Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6aqu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ILE 8.A O no hydrogen 3.096 N/A ARG 4.A N GLU 72.A OE1 no hydrogen 3.031 N/A HIS 5.A N GLU 72.A OE1 no hydrogen 3.261 N/A HIS 5.A N GLU 72.A OE2 no hydrogen 3.062 N/A LYS 7.A N LEU 3.A O no hydrogen 3.317 N/A LYS 7.A NZ ARG 4.A O no hydrogen 3.359 N/A SER 9.A N GLN 12.A OE1 no hydrogen 2.694 N/A SER 9.A OG ASN 1.A O no hydrogen 3.543 N/A THR 14.A OG1 VAL 16.A O no hydrogen 2.578 N/A VAL 17.A N VAL 80.A O no hydrogen 2.979 N/A LEU 18.A N LEU 58.A O no hydrogen 2.876 N/A VAL 19.A N ILE 82.A O no hydrogen 2.703 N/A VAL 20.A N VAL 60.A O no hydrogen 2.927 N/A ARG 25.A N ASP 22.A O no hydrogen 3.150 N/A ASP 27.A N PRO 23.A O no hydrogen 3.472 N/A LYS 28.A N GLY 24.A O no hydrogen 3.013 N/A ILE 29.A N VAL 26.A O no hydrogen 3.146 N/A LYS 30.A N VAL 26.A O no hydrogen 3.072 N/A LYS 30.A NZ ASP 27.A OD1 no hydrogen 2.884 N/A LYS 30.A NZ ASP 38.A OD1 no hydrogen 3.352 N/A CYS 33.A N ILE 29.A O no hydrogen 3.208 N/A CYS 33.A N LYS 30.A O no hydrogen 3.182 N/A CYS 33.A SG ILE 29.A O no hydrogen 3.398 N/A ASP 34.A N HIS 51.A O no hydrogen 3.080 N/A SER 35.A N HIS 51.A O no hydrogen 3.295 N/A VAL 37.A N GLU 49.A O no hydrogen 2.899 N/A LEU 39.A N SER 47.A O no hydrogen 2.791 N/A ALA 40.A N SER 47.A O no hydrogen 3.333 N/A ASN 42.A ND2 HIS 5.A O no hydrogen 3.196 N/A GLU 44.A N ASN 42.A O no hydrogen 2.594 N/A TYR 45.A N ASN 42.A O no hydrogen 3.070 N/A TYR 45.A OH GLY 65.A O no hydrogen 3.088 N/A LYS 46.A N SER 61.A OG no hydrogen 2.991 N/A LYS 46.A NZ ASP 38.A OD1 no hydrogen 2.864 N/A SER 47.A N ALA 40.A O no hydrogen 3.113 N/A VAL 48.A N CYS 59.A O no hydrogen 2.882 N/A GLU 49.A N VAL 37.A O no hydrogen 2.658 N/A CYS 50.A N PHE 57.A O no hydrogen 2.839 N/A HIS 51.A N SER 35.A O no hydrogen 2.876 N/A TYR 52.A N GLN 55.A O no hydrogen 2.911 N/A GLN 55.A N TYR 52.A O no hydrogen 2.883 N/A LYS 56.A NZ GLU 49.A OE2 no hydrogen 2.839 N/A PHE 57.A N CYS 50.A O no hydrogen 3.004 N/A LEU 58.A N THR 14.A OG1 no hydrogen 2.751 N/A CYS 59.A N VAL 48.A O no hydrogen 2.837 N/A CYS 59.A SG LEU 18.A O no hydrogen 3.815 N/A VAL 60.A N LEU 18.A O no hydrogen 2.935 N/A SER 61.A N LYS 46.A O no hydrogen 2.923 N/A SER 61.A OG GLU 44.A O no hydrogen 3.516 N/A SER 61.A OG LYS 46.A O no hydrogen 3.529 N/A HIS 62.A NE2 GLU 172.A OE1 no hydrogen 2.545 N/A GLY 63.A N GLY 21.A O no hydrogen 3.000 N/A CYS 69.A N GLY 65.A O no hydrogen 3.170 N/A PHE 70.A N CYS 66.A O no hydrogen 2.737 N/A GLU 71.A N ALA 67.A O no hydrogen 2.795 N/A GLU 72.A N VAL 68.A O no hydrogen 2.777 N/A LEU 73.A N CYS 69.A O no hydrogen 3.033 N/A CYS 74.A N PHE 70.A O no hydrogen 2.918 N/A CYS 74.A SG PHE 70.A O no hydrogen 3.246 N/A GLN 75.A N GLU 71.A O no hydrogen 2.902 N/A GLN 75.A NE2 GLU 71.A OE2 no hydrogen 2.746 N/A ASN 76.A N GLU 72.A O no hydrogen 3.174 N/A ALA 78.A N LEU 73.A O no hydrogen 3.137 N/A LYS 79.A N PRO 15.A O no hydrogen 2.689 N/A VAL 80.A N PRO 15.A O no hydrogen 2.896 N/A ILE 81.A N LYS 186.A O no hydrogen 2.837 N/A ILE 82.A N VAL 17.A O no hydrogen 3.041 N/A ARG 83.A N GLY 188.A O no hydrogen 3.061 N/A ARG 83.A NE GLU 172.A OE1 no hydrogen 2.859 N/A ARG 83.A NH2 GLU 172.A OE1 no hydrogen 3.537 N/A ALA 84.A N VAL 19.A O no hydrogen 3.056 N/A GLY 85.A N ILE 190.A O no hydrogen 3.200 N/A CYS 87.A N ILE 192.A O no hydrogen 3.023 N/A CYS 87.A SG ILE 192.A O no hydrogen 3.738 N/A GLY 88.A N VAL 169.A O no hydrogen 2.806 N/A SER 89.A OG ILE 95.A O no hydrogen 2.702 N/A LEU 90.A N ALA 167.A O no hydrogen 2.770 N/A GLN 91.A N SER 89.A OG no hydrogen 3.101 N/A GLN 91.A NE2 SER 162.A O no hydrogen 2.646 N/A GLN 91.A NE2 ALA 166.A O no hydrogen 2.807 N/A ILE 95.A N GLN 91.A O no hydrogen 2.670 N/A LYS 96.A N ASP 99.A OD2 no hydrogen 2.708 N/A LYS 96.A NZ PRO 92.A O no hydrogen 3.079 N/A ASP 99.A N LYS 96.A O no hydrogen 2.831 N/A CYS 101.A N LEU 191.A O no hydrogen 2.721 N/A CYS 101.A SG ILE 102.A O no hydrogen 3.641 N/A CYS 101.A SG PHE 145.A O no hydrogen 3.788 N/A ILE 102.A N PHE 145.A O no hydrogen 2.817 N/A CYS 103.A N GLY 189.A O no hydrogen 2.944 N/A ALA 106.A N ALA 123.A O no hydrogen 2.911 N/A VAL 107.A N SER 149.A O no hydrogen 2.633 N/A ARG 108.A NE SER 113.A OG no hydrogen 3.048 N/A ARG 108.A NH1 HIS 118.A O no hydrogen 2.887 N/A ARG 108.A NH1 PHE 121.A O no hydrogen 2.666 N/A ARG 108.A NH2 ILE 117.A O no hydrogen 2.799 N/A GLU 109.A N VAL 107.A O no hydrogen 2.988 N/A ARG 111.A N ASP 153.A OD2 no hydrogen 2.735 N/A SER 113.A N ASP 110.A OD2 no hydrogen 3.061 N/A SER 113.A OG ASP 110.A OD1 no hydrogen 2.385 N/A SER 113.A OG ASP 110.A OD2 no hydrogen 2.913 N/A HIS 114.A N ARG 111.A O no hydrogen 3.225 N/A HIS 114.A NE2 ARG 108.A O no hydrogen 2.790 N/A LEU 116.A N SER 113.A O no hydrogen 3.100 N/A ILE 117.A N SER 113.A O no hydrogen 3.160 N/A PHE 121.A N HIS 118.A O no hydrogen 2.971 N/A GLY 125.A N ASN 104.A O no hydrogen 2.853 N/A ASP 126.A N THR 187.A O no hydrogen 2.812 N/A ASP 128.A N ASP 126.A OD2 no hydrogen 3.137 N/A TYR 130.A N ASP 126.A O no hydrogen 3.242 N/A ASP 131.A N PHE 127.A O no hydrogen 2.762 N/A THR 132.A N ASP 128.A O no hydrogen 2.978 N/A THR 132.A OG1 ASP 128.A O no hydrogen 2.672 N/A LEU 133.A N VAL 129.A O no hydrogen 3.102 N/A ASN 134.A N TYR 130.A O no hydrogen 3.112 N/A LYS 135.A N ASP 131.A O no hydrogen 2.970 N/A LYS 135.A NZ ASP 131.A OD1 no hydrogen 3.539 N/A LYS 135.A NZ ASP 131.A OD2 no hydrogen 3.080 N/A CYS 136.A N THR 132.A O no hydrogen 3.236 N/A CYS 136.A SG THR 132.A O no hydrogen 3.251 N/A ALA 137.A N LEU 133.A O no hydrogen 3.102 N/A GLN 138.A N ASN 134.A O no hydrogen 2.881 N/A GLU 139.A N LYS 135.A O no hydrogen 2.785 N/A LEU 140.A N CYS 136.A O no hydrogen 3.093 N/A ASN 141.A N GLN 138.A O no hydrogen 2.670 N/A VAL 142.A N ALA 137.A O no hydrogen 2.700 N/A PHE 145.A N ILE 100.A O no hydrogen 2.782 N/A GLY 147.A N ILE 102.A O no hydrogen 3.210 N/A SER 149.A N ALA 105.A O no hydrogen 3.079 N/A SER 149.A OG GLU 170.A OE1 no hydrogen 2.667 N/A VAL 150.A N VAL 168.A O no hydrogen 2.778 N/A SER 151.A N VAL 107.A O no hydrogen 3.024 N/A SER 151.A OG GLU 170.A OE1 no hydrogen 3.294 N/A SER 151.A OG GLU 170.A OE2 no hydrogen 3.488 N/A SER 152.A N GLU 170.A O no hydrogen 2.760 N/A ARG 157.A NH1 GLU 109.A OE2 no hydrogen 2.670 N/A GLU 159.A N SER 156.A O no hydrogen 3.422 N/A TYR 161.A N ARG 157.A O no hydrogen 3.014 N/A TYR 161.A OH GLU 109.A OE2 no hydrogen 3.104 N/A SER 162.A N LEU 158.A O no hydrogen 2.976 N/A SER 162.A OG LEU 90.A O no hydrogen 2.661 N/A LYS 163.A N GLU 159.A O no hydrogen 2.958 N/A ALA 164.A N ASP 160.A O no hydrogen 2.780 N/A ASN 165.A N SER 162.A O no hydrogen 3.274 N/A ALA 166.A N TYR 161.A O no hydrogen 2.991 N/A ALA 167.A N ILE 148.A O no hydrogen 2.789 N/A VAL 168.A N ILE 148.A O no hydrogen 3.313 N/A VAL 169.A N GLY 88.A O no hydrogen 2.837 N/A GLU 170.A N VAL 150.A O no hydrogen 2.807 N/A GLU 172.A N GLU 170.A OE2 no hydrogen 2.856 N/A LEU 173.A N GLU 170.A OE2 no hydrogen 2.545 N/A ALA 174.A N SER 151.A OG no hydrogen 2.815 N/A THR 175.A OG1 ASP 110.A OD2 no hydrogen 2.701 N/A LEU 176.A N GLU 172.A O no hydrogen 3.197 N/A MET 177.A N LEU 173.A O no hydrogen 2.933 N/A VAL 178.A N ALA 174.A O no hydrogen 3.198 N/A ILE 179.A N THR 175.A O no hydrogen 2.952 N/A GLY 180.A N LEU 176.A O no hydrogen 2.719 N/A THR 181.A N MET 177.A O no hydrogen 2.729 N/A THR 181.A OG1 MET 177.A O no hydrogen 2.793 N/A LEU 182.A N VAL 178.A O no hydrogen 2.778 N/A ARG 183.A N ILE 179.A O no hydrogen 2.758 N/A ARG 183.A NE GLU 71.A OE2 no hydrogen 3.311 N/A ARG 183.A NE GLN 75.A OE1 no hydrogen 3.205 N/A ARG 183.A NH2 GLU 71.A OE2 no hydrogen 2.950 N/A VAL 185.A N GLY 180.A O no hydrogen 2.775 N/A LYS 186.A N LYS 79.A O no hydrogen 3.027 N/A LYS 186.A NZ ASP 126.A OD1 no hydrogen 3.514 N/A LYS 186.A NZ ASP 126.A OD2 no hydrogen 3.276 N/A LYS 186.A NZ ASP 128.A OD2 no hydrogen 2.704 N/A GLY 188.A N ILE 81.A O no hydrogen 3.162 N/A ILE 190.A N ARG 83.A O no hydrogen 2.838 N/A LEU 191.A N CYS 101.A O no hydrogen 2.741 N/A ILE 192.A N GLY 85.A O no hydrogen 2.874 N/A VAL 193.A N ASP 99.A O no hydrogen 3.079 N/A ASP 194.A N CYS 87.A O no hydrogen 2.694 N/A CYS 196.A SG SER 89.A O no hydrogen 3.496 N/A GLN 199.A NE2 GLY 98.A O no hydrogen 2.662 N/A GLU 201.A N HIS 198.A O no hydrogen 2.968 N/A ASN 202.A N GLN 199.A O no hydrogen 3.030 N/A MET 203.A N GLN 199.A O no hydrogen 3.172 N/A ILE 204.A N LEU 200.A O no hydrogen 3.057 N/A LYS 205.A N GLU 201.A O no hydrogen 3.014 N/A ILE 206.A N ASN 202.A O no hydrogen 2.810 N/A ALA 207.A N MET 203.A O no hydrogen 2.807 N/A LEU 208.A N ILE 204.A O no hydrogen 2.737 N/A GLY 209.A N LYS 205.A O no hydrogen 2.758 N/A ALA 210.A N ILE 206.A O no hydrogen 2.761 N/A CYS 211.A N ALA 207.A O no hydrogen 2.944 N/A CYS 211.A SG ALA 207.A O no hydrogen 3.371 N/A ALA 212.A N LEU 208.A O no hydrogen 3.040 N/A LYS 213.A N GLY 209.A O no hydrogen 2.974 N/A LYS 213.A NZ GLU 139.A OE1 no hydrogen 3.264 N/A LYS 213.A NZ GLU 139.A OE2 no hydrogen 3.295 N/A LEU 214.A N ALA 210.A O no hydrogen 2.946 N/A ALA 215.A N CYS 211.A O no hydrogen 2.799 N/A THR 216.A N ALA 212.A O no hydrogen 3.251 N/A LYS 217.A N LEU 214.A O no hydrogen 3.191 N/A TYR 218.A N ALA 215.A O no hydrogen 3.220 N/A ALA 219.A N ALA 215.A O no hydrogen 3.202 N/A