Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5qi3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLU 146.A OE1 no hydrogen 2.612 N/A GLY 4.A N LYS 17.A O no hydrogen 2.901 N/A VAL 6.A N GLU 181.A OE1 no hydrogen 2.975 N/A SER 7.A N GLU 15.A O no hydrogen 3.009 N/A SER 8.A OG ASP 10.A O no hydrogen 3.088 N/A SER 8.A OG VAL 13.A O no hydrogen 2.802 N/A VAL 13.A N ASP 10.A O no hydrogen 2.941 N/A TYR 14.A N VAL 25.A O no hydrogen 3.012 N/A GLU 15.A N SER 7.A O no hydrogen 2.850 N/A MET 16.A N.A PHE 23.A O no hydrogen 2.923 N/A MET 16.A N.B PHE 23.A O no hydrogen 2.911 N/A ILE 18.A N ILE 21.A O no hydrogen 2.857 N/A GLY 19.A N PHE 2.A O no hydrogen 2.923 N/A ILE 21.A N ILE 18.A O no hydrogen 3.026 N/A ILE 22.A N LYS 158.A O no hydrogen 2.926 N/A PHE 23.A N MET 16.A O.A no hydrogen 2.882 N/A PHE 23.A N MET 16.A O.B no hydrogen 3.058 N/A GLN 24.A N VAL 160.A O no hydrogen 2.946 N/A GLN 24.A NE2 GLU 15.A OE1 no hydrogen 2.950 N/A VAL 25.A N TYR 14.A O no hydrogen 2.883 N/A ALA 26.A N VAL 162.A O no hydrogen 3.039 N/A SER 27.A OG.A ILE 164.A O no hydrogen 2.855 N/A GLY 28.A N ILE 164.A O no hydrogen 3.053 N/A THR 31.A N ASP 29.A OD1 no hydrogen 2.932 N/A THR 31.A OG1 ASP 29.A OD1 no hydrogen 2.759 N/A THR 31.A OG1 ASP 29.A OD2 no hydrogen 3.307 N/A LYS 32.A N ASP 29.A O no hydrogen 3.092 N/A GLU 33.A N ILE 30.A O no hydrogen 3.117 N/A ALA 35.A N ARG 88.A O no hydrogen 3.120 N/A ASP 36.A N SER 119.A OG no hydrogen 2.945 N/A VAL 37.A N SER 119.A O no hydrogen 3.239 N/A ILE 38.A N ASN 91.A O no hydrogen 3.276 N/A VAL 39.A N CYS 121.A O.A no hydrogen 2.936 N/A VAL 39.A N CYS 121.A O.B no hydrogen 2.935 N/A ASN 40.A N ILE 93.A O no hydrogen 2.950 N/A ASN 40.A ND2 HIS 94.A ND1 no hydrogen 3.164 N/A THR 42.A N VAL 95.A O no hydrogen 2.850 N/A SER 43.A N THR 42.A OG1 no hydrogen 2.744 N/A SER 43.A OG SER 45.A OG.A no hydrogen 3.160 N/A SER 45.A OG.A SER 43.A OG no hydrogen 3.160 N/A PHE 46.A N SER 43.A O no hydrogen 3.065 N/A LYS 49.A NZ GLU 65.A OE1 no hydrogen 2.731 N/A LYS 49.A NZ GLU 65.A OE2 no hydrogen 3.128 N/A ALA 50.A N SER 53.A OG no hydrogen 3.058 N/A SER 53.A OG ALA 50.A O no hydrogen 2.772 N/A ALA 55.A N GLY 51.A O no hydrogen 3.255 N/A ILE 56.A N VAL 52.A O no hydrogen 2.930 N/A LEU 57.A N SER 53.A O no hydrogen 2.995 N/A GLU 58.A N LYS 54.A O no hydrogen 2.979 N/A CYS 59.A N.A ALA 55.A O no hydrogen 2.985 N/A CYS 59.A N.B ALA 55.A O no hydrogen 3.026 N/A CYS 59.A SG.A PHE 86.A O no hydrogen 3.965 N/A CYS 59.A SG.B ALA 55.A O no hydrogen 3.388 N/A ALA 60.A N ILE 56.A O no hydrogen 2.843 N/A GLY 61.A N LEU 57.A O no hydrogen 3.048 N/A GLU 65.A N GLY 61.A O no hydrogen 3.254 N/A ARG 66.A N GLN 62.A O no hydrogen 2.943 N/A ARG 66.A NH2 ASN 63.A OD1 no hydrogen 2.851 N/A GLU 67.A N ASN 63.A O no hydrogen 2.928 N/A CYS 68.A N VAL 64.A O no hydrogen 2.986 N/A CYS 68.A SG VAL 64.A O no hydrogen 3.432 N/A SER 69.A N.A GLU 65.A O no hydrogen 3.265 N/A SER 69.A N.B GLU 65.A O no hydrogen 3.271 N/A SER 69.A OG.A ARG 66.A O no hydrogen 3.215 N/A GLN 70.A N ARG 66.A O no hydrogen 3.068 N/A GLN 71.A N GLU 67.A O no hydrogen 3.095 N/A GLN 71.A NE2 ILE 81.A O no hydrogen 2.958 N/A ALA 72.A N CYS 68.A O no hydrogen 2.978 N/A GLN 73.A N SER 69.A O.A no hydrogen 3.208 N/A GLN 73.A N SER 69.A O.B no hydrogen 3.288 N/A GLN 74.A N GLN 70.A O no hydrogen 3.283 N/A GLN 74.A N GLN 71.A O no hydrogen 3.191 N/A ASN 77.A ND2 GLN 71.A O no hydrogen 3.122 N/A TYR 79.A OH GLU 111.A OE2 no hydrogen 2.661 N/A ILE 80.A N HIS 94.A O no hydrogen 3.063 N/A THR 82.A N ILE 92.A O no hydrogen 2.957 N/A THR 82.A OG1 GLY 83.A O no hydrogen 2.902 N/A THR 82.A OG1 HIS 94.A NE2 no hydrogen 2.921 N/A GLY 83.A N GLU 67.A OE1 no hydrogen 3.026 N/A PHE 86.A N ALA 60.A O no hydrogen 2.935 N/A LEU 87.A N GLY 84.A O no hydrogen 2.997 N/A ARG 88.A NH2 LYS 32.A O no hydrogen 2.952 N/A CYS 89.A SG ASN 91.A O no hydrogen 3.357 N/A LYS 90.A N ASP 36.A O no hydrogen 2.873 N/A LYS 90.A NZ ASP 36.A OD1 no hydrogen 2.976 N/A ASN 91.A N ASP 36.A O no hydrogen 3.210 N/A ASN 91.A ND2 THR 82.A O no hydrogen 2.991 N/A ILE 92.A N THR 82.A O no hydrogen 3.070 N/A ILE 93.A N ILE 38.A O no hydrogen 3.118 N/A HIS 94.A N ILE 80.A O no hydrogen 2.836 N/A HIS 94.A NE2 THR 82.A OG1 no hydrogen 2.921 N/A VAL 95.A N ASN 40.A O no hydrogen 2.870 N/A GLY 97.A N THR 42.A O no hydrogen 2.820 N/A ASN 99.A N ILE 96.A O no hydrogen 3.043 N/A LYS 102.A NZ ASP 147.A OD2 no hydrogen 2.690 N/A SER 103.A N.A ASP 100.A OD1.A no hydrogen 2.944 N/A SER 103.A N.A ASP 100.A OD1.B no hydrogen 3.104 N/A SER 103.A N.B ASP 100.A OD1.A no hydrogen 2.953 N/A SER 103.A N.B ASP 100.A OD1.B no hydrogen 3.111 N/A SER 103.A OG.A ASP 100.A OD1.A no hydrogen 2.737 N/A SER 104.A N ASP 100.A O.A no hydrogen 3.068 N/A SER 104.A N ASP 100.A O.B no hydrogen 3.061 N/A SER 104.A OG ASP 100.A O.A no hydrogen 3.257 N/A SER 104.A OG ASP 100.A O.B no hydrogen 3.297 N/A VAL 105.A N VAL 101.A O no hydrogen 2.952 N/A SER 106.A N LYS 102.A O no hydrogen 2.918 N/A SER 106.A OG LYS 102.A O no hydrogen 3.011 N/A SER 107.A N SER 103.A O.A no hydrogen 3.006 N/A SER 107.A N SER 103.A O.B no hydrogen 3.001 N/A SER 107.A OG SER 103.A O.A no hydrogen 3.201 N/A SER 107.A OG SER 103.A O.B no hydrogen 3.193 N/A VAL 108.A N SER 104.A O no hydrogen 3.033 N/A LEU 109.A N VAL 105.A O no hydrogen 2.936 N/A GLN 110.A N SER 106.A O no hydrogen 3.048 N/A GLU 111.A N SER 107.A O no hydrogen 2.948 N/A CYS 112.A N VAL 108.A O no hydrogen 2.969 N/A CYS 112.A SG VAL 108.A O no hydrogen 3.372 N/A GLU 113.A N LEU 109.A O no hydrogen 3.042 N/A LYS 114.A N.A GLN 110.A O no hydrogen 3.074 N/A LYS 114.A N.B GLN 110.A O no hydrogen 3.075 N/A LYS 115.A N GLU 111.A O no hydrogen 3.285 N/A LYS 115.A N CYS 112.A O no hydrogen 3.224 N/A ASN 116.A N GLU 113.A O no hydrogen 3.039 N/A TYR 117.A N CYS 112.A O no hydrogen 2.993 N/A TYR 117.A OH ASN 91.A OD1 no hydrogen 2.629 N/A SER 118.A N ASP 36.A OD2 no hydrogen 2.887 N/A SER 118.A OG ASP 36.A OD2 no hydrogen 3.381 N/A SER 119.A N ASP 36.A OD2 no hydrogen 3.383 N/A ILE 120.A N LYS 159.A O no hydrogen 3.005 N/A CYS 121.A N.A VAL 37.A O no hydrogen 2.929 N/A CYS 121.A N.B VAL 37.A O no hydrogen 2.918 N/A CYS 121.A SG.A LYS 161.A O no hydrogen 3.665 N/A CYS 121.A SG.B GLU 33.A OE1 no hydrogen 3.771 N/A LEU 122.A N LYS 161.A O no hydrogen 2.905 N/A ILE 125.A N PRO 123.A O no hydrogen 2.874 N/A GLY 126.A N SER 41.A OG no hydrogen 3.288 N/A THR 127.A N ALA 124.A O no hydrogen 3.139 N/A THR 127.A OG1 ALA 124.A O no hydrogen 2.800 N/A LYS 131.A N GLY 128.A O no hydrogen 2.974 N/A GLN 132.A N GLY 126.A O no hydrogen 2.852 N/A GLN 132.A NE2 GLY 97.A O no hydrogen 2.816 N/A GLN 132.A NE2 ASN 99.A O no hydrogen 3.059 N/A LYS 136.A N ASP 135.A OD1 no hydrogen 2.949 N/A VAL 137.A N HIS 133.A O no hydrogen 3.034 N/A ALA 138.A N PRO 134.A O no hydrogen 2.952 N/A GLU 139.A N ASP 135.A O no hydrogen 3.154 N/A ALA 140.A N LYS 136.A O no hydrogen 2.998 N/A ILE 141.A N VAL 137.A O no hydrogen 2.965 N/A ILE 142.A N ALA 138.A O no hydrogen 3.143 N/A ASP 143.A N GLU 139.A O no hydrogen 2.930 N/A ALA 144.A N ALA 140.A O no hydrogen 3.009 N/A ILE 145.A N ILE 141.A O no hydrogen 3.264 N/A GLU 146.A N ILE 142.A O no hydrogen 2.955 N/A ASP 147.A N ASP 143.A O no hydrogen 2.971 N/A PHE 148.A N.A ALA 144.A O no hydrogen 3.087 N/A PHE 148.A N.B ALA 144.A O no hydrogen 3.091 N/A VAL 149.A N ILE 145.A O no hydrogen 3.015 N/A GLN 150.A N GLU 146.A O no hydrogen 2.847 N/A LYS 151.A N ASP 147.A O no hydrogen 3.051 N/A GLY 152.A N VAL 149.A O no hydrogen 3.037 N/A SER 153.A N PHE 148.A O.A no hydrogen 3.077 N/A SER 153.A N PHE 148.A O.B no hydrogen 3.083 N/A GLN 155.A N.A GLU 113.A OE2 no hydrogen 2.989 N/A GLN 155.A N.B GLU 113.A OE2 no hydrogen 2.992 N/A GLN 155.A NE2.A ALA 154.A O no hydrogen 3.168 N/A GLN 155.A NE2.B GLY 152.A O no hydrogen 3.029 N/A SER 156.A N.A GLU 113.A OE1 no hydrogen 2.938 N/A SER 156.A N.B GLU 113.A OE1 no hydrogen 2.920 N/A SER 156.A OG.B GLU 113.A OE1 no hydrogen 3.092 N/A SER 156.A OG.B TYR 117.A O no hydrogen 2.867 N/A VAL 157.A N GLU 113.A OE2 no hydrogen 2.947 N/A LYS 158.A N SER 118.A O no hydrogen 2.864 N/A LYS 158.A NZ GLN 155.A O.A no hydrogen 3.229 N/A LYS 158.A NZ GLN 155.A O.B no hydrogen 3.284 N/A LYS 159.A N SER 118.A O no hydrogen 3.079 N/A VAL 160.A N ILE 22.A O no hydrogen 2.977 N/A LYS 161.A N ILE 120.A O no hydrogen 2.962 N/A LYS 161.A NZ GLU 33.A OE1 no hydrogen 2.983 N/A VAL 162.A N GLN 24.A O no hydrogen 2.855 N/A VAL 163.A N LEU 122.A O no hydrogen 2.902 N/A ILE 164.A N ALA 26.A O no hydrogen 2.887 N/A VAL 169.A N LEU 166.A O no hydrogen 2.897 N/A LEU 170.A N.A LEU 166.A O no hydrogen 3.312 N/A LEU 170.A N.B LEU 166.A O no hydrogen 3.311 N/A ASP 171.A N PRO 167.A O no hydrogen 3.251 N/A PHE 173.A N VAL 169.A O no hydrogen 3.240 N/A TYR 174.A N.A LEU 170.A O.A no hydrogen 2.939 N/A TYR 174.A N.A LEU 170.A O.B no hydrogen 2.933 N/A TYR 174.A N.B LEU 170.A O.A no hydrogen 2.925 N/A TYR 174.A N.B LEU 170.A O.B no hydrogen 2.918 N/A ALA 175.A N ASP 171.A O no hydrogen 3.035 N/A ASN 176.A N VAL 172.A O no hydrogen 3.163 N/A ASN 176.A ND2 GLU 139.A OE1 no hydrogen 2.864 N/A MET 177.A N PHE 173.A O no hydrogen 3.006 N/A LYS 178.A N TYR 174.A O.A no hydrogen 3.003 N/A LYS 178.A N TYR 174.A O.B no hydrogen 3.066 N/A LYS 178.A NZ GLU 181.A OE2 no hydrogen 2.752 N/A LYS 179.A N ALA 175.A O no hydrogen 2.985 N/A LYS 179.A NZ GLU 139.A OE1 no hydrogen 2.824 N/A ARG 180.A N ASN 176.A O no hydrogen 3.128 N/A ARG 180.A NE ASN 176.A OD1 no hydrogen 2.820 N/A ARG 180.A NH1 TYR 3.A OH no hydrogen 2.912 N/A ARG 180.A NH1 ASP 143.A OD1 no hydrogen 2.873 N/A ARG 180.A NH2 GLU 139.A O no hydrogen 3.232 N/A ARG 180.A NH2 ASP 143.A OD1 no hydrogen 2.982 N/A ARG 180.A NH2 ASN 176.A OD1 no hydrogen 3.451 N/A GLY 182.A N GLY 4.A O no hydrogen 3.073 N/A