Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p91_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N LYS 95.A O no hydrogen 3.290 N/A PHE 4.A N VAL 94.A O no hydrogen 3.384 N/A HIS 5.A N GLN 63.A O no hydrogen 3.045 N/A HIS 5.A ND1 ASP 93.A OD2 no hydrogen 2.977 N/A HIS 5.A NE2 GLU 61.A OE2 no hydrogen 2.594 N/A ALA 6.A N LEU 92.A O no hydrogen 2.959 N/A LYS 7.A N GLU 61.A O no hydrogen 2.984 N/A PHE 8.A N LEU 90.A O no hydrogen 3.003 N/A LYS 9.A N ALA 58.A O no hydrogen 2.921 N/A LYS 9.A NZ ASP 57.A O no hydrogen 2.895 N/A LEU 13.A N GLU 10.A O no hydrogen 3.323 N/A LYS 15.A N ALA 11.A O no hydrogen 3.308 N/A LYS 15.A NZ LEU 84.A O no hydrogen 2.580 N/A ARG 16.A N ALA 12.A O no hydrogen 2.866 N/A VAL 17.A N LEU 13.A O no hydrogen 2.944 N/A VAL 18.A N PHE 14.A O no hydrogen 3.034 N/A GLU 19.A N LYS 15.A O no hydrogen 3.090 N/A SER 20.A N ARG 16.A O no hydrogen 3.072 N/A SER 20.A OG ARG 16.A O no hydrogen 2.732 N/A LEU 21.A N VAL 17.A O no hydrogen 2.841 N/A LYS 22.A N VAL 18.A O no hydrogen 3.001 N/A LYS 22.A N GLU 19.A O no hydrogen 3.070 N/A LYS 22.A NZ GLU 19.A OE2 no hydrogen 3.043 N/A SER 23.A N GLU 19.A O no hydrogen 3.284 N/A SER 23.A OG GLU 19.A O no hydrogen 3.375 N/A THR 24.A N LEU 21.A O no hydrogen 3.070 N/A THR 24.A OG1 LEU 21.A O no hydrogen 3.147 N/A ILE 25.A N LEU 21.A O no hydrogen 3.029 N/A THR 28.A N ILE 72.A O no hydrogen 2.942 N/A ASN 29.A ND2 ILE 120.A O no hydrogen 3.389 N/A PHE 30.A N LEU 70.A O no hydrogen 2.778 N/A ASP 31.A N ALA 38.A O no hydrogen 2.974 N/A CYS 32.A N ILE 68.A O no hydrogen 2.739 N/A CYS 32.A SG PHE 30.A O no hydrogen 3.835 N/A SER 33.A N GLY 36.A O no hydrogen 3.032 N/A ALA 35.A N SER 33.A OG no hydrogen 3.122 N/A GLY 36.A N SER 33.A O no hydrogen 3.102 N/A ILE 37.A N ILE 54.A O no hydrogen 2.936 N/A ALA 38.A N ASP 31.A O no hydrogen 2.993 N/A VAL 39.A N LEU 52.A O no hydrogen 2.950 N/A CYS 41.A N VAL 50.A O no hydrogen 3.138 N/A CYS 41.A SG THR 28.A OG1 no hydrogen 3.366 N/A CYS 41.A SG MET 42.A O no hydrogen 3.707 N/A ASP 43.A N SER 48.A O no hydrogen 3.016 N/A ASN 44.A N THR 24.A O no hydrogen 2.907 N/A ASN 44.A ND2 ASP 26.A OD2 no hydrogen 3.424 N/A SER 45.A N ASP 43.A OD1 no hydrogen 3.107 N/A HIS 46.A N ASP 43.A O no hydrogen 2.979 N/A HIS 46.A ND1 ASP 43.A O no hydrogen 3.243 N/A VAL 47.A N ASP 43.A OD2 no hydrogen 2.592 N/A SER 48.A N ASP 43.A OD2 no hydrogen 2.962 N/A SER 48.A OG GLN 202.A OE1 no hydrogen 3.140 N/A LEU 49.A N TYR 240.A O no hydrogen 3.104 N/A VAL 50.A N CYS 41.A O no hydrogen 2.697 N/A SER 51.A N LYS 238.A O no hydrogen 2.817 N/A LEU 52.A N VAL 39.A O no hydrogen 2.694 N/A LEU 53.A N VAL 236.A O no hydrogen 3.108 N/A ILE 54.A N ILE 37.A O no hydrogen 2.767 N/A GLU 55.A N ALA 234.A O no hydrogen 2.972 N/A ALA 58.A N GLU 55.A O no hydrogen 3.082 N/A PHE 59.A N THR 56.A O no hydrogen 3.234 N/A ASP 60.A N LYS 7.A O no hydrogen 2.823 N/A GLU 61.A N LYS 7.A O no hydrogen 3.442 N/A GLN 63.A N HIS 5.A O no hydrogen 2.900 N/A CYS 64.A SG LYS 66.A O no hydrogen 3.437 N/A ILE 68.A N CYS 32.A O no hydrogen 3.022 N/A LEU 70.A N PHE 30.A O no hydrogen 2.727 N/A ILE 72.A N THR 28.A O no hydrogen 2.842 N/A LEU 74.A N ASP 26.A O no hydrogen 2.760 N/A HIS 76.A N ASN 73.A OD1 no hydrogen 3.024 N/A LEU 77.A N ASN 73.A O no hydrogen 3.119 N/A SER 78.A N LEU 74.A O no hydrogen 3.004 N/A SER 78.A OG THR 75.A O no hydrogen 3.494 N/A LYS 79.A N THR 75.A O no hydrogen 3.353 N/A ILE 80.A N HIS 76.A O no hydrogen 3.332 N/A LEU 81.A N LEU 77.A O no hydrogen 2.867 N/A LYS 82.A N SER 78.A O no hydrogen 2.690 N/A ALA 83.A N ILE 80.A O no hydrogen 3.105 N/A LEU 84.A N LEU 81.A O no hydrogen 3.013 N/A CYS 88.A N ASP 85.A O no hydrogen 3.194 N/A CYS 88.A SG ASP 85.A O no hydrogen 3.459 N/A CYS 88.A SG THR 105.A OG1 no hydrogen 3.596 N/A GLY 89.A N SER 106.A O no hydrogen 3.330 N/A ILE 91.A N ILE 104.A O no hydrogen 2.930 N/A LEU 92.A N ALA 6.A O no hydrogen 2.720 N/A ASP 93.A N LEU 102.A O no hydrogen 2.848 N/A VAL 94.A N PHE 4.A O no hydrogen 2.923 N/A VAL 101.A N LEU 115.A O no hydrogen 2.953 N/A LEU 102.A N ASP 93.A O no hydrogen 2.836 N/A SER 103.A N PHE 113.A O no hydrogen 3.056 N/A ILE 104.A N ILE 91.A O no hydrogen 2.829 N/A THR 105.A N MET 111.A O no hydrogen 2.893 N/A SER 106.A N GLY 89.A O no hydrogen 3.213 N/A GLU 107.A N LYS 109.A O no hydrogen 2.643 N/A MET 111.A N THR 105.A O no hydrogen 2.914 N/A PHE 113.A N SER 103.A O no hydrogen 2.912 N/A LEU 115.A N VAL 101.A O no hydrogen 3.045 N/A LEU 117.A N ASP 99.A O no hydrogen 2.770 N/A VAL 118.A N GLY 71.A O no hydrogen 2.702 N/A ASP 133.A N LEU 220.A O no hydrogen 2.744 N/A ALA 134.A N LEU 220.A O no hydrogen 3.206 N/A ILE 135.A N GLU 189.A O no hydrogen 2.922 N/A ILE 136.A N LEU 218.A O no hydrogen 2.762 N/A THR 137.A N GLN 187.A O no hydrogen 2.883 N/A LEU 138.A N VAL 216.A O no hydrogen 3.227 N/A SER 140.A N ASP 214.A O no hydrogen 2.873 N/A SER 140.A OG ALA 210.A O no hydrogen 3.399 N/A SER 140.A OG ALA 213.A O no hydrogen 2.628 N/A SER 140.A OG ASP 214.A O no hydrogen 2.866 N/A GLU 142.A N SER 139.A OG no hydrogen 3.160 N/A PHE 143.A N SER 139.A O no hydrogen 3.007 N/A LEU 144.A N SER 140.A O no hydrogen 2.918 N/A LYS 145.A N ALA 141.A O no hydrogen 3.094 N/A LYS 145.A NZ ASP 149.A OD1 no hydrogen 3.061 N/A ILE 146.A N GLU 142.A O no hydrogen 3.223 N/A THR 147.A N PHE 143.A O no hydrogen 3.118 N/A THR 147.A OG1 LEU 144.A O no hydrogen 2.668 N/A LYS 148.A N LEU 144.A O no hydrogen 2.923 N/A ASP 149.A N LYS 145.A O no hydrogen 2.926 N/A PHE 150.A N ILE 146.A O no hydrogen 2.908 N/A SER 151.A N THR 147.A O no hydrogen 2.922 N/A SER 151.A OG THR 147.A O no hydrogen 2.745 N/A ALA 152.A N LYS 148.A O no hydrogen 3.319 N/A LEU 153.A N ASP 149.A O no hydrogen 2.952 N/A GLY 154.A N PHE 150.A O no hydrogen 2.565 N/A SER 157.A N ASP 155.A OD1 no hydrogen 3.204 N/A ILE 158.A N PHE 198.A O no hydrogen 3.035 N/A THR 159.A N THR 170.A O no hydrogen 2.628 N/A THR 159.A OG1 SER 197.A OG no hydrogen 2.847 N/A ILE 160.A N ALA 196.A O no hydrogen 3.039 N/A GLY 161.A N THR 168.A O no hydrogen 2.752 N/A CYS 162.A N VAL 194.A O no hydrogen 2.800 N/A CYS 162.A SG THR 163.A O no hydrogen 3.586 N/A THR 163.A N GLU 166.A O no hydrogen 2.842 N/A THR 163.A OG1 GLU 166.A O no hydrogen 3.340 N/A GLU 166.A N THR 163.A OG1 no hydrogen 3.314 N/A VAL 167.A N LEU 182.A O no hydrogen 2.848 N/A THR 168.A N GLY 161.A O no hydrogen 2.816 N/A LEU 169.A N MET 180.A O no hydrogen 2.972 N/A THR 170.A N THR 159.A O no hydrogen 2.756 N/A THR 171.A N THR 178.A O no hydrogen 3.283 N/A THR 171.A OG1 ASP 155.A OD1 no hydrogen 3.422 N/A THR 171.A OG1 SER 157.A O no hydrogen 2.749 N/A GLY 173.A N CYS 176.A O no hydrogen 2.545 N/A CYS 176.A SG THR 178.A OG1 no hydrogen 3.413 N/A THR 178.A N THR 171.A O no hydrogen 2.757 N/A MET 180.A N LEU 169.A O no hydrogen 3.007 N/A LEU 182.A N VAL 167.A O no hydrogen 2.942 N/A ALA 184.A N ASN 165.A O no hydrogen 3.015 N/A GLN 187.A N THR 137.A O no hydrogen 2.716 N/A GLU 189.A N ILE 135.A O no hydrogen 3.028 N/A HIS 190.A NE2 ASP 193.A OD2 no hydrogen 2.605 N/A ASN 191.A N ASP 133.A O no hydrogen 3.264 N/A LYS 192.A N ASP 133.A O no hydrogen 3.152 N/A VAL 194.A N CYS 162.A O no hydrogen 3.218 N/A ALA 196.A N ILE 160.A O no hydrogen 3.169 N/A SER 197.A OG THR 159.A OG1 no hydrogen 2.847 N/A PHE 198.A N ILE 158.A O no hydrogen 3.034 N/A LEU 200.A N ASP 156.A O no hydrogen 2.830 N/A GLN 202.A NE2 ASP 43.A OD1 no hydrogen 3.438 N/A ILE 203.A N ALA 199.A O no hydrogen 3.294 N/A SER 204.A N LEU 200.A O no hydrogen 2.841 N/A SER 204.A OG LEU 200.A O no hydrogen 3.047 N/A SER 204.A OG LYS 201.A O no hydrogen 3.108 N/A GLU 205.A N LYS 201.A O no hydrogen 3.004 N/A PHE 206.A N GLN 202.A O no hydrogen 2.677 N/A ALA 207.A N ILE 203.A O no hydrogen 2.742 N/A LYS 208.A N GLU 205.A O no hydrogen 3.345 N/A SER 209.A N PHE 206.A O no hydrogen 3.031 N/A SER 209.A OG PHE 206.A O no hydrogen 3.120 N/A ALA 210.A N ALA 207.A O no hydrogen 3.192 N/A LEU 212.A N SER 209.A O no hydrogen 2.939 N/A ALA 213.A N ALA 210.A O no hydrogen 2.978 N/A VAL 216.A N LEU 138.A O no hydrogen 2.723 N/A LYS 217.A N GLU 229.A O no hydrogen 3.065 N/A LEU 218.A N ILE 136.A O no hydrogen 2.818 N/A SER 219.A N ILE 227.A O no hydrogen 2.785 N/A LEU 220.A N ALA 134.A O no hydrogen 2.721 N/A LEU 226.A N LEU 241.A O no hydrogen 2.676 N/A ILE 227.A N SER 219.A O no hydrogen 3.027 N/A MET 228.A N PHE 239.A O no hydrogen 3.068 N/A GLU 229.A N LYS 217.A O no hydrogen 2.754 N/A PHE 230.A N LEU 237.A O no hydrogen 2.687 N/A GLY 232.A N CYS 235.A O no hydrogen 2.735 N/A VAL 236.A N LEU 53.A O no hydrogen 3.118 N/A LEU 237.A N PHE 230.A O no hydrogen 2.840 N/A LYS 238.A N SER 51.A O no hydrogen 2.903 N/A PHE 239.A N MET 228.A O no hydrogen 3.017 N/A TYR 240.A N LEU 49.A O no hydrogen 2.938 N/A LEU 241.A N LEU 226.A O no hydrogen 3.055 N/A LYS 244.A N SER 197.A O no hydrogen 2.648 N/A