Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iao_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N GLU 3.A OE2 no hydrogen 3.230 N/A TYR 6.A N TYR 45.A O no hydrogen 2.935 N/A TYR 6.A OH ASP 47.A OD1 no hydrogen 2.468 N/A SER 7.A N GLU 10.A OE1 no hydrogen 2.798 N/A GLU 10.A N SER 7.A O no hydrogen 2.732 N/A GLU 10.A N SER 7.A OG no hydrogen 3.121 N/A VAL 11.A N SER 7.A O no hydrogen 3.038 N/A SER 12.A N ILE 8.A O no hydrogen 3.228 N/A SER 12.A OG VAL 17.A O no hydrogen 2.338 N/A LEU 14.A N GLU 10.A O no hydrogen 3.307 N/A ALA 15.A N VAL 11.A O no hydrogen 2.904 N/A ALA 21.A N SER 18.A O no hydrogen 2.968 N/A ALA 21.A N SER 18.A OG no hydrogen 3.018 N/A LEU 22.A N SER 18.A O no hydrogen 3.035 N/A TYR 24.A N LYS 20.A O no hydrogen 3.235 N/A TYR 25.A N ALA 21.A O no hydrogen 3.007 N/A ASP 26.A N LEU 22.A O no hydrogen 3.003 N/A LYS 27.A N ARG 23.A O no hydrogen 2.678 N/A ILE 28.A N TYR 24.A O no hydrogen 3.076 N/A ASP 29.A N ASP 26.A O no hydrogen 3.004 N/A LEU 30.A N TYR 25.A O no hydrogen 2.724 N/A PHE 31.A N TYR 25.A O no hydrogen 3.085 N/A LYS 32.A NZ ASP 26.A O no hydrogen 3.286 N/A LYS 32.A NZ ASP 29.A OD1 no hydrogen 2.467 N/A ALA 34.A N GLN 49.A OE1 no hydrogen 2.682 N/A TYR 35.A N TYR 44.A O no hydrogen 3.036 N/A ASP 37.A N TYR 42.A O no hydrogen 3.158 N/A ASP 39.A N ASP 37.A OD2 no hydrogen 2.893 N/A THR 40.A N ASP 37.A OD2 no hydrogen 2.912 N/A SER 41.A N ASP 37.A O no hydrogen 2.665 N/A ARG 43.A NH1 ASP 26.A OD2 no hydrogen 3.001 N/A TYR 44.A N TYR 35.A O no hydrogen 2.859 N/A TYR 45.A N TYR 6.A O no hydrogen 2.685 N/A THR 46.A N GLN 49.A OE1 no hydrogen 2.796 N/A ASP 47.A N SER 4.A O no hydrogen 2.906 N/A SER 48.A OG GLU 3.A OE1 no hydrogen 2.378 N/A SER 48.A OG GLU 3.A OE2 no hydrogen 2.944 N/A GLN 49.A NE2 LYS 32.A O no hydrogen 2.950 N/A LEU 50.A N ASP 47.A O no hydrogen 3.459 N/A HIS 52.A N GLN 49.A O no hydrogen 3.120 N/A LEU 53.A N LEU 50.A O no hydrogen 2.633 N/A ASP 54.A N ILE 51.A O no hydrogen 3.056 N/A LYS 57.A N LEU 53.A O no hydrogen 2.803 N/A SER 58.A N ASP 54.A O no hydrogen 3.109 N/A SER 58.A OG ASP 54.A O no hydrogen 2.904 N/A LEU 59.A N LEU 55.A O no hydrogen 2.907 N/A LYS 60.A N ILE 56.A O no hydrogen 2.975 N/A TYR 61.A N LYS 57.A O no hydrogen 3.150 N/A ILE 62.A N SER 58.A O no hydrogen 3.171 N/A GLY 63.A N LYS 60.A O no hydrogen 2.576 N/A THR 64.A N LEU 59.A O no hydrogen 2.897 N/A THR 64.A OG1 LEU 59.A O no hydrogen 2.795 N/A GLU 68.A N PRO 65.A O no hydrogen 3.074 N/A MET 69.A N PRO 65.A O no hydrogen 3.092 N/A MET 69.A N LEU 66.A O no hydrogen 2.649 N/A LYS 70.A N LEU 66.A O no hydrogen 2.990 N/A LYS 70.A NZ ASP 29.A O no hydrogen 3.452 N/A ALA 72.A N GLU 68.A O no hydrogen 2.980 N/A GLN 73.A N MET 69.A O no hydrogen 3.200 N/A GLN 73.A NE2 LEU 30.A O no hydrogen 3.088 N/A ASP 74.A N LYS 71.A O no hydrogen 3.279 N/A LEU 75.A N ALA 72.A O no hydrogen 3.088 N/A LEU 80.A N GLU 76.A O no hydrogen 2.939 N/A PHE 81.A N MET 77.A O no hydrogen 3.038 N/A PHE 81.A N GLU 78.A O no hydrogen 2.798 N/A ALA 82.A N GLU 78.A O no hydrogen 3.272 N/A PHE 83.A N GLU 79.A O no hydrogen 2.912 N/A TYR 84.A N LEU 80.A O no hydrogen 3.381 N/A TYR 84.A N PHE 81.A O no hydrogen 3.186 N/A THR 85.A N PHE 81.A O no hydrogen 3.319 N/A THR 85.A OG1 PHE 81.A O no hydrogen 3.207 N/A GLU 86.A N ALA 82.A O no hydrogen 3.203 N/A GLU 86.A N PHE 83.A O no hydrogen 3.177 N/A GLN 87.A N TYR 84.A O no hydrogen 2.469 N/A GLU 88.A N TYR 84.A O no hydrogen 2.654 N/A ARG 89.A NE GLU 86.A OE1 no hydrogen 3.047 N/A ARG 89.A NH2 GLU 86.A OE1 no hydrogen 3.394 N/A ARG 89.A NH2 GLU 86.A OE2 no hydrogen 2.815 N/A GLN 90.A NE2 GLU 86.A OE2 no hydrogen 3.431 N/A ILE 91.A N GLN 87.A O no hydrogen 2.849 N/A LYS 94.A N GLN 90.A O no hydrogen 3.488 N/A LEU 95.A N ILE 91.A O no hydrogen 2.703 N/A ASP 96.A N ARG 92.A O no hydrogen 2.573 N/A PHE 97.A N GLU 93.A O no hydrogen 2.918 N/A LEU 98.A N LYS 94.A O no hydrogen 3.271 N/A SER 99.A N LEU 95.A O no hydrogen 2.871 N/A ALA 100.A N PHE 97.A O no hydrogen 2.702 N/A LEU 101.A N PHE 97.A O no hydrogen 2.761 N/A GLU 102.A N LEU 98.A O no hydrogen 3.080 N/A GLN 103.A N SER 99.A O no hydrogen 3.432 N/A THR 104.A N ALA 100.A O no hydrogen 3.086 N/A THR 104.A OG1 LEU 101.A O no hydrogen 3.112 N/A ILE 105.A N GLU 102.A O no hydrogen 3.161 N/A SER 106.A N GLU 102.A O no hydrogen 3.010 N/A SER 106.A OG GLN 103.A O no hydrogen 2.985 N/A LEU 107.A N GLN 103.A O no hydrogen 2.718 N/A LYS 109.A N ILE 105.A O no hydrogen 3.140 N/A LYS 110.A N SER 106.A O no hydrogen 2.969 N/A MET 112.A N VAL 108.A O no hydrogen 3.371 N/A LYS 113.A N LYS 109.A O no hydrogen 2.719 N/A ARG 114.A N LYS 110.A O no hydrogen 3.185 N/A ARG 114.A NH2 GLU 267.A OE2 no hydrogen 2.831 N/A GLN 115.A N ARG 111.A O no hydrogen 3.318 N/A MET 116.A N MET 112.A O no hydrogen 3.065 N/A GLU 117.A N LYS 113.A O no hydrogen 2.807 N/A TYR 118.A N GLN 115.A O no hydrogen 3.268 N/A PHE 125.A N CYS 215.A O no hydrogen 2.992 N/A LEU 127.A N TYR 213.A O no hydrogen 3.078 N/A GLU 129.A N GLY 211.A O no hydrogen 3.347 N/A ILE 132.A N ILE 208.A O no hydrogen 3.346 N/A ILE 134.A N THR 206.A O no hydrogen 2.880 N/A ILE 135.A N THR 192.A O no hydrogen 3.124 N/A GLN 136.A N GLU 204.A O no hydrogen 2.673 N/A THR 137.A N ILE 190.A O no hydrogen 3.065 N/A THR 137.A OG1 ASP 202.A O no hydrogen 3.154 N/A ALA 139.A N ARG 188.A O no hydrogen 3.127 N/A ASN 146.A N GLY 143.A O no hydrogen 2.943 N/A VAL 147.A N GLY 143.A O no hydrogen 3.232 N/A LEU 148.A N SER 151.A OG no hydrogen 2.971 N/A SER 151.A N LEU 148.A O no hydrogen 3.129 N/A SER 151.A OG LEU 148.A O no hydrogen 3.102 N/A TYR 152.A N ASN 149.A O no hydrogen 3.135 N/A TYR 152.A OH GLY 171.A O no hydrogen 2.664 N/A SER 153.A N ALA 150.A O no hydrogen 3.283 N/A SER 153.A OG ALA 150.A O no hydrogen 2.968 N/A LYS 154.A NZ ASP 202.A OD1 no hydrogen 2.906 N/A LYS 156.A N TYR 152.A O no hydrogen 3.289 N/A LYS 156.A N SER 153.A O no hydrogen 2.631 N/A LYS 157.A N SER 153.A O no hydrogen 3.016 N/A GLU 160.A N LYS 156.A O no hydrogen 3.279 N/A SER 161.A OG PHE 158.A O no hydrogen 2.992 N/A ALA 162.A N ILE 159.A O no hydrogen 3.374 N/A ASP 163.A N ILE 159.A O no hydrogen 2.575 N/A GLY 164.A N GLU 160.A O no hydrogen 2.398 N/A ASN 167.A ND2 SER 169.A O no hydrogen 2.558 N/A TYR 170.A N ILE 251.A O no hydrogen 3.013 N/A GLY 171.A N PHE 191.A O no hydrogen 2.698 N/A ALA 172.A N GLN 249.A O no hydrogen 2.949 N/A THR 173.A N HIS 189.A O no hydrogen 3.165 N/A THR 173.A OG1 ASP 246.A OD2 no hydrogen 3.332 N/A PHE 174.A N VAL 247.A O no hydrogen 3.121 N/A TYR 179.A OH SER 175.A O no hydrogen 2.373 N/A THR 180.A N GLU 184.A OE2 no hydrogen 2.853 N/A THR 180.A OG1 GLU 184.A OE2 no hydrogen 2.429 N/A SER 181.A N GLU 184.A OE2 no hydrogen 3.313 N/A SER 181.A OG ASP 183.A OD2 no hydrogen 3.269 N/A GLU 184.A N SER 181.A O no hydrogen 3.141 N/A MET 185.A N ILE 182.A O no hydrogen 3.236 N/A TYR 187.A N ILE 142.A O no hydrogen 3.176 N/A ARG 188.A N THR 173.A O no hydrogen 2.932 N/A ARG 188.A NH1 ASP 246.A OD2 no hydrogen 2.509 N/A ILE 190.A N THR 137.A O no hydrogen 3.019 N/A PHE 191.A N GLY 171.A O no hydrogen 3.138 N/A THR 192.A N ILE 135.A O no hydrogen 3.205 N/A VAL 194.A N ARG 133.A O no hydrogen 3.106 N/A LEU 195.A N ASP 163.A OD2 no hydrogen 3.192 N/A THR 196.A OG1 ASP 163.A OD1 no hydrogen 3.239 N/A THR 196.A OG1 THR 196.A O no hydrogen 2.386 N/A THR 200.A OG1 ASP 202.A OD2 no hydrogen 2.967 N/A MET 203.A N THR 200.A O no hydrogen 3.094 N/A GLU 204.A N GLN 136.A O no hydrogen 2.892 N/A THR 206.A N ILE 134.A O no hydrogen 2.849 N/A ILE 208.A N ILE 132.A O no hydrogen 3.282 N/A LYS 210.A NZ GLU 130.A OE1 no hydrogen 2.682 N/A TYR 213.A N LEU 127.A O no hydrogen 3.027 N/A TYR 213.A OH PRO 209.A O no hydrogen 2.425 N/A ALA 214.A N ILE 270.A O no hydrogen 3.086 N/A CYS 215.A N PHE 125.A O no hydrogen 2.854 N/A ILE 216.A N MET 268.A O no hydrogen 3.315 N/A TYR 218.A N VAL 266.A O no hydrogen 3.136 N/A PHE 220.A N TYR 264.A O no hydrogen 2.972 N/A SER 221.A OG PHE 220.A O no hydrogen 2.800 N/A HIS 224.A N SER 221.A O no hydrogen 3.221 N/A ASN 228.A N HIS 224.A O no hydrogen 2.757 N/A ASN 228.A ND2 HIS 224.A O no hydrogen 2.756 N/A LEU 229.A N TYR 225.A O no hydrogen 3.055 N/A GLN 230.A N PHE 226.A O no hydrogen 3.013 N/A GLN 230.A NE2 TYR 179.A O no hydrogen 3.430 N/A LYS 231.A N LEU 227.A O no hydrogen 3.085 N/A LYS 231.A NZ GLY 122.A O no hydrogen 3.423 N/A LEU 232.A N LEU 229.A O no hydrogen 2.585 N/A ILE 233.A N LEU 229.A O no hydrogen 3.013 N/A LYS 234.A N GLN 230.A O no hydrogen 2.694 N/A TYR 235.A N LYS 231.A O no hydrogen 3.210 N/A ILE 236.A N LEU 232.A O no hydrogen 2.846 N/A ALA 237.A N ILE 233.A O no hydrogen 2.708 N/A ASP 238.A N LYS 234.A O no hydrogen 2.626 N/A ARG 239.A N ILE 236.A O no hydrogen 3.291 N/A GLN 240.A N ALA 237.A O no hydrogen 2.760 N/A LEU 241.A N ILE 236.A O no hydrogen 3.113 N/A THR 242.A OG1 ALA 273.A O no hydrogen 3.364 N/A VAL 244.A N GLU 271.A O no hydrogen 2.705 N/A SER 245.A OG ASP 246.A O no hydrogen 2.530 N/A VAL 247.A N PHE 174.A O no hydrogen 2.600 N/A TYR 248.A N LYS 269.A O no hydrogen 2.709 N/A GLN 249.A N ALA 172.A O no hydrogen 2.733 N/A GLN 249.A NE2 TYR 225.A OH no hydrogen 2.180 N/A LEU 250.A N GLU 267.A O no hydrogen 2.932 N/A ILE 251.A N TYR 170.A O no hydrogen 3.063 N/A ILE 252.A N ARG 265.A O no hydrogen 2.961 N/A ILE 254.A N GLU 263.A O no hydrogen 2.705 N/A HIS 255.A NE2 GLN 261.A O no hydrogen 2.565 N/A SER 257.A N HIS 255.A ND1 no hydrogen 2.953 N/A LYS 260.A N SER 257.A OG no hydrogen 3.035 N/A ARG 265.A N ILE 252.A O no hydrogen 2.686 N/A ARG 265.A NE GLN 115.A OE1 no hydrogen 2.968 N/A ARG 265.A NH1 ASN 219.A OD1 no hydrogen 2.804 N/A ARG 265.A NH2 GLN 115.A OE1 no hydrogen 3.255 N/A VAL 266.A N TYR 218.A O no hydrogen 2.984 N/A GLU 267.A N LEU 250.A O no hydrogen 3.225 N/A MET 268.A N ILE 216.A O no hydrogen 3.112 N/A LYS 269.A N TYR 248.A O no hydrogen 2.849 N/A LYS 269.A NZ GLU 267.A OE1 no hydrogen 2.791 N/A LYS 269.A NZ GLU 267.A OE2 no hydrogen 2.919 N/A GLU 271.A N SER 245.A OG no hydrogen 2.900 N/A ILE 272.A N ARG 212.A O no hydrogen 3.062 N/A ALA 273.A N THR 242.A O no hydrogen 2.704 N/A