Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ppw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A N GLN 68.A OE1 no hydrogen 2.719 N/A VAL 3.A N LEU 16.A O no hydrogen 2.959 N/A LEU 5.A N GLY 14.A O no hydrogen 2.825 N/A LEU 6.A N LEU 28.A O no hydrogen 3.157 N/A ASN 7.A N VAL 11.A O no hydrogen 2.924 N/A ASN 7.A ND2 GLN 9.A O no hydrogen 2.487 N/A VAL 11.A N GLN 9.A O no hydrogen 2.645 N/A THR 13.A N LEU 5.A O no hydrogen 2.899 N/A LEU 16.A N VAL 3.A O no hydrogen 3.332 N/A LYS 18.A N GLU 1.A O no hydrogen 3.147 N/A LYS 18.A NZ GLU 1.A OE1 no hydrogen 2.933 N/A ALA 20.A N GLU 17.A OE1 no hydrogen 2.730 N/A ALA 21.A N LYS 18.A O no hydrogen 3.132 N/A HIS 22.A N TYR 19.A O no hydrogen 3.245 N/A HIS 22.A ND1 LYS 18.A O no hydrogen 3.132 N/A HIS 22.A NE2 HIS 29.A NE2 no hydrogen 2.967 N/A THR 23.A N THR 26.A OG1 no hydrogen 2.822 N/A ASP 25.A N THR 23.A OG1 no hydrogen 2.735 N/A THR 26.A OG1 ALA 21.A O no hydrogen 3.338 N/A THR 26.A OG1 THR 23.A O no hydrogen 3.111 N/A THR 26.A OG1 VAL 110.A O no hydrogen 2.686 N/A HIS 29.A N ASN 112.A O no hydrogen 2.961 N/A HIS 29.A ND1 ARG 27.A O no hydrogen 2.907 N/A HIS 29.A NE2 HIS 66.A NE2 no hydrogen 3.106 N/A LEU 30.A N ILE 4.A O no hydrogen 2.957 N/A ALA 31.A N VAL 114.A O no hydrogen 2.836 N/A PHE 32.A N GLY 65.A O no hydrogen 2.900 N/A SER 33.A N PRO 116.A O no hydrogen 3.166 N/A TRP 35.A N PHE 118.A O no hydrogen 2.894 N/A TRP 35.A NE1 GLN 162.A OE1 no hydrogen 2.982 N/A LEU 36.A N SER 62.A OG no hydrogen 2.744 N/A PHE 37.A N ALA 120.A O no hydrogen 2.824 N/A ASN 38.A N GLN 42.A O no hydrogen 2.843 N/A ASN 38.A ND2 GLN 42.A OE1 no hydrogen 3.220 N/A GLY 41.A N ASN 38.A O no hydrogen 2.659 N/A GLN 42.A N ASN 38.A OD1 no hydrogen 2.708 N/A LEU 43.A N CYS 139.A O no hydrogen 2.711 N/A LEU 44.A N LEU 36.A O no hydrogen 2.916 N/A VAL 45.A N GLN 137.A O no hydrogen 3.051 N/A THR 46.A N THR 60.A O no hydrogen 3.081 N/A THR 46.A OG1 ASN 61.A O no hydrogen 3.083 N/A THR 46.A OG1 SER 62.A O no hydrogen 3.270 N/A ARG 47.A N ASP 135.A O no hydrogen 2.690 N/A ARG 47.A NE GLY 57.A O no hydrogen 2.920 N/A ARG 47.A NH2 GLY 57.A O no hydrogen 3.127 N/A ARG 48.A N VAL 58.A O no hydrogen 2.955 N/A ARG 48.A NE ALA 54.A O no hydrogen 2.962 N/A ARG 48.A NE TRP 55.A O no hydrogen 3.138 N/A ARG 48.A NH2 ALA 54.A O no hydrogen 2.683 N/A ALA 49.A N GLU 132.A O no hydrogen 2.989 N/A LYS 52.A N ALA 49.A O no hydrogen 3.263 N/A LYS 52.A NZ GLU 132.A OE1 no hydrogen 2.930 N/A LYS 53.A NZ TYR 19.A O no hydrogen 3.203 N/A LYS 53.A NZ HIS 22.A O no hydrogen 3.168 N/A TRP 55.A N ASP 105.A OD2 no hydrogen 3.120 N/A GLY 57.A N ARG 48.A O no hydrogen 2.901 N/A THR 60.A N THR 46.A O no hydrogen 3.008 N/A THR 60.A OG1 SER 156.A OG no hydrogen 2.809 N/A SER 62.A OG LEU 44.A O no hydrogen 2.532 N/A VAL 63.A N SER 34.A O no hydrogen 3.231 N/A CYS 64.A SG ASN 61.A OD1 no hydrogen 3.463 N/A GLY 65.A N PHE 32.A O no hydrogen 3.104 N/A HIS 66.A NE2 HIS 29.A NE2 no hydrogen 3.106 N/A HIS 66.A NE2 GLU 113.A OE2 no hydrogen 2.688 N/A GLN 68.A N GLU 71.A OE1 no hydrogen 2.844 N/A GLN 68.A NE2 HIS 2.A O no hydrogen 2.563 N/A GLN 68.A NE2 HIS 66.A O no hydrogen 3.054 N/A LEU 69.A N HIS 2.A NE2 no hydrogen 2.984 N/A GLU 71.A N GLN 68.A O no hydrogen 2.999 N/A GLU 74.A N GLU 74.A OE1 no hydrogen 2.542 N/A ASP 75.A N SER 72.A OG no hydrogen 2.868 N/A ALA 76.A N SER 72.A O no hydrogen 2.950 N/A VAL 77.A N ASN 73.A O no hydrogen 3.108 N/A ILE 78.A N GLU 74.A O no hydrogen 3.197 N/A ARG 79.A N ASP 75.A O no hydrogen 2.777 N/A ARG 79.A NE GLU 71.A OE2 no hydrogen 2.498 N/A ARG 79.A NH1 HIS 66.A O no hydrogen 3.186 N/A ARG 79.A NH1 GLU 71.A OE1 no hydrogen 2.555 N/A ARG 79.A NH1 GLU 71.A OE2 no hydrogen 3.273 N/A ARG 79.A NH2 GLU 1.A OE2 no hydrogen 3.398 N/A ARG 80.A N ALA 76.A O no hydrogen 2.638 N/A ARG 80.A NE GLU 84.A OE2 no hydrogen 3.060 N/A ARG 80.A NH2 GLU 84.A OE2 no hydrogen 3.165 N/A CYS 81.A N VAL 77.A O no hydrogen 2.690 N/A CYS 81.A SG VAL 77.A O no hydrogen 3.177 N/A ARG 82.A N ILE 78.A O no hydrogen 2.965 N/A ARG 82.A NE GLU 88.A OE1 no hydrogen 3.035 N/A ARG 82.A NE GLU 88.A OE2 no hydrogen 2.497 N/A ARG 82.A NH2 GLU 88.A OE1 no hydrogen 2.499 N/A TYR 83.A N ARG 79.A O no hydrogen 2.858 N/A GLU 84.A N ARG 80.A O no hydrogen 2.639 N/A LEU 85.A N CYS 81.A O no hydrogen 3.152 N/A GLY 86.A N ARG 82.A O no hydrogen 2.839 N/A VAL 87.A N CYS 81.A O no hydrogen 3.146 N/A GLU 88.A N SER 124.A OG no hydrogen 3.135 N/A THR 90.A N ARG 121.A O no hydrogen 2.786 N/A THR 90.A OG1 ARG 121.A O no hydrogen 3.460 N/A GLU 93.A N ALA 119.A O no hydrogen 2.655 N/A ILE 95.A N VAL 117.A O no hydrogen 2.948 N/A TYR 96.A N VAL 117.A O no hydrogen 3.364 N/A TYR 101.A N GLU 113.A O no hydrogen 2.892 N/A TYR 101.A OH GLU 113.A OE1 no hydrogen 3.184 N/A ALA 103.A N GLU 111.A O no hydrogen 2.594 N/A ASP 105.A N ILE 109.A O no hydrogen 2.609 N/A SER 107.A N ASP 105.A OD1 no hydrogen 2.911 N/A SER 107.A OG ASP 105.A OD1 no hydrogen 3.493 N/A GLY 108.A N ASP 105.A O no hydrogen 2.594 N/A ILE 109.A N ASP 105.A OD1 no hydrogen 2.497 N/A VAL 110.A N THR 23.A O no hydrogen 2.985 N/A GLU 111.A N ALA 103.A O no hydrogen 2.829 N/A ASN 112.A ND2 THR 26.A O no hydrogen 3.192 N/A GLU 113.A N TYR 101.A O no hydrogen 2.714 N/A VAL 114.A N HIS 29.A O no hydrogen 2.907 N/A CYS 115.A N PHE 99.A O no hydrogen 2.818 N/A CYS 115.A SG SER 33.A OG no hydrogen 3.440 N/A VAL 117.A N TYR 96.A O no hydrogen 2.809 N/A PHE 118.A N SER 33.A O no hydrogen 2.916 N/A ALA 119.A N GLU 93.A O no hydrogen 2.769 N/A ALA 120.A N TRP 35.A O no hydrogen 3.169 N/A ARG 121.A N THR 90.A OG1 no hydrogen 3.120 N/A ARG 121.A NH1 ASN 38.A O no hydrogen 2.767 N/A THR 122.A N PHE 37.A O no hydrogen 3.060 N/A THR 122.A OG1 PHE 37.A O no hydrogen 3.551 N/A THR 123.A N GLU 88.A O no hydrogen 2.757 N/A GLN 127.A N LEU 85.A O no hydrogen 2.928 N/A ASN 129.A N GLU 84.A O no hydrogen 2.986 N/A ASN 129.A ND2 TYR 83.A O no hydrogen 3.320 N/A ASP 131.A N ASN 129.A OD1 no hydrogen 2.711 N/A GLU 132.A N ASN 129.A O no hydrogen 2.799 N/A VAL 133.A N ASN 129.A O no hydrogen 2.900 N/A MET 134.A N ARG 47.A O no hydrogen 2.958 N/A TYR 136.A N ASP 135.A OD1 no hydrogen 2.724 N/A GLN 137.A N VAL 45.A O no hydrogen 2.854 N/A GLN 137.A NE2 TYR 136.A O no hydrogen 3.265 N/A CYS 139.A N LEU 43.A O no hydrogen 2.855 N/A CYS 139.A SG LEU 43.A O no hydrogen 3.958 N/A CYS 139.A SG GLN 137.A O no hydrogen 3.593 N/A VAL 144.A N ASP 140.A O no hydrogen 3.185 N/A LEU 145.A N LEU 141.A O no hydrogen 2.767 N/A HIS 146.A N ALA 142.A O no hydrogen 2.858 N/A GLY 147.A N ASP 143.A O no hydrogen 2.799 N/A ILE 148.A N VAL 144.A O no hydrogen 2.720 N/A ASP 149.A N LEU 145.A O no hydrogen 2.761 N/A ALA 150.A N HIS 146.A O no hydrogen 2.859 N/A THR 151.A N GLY 147.A O no hydrogen 2.775 N/A THR 151.A OG1 GLY 147.A O no hydrogen 3.274 N/A ALA 154.A N THR 151.A O no hydrogen 3.008 N/A PHE 155.A N PRO 152.A O no hydrogen 2.986 N/A SER 156.A N TRP 59.A O no hydrogen 2.791 N/A SER 156.A OG THR 60.A OG1 no hydrogen 2.809 N/A MET 159.A N SER 156.A OG no hydrogen 3.122 N/A VAL 160.A N SER 156.A O no hydrogen 3.025 N/A MET 161.A N PRO 157.A O no hydrogen 3.054 N/A GLN 162.A N TRP 158.A O no hydrogen 2.864 N/A GLN 162.A NE2 SER 33.A OG no hydrogen 2.955 N/A ALA 163.A N MET 159.A O no hydrogen 2.988 N/A THR 164.A N VAL 160.A O no hydrogen 2.982 N/A THR 164.A N MET 161.A O no hydrogen 3.267 N/A THR 164.A OG1 VAL 160.A O no hydrogen 3.038 N/A THR 164.A OG1 MET 161.A O no hydrogen 3.333 N/A ASN 165.A N GLN 162.A O no hydrogen 3.101 N/A ASN 165.A ND2 GLU 167.A OE1 no hydrogen 3.220 N/A GLU 167.A N GLU 167.A OE2 no hydrogen 2.592 N/A ALA 168.A N ASN 165.A OD1 no hydrogen 2.797 N/A ARG 169.A N ASN 165.A O no hydrogen 2.856 N/A ARG 169.A NE ALA 163.A O no hydrogen 2.697 N/A ARG 169.A NH1 ASP 149.A OD2 no hydrogen 3.246 N/A ARG 169.A NH2 ASP 149.A OD1 no hydrogen 2.853 N/A ARG 169.A NH2 ASP 149.A OD2 no hydrogen 3.565 N/A ARG 169.A NH2 ALA 163.A O no hydrogen 3.214 N/A LYS 170.A N ARG 166.A O no hydrogen 3.100 N/A ARG 171.A N GLU 167.A O no hydrogen 3.113 N/A LEU 172.A N ALA 168.A O no hydrogen 2.783 N/A SER 173.A N ARG 169.A O no hydrogen 2.883 N/A SER 173.A OG ARG 169.A O no hydrogen 2.578 N/A ALA 174.A N LEU 172.A O no hydrogen 3.001 N/A PHE 175.A N LEU 172.A O no hydrogen 3.332 N/A