Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nw2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N ARG 75.A O no hydrogen 2.848 N/A GLU 6.A N LYS 52.A O no hydrogen 2.842 N/A ARG 7.A N LYS 52.A O no hydrogen 3.132 N/A MET 9.A N LEU 50.A O no hydrogen 2.768 N/A CYS 11.A N ASP 10.A OD1 no hydrogen 2.691 N/A CYS 11.A SG GLN 48.A O no hydrogen 3.955 N/A ARG 12.A N GLN 48.A O no hydrogen 2.856 N/A ARG 12.A NE GLN 48.A OE1 no hydrogen 2.725 N/A ARG 12.A NH2 ALA 18.A O no hydrogen 3.103 N/A ARG 12.A NH2 GLN 48.A OE1 no hydrogen 3.132 N/A GLY 14.A N GLU 46.A O no hydrogen 2.935 N/A ARG 15.A N ASN 35.A OD1 no hydrogen 2.788 N/A ARG 15.A NE GLU 43.A OE2.B no hydrogen 2.759 N/A ARG 15.A NH1 ALA 36.A O no hydrogen 3.184 N/A ARG 15.A NH1 GLU 43.A OE1.A no hydrogen 2.973 N/A ARG 15.A NH1 GLU 43.A OE1.B no hydrogen 3.160 N/A ARG 15.A NH2 PRO 34.A O no hydrogen 2.888 N/A ARG 15.A NH2 ALA 36.A O no hydrogen 2.850 N/A GLY 17.A N GLU 46.A OE1 no hydrogen 3.084 N/A ALA 18.A N ARG 15.A O no hydrogen 2.979 N/A THR 19.A N GLY 17.A O no hydrogen 2.810 N/A GLY 20.A N TRP 63.A O no hydrogen 2.842 N/A THR 23.A N GLY 20.A O no hydrogen 2.863 N/A THR 23.A OG1 GLY 20.A O no hydrogen 2.659 N/A THR 24.A N ALA 21.A O no hydrogen 3.435 N/A THR 24.A OG1 ALA 21.A O no hydrogen 3.534 N/A TYR 26.A OH HIS 60.A ND1 no hydrogen 2.703 N/A ALA 27.A N THR 24.A OG1 no hydrogen 3.007 N/A VAL 28.A N THR 24.A O no hydrogen 3.004 N/A GLU 29.A N ILE 25.A O no hydrogen 2.988 N/A ALA 30.A N TYR 26.A O no hydrogen 3.088 N/A ASP 31.A N ALA 27.A O no hydrogen 2.717 N/A GLY 32.A N VAL 28.A O no hydrogen 2.682 N/A ASN 35.A N ASP 33.A OD1 no hydrogen 2.860 N/A ALA 36.A N ASP 33.A O no hydrogen 2.983 N/A PHE 38.A N ASN 35.A O no hydrogen 3.130 N/A GLU 39.A N GLU 43.A OE2.A no hydrogen 3.236 N/A LYS 42.A N GLU 39.A O no hydrogen 3.134 N/A GLU 46.A N GLY 14.A O no hydrogen 2.880 N/A GLN 48.A N ARG 12.A O no hydrogen 2.789 N/A GLN 48.A NE2 ARG 15.A O no hydrogen 2.815 N/A GLN 48.A NE2 GLU 46.A OE1 no hydrogen 3.019 N/A TYR 49.A N GLU 64.A O no hydrogen 2.659 N/A LEU 50.A N ASP 10.A O no hydrogen 2.944 N/A ILE 51.A N THR 62.A O no hydrogen 2.778 N/A LYS 52.A N ARG 7.A O no hydrogen 2.982 N/A LYS 52.A NZ GLU 6.A OE2 no hydrogen 3.068 N/A LYS 52.A NZ TRP 53.A O no hydrogen 2.959 N/A LYS 52.A NZ TRP 56.A O no hydrogen 2.635 N/A TRP 53.A NE1 THR 62.A OG1 no hydrogen 2.934 N/A LYS 54.A N THR 4.A O no hydrogen 2.858 N/A TRP 56.A N TRP 53.A O no hydrogen 3.145 N/A TRP 56.A NE1 GLU 3.A OE1 no hydrogen 2.966 N/A SER 57.A OG GLU 155.A OE1 no hydrogen 2.789 N/A HIS 60.A N SER 57.A O no hydrogen 2.993 N/A HIS 60.A ND1 TYR 26.A OH no hydrogen 2.703 N/A HIS 60.A NE2 GLU 155.A OE2 no hydrogen 2.765 N/A ASN 61.A N HIS 58.A O no hydrogen 3.101 N/A ASN 61.A ND2 HIS 58.A ND1 no hydrogen 3.261 N/A THR 62.A N ILE 51.A O no hydrogen 3.317 N/A THR 62.A OG1 GLU 64.A OE2 no hydrogen 2.663 N/A TRP 63.A N THR 23.A OG1 no hydrogen 2.977 N/A GLU 64.A N TYR 49.A O no hydrogen 2.766 N/A THR 65.A N THR 68.A OG1 no hydrogen 2.823 N/A THR 65.A OG1 THR 68.A OG1 no hydrogen 3.398 N/A THR 68.A N THR 65.A OG1 no hydrogen 2.909 N/A THR 68.A OG1 GLU 64.A OE1 no hydrogen 2.835 N/A THR 68.A OG1 THR 65.A O no hydrogen 3.064 N/A THR 68.A OG1 THR 65.A OG1 no hydrogen 3.398 N/A LEU 69.A N THR 65.A O no hydrogen 2.931 N/A LYS 70.A N GLU 66.A O no hydrogen 3.031 N/A LYS 70.A NZ.B GLU 66.A OE2 no hydrogen 3.005 N/A GLN 71.A N GLU 67.A O no hydrogen 2.848 N/A GLN 72.A N THR 68.A O no hydrogen 3.083 N/A ASN 73.A N LYS 70.A O no hydrogen 3.049 N/A VAL 74.A N LEU 69.A O no hydrogen 3.387 N/A ARG 75.A N GLU 3.A O no hydrogen 2.740 N/A LYS 79.A N GLY 76.A O no hydrogen 2.965 N/A LYS 79.A NZ ILE 5.A O no hydrogen 3.168 N/A LEU 80.A N MET 77.A O no hydrogen 3.045 N/A ASN 82.A N LYS 78.A O no hydrogen 3.132 N/A TYR 83.A N LYS 79.A O no hydrogen 2.875 N/A LYS 84.A N LEU 80.A O no hydrogen 2.889 N/A LYS 84.A NZ GLU 66.A OE1 no hydrogen 2.644 N/A LYS 84.A NZ GLU 66.A OE2 no hydrogen 3.563 N/A LYS 85.A N ASP 81.A O no hydrogen 3.060 N/A LYS 86.A N ASN 82.A O no hydrogen 2.965 N/A ASP 87.A N TYR 83.A O no hydrogen 2.847 N/A GLN 88.A N LYS 84.A O no hydrogen 3.093 N/A GLU 89.A N LYS 85.A O no hydrogen 2.936 N/A THR 90.A N LYS 86.A O no hydrogen 2.755 N/A THR 90.A OG1 LYS 86.A O no hydrogen 2.862 N/A LYS 91.A N ASP 87.A O no hydrogen 2.981 N/A LYS 91.A NZ ASP 87.A OD1 no hydrogen 3.311 N/A LYS 91.A NZ ASP 87.A OD2 no hydrogen 2.638 N/A ARG 92.A N GLN 88.A O no hydrogen 3.213 N/A TRP 93.A N GLU 89.A O no hydrogen 3.283 N/A LEU 94.A N THR 90.A O no hydrogen 2.963 N/A ASN 96.A N TRP 93.A O no hydrogen 3.307 N/A ALA 97.A N TRP 93.A O no hydrogen 3.235 N/A ASP 101.A N SER 98.A O no hydrogen 2.438 N/A VAL 102.A N SER 98.A O no hydrogen 3.016 N/A GLU 103.A N PRO 99.A O no hydrogen 2.760 N/A TYR 104.A N GLU 100.A O no hydrogen 3.395 N/A TYR 105.A N ASP 101.A O no hydrogen 2.766 N/A ASN 106.A N VAL 102.A O no hydrogen 2.804 N/A CYS 107.A N GLU 103.A O no hydrogen 2.954 N/A CYS 107.A SG GLU 103.A O no hydrogen 3.185 N/A CYS 107.A SG GLU 103.A OE2 no hydrogen 3.174 N/A GLN 108.A N TYR 104.A O no hydrogen 3.100 N/A GLN 109.A N TYR 105.A O no hydrogen 3.015 N/A GLU 110.A N ASN 106.A O no hydrogen 2.954 N/A LEU 111.A N CYS 107.A O no hydrogen 3.014 N/A THR 112.A N GLN 108.A O no hydrogen 3.053 N/A THR 112.A OG1 GLN 108.A O no hydrogen 2.784 N/A ASP 113.A N GLN 109.A O no hydrogen 2.818 N/A ASP 114.A N GLU 110.A O no hydrogen 2.924 N/A LEU 115.A N LEU 111.A O no hydrogen 2.946 N/A HIS 116.A N THR 112.A O no hydrogen 2.922 N/A LYS 117.A N ASP 113.A O no hydrogen 3.078 N/A GLN 118.A N ASP 114.A O no hydrogen 3.234 N/A TYR 119.A N LEU 115.A O no hydrogen 3.401 N/A TYR 119.A N HIS 116.A O no hydrogen 3.181 N/A GLN 120.A N LYS 117.A O no hydrogen 3.128 N/A GLN 120.A NE2 HIS 58.A O no hydrogen 2.865 N/A ILE 121.A N GLN 118.A O no hydrogen 2.871 N/A GLU 123.A N LYS 143.A O no hydrogen 2.750 N/A ARG 124.A N LYS 143.A O no hydrogen 3.374 N/A ARG 124.A NE TYR 149.A OH no hydrogen 3.135 N/A ARG 124.A NH2 TYR 149.A OH no hydrogen 2.634 N/A ILE 126.A N TYR 141.A O no hydrogen 2.759 N/A HIS 128.A ND1 TYR 171.A OH no hydrogen 2.656 N/A SER 129.A N ASP 139.A O no hydrogen 2.925 N/A SER 129.A OG GLN 131.A O no hydrogen 2.633 N/A SER 133.A N TYR 137.A O no hydrogen 2.881 N/A SER 133.A OG TYR 137.A O no hydrogen 3.560 N/A GLY 136.A N SER 133.A O no hydrogen 2.835 N/A TYR 137.A N SER 133.A OG no hydrogen 3.261 N/A ASP 139.A N SER 129.A OG no hydrogen 2.781 N/A TYR 140.A N GLU 155.A O no hydrogen 2.997 N/A TYR 141.A N ALA 127.A O no hydrogen 2.815 N/A CYS 142.A N SER 153.A O no hydrogen 2.818 N/A CYS 142.A SG TYR 140.A O no hydrogen 3.567 N/A LYS 143.A N ARG 124.A O no hydrogen 2.890 N/A LYS 143.A NZ GLU 123.A OE2 no hydrogen 2.630 N/A LYS 143.A NZ TRP 144.A O no hydrogen 2.963 N/A LYS 143.A NZ LEU 147.A O no hydrogen 2.801 N/A TRP 144.A NE1 SER 153.A OG no hydrogen 2.882 N/A GLN 145.A N ILE 121.A O no hydrogen 2.929 N/A LEU 147.A N TRP 144.A O no hydrogen 3.218 N/A SER 150.A OG GLU 151.A OE1 no hydrogen 2.934 N/A GLU 151.A N PRO 148.A O no hydrogen 2.843 N/A CYS 152.A N TYR 149.A O no hydrogen 3.058 N/A CYS 152.A SG TYR 149.A O no hydrogen 3.193 N/A SER 153.A N CYS 142.A O no hydrogen 3.155 N/A SER 153.A OG GLU 155.A OE1 no hydrogen 2.661 N/A GLU 155.A N TYR 140.A O no hydrogen 2.826 N/A LEU 159.A N ASP 156.A OD2 no hydrogen 2.768 N/A ILE 160.A N ASP 156.A O no hydrogen 2.895 N/A SER 161.A N GLY 157.A O no hydrogen 2.857 N/A SER 161.A OG GLY 157.A O no hydrogen 3.255 N/A SER 161.A OG ALA 158.A O no hydrogen 2.624 N/A LYS 162.A N LEU 159.A O no hydrogen 3.240 N/A LYS 163.A N ILE 160.A O no hydrogen 3.267 N/A LYS 163.A NZ GLU 29.A OE1 no hydrogen 2.815 N/A PHE 164.A N ILE 160.A O no hydrogen 2.799 N/A GLN 165.A NE2 ASP 169.A OD1 no hydrogen 2.575 N/A CYS 167.A SG VAL 122.A O no hydrogen 3.558 N/A ILE 168.A N PHE 164.A O no hydrogen 3.214 N/A ASP 169.A N GLN 165.A O no hydrogen 2.829 N/A GLU 170.A N ALA 166.A O no hydrogen 2.870 N/A TYR 171.A N CYS 167.A O no hydrogen 2.947 N/A TYR 171.A OH HIS 128.A ND1 no hydrogen 2.656 N/A PHE 172.A N ILE 168.A O no hydrogen 2.999 N/A SER 173.A N GLU 170.A O no hydrogen 3.160 N/A