Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a1j_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 GLN 99.A O no hydrogen 3.615 N/A TYR 3.A N ASP 1.A O no hydrogen 2.963 N/A SER 4.A N GLN 99.A O no hydrogen 3.065 N/A SER 4.A OG GLN 99.A O no hydrogen 2.658 N/A LEU 5.A N TYR 98.A O no hydrogen 3.212 N/A VAL 6.A N LYS 62.A O no hydrogen 3.039 N/A SER 8.A N GLU 60.A O no hydrogen 2.799 N/A SER 8.A OG GLU 60.A OE2 no hydrogen 3.190 N/A LEU 9.A N LEU 95.A O no hydrogen 2.756 N/A ASP 10.A N GLN 59.A OE1 no hydrogen 3.012 N/A ASN 11.A ND2 GLU 241.A OE1 no hydrogen 2.860 N/A VAL 12.A N THR 93.A O no hydrogen 2.951 N/A ARG 13.A N ASN 11.A OD1 no hydrogen 2.967 N/A ARG 13.A NE GLU 241.A OE1 no hydrogen 3.073 N/A ARG 13.A NE GLU 241.A OE2 no hydrogen 2.566 N/A ARG 13.A NH2 GLU 241.A OE1 no hydrogen 2.578 N/A ARG 13.A NH2 GLU 241.A OE2 no hydrogen 3.239 N/A ASN 14.A N ASN 11.A O no hydrogen 2.933 N/A ASN 14.A ND2 ASP 242.A OD2 no hydrogen 2.889 N/A LEU 15.A N VAL 12.A O no hydrogen 2.703 N/A SER 16.A N VAL 12.A O no hydrogen 2.866 N/A THR 17.A N ARG 13.A O no hydrogen 3.305 N/A THR 17.A OG1 ARG 13.A O no hydrogen 3.177 N/A LEU 19.A N LEU 15.A O no hydrogen 3.058 N/A LYS 20.A N SER 16.A O no hydrogen 2.995 N/A LYS 20.A N THR 17.A O no hydrogen 3.187 N/A ALA 21.A N ILE 18.A O no hydrogen 2.797 N/A ILE 22.A N LEU 19.A O no hydrogen 3.355 N/A HIS 23.A N LYS 20.A O no hydrogen 3.315 N/A PHE 24.A N ILE 22.A O no hydrogen 3.124 N/A ALA 28.A N ILE 72.A O no hydrogen 3.088 N/A THR 29.A N THR 40.A O no hydrogen 2.754 N/A CYS 30.A N PHE 70.A O no hydrogen 2.801 N/A PHE 31.A N LYS 38.A O no hydrogen 2.740 N/A ALA 32.A N VAL 68.A O no hydrogen 2.885 N/A THR 33.A N GLY 36.A O no hydrogen 2.985 N/A THR 33.A OG1 ALA 32.A O no hydrogen 3.502 N/A THR 33.A OG1 GLU 66.A O no hydrogen 3.126 N/A LYS 34.A NZ GLU 66.A O no hydrogen 2.757 N/A LYS 34.A NZ GLU 66.A OE2 no hydrogen 3.302 N/A GLY 36.A N THR 33.A O no hydrogen 2.957 N/A ILE 37.A N ILE 53.A O no hydrogen 2.964 N/A LYS 38.A N PHE 31.A O no hydrogen 2.795 N/A VAL 39.A N ALA 51.A O no hydrogen 2.928 N/A THR 40.A N THR 29.A O no hydrogen 2.844 N/A THR 40.A OG1 ASN 50.A OD1 no hydrogen 2.502 N/A VAL 41.A N ALA 49.A O no hydrogen 2.994 N/A ASN 43.A N VAL 47.A O no hydrogen 2.805 N/A CYS 46.A N ASN 43.A O no hydrogen 3.127 N/A CYS 46.A SG ALA 44.A O no hydrogen 3.962 N/A GLN 48.A N TYR 251.A O no hydrogen 3.107 N/A GLN 48.A NE2 GLU 42.A OE2 no hydrogen 2.819 N/A GLN 48.A NE2 LEU 128.A O no hydrogen 3.034 N/A ALA 49.A N VAL 41.A O no hydrogen 2.922 N/A ASN 50.A N GLU 249.A O no hydrogen 2.907 N/A ASN 50.A ND2 GLN 48.A OE1 no hydrogen 2.899 N/A ALA 51.A N VAL 39.A O no hydrogen 2.945 N/A PHE 52.A N PHE 247.A O no hydrogen 3.248 N/A ILE 53.A N ILE 37.A O no hydrogen 2.841 N/A GLN 54.A N GLN 54.A OE1 no hydrogen 2.559 N/A GLN 54.A NE2 ILE 245.A O no hydrogen 2.413 N/A ALA 55.A N ASN 35.A O no hydrogen 2.889 N/A ILE 57.A N GLN 54.A O no hydrogen 2.923 N/A PHE 58.A N ALA 55.A O no hydrogen 3.100 N/A GLN 59.A N SER 8.A O no hydrogen 2.978 N/A GLN 59.A NE2 ILE 57.A O no hydrogen 3.426 N/A LYS 62.A N VAL 6.A O no hydrogen 2.906 N/A GLN 64.A N SER 4.A O no hydrogen 2.888 N/A VAL 68.A N ALA 32.A O no hydrogen 2.976 N/A PHE 70.A N CYS 30.A O no hydrogen 3.131 N/A ARG 71.A N GLN 122.A O no hydrogen 3.087 N/A ILE 72.A N ALA 28.A O no hydrogen 3.146 N/A LEU 74.A N GLU 26.A O no hydrogen 2.803 N/A VAL 76.A N ASN 73.A OD1 no hydrogen 2.947 N/A LEU 77.A N ASN 73.A O no hydrogen 2.984 N/A LEU 78.A N LEU 74.A O no hydrogen 2.782 N/A ASP 79.A N THR 75.A O no hydrogen 2.884 N/A CYS 80.A N VAL 76.A O no hydrogen 2.895 N/A CYS 80.A SG VAL 76.A O no hydrogen 3.349 N/A LEU 81.A N LEU 77.A O no hydrogen 2.996 N/A SER 82.A N LEU 78.A O no hydrogen 3.223 N/A SER 82.A OG LEU 78.A O no hydrogen 3.092 N/A ILE 83.A N CYS 80.A O no hydrogen 3.065 N/A GLY 85.A N SER 82.A O no hydrogen 3.091 N/A ALA 94.A N GLU 109.A O no hydrogen 3.067 N/A LEU 95.A N LEU 9.A O no hydrogen 2.704 N/A ARG 96.A N PHE 107.A O no hydrogen 2.864 N/A ARG 96.A NE GLU 60.A OE2 no hydrogen 3.538 N/A ARG 96.A NH2 GLU 60.A OE1 no hydrogen 3.327 N/A TYR 98.A N LEU 5.A O no hydrogen 2.975 N/A TYR 101.A OH GLU 123.A OE1 no hydrogen 2.783 N/A TYR 103.A N GLY 100.A O no hydrogen 2.850 N/A LEU 105.A N ILE 119.A O no hydrogen 2.530 N/A PHE 107.A N ARG 96.A O no hydrogen 3.042 N/A LEU 108.A N THR 115.A O no hydrogen 3.016 N/A GLU 109.A N ALA 94.A O no hydrogen 3.197 N/A GLU 110.A N VAL 113.A O no hydrogen 2.937 N/A GLY 112.A N GLU 109.A OE2 no hydrogen 3.198 N/A VAL 113.A N GLU 110.A O no hydrogen 2.895 N/A THR 115.A N LEU 108.A O no hydrogen 2.763 N/A CYS 117.A N LEU 106.A O no hydrogen 2.923 N/A ILE 119.A N LEU 105.A O no hydrogen 2.852 N/A THR 121.A OG1 TYR 103.A O no hydrogen 2.609 N/A GLN 122.A N ARG 71.A O no hydrogen 2.723 N/A THR 127.A OG1 GLU 125.A O no hydrogen 3.302 N/A LEU 128.A N GLU 42.A OE1 no hydrogen 3.397 N/A PHE 132.A N PHE 130.A O no hydrogen 3.045 N/A CYS 133.A N ASP 131.A O no hydrogen 2.852 N/A CYS 133.A SG ASP 131.A O no hydrogen 3.489 N/A CYS 133.A SG ASP 131.A OD2 no hydrogen 2.807 N/A ASN 136.A N CYS 133.A O no hydrogen 2.628 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 3.527 N/A ILE 138.A N THR 227.A O no hydrogen 3.165 N/A ASN 139.A ND2 GLN 199.A O no hydrogen 3.164 N/A LYS 140.A N HIS 196.A O no hydrogen 3.040 N/A ILE 141.A N ILE 225.A O no hydrogen 2.942 N/A ILE 142.A N ALA 194.A O no hydrogen 2.891 N/A LEU 143.A N VAL 223.A O no hydrogen 2.757 N/A GLN 144.A N LEU 192.A O no hydrogen 3.041 N/A GLN 144.A NE2 GLU 193.A OE2 no hydrogen 3.271 N/A SER 145.A N CYS 221.A O no hydrogen 3.335 N/A SER 145.A OG SER 220.A OG no hydrogen 2.832 N/A LEU 148.A N SER 145.A O no hydrogen 2.860 N/A ARG 149.A NH2 SER 220.A O no hydrogen 2.666 N/A PHE 152.A N LEU 148.A O no hydrogen 2.708 N/A SER 153.A N ARG 149.A O no hydrogen 3.078 N/A SER 153.A N GLU 150.A O no hydrogen 3.185 N/A SER 153.A OG GLU 150.A O no hydrogen 3.016 N/A GLU 154.A N ALA 151.A O no hydrogen 3.037 N/A SER 158.A N ASP 156.A O no hydrogen 3.242 N/A SER 158.A OG VAL 160.A O no hydrogen 2.720 N/A VAL 160.A N SER 158.A OG no hydrogen 3.274 N/A LEU 161.A N TYR 205.A O no hydrogen 2.764 N/A GLN 162.A N SER 174.A O no hydrogen 2.830 N/A ILE 163.A N ASN 203.A O no hydrogen 2.770 N/A THR 164.A N ARG 172.A O no hydrogen 2.808 N/A SER 165.A OG ASP 167.A O no hydrogen 3.225 N/A SER 165.A OG THR 200.A OG1 no hydrogen 2.688 N/A ASP 167.A N SER 165.A OG no hydrogen 2.741 N/A ARG 172.A N THR 164.A O no hydrogen 2.764 N/A ARG 172.A NE ASP 185.A OD2 no hydrogen 2.793 N/A ARG 172.A NH2 ASP 185.A OD1 no hydrogen 2.871 N/A ARG 172.A NH2 ASP 185.A OD2 no hydrogen 3.417 N/A LEU 173.A N LEU 184.A O no hydrogen 2.987 N/A SER 174.A N GLN 162.A O no hydrogen 2.791 N/A THR 175.A N SER 182.A O no hydrogen 3.119 N/A PHE 176.A N SER 158.A OG no hydrogen 2.830 N/A GLY 180.A N GLY 177.A O no hydrogen 2.846 N/A SER 182.A N THR 175.A O no hydrogen 3.378 N/A LEU 184.A N LEU 173.A O no hydrogen 2.777 N/A TYR 186.A N PHE 171.A O no hydrogen 3.006 N/A SER 190.A N PRO 187.A O no hydrogen 2.987 N/A LEU 192.A N SER 190.A OG no hydrogen 3.254 N/A ALA 194.A N ILE 142.A O no hydrogen 3.430 N/A HIS 196.A N LYS 140.A O no hydrogen 2.793 N/A THR 200.A OG1 SER 165.A OG no hydrogen 2.688 N/A ASN 203.A N ILE 163.A O no hydrogen 2.953 N/A ARG 204.A NH1 GLN 162.A OE1 no hydrogen 2.645 N/A TYR 205.A N LEU 161.A O no hydrogen 2.849 N/A TYR 205.A OH GLY 231.A O no hydrogen 2.873 N/A ILE 207.A N GLU 159.A O no hydrogen 3.058 N/A LEU 209.A N LYS 206.A O no hydrogen 2.956 N/A LEU 210.A N ILE 207.A O no hydrogen 2.971 N/A LYS 211.A N ILE 207.A O no hydrogen 2.966 N/A SER 213.A N LEU 210.A O no hydrogen 3.006 N/A SER 213.A OG LEU 210.A O no hydrogen 3.000 N/A SER 213.A OG TYR 237.A OH no hydrogen 3.343 N/A THR 214.A N LYS 211.A O no hydrogen 3.071 N/A THR 214.A OG1 LYS 211.A O no hydrogen 3.082 N/A LYS 215.A N PRO 212.A O no hydrogen 3.250 N/A LEU 217.A N SER 213.A O no hydrogen 3.298 N/A VAL 218.A N THR 214.A O no hydrogen 3.024 N/A LEU 219.A N ALA 216.A O no hydrogen 3.253 N/A SER 220.A N ALA 216.A O no hydrogen 3.034 N/A SER 220.A N LEU 217.A O no hydrogen 3.234 N/A SER 220.A OG SER 145.A OG no hydrogen 2.832 N/A SER 220.A OG ALA 216.A O no hydrogen 3.442 N/A SER 220.A OG LEU 217.A O no hydrogen 2.816 N/A VAL 223.A N LEU 143.A O no hydrogen 3.142 N/A SER 224.A N GLN 236.A O no hydrogen 3.010 N/A ILE 225.A N ILE 141.A O no hydrogen 2.515 N/A ARG 226.A N SER 234.A O no hydrogen 2.882 N/A ASP 228.A N PHE 232.A O no hydrogen 3.233 N/A ASN 229.A N ASN 136.A O no hydrogen 3.335 N/A ASN 229.A ND2 ASN 136.A O no hydrogen 3.423 N/A ARG 230.A N ASP 228.A OD1 no hydrogen 2.645 N/A ARG 230.A NE ASP 228.A OD2 no hydrogen 3.048 N/A ARG 230.A NH2 ASP 228.A OD2 no hydrogen 2.773 N/A GLY 231.A N ASP 228.A O no hydrogen 2.914 N/A GLY 231.A N ASP 228.A OD1 no hydrogen 3.003 N/A PHE 232.A N ASP 228.A OD1 no hydrogen 3.327 N/A LEU 233.A N CYS 252.A O no hydrogen 2.843 N/A SER 234.A N ARG 226.A O no hydrogen 2.642 N/A LEU 235.A N TYR 250.A O no hydrogen 2.720 N/A GLN 236.A N SER 224.A O no hydrogen 3.106 N/A GLN 236.A NE2 GLU 249.A OE2 no hydrogen 2.906 N/A TYR 237.A N VAL 248.A O no hydrogen 2.668 N/A TYR 237.A OH SER 213.A OG no hydrogen 3.343 N/A ASN 240.A N GLN 244.A O no hydrogen 2.830 N/A ASP 242.A N ASN 240.A OD1 no hydrogen 2.506 N/A GLY 243.A N ASN 240.A O no hydrogen 3.081 N/A GLN 244.A N ASN 240.A OD1 no hydrogen 3.258 N/A CYS 246.A N ILE 238.A O no hydrogen 2.702 N/A CYS 246.A SG PHE 52.A O no hydrogen 3.930 N/A CYS 246.A SG GLN 54.A OE1 no hydrogen 3.286 N/A VAL 248.A N TYR 237.A O no hydrogen 2.946 N/A GLU 249.A N ASN 50.A O no hydrogen 2.826 N/A TYR 250.A N LEU 235.A O no hydrogen 2.639 N/A TYR 250.A OH ALA 21.A O no hydrogen 3.122 N/A TYR 251.A N GLN 48.A O no hydrogen 2.987 N/A TYR 251.A OH GLU 249.A OE1 no hydrogen 3.283 N/A CYS 252.A N LEU 233.A O no hydrogen 2.940 N/A CYS 252.A SG CYS 46.A O no hydrogen 4.036 N/A CYS 252.A SG CYS 253.A O no hydrogen 3.515 N/A CYS 253.A N CYS 46.A O no hydrogen 2.973 N/A CYS 253.A SG CYS 46.A O no hydrogen 3.927 N/A CYS 253.A SG PRO 254.A O no hydrogen 3.719 N/A ASP 255.A N ARG 204.A O no hydrogen 2.810 N/A