Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4m16_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A NE2 HIS 4.A ND1 no hydrogen 2.835 N/A HIS 4.A ND1 HIS 2.A NE2 no hydrogen 2.835 N/A MET 8.A N HIS 6.A ND1 no hydrogen 3.316 N/A VAL 9.A N HIS 6.A O no hydrogen 2.982 N/A LEU 10.A N HIS 6.A O no hydrogen 3.118 N/A ASN 11.A N HIS 7.A O no hydrogen 2.919 N/A ASN 11.A ND2 ILE 91.A O no hydrogen 3.019 N/A TYR 12.A N VAL 9.A O no hydrogen 3.413 N/A PHE 13.A N LEU 10.A O no hydrogen 2.958 N/A TYR 14.A N THR 19.A O no hydrogen 2.949 N/A THR 17.A N TYR 14.A O no hydrogen 2.975 N/A THR 17.A OG1 TYR 14.A O no hydrogen 2.914 N/A THR 17.A OG1 THR 19.A O no hydrogen 3.556 N/A THR 19.A N THR 17.A OG1 no hydrogen 3.020 N/A THR 19.A OG1 MET 27.A O no hydrogen 2.816 N/A LYS 21.A N TYR 12.A O no hydrogen 2.864 N/A LYS 21.A NZ ASN 11.A O no hydrogen 3.080 N/A LYS 21.A NZ ASP 88.A OD2 no hydrogen 2.753 N/A ASN 22.A N TYR 14.A OH no hydrogen 3.111 N/A ASN 22.A ND2 LEU 20.A O no hydrogen 2.915 N/A ASN 22.A ND2 ILE 26.A O no hydrogen 2.905 N/A LYS 23.A N ALA 72.A O no hydrogen 2.637 N/A LYS 23.A NZ GLY 70.A O no hydrogen 2.686 N/A GLY 25.A N ASN 22.A O no hydrogen 3.172 N/A ILE 26.A N ASN 22.A OD1 no hydrogen 2.977 N/A GLN 31.A N GLN 31.A OE1.A no hydrogen 2.647 N/A LEU 32.A N GLY 28.A O no hydrogen 2.988 N/A GLU 33.A N TYR 29.A O no hydrogen 2.983 N/A LYS 34.A N LYS 30.A O no hydrogen 3.015 N/A ARG 35.A N GLN 31.A O no hydrogen 3.073 N/A ARG 35.A NE ASN 39.A OD1 no hydrogen 2.942 N/A CYS 36.A N LEU 32.A O no hydrogen 2.893 N/A CYS 36.A SG LEU 32.A O no hydrogen 3.511 N/A LYS 37.A N GLU 33.A O no hydrogen 3.031 N/A ARG 38.A N LYS 34.A O no hydrogen 3.009 N/A ASN 39.A N ARG 35.A O no hydrogen 2.886 N/A ALA 40.A N CYS 36.A O no hydrogen 3.029 N/A LYS 41.A N LYS 37.A O no hydrogen 3.074 N/A LYS 41.A NZ ASN 45.A OD1 no hydrogen 2.785 N/A LYS 42.A N ARG 38.A O no hydrogen 3.210 N/A VAL 43.A N ASN 39.A O no hydrogen 3.182 N/A ILE 44.A N ALA 40.A O no hydrogen 2.854 N/A ASN 45.A N LYS 41.A O no hydrogen 2.930 N/A SER 46.A N LYS 42.A O no hydrogen 3.239 N/A SER 46.A OG GLU 50.A OE2 no hydrogen 2.642 N/A LEU 47.A N VAL 43.A O no hydrogen 3.005 N/A ARG 48.A N ASN 45.A O no hydrogen 3.240 N/A ASN 49.A N SER 46.A O no hydrogen 2.992 N/A GLU 50.A N LEU 47.A O no hydrogen 3.314 N/A PHE 56.A N ASN 128.A OD1 no hydrogen 3.076 N/A SER 58.A N ASP 120.A OD1 no hydrogen 2.691 N/A SER 58.A OG ASP 120.A OD1 no hydrogen 3.370 N/A SER 58.A OG ASP 120.A OD2 no hydrogen 2.561 N/A TYR 60.A N ASP 57.A OD1 no hydrogen 2.960 N/A LEU 61.A N ASP 57.A O no hydrogen 2.946 N/A LYS 62.A N SER 58.A O no hydrogen 2.873 N/A TYR 63.A N SER 59.A O no hydrogen 3.004 N/A LEU 64.A N TYR 60.A O no hydrogen 2.922 N/A HIS 65.A N LEU 61.A O no hydrogen 2.982 N/A HIS 65.A NE2 ALA 156.A O no hydrogen 2.813 N/A LYS 66.A N LYS 62.A O no hydrogen 2.947 N/A ARG 67.A N TYR 63.A O no hydrogen 2.969 N/A ARG 67.A NH1 GLU 50.A OE1 no hydrogen 2.765 N/A ARG 67.A NH1 GLU 50.A OE2 no hydrogen 3.315 N/A ARG 67.A NH1 TYR 63.A OH no hydrogen 2.881 N/A ARG 67.A NH2 GLU 50.A OE2 no hydrogen 2.874 N/A LEU 68.A N LEU 64.A O no hydrogen 2.906 N/A PHE 69.A N HIS 65.A O no hydrogen 2.955 N/A ALA 72.A N PHE 69.A O no hydrogen 3.052 N/A PHE 73.A N PHE 69.A O no hydrogen 2.853 N/A ALA 76.A N PHE 73.A O no hydrogen 3.102 N/A GLY 77.A N HIS 65.A ND1 no hydrogen 3.001 N/A TYR 78.A N TRP 75.A O no hydrogen 2.899 N/A THR 79.A OG1 ASP 81.A OD1 no hydrogen 2.613 N/A ARG 80.A N PRO 153.A O no hydrogen 2.832 N/A ARG 80.A NE HIS 152.A O no hydrogen 2.743 N/A ARG 80.A NH1 MET 94.A O no hydrogen 3.077 N/A ARG 80.A NH1 SER 95.A O no hydrogen 3.052 N/A ARG 80.A NH1 ALA 107.A O no hydrogen 3.411 N/A ARG 80.A NH2 ALA 107.A O no hydrogen 2.767 N/A ARG 80.A NH2 ILE 151.A O no hydrogen 3.043 N/A ARG 80.A NH2 HIS 152.A O no hydrogen 3.129 N/A LEU 82.A N THR 79.A O no hydrogen 3.253 N/A PHE 84.A N ALA 92.A O no hydrogen 2.744 N/A PHE 86.A N THR 90.A O no hydrogen 2.954 N/A ASP 87.A N GLU 74.A OE1 no hydrogen 2.778 N/A GLY 89.A N PHE 86.A O no hydrogen 3.026 N/A THR 90.A N ASP 88.A OD1 no hydrogen 2.817 N/A THR 90.A OG1 ASP 88.A OD1 no hydrogen 2.607 N/A ALA 92.A N PHE 84.A O no hydrogen 2.903 N/A GLN 93.A N MET 8.A O no hydrogen 2.919 N/A GLN 93.A NE2 ASP 81.A O no hydrogen 3.255 N/A LYS 98.A NZ THR 102.A O no hydrogen 3.228 N/A ILE 99.A N ILE 104.A O no hydrogen 2.884 N/A THR 102.A N ILE 99.A O no hydrogen 3.038 N/A THR 102.A OG1 ILE 99.A O no hydrogen 2.637 N/A ILE 104.A N THR 102.A OG1 no hydrogen 2.895 N/A PHE 106.A N MET 97.A O no hydrogen 2.923 N/A ALA 107.A N TYR 150.A O no hydrogen 2.980 N/A GLY 109.A N SER 95.A O no hydrogen 2.856 N/A ASP 110.A N HIS 108.A ND1 no hydrogen 3.068 N/A LYS 111.A N HIS 108.A O no hydrogen 2.919 N/A LYS 111.A NZ GLU 114.A OE1 no hydrogen 3.271 N/A ILE 112.A N GLY 109.A O no hydrogen 3.172 N/A GLN 113.A NE2 ASP 81.A OD2 no hydrogen 3.016 N/A ASN 115.A N LYS 111.A O no hydrogen 2.859 N/A LEU 116.A N ILE 112.A O no hydrogen 2.852 N/A LYS 117.A N GLN 113.A O no hydrogen 2.988 N/A GLU 118.A N GLU 114.A O no hydrogen 2.938 N/A PHE 119.A N ASN 115.A O no hydrogen 2.883 N/A ASP 120.A N LEU 116.A O no hydrogen 2.836 N/A GLU 121.A N LYS 117.A O no hydrogen 2.902 N/A ILE 122.A N GLU 118.A O no hydrogen 2.997 N/A LEU 123.A N PHE 119.A O no hydrogen 3.170 N/A ALA 124.A N ASP 120.A O no hydrogen 2.946 N/A SER 125.A N GLU 121.A O no hydrogen 2.892 N/A SER 125.A OG GLU 121.A O no hydrogen 3.416 N/A SER 125.A OG ILE 122.A O no hydrogen 2.863 N/A LYS 126.A N ILE 122.A O no hydrogen 3.186 N/A LYS 126.A N LEU 123.A O no hydrogen 3.219 N/A SER 127.A N ALA 124.A O no hydrogen 3.135 N/A ASN 128.A N LEU 123.A O no hydrogen 2.918 N/A LEU 129.A N LYS 126.A O no hydrogen 2.902 N/A GLN 130.A N SER 127.A O no hydrogen 3.228 N/A ARG 134.A NE SER 214.A O no hydrogen 2.900 N/A ARG 134.A NH2 SER 214.A OG no hydrogen 2.741 N/A ASP 136.A N SER 133.A OG no hydrogen 3.114 N/A PHE 137.A N SER 133.A O no hydrogen 2.879 N/A ILE 138.A N ARG 134.A O no hydrogen 2.797 N/A GLU 139.A N GLU 135.A O no hydrogen 3.082 N/A GLU 140.A N ASP 136.A O no hydrogen 2.956 N/A THR 141.A N PHE 137.A O no hydrogen 2.933 N/A THR 141.A OG1.A PHE 137.A O no hydrogen 2.835 N/A THR 141.A OG1.A ILE 138.A O no hydrogen 3.262 N/A THR 141.A OG1.B PHE 137.A O no hydrogen 2.731 N/A VAL 142.A N ILE 138.A O no hydrogen 2.898 N/A LYS 143.A N GLU 139.A O no hydrogen 3.357 N/A LYS 143.A NZ GLU 139.A OE2.A no hydrogen 2.945 N/A LYS 143.A NZ GLU 140.A OE2 no hydrogen 2.954 N/A LEU 144.A N GLU 140.A O no hydrogen 3.035 N/A PHE 145.A N THR 141.A O no hydrogen 2.727 N/A SER 146.A N VAL 142.A O no hydrogen 2.945 N/A SER 146.A OG VAL 142.A O no hydrogen 2.986 N/A PHE 147.A N LYS 143.A O no hydrogen 2.977 N/A LEU 148.A N LEU 144.A O no hydrogen 2.920 N/A ASN 149.A N PHE 145.A O no hydrogen 2.831 N/A TYR 150.A N SER 146.A O no hydrogen 2.958 N/A ILE 151.A N PHE 147.A O no hydrogen 2.990 N/A HIS 152.A N LEU 148.A O no hydrogen 3.105 N/A HIS 152.A ND1 ASN 149.A O no hydrogen 2.824 N/A HIS 152.A NE2 GLU 159.A OE2 no hydrogen 2.625 N/A PHE 154.A N ASN 158.A OD1 no hydrogen 2.888 N/A ARG 155.A NH1 ARG 155.A O no hydrogen 2.931 N/A ASN 158.A ND2 PHE 154.A O no hydrogen 2.798 N/A VAL 161.A N GLY 157.A O no hydrogen 3.164 N/A GLN 162.A N ASN 158.A O no hydrogen 3.029 N/A GLN 162.A NE2 ASN 149.A OD1 no hydrogen 3.065 N/A HIS 163.A N GLU 159.A O no hydrogen 3.066 N/A ILE 164.A N ALA 160.A O no hydrogen 3.409 N/A PHE 165.A N VAL 161.A O no hydrogen 2.940 N/A PHE 166.A N GLN 162.A O no hydrogen 3.000 N/A GLU 167.A N HIS 163.A O no hydrogen 3.001 N/A LYS 168.A N ILE 164.A O no hydrogen 2.951 N/A LYS 168.A NZ LEU 47.A O no hydrogen 2.823 N/A LEU 169.A N PHE 165.A O no hydrogen 2.889 N/A ALA 170.A N PHE 166.A O no hydrogen 2.974 N/A GLU 171.A N GLU 167.A O no hydrogen 3.013 N/A ALA 172.A N LYS 168.A O no hydrogen 2.984 N/A ALA 173.A N LEU 169.A O no hydrogen 3.150 N/A ALA 173.A N ALA 170.A O no hydrogen 3.160 N/A GLY 174.A N GLU 171.A O no hydrogen 3.293 N/A HIS 175.A N ALA 170.A O no hydrogen 2.873 N/A HIS 175.A NE2 LEU 132.A O no hydrogen 3.002 N/A ASP 178.A N ILE 213.A O no hydrogen 2.929 N/A PHE 179.A N GLU 167.A OE2 no hydrogen 2.857 N/A SER 180.A N ASP 178.A OD1 no hydrogen 2.964 N/A SER 180.A OG ASP 178.A OD1 no hydrogen 2.672 N/A SER 180.A OG ASP 178.A OD2 no hydrogen 3.399 N/A VAL 181.A N ASP 178.A O no hydrogen 3.173 N/A VAL 182.A N PHE 179.A O no hydrogen 3.419 N/A ARG 186.A N THR 183.A OG1 no hydrogen 3.143 N/A ARG 186.A NH2 ASP 212.A OD2 no hydrogen 2.302 N/A ILE 187.A N THR 183.A O no hydrogen 3.091 N/A MET 188.A N GLU 184.A O no hydrogen 2.879 N/A ARG 189.A N GLU 185.A O no hydrogen 2.870 N/A ALA 190.A N ARG 186.A O no hydrogen 3.121 N/A CYS 191.A N ILE 187.A O no hydrogen 3.032 N/A CYS 191.A SG ASN 149.A OD1 no hydrogen 3.841 N/A CYS 191.A SG ILE 187.A O no hydrogen 3.381 N/A ASN 192.A N MET 188.A O no hydrogen 2.802 N/A ASP 193.A N ARG 189.A O no hydrogen 2.847 N/A ALA 194.A N ALA 190.A O no hydrogen 2.996 N/A MET 195.A N CYS 191.A O no hydrogen 3.367 N/A MET 195.A N ASN 192.A O no hydrogen 3.128 N/A ALA 196.A N ASN 192.A O no hydrogen 2.856 N/A LEU 197.A N ASP 193.A O no hydrogen 2.920 N/A ALA 202.A N LYS 198.A O no hydrogen 3.202 N/A HIS 203.A N GLY 199.A O no hydrogen 3.149 N/A HIS 203.A NE2 GLU 139.A OE1.A no hydrogen 3.028 N/A HIS 203.A NE2 GLU 139.A OE1.B no hydrogen 3.079 N/A GLN 204.A N GLU 200.A O no hydrogen 2.987 N/A GLN 204.A NE2 SER 208.A OG no hydrogen 3.256 N/A ALA 205.A N GLU 201.A O no hydrogen 3.166 N/A LYS 207.A N HIS 203.A O no hydrogen 2.872 N/A LYS 207.A NZ GLU 139.A OE2.B no hydrogen 2.953 N/A SER 208.A N GLN 204.A O no hydrogen 3.184 N/A SER 208.A OG GLN 204.A O no hydrogen 2.780 N/A PHE 210.A N MET 206.A O no hydrogen 2.992 N/A GLU 211.A N LYS 207.A O no hydrogen 2.875 N/A ASP 212.A N SER 208.A O no hydrogen 3.106 N/A ILE 213.A N LEU 209.A O no hydrogen 3.158 N/A SER 214.A OG PHE 210.A O no hydrogen 2.642 N/A SER 214.A OG GLU 211.A O no hydrogen 3.285 N/A GLU 217.A N GLU 217.A OE1 no hydrogen 2.725 N/A GLU 218.A N ASN 215.A O no hydrogen 3.176 N/A VAL 219.A N PRO 216.A O no hydrogen 3.513 N/A ILE 220.A N GLU 217.A O no hydrogen 3.019 N/A PHE 225.A N LEU 222.A O no hydrogen 3.083 N/A