A N LEU 173.A O no hydrogen 3.070 N/A THR 178.A N LYS 287.A O no hydrogen 3.210 N/A THR 178.A OG1 GLU 170.A OE1 no hydrogen 2.698 N/A VAL 179.A N ALA 171.A O no hydrogen 2.803 N/A THR 180.A N ARG 284.A O no hydrogen 3.243 N/A MET 181.A N THR 169.A O no hydrogen 2.848 N/A GLU 182.A N ARG 282.A O no hydrogen 2.993 N/A SER 184.A N LYS 280.A O no hydrogen 2.942 N/A VAL 193.A N VAL 204.A O no hydrogen 2.497 N/A LEU 194.A N LYS 132.A O no hydrogen 2.828 N/A LEU 195.A N TRP 202.A O no hydrogen 2.976 N/A GLN 196.A N GLU 130.A O no hydrogen 2.568 N/A MET 197.A N LYS 200.A O no hydrogen 3.035 N/A TRP 202.A N LEU 195.A O no hydrogen 2.862 N/A LEU 203.A N THR 264.A O no hydrogen 2.612 N/A VAL 204.A N VAL 193.A O no hydrogen 2.776 N/A ARG 206.A N GLU 191.A O no hydrogen 2.996 N/A PHE 209.A N HIS 205.A O no hydrogen 3.091 N/A LEU 210.A N ARG 206.A O no hydrogen 2.934 N/A ASP 211.A N TRP 208.A O no hydrogen 3.226 N/A LEU 212.A N PHE 209.A O no hydrogen 3.400 N/A LEU 214.A N LEU 212.A O no hydrogen 2.897 N/A TRP 216.A N ILE 228.A O no hydrogen 2.909 N/A LEU 217.A N LYS 62.A O no hydrogen 2.963 N/A GLY 219.A N LEU 60.A O no hydrogen 3.026 N/A ASP 221.A N PRO 218.A O no hydrogen 2.859 N/A THR 222.A OG1 ALA 220.A O no hydrogen 3.395 N/A GLY 224.A N ASP 221.A OD1 no hydrogen 3.282 N/A GLY 224.A N ASP 221.A OD2 no hydrogen 2.449 N/A ILE 228.A N TRP 216.A O no hydrogen 2.812 N/A LYS 230.A NZ LYS 92.A O no hydrogen 2.798 N/A LYS 230.A NZ TRP 227.A O no hydrogen 2.627 N/A THR 232.A N GLN 229.A O no hydrogen 3.103 N/A THR 232.A OG1 GLN 229.A O no hydrogen 2.663 N/A LEU 233.A N LYS 230.A O no hydrogen 2.906 N/A VAL 234.A N GLU 231.A O no hydrogen 3.258 N/A THR 235.A N VAL 247.A O no hydrogen 2.661 N/A LYS 237.A N ASP 245.A O no hydrogen 2.925 N/A HIS 240.A N LYS 243.A O no hydrogen 2.833 N/A LYS 242.A NZ SER 76.A O no hydrogen 3.473 N/A LYS 242.A NZ SER 76.A OG no hydrogen 3.146 N/A GLN 244.A NE2 LYS 237.A O no hydrogen 2.699 N/A VAL 247.A N THR 235.A O no hydrogen 2.884 N/A LEU 249.A N LEU 233.A O no hydrogen 2.949 N/A GLN 252.A N ILE 65.A O no hydrogen 2.721 N/A GLU 253.A N SER 251.A OG no hydrogen 3.285 N/A MET 256.A N GLN 252.A O no hydrogen 2.819 N/A HIS 257.A N GLU 253.A O no hydrogen 2.821 N/A THR 258.A N GLY 254.A O no hydrogen 3.104 N/A THR 258.A OG1 GLY 254.A O no hydrogen 3.114 N/A ALA 259.A N ALA 255.A O no hydrogen 2.979 N/A THR 261.A N THR 258.A O no hydrogen 3.226 N/A THR 261.A OG1 THR 258.A O no hydrogen 2.884 N/A ILE 266.A N ALA 201.A O no hydrogen 2.938 N/A SER 269.A N ASN 272.A O no hydrogen 2.837 N/A ASN 272.A N SER 269.A O no hydrogen 2.815 N/A ASN 272.A ND2 ALA 54.A O no hydrogen 3.247 N/A LEU 274.A N GLN 267.A O no hydrogen 2.942 N/A PHE 275.A N THR 52.A O no hydrogen 2.736 N/A GLY 277.A N HIS 31.A NE2 no hydrogen 2.803 N/A GLY 277.A N THR 52.A OG1 no hydrogen 3.202 N/A LEU 279.A N LEU 29.A O no hydrogen 3.013 N/A LYS 280.A N SER 184.A O no hydrogen 3.107 N/A CYS 281.A N ILE 27.A O no hydrogen 2.919 N/A ARG 282.A N GLU 182.A O no hydrogen 2.909 N/A ARG 282.A NH1 GLU 182.A OE2 no hydrogen 3.253 N/A LEU 283.A N VAL 25.A O no hydrogen 2.804 N/A ARG 284.A N THR 180.A O no hydrogen 2.859 N/A ARG 284.A NH1 GLY 22.A O no hydrogen 2.553 N/A LEU 288.A N MET 285.A O no hydrogen 2.947 N/A GLN 289.A N TYR 176.A O no hydrogen 2.783 N/A LYS 291.A NZ GLU 151.A OE2 no hydrogen 2.452 N/A CYS 298.A N LYS 330.A O no hydrogen 2.704 N/A CYS 298.A SG LYS 330.A O no hydrogen 2.754 N/A THR 299.A OG1 MET 297.A O no hydrogen 3.551 N/A LYS 303.A N GLN 321.A O no hydrogen 2.999 N/A VAL 305.A N ARG 319.A O no hydrogen 2.643 N/A LYS 306.A NZ TYR 1.A OH no hydrogen 3.261 N/A ALA 309.A N VAL 317.A O no hydrogen 3.201 N/A THR 311.A N THR 315.A O no hydrogen 2.991 N/A THR 311.A OG1 THR 315.A O no hydrogen 3.181 N/A THR 311.A OG1 THR 315.A OG1 no hydrogen 2.712 N/A HIS 313.A N THR 311.A OG1 no hydrogen 3.044 N/A THR 315.A N THR 311.A OG1 no hydrogen 3.344 N/A THR 315.A OG1 THR 311.A OG1 no hydrogen 2.712 N/A THR 315.A OG1 GLU 364.A OE2 no hydrogen 2.779 N/A ILE 316.A N ALA 365.A O no hydrogen 2.803 N/A VAL 317.A N ALA 309.A O no hydrogen 2.853 N/A ILE 318.A N ILE 363.A O no hydrogen 2.710 N/A ARG 319.A NE GLU 152.A OE1 no hydrogen 2.853 N/A ARG 319.A NE GLU 152.A OE2 no hydrogen 2.602 N/A ARG 319.A NH2 GLU 152.A OE2 no hydrogen 2.552 N/A VAL 320.A N VAL 361.A O no hydrogen 2.890 N/A GLN 321.A N LYS 303.A O no hydrogen 2.920 N/A GLN 321.A NE2 ASP 358.A OD2 no hydrogen 2.840 N/A TYR 322.A OH ASP 325.A O no hydrogen 3.183 N/A GLU 323.A N LYS 301.A O no hydrogen 2.892 N/A CYS 329.A N VAL 354.A O no hydrogen 3.031 N/A LYS 330.A N SER 296.A O no hydrogen 2.821 N/A ILE 331.A N PRO 352.A O no hydrogen 2.865 N/A GLU 334.A N ILE 375.A O no hydrogen 2.939 N/A MET 336.A N TYR 373.A O no hydrogen 2.962 N/A ASP 337.A N HIS 342.A O no hydrogen 3.361 N/A LYS 340.A N ASP 337.A O no hydrogen 2.744 N/A ARG 341.A N ASP 337.A OD1 no hydrogen 2.949 N/A HIS 342.A N ASP 337.A OD1 no hydrogen 3.011 N/A LEU 344.A N ILE 335.A O no hydrogen 2.672 N/A ARG 346.A N GLU 366.A O no hydrogen 3.136 N/A ARG 346.A NH1 GLU 366.A OE1 no hydrogen 2.592 N/A ILE 348.A N GLU 364.A O no hydrogen 2.943 N/A THR 349.A N GLU 364.A O no hydrogen 3.066 N/A ASN 351.A ND2 LYS 291.A O no hydrogen 2.833 N/A VAL 354.A N CYS 329.A O no hydrogen 2.799 N/A LYS 357.A NZ ASP 325.A OD1 no hydrogen 3.099 N/A ASP 358.A N TYR 322.A O no hydrogen 3.241 N/A SER 359.A N GLU 356.A O no hydrogen 3.057 N/A VAL 361.A N VAL 320.A O no hydrogen 2.556 N/A ASN 362.A N GLY 150.A O no hydrogen 3.124 N/A ILE 363.A N ILE 318.A O no hydrogen 2.946 N/A GLU 364.A N THR 349.A OG1 no hydrogen 3.041 N/A ALA 365.A N ILE 316.A O no hydrogen 2.866 N/A GLU 366.A N ARG 346.A O no hydrogen 2.699 N/A GLY 370.A N LYS 389.A O no hydrogen 2.854 N/A SER 372.A N TRP 387.A O no hydrogen 2.867 N/A TYR 373.A N MET 336.A O no hydrogen 2.644 N/A ILE 374.A N LEU 385.A O no hydrogen 2.761 N/A ILE 375.A N GLU 334.A O no hydrogen 2.742 N/A ILE 376.A N LEU 383.A O no hydrogen 3.088 N/A GLY 377.A N PRO 332.A O no hydrogen 2.720 N/A GLN 382.A NE2 GLY 377.A O no hydrogen 3.156 N/A LEU 383.A N ILE 376.A O no hydrogen 2.967 N/A LYS 384.A NZ GLU 379.A OE2 no hydrogen 3.122 N/A LEU 385.A N ILE 374.A O no hydrogen 3.123 N/A TRP 387.A N SER 372.A O no hydrogen 2.913 N/A LYS 389.A N GLY 370.A O no hydrogen 2.665 N/A LYS 389.A NZ GLY 314.A O no hydrogen 2.791 N/A LYS 389.A NZ PRO 367.A O no hydrogen 3.084 N/A