Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1u3s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N SER 2.A O no hydrogen 2.957 N/A VAL 7.A N PRO 3.A O no hydrogen 2.939 N/A LEU 8.A N GLU 4.A O no hydrogen 3.040 N/A THR 9.A N GLN 5.A O no hydrogen 3.150 N/A THR 9.A OG1 LYS 53.A O no hydrogen 3.547 N/A LEU 10.A N LEU 6.A O no hydrogen 3.172 N/A LEU 10.A N VAL 7.A O no hydrogen 3.052 N/A LEU 11.A N VAL 7.A O no hydrogen 2.981 N/A GLU 12.A N LEU 8.A O no hydrogen 2.990 N/A ALA 13.A N LEU 10.A O no hydrogen 2.856 N/A GLU 14.A N LEU 11.A O no hydrogen 3.277 N/A ILE 20.A N ASP 97.A OD1 no hydrogen 3.167 N/A ARG 22.A N ASP 97.A OD2 no hydrogen 3.128 N/A ARG 22.A NH1 ALA 25.A O no hydrogen 2.753 N/A ARG 22.A NH2 ALA 25.A O no hydrogen 2.732 N/A THR 28.A N SER 31.A OG no hydrogen 2.880 N/A THR 28.A OG1 SER 31.A OG no hydrogen 2.985 N/A SER 31.A N THR 28.A OG1 no hydrogen 3.342 N/A SER 31.A OG THR 28.A O no hydrogen 3.320 N/A SER 31.A OG THR 28.A OG1 no hydrogen 2.985 N/A MET 32.A N THR 28.A O no hydrogen 2.919 N/A MET 33.A N GLU 29.A O no hydrogen 3.458 N/A MET 34.A N ALA 30.A O no hydrogen 3.019 N/A SER 35.A N SER 31.A O no hydrogen 2.893 N/A SER 35.A OG SER 31.A O no hydrogen 3.024 N/A LEU 36.A N MET 32.A O no hydrogen 2.953 N/A THR 37.A N MET 33.A O no hydrogen 2.974 N/A THR 37.A OG1 MET 33.A O no hydrogen 3.234 N/A THR 37.A OG1 MET 34.A O no hydrogen 3.256 N/A LYS 38.A N MET 34.A O no hydrogen 3.040 N/A LYS 38.A NZ ILE 20.A O no hydrogen 3.268 N/A LEU 39.A N SER 35.A O no hydrogen 3.080 N/A ALA 40.A N LEU 36.A O no hydrogen 2.920 N/A ASP 41.A N THR 37.A O no hydrogen 3.040 N/A LYS 42.A N LYS 38.A O no hydrogen 3.235 N/A LYS 42.A NZ LEU 19.A O no hydrogen 2.624 N/A GLU 43.A N LEU 39.A O no hydrogen 2.886 N/A LEU 44.A N ALA 40.A O no hydrogen 2.876 N/A VAL 45.A N LYS 42.A O no hydrogen 3.136 N/A MET 47.A N GLU 43.A O no hydrogen 2.864 N/A MET 47.A N LEU 44.A O no hydrogen 3.058 N/A ILE 48.A N LEU 44.A O no hydrogen 3.198 N/A SER 49.A N VAL 45.A O no hydrogen 3.482 N/A TRP 50.A N HIS 46.A O no hydrogen 2.876 N/A ALA 51.A N MET 47.A O no hydrogen 2.874 N/A LYS 52.A N ILE 48.A O no hydrogen 3.129 N/A LYS 53.A N TRP 50.A O no hydrogen 3.119 N/A LYS 53.A NZ SER 49.A O no hydrogen 3.524 N/A ILE 54.A N ALA 51.A O no hydrogen 3.169 N/A PHE 57.A N ILE 54.A O no hydrogen 2.895 N/A GLU 59.A N GLY 56.A O no hydrogen 3.069 N/A LEU 60.A N PHE 57.A O no hydrogen 3.103 N/A SER 61.A N SER 152.A OG no hydrogen 3.018 N/A ASP 64.A N SER 61.A OG no hydrogen 3.239 N/A GLN 65.A N SER 61.A O no hydrogen 3.172 N/A GLN 65.A NE2 LEU 60.A O no hydrogen 2.772 N/A GLN 65.A NE2 SER 61.A O no hydrogen 3.595 N/A VAL 66.A N LEU 62.A O no hydrogen 2.964 N/A ARG 67.A N PHE 63.A O no hydrogen 2.921 N/A LEU 68.A N ASP 64.A O no hydrogen 2.703 N/A LEU 69.A N GLN 65.A O no hydrogen 3.272 N/A GLU 70.A N VAL 66.A O no hydrogen 2.972 N/A SER 71.A N ARG 67.A O no hydrogen 3.194 N/A CYS 72.A N LEU 68.A O no hydrogen 3.142 N/A CYS 72.A SG LEU 68.A O no hydrogen 3.237 N/A TRP 73.A N LEU 69.A O no hydrogen 2.937 N/A TRP 73.A NE1 MET 224.A O no hydrogen 3.046 N/A VAL 76.A N CYS 72.A O no hydrogen 3.043 N/A LEU 77.A N TRP 73.A O no hydrogen 3.147 N/A MET 78.A N MET 74.A O no hydrogen 3.086 N/A MET 79.A N GLU 75.A O no hydrogen 2.818 N/A GLY 80.A N VAL 76.A O no hydrogen 2.994 N/A LEU 81.A N LEU 77.A O no hydrogen 2.898 N/A MET 82.A N MET 78.A O no hydrogen 2.860 N/A TRP 83.A N MET 79.A O no hydrogen 3.214 N/A ARG 84.A N GLY 80.A O no hydrogen 3.287 N/A ARG 84.A NE ILE 93.A O no hydrogen 3.135 N/A ARG 84.A NH2 PHE 94.A O no hydrogen 3.052 N/A SER 85.A N LEU 81.A O no hydrogen 3.062 N/A SER 85.A N MET 82.A O no hydrogen 3.233 N/A SER 85.A OG LEU 81.A O no hydrogen 2.740 N/A ILE 86.A N TRP 83.A O no hydrogen 3.351 N/A HIS 88.A N SER 85.A O no hydrogen 2.777 N/A LYS 91.A N HIS 88.A O no hydrogen 3.025 N/A LEU 92.A N LEU 100.A O no hydrogen 3.238 N/A ILE 93.A N SER 85.A OG no hydrogen 2.930 N/A PHE 94.A N LEU 92.A O no hydrogen 2.940 N/A ALA 95.A N LEU 98.A O no hydrogen 3.255 N/A LEU 98.A N ALA 95.A O no hydrogen 2.851 N/A LEU 100.A N LEU 92.A O no hydrogen 3.481 N/A ASP 101.A N GLU 104.A OE2 no hydrogen 2.810 N/A ARG 102.A NH1 ASP 116.A OD1 no hydrogen 3.178 N/A LYS 106.A N ASP 103.A O no hydrogen 3.387 N/A CYS 107.A SG GLU 104.A O no hydrogen 3.039 N/A ILE 111.A N VAL 108.A O no hydrogen 3.366 N/A PHE 115.A N ILE 111.A O no hydrogen 2.873 N/A ASP 116.A N LEU 112.A O no hydrogen 3.029 N/A MET 117.A N GLU 113.A O no hydrogen 3.106 N/A LEU 118.A N ILE 114.A O no hydrogen 2.958 N/A LEU 119.A N PHE 115.A O no hydrogen 2.639 N/A ALA 120.A N ASP 116.A O no hydrogen 2.921 N/A THR 121.A N MET 117.A O no hydrogen 3.122 N/A THR 121.A OG1 MET 117.A O no hydrogen 3.003 N/A THR 122.A N LEU 118.A O no hydrogen 2.937 N/A THR 122.A OG1 LEU 118.A O no hydrogen 2.755 N/A SER 123.A N LEU 119.A O no hydrogen 2.824 N/A ARG 124.A N ALA 120.A O no hydrogen 2.823 N/A PHE 125.A N THR 121.A O no hydrogen 3.001 N/A ARG 126.A N THR 122.A O no hydrogen 2.954 N/A ARG 126.A NE ILE 86.A O no hydrogen 2.811 N/A ARG 126.A NH2 SER 85.A O no hydrogen 3.271 N/A GLU 127.A N SER 123.A O no hydrogen 3.185 N/A GLU 127.A N ARG 124.A O no hydrogen 3.293 N/A LEU 128.A N PHE 125.A O no hydrogen 3.305 N/A LYS 129.A N ARG 126.A O no hydrogen 3.359 N/A LEU 130.A N PHE 125.A O no hydrogen 3.061 N/A GLN 131.A N GLU 134.A OE1 no hydrogen 2.646 N/A GLN 131.A NE2 LYS 129.A O no hydrogen 2.920 N/A TYR 135.A N GLN 131.A O no hydrogen 2.886 N/A TYR 135.A OH GLU 14.A OE2 no hydrogen 3.269 N/A LEU 136.A N HIS 132.A O no hydrogen 3.009 N/A CYS 137.A N LYS 133.A O no hydrogen 3.311 N/A CYS 137.A SG LYS 133.A O no hydrogen 3.501 N/A VAL 138.A N GLU 134.A O no hydrogen 2.939 N/A LYS 139.A N TYR 135.A O no hydrogen 2.880 N/A LYS 139.A NZ GLU 14.A OE1 no hydrogen 2.681 N/A LYS 139.A NZ GLU 14.A OE2 no hydrogen 3.457 N/A LYS 139.A NZ TYR 135.A OH no hydrogen 3.013 N/A ALA 140.A N LEU 136.A O no hydrogen 3.136 N/A MET 141.A N CYS 137.A O no hydrogen 2.741 N/A ILE 142.A N VAL 138.A O no hydrogen 2.972 N/A LEU 144.A N ALA 140.A O no hydrogen 3.062 N/A ASN 145.A N MET 141.A O no hydrogen 2.846 N/A SER 146.A OG LEU 68.A O no hydrogen 3.054 N/A SER 146.A OG LEU 143.A O no hydrogen 2.900 N/A SER 147.A OG MET 148.A O no hydrogen 3.133 N/A SER 147.A OG TYR 149.A O no hydrogen 3.523 N/A SER 152.A OG ASP 64.A OD2 no hydrogen 2.500 N/A ARG 154.A N ALA 150.A O no hydrogen 3.126 N/A LYS 155.A NZ GLU 59.A O no hydrogen 3.467 N/A LEU 156.A N SER 152.A O no hydrogen 3.123 N/A ALA 157.A N SER 153.A O no hydrogen 3.232 N/A HIS 158.A N ARG 154.A O no hydrogen 2.914 N/A LEU 159.A N LYS 155.A O no hydrogen 2.724 N/A LEU 160.A N LEU 156.A O no hydrogen 2.587 N/A ASN 161.A N ALA 157.A O no hydrogen 2.749 N/A ALA 162.A N HIS 158.A O no hydrogen 3.055 N/A VAL 163.A N LEU 159.A O no hydrogen 3.166 N/A THR 164.A N LEU 160.A O no hydrogen 2.919 N/A THR 164.A OG1 LEU 160.A O no hydrogen 2.867 N/A ASP 165.A N ASN 161.A O no hydrogen 2.861 N/A ALA 166.A N ALA 162.A O no hydrogen 3.001 N/A ALA 166.A N VAL 163.A O no hydrogen 3.010 N/A LEU 167.A N VAL 163.A O no hydrogen 2.975 N/A VAL 168.A N THR 164.A O no hydrogen 3.019 N/A TRP 169.A N ASP 165.A O no hydrogen 3.241 N/A VAL 170.A N ALA 166.A O no hydrogen 3.051 N/A ILE 171.A N LEU 167.A O no hydrogen 3.127 N/A ALA 172.A N VAL 168.A O no hydrogen 2.796 N/A LYS 173.A N TRP 169.A O no hydrogen 2.910 N/A SER 174.A N ILE 171.A O no hydrogen 3.114 N/A SER 174.A OG ILE 171.A O no hydrogen 2.735 N/A GLY 175.A N ALA 172.A O no hydrogen 3.176 N/A GLN 179.A N SER 177.A OG no hydrogen 3.125 N/A GLN 181.A N SER 177.A O no hydrogen 2.824 N/A GLN 181.A NE2 ILE 176.A O no hydrogen 2.851 N/A GLN 181.A NE2 SER 177.A O no hydrogen 3.495 N/A SER 182.A N SER 178.A O no hydrogen 3.088 N/A SER 182.A OG SER 178.A O no hydrogen 3.454 N/A MET 183.A N GLN 179.A O no hydrogen 2.961 N/A ARG 184.A N GLN 180.A O no hydrogen 2.951 N/A ARG 184.A NE GLU 134.A OE2 no hydrogen 2.712 N/A ARG 184.A NH1 LEU 128.A O no hydrogen 2.692 N/A ARG 184.A NH2 LEU 128.A O no hydrogen 2.953 N/A ARG 184.A NH2 LYS 129.A O no hydrogen 3.295 N/A ARG 184.A NH2 GLU 134.A OE1 no hydrogen 2.672 N/A ARG 184.A NH2 GLU 134.A OE2 no hydrogen 3.194 N/A LEU 185.A N GLN 181.A O no hydrogen 3.105 N/A ALA 186.A N SER 182.A O no hydrogen 3.112 N/A ASN 187.A N MET 183.A O no hydrogen 2.990 N/A LEU 188.A N ARG 184.A O no hydrogen 2.958 N/A LEU 189.A N LEU 185.A O no hydrogen 2.930 N/A MET 190.A N ALA 186.A O no hydrogen 2.805 N/A LEU 191.A N LEU 188.A O no hydrogen 3.335 N/A LEU 192.A N LEU 189.A O no hydrogen 3.001 N/A SER 193.A N MET 190.A O no hydrogen 3.316 N/A VAL 195.A N LEU 191.A O no hydrogen 3.025 N/A ARG 196.A N LEU 192.A O no hydrogen 2.996 N/A ARG 196.A NH2 SER 146.A O no hydrogen 2.984 N/A HIS 197.A N SER 193.A O no hydrogen 2.986 N/A ALA 198.A N HIS 194.A O no hydrogen 3.043 N/A SER 199.A N VAL 195.A O no hydrogen 3.014 N/A ASN 200.A N ARG 196.A O no hydrogen 3.039 N/A LYS 201.A N HIS 197.A O no hydrogen 3.187 N/A GLY 202.A N ALA 198.A O no hydrogen 2.778 N/A MET 203.A N SER 199.A O no hydrogen 3.018 N/A GLU 204.A N ASN 200.A O no hydrogen 3.177 N/A HIS 205.A N LYS 201.A O no hydrogen 3.058 N/A HIS 205.A NE2 GLU 109.A O no hydrogen 2.798 N/A LEU 206.A N GLY 202.A O no hydrogen 2.825 N/A LEU 207.A N MET 203.A O no hydrogen 2.659 N/A ASN 208.A N GLU 204.A O no hydrogen 3.052 N/A MET 209.A N HIS 205.A O no hydrogen 3.080 N/A LYS 210.A N LEU 206.A O no hydrogen 2.847 N/A LYS 210.A NZ ASN 226.A OD1 no hydrogen 3.144 N/A CYS 211.A N LEU 207.A O no hydrogen 3.110 N/A CYS 211.A SG LEU 207.A O no hydrogen 3.395 N/A LYS 212.A N ASN 208.A O no hydrogen 3.273 N/A LYS 212.A N MET 209.A O no hydrogen 3.006 N/A ASN 213.A N LYS 210.A O no hydrogen 2.768 N/A VAL 214.A N MET 209.A O no hydrogen 3.518 N/A VAL 217.A N VAL 215.A O no hydrogen 2.679 N/A LEU 221.A N ASP 41.A OD1 no hydrogen 3.128 N/A LEU 222.A N TYR 218.A O no hydrogen 2.758 N/A GLU 223.A N ASP 219.A O no hydrogen 3.176 N/A MET 224.A N LEU 220.A O no hydrogen 3.137 N/A LEU 225.A N LEU 221.A O no hydrogen 2.946 N/A ASN 226.A N LEU 222.A O no hydrogen 2.918 N/A ALA 227.A N GLU 223.A O no hydrogen 2.985 N/A