Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3al3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N THR 40.A OG1 no hydrogen 2.966 N/A PHE 5.A N LEU 28.A O no hydrogen 2.709 N/A GLN 6.A N HIS 41.A O no hydrogen 3.013 N/A GLN 6.A NE2 ILE 30.A O no hydrogen 3.443 N/A GLN 6.A NE2 CYS 34.A O no hydrogen 2.857 N/A SER 8.A N VAL 43.A O no hydrogen 3.109 N/A SER 8.A OG SER 9.A OG.B no hydrogen 3.015 N/A SER 9.A OG.A SER 8.A O no hydrogen 2.811 N/A SER 9.A OG.A HIS 46.A O no hydrogen 2.929 N/A SER 9.A OG.B SER 8.A OG no hydrogen 3.015 N/A SER 9.A OG.B HIS 46.A O no hydrogen 3.312 N/A GLN 13.A N ASN 11.A OD1.B no hydrogen 3.111 N/A ARG 15.A N ASN 11.A O no hydrogen 2.989 N/A ARG 15.A NE LEU 10.A O no hydrogen 3.002 N/A ARG 15.A NH2 LEU 10.A O no hydrogen 3.251 N/A ILE 16.A N PRO 12.A O no hydrogen 3.022 N/A ASP 17.A N GLN 13.A O no hydrogen 2.929 N/A TYR 18.A N GLU 14.A O no hydrogen 2.897 N/A TYR 18.A OH GLU 70.A OE2 no hydrogen 2.447 N/A CYS 19.A N ARG 15.A O no hydrogen 2.907 N/A CYS 19.A SG.A ARG 15.A O no hydrogen 3.155 N/A CYS 19.A SG.B GLU 23.A OE2 no hydrogen 3.710 N/A HIS 20.A N ILE 16.A O no hydrogen 3.128 N/A LEU 21.A N ASP 17.A O no hydrogen 3.043 N/A ILE 22.A N TYR 18.A O no hydrogen 2.855 N/A GLU 23.A N CYS 19.A O no hydrogen 3.130 N/A LYS 24.A N HIS 20.A O no hydrogen 3.036 N/A LEU 25.A N LEU 21.A O no hydrogen 2.927 N/A GLY 26.A N GLU 23.A O no hydrogen 2.921 N/A GLY 27.A N ILE 22.A O no hydrogen 2.821 N/A LEU 28.A N TYR 3.A O no hydrogen 2.955 N/A ILE 30.A N PHE 5.A O no hydrogen 2.802 N/A LYS 32.A NZ ASP 36.A OD2 no hydrogen 2.722 N/A CYS 34.A SG.A PHE 35.A O no hydrogen 3.930 N/A PHE 35.A N GLU 51.A OE2 no hydrogen 2.908 N/A ASP 36.A N GLN 6.A OE1 no hydrogen 2.893 N/A THR 38.A N ASP 36.A OD1 no hydrogen 3.002 N/A THR 38.A OG1 ASP 36.A OD1 no hydrogen 3.077 N/A CYS 39.A N ASP 36.A O no hydrogen 3.114 N/A CYS 39.A SG ASP 36.A O no hydrogen 3.394 N/A CYS 39.A SG HIS 41.A O no hydrogen 4.018 N/A THR 40.A N ILE 4.A O no hydrogen 2.675 N/A THR 40.A OG1 GLN 2.A O no hydrogen 3.473 N/A THR 40.A OG1 ILE 4.A O no hydrogen 3.282 N/A THR 40.A OG1 HIS 41.A ND1 no hydrogen 2.791 N/A HIS 41.A N ILE 4.A O no hydrogen 3.106 N/A HIS 41.A ND1 THR 40.A OG1 no hydrogen 2.791 N/A HIS 41.A NE2 GLU 81.A OE2 no hydrogen 2.704 N/A ILE 42.A N TRP 62.A O no hydrogen 2.921 N/A VAL 43.A N GLN 6.A O no hydrogen 3.166 N/A VAL 44.A N LEU 64.A O no hydrogen 2.983 N/A GLY 45.A N SER 8.A O no hydrogen 3.034 N/A HIS 46.A N SER 9.A OG.A no hydrogen 2.693 N/A ASN 50.A ND2 SER 8.A OG no hydrogen 3.404 N/A LYS 52.A NZ LEU 7.A O no hydrogen 2.871 N/A LYS 52.A NZ LYS 32.A O no hydrogen 2.860 N/A TYR 53.A N ASN 50.A OD1 no hydrogen 3.231 N/A TYR 53.A OH LEU 105.A O no hydrogen 2.858 N/A LEU 54.A N ASN 50.A O no hydrogen 3.089 N/A ALA 55.A N GLU 51.A O no hydrogen 2.997 N/A SER 56.A N LYS 52.A O no hydrogen 3.070 N/A SER 56.A OG LYS 52.A O no hydrogen 2.654 N/A VAL 57.A N TYR 53.A O no hydrogen 3.092 N/A ALA 58.A N LEU 54.A O no hydrogen 2.913 N/A ALA 59.A N ALA 55.A O no hydrogen 3.108 N/A GLY 60.A N VAL 57.A O no hydrogen 2.862 N/A LYS 61.A N SER 56.A O no hydrogen 2.820 N/A LYS 61.A NZ PRO 37.A O no hydrogen 3.024 N/A LYS 61.A NZ CYS 39.A O no hydrogen 2.843 N/A TRP 62.A N THR 40.A O no hydrogen 3.387 N/A LEU 64.A N ILE 42.A O no hydrogen 2.808 N/A HIS 65.A N TYR 84.A O no hydrogen 2.938 N/A HIS 65.A ND1 SER 67.A OG no hydrogen 2.707 N/A ARG 66.A NH1 GLU 14.A OE1 no hydrogen 2.720 N/A SER 67.A N HIS 65.A ND1 no hydrogen 3.000 N/A SER 67.A OG HIS 65.A ND1 no hydrogen 2.707 N/A TYR 68.A N HIS 65.A O no hydrogen 2.957 N/A TYR 68.A OH VAL 79.A O no hydrogen 2.924 N/A LEU 69.A N ARG 66.A O no hydrogen 3.001 N/A GLU 70.A N ARG 66.A O no hydrogen 3.353 N/A ALA 71.A N SER 67.A O no hydrogen 2.887 N/A CYS 72.A N TYR 68.A O no hydrogen 2.938 N/A CYS 72.A SG TYR 68.A O no hydrogen 3.351 N/A ARG 73.A N LEU 69.A O no hydrogen 2.837 N/A ARG 73.A NH1 GLU 70.A OE1 no hydrogen 3.095 N/A ARG 73.A NH2 ASP 17.A OD2.B no hydrogen 2.889 N/A THR 74.A N GLU 70.A O no hydrogen 3.203 N/A THR 74.A OG1 GLU 70.A O no hydrogen 3.177 N/A ALA 75.A N ALA 71.A O no hydrogen 3.020 N/A GLY 76.A N CYS 72.A O no hydrogen 2.767 N/A GLU 81.A N GLU 81.A OE1 no hydrogen 2.700 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.914 N/A TYR 84.A N GLU 81.A O no hydrogen 2.888 N/A GLU 85.A N GLU 82.A O no hydrogen 3.459 N/A TRP 86.A N VAL 63.A O no hydrogen 2.951 N/A TRP 86.A NE1 VAL 44.A O no hydrogen 2.883 N/A SER 88.A N GLU 85.A O no hydrogen 3.015 N/A SER 88.A OG GLU 85.A O no hydrogen 2.853 N/A ILE 91.A N SER 88.A O no hydrogen 3.142 N/A LEU 92.A N SER 88.A O no hydrogen 2.815 N/A ASP 93.A N SER 89.A O no hydrogen 2.770 N/A VAL 94.A N ILE 91.A O no hydrogen 3.178 N/A LEU 95.A N ILE 91.A O no hydrogen 3.123 N/A GLN 102.A N ASN 99.A OD1 no hydrogen 2.948 N/A GLN 102.A NE2 PRO 47.A O no hydrogen 3.064 N/A ARG 103.A N ASN 99.A O no hydrogen 2.916 N/A ARG 104.A N VAL 100.A O no hydrogen 2.996 N/A LEU 105.A N GLN 101.A O no hydrogen 2.869 N/A ALA 106.A N GLN 102.A O no hydrogen 2.764 N/A LEU 107.A N ARG 103.A O no hydrogen 2.851 N/A ALA 108.A N ARG 104.A O no hydrogen 2.840 N/A ALA 109.A N LEU 105.A O no hydrogen 3.050 N/A MET 110.A N ALA 106.A O no hydrogen 3.265 N/A ARG 111.A N LEU 107.A O no hydrogen 2.969 N/A TRP 112.A N ALA 108.A O no hydrogen 2.845 N/A TRP 112.A NE1 LEU 200.A O no hydrogen 3.236 N/A ARG 113.A N ALA 109.A O no hydrogen 3.034 N/A ARG 113.A NE GLU 85.A OE2 no hydrogen 2.725 N/A ARG 113.A NH2 GLU 85.A OE1 no hydrogen 2.799 N/A ARG 113.A NH2 GLU 85.A OE2 no hydrogen 3.553 N/A LYS 114.A N MET 110.A O no hydrogen 2.993 N/A LYS 115.A N ARG 111.A O no hydrogen 3.019 N/A ILE 116.A N TRP 112.A O no hydrogen 3.020 N/A GLN 117.A N ARG 113.A O no hydrogen 3.130 N/A GLN 118.A N LYS 114.A O no hydrogen 3.349 N/A ARG 119.A N ILE 116.A O no hydrogen 3.076 N/A ARG 119.A NH1 GLU 126.A O no hydrogen 3.120 N/A GLN 120.A N ILE 116.A O no hydrogen 3.020 N/A SER 122.A N ARG 119.A O no hydrogen 3.160 N/A GLY 123.A N GLN 120.A O no hydrogen 2.851 N/A ILE 124.A N ARG 119.A O no hydrogen 2.911 N/A ALA 128.A N ALA 58.A O no hydrogen 3.061 N/A PHE 129.A N GLY 153.A O no hydrogen 2.800 N/A SER 130.A N GLY 127.A O no hydrogen 3.335 N/A TRP 132.A N PHE 129.A O no hydrogen 3.082 N/A LYS 133.A N THR 170.A OG1 no hydrogen 2.945 N/A VAL 134.A N LYS 156.A O no hydrogen 2.725 N/A ILE 135.A N HIS 171.A O no hydrogen 2.986 N/A HIS 137.A N PHE 173.A O no hydrogen 2.894 N/A VAL 138.A N GLU 143.A OE2 no hydrogen 3.457 N/A ASP 139.A N ASP 175.A OD2 no hydrogen 2.939 N/A SER 141.A N ASP 139.A OD2 no hydrogen 3.140 N/A SER 141.A OG ASP 139.A OD2 no hydrogen 2.519 N/A ARG 142.A N ASP 139.A O no hydrogen 2.823 N/A ARG 142.A NH1 ASP 175.A OD1 no hydrogen 3.062 N/A PHE 146.A N ARG 142.A O no hydrogen 3.191 N/A LYS 147.A N GLU 143.A O no hydrogen 2.948 N/A ARG 148.A N ALA 144.A O no hydrogen 3.061 N/A ARG 148.A NE GLU 51.A OE2 no hydrogen 2.938 N/A LEU 149.A N GLY 145.A O no hydrogen 2.979 N/A LEU 150.A N PHE 146.A O no hydrogen 2.842 N/A GLN 151.A N LYS 147.A O no hydrogen 2.899 N/A SER 152.A N ARG 148.A O no hydrogen 2.830 N/A SER 152.A OG ALA 55.A O no hydrogen 2.719 N/A GLY 153.A N LEU 149.A O no hydrogen 3.389 N/A GLY 154.A N GLN 151.A O no hydrogen 2.861 N/A ALA 155.A N LEU 150.A O no hydrogen 3.023 N/A LYS 156.A N TRP 132.A O no hydrogen 2.913 N/A LYS 156.A NZ GLU 168.A OE1 no hydrogen 3.435 N/A LEU 158.A N VAL 134.A O no hydrogen 2.794 N/A LEU 165.A N SER 162.A O no hydrogen 2.927 N/A PHE 166.A N VAL 163.A O no hydrogen 2.917 N/A LYS 167.A NZ PRO 164.A O no hydrogen 2.767 N/A GLU 168.A N LEU 165.A O no hydrogen 3.096 N/A ALA 169.A N PHE 166.A O no hydrogen 3.155 N/A THR 170.A N LYS 133.A O no hydrogen 2.885 N/A THR 170.A OG1 LYS 133.A O no hydrogen 3.433 N/A THR 170.A OG1 HIS 171.A ND1 no hydrogen 2.777 N/A HIS 171.A N LYS 133.A O no hydrogen 3.370 N/A HIS 171.A ND1 THR 170.A OG1 no hydrogen 2.777 N/A LEU 172.A N TYR 189.A O no hydrogen 2.664 N/A PHE 173.A N ILE 135.A O no hydrogen 3.025 N/A SER 174.A N LEU 191.A O no hydrogen 3.036 N/A SER 174.A OG HIS 137.A O no hydrogen 2.987 N/A LEU 176.A N SER 174.A OG no hydrogen 3.252 N/A ILE 180.A N VAL 178.A O no hydrogen 3.052 N/A GLU 182.A N ASN 179.A OD1 no hydrogen 3.371 N/A ALA 183.A N ASN 179.A O no hydrogen 3.372 N/A ALA 184.A N ILE 180.A O no hydrogen 2.924 N/A ALA 185.A N ALA 181.A O no hydrogen 2.817 N/A GLN 186.A N ALA 183.A O no hydrogen 2.905 N/A ASN 187.A N ALA 184.A O no hydrogen 2.897 N/A VAL 188.A N ALA 183.A O no hydrogen 3.306 N/A TYR 189.A N THR 170.A O no hydrogen 2.971 N/A CYS 190.A SG ILE 180.A O no hydrogen 3.715 N/A CYS 190.A SG VAL 188.A O no hydrogen 3.564 N/A LEU 191.A N LEU 172.A O no hydrogen 2.823 N/A ARG 192.A N TYR 211.A O no hydrogen 2.804 N/A ARG 192.A NH1 ASN 210.A O no hydrogen 3.074 N/A THR 193.A N SER 174.A O no hydrogen 3.161 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 2.807 N/A TYR 195.A N ARG 192.A O no hydrogen 3.177 N/A ILE 196.A N THR 193.A O no hydrogen 2.915 N/A ASP 198.A N GLU 194.A O no hydrogen 3.002 N/A TYR 199.A N TYR 195.A O no hydrogen 2.773 N/A LEU 200.A N ILE 196.A O no hydrogen 3.344 N/A MET 201.A N ALA 197.A O no hydrogen 2.789 N/A GLN 202.A N ASP 198.A O no hydrogen 3.047 N/A ASN 210.A N HIS 207.A O no hydrogen 2.932 N/A TYR 211.A N VAL 208.A O no hydrogen 2.833 N/A TYR 211.A OH ASP 198.A OD2 no hydrogen 2.597 N/A CYS 212.A SG.A LEU 213.A O no hydrogen 3.369 N/A CYS 212.A SG.B VAL 208.A O no hydrogen 3.974 N/A CYS 212.A SG.B GLU 209.A O no hydrogen 3.825 N/A LEU 213.A N CYS 190.A O no hydrogen 2.888 N/A GLU 215.A N GLU 215.A OE1 no hydrogen 2.512 N/A ALA 216.A N LEU 213.A O no hydrogen 3.050 N/A ILE 217.A N PRO 214.A O no hydrogen 3.254 N/A