Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1uar_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH LYS 205.A O no hydrogen 2.644 N/A ALA 3.A N LEU 244.A O no hydrogen 2.936 N/A HIS 4.A ND1 GLU 6.A OE2 no hydrogen 2.737 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.705 N/A VAL 7.A N HIS 4.A O no hydrogen 3.190 N/A LEU 8.A N PRO 5.A O no hydrogen 3.083 N/A VAL 9.A N LEU 108.A O no hydrogen 2.903 N/A THR 11.A OG1 GLU 118.A OE1 no hydrogen 2.780 N/A TRP 13.A N SER 10.A OG no hydrogen 3.083 N/A VAL 14.A N SER 10.A O no hydrogen 3.077 N/A GLN 15.A N THR 11.A O no hydrogen 3.020 N/A GLU 16.A N ASP 12.A O no hydrogen 3.042 N/A HIS 17.A N VAL 14.A O no hydrogen 2.978 N/A HIS 17.A ND1 ASP 20.A OD2 no hydrogen 3.319 N/A ASP 20.A N HIS 17.A O no hydrogen 3.083 N/A LYS 22.A N ASP 20.A OD1 no hydrogen 2.893 N/A LYS 22.A NZ ASP 77.A OD2 no hydrogen 2.798 N/A VAL 23.A N ASP 20.A O no hydrogen 3.058 N/A ARG 24.A N THR 79.A O no hydrogen 3.034 N/A ARG 24.A NE GLY 73.A O no hydrogen 2.872 N/A ARG 24.A NH1 VAL 23.A O no hydrogen 2.951 N/A LEU 26.A N VAL 81.A O no hydrogen 2.765 N/A GLU 27.A N GLN 44.A O no hydrogen 2.819 N/A VAL 28.A N TYR 83.A O no hydrogen 2.783 N/A GLU 30.A N ASP 85.A OD1 no hydrogen 3.241 N/A LEU 33.A N ASP 31.A OD1 no hydrogen 2.865 N/A LEU 34.A N ASP 31.A O no hydrogen 3.212 N/A TYR 35.A OH ALA 43.A O no hydrogen 2.649 N/A ASP 36.A N LEU 33.A O no hydrogen 3.257 N/A THR 37.A N LEU 34.A O no hydrogen 3.102 N/A THR 37.A OG1 LEU 34.A O no hydrogen 2.643 N/A GLY 38.A N TYR 35.A O no hydrogen 3.027 N/A HIS 39.A N THR 123.A O no hydrogen 2.913 N/A HIS 39.A ND1 TYR 35.A O no hydrogen 2.913 N/A HIS 39.A NE2 GLU 125.A O no hydrogen 2.730 N/A ILE 40.A N TYR 83.A OH no hydrogen 3.086 N/A ALA 43.A N ILE 40.A O no hydrogen 2.962 N/A GLN 44.A N VAL 25.A O no hydrogen 2.895 N/A LYS 45.A NZ ILE 32.A O no hydrogen 2.536 N/A LYS 45.A NZ ASP 36.A OD1 no hydrogen 3.202 N/A ILE 46.A N GLU 27.A O no hydrogen 3.157 N/A ASP 47.A N ASP 51.A OD2 no hydrogen 2.673 N/A ARG 50.A NH1 ASP 51.A OD1 no hydrogen 3.428 N/A ASP 51.A N ASP 47.A O no hydrogen 2.733 N/A PHE 52.A N TRP 48.A O no hydrogen 2.784 N/A TRP 53.A N GLN 49.A O no hydrogen 3.306 N/A TRP 53.A NE1 GLU 232.A OE2 no hydrogen 2.668 N/A ASP 54.A N ASP 59.A O no hydrogen 2.816 N/A VAL 56.A N ASP 54.A OD2 no hydrogen 2.918 N/A VAL 57.A N ASP 54.A OD2 no hydrogen 2.923 N/A ARG 58.A NH1 THR 258.A OG1 no hydrogen 2.893 N/A ARG 58.A NH2 GLY 255.A O no hydrogen 2.866 N/A ARG 58.A NH2 THR 258.A OG1 no hydrogen 3.135 N/A ASP 59.A N VAL 57.A O no hydrogen 3.091 N/A PHE 60.A N ASP 59.A OD1 no hydrogen 2.860 N/A ILE 61.A N PHE 52.A O no hydrogen 2.810 N/A SER 62.A OG GLU 64.A OE1 no hydrogen 3.513 N/A GLU 63.A N GLU 63.A OE1 no hydrogen 2.516 N/A GLU 65.A N SER 62.A OG no hydrogen 3.168 N/A PHE 66.A N SER 62.A O no hydrogen 2.841 N/A ALA 67.A N GLU 63.A O no hydrogen 3.086 N/A LYS 68.A N GLU 64.A O no hydrogen 3.200 N/A LYS 68.A NZ GLU 64.A O no hydrogen 3.478 N/A LEU 69.A N GLU 65.A O no hydrogen 3.041 N/A ARG 71.A N LYS 68.A O no hydrogen 3.102 N/A LEU 72.A N LEU 69.A O no hydrogen 3.006 N/A GLY 73.A N GLU 70.A O no hydrogen 2.966 N/A SER 75.A N THR 78.A OG1 no hydrogen 2.822 N/A ASN 76.A ND2 ARG 133.A O no hydrogen 3.302 N/A THR 78.A N SER 75.A O no hydrogen 3.108 N/A THR 78.A OG1 SER 75.A O no hydrogen 3.273 N/A THR 79.A N LYS 22.A O no hydrogen 2.692 N/A THR 79.A OG1 ASP 105.A OD2 no hydrogen 2.870 N/A VAL 80.A N ASP 105.A O no hydrogen 2.998 N/A VAL 81.A N ARG 24.A O no hydrogen 2.935 N/A LEU 82.A N ARG 107.A O no hydrogen 2.802 N/A TYR 83.A N LEU 26.A O no hydrogen 3.135 N/A TYR 83.A OH GLU 27.A OE1 no hydrogen 2.551 N/A GLY 84.A N ASN 88.A OD1 no hydrogen 3.036 N/A ASP 85.A N ASP 29.A OD1 no hydrogen 2.980 N/A LYS 86.A NZ GLU 30.A OE1 no hydrogen 2.684 N/A ASN 88.A N ASP 85.A O no hydrogen 3.118 N/A TRP 89.A N LYS 86.A O no hydrogen 3.038 N/A TRP 89.A NE1 ARG 233.A O no hydrogen 3.038 N/A ALA 92.A N ASN 88.A O no hydrogen 2.807 N/A TYR 93.A N TRP 89.A O no hydrogen 3.411 N/A ALA 94.A N TRP 90.A O no hydrogen 2.985 N/A PHE 95.A N ALA 91.A O no hydrogen 2.941 N/A TRP 96.A N ALA 92.A O no hydrogen 2.925 N/A TRP 96.A NE1 ILE 143.A O no hydrogen 2.985 N/A PHE 97.A N TYR 93.A O no hydrogen 2.946 N/A PHE 98.A N ALA 94.A O no hydrogen 2.839 N/A LYS 99.A N PHE 95.A O no hydrogen 3.003 N/A LYS 99.A NZ HIS 103.A O no hydrogen 2.938 N/A LYS 99.A NZ LYS 104.A O no hydrogen 3.030 N/A TYR 100.A N TRP 96.A O no hydrogen 2.813 N/A TYR 100.A OH GLU 141.A OE2 no hydrogen 2.702 N/A TYR 100.A OH TYR 146.A OH no hydrogen 3.172 N/A ASN 101.A N PHE 97.A O no hydrogen 3.093 N/A ASN 101.A N PHE 98.A O no hydrogen 3.137 N/A ASN 101.A ND2 PHE 97.A O no hydrogen 3.007 N/A GLY 102.A N LYS 99.A O no hydrogen 2.900 N/A HIS 103.A N PHE 98.A O no hydrogen 2.926 N/A ARG 107.A N VAL 80.A O no hydrogen 2.806 N/A ARG 107.A NE ASP 105.A OD1 no hydrogen 2.865 N/A ARG 107.A NH2 ASP 105.A OD1 no hydrogen 3.561 N/A ARG 107.A NH2 ASP 105.A OD2 no hydrogen 2.928 N/A LEU 108.A N VAL 7.A O no hydrogen 2.848 N/A ARG 112.A N GLY 84.A O no hydrogen 2.901 N/A ARG 112.A NH1 GLY 38.A O no hydrogen 2.919 N/A ARG 112.A NH2 GLY 38.A O no hydrogen 2.940 N/A GLN 113.A NE2 PRO 200.A O no hydrogen 3.166 N/A LYS 114.A N GLY 110.A O no hydrogen 3.250 N/A LYS 114.A NZ THR 11.A OG1 no hydrogen 3.271 N/A LYS 114.A NZ GLU 118.A OE2 no hydrogen 2.712 N/A TRP 115.A N GLY 111.A O no hydrogen 3.358 N/A TRP 115.A NE1 PRO 121.A O no hydrogen 2.759 N/A VAL 116.A N ARG 112.A O no hydrogen 2.954 N/A GLU 117.A N GLN 113.A O no hydrogen 2.948 N/A GLU 118.A N LYS 114.A O no hydrogen 2.951 N/A GLY 119.A N VAL 116.A O no hydrogen 3.024 N/A ARG 120.A N TRP 115.A O no hydrogen 3.264 N/A ARG 120.A NE GLU 118.A OE1 no hydrogen 2.850 N/A ARG 120.A NH1 GLN 15.A OE1 no hydrogen 2.712 N/A THR 123.A N HIS 39.A O no hydrogen 2.863 N/A GLU 125.A N THR 123.A OG1 no hydrogen 3.069 N/A TYR 129.A OH GLY 42.A O no hydrogen 2.772 N/A GLY 132.A N GLU 70.A O no hydrogen 2.888 N/A ARG 133.A N SER 75.A OG no hydrogen 2.998 N/A TYR 134.A N GLU 70.A OE2 no hydrogen 2.930 N/A ARG 139.A NH2 PHE 60.A O no hydrogen 3.197 N/A ARG 139.A NH2 ILE 61.A O no hydrogen 2.763 N/A ASP 140.A N TYR 100.A O no hydrogen 2.765 N/A SER 142.A N ASP 140.A OD1 no hydrogen 3.113 N/A SER 142.A OG ASP 140.A OD1 no hydrogen 2.577 N/A SER 142.A OG ASP 140.A OD2 no hydrogen 3.255 N/A ILE 143.A N ASP 140.A O no hydrogen 3.441 N/A ARG 144.A N GLU 141.A O no hydrogen 3.293 N/A ARG 144.A NE ASP 254.A OD1 no hydrogen 2.741 N/A ARG 144.A NH1 ASP 59.A OD1 no hydrogen 3.241 N/A ARG 144.A NH1 TYR 100.A OH no hydrogen 2.991 N/A ARG 144.A NH2 ASP 59.A OD1 no hydrogen 3.102 N/A ARG 144.A NH2 ASP 254.A OD1 no hydrogen 3.549 N/A ARG 144.A NH2 ASP 254.A OD2 no hydrogen 2.975 N/A ALA 145.A N ASN 252.A O no hydrogen 3.011 N/A TYR 146.A N ASP 149.A OD2 no hydrogen 2.688 N/A TYR 146.A OH GLU 141.A OE1 no hydrogen 2.603 N/A ARG 147.A NH1 GLU 259.A OE2 no hydrogen 2.861 N/A ASP 149.A N TYR 146.A O no hydrogen 2.751 N/A VAL 150.A N ARG 147.A O no hydrogen 3.197 N/A HIS 153.A N ASP 149.A O no hydrogen 3.051 N/A HIS 153.A NE2 ALA 163.A O no hydrogen 2.879 N/A ILE 154.A N VAL 150.A O no hydrogen 2.639 N/A ILE 155.A N LEU 151.A O no hydrogen 3.371 N/A LYS 156.A N GLU 152.A O no hydrogen 3.219 N/A LYS 156.A NZ ASP 224.A OD2 no hydrogen 2.593 N/A VAL 157.A N HIS 153.A O no hydrogen 2.827 N/A LYS 158.A N ILE 154.A O no hydrogen 3.327 N/A GLU 159.A N ILE 155.A O no hydrogen 3.020 N/A GLY 160.A N VAL 157.A O no hydrogen 3.406 N/A LYS 161.A N LYS 156.A O no hydrogen 2.777 N/A GLY 162.A N LYS 156.A O no hydrogen 2.957 N/A ALA 163.A N ASP 224.A O no hydrogen 2.872 N/A VAL 165.A N VAL 226.A O no hydrogen 2.877 N/A ASP 166.A N LYS 190.A O no hydrogen 2.872 N/A VAL 167.A N TYR 228.A O no hydrogen 3.114 N/A ARG 168.A N ASP 166.A OD1 no hydrogen 3.093 N/A ARG 168.A NE ASP 166.A OD1 no hydrogen 3.004 N/A ARG 168.A NE ASP 166.A OD2 no hydrogen 3.462 N/A ARG 168.A NH2 ASP 166.A OD2 no hydrogen 2.885 N/A ARG 168.A NH2 GLY 184.A O no hydrogen 2.657 N/A SER 169.A OG GLU 172.A OE2 no hydrogen 2.971 N/A GLN 171.A N GLN 171.A OE1 no hydrogen 2.631 N/A GLU 172.A N SER 169.A OG no hydrogen 3.332 N/A TYR 173.A N SER 169.A O no hydrogen 2.931 N/A TYR 173.A OH ALA 189.A O no hydrogen 2.612 N/A TYR 173.A OH GLU 273.A OXT no hydrogen 2.798 N/A ARG 174.A N PRO 170.A O no hydrogen 2.843 N/A ARG 174.A NE GLU 176.A OE2 no hydrogen 2.689 N/A ARG 174.A NH2 GLU 176.A OE1 no hydrogen 3.522 N/A GLY 175.A N GLU 172.A O no hydrogen 3.155 N/A GLU 176.A N GLN 171.A O no hydrogen 2.841 N/A ARG 182.A N GLY 261.A O no hydrogen 3.017 N/A HIS 185.A N ALA 269.A O no hydrogen 2.724 N/A HIS 185.A ND1 ILE 186.A O no hydrogen 3.217 N/A ILE 186.A N TYR 228.A OH no hydrogen 2.948 N/A GLY 188.A N GLU 273.A OE1 no hydrogen 2.863 N/A ALA 189.A N ILE 186.A O no hydrogen 2.920 N/A LYS 190.A N LEU 164.A O no hydrogen 2.814 N/A LYS 190.A NZ GLU 273.A O no hydrogen 2.492 N/A LYS 190.A NZ GLU 273.A OXT no hydrogen 3.372 N/A ILE 192.A N ASP 166.A O no hydrogen 3.029 N/A TRP 194.A N VAL 167.A O no hydrogen 3.265 N/A LYS 196.A N PRO 193.A O no hydrogen 3.048 N/A ALA 197.A N TRP 194.A O no hydrogen 3.110 N/A VAL 198.A N ALA 195.A O no hydrogen 3.112 N/A ASN 199.A N THR 203.A O no hydrogen 2.767 N/A GLY 202.A N ASN 199.A O no hydrogen 2.938 N/A THR 203.A N ASP 201.A OD1 no hydrogen 3.041 N/A THR 203.A OG1 ASN 199.A OD1 no hydrogen 3.221 N/A THR 203.A OG1 ASP 201.A OD1 no hydrogen 2.744 N/A PHE 204.A N ASN 109.A OD1 no hydrogen 2.966 N/A LYS 205.A N ALA 197.A O no hydrogen 2.936 N/A LYS 205.A NZ LYS 196.A O no hydrogen 2.848 N/A SER 206.A N GLU 209.A OE1 no hydrogen 2.936 N/A SER 206.A OG GLU 209.A OE1 no hydrogen 3.334 N/A GLU 209.A N SER 206.A OG no hydrogen 3.079 N/A LEU 210.A N SER 206.A O no hydrogen 2.832 N/A ARG 211.A N ALA 207.A O no hydrogen 2.867 N/A ALA 212.A N GLU 208.A O no hydrogen 3.181 N/A LEU 213.A N LEU 210.A O no hydrogen 2.929 N/A TYR 214.A N ARG 211.A O no hydrogen 3.070 N/A GLU 215.A N ARG 211.A O no hydrogen 2.898 N/A LEU 217.A N TYR 214.A O no hydrogen 2.962 N/A GLY 218.A N GLU 215.A O no hydrogen 2.947 N/A ILE 219.A N TYR 214.A O no hydrogen 3.122 N/A THR 220.A OG1 ASP 222.A OD1 no hydrogen 2.614 N/A LYS 223.A N THR 220.A O no hydrogen 3.054 N/A LYS 223.A NZ GLY 218.A O no hydrogen 2.703 N/A ASP 224.A N LYS 161.A O no hydrogen 3.015 N/A ILE 225.A N HIS 249.A O no hydrogen 2.806 N/A VAL 226.A N ALA 163.A O no hydrogen 3.049 N/A VAL 227.A N LYS 251.A O no hydrogen 2.863 N/A TYR 228.A N VAL 165.A O no hydrogen 2.954 N/A TYR 228.A OH ASP 166.A OD2 no hydrogen 2.700 N/A ARG 229.A NE GLU 178.A OE2 no hydrogen 2.760 N/A ARG 229.A NH1 GLU 172.A OE1 no hydrogen 3.047 N/A ARG 229.A NH2 GLU 178.A OE2 no hydrogen 3.434 N/A GLU 232.A N GLU 232.A OE1 no hydrogen 2.674 N/A ARG 233.A N ILE 230.A O no hydrogen 2.974 N/A ARG 233.A NE GLU 178.A OE1 no hydrogen 3.425 N/A ARG 233.A NE GLU 178.A OE2 no hydrogen 3.011 N/A ARG 233.A NH1 GLU 30.A OE2 no hydrogen 2.561 N/A ARG 233.A NH2 GLU 30.A OE2 no hydrogen 2.917 N/A ARG 233.A NH2 GLU 178.A OE1 no hydrogen 2.790 N/A SER 234.A N ALA 231.A O no hydrogen 3.100 N/A SER 234.A OG ALA 231.A O no hydrogen 3.285 N/A SER 234.A OG ASN 252.A OD1 no hydrogen 2.620 N/A SER 235.A N ALA 231.A O no hydrogen 3.198 N/A SER 235.A OG ALA 231.A O no hydrogen 2.793 N/A HIS 236.A NE2 ASN 87.A O no hydrogen 3.081 N/A TRP 238.A N SER 234.A O no hydrogen 3.145 N/A TRP 238.A NE1 VAL 250.A O no hydrogen 3.019 N/A PHE 239.A N SER 235.A O no hydrogen 2.889 N/A VAL 240.A N HIS 236.A O no hydrogen 3.067 N/A LEU 241.A N SER 237.A O no hydrogen 2.974 N/A LYS 242.A N TRP 238.A O no hydrogen 2.935 N/A TYR 243.A N PHE 239.A O no hydrogen 2.903 N/A LEU 244.A N PHE 239.A O no hydrogen 3.384 N/A LEU 245.A N VAL 240.A O no hydrogen 2.914 N/A TYR 247.A N LEU 241.A O no hydrogen 2.895 N/A TYR 247.A OH ILE 219.A O no hydrogen 2.651 N/A LYS 251.A N ILE 225.A O no hydrogen 2.793 N/A ASN 252.A N ILE 143.A O no hydrogen 2.912 N/A ASN 252.A ND2 ALA 231.A O no hydrogen 3.447 N/A TYR 253.A N VAL 227.A O no hydrogen 2.891 N/A TYR 253.A OH GLU 259.A OE1 no hydrogen 2.611 N/A SER 256.A OG TYR 253.A O no hydrogen 2.597 N/A TRP 257.A NE1 ARG 182.A O no hydrogen 2.935 N/A THR 258.A N ARG 229.A O no hydrogen 3.090 N/A THR 258.A OG1 ARG 229.A O no hydrogen 2.732 N/A THR 258.A OG1 GLY 255.A O no hydrogen 3.070 N/A GLU 259.A N GLY 255.A O no hydrogen 3.337 N/A GLU 259.A N SER 256.A O no hydrogen 3.161 N/A TRP 260.A N SER 256.A O no hydrogen 2.895 N/A TRP 260.A NE1 PRO 267.A O no hydrogen 2.922 N/A GLY 261.A N TRP 257.A O no hydrogen 2.704 N/A ASN 262.A N GLU 259.A O no hydrogen 3.069 N/A LEU 263.A N TRP 260.A O no hydrogen 3.197 N/A ALA 269.A N HIS 185.A O no hydrogen 2.846 N/A GLY 271.A N ARG 174.A O no hydrogen 2.836 N/A