Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6d43_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NE ASP 225.A OD1 no hydrogen 3.132 N/A ARG 2.A NH1 GLN 200.A O no hydrogen 2.761 N/A ARG 2.A NH2 ASP 225.A OD1 no hydrogen 3.395 N/A LYS 3.A NZ ALA 33.A O no hydrogen 2.592 N/A PHE 4.A N ASP 34.A O no hydrogen 3.202 N/A PHE 5.A N ASP 225.A O no hydrogen 2.990 N/A VAL 6.A N GLU 36.A O no hydrogen 2.923 N/A GLY 7.A N PHE 227.A O no hydrogen 2.700 N/A GLY 8.A N VAL 38.A O no hydrogen 2.588 N/A ASN 9.A N VAL 229.A O no hydrogen 2.855 N/A TRP 10.A N ALA 40.A O no hydrogen 3.145 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 2.962 N/A LYS 11.A NZ GLU 95.A OE2 no hydrogen 2.769 N/A ARG 15.A N SER 18.A OG no hydrogen 2.820 N/A ARG 15.A NH1 GLY 14.A O no hydrogen 3.076 N/A SER 18.A OG ARG 15.A O no hydrogen 3.092 N/A LEU 19.A N ARG 15.A O no hydrogen 2.792 N/A GLY 20.A N LYS 16.A O no hydrogen 2.785 N/A GLU 21.A N GLN 17.A O no hydrogen 3.109 N/A LEU 22.A N SER 18.A O no hydrogen 3.011 N/A ILE 23.A N LEU 19.A O no hydrogen 2.763 N/A GLY 24.A N GLY 20.A O no hydrogen 2.802 N/A THR 25.A N GLU 21.A O no hydrogen 3.102 N/A THR 25.A OG1 GLU 21.A O no hydrogen 3.235 N/A LEU 26.A N LEU 22.A O no hydrogen 3.085 N/A ASN 27.A N ILE 23.A O no hydrogen 2.944 N/A ASN 27.A ND2 LYS 52.A O no hydrogen 3.172 N/A ALA 28.A N GLY 24.A O no hydrogen 3.313 N/A ALA 29.A N THR 25.A O no hydrogen 3.112 N/A THR 35.A N PRO 32.A O no hydrogen 3.400 N/A THR 35.A OG1 ASP 34.A OD1 no hydrogen 3.523 N/A THR 35.A OG1 ILE 242.A O no hydrogen 3.386 N/A GLU 36.A N PHE 4.A O no hydrogen 2.697 N/A VAL 38.A N VAL 6.A O no hydrogen 3.050 N/A CYS 39.A N ALA 58.A O no hydrogen 2.954 N/A ALA 40.A N GLY 8.A O no hydrogen 2.711 N/A TYR 45.A N PRO 42.A O no hydrogen 2.837 N/A ILE 46.A N THR 43.A O no hydrogen 3.356 N/A ALA 49.A N TYR 45.A O no hydrogen 2.956 N/A ARG 50.A N ILE 46.A O no hydrogen 3.051 N/A ARG 50.A NE ARG 50.A O no hydrogen 2.693 N/A ARG 50.A NH1 ILE 57.A O no hydrogen 2.903 N/A ARG 50.A NH2 LEU 53.A O no hydrogen 2.845 N/A ARG 50.A NH2 ASP 54.A O no hydrogen 3.244 N/A ARG 50.A NH2 ILE 57.A O no hydrogen 3.260 N/A GLN 51.A N ASP 47.A O no hydrogen 3.072 N/A GLN 51.A NE2 ASP 47.A O no hydrogen 3.567 N/A GLN 51.A NE2 ASP 47.A OD1 no hydrogen 2.782 N/A LYS 52.A N PHE 48.A O no hydrogen 3.100 N/A LEU 53.A N ALA 49.A O no hydrogen 2.714 N/A ASP 54.A N ASN 27.A OD1 no hydrogen 2.898 N/A LYS 56.A N ASP 54.A OD1 no hydrogen 3.006 N/A LYS 56.A NZ ALA 29.A O no hydrogen 3.105 N/A ILE 57.A N ASP 54.A O no hydrogen 3.000 N/A ALA 58.A N VAL 37.A O no hydrogen 3.054 N/A ALA 60.A N CYS 39.A O no hydrogen 2.765 N/A ALA 61.A N TRP 88.A O no hydrogen 3.052 N/A GLN 62.A NE2 LYS 11.A O no hydrogen 2.845 N/A GLN 62.A NE2 ALA 40.A O no hydrogen 2.742 N/A ASN 63.A ND2 GLU 102.A OE2 no hydrogen 3.150 N/A CYS 64.A SG TYR 65.A O no hydrogen 3.300 N/A TYR 65.A N ILE 76.A O no hydrogen 2.809 N/A LYS 66.A NZ GLN 109.A OE1 no hydrogen 3.110 N/A GLU 75.A N PHE 72.A O no hydrogen 2.932 N/A SER 77.A OG THR 68.A O no hydrogen 2.830 N/A MET 80.A N SER 77.A OG no hydrogen 3.278 N/A ILE 81.A N SER 77.A O no hydrogen 3.118 N/A LYS 82.A N PRO 78.A O no hydrogen 2.943 N/A LYS 82.A NZ GLU 117.A O no hydrogen 2.949 N/A ASP 83.A N GLY 79.A O no hydrogen 2.967 N/A CYS 84.A N MET 80.A O no hydrogen 3.099 N/A CYS 84.A N ILE 81.A O no hydrogen 3.173 N/A CYS 84.A SG MET 80.A O no hydrogen 3.324 N/A GLY 85.A N LYS 82.A O no hydrogen 2.918 N/A ALA 86.A N ILE 81.A O no hydrogen 3.178 N/A THR 87.A N VAL 59.A O no hydrogen 2.991 N/A TRP 88.A N VAL 59.A O no hydrogen 3.308 N/A VAL 89.A N GLY 120.A O no hydrogen 2.868 N/A VAL 90.A N ALA 61.A O no hydrogen 2.781 N/A LEU 91.A N ILE 122.A O no hydrogen 2.893 N/A SER 94.A N GLU 163.A OE1 no hydrogen 2.745 N/A SER 94.A OG GLU 163.A OE2 no hydrogen 2.920 N/A GLU 95.A N HIS 93.A ND1 no hydrogen 3.329 N/A ARG 96.A NE GLU 102.A OE2 no hydrogen 2.904 N/A ARG 96.A NH2 GLU 102.A OE2 no hydrogen 3.486 N/A ARG 97.A N HIS 93.A O no hydrogen 2.920 N/A ARG 97.A NE GLY 92.A O no hydrogen 2.776 N/A ARG 97.A NH1 ASP 104.A OD1 no hydrogen 2.851 N/A ARG 97.A NH2 CYS 124.A O no hydrogen 2.954 N/A HIS 98.A N SER 94.A O no hydrogen 2.706 N/A VAL 99.A N GLU 95.A O no hydrogen 2.930 N/A PHE 100.A N GLU 95.A O no hydrogen 3.248 N/A GLU 102.A N ARG 96.A O no hydrogen 2.965 N/A LEU 106.A N SER 103.A OG no hydrogen 2.972 N/A ILE 107.A N SER 103.A O no hydrogen 2.931 N/A GLY 108.A N ASP 104.A O no hydrogen 2.868 N/A GLN 109.A N GLU 105.A O no hydrogen 3.082 N/A LYS 110.A N LEU 106.A O no hydrogen 2.963 N/A LYS 110.A NZ ASN 63.A OD1 no hydrogen 2.973 N/A LYS 110.A NZ CYS 64.A O no hydrogen 2.868 N/A LYS 110.A NZ GLU 102.A OE1 no hydrogen 2.894 N/A LYS 110.A NZ GLU 102.A OE2 no hydrogen 3.326 N/A VAL 111.A N ILE 107.A O no hydrogen 2.953 N/A ALA 112.A N GLY 108.A O no hydrogen 3.038 N/A HIS 113.A N GLN 109.A O no hydrogen 3.084 N/A ALA 114.A N LYS 110.A O no hydrogen 2.981 N/A LEU 115.A N VAL 111.A O no hydrogen 3.016 N/A ALA 116.A N ALA 112.A O no hydrogen 3.031 N/A GLU 117.A N HIS 113.A O no hydrogen 2.944 N/A GLY 118.A N LEU 115.A O no hydrogen 3.128 N/A LEU 119.A N ALA 114.A O no hydrogen 3.127 N/A GLY 120.A N THR 87.A O no hydrogen 2.963 N/A VAL 121.A N LYS 157.A O no hydrogen 2.892 N/A ILE 122.A N VAL 89.A O no hydrogen 2.827 N/A ALA 123.A N VAL 159.A O no hydrogen 2.856 N/A CYS 124.A N LEU 91.A O no hydrogen 2.837 N/A CYS 124.A SG LEU 91.A O no hydrogen 3.747 N/A CYS 124.A SG ILE 122.A O no hydrogen 4.049 N/A ILE 125.A N ALA 161.A O no hydrogen 2.953 N/A GLY 126.A N GLN 144.A OE1 no hydrogen 2.835 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.758 N/A LYS 128.A N GLU 131.A OE1 no hydrogen 2.765 N/A ARG 132.A N LYS 128.A O no hydrogen 2.916 N/A ARG 132.A NH1 GLU 127.A OE2 no hydrogen 2.558 N/A GLU 133.A N LEU 129.A O no hydrogen 2.785 N/A ALA 134.A N ASP 130.A O no hydrogen 3.087 N/A GLY 135.A N ARG 132.A O no hydrogen 2.800 N/A ILE 136.A N GLU 131.A O no hydrogen 3.088 N/A THR 137.A OG1 GLU 127.A OE2 no hydrogen 2.793 N/A VAL 140.A N ILE 136.A O no hydrogen 3.186 N/A VAL 141.A N THR 137.A O no hydrogen 3.102 N/A PHE 142.A N GLU 138.A O no hydrogen 2.927 N/A GLU 143.A N LYS 139.A O no hydrogen 3.048 N/A GLN 144.A N VAL 140.A O no hydrogen 2.962 N/A GLN 144.A NE2 GLY 126.A O no hydrogen 3.340 N/A THR 145.A N VAL 141.A O no hydrogen 2.868 N/A THR 145.A OG1 VAL 141.A O no hydrogen 2.728 N/A LYS 146.A N PHE 142.A O no hydrogen 2.699 N/A LYS 146.A NZ ASP 150.A OD2 no hydrogen 3.056 N/A VAL 147.A N GLU 143.A O no hydrogen 3.066 N/A ILE 148.A N GLN 144.A O no hydrogen 3.178 N/A ALA 149.A N THR 145.A O no hydrogen 2.713 N/A ASP 150.A N LYS 146.A O no hydrogen 2.716 N/A ASN 151.A N ILE 148.A O no hydrogen 2.790 N/A ASN 151.A ND2 VAL 147.A O no hydrogen 2.974 N/A VAL 152.A N ALA 149.A O no hydrogen 3.242 N/A SER 156.A N ASP 154.A OD1 no hydrogen 3.457 N/A SER 156.A OG ASP 154.A OD1 no hydrogen 3.548 N/A SER 156.A OG ASP 154.A OD2 no hydrogen 3.278 N/A VAL 158.A N TRP 155.A O no hydrogen 3.056 N/A VAL 159.A N VAL 121.A O no hydrogen 2.875 N/A LEU 160.A N ARG 203.A O no hydrogen 2.935 N/A ALA 161.A N ALA 123.A O no hydrogen 2.930 N/A TYR 162.A N ILE 205.A O no hydrogen 2.877 N/A TYR 162.A OH GLU 127.A OE1 no hydrogen 2.693 N/A TYR 162.A OH GLU 127.A OE2 no hydrogen 3.209 N/A GLU 163.A N ILE 125.A O no hydrogen 2.659 N/A TRP 166.A N GLU 127.A O no hydrogen 3.015 N/A TRP 166.A NE1 TYR 162.A OH no hydrogen 3.051 N/A ALA 167.A N PRO 164.A O no hydrogen 3.095 N/A ILE 168.A N VAL 165.A O no hydrogen 2.987 N/A LYS 172.A NZ GLU 133.A OE2 no hydrogen 2.979 N/A THR 175.A N GLN 178.A OE1 no hydrogen 2.997 N/A GLN 178.A N THR 175.A O no hydrogen 2.957 N/A ALA 179.A N THR 175.A O no hydrogen 3.117 N/A GLN 180.A N PRO 176.A O no hydrogen 2.989 N/A GLN 180.A NE2 GLU 184.A OE1 no hydrogen 3.233 N/A GLN 180.A NE2 ASP 223.A OD2 no hydrogen 2.741 N/A GLU 181.A N GLN 177.A O no hydrogen 2.955 N/A VAL 182.A N GLN 178.A O no hydrogen 3.401 N/A HIS 183.A N ALA 179.A O no hydrogen 2.991 N/A HIS 183.A ND1 ASP 223.A O no hydrogen 3.034 N/A GLU 184.A N GLN 180.A O no hydrogen 2.895 N/A LYS 185.A N GLU 181.A O no hydrogen 3.361 N/A LYS 185.A NZ GLU 138.A OE2 no hydrogen 2.750 N/A LYS 185.A NZ GLU 181.A OE2 no hydrogen 3.188 N/A LEU 186.A N VAL 182.A O no hydrogen 2.926 N/A ARG 187.A N HIS 183.A O no hydrogen 3.076 N/A ARG 187.A NE ASP 223.A OD1 no hydrogen 2.720 N/A ARG 187.A NH1 ALA 199.A O no hydrogen 2.901 N/A ARG 187.A NH1 THR 202.A O no hydrogen 2.850 N/A ARG 187.A NH2 ASP 223.A O no hydrogen 3.149 N/A ARG 187.A NH2 ASP 225.A OD2 no hydrogen 2.932 N/A GLY 188.A N GLU 184.A O no hydrogen 2.948 N/A TRP 189.A N LYS 185.A O no hydrogen 2.788 N/A LEU 190.A N LEU 186.A O no hydrogen 2.986 N/A LYS 191.A N ARG 187.A O no hydrogen 2.968 N/A LYS 191.A NZ ASP 196.A OD1 no hydrogen 2.803 N/A SER 192.A N GLY 188.A O no hydrogen 2.998 N/A SER 192.A OG GLY 188.A O no hydrogen 2.919 N/A ASN 193.A N TRP 189.A O no hydrogen 2.905 N/A VAL 194.A N LEU 190.A O no hydrogen 2.933 N/A SER 195.A N LEU 190.A O no hydrogen 2.881 N/A VAL 198.A N SER 195.A OG no hydrogen 2.996 N/A ALA 199.A N SER 195.A O no hydrogen 3.076 N/A GLN 200.A N ASP 196.A O no hydrogen 2.893 N/A GLN 200.A NE2 SER 1.A O no hydrogen 3.482 N/A SER 201.A N ALA 197.A O no hydrogen 3.062 N/A SER 201.A OG ALA 197.A O no hydrogen 2.727 N/A THR 202.A N VAL 198.A O no hydrogen 2.983 N/A THR 202.A OG1 VAL 198.A O no hydrogen 2.653 N/A ARG 203.A NH1 LYS 3.A O no hydrogen 2.949 N/A ARG 203.A NH1 GLU 36.A OE1 no hydrogen 2.952 N/A ARG 203.A NH2 GLU 36.A OE1 no hydrogen 2.872 N/A ILE 204.A N ASP 225.A OD2 no hydrogen 2.916 N/A ILE 205.A N LEU 160.A O no hydrogen 2.714 N/A TYR 206.A N GLY 226.A O no hydrogen 2.910 N/A GLY 207.A N TYR 162.A O no hydrogen 2.708 N/A THR 211.A N THR 214.A OG1 no hydrogen 3.158 N/A THR 211.A OG1 THR 214.A OG1 no hydrogen 3.339 N/A GLY 212.A N GLU 237.A OE1 no hydrogen 3.044 N/A ALA 213.A N THR 211.A OG1 no hydrogen 3.179 N/A THR 214.A N THR 211.A O no hydrogen 3.304 N/A THR 214.A N THR 211.A OG1 no hydrogen 3.194 N/A THR 214.A OG1 THR 211.A OG1 no hydrogen 3.339 N/A CYS 215.A N THR 211.A O no hydrogen 3.047 N/A CYS 215.A SG GLY 212.A O no hydrogen 3.308 N/A LYS 216.A NZ ASN 243.A O no hydrogen 3.388 N/A LYS 216.A NZ GLN 246.A OXT no hydrogen 3.319 N/A LEU 218.A N THR 214.A O no hydrogen 3.119 N/A ALA 219.A N CYS 215.A O no hydrogen 2.792 N/A SER 220.A N LYS 216.A O no hydrogen 3.139 N/A SER 220.A OG LYS 216.A O no hydrogen 3.242 N/A SER 220.A OG GLU 217.A O no hydrogen 2.934 N/A GLN 221.A N LEU 218.A O no hydrogen 3.128 N/A ASP 223.A N GLN 180.A OE1 no hydrogen 2.985 N/A VAL 224.A N GLN 221.A O no hydrogen 3.092 N/A ASP 225.A N ILE 204.A O no hydrogen 3.000 N/A PHE 227.A N PHE 5.A O no hydrogen 2.840 N/A LEU 228.A N TYR 206.A O no hydrogen 3.111 N/A VAL 229.A N GLY 7.A O no hydrogen 2.821 N/A SER 233.A N GLY 230.A O no hydrogen 2.929 N/A SER 233.A OG VAL 229.A O no hydrogen 3.445 N/A SER 233.A OG GLY 230.A O no hydrogen 2.648 N/A LEU 234.A N GLY 231.A O no hydrogen 3.054 N/A LYS 235.A N ALA 232.A O no hydrogen 3.092 N/A PHE 238.A N LYS 235.A O no hydrogen 3.165 N/A VAL 239.A N PRO 236.A O no hydrogen 3.050 N/A ILE 241.A N GLU 237.A O no hydrogen 3.174 N/A ILE 242.A N PHE 238.A O no hydrogen 2.906 N/A ASN 243.A N VAL 239.A O no hydrogen 3.105 N/A ALA 244.A N ILE 241.A O no hydrogen 3.251 N/A LYS 245.A NZ ALA 219.A O no hydrogen 3.112 N/A GLN 246.A N ASN 243.A O no hydrogen 3.028 N/A GLN 246.A NE2 ASP 34.A OD1 no hydrogen 3.024 N/A