Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4iaa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE1 no hydrogen 2.760 N/A SER 4.A OG PRO 1.A O no hydrogen 2.806 N/A GLN 5.A N PRO 1.A O no hydrogen 3.391 N/A TYR 6.A N LEU 2.A O no hydrogen 3.384 N/A GLN 7.A N ILE 24.A O no hydrogen 2.795 N/A GLY 9.A N SER 22.A O no hydrogen 2.966 N/A LEU 12.A N VAL 20.A O no hydrogen 2.882 N/A GLY 15.A N GLY 18.A O no hydrogen 3.172 N/A SER 19.A N HIS 36.A O no hydrogen 3.221 N/A VAL 20.A N GLY 13.A O no hydrogen 3.056 N/A TYR 21.A N ILE 34.A O no hydrogen 2.807 N/A SER 22.A N PRO 10.A O no hydrogen 2.946 N/A ILE 24.A N GLN 7.A O no hydrogen 3.157 N/A ARG 25.A N LEU 30.A O no hydrogen 2.916 N/A ARG 25.A NE ASP 28.A OD1 no hydrogen 2.775 N/A ARG 25.A NH2 ASP 28.A OD2 no hydrogen 2.353 N/A VAL 26.A N GLN 5.A O no hydrogen 3.314 N/A ASN 29.A N ARG 25.A O no hydrogen 2.479 N/A VAL 32.A N GLY 23.A O no hydrogen 2.851 N/A ALA 33.A N LEU 88.A O no hydrogen 2.768 N/A ILE 34.A N TYR 21.A O no hydrogen 2.853 N/A LYS 35.A N LEU 86.A O no hydrogen 2.881 N/A LYS 35.A NZ GLU 57.A OE1 no hydrogen 3.564 N/A LYS 35.A NZ GLU 57.A OE2 no hydrogen 2.426 N/A HIS 36.A N SER 19.A O no hydrogen 3.027 N/A VAL 37.A N PHE 84.A O no hydrogen 2.808 N/A LYS 39.A N ASP 82.A O no hydrogen 2.454 N/A LYS 39.A NZ GLU 79.A OE2 no hydrogen 2.916 N/A LYS 39.A NZ ARG 80.A O no hydrogen 2.724 N/A LYS 39.A NZ PRO 81.A O no hydrogen 3.210 N/A ILE 42.A N LYS 39.A O no hydrogen 2.954 N/A GLY 46.A N VAL 54.A O no hydrogen 2.777 N/A LEU 48.A N THR 52.A O no hydrogen 3.184 N/A GLY 51.A N LEU 48.A O no hydrogen 2.585 N/A VAL 54.A N GLY 46.A O no hydrogen 3.126 N/A MET 56.A N ASP 44.A O no hydrogen 2.924 N/A VAL 58.A N PRO 55.A O no hydrogen 2.961 N/A VAL 59.A N PRO 55.A O no hydrogen 3.365 N/A LEU 60.A N MET 56.A O no hydrogen 2.910 N/A LEU 61.A N GLU 57.A O no hydrogen 2.858 N/A LYS 62.A N VAL 58.A O no hydrogen 3.010 N/A LYS 62.A N VAL 59.A O no hydrogen 3.032 N/A LYS 63.A N VAL 59.A O no hydrogen 3.126 N/A VAL 64.A N LEU 60.A O no hydrogen 3.249 N/A VAL 64.A N LEU 61.A O no hydrogen 3.293 N/A SER 65.A OG LEU 61.A O no hydrogen 2.462 N/A SER 69.A OG VAL 64.A O no hydrogen 3.518 N/A SER 69.A OG GLY 67.A O no hydrogen 3.354 N/A ILE 72.A N LEU 152.A O no hydrogen 3.326 N/A ARG 73.A N GLU 89.A OE1 no hydrogen 2.975 N/A ARG 73.A NE GLY 67.A O no hydrogen 2.880 N/A LEU 74.A N SER 65.A OG no hydrogen 3.022 N/A LEU 75.A N ILE 87.A O no hydrogen 3.066 N/A PHE 78.A N VAL 85.A O no hydrogen 2.712 N/A ARG 80.A N SER 83.A O no hydrogen 3.000 N/A PHE 84.A N VAL 37.A O no hydrogen 2.645 N/A VAL 85.A N PHE 78.A O no hydrogen 2.906 N/A LEU 86.A N LYS 35.A O no hydrogen 3.037 N/A ILE 87.A N ASP 76.A O no hydrogen 2.813 N/A LEU 88.A N ALA 33.A O no hydrogen 2.756 N/A GLU 89.A N ARG 73.A O no hydrogen 3.264 N/A ARG 90.A NE VAL 32.A O no hydrogen 2.786 N/A ARG 90.A NH1 GLU 92.A OE1 no hydrogen 3.110 N/A ARG 90.A NH2 GLY 23.A O no hydrogen 2.942 N/A GLN 95.A N ILE 143.A O no hydrogen 3.025 N/A GLN 95.A NE2 GLU 103.A OE2 no hydrogen 3.482 N/A LEU 97.A N ASP 138.A O no hydrogen 3.239 N/A LEU 97.A N ILE 141.A O no hydrogen 2.955 N/A ASP 99.A N ASP 96.A OD1 no hydrogen 2.733 N/A PHE 100.A N ASP 96.A O no hydrogen 3.156 N/A ILE 101.A N LEU 97.A O no hydrogen 2.925 N/A THR 102.A N PHE 98.A O no hydrogen 2.814 N/A THR 102.A OG1 PHE 98.A O no hydrogen 2.935 N/A GLU 103.A N ASP 99.A O no hydrogen 2.746 N/A ARG 104.A N PHE 100.A O no hydrogen 2.794 N/A GLY 105.A N ILE 101.A O no hydrogen 2.825 N/A LEU 107.A N MET 203.A O no hydrogen 3.089 N/A LEU 111.A N GLN 108.A O no hydrogen 2.942 N/A ALA 112.A N GLN 108.A O no hydrogen 2.935 N/A ARG 113.A N GLU 109.A O no hydrogen 2.724 N/A ARG 113.A NE TRP 256.A O no hydrogen 2.641 N/A SER 114.A N GLU 110.A O no hydrogen 3.297 N/A SER 114.A OG THR 266.A OG1 no hydrogen 2.780 N/A PHE 115.A N LEU 111.A O no hydrogen 3.094 N/A PHE 116.A N ALA 112.A O no hydrogen 2.718 N/A TRP 117.A N ARG 113.A O no hydrogen 3.003 N/A GLN 118.A N SER 114.A O no hydrogen 3.130 N/A VAL 119.A N PHE 115.A O no hydrogen 2.964 N/A LEU 120.A N PHE 116.A O no hydrogen 2.926 N/A GLU 121.A N TRP 117.A O no hydrogen 2.813 N/A ALA 122.A N GLN 118.A O no hydrogen 2.972 N/A VAL 123.A N VAL 119.A O no hydrogen 2.773 N/A ARG 124.A N LEU 120.A O no hydrogen 2.879 N/A ARG 124.A NH1 GLN 252.A OE1 no hydrogen 3.004 N/A HIS 125.A N GLU 121.A O no hydrogen 2.955 N/A CYS 126.A N ALA 122.A O no hydrogen 3.195 N/A CYS 126.A SG ALA 122.A O no hydrogen 3.562 N/A HIS 127.A N VAL 123.A O no hydrogen 2.944 N/A ASN 128.A N ARG 124.A O no hydrogen 2.875 N/A CYS 129.A N HIS 125.A O no hydrogen 2.915 N/A CYS 129.A SG LYS 63.A O no hydrogen 3.387 N/A CYS 129.A SG HIS 125.A NE2 no hydrogen 3.453 N/A CYS 129.A SG HIS 125.A O no hydrogen 3.306 N/A GLY 130.A N HIS 127.A O no hydrogen 3.061 N/A VAL 131.A N CYS 126.A O no hydrogen 2.949 N/A LEU 132.A N ALA 159.A O no hydrogen 2.824 N/A HIS 133.A NE2 ILE 153.A O no hydrogen 2.372 N/A ARG 134.A NH1 ASP 168.A OD1 no hydrogen 3.211 N/A ARG 134.A NH1 ASP 168.A OD2 no hydrogen 3.397 N/A ARG 134.A NH1 TYR 186.A OH no hydrogen 2.925 N/A ARG 134.A NH2 ASP 168.A OD2 no hydrogen 3.071 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 2.978 N/A LYS 137.A NZ THR 172.A OG1 no hydrogen 2.972 N/A GLU 139.A N ASP 138.A OD1 no hydrogen 2.707 N/A ASN 140.A N LYS 137.A O no hydrogen 3.128 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.906 N/A ILE 141.A N ASP 138.A O no hydrogen 3.089 N/A LEU 142.A N LYS 151.A O no hydrogen 2.858 N/A ILE 143.A N GLN 95.A O no hydrogen 2.865 N/A ASP 144.A N GLU 149.A O no hydrogen 2.869 N/A LEU 145.A N PRO 93.A O no hydrogen 3.189 N/A ASN 146.A N ASP 144.A OD1 no hydrogen 3.018 N/A ARG 147.A N ASP 144.A OD1 no hydrogen 3.301 N/A GLY 148.A N ASP 144.A O no hydrogen 2.955 N/A LYS 151.A N LEU 142.A O no hydrogen 2.779 N/A LYS 151.A NZ SER 69.A O no hydrogen 2.557 N/A ILE 153.A N ASN 140.A O no hydrogen 2.866 N/A GLY 156.A N ASP 154.A OD2 no hydrogen 3.134 N/A SER 157.A OG ASP 170.A O no hydrogen 3.212 N/A ALA 159.A N LEU 132.A O no hydrogen 3.090 N/A LEU 161.A N GLY 130.A O no hydrogen 2.637 N/A LYS 162.A NZ VAL 165.A O no hydrogen 3.237 N/A TYR 166.A N TYR 186.A O no hydrogen 2.797 N/A TYR 166.A OH LEU 160.A O no hydrogen 2.621 N/A THR 172.A OG1 ASP 135.A OD1 no hydrogen 2.479 N/A ARG 173.A NE ASP 213.A OD1 no hydrogen 3.059 N/A ARG 173.A NH2 ASP 213.A OD2 no hydrogen 2.655 N/A TYR 175.A N THR 172.A O no hydrogen 3.003 N/A SER 176.A N ARG 173.A O no hydrogen 2.681 N/A SER 176.A OG ARG 173.A O no hydrogen 2.514 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.894 N/A TRP 180.A N PRO 177.A O no hydrogen 2.839 N/A ILE 181.A N PRO 177.A O no hydrogen 3.256 N/A ARG 182.A N PRO 178.A O no hydrogen 2.891 N/A ARG 182.A NE TYR 183.A OH no hydrogen 3.250 N/A TYR 183.A N GLU 179.A O no hydrogen 2.976 N/A HIS 184.A N TRP 180.A O no hydrogen 2.907 N/A TYR 186.A N TYR 166.A O no hydrogen 3.193 N/A TYR 186.A OH ASP 168.A O no hydrogen 2.668 N/A ARG 189.A NH1 ASP 163.A OD1 no hydrogen 3.142 N/A SER 190.A OG HIS 187.A O no hydrogen 3.072 N/A ALA 191.A N HIS 187.A O no hydrogen 2.951 N/A ALA 192.A N GLY 188.A O no hydrogen 2.736 N/A VAL 193.A N ARG 189.A O no hydrogen 2.776 N/A TRP 194.A N SER 190.A O no hydrogen 3.114 N/A SER 195.A N ALA 191.A O no hydrogen 3.004 N/A SER 195.A OG ALA 192.A O no hydrogen 2.736 N/A LEU 196.A N ALA 192.A O no hydrogen 2.897 N/A GLY 197.A N VAL 193.A O no hydrogen 2.751 N/A ILE 198.A N TRP 194.A O no hydrogen 2.851 N/A LEU 199.A N SER 195.A O no hydrogen 2.738 N/A LEU 200.A N LEU 196.A O no hydrogen 2.739 N/A TYR 201.A N GLY 197.A O no hydrogen 3.299 N/A TYR 201.A N ILE 198.A O no hydrogen 3.146 N/A TYR 201.A OH PHE 222.A O no hydrogen 2.456 N/A ASP 202.A N ILE 198.A O no hydrogen 2.995 N/A MET 203.A N LEU 199.A O no hydrogen 3.080 N/A VAL 204.A N LEU 200.A O no hydrogen 3.180 N/A CYS 205.A N TYR 201.A O no hydrogen 2.776 N/A GLY 206.A N ASP 202.A O no hydrogen 2.747 N/A ILE 208.A N ASP 207.A OD1 no hydrogen 2.930 N/A ILE 216.A N HIS 212.A O no hydrogen 3.126 N/A ILE 217.A N ASP 213.A O no hydrogen 2.872 N/A ARG 218.A N GLU 214.A O no hydrogen 2.948 N/A GLY 219.A N GLU 215.A O no hydrogen 3.057 N/A GLY 219.A N ILE 216.A O no hydrogen 2.819 N/A ARG 224.A NE TYR 201.A OH no hydrogen 3.538 N/A ARG 224.A NH2 TYR 201.A OH no hydrogen 3.569 N/A SER 228.A N GLU 109.A OE2 no hydrogen 2.895 N/A SER 228.A OG GLU 109.A OE1 no hydrogen 2.945 N/A CYS 230.A N SER 228.A O no hydrogen 2.893 N/A CYS 230.A N SER 228.A OG no hydrogen 2.981 N/A GLN 231.A N SER 228.A O no hydrogen 3.192 N/A GLN 231.A NE2 VAL 227.A O no hydrogen 3.228 N/A HIS 232.A ND1 HIS 254.A NE2 no hydrogen 3.183 N/A LEU 233.A N GLU 229.A O no hydrogen 3.425 N/A ILE 234.A N CYS 230.A O no hydrogen 2.900 N/A ARG 235.A N GLN 231.A O no hydrogen 2.909 N/A ARG 235.A NH1 GLN 231.A OE1 no hydrogen 2.736 N/A ARG 235.A NH2 VAL 221.A O no hydrogen 2.701 N/A TRP 236.A N HIS 232.A O no hydrogen 2.869 N/A CYS 237.A N LEU 233.A O no hydrogen 2.980 N/A CYS 237.A SG LEU 233.A O no hydrogen 3.567 N/A LEU 238.A N ILE 234.A O no hydrogen 2.986 N/A LEU 238.A N ARG 235.A O no hydrogen 3.090 N/A ALA 239.A N TRP 236.A O no hydrogen 3.298 N/A ARG 241.A NH1 ASP 244.A OD2 no hydrogen 3.268 N/A ASP 244.A N ARG 241.A O no hydrogen 2.840 N/A ARG 245.A N PRO 242.A O no hydrogen 3.049 N/A ARG 245.A NE ALA 239.A O no hydrogen 2.670 N/A ARG 245.A NH1 GLU 179.A OE1 no hydrogen 3.404 N/A ARG 245.A NH1 GLU 179.A OE2 no hydrogen 2.756 N/A ARG 245.A NH1 SER 190.A O no hydrogen 3.063 N/A ARG 245.A NH2 GLU 179.A OE1 no hydrogen 2.606 N/A ARG 245.A NH2 GLU 179.A OE2 no hydrogen 3.565 N/A ARG 245.A NH2 ALA 239.A O no hydrogen 3.122 N/A THR 247.A N GLU 250.A OE1 no hydrogen 3.095 N/A ILE 251.A N THR 247.A O no hydrogen 2.835 N/A GLN 252.A N PHE 248.A O no hydrogen 2.663 N/A GLN 252.A NE2 GLU 121.A OE2 no hydrogen 2.807 N/A ASN 253.A N GLU 249.A O no hydrogen 2.692 N/A HIS 254.A N ILE 251.A O no hydrogen 3.183 N/A HIS 254.A NE2 HIS 232.A ND1 no hydrogen 3.183 N/A TRP 256.A N HIS 254.A ND1 no hydrogen 3.027 N/A TRP 256.A NE1 GLU 109.A OE1 no hydrogen 2.967 N/A MET 257.A N HIS 254.A O no hydrogen 2.896 N/A GLN 258.A N PRO 255.A O no hydrogen 3.264 N/A GLN 258.A NE2 GLN 252.A O no hydrogen 3.400 N/A GLN 258.A NE2 HIS 254.A O no hydrogen 3.366 N/A THR 266.A N LEU 262.A O no hydrogen 3.066 N/A THR 266.A OG1 SER 114.A OG no hydrogen 2.780 N/A THR 266.A OG1 LEU 262.A O no hydrogen 2.672 N/A ALA 267.A N PRO 263.A O no hydrogen 3.215 N/A GLU 268.A N GLN 264.A O no hydrogen 3.150 N/A ILE 269.A N GLU 265.A O no hydrogen 3.248 N/A HIS 270.A N THR 266.A O no hydrogen 2.887 N/A HIS 270.A NE2 GLU 110.A OE1 no hydrogen 2.840 N/A LEU 271.A N ALA 267.A O no hydrogen 2.726 N/A HIS 272.A N ALA 267.A O no hydrogen 2.926 N/A