Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2afq_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N TRP 141.A O no hydrogen 2.985 N/A ILE 1.A N ASP 190.A OD1 no hydrogen 3.062 N/A ILE 1.A N ASP 190.A OD2 no hydrogen 2.787 N/A VAL 2.A N ASP 185.A O no hydrogen 3.233 N/A SER 5.A N VAL 148.A O no hydrogen 3.069 N/A ALA 7.A N LEU 146.A O no hydrogen 3.007 N/A MET 11.A N GLU 8.A O no hydrogen 3.120 N/A GLN 15.A N SER 12.A O.A no hydrogen 3.013 N/A GLN 15.A N SER 12.A O.B no hydrogen 3.116 N/A GLN 15.A NE2 SER 12.A OG.A no hydrogen 2.861 N/A GLN 15.A NE2 THR 139.A OG1 no hydrogen 2.428 N/A VAL 16.A N ALA 30.A O no hydrogen 3.031 N/A MET 17.A N ARG 62.A O no hydrogen 3.007 N/A LEU 18.A N CYS 28.A O no hydrogen 2.964 N/A PHE 19.A N LEU 60.A O no hydrogen 2.983 N/A ARG 20.A N.A GLU 25.A O no hydrogen 2.910 N/A ARG 20.A N.B GLU 25.A O no hydrogen 2.915 N/A ARG 20.A NH1.B GLU 25.A OE2 no hydrogen 3.072 N/A ARG 20.A NH2.B GLU 25.A OE1 no hydrogen 2.836 N/A LYS 21.A N ASP 58.A O no hydrogen 2.968 N/A LYS 21.A NZ ASN 57.A O.A no hydrogen 2.935 N/A LYS 21.A NZ ASN 57.A O.B no hydrogen 2.854 N/A LYS 21.A NZ ASN 57.A OD1.B no hydrogen 3.063 N/A GLN 24.A NE2 LYS 21.A O no hydrogen 2.875 N/A GLU 25.A N ARG 20.A O.A no hydrogen 3.256 N/A GLU 25.A N ARG 20.A O.B no hydrogen 3.252 N/A LEU 27.A N LEU 18.A O no hydrogen 2.799 N/A CYS 28.A N LEU 18.A O no hydrogen 3.431 N/A CYS 28.A SG LEU 27.A O no hydrogen 2.990 N/A GLY 29.A N SER 191.A O no hydrogen 2.869 N/A SER 31.A N LEU 39.A O no hydrogen 2.844 N/A SER 31.A OG GLN 207.A OE1 no hydrogen 2.519 N/A LEU 32.A N.A TRP 14.A O no hydrogen 2.886 N/A LEU 32.A N.B TRP 14.A O no hydrogen 2.886 N/A ILE 33.A N TRP 37.A O no hydrogen 3.098 N/A ARG 36.A N SER 34.A OG no hydrogen 3.290 N/A TRP 37.A N SER 34.A OG no hydrogen 3.067 N/A VAL 38.A N MET 103.A O no hydrogen 2.987 N/A LEU 39.A N SER 31.A O no hydrogen 2.808 N/A THR 40.A N ALA 101.A O no hydrogen 3.080 N/A THR 40.A OG1 GLY 29.A O no hydrogen 3.084 N/A ALA 41.A N THR 40.A OG1 no hydrogen 2.739 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.853 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.694 N/A CYS 44.A N ALA 41.A O no hydrogen 3.149 N/A LEU 45.A N ALA 42.A O no hydrogen 2.890 N/A LEU 46.A N ALA 42.A O no hydrogen 2.861 N/A GLU 56.A N GLU 56.A OE2 no hydrogen 2.575 N/A ASP 58.A N THR 55I.A O no hydrogen 3.073 N/A LEU 60.A N PHE 19.A O no hydrogen 3.180 N/A VAL 61.A N SER 79.A O no hydrogen 2.986 N/A ARG 62.A N MET 17.A O no hydrogen 3.076 N/A ARG 62.A NH1 GLU 76.A OE1 no hydrogen 3.254 N/A ILE 63.A N LYS 77.A O no hydrogen 2.887 N/A LYS 65.A NZ SER 67.A O no hydrogen 3.143 N/A LYS 65.A NZ ARG 70.A O no hydrogen 3.274 N/A LYS 65.A NZ GLU 76.A OE1 no hydrogen 3.474 N/A LYS 65.A NZ GLU 76.A OE2 no hydrogen 2.960 N/A ARG 68.A N SER 144.A O no hydrogen 3.133 N/A THR 69.A N SER 67.A OG no hydrogen 3.292 N/A ARG 70.A N SER 67.A OG no hydrogen 3.088 N/A GLU 72.A N GLU 76.A OE2 no hydrogen 2.799 N/A ILE 75.A N GLU 72.A O no hydrogen 3.151 N/A GLU 76.A N GLU 72.A O no hydrogen 3.050 N/A LYS 77.A N ILE 63.A O no hydrogen 2.893 N/A SER 79.A N VAL 61.A O no hydrogen 2.962 N/A GLU 82.A N LYS 104.A O no hydrogen 2.643 N/A LYS 83.A N LYS 104.A O no hydrogen 3.419 N/A TYR 85.A N LEU 102.A O no hydrogen 2.832 N/A HIS 87.A N ILE 100.A O no hydrogen 3.405 N/A ARG 89.A N.A HIS 87.A ND1 no hydrogen 2.970 N/A ARG 89.A N.B HIS 87.A ND1 no hydrogen 2.960 N/A ARG 89.A NH1.A PRO 88.A O no hydrogen 2.947 N/A TYR 90.A N HIS 87.A O no hydrogen 3.002 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.765 N/A ASN 91.A N ASP 97.A O no hydrogen 3.053 N/A ASN 95.A N ASN 91.A OD1 no hydrogen 3.370 N/A ASN 95.A ND2 ARG 166.A O no hydrogen 2.922 N/A ASP 97.A N ASN 95.A OD1 no hydrogen 3.321 N/A ARG 98.A NH1 ARG 89.A O.A no hydrogen 3.540 N/A ARG 98.A NH1 ARG 89.A O.B no hydrogen 3.503 N/A ALA 101.A N THR 40.A O no hydrogen 3.039 N/A LEU 102.A N TYR 85.A O no hydrogen 2.883 N/A MET 103.A N VAL 38.A O no hydrogen 2.922 N/A LYS 104.A N LYS 83.A O no hydrogen 2.905 N/A LYS 104.A NZ PHE 243.A O no hydrogen 2.735 N/A LYS 104.A NZ GLU 245.A O no hydrogen 3.157 N/A LEU 105.A N ARG 36.A O no hydrogen 2.935 N/A LYS 106.A N MET 80.A O no hydrogen 2.892 N/A VAL 109.A N ASP 35.A O no hydrogen 2.907 N/A SER 112.A N ILE 115.A O no hydrogen 2.903 N/A TYR 114.A N SER 112.A OG no hydrogen 3.238 N/A ILE 115.A N SER 112.A O no hydrogen 3.421 N/A HIS 116.A N PRO 13.A O no hydrogen 3.159 N/A VAL 118.A N LEU 32.A O.A no hydrogen 2.963 N/A VAL 118.A N LEU 32.A O.B no hydrogen 2.966 N/A CYS 119.A N TRP 205.A O no hydrogen 3.201 N/A THR 125.A N ASP 122.A OD1 no hydrogen 2.824 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 2.674 N/A ALA 126.A N ASP 122.A O no hydrogen 3.059 N/A LEU 130.A N ALA 126.A O no hydrogen 3.018 N/A GLN 131.A N LEU 129C.A O no hydrogen 2.910 N/A GLN 131.A NE2 SER 128B.A O.A no hydrogen 2.601 N/A GLN 131.A NE2 SER 128B.A O.B no hydrogen 2.614 N/A GLY 133.A N ILE 153.A O no hydrogen 2.870 N/A TYR 134.A N GLN 131.A O no hydrogen 3.176 N/A LYS 135.A NZ TYR 176A.A OH no hydrogen 3.210 N/A GLY 136.A N LEU 151.A O no hydrogen 2.690 N/A ARG 137.A N VAL 196.A O no hydrogen 2.756 N/A ARG 137.A NE ASN 150.A OD1 no hydrogen 3.160 N/A VAL 138.A N VAL 149.A O no hydrogen 2.958 N/A GLY 140.A N GLN 147.A O no hydrogen 3.058 N/A ASN 143.A N ILE 1.A O no hydrogen 2.989 N/A LEU 146.A N HIS 66.A O no hydrogen 2.997 N/A GLN 147.A N GLY 140.A O no hydrogen 2.598 N/A GLN 147.A NE2 ASP 6.A OD1 no hydrogen 3.050 N/A GLN 147.A NE2 VAL 145.A O no hydrogen 3.098 N/A VAL 148.A N SER 5.A O no hydrogen 2.915 N/A VAL 149.A N VAL 138.A O no hydrogen 3.097 N/A LEU 151.A N GLY 136.A O no hydrogen 2.756 N/A ILE 153.A N TYR 134.A O no hydrogen 2.855 N/A VAL 154.A N CYS 173.A O.A no hydrogen 2.887 N/A VAL 154.A N CYS 173.A O.B no hydrogen 2.850 N/A ARG 156.A NH1.A MET 171.A O no hydrogen 2.800 N/A ARG 156.A NH1.B MET 171.A O no hydrogen 3.100 N/A ARG 156.A NH2.A THR 168.A O no hydrogen 2.940 N/A ARG 156.A NH2.A MET 171.A O no hydrogen 3.084 N/A ARG 156.A NH2.B MET 171.A O no hydrogen 2.960 N/A CYS 159.A N.A GLU 155.A O no hydrogen 2.970 N/A CYS 159.A N.B GLU 155.A O no hydrogen 2.968 N/A CYS 159.A SG.A VAL 154.A O no hydrogen 3.490 N/A CYS 159.A SG.A GLU 155.A O no hydrogen 3.448 N/A LYS 160.A N ARG 156.A O.A no hydrogen 3.001 N/A LYS 160.A N ARG 156.A O.B no hydrogen 2.982 N/A ASP 161.A N PRO 157.A O no hydrogen 3.245 N/A SER 162.A N.A CYS 159.A O.A no hydrogen 3.205 N/A SER 162.A N.A CYS 159.A O.B no hydrogen 3.089 N/A SER 162.A N.B VAL 158.A O no hydrogen 3.138 N/A SER 162.A N.B CYS 159.A O.A no hydrogen 3.211 N/A SER 162.A N.B CYS 159.A O.B no hydrogen 3.095 N/A SER 162.A OG.A CYS 159.A O.A no hydrogen 2.848 N/A SER 162.A OG.A CYS 159.A O.B no hydrogen 2.783 N/A SER 162.A OG.B VAL 158.A O no hydrogen 2.971 N/A THR 163.A OG1 GLU 215.A OE2 no hydrogen 2.716 N/A ILE 165.A N THR 163.A OG1 no hydrogen 3.060 N/A ARG 166.A NE GLU 94A.A OE1 no hydrogen 2.915 N/A ARG 166.A NH2 GLU 94A.A OE1 no hydrogen 3.165 N/A ARG 166.A NH2 GLU 94A.A OE2 no hydrogen 3.564 N/A THR 168.A OG1 ASP 97.A OD1 no hydrogen 2.701 N/A ASN 170.A N THR 168.A OG1 no hydrogen 3.145 N/A ASN 170.A ND2 ASP 97.A OD1 no hydrogen 3.186 N/A MET 171.A N THR 168.A O no hydrogen 3.010 N/A PHE 172.A N TYR 226.A O no hydrogen 3.039 N/A ALA 174.A N GLY 224.A O no hydrogen 3.147 N/A GLY 175.A N PRO 152.A O no hydrogen 3.009 N/A ARG 183.A NE GLU 180B.A O no hydrogen 3.577 N/A ASP 185.A N VAL 2.A O no hydrogen 2.994 N/A CYS 187.A N ASP 190.A OD2 no hydrogen 2.652 N/A CYS 187.A SG ASP 185.A O no hydrogen 4.042 N/A ASP 190.A N CYS 187.A O no hydrogen 2.675 N/A SER 191.A N GLU 188.A O no hydrogen 3.067 N/A SER 191.A OG HIS 43.A NE2 no hydrogen 3.172 N/A SER 191.A OG GLU 188.A O no hydrogen 2.764 N/A GLY 192.A N VAL 211.A O no hydrogen 2.913 N/A GLY 193.A N ASP 190.A O no hydrogen 3.145 N/A PHE 195.A N GLY 209.A O no hydrogen 2.966 N/A VAL 196.A N ARG 137.A O no hydrogen 2.892 N/A MET 197.A N TYR 206.A O no hydrogen 2.987 N/A SER 199.A N ARG 204.A O no hydrogen 2.861 N/A SER 199.A OG ASN 202B.A OD1 no hydrogen 3.394 N/A ARG 204.A N ASN 202B.A OD1 no hydrogen 3.014 N/A TYR 206.A N MET 197.A O no hydrogen 2.855 N/A GLN 207.A N CYS 119.A O no hydrogen 2.823 N/A GLN 207.A NE2 GLY 209.A O no hydrogen 3.183 N/A MET 208.A N PHE 195.A O no hydrogen 2.931 N/A GLY 209.A N PHE 195.A O no hydrogen 3.183 N/A ILE 210.A N THR 227.A O no hydrogen 3.267 N/A VAL 211.A N GLY 193.A O no hydrogen 2.951 N/A SER 212.A N PHE 225.A O no hydrogen 2.892 N/A SER 212.A OG ASP 99.A OD2 no hydrogen 2.813 N/A TRP 213.A N PHE 225.A O no hydrogen 3.273 N/A TRP 213.A NE1 GLU 215.A OE2 no hydrogen 3.014 N/A GLY 214.A N GLU 188.A OE1 no hydrogen 3.141 N/A GLU 215.A N TYR 223.A O no hydrogen 2.964 N/A CYS 217.A SG.A ALA 186.A O no hydrogen 2.891 N/A GLY 224.A N ALA 174.A O no hydrogen 3.143 N/A PHE 225.A N TRP 213.A O no hydrogen 2.785 N/A TYR 226.A N PHE 172.A O no hydrogen 2.808 N/A THR 227.A N ILE 210.A O no hydrogen 2.922 N/A THR 227.A OG1 ASP 99.A O no hydrogen 2.779 N/A HIS 228.A N ASN 170.A O no hydrogen 2.848 N/A VAL 229.A N MET 208.A O no hydrogen 3.100 N/A ARG 231.A N HIS 228.A ND1 no hydrogen 3.412 N/A ARG 231.A NE ASN 170.A OD1 no hydrogen 2.978 N/A ARG 231.A NH2 ASN 170.A OD1 no hydrogen 2.910 N/A LEU 232.A N VAL 229.A O no hydrogen 2.986 N/A LYS 233.A N PHE 230.A O no hydrogen 3.074 N/A LYS 233.A NZ PRO 121.A O no hydrogen 2.880 N/A ILE 236.A N LEU 232.A O no hydrogen 3.239 N/A GLN 237.A N LYS 233.A O no hydrogen 2.851 N/A GLN 237.A NE2 GLN 237.A O no hydrogen 3.598 N/A GLN 237.A NE2 ASP 241.A OD1 no hydrogen 2.891 N/A GLN 237.A NE2 ASP 241.A OD2 no hydrogen 3.009 N/A LYS 238.A N LYS 234.A O no hydrogen 2.895 N/A VAL 239.A N TRP 235.A O no hydrogen 2.951 N/A ILE 240.A N ILE 236.A O no hydrogen 3.113 N/A ASP 241.A N GLN 237.A O no hydrogen 3.057 N/A GLN 242.A N LYS 238.A O no hydrogen 3.052 N/A PHE 243.A N VAL 239.A O no hydrogen 2.877 N/A GLY 244.A N ILE 240.A O no hydrogen 2.725 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.762 N/A GLU 94A.A N ASN 91.A OD1 no hydrogen 2.641 N/A ALA 127A.A N ARG 123.A O no hydrogen 2.920 N/A PHE 201A.A N SER 199.A OG no hydrogen 3.091 N/A ARG 219A.A N GLY 216.A O no hydrogen 3.187 N/A ARG 219A.A NH1 ASP 218.A O no hydrogen 3.037 N/A SER 128B.A N.A GLU 124.A O no hydrogen 2.955 N/A SER 128B.A N.B GLU 124.A O no hydrogen 2.957 N/A SER 128B.A OG.A GLU 124.A O no hydrogen 3.091 N/A SER 128B.A OG.B GLU 124.A O no hydrogen 2.905 N/A SER 128B.A OG.B THR 125.A O no hydrogen 3.066 N/A GLU 180B.A N LYS 177.A O no hydrogen 2.664 N/A ASN 202B.A N SER 199.A OG no hydrogen 3.423 N/A ASN 202B.A ND2 TYR 206.A OH no hydrogen 2.892 N/A LEU 129C.A N THR 125.A O no hydrogen 2.885 N/A TRP 50D.A N TYR 47A.A O no hydrogen 3.211 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.520 N/A LYS 52F.A N TYR 47A.A O no hydrogen 3.092 N/A PHE 54H.A N LEU 45.A O no hydrogen 3.372 N/A THR 55I.A N ASP 58.A OD2 no hydrogen 2.949 N/A THR 55I.A OG1 ASP 58.A OD2 no hydrogen 3.098 N/A