Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ci7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N ALA 2.A O no hydrogen 3.253 N/A TYR 7.A N GLU 3.A O no hydrogen 3.279 N/A TYR 7.A OH MET 198.A O no hydrogen 2.720 N/A LEU 8.A N GLU 4.A O no hydrogen 2.773 N/A ASN 9.A N GLN 5.A O no hydrogen 2.855 N/A LEU 10.A N GLN 6.A O no hydrogen 3.098 N/A VAL 11.A N TYR 7.A O no hydrogen 2.918 N/A GLN 12.A N LEU 8.A O no hydrogen 2.960 N/A TYR 13.A N ASN 9.A O no hydrogen 2.606 N/A ILE 14.A N LEU 10.A O no hydrogen 3.080 N/A ILE 15.A N VAL 11.A O no hydrogen 3.331 N/A ASN 16.A N GLN 12.A O no hydrogen 2.856 N/A HIS 17.A N TYR 13.A O no hydrogen 2.665 N/A ARG 21.A N THR 29.A O no hydrogen 2.901 N/A ARG 21.A NE GLU 19.A OE1 no hydrogen 3.545 N/A THR 25.A OG1 ASP 23.A OD1 no hydrogen 2.242 N/A THR 25.A OG1 SER 291.A OG no hydrogen 2.356 N/A GLY 26.A N ASP 23.A O no hydrogen 2.745 N/A GLY 26.A N ASP 23.A OD1 no hydrogen 2.932 N/A THR 29.A N ARG 21.A O no hydrogen 3.229 N/A LEU 30.A N ILE 236.A O no hydrogen 2.793 N/A SER 31.A N GLU 19.A O no hydrogen 2.955 N/A VAL 32.A N CYS 234.A O no hydrogen 2.652 N/A ALA 34.A N GLY 232.A O no hydrogen 3.022 N/A LEU 38.A N HIS 229.A O no hydrogen 3.013 N/A LYS 39.A NZ ASP 226.A OD1 no hydrogen 2.953 N/A PHE 40.A N PHE 227.A O no hydrogen 2.693 N/A SER 41.A N GLU 3.A OE2 no hydrogen 2.970 N/A LEU 42.A N GLY 225.A O no hydrogen 2.735 N/A ARG 43.A N SER 41.A OG no hydrogen 3.114 N/A LYS 45.A NZ SER 259.A OG no hydrogen 3.084 N/A THR 46.A OG1 SER 41.A O no hydrogen 2.835 N/A THR 46.A OG1 ARG 43.A O no hydrogen 2.929 N/A PHE 47.A N PRO 256.A O no hydrogen 3.151 N/A LEU 49.A N PHE 47.A O no hydrogen 2.474 N/A THR 51.A N GLU 4.A OE1 no hydrogen 3.093 N/A THR 51.A N GLU 4.A OE2 no hydrogen 3.061 N/A THR 51.A OG1 GLU 4.A OE2 no hydrogen 2.677 N/A THR 51.A OG1 ARG 253.A O no hydrogen 2.846 N/A THR 52.A N GLU 4.A OE1 no hydrogen 2.643 N/A THR 52.A OG1 GLU 4.A OE1 no hydrogen 2.530 N/A THR 52.A OG1 GLN 247.A OE1 no hydrogen 2.815 N/A LYS 53.A NZ ILE 286.A O no hydrogen 2.898 N/A VAL 55.A N TYR 280.A OH no hydrogen 3.056 N/A ILE 57.A N VAL 55.A O no hydrogen 2.595 N/A ARG 58.A NH1 LYS 80.A O no hydrogen 3.344 N/A ARG 58.A NH2 LYS 80.A O no hydrogen 3.208 N/A VAL 60.A N PHE 56.A O no hydrogen 2.869 N/A ILE 61.A N ILE 57.A O no hydrogen 2.707 N/A GLU 62.A N ARG 58.A O no hydrogen 3.037 N/A GLU 63.A N GLY 59.A O no hydrogen 3.019 N/A LEU 64.A N VAL 60.A O no hydrogen 3.155 N/A LEU 64.A N ILE 61.A O no hydrogen 2.824 N/A LEU 65.A N ILE 61.A O no hydrogen 3.172 N/A TRP 66.A N GLU 62.A O no hydrogen 3.007 N/A PHE 67.A N GLU 63.A O no hydrogen 2.788 N/A ILE 68.A N LEU 64.A O no hydrogen 2.769 N/A ARG 69.A N LEU 65.A O no hydrogen 2.955 N/A GLY 70.A N PHE 67.A O no hydrogen 2.692 N/A GLU 71.A N TRP 66.A O no hydrogen 3.334 N/A THR 72.A OG1 TYR 122.A OH no hydrogen 3.275 N/A SER 74.A N GLY 105.A O no hydrogen 2.847 N/A SER 74.A OG GLY 105.A O no hydrogen 3.243 N/A LEU 75.A N ASP 73.A OD2 no hydrogen 2.710 N/A LYS 76.A N ASP 73.A O no hydrogen 3.004 N/A LYS 76.A NZ GLU 71.A OE2 no hydrogen 2.944 N/A ARG 78.A N SER 74.A O no hydrogen 2.886 N/A ARG 78.A N LEU 75.A O no hydrogen 2.810 N/A ARG 78.A NE ASP 86.A OD2 no hydrogen 2.625 N/A ARG 78.A NH1 GLU 104.A OE2 no hydrogen 3.419 N/A GLU 79.A N LEU 75.A O no hydrogen 2.836 N/A GLU 79.A N LYS 76.A O no hydrogen 2.706 N/A LYS 80.A NZ GLU 62.A OE2 no hydrogen 2.892 N/A ASN 81.A N ARG 78.A O no hydrogen 2.868 N/A ILE 82.A N LEU 77.A O no hydrogen 2.925 N/A TRP 85.A NE1 GLU 63.A OE2 no hydrogen 3.231 N/A ASP 86.A N HIS 83.A O no hydrogen 3.074 N/A ASN 88.A ND2 ILE 292.A O no hydrogen 3.481 N/A SER 90.A N ALA 87.A O no hydrogen 2.533 N/A SER 90.A OG ALA 87.A O no hydrogen 2.669 N/A TYR 93.A N SER 90.A OG no hydrogen 3.294 N/A TYR 93.A OH ALA 167.A O no hydrogen 3.249 N/A LEU 94.A N SER 90.A O no hydrogen 3.094 N/A SER 96.A N GLU 92.A O no hydrogen 3.331 N/A SER 96.A OG TYR 93.A O no hydrogen 2.606 N/A ILE 97.A N TYR 93.A O no hydrogen 3.020 N/A GLY 98.A N ASP 95.A O no hydrogen 2.687 N/A THR 100.A N GLY 98.A O no hydrogen 2.395 N/A THR 100.A OG1 GLY 98.A O no hydrogen 3.349 N/A ARG 102.A N LEU 99.A O no hydrogen 3.392 N/A ARG 102.A NH1 ASP 106.A OD1 no hydrogen 3.331 N/A GLY 105.A N GLY 89.A O no hydrogen 3.000 N/A ASP 106.A N GLN 103.A O no hydrogen 3.034 N/A LEU 107.A N THR 72.A O no hydrogen 3.062 N/A GLY 108.A N ASP 106.A OD1 no hydrogen 2.965 N/A ILE 110.A N GLY 108.A O no hydrogen 2.723 N/A GLN 114.A N ILE 110.A O no hydrogen 3.086 N/A GLN 114.A NE2 PRO 109.A O no hydrogen 3.309 N/A TRP 115.A N TYR 111.A O no hydrogen 2.847 N/A ARG 116.A N GLY 112.A O no hydrogen 2.992 N/A ARG 116.A NE ILE 68.A O no hydrogen 3.098 N/A HIS 117.A N PHE 113.A O no hydrogen 2.629 N/A HIS 117.A ND1 GLN 132.A O no hydrogen 2.780 N/A PHE 118.A N GLN 114.A O no hydrogen 2.971 N/A ALA 120.A N HIS 117.A O no hydrogen 2.561 N/A TYR 122.A OH THR 72.A OG1 no hydrogen 3.275 N/A TYR 122.A OH ASP 106.A OD1 no hydrogen 2.353 N/A TYR 122.A OH ASP 106.A OD2 no hydrogen 3.323 N/A ILE 123.A N TYR 129.A OH no hydrogen 2.574 N/A CYS 125.A N ASP 106.A OD2 no hydrogen 2.912 N/A LYS 126.A N ASP 124.A OD1 no hydrogen 2.764 N/A THR 127.A N ASP 124.A O no hydrogen 2.913 N/A THR 127.A OG1 ILE 123.A O no hydrogen 2.885 N/A THR 127.A OG1 ASP 124.A O no hydrogen 2.703 N/A TYR 129.A OH ASP 124.A O no hydrogen 3.276 N/A GLN 132.A N TYR 129.A O no hydrogen 2.682 N/A GLN 136.A NE2 GLN 114.A O no hydrogen 2.804 N/A GLN 136.A NE2 SER 156.A O no hydrogen 2.912 N/A LEU 137.A N TRP 115.A O no hydrogen 3.357 N/A ALA 138.A N ASP 135.A OD2 no hydrogen 3.220 N/A ASN 139.A N ASP 135.A O no hydrogen 3.015 N/A ILE 140.A N GLN 136.A O no hydrogen 2.776 N/A ILE 141.A N LEU 137.A O no hydrogen 3.225 N/A GLN 142.A N ALA 138.A O no hydrogen 3.142 N/A LYS 143.A N ASN 139.A O no hydrogen 2.889 N/A ILE 144.A N ILE 140.A O no hydrogen 3.009 N/A ARG 145.A N ILE 141.A O no hydrogen 2.967 N/A ARG 145.A NE VAL 219.A O no hydrogen 2.817 N/A ARG 145.A NH2 VAL 219.A O no hydrogen 3.041 N/A THR 146.A N GLN 142.A O no hydrogen 2.823 N/A SER 147.A OG SER 147.A O no hydrogen 2.575 N/A ILE 154.A N ARG 152.A O no hydrogen 2.864 N/A LEU 155.A N CYS 175.A O no hydrogen 3.052 N/A SER 156.A N GLN 136.A OE1 no hydrogen 2.970 N/A SER 156.A OG MET 173.A O no hydrogen 3.223 N/A ALA 157.A N MET 173.A O no hydrogen 2.877 N/A TRP 158.A N SER 156.A OG no hydrogen 3.075 N/A ASN 159.A ND2 GLN 114.A OE1 no hydrogen 3.097 N/A ASN 159.A ND2 PHE 118.A O no hydrogen 3.677 N/A ALA 161.A N ASN 159.A OD1 no hydrogen 3.021 N/A ASP 162.A N ASN 159.A O no hydrogen 2.576 N/A LEU 163.A N ASN 159.A O no hydrogen 3.154 N/A LYS 165.A NZ ALA 161.A O no hydrogen 3.202 N/A MET 166.A N LEU 163.A O no hydrogen 3.396 N/A ALA 167.A N LEU 107.A O no hydrogen 2.889 N/A CYS 171.A N TYR 111.A OH no hydrogen 2.416 N/A CYS 171.A SG SER 195.A O no hydrogen 3.057 N/A HIS 172.A N TYR 111.A OH no hydrogen 3.142 N/A HIS 172.A ND1 TYR 209.A OH no hydrogen 2.597 N/A CYS 175.A N LEU 155.A O no hydrogen 3.111 N/A CYS 175.A SG LEU 155.A O no hydrogen 3.908 N/A GLN 176.A N GLN 190.A O no hydrogen 3.079 N/A PHE 177.A N LEU 153.A O no hydrogen 2.910 N/A TYR 178.A N SER 188.A O no hydrogen 3.397 N/A HIS 180.A N GLU 186.A O no hydrogen 3.241 N/A SER 188.A N TYR 178.A O no hydrogen 2.987 N/A SER 188.A OG ASP 226.A OD2 no hydrogen 2.528 N/A CYS 189.A N ASP 226.A O no hydrogen 2.911 N/A GLN 190.A N GLN 176.A O no hydrogen 3.145 N/A LEU 191.A N ILE 228.A O no hydrogen 2.931 N/A TYR 192.A N PHE 174.A O no hydrogen 2.828 N/A GLN 193.A N VAL 230.A O no hydrogen 2.821 N/A GLN 193.A NE2 SER 195.A O no hydrogen 3.360 N/A ARG 194.A NE PRO 170.A O no hydrogen 2.806 N/A ARG 194.A NH2 PRO 169.A O no hydrogen 3.414 N/A ARG 194.A NH2 PRO 170.A O no hydrogen 3.415 N/A CYS 196.A N ASP 233.A O no hydrogen 3.025 N/A CYS 196.A SG GLN 193.A O no hydrogen 3.241 N/A CYS 196.A SG HIS 229.A NE2 no hydrogen 3.983 N/A MET 198.A N HIS 235.A O no hydrogen 3.381 N/A GLY 199.A N ASP 197.A OD2 no hydrogen 3.159 N/A VAL 202.A N ASP 197.A O no hydrogen 3.240 N/A PHE 204.A N LEU 200.A O no hydrogen 3.348 N/A ASN 205.A N GLY 201.A O no hydrogen 3.005 N/A ILE 206.A N VAL 202.A O no hydrogen 2.814 N/A ILE 206.A N PRO 203.A O no hydrogen 3.153 N/A ALA 207.A N PRO 203.A O no hydrogen 3.234 N/A SER 208.A N PHE 204.A O no hydrogen 2.914 N/A TYR 209.A N ASN 205.A O no hydrogen 2.935 N/A TYR 209.A OH HIS 172.A ND1 no hydrogen 2.597 N/A ALA 210.A N ILE 206.A O no hydrogen 2.887 N/A LEU 211.A N ALA 207.A O no hydrogen 2.842 N/A LEU 212.A N SER 208.A O no hydrogen 3.297 N/A THR 213.A N TYR 209.A O no hydrogen 2.933 N/A THR 213.A OG1 TYR 209.A O no hydrogen 2.802 N/A CYS 214.A N ALA 210.A O no hydrogen 3.112 N/A CYS 214.A SG ALA 210.A O no hydrogen 3.056 N/A MET 215.A N LEU 211.A O no hydrogen 2.628 N/A ILE 216.A N LEU 212.A O no hydrogen 2.751 N/A ALA 217.A N THR 213.A O no hydrogen 2.894 N/A HIS 218.A N CYS 214.A O no hydrogen 2.710 N/A VAL 219.A N MET 215.A O no hydrogen 3.119 N/A CYS 220.A N ALA 217.A O no hydrogen 3.198 N/A CYS 220.A SG ILE 141.A O no hydrogen 3.858 N/A CYS 220.A SG ILE 216.A O no hydrogen 3.150 N/A ASP 221.A N HIS 218.A O no hydrogen 3.276 N/A GLY 225.A N LEU 187.A O no hydrogen 3.017 N/A ASP 226.A N SER 188.A OG no hydrogen 3.125 N/A PHE 227.A N PHE 40.A O no hydrogen 2.464 N/A ILE 228.A N CYS 189.A O no hydrogen 2.660 N/A HIS 229.A N LEU 38.A O no hydrogen 2.791 N/A VAL 230.A N LEU 191.A O no hydrogen 2.721 N/A GLY 232.A N GLN 193.A O no hydrogen 2.803 N/A ASP 233.A N ARG 194.A O no hydrogen 2.758 N/A CYS 234.A N VAL 32.A O no hydrogen 2.996 N/A HIS 235.A N CYS 196.A O no hydrogen 3.035 N/A HIS 235.A ND1 ASP 233.A O no hydrogen 2.696 N/A ILE 236.A N LEU 30.A O no hydrogen 2.858 N/A TYR 237.A OH ASP 23.A OD2 no hydrogen 3.300 N/A LYS 238.A N GLY 28.A O no hydrogen 3.053 N/A HIS 240.A N TYR 237.A O no hydrogen 2.703 N/A ILE 241.A N LYS 238.A O no hydrogen 2.598 N/A ALA 243.A N GLU 242.A OE1 no hydrogen 2.668 N/A LEU 244.A N ILE 241.A O no hydrogen 2.426 N/A GLN 245.A N ILE 241.A O no hydrogen 3.419 N/A GLN 245.A N GLN 245.A OE1 no hydrogen 2.523 N/A LEU 248.A N LEU 244.A O no hydrogen 2.488 N/A THR 249.A OG1 GLN 245.A O no hydrogen 3.076 N/A THR 249.A OG1 GLN 246.A O no hydrogen 2.308 N/A ARG 250.A N GLN 247.A O no hydrogen 2.837 N/A ARG 250.A NE GLN 246.A OE1 no hydrogen 2.955 N/A ARG 250.A NH2 GLU 284.A O no hydrogen 3.429 N/A SER 251.A N TYR 283.A OH no hydrogen 2.808 N/A ARG 253.A N THR 51.A OG1 no hydrogen 2.794 N/A ARG 253.A NH1 HIS 281.A O no hydrogen 2.731 N/A THR 257.A N GLN 278.A O no hydrogen 2.693 N/A THR 257.A OG1 GLN 278.A O no hydrogen 2.935 N/A LEU 258.A N LYS 45.A O no hydrogen 2.755 N/A SER 259.A N ASN 276.A O no hydrogen 3.308 N/A THR 265.A OG1 THR 265.A O no hydrogen 2.186 N/A GLU 268.A N ASP 266.A OD1 no hydrogen 3.288 N/A THR 271.A OG1 ASP 274.A OD2 no hydrogen 2.507 N/A ASP 274.A N THR 271.A O no hydrogen 2.756 N/A PHE 275.A N LEU 272.A O no hydrogen 2.893 N/A TYR 280.A OH LEU 50.A O no hydrogen 2.536 N/A TYR 283.A N THR 51.A O no hydrogen 2.806 N/A TYR 283.A OH SER 251.A O no hydrogen 3.003 N/A GLU 284.A N GLU 284.A OE2 no hydrogen 2.365 N/A LYS 289.A N HIS 240.A NE2 no hydrogen 3.270 N/A LYS 289.A NZ LYS 287.A O no hydrogen 2.934 N/A SER 291.A OG THR 25.A OG1 no hydrogen 2.356 N/A SER 291.A OG THR 27.A OG1 no hydrogen 2.962 N/A