Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5aae_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 7.A OD2 no hydrogen 2.710 N/A ASP 7.A N ALA 4.A O no hydrogen 3.134 N/A PHE 8.A N LEU 5.A O no hydrogen 3.101 N/A GLU 9.A N ARG 26.A O no hydrogen 2.990 N/A LEU 14.A N VAL 22.A O no hydrogen 2.780 N/A ASN 21.A N VAL 38.A O no hydrogen 2.966 N/A VAL 22.A N GLY 15.A O no hydrogen 3.119 N/A TYR 23.A N LEU 36.A O no hydrogen 3.319 N/A LEU 24.A N ARG 12.A O no hydrogen 2.661 N/A ALA 25.A N LEU 34.A O no hydrogen 2.763 N/A ARG 26.A N GLU 9.A O no hydrogen 3.261 N/A ARG 26.A NH2 GLU 9.A OE1 no hydrogen 2.391 N/A GLU 27.A N PHE 32.A O no hydrogen 3.005 N/A LYS 28.A N ASP 7.A O no hydrogen 3.231 N/A SER 30.A OG GLU 27.A OE1 no hydrogen 2.371 N/A PHE 32.A N GLU 27.A OE1 no hydrogen 2.876 N/A LEU 34.A N ALA 25.A O no hydrogen 2.763 N/A ALA 35.A N LEU 85.A O no hydrogen 2.839 N/A LEU 36.A N TYR 23.A O no hydrogen 3.029 N/A LYS 37.A N LEU 83.A O no hydrogen 3.188 N/A VAL 38.A N ASN 21.A O no hydrogen 2.884 N/A LEU 39.A N VAL 81.A O no hydrogen 2.895 N/A LYS 41.A N THR 79.A O no hydrogen 2.938 N/A LEU 44.A N LYS 41.A O no hydrogen 2.980 N/A GLU 45.A N LYS 41.A O no hydrogen 2.498 N/A LYS 46.A N ALA 42.A O no hydrogen 3.267 N/A GLY 48.A N LEU 44.A O no hydrogen 2.497 N/A ARG 54.A N GLU 50.A O no hydrogen 2.873 N/A ARG 55.A N HIS 51.A O no hydrogen 3.441 N/A GLU 56.A N GLN 52.A O no hydrogen 2.351 N/A VAL 57.A N LEU 53.A O no hydrogen 2.712 N/A GLU 58.A N ARG 54.A O no hydrogen 3.225 N/A ILE 59.A N ARG 55.A O no hydrogen 2.428 N/A GLN 60.A N GLU 56.A O no hydrogen 2.746 N/A GLN 60.A NE2 LEU 69.A O no hydrogen 2.677 N/A SER 61.A N VAL 57.A O no hydrogen 2.819 N/A ARG 64.A N TYR 121.A OH no hydrogen 2.798 N/A ASN 67.A N HIS 65.A ND1 no hydrogen 3.137 N/A ASN 67.A ND2 LEU 145.A O no hydrogen 3.052 N/A ILE 68.A N HIS 65.A O no hydrogen 3.004 N/A LEU 69.A N ILE 147.A O no hydrogen 2.725 N/A ARG 70.A N GLU 86.A OE1 no hydrogen 3.015 N/A TYR 72.A N ILE 84.A O no hydrogen 2.822 N/A PHE 75.A N TYR 82.A O no hydrogen 3.391 N/A HIS 76.A ND1 ASP 77.A O no hydrogen 2.716 N/A ARG 80.A N ASP 77.A OD1 no hydrogen 2.977 N/A ARG 80.A NH1 TYR 82.A OH no hydrogen 2.574 N/A VAL 81.A N LEU 39.A O no hydrogen 2.471 N/A TYR 82.A N PHE 75.A O no hydrogen 2.959 N/A LEU 83.A N LYS 37.A O no hydrogen 2.856 N/A ILE 84.A N GLY 73.A O no hydrogen 2.955 N/A LEU 85.A N ALA 35.A O no hydrogen 2.803 N/A GLU 86.A N ARG 70.A O no hydrogen 2.987 N/A LEU 90.A N LEU 139.A O no hydrogen 3.299 N/A VAL 93.A N LEU 137.A O no hydrogen 3.034 N/A ARG 95.A N THR 92.A OG1 no hydrogen 3.042 N/A LEU 97.A N VAL 93.A O no hydrogen 2.848 N/A GLN 98.A N TYR 94.A O no hydrogen 2.895 N/A LEU 100.A N GLU 96.A O no hydrogen 3.226 N/A LYS 102.A N LEU 100.A O no hydrogen 2.625 N/A LYS 102.A NZ SER 101.A OG no hydrogen 3.310 N/A PHE 103.A N PHE 186.A O no hydrogen 2.795 N/A THR 108.A N ASP 104.A O no hydrogen 3.224 N/A THR 108.A OG1 PHE 103.A O no hydrogen 3.499 N/A THR 108.A OG1 ASP 104.A O no hydrogen 3.177 N/A ALA 109.A N GLU 105.A O no hydrogen 2.903 N/A THR 110.A N GLN 106.A O no hydrogen 3.042 N/A THR 110.A OG1 GLN 106.A O no hydrogen 2.409 N/A TYR 111.A N ARG 107.A O no hydrogen 3.049 N/A ILE 112.A N THR 108.A O no hydrogen 2.953 N/A THR 113.A N ALA 109.A O no hydrogen 3.177 N/A THR 113.A OG1 ALA 109.A O no hydrogen 2.868 N/A THR 113.A OG1 SER 251.A OG no hydrogen 2.985 N/A GLU 114.A N THR 110.A O no hydrogen 3.180 N/A LEU 115.A N TYR 111.A O no hydrogen 3.128 N/A ALA 116.A N ILE 112.A O no hydrogen 2.872 N/A ASN 117.A N THR 113.A O no hydrogen 3.015 N/A ALA 118.A N GLU 114.A O no hydrogen 2.997 N/A LEU 119.A N LEU 115.A O no hydrogen 2.756 N/A SER 120.A N ALA 116.A O no hydrogen 2.618 N/A TYR 121.A N ASN 117.A O no hydrogen 3.127 N/A CYS 122.A N ALA 118.A O no hydrogen 3.006 N/A CYS 122.A SG ALA 118.A O no hydrogen 3.430 N/A HIS 123.A N LEU 119.A O no hydrogen 2.520 N/A HIS 123.A NE2 GLU 172.A O no hydrogen 2.897 N/A SER 124.A N SER 120.A O no hydrogen 3.137 N/A SER 124.A OG TYR 121.A O no hydrogen 2.360 N/A LYS 125.A N CYS 122.A O no hydrogen 3.077 N/A ARG 126.A N HIS 123.A O no hydrogen 3.262 N/A VAL 127.A N CYS 122.A O no hydrogen 2.699 N/A HIS 129.A N ASP 175.A OD2 no hydrogen 3.484 N/A ARG 130.A N ASP 175.A OD1 no hydrogen 3.293 N/A ASP 131.A N HIS 129.A O no hydrogen 2.426 N/A ILE 132.A N ARG 130.A O no hydrogen 3.109 N/A LYS 133.A NZ ASP 131.A OD1 no hydrogen 2.832 N/A LYS 133.A NZ ASP 131.A OD2 no hydrogen 3.142 N/A LYS 133.A NZ THR 156.A OG1 no hydrogen 2.756 N/A ASN 136.A N LYS 133.A O no hydrogen 3.024 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 3.608 N/A LEU 137.A N PRO 134.A O no hydrogen 3.229 N/A LEU 138.A N LYS 146.A O no hydrogen 2.850 N/A LEU 139.A N GLY 91.A O no hydrogen 2.913 N/A GLY 140.A N GLU 144.A O no hydrogen 2.826 N/A ALA 142.A N GLU 144.A OE1 no hydrogen 3.190 N/A GLY 143.A N GLY 140.A O no hydrogen 2.746 N/A GLU 144.A N GLU 144.A OE1 no hydrogen 2.664 N/A LEU 145.A N GLU 114.A OE2 no hydrogen 3.019 N/A LYS 146.A N LEU 138.A O no hydrogen 2.695 N/A LYS 146.A NZ PRO 66.A O no hydrogen 3.034 N/A LYS 146.A NZ GLU 86.A OE1 no hydrogen 3.496 N/A LYS 146.A NZ GLU 86.A OE2 no hydrogen 3.306 N/A ILE 147.A N ASN 67.A O no hydrogen 2.758 N/A ALA 148.A N ASN 136.A O no hydrogen 2.964 N/A SER 153.A OG ILE 128.A O no hydrogen 2.757 N/A VAL 154.A N ILE 128.A O no hydrogen 3.006 N/A TYR 159.A OH GLU 185.A OE1 no hydrogen 2.347 N/A LEU 160.A N LEU 157.A O no hydrogen 2.848 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.761 N/A MET 164.A N PRO 161.A O no hydrogen 3.234 N/A ILE 165.A N PRO 161.A O no hydrogen 3.110 N/A GLU 166.A N PRO 162.A O no hydrogen 3.248 N/A GLY 167.A N GLU 163.A O no hydrogen 3.357 N/A ARG 168.A NH2 GLU 166.A OE1 no hydrogen 2.312 N/A ARG 168.A NH2 HIS 230.A NE2 no hydrogen 2.887 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.516 N/A LYS 173.A N ASP 171.A OD1 no hydrogen 3.062 N/A LYS 173.A NZ ARG 235.A O no hydrogen 2.907 N/A LYS 173.A NZ PRO 236.A O no hydrogen 2.724 N/A VAL 174.A N ASP 171.A O no hydrogen 3.315 N/A ASP 175.A N GLU 172.A O no hydrogen 3.436 N/A TRP 177.A N LYS 173.A O no hydrogen 3.174 N/A SER 178.A N VAL 174.A O no hydrogen 3.313 N/A SER 178.A OG TYR 159.A O no hydrogen 3.086 N/A SER 178.A OG VAL 174.A O no hydrogen 2.904 N/A LEU 179.A N ASP 175.A O no hydrogen 2.686 N/A GLY 180.A N LEU 176.A O no hydrogen 3.007 N/A VAL 181.A N TRP 177.A O no hydrogen 2.920 N/A LEU 182.A N SER 178.A O no hydrogen 2.955 N/A CYS 183.A N LEU 179.A O no hydrogen 2.996 N/A TYR 184.A N GLY 180.A O no hydrogen 3.316 N/A TYR 184.A OH THR 211.A O no hydrogen 2.862 N/A GLU 185.A N VAL 181.A O no hydrogen 3.193 N/A PHE 186.A N LEU 182.A O no hydrogen 2.954 N/A LEU 187.A N CYS 183.A O no hydrogen 3.377 N/A LEU 187.A N TYR 184.A O no hydrogen 3.110 N/A VAL 188.A N TYR 184.A O no hydrogen 2.859 N/A GLY 189.A N GLU 185.A O no hydrogen 2.604 N/A GLU 194.A N PRO 191.A O no hydrogen 3.336 N/A ASN 196.A N GLU 200.A OE1 no hydrogen 3.219 N/A THR 197.A OG1 GLN 199.A OE1 no hydrogen 3.570 N/A GLN 199.A N GLN 199.A OE1 no hydrogen 2.862 N/A GLU 200.A N THR 197.A O no hydrogen 3.270 N/A GLU 200.A N THR 197.A OG1 no hydrogen 3.051 N/A THR 201.A N THR 197.A O no hydrogen 2.890 N/A THR 201.A OG1 THR 197.A O no hydrogen 2.691 N/A TYR 202.A N TYR 198.A O no hydrogen 2.905 N/A LYS 203.A N GLU 200.A O no hydrogen 3.131 N/A ARG 204.A N GLU 200.A O no hydrogen 3.180 N/A ARG 204.A NH2 GLU 200.A OE2 no hydrogen 2.672 N/A ILE 205.A N THR 201.A O no hydrogen 2.986 N/A SER 206.A N TYR 202.A O no hydrogen 3.093 N/A SER 206.A OG GLU 166.A OE2 no hydrogen 2.445 N/A ARG 207.A N LYS 203.A O no hydrogen 2.752 N/A GLU 209.A N ARG 204.A O no hydrogen 2.907 N/A VAL 216.A N PRO 213.A O no hydrogen 3.240 N/A THR 217.A OG1 GLU 105.A OE2 no hydrogen 2.399 N/A ARG 221.A N THR 217.A O no hydrogen 3.130 N/A ARG 221.A NE VAL 216.A O no hydrogen 3.105 N/A ARG 221.A NH2 PRO 213.A O no hydrogen 3.145 N/A ASP 222.A N GLU 218.A O no hydrogen 3.206 N/A ILE 224.A N ALA 220.A O no hydrogen 3.297 N/A SER 225.A N ARG 221.A O no hydrogen 3.148 N/A SER 225.A OG ARG 221.A O no hydrogen 2.812 N/A ARG 226.A N ASP 222.A O no hydrogen 3.248 N/A ARG 226.A NE ASP 222.A OD1 no hydrogen 2.630 N/A LEU 227.A N LEU 223.A O no hydrogen 3.282 N/A LEU 228.A N ILE 224.A O no hydrogen 2.991 N/A LYS 229.A NZ GLN 234.A O no hydrogen 2.372 N/A SER 233.A N ASN 231.A OD1 no hydrogen 2.893 N/A ARG 235.A N PRO 232.A O no hydrogen 3.049 N/A ARG 235.A NE LYS 229.A O no hydrogen 3.310 N/A ARG 235.A NH1 GLU 163.A OE2 no hydrogen 2.935 N/A ARG 235.A NH2 GLU 163.A OE1 no hydrogen 3.217 N/A ARG 235.A NH2 GLU 163.A OE2 no hydrogen 3.280 N/A ARG 235.A NH2 LYS 229.A O no hydrogen 3.229 N/A VAL 241.A N MET 237.A O no hydrogen 3.107 N/A LEU 242.A N LEU 238.A O no hydrogen 3.130 N/A GLU 243.A N ARG 239.A O no hydrogen 3.194 N/A HIS 244.A N VAL 241.A O no hydrogen 2.991 N/A HIS 244.A NE2 ASP 222.A OD1 no hydrogen 2.906 N/A TRP 246.A N HIS 244.A ND1 no hydrogen 3.073 N/A TRP 246.A NE1 GLU 105.A OE2 no hydrogen 2.875 N/A THR 248.A N HIS 244.A O no hydrogen 2.847 N/A THR 248.A OG1 LEU 242.A O no hydrogen 3.488 N/A THR 248.A OG1 HIS 244.A O no hydrogen 3.282 N/A ALA 249.A N PRO 245.A O no hydrogen 2.848 N/A ASN 250.A N ILE 247.A O no hydrogen 3.309 N/A ASN 250.A ND2 TRP 246.A O no hydrogen 2.954 N/A SER 251.A N ILE 247.A O no hydrogen 2.789 N/A SER 251.A OG THR 113.A OG1 no hydrogen 2.985 N/A SER 251.A OG SER 252.A O no hydrogen 3.379 N/A