Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7kd8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH1 GLU 4.A OE2 no hydrogen 3.332 N/A GLU 5.A N ARG 1.A O no hydrogen 3.007 N/A ALA 6.A N THR 2.A O no hydrogen 2.891 N/A GLN 7.A N LYS 3.A O no hydrogen 3.045 N/A GLU 8.A N GLU 4.A O no hydrogen 3.009 N/A THR 9.A N GLU 5.A O no hydrogen 2.880 N/A THR 9.A OG1 GLU 5.A O no hydrogen 3.135 N/A ARG 10.A N.A ALA 6.A O no hydrogen 2.927 N/A ARG 10.A N.B ALA 6.A O no hydrogen 2.941 N/A ARG 10.A NH1.A HIS 48.A O no hydrogen 3.492 N/A ALA 11.A N GLN 7.A O no hydrogen 3.080 N/A GLN 12.A N GLU 8.A O no hydrogen 2.912 N/A ILE 13.A N THR 9.A O no hydrogen 2.918 N/A ILE 14.A N ARG 10.A O.A no hydrogen 2.920 N/A ILE 14.A N ARG 10.A O.B no hydrogen 2.956 N/A GLU 15.A N ALA 11.A O no hydrogen 2.998 N/A ALA 16.A N GLN 12.A O no hydrogen 3.052 N/A ALA 17.A N ILE 13.A O no hydrogen 2.777 N/A GLU 18.A N ILE 14.A O no hydrogen 3.040 N/A ARG 19.A N GLU 15.A O no hydrogen 3.167 N/A ARG 19.A NE GLU 15.A OE1 no hydrogen 2.919 N/A ARG 19.A NE GLU 15.A OE2 no hydrogen 3.349 N/A ARG 19.A NH2 GLU 15.A OE1 no hydrogen 3.129 N/A ALA 20.A N ALA 16.A O no hydrogen 2.804 N/A PHE 21.A N ALA 17.A O no hydrogen 2.779 N/A TYR 22.A N GLU 18.A O no hydrogen 2.985 N/A LYS 23.A N ARG 19.A O no hydrogen 3.172 N/A ARG 24.A N ALA 20.A O no hydrogen 2.910 N/A GLY 25.A N PHE 21.A O no hydrogen 2.704 N/A VAL 26.A N LYS 113.A O no hydrogen 2.967 N/A ARG 28.A NH2 ARG 24.A O no hydrogen 3.375 N/A THR 29.A N VAL 26.A O no hydrogen 3.250 N/A THR 29.A OG1 GLY 25.A O no hydrogen 2.744 N/A THR 30.A N ASP 33.A OD2 no hydrogen 2.946 N/A ASP 33.A N THR 30.A OG1 no hydrogen 3.019 N/A ILE 34.A N THR 30.A O no hydrogen 3.124 N/A ALA 35.A N LEU 31.A O no hydrogen 2.909 N/A GLU 36.A N ALA 32.A O no hydrogen 3.155 N/A LEU 37.A N ASP 33.A O no hydrogen 3.142 N/A ALA 38.A N ILE 34.A O no hydrogen 2.855 N/A GLY 39.A N GLU 36.A O no hydrogen 3.164 N/A VAL 40.A N ALA 35.A O no hydrogen 3.064 N/A ALA 44.A N THR 41.A O no hydrogen 3.191 N/A TYR 46.A N GLY 43.A O no hydrogen 3.125 N/A TRP 47.A N ALA 44.A O no hydrogen 2.957 N/A HIS 48.A N ILE 45.A O no hydrogen 3.059 N/A HIS 48.A ND1 ALA 44.A O no hydrogen 3.132 N/A PHE 49.A N ILE 45.A O no hydrogen 2.927 N/A ASN 50.A N GLU 54.A OE1 no hydrogen 2.725 N/A ASN 50.A ND2 GLU 54.A OE1 no hydrogen 3.273 N/A ASN 50.A ND2 GLU 54.A OE2 no hydrogen 2.815 N/A ASN 51.A ND2 GLU 122.A OE1.A no hydrogen 3.373 N/A ASN 51.A ND2 GLU 122.A OE2.B no hydrogen 2.726 N/A LYS 52.A NZ VAL 26.A O no hydrogen 3.019 N/A LYS 52.A NZ THR 29.A O no hydrogen 2.930 N/A GLU 54.A N ASN 51.A O no hydrogen 3.210 N/A GLU 54.A N ASN 51.A OD1 no hydrogen 3.134 N/A VAL 56.A N LYS 52.A O no hydrogen 2.939 N/A GLN 57.A N ALA 53.A O no hydrogen 2.916 N/A GLN 57.A NE2 ASP 61.A OD2 no hydrogen 2.427 N/A ALA 58.A N GLU 54.A O no hydrogen 2.952 N/A LEU 59.A N LEU 55.A O no hydrogen 3.086 N/A LEU 60.A N VAL 56.A O no hydrogen 2.950 N/A ASP 61.A N GLN 57.A O no hydrogen 2.698 N/A SER 62.A N ALA 58.A O no hydrogen 3.058 N/A SER 62.A N LEU 59.A O no hydrogen 3.213 N/A SER 62.A OG LEU 59.A O no hydrogen 2.609 N/A LEU 63.A N LEU 60.A O no hydrogen 3.194 N/A HIS 64.A N ASP 61.A O no hydrogen 3.240 N/A THR 66.A OG1 GLU 96.A OE2 no hydrogen 2.848 N/A HIS 67.A N HIS 64.A O no hydrogen 3.147 N/A ASP 68.A N GLU 65.A O no hydrogen 3.343 N/A ALA 71.A N HIS 67.A O no hydrogen 3.038 N/A ARG 72.A N ASP 68.A O no hydrogen 2.936 N/A ARG 72.A NE GLU 75.A OE1 no hydrogen 3.198 N/A ARG 72.A NH2 GLU 75.A OE2 no hydrogen 3.200 N/A ALA 73.A N HIS 69.A O no hydrogen 3.169 N/A SER 74.A N LEU 70.A O no hydrogen 2.985 N/A SER 74.A OG ALA 71.A O no hydrogen 2.693 N/A GLU 75.A N ALA 71.A O no hydrogen 3.100 N/A GLU 75.A N ARG 72.A O no hydrogen 3.200 N/A SER 76.A N ALA 73.A O no hydrogen 3.070 N/A ASP 78.A N SER 76.A OG no hydrogen 3.105 N/A GLU 79.A N SER 76.A O no hydrogen 3.138 N/A ASP 81.A N GLU 79.A OE2 no hydrogen 2.966 N/A LEU 83.A N GLN 150.A OE1 no hydrogen 2.924 N/A GLY 84.A N ASP 81.A OD1 no hydrogen 3.071 N/A CYS 85.A N ASP 81.A O no hydrogen 2.943 N/A CYS 85.A SG ASP 81.A O no hydrogen 3.497 N/A MET 86.A N PRO 82.A O no hydrogen 3.158 N/A ARG 87.A N LEU 83.A O no hydrogen 2.924 N/A ARG 87.A NE ASP 193.A OD1 no hydrogen 2.820 N/A ARG 87.A NH2 ASP 193.A OD1 no hydrogen 3.475 N/A ARG 87.A NH2 ASP 193.A OD2 no hydrogen 2.975 N/A LYS 88.A N GLY 84.A O no hydrogen 2.961 N/A LEU 89.A N CYS 85.A O no hydrogen 2.860 N/A LEU 90.A N MET 86.A O no hydrogen 2.940 N/A LEU 91.A N ARG 87.A O no hydrogen 2.939 N/A GLN 92.A N LYS 88.A O no hydrogen 3.031 N/A GLN 92.A NE2 THR 66.A O no hydrogen 3.207 N/A GLN 92.A NE2 HIS 67.A ND1 no hydrogen 2.929 N/A VAL 93.A N LEU 89.A O no hydrogen 2.895 N/A PHE 94.A N LEU 90.A O no hydrogen 3.067 N/A ASN 95.A N LEU 91.A O no hydrogen 2.922 N/A GLU 96.A N GLN 92.A O no hydrogen 2.815 N/A LEU 97.A N VAL 93.A O no hydrogen 3.065 N/A VAL 98.A N PHE 94.A O no hydrogen 3.141 N/A LEU 99.A N ASN 95.A O no hydrogen 2.934 N/A ASP 100.A N GLU 96.A O no hydrogen 2.760 N/A ARG 102.A N ASP 100.A OD1 no hydrogen 3.242 N/A ARG 102.A NE GLU 18.A OE1 no hydrogen 3.048 N/A ARG 102.A NE GLU 18.A OE2 no hydrogen 2.704 N/A ARG 102.A NH2 GLU 18.A OE2 no hydrogen 2.747 N/A THR 103.A N ASP 100.A OD2 no hydrogen 3.178 N/A THR 103.A OG1 ASP 100.A OD2 no hydrogen 2.777 N/A ARG 104.A N ASP 100.A O no hydrogen 3.029 N/A ARG 105.A N ALA 101.A O no hydrogen 2.975 N/A ILE 106.A N ARG 102.A O no hydrogen 2.936 N/A ASN 107.A N THR 103.A O no hydrogen 2.965 N/A ASN 107.A ND2 THR 103.A O no hydrogen 2.958 N/A GLU 108.A N ARG 104.A O no hydrogen 2.910 N/A ILE 109.A N ARG 105.A O no hydrogen 2.933 N/A LEU 110.A N ILE 106.A O no hydrogen 2.973 N/A HIS 111.A N ASN 107.A O no hydrogen 2.786 N/A HIS 112.A N GLU 108.A O no hydrogen 2.841 N/A HIS 112.A ND1 GLU 108.A OE1 no hydrogen 2.844 N/A LYS 113.A N ILE 109.A O no hydrogen 2.833 N/A LYS 113.A NZ TYR 22.A O no hydrogen 2.787 N/A THR 117.A OG1.A GLU 115.A OE1 no hydrogen 3.000 N/A MET 120.A N.B THR 117.A O.B no hydrogen 2.869 N/A CYS 121.A N.A ASP 118.A O.A no hydrogen 3.028 N/A CYS 121.A SG.B GLN 125.A OE1 no hydrogen 3.477 N/A GLU 122.A N.A ASP 118.A OD2.A no hydrogen 2.928 N/A GLU 122.A N.B ASP 118.A OD2.A no hydrogen 2.876 N/A GLU 122.A N.B GLU 122.A OE1.B no hydrogen 3.251 N/A ILE 123.A N ASP 118.A OD1.A no hydrogen 3.185 N/A ILE 123.A N MET 120.A O.B no hydrogen 3.186 N/A GLN 125.A N CYS 121.A O.A no hydrogen 3.051 N/A GLN 125.A N CYS 121.A O.B no hydrogen 3.168 N/A GLN 126.A N GLU 122.A O.A no hydrogen 2.837 N/A GLN 126.A N GLU 122.A O.B no hydrogen 2.777 N/A ARG 127.A N ILE 123.A O no hydrogen 3.071 N/A ARG 127.A NH1 LEU 110.A O no hydrogen 3.174 N/A GLN 128.A N ARG 124.A O no hydrogen 2.900 N/A SER 129.A N GLN 125.A O no hydrogen 2.985 N/A SER 129.A OG GLN 125.A O no hydrogen 3.181 N/A ALA 130.A N GLN 126.A O no hydrogen 2.910 N/A VAL 131.A N ARG 127.A O no hydrogen 2.982 N/A LEU 132.A N GLN 128.A O no hydrogen 2.904 N/A ASP 133.A N SER 129.A O no hydrogen 2.987 N/A ILE 134.A N ALA 130.A O no hydrogen 3.038 N/A HIS 135.A N VAL 131.A O no hydrogen 2.817 N/A HIS 135.A NE2 GLU 158.A OE1 no hydrogen 3.012 N/A LYS 136.A N LEU 132.A O no hydrogen 2.874 N/A GLY 137.A N ASP 133.A O no hydrogen 3.123 N/A TRP 138.A N ILE 134.A O no hydrogen 2.823 N/A THR 139.A N HIS 135.A O no hydrogen 2.784 N/A THR 139.A OG1 HIS 135.A O no hydrogen 2.871 N/A LEU 140.A N LYS 136.A O no hydrogen 3.166 N/A ALA 141.A N GLY 137.A O no hydrogen 2.917 N/A LEU 142.A N TRP 138.A O no hydrogen 2.859 N/A ALA 143.A N THR 139.A O no hydrogen 2.873 N/A ASN 144.A N LEU 140.A O no hydrogen 2.808 N/A ASN 144.A ND2 SER 74.A O no hydrogen 3.260 N/A ALA 145.A N ALA 141.A O no hydrogen 2.956 N/A VAL 146.A N LEU 142.A O no hydrogen 2.829 N/A ARG 147.A N ALA 143.A O no hydrogen 3.060 N/A ARG 147.A NH1 ASN 144.A OD1 no hydrogen 2.748 N/A ARG 148.A N ASN 144.A O no hydrogen 3.015 N/A ARG 148.A NE GLU 79.A O no hydrogen 3.081 N/A ARG 148.A NH2 GLU 79.A O no hydrogen 3.462 N/A GLY 149.A N VAL 146.A O no hydrogen 2.915 N/A GLN 150.A N ALA 145.A O no hydrogen 2.751 N/A GLN 150.A NE2 ASP 81.A OD1 no hydrogen 2.678 N/A LEU 155.A N PRO 152.A O no hydrogen 3.102 N/A ASP 156.A N LEU 205.A O no hydrogen 2.824 N/A ARG 159.A N ASP 156.A OD1 no hydrogen 2.989 N/A ARG 159.A NE ASP 156.A OD2 no hydrogen 2.954 N/A ARG 159.A NH1 ALA 204.A O no hydrogen 2.804 N/A ARG 159.A NH2 ALA 204.A O no hydrogen 3.281 N/A ARG 159.A NH2 ARG 206.A O no hydrogen 3.458 N/A ALA 160.A N ASP 156.A O no hydrogen 2.863 N/A ALA 161.A N ALA 157.A O no hydrogen 2.987 N/A VAL 162.A N GLU 158.A O no hydrogen 3.171 N/A ALA 163.A N ARG 159.A O no hydrogen 2.901 N/A LEU 164.A N ALA 160.A O no hydrogen 2.885 N/A TYR 165.A N ALA 161.A O no hydrogen 3.021 N/A ALA 166.A N VAL 162.A O no hydrogen 2.884 N/A TYR 167.A N ALA 163.A O no hydrogen 3.086 N/A TYR 167.A OH TRP 191.A O no hydrogen 2.605 N/A VAL 168.A N LEU 164.A O no hydrogen 2.976 N/A ASP 169.A N TYR 165.A O no hydrogen 2.814 N/A GLY 170.A N ALA 166.A O no hydrogen 2.849 N/A LEU 171.A N TYR 167.A O no hydrogen 2.841 N/A ILE 172.A N VAL 168.A O no hydrogen 2.998 N/A ARG 173.A N ASP 169.A O no hydrogen 3.044 N/A ARG 173.A NH1 HIS 111.A ND1 no hydrogen 3.075 N/A ARG 173.A NH1 ASP 169.A OD2 no hydrogen 2.804 N/A ARG 173.A NH2 ASP 169.A OD2 no hydrogen 2.979 N/A ARG 174.A N.A GLY 170.A O no hydrogen 2.866 N/A ARG 174.A N.B GLY 170.A O no hydrogen 2.891 N/A ARG 174.A NH1.A SER 181.A OG no hydrogen 2.417 N/A TRP 175.A N LEU 171.A O no hydrogen 2.894 N/A LEU 176.A N ILE 172.A O no hydrogen 2.867 N/A LEU 177.A N ARG 173.A O no hydrogen 2.996 N/A LEU 178.A N ARG 174.A O.A no hydrogen 2.920 N/A LEU 178.A N ARG 174.A O.B no hydrogen 2.919 N/A SER 181.A N LEU 178.A O no hydrogen 3.101 N/A SER 181.A OG LEU 178.A O no hydrogen 2.795 N/A LEU 184.A N VAL 182.A O no hydrogen 2.847 N/A GLY 186.A N ASP 183.A OD1 no hydrogen 2.825 N/A ASP 187.A N ASP 183.A O no hydrogen 3.005 N/A VAL 188.A N LEU 185.A O no hydrogen 3.383 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.653 N/A TRP 191.A N ASP 187.A O no hydrogen 2.971 N/A VAL 192.A N VAL 188.A O no hydrogen 2.927 N/A ASP 193.A N GLU 189.A O no hydrogen 2.878 N/A THR 194.A N LYS 190.A O no hydrogen 2.901 N/A THR 194.A OG1 LYS 190.A O no hydrogen 2.834 N/A LEU 196.A N VAL 192.A O no hydrogen 3.061 N/A ASP 197.A N ASP 193.A O no hydrogen 2.713 N/A MET 198.A N THR 194.A O no hydrogen 3.258 N/A ARG 200.A N LEU 196.A O no hydrogen 3.105 N/A LEU 201.A N ASP 197.A O no hydrogen 3.021 N/A SER 202.A N MET 198.A O no hydrogen 3.085 N/A ALA 204.A N SER 202.A OG no hydrogen 3.262 N/A LEU 205.A N SER 202.A O no hydrogen 3.221 N/A ARG 206.A N PRO 203.A O no hydrogen 3.118 N/A ARG 206.A NH2 ARG 200.A O no hydrogen 3.054 N/A LYS 207.A N GLU 154.A O no hydrogen 2.687 N/A