Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e1i_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 11.A N VAL 7.A O no hydrogen 2.788 N/A GLU 13.A N ARG 9.A O no hydrogen 3.359 N/A ASN 14.A N SER 10.A O no hydrogen 2.903 N/A LEU 15.A N ILE 11.A O no hydrogen 3.095 N/A ARG 16.A N LEU 12.A O no hydrogen 3.067 N/A SER 17.A OG GLU 13.A O no hydrogen 3.316 N/A SER 17.A OG ASN 14.A O no hydrogen 2.602 N/A LYS 18.A N ASN 14.A O no hydrogen 3.022 N/A LYS 18.A NZ ASN 14.A OD1 no hydrogen 3.346 N/A ILE 19.A N LEU 15.A O no hydrogen 2.912 N/A GLN 20.A N ARG 16.A O no hydrogen 3.186 N/A LYS 21.A N SER 17.A O no hydrogen 3.132 N/A LYS 21.A NZ ASP 25.A OD1 no hydrogen 3.154 N/A LYS 21.A NZ ASP 25.A OD2 no hydrogen 3.440 N/A LEU 22.A N LYS 18.A O no hydrogen 3.035 N/A GLU 23.A N ILE 19.A O no hydrogen 2.800 N/A SER 24.A N GLN 20.A O no hydrogen 3.065 N/A ASP 25.A N LYS 21.A O no hydrogen 2.832 N/A VAL 26.A N LEU 22.A O no hydrogen 2.935 N/A SER 27.A N GLU 23.A O no hydrogen 3.267 N/A ALA 28.A N SER 24.A O no hydrogen 2.890 N/A GLN 29.A N ASP 25.A O no hydrogen 3.082 N/A MET 30.A N VAL 26.A O no hydrogen 3.057 N/A GLU 31.A N SER 27.A O no hydrogen 3.238 N/A TYR 32.A N ALA 28.A O no hydrogen 3.211 N/A CYS 33.A N GLN 29.A O no hydrogen 3.011 N/A CYS 33.A SG GLN 29.A O no hydrogen 3.253 N/A CYS 33.A SG GLN 29.A OE1 no hydrogen 3.625 N/A ARG 34.A N GLU 31.A O no hydrogen 3.164 N/A ARG 34.A NE GLU 31.A OE1 no hydrogen 2.949 N/A ARG 34.A NH2 GLU 31.A OE1 no hydrogen 3.317 N/A ARG 34.A NH2 GLU 31.A OE2 no hydrogen 3.391 N/A SER 40.A N ASN 119.A OD1 no hydrogen 2.984 N/A CYS 41.A SG ALA 117.A O no hydrogen 3.729 N/A ASN 42.A ND2 ASN 124.A O no hydrogen 2.605 N/A SER 47.A OG LEU 66.A O no hydrogen 2.635 N/A LYS 49.A N GLU 53.A OE2 no hydrogen 3.160 N/A CYS 51.A N THR 90.A OG1 no hydrogen 3.258 N/A CYS 51.A SG TRP 89.A O no hydrogen 3.697 N/A CYS 51.A SG THR 90.A OG1 no hydrogen 3.305 N/A GLU 52.A N GLU 50.A OE1 no hydrogen 2.810 N/A ILE 54.A N GLU 50.A O no hydrogen 3.184 N/A ILE 55.A N CYS 51.A O no hydrogen 3.088 N/A ARG 56.A N GLU 52.A O no hydrogen 3.093 N/A LYS 57.A N GLU 53.A O no hydrogen 2.853 N/A LYS 57.A N ILE 54.A O no hydrogen 3.055 N/A LYS 57.A NZ SER 47.A O no hydrogen 2.720 N/A GLY 58.A N ILE 55.A O no hydrogen 3.180 N/A GLY 59.A N ILE 54.A O no hydrogen 2.913 N/A THR 61.A OG1 GLU 63.A OE2 no hydrogen 2.509 N/A SER 62.A OG ASN 83.A OD1 no hydrogen 2.856 N/A GLU 63.A N CYS 80.A O no hydrogen 3.193 N/A MET 64.A N CYS 126.A O no hydrogen 3.081 N/A TYR 65.A N VAL 78.A O no hydrogen 2.866 N/A TYR 65.A OH THR 61.A O no hydrogen 2.618 N/A ILE 67.A N TYR 76.A O no hydrogen 2.883 N/A GLN 68.A N GLY 48.A O no hydrogen 2.975 N/A GLN 68.A NE2 ASP 70.A O no hydrogen 3.431 N/A GLN 68.A NE2 VAL 73.A O no hydrogen 2.716 N/A SER 72.A N ASP 70.A OD1 no hydrogen 3.153 N/A SER 72.A OG ASP 70.A OD1 no hydrogen 3.177 N/A VAL 73.A N ASP 70.A O no hydrogen 2.748 N/A TYR 76.A N ILE 67.A O no hydrogen 2.832 N/A VAL 78.A N TYR 65.A O no hydrogen 2.939 N/A TYR 79.A N TYR 132.A OH no hydrogen 3.204 N/A TYR 79.A OH GLY 127.A O no hydrogen 2.505 N/A CYS 80.A N GLU 63.A O no hydrogen 2.879 N/A ASP 81.A N TRP 89.A O no hydrogen 2.925 N/A MET 82.A N SER 62.A OG no hydrogen 2.761 N/A ASN 83.A N ASP 81.A OD1 no hydrogen 2.884 N/A THR 84.A N ASP 81.A OD1 no hydrogen 2.964 N/A THR 84.A OG1 ASP 81.A OD1 no hydrogen 3.290 N/A THR 84.A OG1 ASP 81.A OD2 no hydrogen 2.500 N/A GLY 87.A N THR 84.A O no hydrogen 2.769 N/A TRP 89.A N ASP 81.A O no hydrogen 3.154 N/A TRP 89.A NE1 THR 84.A O no hydrogen 3.008 N/A THR 90.A N ILE 294.A O no hydrogen 2.815 N/A VAL 91.A N TYR 79.A O no hydrogen 3.059 N/A ILE 92.A N MET 292.A O no hydrogen 2.834 N/A GLN 93.A N MET 292.A O no hydrogen 3.237 N/A ASN 94.A N TYR 132.A O no hydrogen 3.192 N/A ASN 94.A ND2 GLY 130.A O no hydrogen 3.097 N/A ARG 95.A N MET 290.A O no hydrogen 2.591 N/A ARG 95.A NH1 PRO 252.A O no hydrogen 2.809 N/A ARG 95.A NH1 GLY 254.A O no hydrogen 2.772 N/A ARG 95.A NH2 GLY 254.A O no hydrogen 2.858 N/A GLN 96.A N GLU 131.A OE2 no hydrogen 2.660 N/A ASP 97.A N GLU 131.A OE2 no hydrogen 2.837 N/A GLY 98.A N GLU 131.A OE2 no hydrogen 2.803 N/A SER 99.A N ASP 97.A OD1 no hydrogen 3.258 N/A SER 99.A OG ASP 97.A OD1 no hydrogen 3.061 N/A VAL 100.A N GLU 131.A OE1 no hydrogen 3.136 N/A GLY 103.A N ASP 101.A OD1 no hydrogen 2.719 N/A ARG 104.A N PHE 102.A O no hydrogen 2.986 N/A ARG 104.A NE ASP 101.A O no hydrogen 2.585 N/A ARG 104.A NH2 ASP 101.A O no hydrogen 3.448 N/A TRP 106.A N ASP 219.A OD1 no hydrogen 2.945 N/A TRP 106.A NE1 GLU 174.A OE2 no hydrogen 2.828 N/A TYR 109.A N LYS 105.A O no hydrogen 3.304 N/A TYR 109.A OH PHE 102.A O no hydrogen 2.600 N/A LYS 110.A N TRP 106.A O no hydrogen 2.761 N/A LYS 110.A NZ ASP 137.A OD2 no hydrogen 2.783 N/A LYS 110.A NZ GLU 174.A OE1 no hydrogen 3.078 N/A GLN 111.A N ASP 107.A O no hydrogen 2.802 N/A GLN 111.A NE2 ASP 107.A OD1 no hydrogen 3.394 N/A GLY 112.A N PRO 108.A O no hydrogen 2.862 N/A PHE 113.A N TRP 133.A O no hydrogen 2.936 N/A ASN 115.A N GLU 131.A O no hydrogen 2.784 N/A THR 118.A N LEU 128.A O no hydrogen 2.831 N/A ASN 119.A ND2 SER 40.A O no hydrogen 2.858 N/A ASN 119.A ND2 LYS 123.A O no hydrogen 3.415 N/A THR 120.A OG1 ASP 121.A OD1 no hydrogen 3.158 N/A GLY 122.A N ASP 121.A OD2 no hydrogen 2.384 N/A LYS 123.A N THR 120.A O no hydrogen 2.895 N/A LEU 128.A N THR 118.A O no hydrogen 3.395 N/A GLY 130.A N VAL 116.A O no hydrogen 3.062 N/A TYR 132.A OH VAL 91.A O no hydrogen 2.683 N/A TRP 133.A N PHE 113.A O no hydrogen 2.912 N/A LEU 134.A N ILE 92.A O no hydrogen 2.881 N/A ASN 136.A N TYR 109.A O no hydrogen 2.888 N/A ASP 137.A N LYS 110.A O no hydrogen 3.379 N/A ILE 139.A N GLY 135.A O no hydrogen 2.840 N/A SER 140.A N ASN 136.A O no hydrogen 2.869 N/A SER 140.A OG VAL 171.A O no hydrogen 2.790 N/A GLN 141.A N ASP 137.A O no hydrogen 3.122 N/A LEU 142.A N LYS 138.A O no hydrogen 3.114 N/A THR 143.A N ILE 139.A O no hydrogen 3.087 N/A THR 143.A OG1 ILE 139.A O no hydrogen 3.473 N/A THR 143.A OG1 SER 140.A O no hydrogen 3.160 N/A ARG 144.A N SER 140.A O no hydrogen 3.137 N/A ARG 144.A NH1 GLN 172.A OE1 no hydrogen 3.188 N/A MET 145.A N LEU 142.A O no hydrogen 3.447 N/A THR 148.A OG1 THR 143.A O no hydrogen 3.222 N/A THR 148.A OG1 GLY 146.A O no hydrogen 2.864 N/A GLU 149.A N ARG 295.A O no hydrogen 2.776 N/A LEU 150.A N TYR 166.A O no hydrogen 2.856 N/A LEU 151.A N LYS 293.A O no hydrogen 2.769 N/A ILE 152.A N ALA 164.A O no hydrogen 2.988 N/A GLU 153.A N SER 291.A O no hydrogen 3.129 N/A MET 154.A N VAL 162.A O no hydrogen 3.193 N/A GLU 155.A N LYS 289.A O no hydrogen 2.928 N/A ASP 156.A N ASP 160.A O no hydrogen 3.023 N/A TRP 157.A N TYR 285.A OH no hydrogen 3.070 N/A TRP 157.A NE1 SER 286.A O no hydrogen 2.806 N/A LYS 158.A N ASP 156.A OD1 no hydrogen 2.881 N/A GLY 159.A N ASP 156.A O no hydrogen 3.462 N/A ASP 160.A N ASP 156.A OD1 no hydrogen 2.988 N/A VAL 162.A N MET 154.A O no hydrogen 3.266 N/A LYS 163.A N THR 188.A OG1 no hydrogen 3.002 N/A ALA 164.A N ILE 152.A O no hydrogen 2.762 N/A HIS 165.A N ARG 186.A O no hydrogen 2.800 N/A TYR 166.A N LEU 150.A O no hydrogen 2.829 N/A GLY 167.A N LYS 184.A O no hydrogen 2.839 N/A GLY 168.A N ASN 183.A O no hydrogen 3.255 N/A PHE 169.A N THR 148.A O no hydrogen 2.773 N/A THR 170.A N SER 181.A O no hydrogen 3.031 N/A VAL 171.A N THR 143.A OG1 no hydrogen 2.912 N/A GLN 172.A N GLN 179.A O no hydrogen 2.957 N/A ASN 176.A N ASN 173.A O no hydrogen 3.016 N/A ASN 176.A N ASN 173.A OD1 no hydrogen 3.231 N/A ASN 176.A ND2 ASN 173.A OD1 no hydrogen 2.953 N/A LYS 177.A N GLU 174.A O no hydrogen 2.751 N/A TYR 178.A N ASN 173.A O no hydrogen 2.851 N/A TYR 178.A OH ASP 137.A OD1 no hydrogen 2.550 N/A GLN 179.A N ASN 176.A O no hydrogen 3.260 N/A ILE 180.A N MET 213.A O no hydrogen 3.032 N/A SER 181.A N THR 170.A O no hydrogen 3.086 N/A VAL 182.A N ASN 211.A OD1 no hydrogen 2.895 N/A ASN 183.A N GLY 168.A O no hydrogen 3.061 N/A LYS 184.A NZ ASN 183.A OD1 no hydrogen 2.710 N/A ARG 186.A N HIS 165.A O no hydrogen 2.834 N/A THR 188.A N LYS 163.A O no hydrogen 2.881 N/A ALA 189.A N LYS 163.A O no hydrogen 2.903 N/A ALA 192.A N GLY 190.A O no hydrogen 2.811 N/A LEU 193.A N TYR 166.A OH no hydrogen 3.253 N/A ASP 195.A N ASN 191.A O no hydrogen 2.929 N/A GLY 196.A N ALA 192.A O no hydrogen 3.153 N/A ALA 197.A N THR 208.A OG1 no hydrogen 3.012 N/A SER 198.A OG GLN 199.A OE1 no hydrogen 3.353 N/A GLN 199.A N GLN 199.A OE1 no hydrogen 2.799 N/A GLN 199.A NE2 MET 278.A O no hydrogen 3.500 N/A LEU 200.A N ALA 197.A O no hydrogen 3.243 N/A ARG 205.A NE ASP 195.A O no hydrogen 2.989 N/A THR 206.A N GLY 202.A O no hydrogen 3.047 N/A THR 206.A OG1 GLY 202.A O no hydrogen 2.935 N/A MET 207.A N GLU 203.A O no hydrogen 2.943 N/A THR 208.A N ARG 205.A O no hydrogen 2.950 N/A THR 208.A OG1 ARG 205.A O no hydrogen 2.483 N/A ILE 209.A N THR 206.A O no hydrogen 3.243 N/A HIS 210.A N LEU 193.A O no hydrogen 3.053 N/A HIS 210.A ND1 TRP 243.A O no hydrogen 2.614 N/A ASN 211.A N LEU 193.A O no hydrogen 2.929 N/A GLY 212.A N ILE 180.A O no hydrogen 2.813 N/A MET 213.A N HIS 210.A O no hydrogen 2.942 N/A PHE 215.A N LYS 177.A O no hydrogen 2.980 N/A SER 216.A N TRP 242.A O no hydrogen 3.120 N/A THR 217.A N ARG 220.A O no hydrogen 3.118 N/A THR 217.A OG1 ASP 219.A OD1 no hydrogen 2.595 N/A ARG 220.A N THR 217.A O no hydrogen 2.855 N/A ASN 222.A ND2 PHE 215.A O no hydrogen 2.917 N/A ASP 223.A N ASP 221.A OD1 no hydrogen 3.040 N/A GLY 224.A N ASN 245.A O no hydrogen 2.899 N/A TRP 225.A N ASP 223.A OD1 no hydrogen 2.977 N/A THR 227.A OG1 ASP 229.A OD1 no hydrogen 3.437 N/A LYS 232.A N ASP 229.A O no hydrogen 3.174 N/A CYS 234.A N ASP 223.A OD2 no hydrogen 3.012 N/A CYS 234.A SG ASP 223.A OD2 no hydrogen 3.567 N/A CYS 234.A SG ASN 245.A O no hydrogen 3.337 N/A SER 235.A OG GLY 240.A O no hydrogen 3.008 N/A LYS 236.A NZ ARG 231.A O no hydrogen 2.897 N/A GLY 239.A N LYS 236.A O no hydrogen 2.744 N/A GLY 241.A N TYR 109.A OH no hydrogen 2.960 N/A TRP 242.A N SER 216.A O no hydrogen 3.286 N/A TRP 243.A NE1 TYR 178.A O no hydrogen 2.641 N/A TYR 244.A OH GLY 240.A O no hydrogen 2.828 N/A ASN 245.A N CYS 247.A O no hydrogen 2.688 N/A ASN 245.A ND2 ILE 209.A O no hydrogen 2.768 N/A ARG 246.A N MET 207.A O no hydrogen 2.735 N/A HIS 248.A NE2 ALA 272.A O no hydrogen 3.118 N/A ALA 249.A N HIS 210.A NE2 no hydrogen 2.969 N/A ALA 250.A N HIS 210.A NE2 no hydrogen 3.239 N/A ASN 251.A N VAL 276.A O no hydrogen 2.881 N/A ASN 253.A N ASN 251.A OD1 no hydrogen 3.247 N/A ASN 253.A ND2 GLY 241.A O no hydrogen 2.951 N/A GLY 254.A N ASN 251.A O no hydrogen 3.104 N/A ARG 255.A N ASP 273.A O no hydrogen 2.789 N/A TYR 256.A OH ARG 288.A O no hydrogen 2.627 N/A TYR 257.A N SER 286.A OG no hydrogen 3.382 N/A TYR 257.A OH ASP 273.A OD1 no hydrogen 2.460 N/A TYR 262.A N TRP 284.A O no hydrogen 3.096 N/A THR 263.A OG1 ASP 265.A OD1 no hydrogen 2.836 N/A MET 266.A N THR 263.A O no hydrogen 2.973 N/A ALA 267.A N TRP 264.A O no hydrogen 3.298 N/A HIS 269.A NE2 GLU 237.A O no hydrogen 2.794 N/A GLY 270.A N ALA 267.A O no hydrogen 2.932 N/A GLY 274.A N TYR 262.A OH no hydrogen 3.121 N/A VAL 275.A N SER 286.A OG no hydrogen 2.970 N/A VAL 276.A N ASN 251.A O no hydrogen 3.278 N/A TRP 277.A NE1 GLY 190.A O no hydrogen 2.931 N/A MET 278.A N ALA 249.A O no hydrogen 2.851 N/A ASN 279.A ND2 GLY 196.A O no hydrogen 3.468 N/A TRP 280.A N TRP 277.A O no hydrogen 2.791 N/A LYS 281.A N TRP 277.A O no hydrogen 3.217 N/A LYS 281.A NZ ASP 156.A OD2 no hydrogen 3.229 N/A GLY 282.A N MET 278.A O no hydrogen 3.011 N/A SER 286.A N GLY 260.A O no hydrogen 2.659 N/A SER 286.A OG ARG 255.A O no hydrogen 3.285 N/A MET 287.A N VAL 275.A O no hydrogen 2.808 N/A ARG 288.A N GLU 155.A O no hydrogen 2.803 N/A LYS 289.A N GLU 155.A O no hydrogen 3.061 N/A MET 290.A N ARG 95.A O no hydrogen 3.050 N/A SER 291.A N GLU 153.A O no hydrogen 2.939 N/A MET 292.A N GLN 93.A O no hydrogen 2.773 N/A LYS 293.A N LEU 151.A O no hydrogen 2.903 N/A LYS 293.A NZ ASP 81.A OD2 no hydrogen 2.678 N/A LYS 293.A NZ GLU 153.A OE1 no hydrogen 2.964 N/A ILE 294.A N THR 90.A O no hydrogen 2.811 N/A ARG 295.A N GLU 149.A O no hydrogen 3.199 N/A ARG 295.A NE GLU 149.A OE2 no hydrogen 3.126 N/A ARG 295.A NH1 GLU 85.A OE2 no hydrogen 3.419 N/A ARG 295.A NH1 GLY 87.A O no hydrogen 2.847 N/A ARG 295.A NH2 GLU 85.A OE2 no hydrogen 2.842 N/A ARG 295.A NH2 GLU 149.A OE2 no hydrogen 2.837 N/A PHE 297.A N PRO 147.A O no hydrogen 2.654 N/A