Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1toc_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASN 143.A O no hydrogen 2.897 N/A VAL 2.A N ASP 199.A O no hydrogen 2.834 N/A GLY 4.A N ILE 1.A O no hydrogen 3.383 N/A GLN 5.A N VAL 162.A O no hydrogen 2.874 N/A ALA 7.A N LEU 160.A O no hydrogen 3.088 N/A LEU 11.A N GLU 8.A O no hydrogen 2.879 N/A GLN 15.A N SER 12.A O no hydrogen 2.996 N/A MET 17.A N ARG 62.A O no hydrogen 2.876 N/A PHE 19.A N LEU 60.A O no hydrogen 2.582 N/A ARG 20.A N GLU 25.A O no hydrogen 2.942 N/A ARG 20.A NH1 GLU 25.A OE2 ARG 20.A HH11 2.698 1.916 LYS 21.A N ASP 58.A O no hydrogen 2.746 N/A GLU 25.A N ARG 20.A O no hydrogen 3.221 N/A LEU 27.A N LEU 18.A O no hydrogen 3.129 N/A CYS 28.A N LEU 18.A O no hydrogen 3.372 N/A CYS 28.A SG LEU 27.A O no hydrogen 2.955 N/A CYS 28.A SG SER 205.A O no hydrogen 3.080 N/A SER 31.A N LEU 39.A O no hydrogen 3.044 N/A SER 31.A OG LEU 39.A O no hydrogen 3.513 N/A ARG 36.A NH1 LYS 106.A O ARG 36.A HH12 2.757 1.795 ARG 36.A NH2 LYS 106.A O ARG 36.A HH22 3.315 2.550 TRP 37.A N SER 34.A OG no hydrogen 2.989 N/A VAL 38.A N LEU 103.A O no hydrogen 3.015 N/A LEU 39.A N SER 31.A O no hydrogen 2.837 N/A THR 40.A N ALA 101.A O no hydrogen 3.033 N/A THR 40.A OG1 GLY 29.A O no hydrogen 2.955 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.965 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.955 N/A CYS 44.A N ALA 41.A O no hydrogen 2.904 N/A CYS 44.A SG SER 205.A O no hydrogen 2.972 N/A LEU 45.A N ALA 42.A O no hydrogen 2.769 N/A LEU 46.A N ALA 42.A O no hydrogen 3.108 N/A ASP 57.A N THR 55I.A OG1 no hydrogen 3.004 N/A LEU 60.A N PHE 19.A O no hydrogen 2.907 N/A VAL 61.A N SER 79.A O no hydrogen 2.789 N/A ARG 62.A NE GLU 76.A OE1 no hydrogen 2.786 N/A ARG 62.A NH2 THR 69.A O ARG 62.A HH22 3.446 2.606 ARG 62.A NH2 GLU 76.A OE1 ARG 62.A HH21 3.201 2.461 ARG 62.A NH2 GLU 76.A OE2 ARG 62.A HH21 2.907 2.032 LYS 65.A NZ THR 69.A O no hydrogen 3.541 N/A LYS 65.A NZ ARG 70.A O no hydrogen 2.549 N/A LYS 65.A NZ GLU 76.A OE2 no hydrogen 3.235 N/A HIS 66.A NE2 ALA 7.A O no hydrogen 2.715 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.876 N/A SER 67.A OG SER 158.A O no hydrogen 3.155 N/A ARG 68.A N SER 158.A O no hydrogen 2.833 N/A ARG 68.A NH1 PRO 157.A O ARG 68.A HH11 3.025 2.085 TYR 71.A OH ARG 73A.A O no hydrogen 2.920 N/A GLU 72.A N GLU 76.A OE2 no hydrogen 2.715 N/A VAL 75.A N GLU 72.A O no hydrogen 2.829 N/A LYS 77.A N ILE 63.A O no hydrogen 2.908 N/A LYS 77.A NZ GLU 110.A O no hydrogen 2.582 N/A SER 79.A OG MET 80.A O no hydrogen 2.985 N/A TYR 85.A N LEU 102.A O no hydrogen 2.951 N/A HIS 87.A N ILE 100.A O no hydrogen 3.404 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 2.975 N/A TYR 90.A N HIS 87.A O no hydrogen 3.103 N/A TYR 90.A OH LEU 46.A O no hydrogen 3.020 N/A ASN 91.A N ASP 97.A O no hydrogen 3.179 N/A ASN 95.A ND2 ARG 180.A O ASN 95.A HD22 2.965 2.037 ARG 98.A NH1 ARG 89.A O ARG 98.A HH11 3.500 2.530 ALA 101.A N THR 40.A O no hydrogen 2.848 N/A LEU 102.A N TYR 85.A O no hydrogen 2.689 N/A LEU 103.A N VAL 38.A O no hydrogen 2.811 N/A LYS 104.A N LYS 83.A O no hydrogen 2.922 N/A LEU 105.A N ARG 36.A O no hydrogen 2.983 N/A LYS 106.A N MET 80.A O no hydrogen 2.969 N/A ILE 109.A N ASP 35.A O no hydrogen 2.930 N/A SER 112.A N ILE 115.A O no hydrogen 2.993 N/A SER 112.A OG GLU 110.A O no hydrogen 3.124 N/A HIS 116.A N PRO 13.A O no hydrogen 3.013 N/A HIS 116.A ND1 PRO 117.A O no hydrogen 3.116 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 2.969 N/A THR 125.A OG1 GLN 124.A OE1 no hydrogen 3.415 N/A ALA 126.A N ASP 122.A O no hydrogen 2.707 N/A LEU 130.A N ALA 126.A O no hydrogen 2.841 N/A HIS 131.A N LEU 129C.A O no hydrogen 3.036 N/A GLY 133.A N LEU 167.A O no hydrogen 2.872 N/A PHE 134.A N HIS 131.A O no hydrogen 3.292 N/A LYS 135.A NZ TYR 190A.A OH no hydrogen 2.721 N/A ARG 137.A N VAL 210.A O no hydrogen 2.790 N/A VAL 138.A N VAL 163.A O no hydrogen 2.969 N/A THR 139.A OG1 GLN 15.A OE1 no hydrogen 3.387 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 2.905 N/A ASN 143.A N GLU 202.A O no hydrogen 3.232 N/A ARG 144.A N VAL 155.A O no hydrogen 2.881 N/A ARG 144.A NH1 VAL 155.A O ARG 144.A HH11 3.390 2.662 ARG 144.A NH1 GLU 154E.A O ARG 144.A HH11 2.696 1.958 GLN 156.A N GLU 154E.A OE2 no hydrogen 2.763 N/A LEU 160.A N HIS 66.A O no hydrogen 2.614 N/A GLN 161.A NE2 ASP 6.A OD1 GLN 161.A HE21 2.934 1.993 GLN 161.A NE2 VAL 159.A O GLN 161.A HE22 2.701 1.885 GLN 161.A NE2 LEU 160.A O GLN 161.A HE22 2.588 1.900 VAL 162.A N GLN 5.A O no hydrogen 2.732 N/A LEU 165.A N GLY 136.A O no hydrogen 2.671 N/A LEU 167.A N PHE 134.A O no hydrogen 2.801 N/A VAL 168.A N CYS 187.A O no hydrogen 3.367 N/A ARG 170.A NH1 THR 182.A O ARG 170.A HH12 3.407 2.612 ARG 170.A NH1 MET 185.A O ARG 170.A HH12 3.518 2.855 ARG 170.A NH2 THR 182.A O ARG 170.A HH22 2.883 1.906 VAL 172.A N GLU 169.A O no hydrogen 2.979 N/A CYS 173.A N GLU 169.A O no hydrogen 3.211 N/A CYS 173.A SG GLU 169.A O no hydrogen 3.341 N/A LYS 174.A N ARG 170.A O no hydrogen 2.842 N/A LYS 174.A NZ ILE 181.A O no hydrogen 2.982 N/A ALA 175.A N PRO 171.A O no hydrogen 3.239 N/A SER 176.A N CYS 173.A O no hydrogen 2.983 N/A SER 176.A OG VAL 172.A O no hydrogen 3.392 N/A SER 176.A OG CYS 173.A O no hydrogen 2.533 N/A THR 177.A OG1 GLU 229.A OE1 no hydrogen 3.478 N/A ILE 179.A N THR 177.A OG1 no hydrogen 3.201 N/A THR 182.A OG1 ASP 97.A OD1 no hydrogen 2.597 N/A ASN 184.A N THR 182.A OG1 no hydrogen 3.041 N/A ASN 184.A ND2 ASP 97.A OD1 ASN 184.A HD22 2.948 2.076 ASN 184.A ND2 ASP 97.A OD2 ASN 184.A HD22 3.101 2.400 PHE 186.A N TYR 240.A O no hydrogen 3.148 N/A ALA 188.A N GLY 238.A O no hydrogen 2.962 N/A GLY 189.A N PRO 166.A O no hydrogen 3.068 N/A LYS 191.A N GLU 194B.A OE1 no hydrogen 2.930 N/A LYS 191.A NZ GLU 169.A OE1 no hydrogen 2.816 N/A LYS 191.A NZ GLU 169.A OE2 no hydrogen 2.871 N/A ARG 197.A NE ASP 232A.A OD2 no hydrogen 2.739 N/A ARG 197.A NH1 ASP 234.A OD1 ARG 197.A HH12 2.838 1.916 ARG 197.A NH2 ASP 234.A OD1 ARG 197.A HH22 3.024 2.175 ARG 197.A NH2 ASP 232A.A OD2 ARG 197.A HH21 3.140 2.446 GLY 198.A N ASP 232A.A OD1 no hydrogen 3.195 N/A ASP 199.A N VAL 2.A O no hydrogen 3.216 N/A CYS 201.A N ASP 204.A OD2 no hydrogen 2.732 N/A CYS 201.A SG ARG 145.A O no hydrogen 3.848 N/A ASP 204.A N CYS 201.A O no hydrogen 2.955 N/A GLY 206.A N VAL 225.A O no hydrogen 3.062 N/A GLY 207.A N ASP 204.A O no hydrogen 2.667 N/A PHE 209.A N GLY 223.A O no hydrogen 2.684 N/A VAL 210.A N ARG 137.A O no hydrogen 2.931 N/A MET 211.A N TYR 220.A O no hydrogen 2.717 N/A SER 213.A N ARG 218.A O no hydrogen 2.830 N/A ARG 218.A N ASN 216B.A OD1 no hydrogen 2.845 N/A ARG 218.A NH1 ASN 216B.A O ARG 218.A HH11 3.247 2.587 TYR 220.A N MET 211.A O no hydrogen 2.817 N/A GLN 221.A N CYS 119.A O no hydrogen 3.173 N/A MET 222.A N PHE 209.A O no hydrogen 2.940 N/A GLY 223.A N PHE 209.A O no hydrogen 3.216 N/A ILE 224.A N THR 241.A O no hydrogen 3.064 N/A VAL 225.A N GLY 207.A O no hydrogen 3.020 N/A SER 226.A N PHE 239.A O no hydrogen 2.965 N/A SER 226.A OG ASP 99.A OD2 no hydrogen 3.463 N/A TRP 227.A N PHE 239.A O no hydrogen 3.200 N/A CYS 231.A N GLU 146.A OE1 no hydrogen 2.803 N/A CYS 231.A SG ALA 200.A O no hydrogen 4.004 N/A LYS 236.A N ARG 233.A O no hydrogen 3.088 N/A LYS 236.A NZ GLU 229.A OE1 no hydrogen 3.245 N/A GLY 238.A N ALA 188.A O no hydrogen 3.201 N/A PHE 239.A N TRP 227.A O no hydrogen 2.954 N/A TYR 240.A N PHE 186.A O no hydrogen 2.867 N/A THR 241.A N ILE 224.A O no hydrogen 2.734 N/A THR 241.A OG1 ASP 99.A O no hydrogen 3.027 N/A HIS 242.A N ASN 184.A O no hydrogen 3.240 N/A VAL 243.A N MET 222.A O no hydrogen 2.904 N/A ARG 245.A N HIS 242.A ND1 no hydrogen 3.368 N/A ARG 245.A NE ASP 183.A O no hydrogen 3.106 N/A ARG 245.A NE ASP 183.A OD1 no hydrogen 3.372 N/A ARG 245.A NH2 ASP 183.A OD1 ARG 245.A HH21 2.914 1.950 LEU 246.A N HIS 242.A O no hydrogen 3.461 N/A LYS 247.A N PHE 244.A O no hydrogen 3.001 N/A LYS 247.A NZ PRO 121.A O no hydrogen 2.886 N/A ILE 250.A N LEU 246.A O no hydrogen 3.109 N/A GLN 251.A N LYS 247.A O no hydrogen 2.980 N/A LYS 252.A N LYS 248.A O no hydrogen 2.934 N/A VAL 253.A N TRP 249.A O no hydrogen 2.798 N/A ILE 254.A N ILE 250.A O no hydrogen 3.144 N/A ASP 255.A N GLN 251.A O no hydrogen 2.980 N/A LEU 257.A N ILE 254.A O no hydrogen 3.174 N/A GLY 258.A N ASP 255.A O no hydrogen 3.423 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.728 N/A GLU 94A.A N ASN 91.A OD1 no hydrogen 3.079 N/A ALA 127A.A N LYS 123.A O no hydrogen 2.699 N/A TYR 215A.A N SER 213.A OG no hydrogen 3.143 N/A ASP 232A.A N ASP 199.A OD2 no hydrogen 3.316 N/A LYS 128B.A N GLN 124.A O no hydrogen 3.247 N/A GLU 194B.A N LYS 191.A O no hydrogen 3.052 N/A LEU 129C.A N THR 125.A O no hydrogen 3.198 N/A VAL 152C.A N THR 149.A O no hydrogen 2.917 N/A TRP 50D.A N TYR 47A.A O no hydrogen 2.989 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.638 N/A GLU 154E.A N SER 151B.A O no hydrogen 2.665 N/A LYS 52F.A NZ HIS 43.A O no hydrogen 3.016 N/A LYS 52F.A NZ CYS 44.A O no hydrogen 2.966 N/A PHE 54H.A N LEU 45.A O no hydrogen 2.919 N/A THR 55I.A N ASP 58.A OD1 no hydrogen 3.267 N/A THR 55I.A OG1 ASP 58.A OD1 no hydrogen 3.544 N/A