Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iw4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N ASP 8.A OD2 no hydrogen 3.037 N/A ASN 10.A N ASP 27.A O no hydrogen 3.005 N/A LEU 12.A N LEU 25.A O no hydrogen 3.060 N/A LEU 15.A N VAL 23.A O no hydrogen 2.622 N/A GLY 16.A N VAL 23.A O no hydrogen 3.209 N/A GLY 18.A N GLY 21.A O no hydrogen 2.706 N/A GLY 21.A N GLY 18.A O no hydrogen 2.708 N/A VAL 23.A N GLY 16.A O no hydrogen 2.998 N/A MET 24.A N ILE 37.A O no hydrogen 2.908 N/A LEU 25.A N MET 13.A O no hydrogen 2.834 N/A ALA 26.A N TYR 35.A O no hydrogen 3.093 N/A ASP 27.A N ASN 10.A O no hydrogen 3.389 N/A ARG 28.A N GLU 33.A O no hydrogen 2.992 N/A ARG 28.A NH1 ASP 2.A OD2 no hydrogen 3.502 N/A ARG 28.A NH1 TYR 35.A OH no hydrogen 3.335 N/A ARG 28.A NH2 ASP 2.A O no hydrogen 3.482 N/A ARG 28.A NH2 ASP 2.A OD1 no hydrogen 3.367 N/A LYS 29.A N ASP 8.A O no hydrogen 2.737 N/A LYS 29.A NZ THR 7.A O no hydrogen 2.479 N/A THR 31.A N ARG 28.A O no hydrogen 3.169 N/A THR 31.A OG1 ARG 28.A O no hydrogen 3.385 N/A TYR 35.A N ALA 26.A O no hydrogen 2.861 N/A ALA 36.A N MET 87.A O no hydrogen 2.934 N/A ILE 37.A N MET 24.A O no hydrogen 2.955 N/A LYS 38.A N PHE 85.A O no hydrogen 2.797 N/A LYS 38.A NZ GLU 57.A OE1 no hydrogen 2.410 N/A LYS 38.A NZ GLU 57.A OE2 no hydrogen 3.277 N/A ILE 39.A N LYS 22.A O no hydrogen 2.833 N/A LEU 40.A N LEU 83.A O no hydrogen 2.742 N/A LYS 42.A N ASP 81.A O no hydrogen 2.713 N/A LYS 42.A NZ GLN 78.A OE1 no hydrogen 2.852 N/A LYS 42.A NZ THR 79.A O no hydrogen 2.911 N/A LYS 42.A NZ VAL 80.A O no hydrogen 3.151 N/A LYS 42.A NZ GLN 312.A OE1 no hydrogen 2.737 N/A VAL 44.A N LYS 41.A O no hydrogen 2.869 N/A VAL 45.A N LYS 41.A O no hydrogen 3.237 N/A ILE 46.A N LYS 42.A O no hydrogen 3.044 N/A GLN 47.A N ASP 43.A O no hydrogen 2.690 N/A ASP 48.A N VAL 44.A O no hydrogen 2.628 N/A ASP 49.A N ILE 46.A O no hydrogen 2.532 N/A ASP 50.A N VAL 45.A O no hydrogen 2.605 N/A CYS 53.A SG ASP 50.A O no hydrogen 3.188 N/A CYS 53.A SG ASP 50.A OD1 no hydrogen 3.365 N/A THR 54.A N ASP 50.A O no hydrogen 3.037 N/A THR 54.A OG1 ASP 50.A O no hydrogen 2.900 N/A MET 55.A N VAL 51.A O no hydrogen 2.985 N/A VAL 56.A N GLU 52.A O no hydrogen 2.870 N/A GLU 57.A N CYS 53.A O no hydrogen 2.881 N/A LYS 58.A N THR 54.A O no hydrogen 3.134 N/A LYS 58.A NZ GLY 317.A O no hydrogen 2.940 N/A ARG 59.A N MET 55.A O no hydrogen 3.150 N/A ARG 59.A NE GLU 157.A OE1 no hydrogen 2.975 N/A ARG 59.A NH2 GLU 157.A OE1 no hydrogen 3.536 N/A ARG 59.A NH2 GLU 157.A OE2 no hydrogen 2.669 N/A VAL 60.A N VAL 56.A O no hydrogen 2.649 N/A LEU 61.A N GLU 57.A O no hydrogen 2.673 N/A ALA 62.A N LYS 58.A O no hydrogen 2.896 N/A ALA 62.A N ARG 59.A O no hydrogen 2.876 N/A LEU 63.A N VAL 60.A O no hydrogen 3.449 N/A LYS 66.A NZ LEU 61.A O no hydrogen 2.703 N/A LEU 70.A N PRO 67.A O no hydrogen 3.494 N/A THR 71.A N ILE 149.A O no hydrogen 3.190 N/A THR 71.A OG1 ILE 149.A O no hydrogen 3.270 N/A GLN 72.A N GLU 88.A OE2 no hydrogen 2.787 N/A GLN 72.A NE2 GLU 88.A OE1 no hydrogen 2.865 N/A GLN 72.A NE2 VAL 325.A O no hydrogen 3.031 N/A HIS 74.A N VAL 86.A O no hydrogen 2.613 N/A SER 75.A N VAL 86.A O no hydrogen 3.455 N/A CYS 76.A N TYR 319.A O no hydrogen 2.832 N/A PHE 77.A N TYR 84.A O no hydrogen 3.372 N/A GLN 78.A NE2 PHE 315.A O no hydrogen 3.557 N/A THR 79.A N ARG 82.A O no hydrogen 2.786 N/A VAL 80.A N THR 79.A OG1 no hydrogen 2.638 N/A LEU 83.A N LEU 40.A O no hydrogen 2.673 N/A TYR 84.A N PHE 77.A O no hydrogen 3.017 N/A PHE 85.A N LYS 38.A O no hydrogen 2.838 N/A VAL 86.A N SER 75.A O no hydrogen 2.817 N/A MET 87.A N ALA 36.A O no hydrogen 2.453 N/A GLU 88.A N GLN 72.A O no hydrogen 3.028 N/A GLY 92.A N LEU 141.A O no hydrogen 2.247 N/A LEU 95.A N VAL 139.A O no hydrogen 2.913 N/A HIS 98.A N ASP 94.A O no hydrogen 2.919 N/A HIS 98.A NE2 GLY 92.A O no hydrogen 2.537 N/A ILE 99.A N LEU 95.A O no hydrogen 2.703 N/A GLN 100.A N MET 96.A O no hydrogen 3.082 N/A GLN 100.A NE2 MET 96.A O no hydrogen 3.570 N/A GLN 101.A N TYR 97.A O no hydrogen 3.113 N/A VAL 102.A N ILE 99.A O no hydrogen 3.176 N/A PHE 105.A N MET 201.A O no hydrogen 3.078 N/A ALA 110.A N LYS 106.A O no hydrogen 3.004 N/A VAL 111.A N GLU 107.A O no hydrogen 2.788 N/A PHE 112.A N PRO 108.A O no hydrogen 3.084 N/A TYR 113.A N GLN 109.A O no hydrogen 2.963 N/A ALA 114.A N ALA 110.A O no hydrogen 2.740 N/A ALA 115.A N VAL 111.A O no hydrogen 3.041 N/A GLU 116.A N PHE 112.A O no hydrogen 2.985 N/A ILE 117.A N TYR 113.A O no hydrogen 2.916 N/A SER 118.A N ALA 114.A O no hydrogen 2.835 N/A SER 118.A OG ALA 115.A O no hydrogen 2.797 N/A ILE 119.A N ALA 115.A O no hydrogen 3.344 N/A ILE 119.A N GLU 116.A O no hydrogen 3.059 N/A LEU 121.A N ILE 117.A O no hydrogen 3.090 N/A PHE 122.A N SER 118.A O no hydrogen 2.762 N/A PHE 123.A N ILE 119.A O no hydrogen 3.057 N/A LEU 124.A N GLY 120.A O no hydrogen 3.137 N/A HIS 125.A N LEU 121.A O no hydrogen 2.941 N/A HIS 125.A NE2 ASP 190.A OD2 no hydrogen 3.197 N/A LYS 126.A N PHE 122.A O no hydrogen 3.045 N/A ARG 127.A N PHE 123.A O no hydrogen 3.341 N/A ARG 127.A NH1 PHE 123.A O no hydrogen 3.300 N/A GLY 128.A N HIS 125.A O no hydrogen 2.933 N/A ILE 129.A N LEU 124.A O no hydrogen 2.781 N/A ILE 130.A N LYS 156.A O no hydrogen 2.933 N/A TYR 131.A N ASP 190.A OD2 no hydrogen 2.409 N/A TYR 131.A OH ALA 150.A O no hydrogen 2.648 N/A TYR 131.A OH ASP 151.A O no hydrogen 3.324 N/A ARG 132.A N ASP 190.A OD1 no hydrogen 2.637 N/A ARG 132.A NE MET 154.A O no hydrogen 2.866 N/A ARG 132.A NH1 GLU 167.A OE1 no hydrogen 3.060 N/A ARG 132.A NH2 MET 154.A O no hydrogen 2.860 N/A ARG 132.A NH2 CYS 155.A O no hydrogen 3.186 N/A LYS 135.A NZ THR 171.A OG1 no hydrogen 3.023 N/A LEU 136.A N TYR 174.A OH no hydrogen 3.143 N/A ASN 138.A N LYS 135.A O no hydrogen 2.932 N/A ASN 138.A ND2 ASP 133.A O no hydrogen 2.589 N/A ASN 138.A ND2 ASP 133.A OD2 no hydrogen 2.801 N/A VAL 139.A N LEU 136.A O no hydrogen 3.103 N/A MET 140.A N LYS 148.A O no hydrogen 2.832 N/A LEU 141.A N GLY 93.A O no hydrogen 3.022 N/A ASP 142.A N HIS 146.A O no hydrogen 2.905 N/A GLY 145.A N ASP 142.A O no hydrogen 3.046 N/A HIS 146.A N ASP 142.A OD1 no hydrogen 2.714 N/A ILE 147.A N GLU 116.A OE1 no hydrogen 3.025 N/A LYS 148.A N MET 140.A O no hydrogen 2.919 N/A LYS 148.A NZ PRO 68.A O no hydrogen 2.413 N/A LYS 148.A NZ GLU 88.A OE2 no hydrogen 2.629 N/A ILE 149.A N PHE 69.A O no hydrogen 2.708 N/A ALA 150.A N ASN 138.A O no hydrogen 2.810 N/A GLY 153.A N ASP 151.A OD1 no hydrogen 3.166 N/A CYS 155.A SG PHE 152.A O no hydrogen 3.382 N/A LYS 156.A N ILE 130.A O no hydrogen 2.819 N/A MET 159.A N GLY 128.A O no hydrogen 2.723 N/A VAL 163.A N MET 160.A O no hydrogen 3.103 N/A THR 165.A N TYR 185.A O no hydrogen 3.150 N/A ARG 166.A NE TYR 182.A O no hydrogen 2.836 N/A ARG 166.A NH2 TYR 182.A O no hydrogen 3.054 N/A GLU 167.A N THR 165.A OG1 no hydrogen 3.226 N/A CYS 169.A SG GLU 167.A O no hydrogen 3.853 N/A TYR 174.A N THR 171.A O no hydrogen 2.644 N/A ILE 175.A N PRO 172.A O no hydrogen 3.279 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.887 N/A ILE 180.A N ALA 176.A O no hydrogen 3.480 N/A ALA 181.A N PRO 177.A O no hydrogen 2.925 N/A TYR 182.A N ILE 179.A O no hydrogen 2.780 N/A GLN 183.A N GLU 178.A O no hydrogen 2.898 N/A TYR 185.A N THR 165.A O no hydrogen 3.083 N/A TYR 185.A OH GLU 167.A O no hydrogen 2.798 N/A SER 188.A OG GLU 178.A OE2 no hydrogen 2.537 N/A VAL 189.A N GLY 186.A O no hydrogen 3.465 N/A ASP 190.A N LYS 187.A O no hydrogen 3.049 N/A TRP 191.A N SER 188.A O no hydrogen 3.230 N/A TRP 192.A N SER 188.A O no hydrogen 3.219 N/A ALA 193.A N VAL 189.A O no hydrogen 3.117 N/A TYR 194.A N ASP 190.A O no hydrogen 2.933 N/A TYR 194.A OH ALA 114.A O no hydrogen 2.749 N/A GLY 195.A N TRP 191.A O no hydrogen 2.894 N/A VAL 196.A N TRP 192.A O no hydrogen 2.993 N/A LEU 197.A N ALA 193.A O no hydrogen 2.966 N/A LEU 198.A N TYR 194.A O no hydrogen 2.909 N/A TYR 199.A N GLY 195.A O no hydrogen 2.696 N/A GLU 200.A N VAL 196.A O no hydrogen 2.918 N/A MET 201.A N LEU 197.A O no hydrogen 2.841 N/A LEU 202.A N LEU 198.A O no hydrogen 3.038 N/A ALA 203.A N TYR 199.A O no hydrogen 2.818 N/A GLY 204.A N GLU 200.A O no hydrogen 2.881 N/A GLU 211.A N GLU 215.A OE2 no hydrogen 2.252 N/A GLU 215.A N ASP 212.A OD1 no hydrogen 2.912 N/A LEU 216.A N ASP 212.A O no hydrogen 2.882 N/A PHE 217.A N GLU 213.A O no hydrogen 2.848 N/A GLN 218.A N ASP 214.A O no hydrogen 2.873 N/A SER 219.A N GLU 215.A O no hydrogen 3.052 N/A SER 219.A OG ASP 209.A O no hydrogen 3.354 N/A ILE 220.A N LEU 216.A O no hydrogen 2.949 N/A MET 221.A N PHE 217.A O no hydrogen 2.943 N/A HIS 223.A N SER 219.A O no hydrogen 2.902 N/A LEU 231.A N PRO 228.A O no hydrogen 3.261 N/A SER 232.A OG GLU 107.A OE1 no hydrogen 2.773 N/A SER 232.A OG GLU 107.A OE2 no hydrogen 2.919 N/A GLU 234.A N GLU 234.A OE1 no hydrogen 2.877 N/A ALA 235.A N SER 232.A OG no hydrogen 3.162 N/A VAL 236.A N SER 232.A O no hydrogen 3.083 N/A SER 237.A N LYS 233.A O no hydrogen 3.071 N/A SER 237.A N GLU 234.A O no hydrogen 3.203 N/A SER 237.A OG HIS 264.A NE2 no hydrogen 2.650 N/A ILE 238.A N GLU 234.A O no hydrogen 3.100 N/A CYS 239.A N ALA 235.A O no hydrogen 3.160 N/A CYS 239.A SG ALA 235.A O no hydrogen 3.276 N/A LYS 240.A N VAL 236.A O no hydrogen 3.118 N/A GLY 241.A N SER 237.A O no hydrogen 2.709 N/A LEU 242.A N ILE 238.A O no hydrogen 2.699 N/A MET 243.A N CYS 239.A O no hydrogen 2.734 N/A THR 244.A OG1 LYS 240.A O no hydrogen 2.692 N/A THR 244.A OG1 GLY 241.A O no hydrogen 3.133 N/A LYS 245.A NZ ILE 220.A O no hydrogen 2.798 N/A LYS 245.A NZ HIS 223.A O no hydrogen 2.557 N/A LYS 249.A N HIS 246.A O no hydrogen 3.193 N/A ARG 250.A N PRO 247.A O no hydrogen 3.180 N/A ARG 250.A NE THR 244.A O no hydrogen 2.965 N/A ARG 250.A NH1 GLU 178.A OE1 no hydrogen 3.448 N/A ARG 250.A NH1 GLU 178.A OE2 no hydrogen 2.655 N/A ARG 250.A NH1 SER 188.A O no hydrogen 2.729 N/A ARG 250.A NH2 GLU 178.A OE1 no hydrogen 2.588 N/A ARG 250.A NH2 GLU 178.A OE2 no hydrogen 3.449 N/A ARG 250.A NH2 THR 244.A O no hydrogen 3.186 N/A ARG 250.A NH2 LYS 245.A O no hydrogen 3.289 N/A LEU 251.A N GLY 241.A O no hydrogen 2.856 N/A CYS 253.A N ARG 250.A O no hydrogen 3.004 N/A CYS 253.A SG LEU 251.A O no hydrogen 3.922 N/A GLY 257.A N GLY 254.A O no hydrogen 3.243 N/A ARG 259.A NE GLU 263.A OE2 no hydrogen 3.077 N/A ARG 259.A NH1 GLU 256.A OE1 no hydrogen 2.982 N/A ASP 260.A N GLU 256.A O no hydrogen 3.006 N/A VAL 261.A N GLY 257.A O no hydrogen 3.191 N/A VAL 261.A N GLU 258.A O no hydrogen 2.784 N/A ARG 262.A N GLU 258.A O no hydrogen 2.981 N/A ARG 262.A NH2 GLU 276.A OE1 no hydrogen 2.808 N/A HIS 264.A N VAL 261.A O no hydrogen 2.984 N/A HIS 264.A NE2 SER 237.A OG no hydrogen 2.650 N/A PHE 266.A N HIS 264.A ND1 no hydrogen 2.963 N/A PHE 267.A N HIS 264.A O no hydrogen 2.578 N/A ARG 268.A N ALA 265.A O no hydrogen 2.941 N/A ILE 270.A N PHE 267.A O no hydrogen 3.440 N/A TRP 272.A NE1 ARG 262.A O no hydrogen 3.012 N/A LEU 275.A N ASP 271.A O no hydrogen 2.609 N/A GLU 276.A N TRP 272.A O no hydrogen 2.905 N/A ASN 277.A N LYS 274.A O no hydrogen 3.288 N/A ARG 278.A N LEU 275.A O no hydrogen 2.789 N/A GLU 279.A N LYS 274.A O no hydrogen 3.142 N/A PHE 292.A N ASP 290.A OD1 no hydrogen 2.947 N/A ILE 307.A N ASP 303.A O no hydrogen 3.043 N/A ALA 308.A N GLN 304.A O no hydrogen 2.904 N/A ASN 309.A N VAL 306.A O no hydrogen 2.728 N/A ILE 310.A N ILE 307.A O no hydrogen 2.874 N/A GLN 312.A NE2 VAL 80.A O no hydrogen 3.174 N/A SER 313.A N ASP 311.A OD1 no hydrogen 3.248 N/A SER 313.A OG ASP 311.A OD1 no hydrogen 2.724 N/A ASP 314.A N ASP 311.A O no hydrogen 3.317 N/A PHE 315.A N GLN 312.A O no hydrogen 3.185 N/A GLU 316.A N SER 313.A O no hydrogen 2.855 N/A TYR 319.A N CYS 76.A O no hydrogen 3.314 N/A ASN 321.A N HIS 74.A O no hydrogen 3.037 N/A ASN 321.A ND2 LEU 73.A O no hydrogen 3.070 N/A GLN 323.A N ASN 321.A OD1 no hydrogen 2.981 N/A PHE 324.A N ASN 321.A O no hydrogen 3.309 N/A VAL 325.A N GLN 72.A OE1 no hydrogen 2.829 N/A