Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1koe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 PRO 2.A O no hydrogen 3.036 N/A LEU 4.A N PRO 64.A O no hydrogen 3.021 N/A HIS 5.A N GLU 169.A OE1 no hydrogen 2.838 N/A HIS 5.A ND1 GLU 169.A OE1 no hydrogen 2.706 N/A HIS 5.A NE2 ASP 70.A OD1 no hydrogen 2.637 N/A LEU 6.A N VAL 66.A O no hydrogen 2.853 N/A VAL 7.A N CYS 167.A O no hydrogen 2.929 N/A ALA 8.A N PHE 95.A O no hydrogen 3.036 N/A LEU 9.A N VAL 165.A O no hydrogen 2.857 N/A ASN 10.A N GLN 30.A OE1 no hydrogen 2.773 N/A THR 11.A OG1 PRO 12.A O no hydrogen 3.154 N/A LEU 13.A N TYR 163.A O no hydrogen 2.777 N/A SER 14.A OG GLU 135.A OE1 no hydrogen 3.038 N/A GLY 15.A N CYS 159.A O no hydrogen 2.915 N/A GLY 16.A N SER 14.A OG no hydrogen 3.230 N/A MET 17.A N TRP 132.A O no hydrogen 2.947 N/A GLY 19.A N TRP 132.A O no hydrogen 2.902 N/A ALA 23.A N GLY 19.A O no hydrogen 3.157 N/A ASP 24.A N ILE 20.A O no hydrogen 2.815 N/A PHE 25.A N ARG 21.A O no hydrogen 2.955 N/A GLN 26.A N GLY 22.A O no hydrogen 3.049 N/A CYS 27.A N ALA 23.A O no hydrogen 3.088 N/A CYS 27.A SG ALA 23.A O no hydrogen 3.653 N/A PHE 28.A N ASP 24.A O no hydrogen 3.019 N/A GLN 29.A N PHE 25.A O no hydrogen 2.853 N/A GLN 30.A N GLN 26.A O no hydrogen 2.912 N/A GLN 30.A NE2 GLN 26.A OE1 no hydrogen 3.131 N/A ALA 31.A N CYS 27.A O no hydrogen 3.089 N/A ARG 32.A N PHE 28.A O no hydrogen 3.139 N/A ALA 33.A N GLN 29.A O no hydrogen 3.025 N/A VAL 34.A N ALA 31.A O no hydrogen 3.230 N/A GLY 35.A N ARG 32.A O no hydrogen 3.122 N/A LEU 36.A N ALA 31.A O no hydrogen 3.061 N/A ARG 41.A N ILE 168.A O no hydrogen 2.927 N/A ARG 41.A NE ASP 24.A OD2 no hydrogen 3.159 N/A ARG 41.A NH1 GLN 49.A OE1 no hydrogen 2.884 N/A ARG 41.A NH2 ASP 24.A OD2 no hydrogen 2.736 N/A ALA 42.A N ASP 24.A OD1 no hydrogen 2.852 N/A PHE 43.A N LEU 166.A O no hydrogen 2.752 N/A SER 45.A N HIS 115.A O no hydrogen 3.011 N/A SER 45.A OG SER 117.A OG no hydrogen 2.609 N/A SER 46.A N GLN 49.A O no hydrogen 2.832 N/A ARG 47.A N THR 131.A OG1 no hydrogen 3.208 N/A GLN 49.A N SER 46.A O no hydrogen 3.177 N/A GLN 49.A NE2 ASP 50.A O no hydrogen 3.317 N/A LEU 51.A N SER 45.A OG no hydrogen 2.881 N/A TYR 52.A N GLY 121.A O no hydrogen 3.060 N/A TYR 52.A OH ASP 78.A OD1 no hydrogen 2.624 N/A SER 53.A N ASP 50.A O no hydrogen 3.134 N/A ILE 54.A N LEU 51.A O no hydrogen 3.148 N/A ARG 56.A N ASN 170.A O no hydrogen 2.944 N/A ARG 56.A NH1 ASN 170.A OD1 no hydrogen 2.568 N/A ASP 59.A N ARG 56.A O no hydrogen 2.861 N/A ARG 60.A N ARG 57.A O no hydrogen 3.279 N/A ARG 60.A NE VAL 55.A O no hydrogen 2.670 N/A ARG 60.A NH2 SER 53.A O no hydrogen 3.289 N/A ARG 60.A NH2 VAL 55.A O no hydrogen 3.133 N/A ILE 65.A N SER 74.A O no hydrogen 2.865 N/A VAL 66.A N LEU 4.A O no hydrogen 2.902 N/A ASN 67.A N GLU 71.A O no hydrogen 2.922 N/A ASN 67.A ND2 GLU 71.A OE1 no hydrogen 2.911 N/A ASN 67.A ND2 ARG 93.A O no hydrogen 2.887 N/A LYS 69.A N ASN 67.A OD1 no hydrogen 2.965 N/A ASP 70.A N ASN 67.A O no hydrogen 2.886 N/A GLU 71.A N ASN 67.A OD1 no hydrogen 2.968 N/A LEU 73.A N ILE 65.A O no hydrogen 2.735 N/A SER 74.A N ILE 65.A O no hydrogen 3.256 N/A SER 74.A OG SER 76.A O no hydrogen 2.930 N/A SER 76.A OG SER 79.A OG no hydrogen 2.701 N/A TRP 77.A NE1 TYR 52.A O no hydrogen 2.806 N/A ASP 78.A N ARG 60.A O no hydrogen 3.005 N/A SER 79.A N SER 76.A OG no hydrogen 3.133 N/A SER 79.A OG SER 76.A OG no hydrogen 2.701 N/A LEU 80.A N TRP 77.A O no hydrogen 2.980 N/A PHE 81.A N ASP 78.A O no hydrogen 2.960 N/A SER 82.A OG SER 79.A O no hydrogen 2.982 N/A SER 84.A N SER 82.A OG no hydrogen 3.421 N/A SER 84.A OG SER 82.A OG no hydrogen 3.325 N/A LEU 88.A N GLY 149.A O no hydrogen 2.786 N/A ALA 92.A N GLN 89.A O no hydrogen 3.064 N/A ARG 93.A NE GLU 71.A OE1 no hydrogen 3.114 N/A ARG 93.A NH2 GLU 71.A OE1 no hydrogen 3.184 N/A ARG 93.A NH2 GLU 71.A OE2 no hydrogen 2.574 N/A SER 96.A N ARG 100.A O no hydrogen 2.915 N/A SER 96.A OG ASN 10.A OD1 no hydrogen 3.458 N/A SER 96.A OG ASP 98.A OD1 no hydrogen 2.696 N/A SER 96.A OG ARG 100.A O no hydrogen 3.501 N/A PHE 97.A N ALA 8.A O no hydrogen 3.113 N/A ASP 98.A N ASN 10.A OD1 no hydrogen 3.009 N/A GLY 99.A N SER 96.A O no hydrogen 2.982 N/A ARG 100.A N SER 96.A OG no hydrogen 3.193 N/A ARG 100.A NE ASP 98.A OD1 no hydrogen 2.827 N/A ARG 100.A NH2 ASN 10.A O no hydrogen 2.830 N/A ARG 100.A NH2 ASP 98.A OD1 no hydrogen 3.250 N/A ARG 100.A NH2 ASP 98.A OD2 no hydrogen 2.785 N/A VAL 102.A N ILE 94.A O no hydrogen 3.078 N/A LEU 103.A N ASP 101.A OD1 no hydrogen 2.885 N/A ARG 104.A N ASP 101.A O no hydrogen 3.183 N/A ARG 104.A N ASP 101.A OD1 no hydrogen 3.400 N/A HIS 105.A N ASP 101.A O no hydrogen 2.967 N/A ALA 107.A N HIS 105.A ND1 no hydrogen 3.084 N/A TRP 108.A N HIS 105.A O no hydrogen 3.388 N/A GLN 110.A NE2 ASN 161.A OD1 no hydrogen 2.901 N/A LYS 111.A NZ VAL 102.A O no hydrogen 2.784 N/A LYS 111.A NZ LEU 103.A O no hydrogen 3.302 N/A LYS 111.A NZ TRP 108.A O no hydrogen 2.616 N/A VAL 113.A N SER 144.A O no hydrogen 2.750 N/A TRP 114.A N ILE 164.A O no hydrogen 3.084 N/A TRP 114.A NE1 LEU 13.A O no hydrogen 2.880 N/A HIS 115.A N GLN 142.A O no hydrogen 2.938 N/A HIS 115.A NE2 GLU 153.A O no hydrogen 2.870 N/A GLY 116.A N GLN 142.A O no hydrogen 2.908 N/A SER 117.A N HIS 115.A ND1 no hydrogen 3.037 N/A SER 117.A OG SER 45.A OG no hydrogen 2.609 N/A SER 117.A OG HIS 115.A O no hydrogen 2.904 N/A ASP 118.A N ARG 122.A O no hydrogen 2.853 N/A SER 120.A N ASP 118.A OD1 no hydrogen 2.900 N/A SER 120.A OG ASP 118.A OD1 no hydrogen 2.737 N/A GLY 121.A N ASP 118.A O no hydrogen 2.980 N/A ARG 122.A N ASP 118.A OD1 no hydrogen 2.996 N/A ARG 122.A NE ASP 118.A OD2 no hydrogen 2.884 N/A ARG 122.A NH2 ASP 118.A OD2 no hydrogen 2.807 N/A ARG 123.A N ASP 50.A OD1 no hydrogen 2.901 N/A ARG 123.A NE ASP 50.A OD1 no hydrogen 2.769 N/A ARG 123.A NH1 ARG 47.A O no hydrogen 2.757 N/A ARG 123.A NH2 ASP 50.A OD1 no hydrogen 3.386 N/A ARG 123.A NH2 ASP 50.A OD2 no hydrogen 3.080 N/A LEU 124.A N GLY 116.A O no hydrogen 3.094 N/A SER 127.A N LEU 124.A O no hydrogen 2.824 N/A SER 127.A OG THR 140.A OG1 no hydrogen 3.287 N/A SER 127.A OG GLN 142.A OE1 no hydrogen 2.943 N/A CYS 129.A N THR 140.A O no hydrogen 3.020 N/A TRP 132.A N TYR 128.A O no hydrogen 2.852 N/A TRP 132.A NE1 SER 45.A O no hydrogen 2.794 N/A ARG 133.A N CYS 129.A O no hydrogen 3.000 N/A THR 134.A N CYS 129.A O no hydrogen 3.321 N/A THR 136.A N THR 134.A OG1 no hydrogen 3.226 N/A THR 140.A OG1 SER 127.A OG no hydrogen 3.287 N/A GLY 141.A N ALA 157.A O no hydrogen 2.838 N/A GLN 142.A N SER 127.A O no hydrogen 2.831 N/A GLN 142.A NE2 GLN 154.A OE1 no hydrogen 3.037 N/A ALA 143.A N LYS 155.A O no hydrogen 2.749 N/A SER 144.A N VAL 113.A O no hydrogen 2.858 N/A SER 144.A OG ARG 150.A O no hydrogen 2.736 N/A SER 145.A N GLU 153.A OE1 no hydrogen 2.924 N/A LEU 146.A N LYS 111.A O no hydrogen 2.804 N/A LEU 147.A N SER 145.A OG no hydrogen 3.333 N/A SER 148.A N SER 145.A O no hydrogen 3.198 N/A SER 148.A OG SER 145.A O no hydrogen 2.851 N/A SER 148.A OG GLU 153.A OE1 no hydrogen 3.354 N/A GLY 149.A N LEU 146.A O no hydrogen 3.059 N/A ARG 150.A NE SER 148.A OG no hydrogen 3.042 N/A ARG 150.A NH2 SER 148.A OG no hydrogen 3.295 N/A LEU 151.A N GLY 86.A O no hydrogen 2.970 N/A LEU 152.A N GLN 85.A O no hydrogen 2.946 N/A GLU 153.A N SER 144.A OG no hydrogen 3.034 N/A GLN 154.A NE2 SER 117.A O no hydrogen 2.949 N/A GLN 154.A NE2 LEU 152.A O no hydrogen 2.861 N/A LYS 155.A N ALA 143.A O no hydrogen 3.196 N/A LYS 155.A NZ GLU 153.A OE2 no hydrogen 2.525 N/A ALA 157.A N GLY 141.A O no hydrogen 2.846 N/A SER 158.A OG THR 137.A O no hydrogen 2.839 N/A CYS 159.A N ALA 139.A O no hydrogen 2.865 N/A HIS 160.A N SER 158.A OG no hydrogen 3.279 N/A ASN 161.A N SER 158.A O no hydrogen 3.110 N/A ASN 161.A ND2 SER 158.A O no hydrogen 2.948 N/A TYR 163.A N LEU 13.A O no hydrogen 2.915 N/A ILE 164.A N SER 112.A O no hydrogen 2.910 N/A CYS 167.A N VAL 7.A O no hydrogen 2.732 N/A ILE 168.A N ARG 41.A O no hydrogen 2.783 N/A GLU 169.A N HIS 5.A O no hydrogen 3.022 N/A ASN 170.A N THR 39.A O no hydrogen 2.836 N/A PHE 172.A N ASP 59.A OD2 no hydrogen 3.134 N/A