Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3siu_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N PRO 3.A O no hydrogen 3.251 N/A ARG 6.A NH1 GLY 148.A O no hydrogen 3.201 N/A ARG 6.A NH2 GLY 148.A O no hydrogen 3.152 N/A ILE 8.A N GLU 4.A O no hydrogen 3.095 N/A VAL 9.A N TYR 5.A O no hydrogen 2.781 N/A ASP 10.A N ARG 6.A O no hydrogen 3.099 N/A ALA 11.A N VAL 7.A O no hydrogen 2.853 N/A ASN 12.A N ILE 8.A O no hydrogen 2.755 N/A ASN 12.A ND2 SER 141.A OG no hydrogen 3.291 N/A ASN 13.A N VAL 9.A O no hydrogen 3.040 N/A LEU 14.A N ASP 10.A O no hydrogen 3.150 N/A THR 15.A N ALA 11.A O no hydrogen 3.351 N/A VAL 16.A N ASN 13.A O no hydrogen 2.791 N/A GLU 17.A N ASN 13.A O no hydrogen 3.138 N/A ILE 18.A N LEU 14.A O no hydrogen 2.804 N/A GLU 19.A N THR 15.A O no hydrogen 3.029 N/A ASN 20.A N VAL 16.A O no hydrogen 3.010 N/A GLU 21.A N GLU 17.A O no hydrogen 3.129 N/A LEU 22.A N ILE 18.A O no hydrogen 2.916 N/A ASN 23.A N GLU 19.A O no hydrogen 2.932 N/A ILE 24.A N ASN 20.A O no hydrogen 2.994 N/A ILE 25.A N GLU 21.A O no hydrogen 2.806 N/A HIS 26.A N LEU 22.A O no hydrogen 3.029 N/A LYS 27.A N ASN 23.A O no hydrogen 3.103 N/A PHE 28.A N ILE 24.A O no hydrogen 2.970 N/A ILE 29.A N ILE 25.A O no hydrogen 2.732 N/A ARG 30.A N HIS 26.A O no hydrogen 2.788 N/A ASP 31.A N LYS 27.A O no hydrogen 3.008 N/A LYS 32.A N PHE 28.A O no hydrogen 2.924 N/A TYR 33.A N ILE 29.A O no hydrogen 3.095 N/A TYR 33.A OH GLY 58.A O no hydrogen 2.969 N/A SER 34.A N ASP 31.A O no hydrogen 3.290 N/A LYS 35.A NZ GLU 98.A OE1 no hydrogen 3.039 N/A LYS 35.A NZ GLU 98.A OE2 no hydrogen 3.537 N/A ARG 36.A NE ARG 36.A O no hydrogen 2.752 N/A ARG 36.A NH1 ASN 59.A O no hydrogen 2.261 N/A ARG 36.A NH2 GLY 91.A O no hydrogen 3.295 N/A PHE 37.A N TYR 33.A O no hydrogen 3.104 N/A GLU 39.A N GLU 39.A OE2 no hydrogen 2.655 N/A LEU 40.A N PHE 37.A O no hydrogen 3.422 N/A SER 42.A OG GLU 39.A O no hydrogen 2.797 N/A LEU 43.A N LEU 40.A O no hydrogen 2.625 N/A VAL 44.A N LEU 40.A O no hydrogen 2.877 N/A TYR 50.A N ASN 46.A O no hydrogen 2.793 N/A ILE 51.A N ALA 47.A O no hydrogen 2.932 N/A ARG 52.A N LEU 48.A O no hydrogen 3.019 N/A THR 53.A N ASP 49.A O no hydrogen 2.849 N/A THR 53.A OG1 ASP 49.A O no hydrogen 2.610 N/A VAL 54.A N TYR 50.A O no hydrogen 2.841 N/A LYS 55.A N ILE 51.A O no hydrogen 2.959 N/A GLU 56.A N ARG 52.A O no hydrogen 3.008 N/A LEU 57.A N THR 53.A O no hydrogen 2.806 N/A GLY 58.A N VAL 54.A O no hydrogen 3.009 N/A ASN 59.A ND2 LEU 94.A O no hydrogen 2.788 N/A CYS 64.A N LEU 61.A O no hydrogen 3.222 N/A CYS 64.A SG LEU 61.A O no hydrogen 3.298 N/A ASN 66.A N LYS 63.A O no hydrogen 2.843 N/A ASN 67.A N CYS 64.A O no hydrogen 3.070 N/A ASN 67.A ND2 GLU 56.A OE2 no hydrogen 2.630 N/A LEU 70.A N ASN 67.A OD1 no hydrogen 2.211 N/A GLN 71.A NE2 ASN 76.A OD1 no hydrogen 3.625 N/A GLN 72.A N ASN 69.A O no hydrogen 3.004 N/A GLN 72.A NE2 ASN 69.A O no hydrogen 3.324 N/A ILE 73.A N LEU 70.A O no hydrogen 3.035 N/A LEU 74.A N LEU 70.A O no hydrogen 3.121 N/A THR 78.A N THR 75.A OG1 no hydrogen 3.030 N/A ILE 79.A N THR 75.A O no hydrogen 2.832 N/A MET 80.A N ASN 76.A O no hydrogen 2.997 N/A VAL 81.A N ALA 77.A O no hydrogen 3.054 N/A VAL 82.A N THR 78.A O no hydrogen 2.927 N/A SER 83.A N ILE 79.A O no hydrogen 2.958 N/A VAL 84.A N MET 80.A O no hydrogen 3.123 N/A THR 85.A N VAL 81.A O no hydrogen 3.028 N/A THR 85.A OG1 VAL 81.A O no hydrogen 2.721 N/A ALA 86.A N VAL 82.A O no hydrogen 2.714 N/A ALA 86.A N SER 83.A O no hydrogen 3.250 N/A SER 87.A N SER 83.A O no hydrogen 3.300 N/A SER 87.A OG VAL 84.A O no hydrogen 3.107 N/A THR 89.A N ALA 86.A O no hydrogen 3.146 N/A THR 89.A OG1 GLU 39.A OE2 no hydrogen 2.756 N/A GLN 90.A N GLU 39.A OE1 no hydrogen 3.370 N/A GLN 92.A N GLN 92.A OE1 no hydrogen 2.917 N/A LEU 94.A N ASN 59.A OD1 no hydrogen 2.513 N/A SER 95.A N GLU 98.A OE1 no hydrogen 2.643 N/A GLU 97.A N SER 95.A OG no hydrogen 2.879 N/A GLU 98.A N SER 95.A OG no hydrogen 2.907 N/A LEU 99.A N SER 95.A O no hydrogen 2.788 N/A GLU 100.A N GLU 96.A O no hydrogen 2.983 N/A ARG 101.A N GLU 97.A O no hydrogen 3.009 N/A ARG 101.A NE GLU 104.A OE1 no hydrogen 3.437 N/A ARG 101.A NH1 GLU 100.A OE1 no hydrogen 2.418 N/A ARG 101.A NH2 GLU 104.A OE2 no hydrogen 3.330 N/A LEU 102.A N GLU 98.A O no hydrogen 2.997 N/A GLU 103.A N LEU 99.A O no hydrogen 2.986 N/A GLU 104.A N GLU 100.A O no hydrogen 3.125 N/A ALA 105.A N ARG 101.A O no hydrogen 3.234 N/A CYS 106.A N LEU 102.A O no hydrogen 2.993 N/A CYS 106.A SG ILE 51.A O no hydrogen 3.753 N/A CYS 106.A SG LEU 102.A O no hydrogen 3.569 N/A ASP 107.A N GLU 103.A O no hydrogen 2.966 N/A MET 108.A N GLU 104.A O no hydrogen 3.011 N/A ALA 109.A N ALA 105.A O no hydrogen 2.935 N/A LEU 110.A N CYS 106.A O no hydrogen 3.037 N/A GLU 111.A N ASP 107.A O no hydrogen 3.082 N/A LEU 112.A N MET 108.A O no hydrogen 2.967 N/A ASN 113.A N ALA 109.A O no hydrogen 2.920 N/A ALA 114.A N LEU 110.A O no hydrogen 3.014 N/A SER 115.A N GLU 111.A O no hydrogen 3.204 N/A LYS 116.A N LEU 112.A O no hydrogen 2.852 N/A HIS 117.A N ASN 113.A O no hydrogen 2.853 N/A ARG 118.A N ALA 114.A O no hydrogen 2.906 N/A ARG 118.A NE GLU 121.A OE1 no hydrogen 3.215 N/A ARG 118.A NH2 GLU 121.A OE2 no hydrogen 2.440 N/A ILE 119.A N SER 115.A O no hydrogen 3.015 N/A TYR 120.A N LYS 116.A O no hydrogen 2.905 N/A GLU 121.A N HIS 117.A O no hydrogen 2.950 N/A TYR 122.A N ARG 118.A O no hydrogen 3.264 N/A VAL 123.A N ILE 119.A O no hydrogen 2.917 N/A GLU 124.A N TYR 120.A O no hydrogen 2.961 N/A SER 125.A N GLU 121.A O no hydrogen 2.957 N/A ARG 126.A N TYR 122.A O no hydrogen 2.948 N/A ARG 126.A NE GLU 4.A OE2 no hydrogen 2.483 N/A ARG 126.A NH2 GLU 4.A OE1 no hydrogen 3.257 N/A ARG 126.A NH2 GLU 4.A OE2 no hydrogen 3.114 N/A MET 127.A N VAL 123.A O no hydrogen 2.918 N/A SER 128.A N GLU 124.A O no hydrogen 2.867 N/A SER 128.A OG GLU 124.A O no hydrogen 3.409 N/A SER 128.A OG SER 125.A O no hydrogen 2.717 N/A PHE 129.A N SER 125.A O no hydrogen 3.192 N/A ILE 130.A N ARG 126.A O no hydrogen 2.777 N/A ALA 131.A N MET 127.A O no hydrogen 2.913 N/A ASN 133.A N ASP 209.A OD1 no hydrogen 3.308 N/A ASN 133.A ND2 SER 214.A OG no hydrogen 3.362 N/A LEU 134.A N ASP 209.A OD2 no hydrogen 2.805 N/A SER 135.A N ALA 131.A O no hydrogen 2.894 N/A SER 135.A OG MET 127.A O no hydrogen 3.180 N/A SER 135.A OG ALA 131.A O no hydrogen 3.026 N/A ILE 136.A N PRO 132.A O no hydrogen 3.173 N/A ILE 137.A N LEU 134.A O no hydrogen 2.788 N/A ILE 138.A N LEU 134.A O no hydrogen 3.217 N/A GLY 139.A N SER 135.A O no hydrogen 2.588 N/A SER 141.A OG ASN 12.A OD1 no hydrogen 3.198 N/A THR 142.A OG1 ILE 138.A O no hydrogen 3.293 N/A ALA 143.A N GLY 139.A O no hydrogen 3.112 N/A ALA 144.A N ALA 140.A O no hydrogen 2.717 N/A LYS 145.A N SER 141.A O no hydrogen 2.924 N/A ILE 146.A N THR 142.A O no hydrogen 2.902 N/A MET 147.A N ALA 143.A O no hydrogen 2.944 N/A GLY 148.A N ALA 144.A O no hydrogen 2.902 N/A VAL 149.A N LYS 145.A O no hydrogen 3.270 N/A ALA 150.A N ILE 146.A O no hydrogen 3.164 N/A GLY 151.A N MET 147.A O no hydrogen 2.818 N/A GLY 152.A N MET 147.A O no hydrogen 3.042 N/A ASN 155.A ND2 GLY 151.A O no hydrogen 3.177 N/A LEU 156.A N GLY 152.A O no hydrogen 3.022 N/A SER 157.A N LEU 153.A O no hydrogen 3.182 N/A SER 157.A OG THR 154.A O no hydrogen 2.791 N/A LYS 158.A N THR 154.A O no hydrogen 3.319 N/A MET 159.A N LEU 156.A O no hydrogen 3.127 N/A CYS 162.A SG ASN 163.A OD1 no hydrogen 3.578 N/A ASN 163.A N PRO 160.A O no hydrogen 3.053 N/A ILE 164.A N PRO 160.A O no hydrogen 3.175 N/A MET 165.A N ALA 161.A O no hydrogen 2.878 N/A LEU 166.A N ASN 163.A O no hydrogen 3.281 N/A ALA 169.A N LEU 166.A O no hydrogen 3.128 N/A TYR 176.A N LEU 167.A O no hydrogen 2.884 N/A HIS 179.A N GLY 175.A O no hydrogen 3.160 N/A SER 180.A N ILE 177.A O no hydrogen 3.192 N/A SER 180.A OG ILE 177.A O no hydrogen 2.712 N/A VAL 183.A N SER 180.A OG no hydrogen 3.379 N/A GLN 184.A N SER 180.A O no hydrogen 3.110 N/A GLN 184.A N ASP 181.A O no hydrogen 2.535 N/A GLN 184.A NE2 TYR 178.A O no hydrogen 2.846 N/A SER 185.A N ASP 181.A O no hydrogen 2.997 N/A SER 185.A OG ILE 182.A O no hydrogen 2.948 N/A LEU 186.A N VAL 183.A O no hydrogen 3.371 N/A LEU 190.A N PRO 187.A O no hydrogen 2.907 N/A ARG 191.A N PRO 188.A O no hydrogen 3.107 N/A ARG 191.A NE LEU 186.A O no hydrogen 2.663 N/A ARG 191.A NH2 GLN 184.A O no hydrogen 3.024 N/A ARG 191.A NH2 LEU 186.A O no hydrogen 3.321 N/A ARG 192.A NH2 HIS 173.A ND1 no hydrogen 3.086 N/A ALA 194.A N LEU 190.A O no hydrogen 3.010 N/A ALA 195.A N ARG 191.A O no hydrogen 2.752 N/A ARG 196.A N ARG 192.A O no hydrogen 3.091 N/A LEU 197.A N LYS 193.A O no hydrogen 3.009 N/A VAL 198.A N ALA 194.A O no hydrogen 2.930 N/A ALA 199.A N ALA 195.A O no hydrogen 2.868 N/A ALA 200.A N ARG 196.A O no hydrogen 3.025 N/A LYS 201.A N LEU 197.A O no hydrogen 3.193 N/A CYS 202.A N VAL 198.A O no hydrogen 2.857 N/A CYS 202.A SG VAL 198.A O no hydrogen 3.458 N/A THR 203.A N ALA 199.A O no hydrogen 2.933 N/A THR 203.A N ALA 200.A O no hydrogen 3.015 N/A THR 203.A OG1 ALA 199.A O no hydrogen 3.154 N/A LEU 204.A N ALA 200.A O no hydrogen 3.303 N/A ALA 205.A N LYS 201.A O no hydrogen 2.884 N/A ALA 206.A N CYS 202.A O no hydrogen 2.856 N/A ARG 207.A N THR 203.A O no hydrogen 3.209 N/A VAL 208.A N LEU 204.A O no hydrogen 3.113 N/A ASP 209.A N ALA 205.A O no hydrogen 3.101 N/A SER 210.A N ARG 207.A O no hydrogen 3.037 N/A SER 210.A OG ARG 207.A O no hydrogen 2.782 N/A PHE 211.A N VAL 208.A O no hydrogen 2.970 N/A HIS 212.A N ASP 209.A O no hydrogen 3.282 N/A THR 215.A OG1 GLU 216.A OE2 no hydrogen 3.308 N/A GLY 217.A N SER 214.A O no hydrogen 2.742 N/A VAL 219.A N SER 214.A OG no hydrogen 2.984 N/A TYR 221.A N GLY 217.A O no hydrogen 2.751 N/A GLU 222.A N LYS 218.A O no hydrogen 2.824 N/A LEU 223.A N VAL 219.A O no hydrogen 2.843 N/A LYS 224.A N GLY 220.A O no hydrogen 2.818 N/A ASP 225.A N TYR 221.A O no hydrogen 2.971 N/A GLU 226.A N GLU 222.A O no hydrogen 2.840 N/A ILE 227.A N LEU 223.A O no hydrogen 2.914 N/A GLU 228.A N LYS 224.A O no hydrogen 2.740 N/A ARG 229.A N ASP 225.A O no hydrogen 2.780 N/A PHE 231.A N ILE 227.A O no hydrogen 3.234 N/A ASP 232.A N GLU 228.A O no hydrogen 2.881 N/A LYS 233.A N ARG 229.A O no hydrogen 2.914 N/A TRP 234.A N LYS 230.A O no hydrogen 3.138 N/A