Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1oe5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N PRO 2.A O no hydrogen 2.618 N/A LEU 7.A N ALA 3.A O no hydrogen 2.894 N/A LYS 8.A N ASP 4.A O no hydrogen 3.008 N/A VAL 9.A N SER 5.A O no hydrogen 2.988 N/A GLU 10.A N PHE 6.A O no hydrogen 3.133 N/A LEU 11.A N LEU 7.A O no hydrogen 2.795 N/A GLU 12.A N LYS 8.A O no hydrogen 2.863 N/A LEU 13.A N VAL 9.A O no hydrogen 2.805 N/A ASN 14.A N GLU 10.A O no hydrogen 2.730 N/A LEU 15.A N LEU 11.A O no hydrogen 3.038 N/A LYS 16.A N GLU 12.A O no hydrogen 3.069 N/A LEU 17.A N LEU 13.A O no hydrogen 2.855 N/A SER 18.A N ASN 14.A O no hydrogen 2.793 N/A SER 18.A N LEU 15.A O no hydrogen 3.195 N/A SER 18.A OG LEU 15.A O no hydrogen 2.983 N/A LEU 20.A N LEU 17.A O no hydrogen 2.981 N/A GLN 23.A N GLN 161.A OE1 no hydrogen 2.840 N/A VAL 26.A N GLN 23.A O no hydrogen 2.851 N/A GLN 27.A N MET 145.A O no hydrogen 2.813 N/A GLN 27.A NE2 VAL 26.A O no hydrogen 3.224 N/A TYR 28.A N MET 145.A O no hydrogen 3.131 N/A TYR 30.A N ILE 143.A O no hydrogen 2.909 N/A TYR 30.A OH ARG 99.A O no hydrogen 2.451 N/A VAL 34.A N ASN 31.A O no hydrogen 2.750 N/A TYR 35.A OH ALA 67.A O no hydrogen 2.733 N/A ALA 36.A N PRO 32.A O no hydrogen 2.763 N/A TRP 37.A N VAL 34.A O no hydrogen 3.350 N/A HIS 40.A N ALA 36.A O no hydrogen 3.192 N/A HIS 40.A ND1 GLY 70.A O no hydrogen 2.712 N/A HIS 40.A NE2 GLU 10.A OE1 no hydrogen 2.409 N/A GLU 41.A N TRP 37.A O no hydrogen 2.750 N/A ASN 42.A N ALA 38.A O no hydrogen 2.940 N/A ASN 42.A ND2.A GLU 86.A O no hydrogen 3.137 N/A TYR 43.A N PRO 39.A O no hydrogen 2.952 N/A TYR 43.A OH VAL 136.A O no hydrogen 2.947 N/A VAL 44.A N HIS 40.A O no hydrogen 2.942 N/A GLN 45.A N GLU 41.A O no hydrogen 2.886 N/A THR 46.A N ASN 42.A O.A no hydrogen 2.874 N/A THR 46.A N ASN 42.A O.B no hydrogen 2.892 N/A THR 46.A OG1 ASN 42.A O.A no hydrogen 2.632 N/A THR 46.A OG1 ASN 42.A O.B no hydrogen 2.613 N/A THR 46.A OG1 ASN 42.A OD1.A no hydrogen 3.016 N/A TYR 47.A N TYR 43.A O no hydrogen 2.851 N/A TYR 47.A N VAL 44.A O no hydrogen 3.164 N/A TYR 47.A OH LEU 83.A O no hydrogen 2.481 N/A CYS 48.A N VAL 44.A O no hydrogen 2.729 N/A SER 50.A OG LYS 51.A O no hydrogen 2.850 N/A LYS 52.A N LEU 180.A O no hydrogen 2.799 N/A LYS 52.A NZ TYR 47.A O no hydrogen 2.701 N/A LYS 52.A NZ PHE 131.A O no hydrogen 2.955 N/A GLU 53.A N HIS 133.A O no hydrogen 2.870 N/A VAL 54.A N HIS 133.A O no hydrogen 2.984 N/A LEU 55.A N LEU 184.A O no hydrogen 2.789 N/A PHE 56.A N PHE 135.A O no hydrogen 2.861 N/A LEU 57.A N ILE 186.A O no hydrogen 2.815 N/A GLY 58.A N HIS 137.A O no hydrogen 2.676 N/A ASN 60.A ND2 LEU 142.A O no hydrogen 2.748 N/A PHE 64.A N GLU 110.A OE1 no hydrogen 3.044 N/A GLY 65.A N GLY 62.A O no hydrogen 3.327 N/A ALA 67.A N GLY 62.A O no hydrogen 3.216 N/A GLN 68.A N GLY 65.A O no hydrogen 2.726 N/A GLN 68.A NE2 PRO 63.A O no hydrogen 2.914 N/A THR 69.A N GLY 65.A O no hydrogen 2.793 N/A THR 69.A OG1 GLY 65.A O no hydrogen 3.258 N/A THR 69.A OG1 GLY 74.A O no hydrogen 2.783 N/A GLY 70.A N MET 66.A O no hydrogen 2.856 N/A GLU 75.A N PHE 73.A O no hydrogen 2.860 N/A HIS 78.A N GLU 75.A OE1 no hydrogen 2.890 N/A VAL 79.A N GLU 75.A O no hydrogen 2.910 N/A ARG 80.A N VAL 76.A O no hydrogen 2.813 N/A ARG 80.A NE GLU 86.A OE1 no hydrogen 3.207 N/A ARG 80.A NH2 GLU 86.A OE2 no hydrogen 3.433 N/A ASP 81.A N ASN 77.A O no hydrogen 2.890 N/A TRP 82.A N HIS 78.A O no hydrogen 2.935 N/A TRP 82.A NE1 GLY 125.A O no hydrogen 2.886 N/A LEU 83.A N HIS 78.A O no hydrogen 3.259 N/A GLN 84.A N VAL 79.A O no hydrogen 2.773 N/A ILE 85.A N VAL 79.A O no hydrogen 3.336 N/A SER 90.A N TYR 35.A O no hydrogen 2.752 N/A LYS 91.A NZ PRO 92.A O no hydrogen 3.114 N/A LYS 91.A NZ GLU 93.A O no hydrogen 3.441 N/A HIS 96.A NE2 HIS 147.A O no hydrogen 2.671 N/A LYS 98.A N HIS 96.A ND1 no hydrogen 3.105 N/A LYS 98.A NZ SER 148.A O no hydrogen 3.357 N/A ARG 99.A N HIS 96.A O no hydrogen 2.816 N/A ARG 99.A NH1 LYS 98.A O no hydrogen 2.832 N/A ILE 101.A N GLU 95.A OE2 no hydrogen 2.779 N/A ARG 102.A N GLN 68.A OE1 no hydrogen 2.929 N/A ARG 102.A NH2 GLU 105.A OE1 no hydrogen 2.909 N/A GLY 103.A N GLN 68.A OE1 no hydrogen 3.037 N/A GLU 105.A N ARG 102.A O no hydrogen 3.088 N/A CYS 106.A N GLY 103.A O no hydrogen 2.916 N/A CYS 106.A SG GLN 108.A O no hydrogen 3.891 N/A CYS 106.A SG GLN 108.A OE1 no hydrogen 3.380 N/A GLN 108.A N GLN 108.A OE1 no hydrogen 2.970 N/A SER 109.A OG GLU 75.A OE2 no hydrogen 2.983 N/A ALA 114.A N GLU 110.A O no hydrogen 2.983 N/A ARG 115.A N VAL 111.A O no hydrogen 3.034 N/A ARG 115.A NH1 PRO 215.A O no hydrogen 2.750 N/A ARG 115.A NH1 ASN 223.A OD1 no hydrogen 3.020 N/A ARG 115.A NH2 ASN 223.A OD1 no hydrogen 3.178 N/A PHE 116.A N SER 112.A O no hydrogen 3.072 N/A TRP 117.A N GLY 113.A O no hydrogen 3.035 N/A TRP 117.A NE1 PRO 72.A O no hydrogen 3.181 N/A SER 118.A N ALA 114.A O no hydrogen 2.768 N/A LEU 119.A N ARG 115.A O no hydrogen 2.986 N/A PHE 120.A N PHE 116.A O no hydrogen 3.435 N/A LYS 121.A N TRP 117.A O no hydrogen 2.803 N/A SER 122.A N SER 118.A O no hydrogen 2.974 N/A SER 122.A OG SER 118.A O no hydrogen 3.250 N/A LEU 123.A N LEU 119.A O no hydrogen 2.995 N/A CYS 124.A N PHE 120.A O no hydrogen 2.837 N/A CYS 124.A SG LEU 243.A O no hydrogen 3.507 N/A GLY 125.A N LYS 121.A O no hydrogen 2.911 N/A GLN 126.A N CYS 124.A O no hydrogen 2.984 N/A GLU 128.A N GLU 128.A OE1 no hydrogen 2.746 N/A THR 129.A N GLN 126.A O no hydrogen 3.108 N/A PHE 131.A N PRO 127.A O no hydrogen 2.885 N/A LYS 132.A N GLU 128.A O no hydrogen 2.820 N/A PHE 135.A N VAL 54.A O no hydrogen 2.968 N/A HIS 137.A N PHE 56.A O no hydrogen 2.815 N/A HIS 139.A N GLY 58.A O no hydrogen 2.858 N/A HIS 139.A NE2 ASP 170.A OD1 no hydrogen 2.905 N/A CYS 140.A N MET 59.A O no hydrogen 3.021 N/A CYS 140.A SG LEU 142.A O no hydrogen 3.824 N/A ILE 143.A N TYR 30.A O no hydrogen 2.888 N/A MET 145.A N TYR 28.A O no hydrogen 2.899 N/A ASN 146.A N LYS 150.A O no hydrogen 3.015 N/A SER 148.A N ASN 146.A OD1 no hydrogen 3.131 N/A SER 148.A OG ASN 146.A OD1 no hydrogen 3.309 N/A GLY 149.A N ASN 146.A O no hydrogen 2.952 N/A LYS 150.A N ASN 146.A OD1 no hydrogen 2.845 N/A LEU 152.A N PHE 144.A O no hydrogen 2.777 N/A THR 153.A N ASP 156.A OD2 no hydrogen 3.232 N/A THR 153.A OG1 ASP 156.A OD2 no hydrogen 3.352 N/A ASP 156.A N THR 153.A O no hydrogen 2.834 N/A LEU 157.A N PRO 154.A O no hydrogen 3.084 N/A LYS 159.A NZ ASP 163.A OD2 no hydrogen 2.816 N/A GLN 161.A NE2 GLN 23.A O no hydrogen 2.793 N/A ARG 162.A N PRO 158.A O no hydrogen 3.002 N/A ARG 162.A NH1 LEU 157.A O no hydrogen 2.655 N/A ASP 163.A N LYS 159.A O no hydrogen 3.069 N/A THR 164.A OG1 ALA 160.A O no hydrogen 2.491 N/A LEU 166.A N ARG 162.A O no hydrogen 2.850 N/A GLU 167.A N ASP 163.A O no hydrogen 3.066 N/A ILE 168.A N THR 164.A O no hydrogen 3.374 N/A CYS 169.A N LEU 165.A O no hydrogen 3.043 N/A CYS 169.A SG LEU 165.A O no hydrogen 3.355 N/A ASP 170.A N LEU 166.A O no hydrogen 2.853 N/A GLU 171.A N GLU 167.A O no hydrogen 3.269 N/A ALA 172.A N ILE 168.A O no hydrogen 3.185 N/A LEU 173.A N CYS 169.A O no hydrogen 2.748 N/A CYS 174.A N ASP 170.A O no hydrogen 3.040 N/A CYS 174.A SG ASP 170.A O no hydrogen 3.468 N/A CYS 174.A SG ALA 199.A O no hydrogen 3.659 N/A GLN 175.A N GLU 171.A O no hydrogen 3.089 N/A ALA 176.A N ALA 172.A O no hydrogen 2.870 N/A VAL 177.A N LEU 173.A O no hydrogen 2.827 N/A ARG 178.A N CYS 174.A O no hydrogen 3.056 N/A VAL 179.A N GLN 175.A O no hydrogen 2.893 N/A LEU 180.A N ALA 176.A O no hydrogen 3.120 N/A GLY 181.A N ARG 178.A O no hydrogen 3.327 N/A VAL 182.A N VAL 177.A O no hydrogen 3.292 N/A LYS 183.A N GLU 53.A O no hydrogen 2.924 N/A LYS 183.A NZ GLY 181.A O no hydrogen 3.512 N/A LEU 184.A N GLU 53.A O no hydrogen 2.864 N/A VAL 185.A N THR 208.A O no hydrogen 2.812 N/A ILE 186.A N LEU 55.A O no hydrogen 2.753 N/A GLY 187.A N LYS 210.A O no hydrogen 2.917 N/A VAL 188.A N LEU 57.A O no hydrogen 2.845 N/A GLY 189.A N ILE 212.A O no hydrogen 2.954 N/A SER 192.A OG LEU 57.A O no hydrogen 3.334 N/A GLU 193.A N GLY 189.A O no hydrogen 3.137 N/A GLN 194.A N ARG 190.A O no hydrogen 2.898 N/A GLN 194.A NE2 ARG 190.A O no hydrogen 2.898 N/A ARG 195.A N PHE 191.A O no hydrogen 2.947 N/A ARG 195.A NE ASP 170.A OD1 no hydrogen 2.981 N/A ARG 195.A NE ASP 170.A OD2 no hydrogen 3.260 N/A ARG 195.A NH2 ASP 170.A OD2 no hydrogen 2.813 N/A ALA 196.A N SER 192.A O no hydrogen 2.764 N/A ARG 197.A N GLU 193.A O no hydrogen 2.863 N/A ARG 197.A NH1 GLU 193.A OE2 no hydrogen 3.321 N/A ARG 197.A NH2 GLU 193.A OE2 no hydrogen 2.566 N/A ARG 197.A NH2 VAL 209.A O no hydrogen 2.763 N/A LYS 198.A N GLN 194.A O no hydrogen 3.028 N/A LYS 198.A NZ GLN 194.A O no hydrogen 3.319 N/A ALA 199.A N ARG 195.A O no hydrogen 2.954 N/A LEU 200.A N ALA 196.A O no hydrogen 2.781 N/A MET 201.A N ARG 197.A O no hydrogen 2.889 N/A ALA 202.A N LYS 198.A O no hydrogen 3.090 N/A GLU 203.A N LEU 200.A O no hydrogen 3.133 N/A GLY 204.A N MET 201.A O no hydrogen 2.870 N/A ILE 205.A N LEU 200.A O no hydrogen 3.340 N/A THR 208.A N LYS 183.A O no hydrogen 2.887 N/A LYS 210.A N VAL 185.A O no hydrogen 2.852 N/A ILE 212.A N GLY 187.A O no hydrogen 2.958 N/A MET 213.A N GLN 233.A OE1 no hydrogen 2.884 N/A SER 216.A N HIS 214.A ND1 no hydrogen 3.046 N/A ARG 218.A N SER 216.A OG no hydrogen 2.921 N/A ASN 219.A N SER 216.A O no hydrogen 3.044 N/A ASN 219.A ND2 HIS 214.A O no hydrogen 3.045 N/A GLN 221.A N ASN 219.A OD1 no hydrogen 3.138 N/A ALA 222.A N ASN 219.A O no hydrogen 2.788 N/A ASN 223.A N PRO 220.A O no hydrogen 3.334 N/A ASN 223.A ND2 PRO 217.A O no hydrogen 3.067 N/A TRP 226.A NE1 MET 213.A O no hydrogen 2.920 N/A ILE 229.A N GLY 225.A O no hydrogen 2.840 N/A VAL 230.A N TRP 226.A O no hydrogen 2.770 N/A ARG 231.A N GLU 227.A O no hydrogen 2.717 N/A ARG 231.A NE GLU 227.A OE2 no hydrogen 3.205 N/A GLY 232.A N GLY 228.A O no hydrogen 3.225 N/A GLN 233.A N ILE 229.A O no hydrogen 2.917 N/A LEU 234.A N VAL 230.A O no hydrogen 2.789 N/A LEU 235.A N ARG 231.A O no hydrogen 3.094 N/A GLU 236.A N GLY 232.A O no hydrogen 3.130 N/A LEU 237.A N GLN 233.A O no hydrogen 3.087 N/A GLY 238.A N LEU 235.A O no hydrogen 2.785 N/A VAL 239.A N LEU 234.A O no hydrogen 3.028 N/A LEU 243.A N LEU 240.A O no hydrogen 2.868 N/A THR 244.A OG1 LEU 240.A O no hydrogen 3.388 N/A