Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kwl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ ALA 36.A O no hydrogen 3.141 N/A ARG 7.A N ASP 11.A OD2.A no hydrogen 2.996 N/A LEU 9.A N GLU 43.A OE1 no hydrogen 2.819 N/A ASP 11.A N THR 8.A OG1 no hydrogen 2.973 N/A LEU 12.A N THR 8.A O no hydrogen 2.914 N/A ILE 13.A N LEU 9.A O no hydrogen 2.937 N/A ARG 14.A N ALA 10.A O no hydrogen 3.049 N/A ARG 14.A NH1 GLU 18.A OE2 no hydrogen 2.901 N/A ARG 14.A NH2 ASP 11.A OD1.A no hydrogen 2.761 N/A ILE 15.A N ASP 11.A O no hydrogen 2.941 N/A LEU 16.A N LEU 12.A O no hydrogen 2.836 N/A HIS 17.A N ILE 13.A O no hydrogen 2.933 N/A HIS 17.A ND1.B ASN 64.A OD1 no hydrogen 2.647 N/A HIS 17.A NE2.B ASP 61.A OD2 no hydrogen 2.653 N/A GLU 18.A N ARG 14.A O no hydrogen 3.228 N/A LEU 19.A N ILE 15.A O no hydrogen 2.965 N/A PHE 20.A N LEU 16.A O no hydrogen 2.940 N/A ALA 21.A N GLU 18.A O no hydrogen 3.156 N/A GLU 29.A N ASN 26.A OD1 no hydrogen 3.096 N/A VAL 30.A N ASN 26.A O no hydrogen 2.984 N/A GLN 31.A N VAL 27.A O no hydrogen 2.827 N/A GLN 31.A NE2 CYS 127.A O no hydrogen 2.733 N/A ALA 32.A N GLU 28.A O no hydrogen 2.945 N/A VAL 33.A N.A GLU 29.A O no hydrogen 2.969 N/A VAL 33.A N.B GLU 29.A O no hydrogen 2.983 N/A LEU 34.A N VAL 30.A O no hydrogen 3.025 N/A GLU 35.A N GLN 31.A O no hydrogen 2.922 N/A ALA 36.A N ALA 32.A O no hydrogen 2.932 N/A TYR 37.A N VAL 33.A O.A no hydrogen 3.149 N/A TYR 37.A N VAL 33.A O.B no hydrogen 3.333 N/A TYR 37.A N LEU 34.A O no hydrogen 3.298 N/A TYR 37.A OH GLU 43.A OE1 no hydrogen 2.647 N/A SER 39.A N ASN 125.A OD1 no hydrogen 2.858 N/A SER 39.A OG LEU 95.A O no hydrogen 2.894 N/A ASN 40.A N TYR 37.A OH no hydrogen 3.188 N/A ASN 40.A ND2 GLU 43.A OE2 no hydrogen 3.361 N/A ALA 42.A N ASN 40.A OD1 no hydrogen 3.353 N/A GLU 43.A N ASN 40.A O no hydrogen 2.879 N/A TRP 44.A N PRO 41.A O no hydrogen 3.203 N/A TRP 44.A NE1 SER 39.A OG no hydrogen 2.867 N/A TYR 47.A N TRP 44.A O no hydrogen 2.914 N/A ALA 48.A N ALA 45.A O no hydrogen 3.052 N/A LYS 49.A N TYR 47.A O no hydrogen 2.910 N/A LYS 49.A NZ LEU 46.A O no hydrogen 2.979 N/A LYS 49.A NZ GLY 183.A O no hydrogen 2.798 N/A TYR 53.A N ASP 51.A OD2 no hydrogen 2.861 N/A ARG 54.A N ASP 51.A OD2 no hydrogen 3.291 N/A ARG 54.A NE TYR 55.A O no hydrogen 2.788 N/A ARG 54.A NH2 TYR 55.A O no hydrogen 3.353 N/A THR 56.A N CYS 73.A O no hydrogen 3.052 N/A THR 56.A OG1 LYS 49.A O no hydrogen 2.610 N/A ARG 57.A NH1 THR 177.A O no hydrogen 3.188 N/A ASN 58.A N ILE 71.A O no hydrogen 2.855 N/A ASN 58.A ND2 LYS 49.A O no hydrogen 3.697 N/A ASN 58.A ND2 THR 56.A OG1 no hydrogen 3.144 N/A ASN 58.A ND2 ILE 71.A O no hydrogen 3.039 N/A LEU 59.A N SER 180.A O no hydrogen 2.832 N/A VAL 60.A N LEU 69.A O no hydrogen 2.779 N/A ASP 61.A N LEU 69.A O no hydrogen 3.109 N/A GLY 63.A N ASP 61.A OD2 no hydrogen 2.861 N/A GLY 65.A N GLN 62.A O no hydrogen 2.909 N/A LYS 66.A N GLY 63.A O no hydrogen 2.830 N/A LYS 66.A NZ PHE 20.A O no hydrogen 2.983 N/A LYS 66.A NZ GLY 22.A O no hydrogen 2.782 N/A ASN 68.A N TYR 154.A O no hydrogen 3.026 N/A LEU 69.A N ASP 61.A O no hydrogen 2.853 N/A MET 70.A N HIS 152.A O no hydrogen 2.856 N/A ILE 71.A N ASN 58.A O no hydrogen 2.806 N/A LEU 72.A N SER 150.A O no hydrogen 2.747 N/A CYS 73.A N THR 56.A O no hydrogen 3.016 N/A CYS 73.A SG LYS 49.A O no hydrogen 3.937 N/A TRP 74.A N ALA 148.A O no hydrogen 2.835 N/A TRP 74.A NE1 SER 150.A OG no hydrogen 2.845 N/A GLY 75.A N HIS 78.A ND1 no hydrogen 2.842 N/A GLU 76.A N GLU 76.A OE1 no hydrogen 2.821 N/A HIS 78.A N GLY 75.A O no hydrogen 3.014 N/A HIS 78.A NE2 GLN 52.A O no hydrogen 3.063 N/A SER 80.A N VAL 139.A O no hydrogen 2.830 N/A SER 80.A OG SER 81.A O.A no hydrogen 2.635 N/A SER 80.A OG SER 81.A O.B no hydrogen 2.719 N/A SER 80.A OG VAL 139.A O no hydrogen 3.317 N/A HIS 83.A N HIS 137.A O no hydrogen 2.941 N/A HIS 83.A ND1 SER 81.A O.A no hydrogen 2.964 N/A HIS 83.A ND1 SER 81.A O.B no hydrogen 2.797 N/A ASP 84.A N HIS 162.A O no hydrogen 3.394 N/A HIS 85.A N ASP 132.A OD1 no hydrogen 2.916 N/A THR 86.A OG1 THR 160.A O no hydrogen 2.492 N/A ASP 87.A N ASP 132.A OD2 no hydrogen 3.026 N/A SER 88.A N HIS 85.A O no hydrogen 2.842 N/A SER 88.A OG PRO 156.A O no hydrogen 2.776 N/A HIS 89.A N SER 155.A O no hydrogen 2.821 N/A HIS 89.A ND1 TYR 129.A OH no hydrogen 2.730 N/A CYS 90.A N ILE 130.A O no hydrogen 3.067 N/A PHE 91.A N LEU 153.A O no hydrogen 2.837 N/A LEU 92.A N.A ALA 128.A O no hydrogen 2.885 N/A LEU 92.A N.B ALA 128.A O no hydrogen 2.944 N/A LYS 93.A N LEU 151.A O no hydrogen 2.770 N/A LYS 93.A NZ LEU 34.A O no hydrogen 2.849 N/A LYS 93.A NZ TYR 37.A O no hydrogen 2.670 N/A LYS 93.A NZ ASN 125.A O no hydrogen 2.836 N/A LYS 93.A NZ ASN 125.A OD1 no hydrogen 3.283 N/A LEU 94.A N GLN 126.A O no hydrogen 2.967 N/A LEU 95.A N VAL 149.A O no hydrogen 2.766 N/A GLN 96.A N VAL 149.A O no hydrogen 2.981 N/A GLN 96.A NE2 PRO 147.A O no hydrogen 3.290 N/A LEU 99.A N LEU 122.A O no hydrogen 3.085 N/A LYS 100.A N GLU 140.A O no hydrogen 2.756 N/A GLU 101.A N ARG 120.A O no hydrogen 2.841 N/A THR 102.A N ARG 138.A O no hydrogen 2.937 N/A LEU 103.A N SER 118.A O no hydrogen 2.890 N/A PHE 104.A N LEU 136.A O no hydrogen 2.909 N/A TRP 106.A NE1 ASP 132.A O no hydrogen 2.790 N/A ASN 112.A N THR 168.A O no hydrogen 3.064 N/A MET 114.A N GLN 166.A O no hydrogen 2.824 N/A LYS 117.A N LEU 103.A O no hydrogen 2.792 N/A LYS 117.A NZ ASP 105.A OD1 no hydrogen 3.188 N/A ARG 120.A N GLU 101.A O no hydrogen 2.891 N/A ARG 120.A NE GLU 101.A OE1 no hydrogen 2.863 N/A ARG 120.A NH2 GLU 101.A OE1 no hydrogen 3.037 N/A LEU 122.A N LEU 99.A O no hydrogen 2.744 N/A ARG 123.A N GLN 126.A OE1 no hydrogen 2.955 N/A ARG 123.A NH1 ASN 98.A OD1 no hydrogen 3.173 N/A ASN 125.A N LEU 94.A O no hydrogen 2.838 N/A GLN 126.A N ARG 123.A O no hydrogen 2.934 N/A CYS 127.A N GLU 35.A OE1 no hydrogen 3.101 N/A CYS 127.A SG LEU 92.A O.A no hydrogen 3.532 N/A CYS 127.A SG ALA 128.A O no hydrogen 3.625 N/A ALA 128.A N LEU 92.A O.A no hydrogen 2.645 N/A ALA 128.A N LEU 92.A O.B no hydrogen 2.887 N/A TYR 129.A OH HIS 89.A ND1 no hydrogen 2.730 N/A ILE 130.A N CYS 90.A O no hydrogen 2.899 N/A ASN 131.A ND2 TYR 129.A OH no hydrogen 2.824 N/A SER 133.A OG.A ASN 131.A OD1 no hydrogen 2.484 N/A ILE 134.A N ASN 131.A O no hydrogen 3.020 N/A ILE 134.A N ASN 131.A OD1 no hydrogen 3.027 N/A GLY 135.A N ASN 131.A O no hydrogen 3.299 N/A LEU 136.A N PHE 104.A O no hydrogen 2.908 N/A HIS 137.A N HIS 83.A O no hydrogen 3.267 N/A HIS 137.A ND1 GLU 101.A OE2 no hydrogen 2.756 N/A HIS 137.A NE2 HIS 83.A NE2 no hydrogen 3.092 N/A ARG 138.A N THR 102.A O no hydrogen 2.892 N/A ARG 138.A NH1 SER 80.A O no hydrogen 3.150 N/A ARG 138.A NH2 GLN 166.A OE1 no hydrogen 2.753 N/A VAL 139.A N SER 80.A OG no hydrogen 2.908 N/A GLU 140.A N LYS 100.A O no hydrogen 2.881 N/A ASN 141.A N HIS 78.A O no hydrogen 2.774 N/A ASN 141.A ND2 TRP 74.A O no hydrogen 3.161 N/A ASN 141.A ND2 GLY 75.A O no hydrogen 3.142 N/A ASN 141.A ND2 GLU 146.A O no hydrogen 2.893 N/A SER 143.A N ASN 141.A OD1 no hydrogen 3.152 N/A THR 145.A N SER 143.A OG no hydrogen 3.142 N/A GLU 146.A N SER 143.A OG no hydrogen 2.854 N/A ALA 148.A N TRP 74.A O no hydrogen 2.911 N/A VAL 149.A N GLN 96.A O no hydrogen 2.882 N/A SER 150.A N LEU 72.A O no hydrogen 2.925 N/A SER 150.A OG HIS 152.A NE2 no hydrogen 2.647 N/A LEU 151.A N LYS 93.A O no hydrogen 2.739 N/A HIS 152.A N MET 70.A O no hydrogen 2.748 N/A HIS 152.A ND1 TYR 154.A OH no hydrogen 2.727 N/A HIS 152.A NE2 SER 150.A OG no hydrogen 2.647 N/A LEU 153.A N PHE 91.A O no hydrogen 2.910 N/A TYR 154.A N ASN 68.A O no hydrogen 3.003 N/A SER 155.A N HIS 89.A O no hydrogen 3.034 N/A SER 155.A OG LYS 66.A O no hydrogen 2.682 N/A CYS 161.A N VAL 174.A O no hydrogen 3.045 N/A CYS 161.A SG HIS 162.A O no hydrogen 3.955 N/A HIS 162.A N ASP 84.A OD1 no hydrogen 2.742 N/A HIS 162.A ND1 ASP 84.A OD2 no hydrogen 2.754 N/A ALA 163.A N ASN 172.A O no hydrogen 2.847 N/A PHE 164.A N ILE 82.A O no hydrogen 2.855 N/A ASP 165.A N HIS 170.A O no hydrogen 2.864 N/A ARG 167.A N ASP 165.A OD1 no hydrogen 3.038 N/A ARG 167.A NE GLU 113.A OE1 no hydrogen 3.089 N/A ARG 167.A NH2 GLU 113.A OE1 no hydrogen 3.463 N/A ARG 167.A NH2 GLU 113.A OE2 no hydrogen 3.060 N/A THR 168.A N ASP 165.A O no hydrogen 3.182 N/A THR 168.A OG1 ASP 165.A OD2 no hydrogen 2.622 N/A GLY 169.A N ASP 165.A O no hydrogen 2.653 N/A HIS 170.A N THR 168.A OG1 no hydrogen 3.094 N/A ASN 172.A N ALA 163.A O no hydrogen 2.879 N/A VAL 174.A N CYS 161.A O no hydrogen 2.802 N/A MET 176.A N ASP 159.A O no hydrogen 2.682 N/A HIS 179.A N ARG 57.A O no hydrogen 2.726 N/A SER 180.A OG ASN 58.A OD1 no hydrogen 2.651 N/A LYS 181.A N ILE 184.A O no hydrogen 2.856 N/A PHE 182.A N LEU 59.A O no hydrogen 2.860 N/A ILE 184.A N LYS 181.A O no hydrogen 2.977 N/A ARG 185.A NH1 HIS 179.A O no hydrogen 2.861 N/A THR 186.A N HIS 179.A O no hydrogen 3.047 N/A THR 186.A OG1 PHE 178.A O no hydrogen 3.496 N/A