Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e6a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N ASP 25.A O no hydrogen 3.372 N/A ILE 2.A N ASP 25.A O no hydrogen 3.478 N/A LYS 3.A NZ GLU 27.A OE1 no hydrogen 2.825 N/A ILE 4.A N GLU 27.A O no hydrogen 3.174 N/A GLY 5.A N TYR 94.A O no hydrogen 2.738 N/A ILE 6.A N ALA 30.A O no hydrogen 3.469 N/A ASN 7.A N VAL 96.A O no hydrogen 2.901 N/A GLY 8.A N ASN 32.A O no hydrogen 2.612 N/A PHE 9.A N ASP 33.A OD2 no hydrogen 2.724 N/A ARG 11.A NE GLU 317.A OE1 no hydrogen 3.175 N/A ARG 11.A NH1 ASP 48.A OD2 no hydrogen 1.963 N/A ARG 11.A NH2 ASP 48.A OD1 no hydrogen 2.684 N/A ARG 14.A N GLY 10.A O no hydrogen 2.668 N/A ARG 14.A NH1 PHE 9.A O no hydrogen 2.757 N/A LEU 15.A N ARG 11.A O no hydrogen 2.716 N/A VAL 16.A N ILE 12.A O no hydrogen 2.577 N/A ALA 17.A N ARG 14.A O no hydrogen 2.889 N/A ARG 18.A N ARG 14.A O no hydrogen 2.713 N/A ARG 18.A NH1 HIS 51.A O no hydrogen 3.425 N/A ARG 18.A NH2 PHE 45.A O no hydrogen 3.278 N/A ARG 18.A NH2 GLY 52.A O no hydrogen 3.180 N/A VAL 19.A N LEU 15.A O no hydrogen 3.134 N/A LEU 21.A N ALA 17.A O no hydrogen 3.157 N/A GLN 22.A N VAL 19.A O no hydrogen 2.826 N/A SER 23.A OG ALA 20.A O no hydrogen 3.145 N/A VAL 26.A N SER 23.A OG no hydrogen 3.376 N/A GLU 27.A N ILE 2.A O no hydrogen 2.910 N/A VAL 31.A N THR 75.A O no hydrogen 2.862 N/A ASN 32.A N ILE 6.A O no hydrogen 2.988 N/A ASP 33.A N PHE 77.A O no hydrogen 2.950 N/A PHE 35.A N ASP 33.A OD1 no hydrogen 2.989 N/A MET 41.A N THR 37.A O no hydrogen 2.542 N/A THR 42.A N THR 38.A O no hydrogen 3.295 N/A THR 42.A OG1 THR 38.A O no hydrogen 3.233 N/A THR 42.A OG1 ASP 39.A O no hydrogen 2.944 N/A TYR 43.A N TYR 40.A O no hydrogen 3.174 N/A TYR 43.A N MET 41.A O no hydrogen 2.341 N/A MET 44.A N TYR 40.A O no hydrogen 3.104 N/A MET 44.A N MET 41.A O no hydrogen 2.772 N/A PHE 45.A N MET 41.A O no hydrogen 3.014 N/A LYS 46.A NZ TYR 47.A OH no hydrogen 3.157 N/A VAL 50.A N ASP 48.A OD1 no hydrogen 3.002 N/A HIS 51.A N ASP 48.A OD1 no hydrogen 3.304 N/A TRP 54.A N LYS 46.A O no hydrogen 3.103 N/A TRP 54.A NE1 SER 57.A O no hydrogen 3.230 N/A SER 57.A OG ASP 58.A OD2 no hydrogen 2.953 N/A LYS 60.A N LEU 68.A O no hydrogen 3.026 N/A LYS 60.A NZ ASP 58.A OD1 no hydrogen 2.761 N/A LYS 60.A NZ GLY 70.A O no hydrogen 3.390 N/A LYS 65.A N THR 38.A OG1 no hydrogen 3.424 N/A THR 66.A OG1 ASP 63.A OD1 no hydrogen 2.938 N/A THR 66.A OG1 SER 64.A O no hydrogen 2.974 N/A LEU 68.A N LYS 60.A O no hydrogen 2.739 N/A LEU 69.A N LYS 72.A O no hydrogen 2.874 N/A LYS 72.A NZ LEU 28.A O no hydrogen 3.304 N/A VAL 74.A N LEU 67.A O no hydrogen 2.696 N/A THR 75.A N VAL 29.A O no hydrogen 2.647 N/A VAL 76.A N LYS 65.A O no hydrogen 2.653 N/A PHE 77.A N VAL 31.A O no hydrogen 2.724 N/A ARG 80.A NH1 GLY 78.A O no hydrogen 3.403 N/A GLU 84.A N ASN 81.A O no hydrogen 2.917 N/A ILE 85.A N PRO 82.A O no hydrogen 2.887 N/A TRP 87.A N ILE 85.A O no hydrogen 2.640 N/A TRP 87.A NE1 HIS 111.A ND1 no hydrogen 2.974 N/A ALA 88.A N GLY 114.A O no hydrogen 2.930 N/A GLU 89.A N PRO 86.A O no hydrogen 2.893 N/A ALA 90.A N TRP 87.A O no hydrogen 2.543 N/A GLY 91.A N TRP 87.A O no hydrogen 3.130 N/A GLU 93.A N LYS 3.A O no hydrogen 3.282 N/A VAL 95.A N LYS 118.A O no hydrogen 2.893 N/A VAL 96.A N GLY 5.A O no hydrogen 2.469 N/A GLU 97.A N VAL 120.A O no hydrogen 2.918 N/A SER 98.A N VAL 96.A O no hydrogen 2.918 N/A SER 98.A OG GLY 8.A O no hydrogen 3.430 N/A SER 98.A OG SER 98.A O no hydrogen 2.066 N/A THR 99.A OG1 GLU 97.A OE2 no hydrogen 2.619 N/A VAL 101.A N THR 99.A OG1 no hydrogen 3.238 N/A LYS 105.A N ASP 127.A OD1 no hydrogen 2.486 N/A ALA 108.A N ASP 104.A O no hydrogen 3.032 N/A ALA 109.A N GLU 106.A O no hydrogen 3.150 N/A ALA 110.A N LYS 107.A O no hydrogen 3.188 N/A HIS 111.A NE2 GLU 97.A OE1 no hydrogen 2.721 N/A ALA 116.A N HIS 111.A O no hydrogen 3.473 N/A LYS 118.A N GLU 93.A O no hydrogen 3.295 N/A LYS 118.A NZ TYR 140.A OH no hydrogen 2.532 N/A VAL 119.A N ASP 145.A O no hydrogen 3.064 N/A VAL 120.A N VAL 95.A O no hydrogen 3.199 N/A ILE 121.A N VAL 147.A O no hydrogen 3.096 N/A SER 122.A N GLU 97.A O no hydrogen 3.320 N/A SER 122.A OG GLU 97.A O no hydrogen 2.915 N/A SER 125.A OG THR 103.A O no hydrogen 2.557 N/A SER 125.A OG ASP 127.A OD1 no hydrogen 3.494 N/A ALA 128.A N SER 125.A OG no hydrogen 2.989 N/A PHE 131.A N SER 148.A O no hydrogen 2.776 N/A CYS 133.A SG ASN 149.A OD1 no hydrogen 4.021 N/A CYS 133.A SG ARG 323.A O no hydrogen 3.696 N/A GLY 134.A N GLU 137.A OE2 no hydrogen 2.613 N/A VAL 135.A N VAL 132.A O no hydrogen 3.099 N/A ASN 136.A N VAL 132.A O no hydrogen 3.289 N/A LYS 139.A N ASN 136.A O no hydrogen 3.127 N/A TYR 140.A N ASP 138.A O no hydrogen 2.727 N/A THR 141.A OG1 ASP 143.A OD1 no hydrogen 3.017 N/A ASP 143.A N THR 141.A O no hydrogen 2.646 N/A ILE 144.A N THR 141.A O no hydrogen 3.405 N/A VAL 147.A N VAL 119.A O no hydrogen 3.409 N/A SER 148.A N PRO 129.A O no hydrogen 2.692 N/A SER 148.A OG ALA 123.A O no hydrogen 2.588 N/A ASN 149.A N ILE 121.A O no hydrogen 3.357 N/A CYS 152.A SG THR 153.A OG1 no hydrogen 3.655 N/A CYS 152.A SG HIS 179.A NE2 no hydrogen 3.175 N/A THR 153.A OG1 TYR 314.A OH no hydrogen 2.699 N/A THR 154.A N SER 151.A OG no hydrogen 2.906 N/A THR 154.A OG1 SER 151.A OG no hydrogen 2.755 N/A THR 154.A OG1 ALA 213.A O no hydrogen 3.186 N/A ASN 155.A N SER 151.A O no hydrogen 2.837 N/A ASN 155.A ND2 ASN 149.A O no hydrogen 3.428 N/A CYS 156.A N THR 153.A O no hydrogen 2.981 N/A LEU 157.A N THR 153.A O no hydrogen 2.925 N/A ALA 158.A N THR 154.A O no hydrogen 3.010 N/A ALA 161.A N LEU 157.A O no hydrogen 3.170 N/A LYS 162.A N ALA 158.A O no hydrogen 3.080 N/A LYS 162.A NZ VAL 135.A O no hydrogen 3.117 N/A VAL 163.A N PRO 159.A O no hydrogen 2.749 N/A ILE 164.A N LEU 160.A O no hydrogen 3.254 N/A HIS 165.A N ALA 161.A O no hydrogen 2.602 N/A ASP 166.A N LYS 162.A O no hydrogen 2.744 N/A ASN 167.A N VAL 163.A O no hydrogen 3.481 N/A ASN 167.A ND2 VAL 163.A O no hydrogen 2.890 N/A PHE 168.A N ILE 164.A O no hydrogen 2.701 N/A GLY 169.A N HIS 165.A O no hydrogen 2.702 N/A ILE 170.A N HIS 165.A ND1 no hydrogen 2.815 N/A ILE 171.A N ARG 248.A O no hydrogen 2.920 N/A GLY 173.A N LYS 227.A O no hydrogen 2.940 N/A LEU 174.A N THR 246.A O no hydrogen 3.098 N/A MET 175.A N THR 229.A O no hydrogen 3.322 N/A THR 176.A N ASP 244.A O no hydrogen 2.659 N/A THR 177.A OG1 VAL 242.A O no hydrogen 3.410 N/A THR 177.A OG1 TYR 314.A OH no hydrogen 3.116 N/A HIS 179.A N PHE 233.A O no hydrogen 2.745 N/A HIS 179.A ND1 ALA 180.A O no hydrogen 2.887 N/A GLY 190.A N GLY 199.A O no hydrogen 3.437 N/A SER 192.A OG ASP 195.A O no hydrogen 3.346 N/A GLY 198.A N ASP 195.A OD2 no hydrogen 2.551 N/A GLY 199.A N TRP 196.A O no hydrogen 2.809 N/A ARG 200.A N ARG 197.A O no hydrogen 3.069 N/A ARG 200.A NE ASP 189.A OD2 no hydrogen 2.539 N/A ARG 200.A NH2 ASP 189.A OD2 no hydrogen 3.335 N/A ALA 201.A N ASP 189.A OD1 no hydrogen 3.291 N/A ILE 207.A N ARG 234.A O no hydrogen 3.208 N/A SER 209.A N SER 232.A O no hydrogen 2.880 N/A SER 209.A OG SER 210.A O no hydrogen 3.111 N/A ALA 216.A N GLY 212.A O no hydrogen 2.510 N/A VAL 217.A N ALA 213.A O no hydrogen 3.093 N/A LYS 219.A N ALA 216.A O no hydrogen 2.750 N/A VAL 220.A N ALA 216.A O no hydrogen 3.409 N/A LEU 224.A N LEU 221.A O no hydrogen 2.856 N/A ASN 225.A N PRO 222.A O no hydrogen 2.818 N/A LYS 227.A N LEU 224.A O no hydrogen 3.138 N/A LYS 227.A NZ ASP 223.A O no hydrogen 3.479 N/A LYS 227.A NZ ASN 225.A O no hydrogen 3.506 N/A MET 231.A N MET 175.A O no hydrogen 2.923 N/A PHE 233.A N THR 177.A O no hydrogen 3.109 N/A ARG 234.A N ILE 207.A O no hydrogen 2.753 N/A ARG 234.A NE HIS 179.A ND1 no hydrogen 3.277 N/A ARG 234.A NH1 GLN 185.A OE1 no hydrogen 3.410 N/A VAL 235.A N HIS 179.A O no hydrogen 3.122 N/A SER 241.A N TYR 314.A O no hydrogen 3.139 N/A VAL 243.A N ALA 312.A O no hydrogen 2.574 N/A ASP 244.A N THR 176.A O no hydrogen 2.603 N/A LEU 245.A N LEU 310.A O no hydrogen 3.049 N/A VAL 247.A N VAL 308.A O no hydrogen 3.045 N/A ARG 248.A N GLU 172.A O no hydrogen 3.049 N/A GLU 250.A N GLY 169.A O no hydrogen 2.788 N/A LYS 251.A N PHE 168.A O no hydrogen 3.031 N/A TYR 255.A OH ALA 297.A O no hydrogen 2.700 N/A ILE 258.A N TYR 255.A O no hydrogen 3.050 N/A LYS 259.A N TYR 255.A O no hydrogen 2.929 N/A SER 260.A N ASP 256.A O no hydrogen 2.938 N/A SER 260.A OG ASP 256.A O no hydrogen 3.253 N/A ALA 261.A N ALA 257.A O no hydrogen 3.259 N/A ILE 262.A N ILE 258.A O no hydrogen 2.433 N/A LYS 263.A N LYS 259.A O no hydrogen 2.431 N/A LYS 263.A NZ GLU 278.A OE2 no hydrogen 2.993 N/A SER 264.A N SER 260.A O no hydrogen 2.508 N/A SER 264.A OG SER 260.A O no hydrogen 2.687 N/A ALA 265.A N ILE 262.A O no hydrogen 2.760 N/A SER 266.A N ILE 262.A O no hydrogen 2.992 N/A SER 266.A OG LYS 263.A O no hydrogen 3.022 N/A ILE 273.A N LEU 270.A O no hydrogen 3.014 N/A ILE 274.A N LEU 270.A O no hydrogen 3.187 N/A TYR 276.A OH GLU 278.A OE1 no hydrogen 2.811 N/A VAL 277.A N PHE 295.A O no hydrogen 3.015 N/A LEU 281.A N GLU 279.A O no hydrogen 2.744 N/A VAL 282.A N ASP 285.A OD2 no hydrogen 2.584 N/A ASP 285.A N VAL 282.A O no hydrogen 3.261 N/A PHE 286.A N SER 283.A O no hydrogen 2.820 N/A ARG 291.A N ASP 289.A O no hydrogen 2.500 N/A ARG 291.A N ASP 289.A OD1 no hydrogen 3.136 N/A SER 292.A N ILE 273.A O no hydrogen 2.472 N/A SER 292.A OG ASN 155.A OD1 no hydrogen 3.071 N/A SER 293.A N ILE 273.A O no hydrogen 2.910 N/A ASP 296.A N VAL 311.A O no hydrogen 3.232 N/A ALA 297.A N VAL 277.A O no hydrogen 2.917 N/A LEU 303.A N PHE 307.A O no hydrogen 2.990 N/A ASN 304.A ND2 LEU 303.A O no hydrogen 2.700 N/A PHE 307.A N ASN 304.A O no hydrogen 3.369 N/A VAL 308.A N VAL 247.A O no hydrogen 3.415 N/A LYS 309.A N ILE 301.A O no hydrogen 2.880 N/A LYS 309.A NZ ASP 244.A OD1 no hydrogen 3.039 N/A LYS 309.A NZ ASP 244.A OD2 no hydrogen 2.539 N/A LYS 309.A NZ THR 246.A OG1 no hydrogen 2.630 N/A LEU 310.A N LEU 245.A O no hydrogen 2.984 N/A ALA 312.A N VAL 243.A O no hydrogen 3.040 N/A TRP 313.A N ILE 294.A O no hydrogen 3.405 N/A TYR 314.A N SER 241.A O no hydrogen 3.146 N/A TYR 314.A OH THR 153.A OG1 no hydrogen 2.699 N/A TYR 314.A OH THR 177.A OG1 no hydrogen 3.116 N/A TRP 318.A N ASP 315.A OD1 no hydrogen 2.533 N/A GLY 319.A N ASP 315.A O no hydrogen 3.001 N/A TYR 320.A OH ASN 149.A O no hydrogen 3.031 N/A TYR 320.A OH ALA 150.A O no hydrogen 3.102 N/A SER 321.A N GLU 317.A O no hydrogen 2.768 N/A SER 321.A OG ILE 12.A O no hydrogen 3.561 N/A SER 321.A OG GLU 317.A O no hydrogen 2.726 N/A ASN 322.A N TRP 318.A O no hydrogen 2.980 N/A ARG 323.A N GLY 319.A O no hydrogen 3.319 N/A ARG 323.A NH1 SER 290.A O no hydrogen 2.860 N/A ARG 323.A NH1 SER 292.A OG no hydrogen 3.092 N/A ARG 323.A NH2 SER 290.A O no hydrogen 3.557 N/A VAL 324.A N TYR 320.A O no hydrogen 3.028 N/A ASP 326.A N ASN 322.A O no hydrogen 3.180 N/A LEU 327.A N ARG 323.A O no hydrogen 2.936 N/A LEU 327.A N VAL 324.A O no hydrogen 3.102 N/A ILE 328.A N VAL 324.A O no hydrogen 3.252 N/A ARG 329.A N ILE 325.A O no hydrogen 3.105 N/A HIS 330.A N ASP 326.A O no hydrogen 3.335 N/A MET 331.A N LEU 327.A O no hydrogen 3.370 N/A ALA 332.A N ILE 328.A O no hydrogen 3.111 N/A LYS 333.A N HIS 330.A O no hydrogen 2.823 N/A THR 334.A OG1 HIS 330.A O no hydrogen 3.236 N/A