Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pe3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N ASP 1.A OD2 no hydrogen 2.912 N/A MET 5.A N ASP 1.A O no hydrogen 3.258 N/A GLN 6.A N TRP 2.A O no hydrogen 3.166 N/A GLN 6.A NE2 GLU 10.A OE1 no hydrogen 3.403 N/A GLN 6.A NE2 GLU 10.A OE2 no hydrogen 3.234 N/A GLU 7.A N LYS 3.A O no hydrogen 3.224 N/A ILE 8.A N LEU 4.A O no hydrogen 3.036 N/A ILE 9.A N MET 5.A O no hydrogen 3.223 N/A GLU 10.A N GLN 6.A O no hydrogen 2.923 N/A ALA 11.A N GLU 7.A O no hydrogen 2.954 N/A GLY 13.A N GLU 142.A OE2 no hydrogen 3.069 N/A SER 15.A N LYS 64.A O no hydrogen 3.080 N/A SER 15.A OG ASP 63.A OD2 no hydrogen 2.555 N/A GLY 16.A N GLU 18.A OE2 no hydrogen 2.857 N/A TYR 17.A N VAL 14.A O no hydrogen 2.684 N/A GLU 18.A N GLU 18.A OE1 no hydrogen 2.642 N/A LEU 20.A N TYR 17.A O no hydrogen 3.074 N/A ILE 22.A N PRO 12.A O no hydrogen 2.741 N/A ARG 23.A N GLU 18.A O no hydrogen 2.870 N/A ILE 25.A N GLY 21.A O no hydrogen 3.465 N/A VAL 26.A N ILE 22.A O no hydrogen 3.164 N/A VAL 27.A N ARG 23.A O no hydrogen 3.098 N/A ASP 28.A N ASP 24.A O no hydrogen 2.993 N/A VAL 29.A N ILE 25.A O no hydrogen 2.962 N/A LEU 30.A N VAL 26.A O no hydrogen 3.071 N/A LEU 30.A N VAL 27.A O no hydrogen 2.930 N/A LYS 31.A N VAL 27.A O no hydrogen 2.763 N/A LYS 31.A N ASP 28.A O no hydrogen 3.086 N/A VAL 33.A N LEU 30.A O no hydrogen 3.148 N/A ALA 34.A N LEU 30.A O no hydrogen 2.727 N/A ASP 35.A N HIS 48.A O no hydrogen 2.895 N/A LYS 38.A N ILE 46.A O no hydrogen 3.039 N/A ASP 40.A N ASN 44.A O no hydrogen 3.258 N/A LEU 42.A N ASP 40.A OD1 no hydrogen 2.791 N/A GLY 43.A N ASP 40.A O no hydrogen 2.902 N/A ASN 44.A N ASP 40.A OD1 no hydrogen 2.941 N/A ASN 44.A ND2 ASP 40.A OD1 no hydrogen 3.308 N/A ASN 44.A ND2 ASP 40.A OD2 no hydrogen 2.674 N/A ASN 44.A ND2 GLY 197.A O no hydrogen 3.166 N/A VAL 45.A N GLY 187.A O no hydrogen 2.987 N/A ILE 46.A N LYS 38.A O no hydrogen 2.838 N/A ALA 47.A N ILE 185.A O no hydrogen 2.828 N/A HIS 48.A N GLU 36.A O no hydrogen 2.792 N/A HIS 48.A NE2 ASP 182.A OD1 no hydrogen 2.699 N/A PHE 49.A N ILE 183.A O no hydrogen 2.572 N/A LYS 50.A N ASP 35.A OD2 no hydrogen 3.243 N/A LYS 50.A NZ HIS 48.A ND1 no hydrogen 3.417 N/A GLY 51.A N ASP 182.A OD1 no hydrogen 2.812 N/A SER 52.A N GLU 180.A O no hydrogen 2.609 N/A SER 52.A OG GLU 180.A O no hydrogen 2.630 N/A SER 53.A N SER 52.A OG no hydrogen 2.606 N/A ARG 55.A N GLU 208.A OE1 no hydrogen 3.432 N/A ILE 56.A N ASP 182.A O no hydrogen 2.777 N/A MET 57.A N VAL 209.A O no hydrogen 2.839 N/A VAL 58.A N TYR 184.A O no hydrogen 2.939 N/A ALA 59.A N ILE 211.A O no hydrogen 3.105 N/A ALA 60.A N VAL 186.A O no hydrogen 3.209 N/A HIS 61.A ND1 ASP 63.A O no hydrogen 3.069 N/A MET 62.A N SER 188.A O no hydrogen 2.771 N/A LYS 64.A N GLY 13.A O no hydrogen 3.074 N/A LYS 64.A NZ ILE 9.A O no hydrogen 3.301 N/A LYS 64.A NZ ALA 11.A O no hydrogen 3.097 N/A LYS 64.A NZ GLU 142.A OE1 no hydrogen 2.533 N/A GLY 66.A N ILE 83.A O no hydrogen 2.674 N/A VAL 67.A N GLY 141.A O no hydrogen 2.912 N/A MET 68.A N VAL 81.A O no hydrogen 2.824 N/A VAL 69.A N THR 139.A O no hydrogen 2.715 N/A ASN 70.A N HIS 79.A O no hydrogen 2.671 N/A HIS 71.A N HIS 79.A O no hydrogen 3.284 N/A ASP 73.A N TYR 77.A O no hydrogen 3.032 N/A GLY 76.A N ASP 73.A O no hydrogen 3.038 N/A TYR 77.A N ASP 73.A OD1 no hydrogen 3.029 N/A LEU 78.A N VAL 120.A O no hydrogen 2.847 N/A HIS 79.A N HIS 71.A O no hydrogen 2.950 N/A VAL 81.A N MET 68.A O no hydrogen 2.741 N/A ILE 83.A N GLY 66.A O no hydrogen 2.742 N/A VAL 86.A N GLY 84.A O no hydrogen 2.778 N/A THR 90.A N LEU 87.A O no hydrogen 2.816 N/A THR 90.A OG1 LEU 87.A O no hydrogen 2.871 N/A LEU 91.A N PRO 88.A O no hydrogen 3.066 N/A ILE 96.A N GLY 107.A O no hydrogen 2.852 N/A ARG 97.A N GLU 142.A O no hydrogen 2.886 N/A ARG 97.A NE GLU 104.A OE1 no hydrogen 2.690 N/A ARG 97.A NH1 GLU 10.A O no hydrogen 2.783 N/A ARG 97.A NH2 GLU 10.A O no hydrogen 3.527 N/A ARG 97.A NH2 GLU 104.A OE1 no hydrogen 3.177 N/A ARG 97.A NH2 GLU 104.A OE2 no hydrogen 3.535 N/A PHE 98.A N ARG 105.A O no hydrogen 2.826 N/A PHE 99.A N VAL 140.A O no hydrogen 3.055 N/A THR 100.A N GLY 103.A O no hydrogen 3.063 N/A THR 100.A OG1 GLY 103.A O no hydrogen 2.658 N/A GLU 101.A N GLY 134.A O no hydrogen 3.167 N/A LYS 102.A NZ GLU 132.A O no hydrogen 3.004 N/A GLY 103.A N THR 100.A O no hydrogen 3.086 N/A ARG 105.A N PHE 98.A O no hydrogen 2.935 N/A ARG 105.A NH1 MET 133.A O no hydrogen 2.640 N/A GLY 107.A N ILE 96.A O no hydrogen 3.075 N/A VAL 108.A N ASP 121.A O no hydrogen 2.909 N/A VAL 109.A N GLN 94.A O no hydrogen 3.040 N/A GLN 117.A N ASP 116.A OD1 no hydrogen 2.544 N/A ILE 118.A N TRP 115.A O no hydrogen 2.441 N/A VAL 120.A N LEU 78.A O no hydrogen 2.789 N/A ASP 121.A N VAL 108.A O no hydrogen 2.872 N/A GLY 123.A N ASP 121.A OD1 no hydrogen 3.027 N/A SER 125.A N GLU 129.A OE1 no hydrogen 2.527 N/A LYS 127.A N LYS 74.A O no hydrogen 3.171 N/A GLU 129.A N SER 126.A OG no hydrogen 2.972 N/A ALA 130.A N SER 126.A O no hydrogen 2.907 N/A GLU 131.A N LYS 127.A O no hydrogen 2.833 N/A GLU 132.A N GLU 128.A O no hydrogen 2.697 N/A MET 133.A N GLU 129.A O no hydrogen 2.890 N/A MET 133.A N ALA 130.A O no hydrogen 3.086 N/A GLY 134.A N GLU 131.A O no hydrogen 2.717 N/A PHE 135.A N ALA 130.A O no hydrogen 3.231 N/A ARG 136.A N THR 139.A OG1 no hydrogen 2.752 N/A GLY 138.A N VAL 69.A O no hydrogen 2.723 N/A THR 139.A N ARG 136.A O no hydrogen 2.915 N/A THR 139.A OG1 ARG 136.A O no hydrogen 2.649 N/A GLY 141.A N VAL 67.A O no hydrogen 2.873 N/A GLU 142.A N ARG 97.A O no hydrogen 2.965 N/A PHE 143.A N TYR 159.A OH no hydrogen 2.523 N/A ALA 144.A N ARG 95.A O no hydrogen 3.179 N/A THR 148.A N ALA 156.A O no hydrogen 2.798 N/A ARG 149.A NE ASN 151.A O no hydrogen 2.819 N/A ARG 149.A NH2 GLU 152.A O no hydrogen 2.576 N/A ASN 151.A N ARG 154.A O no hydrogen 3.244 N/A HIS 153.A N ASN 151.A OD1 no hydrogen 2.868 N/A ARG 154.A N ASN 151.A OD1 no hydrogen 2.875 N/A ARG 154.A NE ASP 305.A OD2 no hydrogen 2.921 N/A PHE 155.A N ALA 304.A O no hydrogen 3.195 N/A ALA 156.A N THR 148.A O no hydrogen 2.788 N/A THR 157.A N GLU 302.A O no hydrogen 2.925 N/A THR 157.A OG1 PRO 158.A O no hydrogen 3.118 N/A TYR 159.A OH ILE 65.A O no hydrogen 2.939 N/A ASP 161.A N GLU 302.A OE1 no hydrogen 2.893 N/A ARG 163.A NE MET 62.A O no hydrogen 2.783 N/A ARG 163.A NH1 ILE 8.A O no hydrogen 2.727 N/A ARG 163.A NH1 ALA 11.A O no hydrogen 2.663 N/A ARG 163.A NH2 ALA 11.A O no hydrogen 3.236 N/A ARG 163.A NH2 GLY 13.A O no hydrogen 3.209 N/A ARG 163.A NH2 MET 62.A O no hydrogen 2.761 N/A ILE 164.A N LEU 160.A O no hydrogen 2.916 N/A LEU 166.A N ASP 162.A O no hydrogen 3.003 N/A TYR 167.A N ARG 163.A O no hydrogen 2.832 N/A ALA 168.A N ILE 164.A O no hydrogen 2.945 N/A MET 169.A N CYS 165.A O no hydrogen 2.772 N/A ILE 170.A N LEU 166.A O no hydrogen 2.947 N/A GLU 171.A N TYR 167.A O no hydrogen 2.757 N/A ALA 172.A N ALA 168.A O no hydrogen 2.945 N/A ALA 173.A N MET 169.A O no hydrogen 2.899 N/A ARG 174.A N ILE 170.A O no hydrogen 2.883 N/A GLN 175.A N GLU 171.A O no hydrogen 3.043 N/A LEU 176.A N ALA 173.A O no hydrogen 3.177 N/A GLY 177.A N GLU 321.A OE2 no hydrogen 2.788 N/A HIS 179.A ND1 ALA 181.A O no hydrogen 2.632 N/A ASP 182.A N PRO 54.A O no hydrogen 2.871 N/A ILE 183.A N PHE 49.A O no hydrogen 2.924 N/A TYR 184.A N ILE 56.A O no hydrogen 2.895 N/A ILE 185.A N ALA 47.A O no hydrogen 2.852 N/A VAL 186.A N VAL 58.A O no hydrogen 2.793 N/A GLY 187.A N VAL 45.A O no hydrogen 2.675 N/A SER 188.A N ALA 60.A O no hydrogen 3.310 N/A SER 188.A OG ASP 274.A OD2 no hydrogen 3.144 N/A VAL 189.A N ASN 44.A OD1 no hydrogen 3.214 N/A GLN 190.A N GLU 18.A OE2 no hydrogen 3.071 N/A GLU 191.A N ASP 63.A OD1 no hydrogen 3.152 N/A GLU 192.A N ASP 63.A OD2 no hydrogen 2.822 N/A LEU 195.A N GLU 191.A O no hydrogen 3.170 N/A ARG 196.A N GLN 190.A O no hydrogen 3.279 N/A ARG 196.A NE GLN 190.A OE1 no hydrogen 3.325 N/A ARG 199.A N LEU 195.A O no hydrogen 3.467 N/A ALA 201.A N GLY 197.A O no hydrogen 3.134 N/A SER 202.A N ALA 198.A O no hydrogen 2.819 N/A SER 202.A OG ALA 198.A O no hydrogen 2.661 N/A SER 202.A OG ARG 199.A O no hydrogen 2.848 N/A TYR 203.A N ARG 199.A O no hydrogen 3.044 N/A ALA 204.A N VAL 200.A O no hydrogen 3.090 N/A ILE 205.A N ALA 201.A O no hydrogen 2.989 N/A ASN 206.A N SER 202.A O no hydrogen 2.715 N/A GLU 208.A N ARG 55.A O no hydrogen 2.865 N/A VAL 209.A N ARG 55.A O no hydrogen 3.142 N/A GLY 210.A N ALA 286.A O no hydrogen 2.957 N/A ILE 211.A N MET 57.A O no hydrogen 2.816 N/A ALA 212.A N ALA 288.A O no hydrogen 2.976 N/A MET 213.A N ALA 59.A O no hydrogen 3.022 N/A ASP 214.A N LEU 290.A O no hydrogen 3.269 N/A THR 216.A N ILE 292.A O no hydrogen 3.057 N/A THR 216.A OG1 GLU 265.A OE1 no hydrogen 3.102 N/A THR 216.A OG1 GLU 265.A OE2 no hydrogen 2.988 N/A ALA 218.A N ILE 294.A O no hydrogen 3.094 N/A LYS 219.A N PRO 229.A O no hydrogen 2.656 N/A LYS 219.A NZ GLN 220.A O no hydrogen 3.304 N/A GLN 220.A N ASP 223.A OD1 no hydrogen 2.978 N/A GLY 225.A N ASP 223.A OD2 no hydrogen 3.118 N/A LYS 226.A N ASP 223.A O no hydrogen 3.292 N/A GLU 230.A N GLN 263.A OE1 no hydrogen 2.926 N/A GLY 232.A N ASP 308.A OD2 no hydrogen 2.693 N/A LYS 233.A N GLU 230.A O no hydrogen 3.239 N/A LYS 233.A NZ GLU 230.A OE2 no hydrogen 2.872 N/A GLY 234.A N ASP 308.A OD1 no hydrogen 2.871 N/A VAL 236.A N SER 291.A O no hydrogen 2.731 N/A MET 237.A N GLN 263.A O no hydrogen 2.896 N/A VAL 239.A N GLU 265.A O no hydrogen 3.177 N/A ASN 242.A ND2 ALA 275.A O no hydrogen 3.250 N/A ILE 243.A N GLY 240.A O no hydrogen 3.045 N/A ASN 244.A N THR 287.A O no hydrogen 2.887 N/A LYS 246.A NZ THR 329.A O no hydrogen 2.908 N/A ARG 248.A N ASN 244.A O no hydrogen 2.944 N/A ARG 248.A NE ASP 238.A O no hydrogen 3.148 N/A ARG 248.A NH1 ARG 248.A O no hydrogen 3.341 N/A ARG 248.A NH1 ASP 252.A OD2 no hydrogen 3.136 N/A ARG 248.A NH2 MET 237.A O no hydrogen 2.878 N/A ALA 249.A N PRO 245.A O no hydrogen 2.934 N/A PHE 250.A N LYS 246.A O no hydrogen 3.125 N/A ALA 251.A N LEU 247.A O no hydrogen 3.152 N/A ASP 252.A N ARG 248.A O no hydrogen 3.214 N/A GLU 253.A N ALA 249.A O no hydrogen 3.118 N/A GLU 253.A N PHE 250.A O no hydrogen 2.617 N/A VAL 254.A N PHE 250.A O no hydrogen 2.904 N/A ALA 255.A N ALA 251.A O no hydrogen 2.908 N/A LYS 256.A N ASP 252.A O no hydrogen 3.376 N/A LYS 256.A NZ ASP 252.A O no hydrogen 3.040 N/A LYS 256.A NZ ASP 252.A OD2 no hydrogen 3.353 N/A LYS 257.A N GLU 253.A O no hydrogen 2.867 N/A LYS 257.A NZ GLU 322.A OE1 no hydrogen 2.494 N/A TYR 258.A N VAL 254.A O no hydrogen 2.935 N/A TYR 258.A OH GLU 322.A OE1 no hydrogen 2.571 N/A GLU 259.A N LYS 256.A O no hydrogen 3.175 N/A ILE 260.A N ALA 255.A O no hydrogen 2.964 N/A GLN 263.A N PRO 235.A O no hydrogen 2.773 N/A GLN 263.A NE2 GLU 230.A O no hydrogen 2.865 N/A GLN 263.A NE2 GLY 234.A O no hydrogen 2.909 N/A SER 267.A N VAL 239.A O no hydrogen 2.994 N/A ASN 276.A N THR 273.A O no hydrogen 2.885 N/A ASN 276.A ND2 THR 271.A O no hydrogen 3.033 N/A MET 278.A N ASP 274.A O no hydrogen 3.104 N/A ASN 281.A N MET 278.A O no hydrogen 3.210 N/A GLY 284.A N ASN 281.A O no hydrogen 3.218 N/A VAL 285.A N GLN 279.A O no hydrogen 2.866 N/A ALA 286.A N GLU 208.A O no hydrogen 3.180 N/A THR 287.A OG1 ASN 242.A O no hydrogen 3.022 N/A ALA 288.A N GLY 210.A O no hydrogen 3.107 N/A LEU 290.A N ALA 212.A O no hydrogen 2.804 N/A SER 291.A N VAL 236.A O no hydrogen 2.700 N/A SER 291.A OG ASP 214.A O no hydrogen 2.966 N/A ILE 292.A N ASP 214.A O no hydrogen 3.165 N/A ILE 294.A N THR 216.A O no hydrogen 2.797 N/A ARG 295.A N LEU 303.A O no hydrogen 2.918 N/A ARG 295.A NE LYS 219.A O no hydrogen 2.881 N/A TYR 296.A N GLN 220.A OE1 no hydrogen 2.933 N/A HIS 298.A N GLU 302.A OE2 no hydrogen 2.731 N/A SER 299.A OG TYR 296.A O no hydrogen 2.637 N/A GLN 300.A N GLN 300.A OE1 no hydrogen 2.690 N/A GLN 300.A NE2 THR 90.A O no hydrogen 2.682 N/A LEU 303.A N ARG 295.A O no hydrogen 3.065 N/A ALA 304.A N PHE 155.A O no hydrogen 3.034 N/A ALA 306.A N HIS 153.A O no hydrogen 2.859 N/A ARG 307.A N ASP 305.A OD1 no hydrogen 2.917 N/A ARG 307.A NE ASP 305.A OD1 no hydrogen 2.963 N/A ARG 307.A NH2 ASP 305.A OD2 no hydrogen 2.770 N/A ASP 308.A N ASP 305.A O no hydrogen 2.734 N/A VAL 309.A N ASP 305.A O no hydrogen 3.199 N/A ASP 310.A N ALA 306.A O no hydrogen 2.743 N/A ASN 311.A N ARG 307.A O no hydrogen 3.205 N/A THR 312.A N ASP 308.A O no hydrogen 2.897 N/A THR 312.A OG1 ASP 308.A O no hydrogen 2.833 N/A ILE 313.A N VAL 309.A O no hydrogen 3.206 N/A LYS 314.A N ASP 310.A O no hydrogen 3.062 N/A LYS 314.A NZ ASP 310.A OD2 no hydrogen 2.939 N/A LEU 315.A N ASN 311.A O no hydrogen 2.800 N/A ALA 316.A N THR 312.A O no hydrogen 2.862 N/A LYS 317.A N ILE 313.A O no hydrogen 3.164 N/A LYS 317.A NZ GLN 175.A O no hydrogen 2.595 N/A ALA 318.A N LYS 314.A O no hydrogen 3.118 N/A LEU 319.A N LEU 315.A O no hydrogen 2.977 N/A LEU 320.A N ALA 316.A O no hydrogen 3.103 N/A GLU 321.A N LYS 317.A O no hydrogen 3.021 N/A GLU 321.A N ALA 318.A O no hydrogen 3.265 N/A GLU 322.A N ALA 318.A O no hydrogen 2.938 N/A LEU 323.A N LEU 319.A O no hydrogen 2.988 N/A THR 329.A N ASP 327.A OD1 no hydrogen 3.147 N/A THR 329.A OG1 ASP 327.A OD1 no hydrogen 2.641 N/A