Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1tue_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 GLU 11.A OE2 no hydrogen 2.824 N/A THR 4.A N GLU 7.A OE1 no hydrogen 2.870 N/A THR 8.A N THR 4.A O no hydrogen 2.961 N/A THR 8.A OG1 GLN 3.A OE1 no hydrogen 2.981 N/A THR 8.A OG1 THR 4.A O no hydrogen 3.334 N/A LEU 9.A N PRO 5.A O no hydrogen 2.991 N/A SER 10.A N LYS 6.A O no hydrogen 2.810 N/A SER 10.A OG ASN 60.A OD1 no hydrogen 2.284 N/A GLU 11.A N GLU 7.A O no hydrogen 2.954 N/A ARG 12.A N THR 8.A O no hydrogen 3.104 N/A LEU 13.A N LEU 9.A O no hydrogen 2.929 N/A SER 14.A N SER 10.A O no hydrogen 2.941 N/A ALA 15.A N GLU 11.A O no hydrogen 3.411 N/A LEU 16.A N ARG 12.A O no hydrogen 3.097 N/A GLN 17.A N LEU 13.A O no hydrogen 2.804 N/A GLN 17.A NE2 GLU 44.A OE2 no hydrogen 2.893 N/A ASP 18.A N SER 14.A O no hydrogen 3.083 N/A LYS 19.A N ALA 15.A O no hydrogen 3.104 N/A ILE 20.A N LEU 16.A O no hydrogen 2.886 N/A ILE 21.A N GLN 17.A O no hydrogen 3.239 N/A ASP 22.A N ASP 18.A O no hydrogen 2.999 N/A HIS 23.A N LYS 19.A O no hydrogen 3.099 N/A TYR 24.A N ILE 20.A O no hydrogen 3.288 N/A TYR 24.A OH TYR 37.A OH no hydrogen 2.585 N/A GLU 25.A N ILE 21.A O no hydrogen 2.878 N/A ASN 26.A N ASP 22.A O no hydrogen 2.785 N/A ASP 27.A N HIS 23.A O no hydrogen 3.025 N/A SER 28.A OG SER 33.A OG no hydrogen 2.668 N/A ASP 30.A N SER 28.A OG no hydrogen 3.177 N/A ASP 32.A N ASP 30.A OD1 no hydrogen 2.942 N/A SER 33.A N ASP 30.A O no hydrogen 2.890 N/A SER 33.A OG SER 28.A OG no hydrogen 2.668 N/A GLN 34.A N ILE 31.A O no hydrogen 3.028 N/A GLN 34.A NE2 TRP 97.A O no hydrogen 3.006 N/A ILE 35.A N ILE 31.A O no hydrogen 3.080 N/A GLN 36.A N ASP 32.A O no hydrogen 3.186 N/A TYR 37.A N SER 33.A O no hydrogen 2.820 N/A TYR 37.A OH TYR 24.A OH no hydrogen 2.585 N/A TRP 38.A N GLN 34.A O no hydrogen 2.979 N/A TRP 38.A NE1 THR 102.A O no hydrogen 3.066 N/A GLN 39.A N ILE 35.A O no hydrogen 3.105 N/A LEU 40.A N GLN 36.A O no hydrogen 3.016 N/A ILE 41.A N TYR 37.A O no hydrogen 3.158 N/A ARG 42.A N TRP 38.A O no hydrogen 3.078 N/A ARG 42.A NH1 GLN 81.A OE1 no hydrogen 2.760 N/A TRP 43.A N GLN 39.A O no hydrogen 2.942 N/A GLU 44.A N LEU 40.A O no hydrogen 2.782 N/A ASN 45.A N ILE 41.A O no hydrogen 3.057 N/A ASN 45.A ND2 ILE 41.A O no hydrogen 3.033 N/A ALA 46.A N ARG 42.A O no hydrogen 2.912 N/A ILE 47.A N TRP 43.A O no hydrogen 2.981 N/A PHE 48.A N GLU 44.A O no hydrogen 3.139 N/A PHE 49.A N ASN 45.A O no hydrogen 2.977 N/A ALA 50.A N ALA 46.A O no hydrogen 3.041 N/A ALA 51.A N ILE 47.A O no hydrogen 2.842 N/A ARG 52.A N PHE 48.A O no hydrogen 3.219 N/A ARG 52.A NE PRO 65.A O no hydrogen 2.767 N/A ARG 52.A NH2 VAL 64.A O no hydrogen 2.807 N/A ARG 52.A NH2 PRO 65.A O no hydrogen 3.231 N/A GLU 53.A N PHE 49.A O no hydrogen 3.057 N/A HIS 54.A N ALA 51.A O no hydrogen 3.021 N/A GLY 55.A N ARG 52.A O no hydrogen 2.937 N/A ILE 56.A N ALA 51.A O no hydrogen 2.874 N/A LEU 59.A N GLN 62.A O no hydrogen 2.813 N/A ASN 60.A ND2 SER 10.A O no hydrogen 2.524 N/A GLN 62.A N LEU 59.A O no hydrogen 2.803 N/A GLN 62.A NE2 ASN 60.A O no hydrogen 3.037 N/A VAL 64.A N GLN 57.A O no hydrogen 3.050 N/A ILE 69.A N ALA 66.A O no hydrogen 2.971 N/A SER 70.A N ALA 66.A O no hydrogen 3.095 N/A LYS 71.A N TYR 67.A O no hydrogen 2.911 N/A SER 72.A N ASN 68.A O no hydrogen 2.963 N/A LYS 73.A N ILE 69.A O no hydrogen 2.972 N/A ALA 74.A N SER 70.A O no hydrogen 3.053 N/A HIS 75.A N LYS 71.A O no hydrogen 2.936 N/A LYS 76.A N SER 72.A O no hydrogen 3.000 N/A LYS 76.A NZ ASN 108.A OD1 no hydrogen 3.224 N/A ALA 77.A N LYS 73.A O no hydrogen 2.980 N/A ILE 78.A N ALA 74.A O no hydrogen 2.889 N/A GLU 79.A N HIS 75.A O no hydrogen 3.040 N/A LEU 80.A N LYS 76.A O no hydrogen 3.108 N/A GLN 81.A N ALA 77.A O no hydrogen 2.905 N/A MET 82.A N ILE 78.A O no hydrogen 2.866 N/A ALA 83.A N GLU 79.A O no hydrogen 3.143 N/A LEU 84.A N LEU 80.A O no hydrogen 2.928 N/A GLN 85.A N GLN 81.A O no hydrogen 2.809 N/A GLY 86.A N MET 82.A O no hydrogen 3.100 N/A LEU 87.A N ALA 83.A O no hydrogen 2.938 N/A ALA 88.A N LEU 84.A O no hydrogen 2.824 N/A GLN 89.A N GLY 86.A O no hydrogen 3.035 N/A SER 90.A N LEU 87.A O no hydrogen 3.059 N/A SER 90.A OG LEU 87.A O no hydrogen 2.627 N/A TYR 92.A N SER 90.A OG no hydrogen 3.027 N/A LYS 93.A N SER 90.A O no hydrogen 3.324 N/A GLU 95.A N TYR 92.A O no hydrogen 3.236 N/A TRP 97.A N LYS 29.A O no hydrogen 2.816 N/A TRP 97.A NE1 TYR 92.A O no hydrogen 2.787 N/A THR 98.A N ASP 101.A OD2 no hydrogen 3.041 N/A ASP 101.A N THR 98.A OG1 no hydrogen 3.066 N/A THR 102.A N LEU 99.A O no hydrogen 3.234 N/A THR 102.A OG1 THR 98.A O no hydrogen 2.665 N/A CYS 103.A SG GLN 100.A O no hydrogen 3.552 N/A TRP 107.A N CYS 103.A O no hydrogen 3.161 N/A TRP 107.A NE1 GLU 79.A OE2 no hydrogen 2.701 N/A ASN 108.A N GLU 104.A O no hydrogen 2.819 N/A ASN 108.A ND2 GLU 104.A OE2 no hydrogen 3.218 N/A THR 109.A N LEU 106.A O no hydrogen 2.936 N/A THR 109.A OG1 GLU 105.A O no hydrogen 2.701 N/A CYS 114.A SG THR 112.A O no hydrogen 3.715 N/A CYS 114.A SG TYR 165.A OH no hydrogen 3.632 N/A PHE 115.A N TYR 143.A O no hydrogen 3.039 N/A LYS 116.A NZ LEU 106.A O no hydrogen 2.868 N/A LYS 116.A NZ THR 109.A O no hydrogen 2.729 N/A LYS 116.A NZ PRO 111.A O no hydrogen 2.729 N/A LYS 116.A NZ CYS 114.A O no hydrogen 2.872 N/A LYS 117.A N SER 141.A O no hydrogen 3.019 N/A LYS 117.A NZ GLU 95.A OE1 no hydrogen 2.917 N/A LYS 117.A NZ ASP 96.A O no hydrogen 2.760 N/A GLN 120.A N ALA 138.A O no hydrogen 2.819 N/A VAL 122.A N TYR 136.A O no hydrogen 2.706 N/A GLN 123.A N HIS 193.A O no hydrogen 3.262 N/A VAL 124.A N MET 134.A O no hydrogen 3.049 N/A TYR 125.A N GLU 191.A O no hydrogen 2.896 N/A TYR 125.A OH GLN 123.A OE1 no hydrogen 3.274 N/A PHE 126.A N ASN 132.A O no hydrogen 3.053 N/A ASP 127.A N THR 189.A O no hydrogen 3.142 N/A ASN 129.A N PHE 126.A O no hydrogen 3.175 N/A ASP 131.A N ASN 129.A OD1 no hydrogen 3.235 N/A ASN 132.A N ASN 129.A O no hydrogen 3.403 N/A CYS 133.A SG VAL 124.A O no hydrogen 3.472 N/A MET 134.A N VAL 124.A O no hydrogen 2.966 N/A TYR 136.A N VAL 122.A O no hydrogen 2.794 N/A TYR 136.A OH GLU 180.A OE2 no hydrogen 2.496 N/A ALA 138.A N GLN 120.A O no hydrogen 2.682 N/A TRP 139.A N TYR 174.A OH no hydrogen 3.482 N/A TRP 139.A NE1 GLU 110.A O no hydrogen 3.002 N/A ASP 140.A N GLY 118.A O no hydrogen 2.737 N/A SER 141.A N LYS 117.A O no hydrogen 3.010 N/A VAL 142.A N THR 154.A O no hydrogen 2.725 N/A TYR 143.A N PHE 115.A O no hydrogen 2.781 N/A TYR 143.A OH GLU 95.A OE1 no hydrogen 2.557 N/A TYR 143.A OH GLU 95.A OE2 no hydrogen 3.378 N/A TYR 144.A N ASP 152.A O no hydrogen 2.925 N/A THR 146.A N THR 150.A O no hydrogen 2.772 N/A THR 146.A OG1 THR 150.A O no hydrogen 3.116 N/A THR 146.A OG1 THR 150.A OG1 no hydrogen 2.915 N/A ASP 147.A N GLU 168.A OE2 no hydrogen 2.930 N/A GLY 149.A N THR 146.A O no hydrogen 2.834 N/A THR 150.A N THR 146.A OG1 no hydrogen 3.173 N/A THR 150.A OG1 THR 146.A OG1 no hydrogen 2.915 N/A ASP 152.A N TYR 144.A O no hydrogen 2.908 N/A LYS 153.A NZ GLU 95.A OE2 no hydrogen 2.786 N/A LYS 153.A NZ TYR 143.A OH no hydrogen 3.393 N/A THR 154.A N VAL 142.A O no hydrogen 2.894 N/A THR 156.A OG1 TRP 139.A O no hydrogen 2.713 N/A THR 156.A OG1 TYR 174.A OH no hydrogen 3.276 N/A CYS 157.A N TYR 164.A O no hydrogen 2.683 N/A SER 159.A N GLY 162.A O no hydrogen 3.114 N/A SER 159.A OG GLY 162.A O no hydrogen 3.276 N/A ARG 161.A NE GLU 176.A OE2 no hydrogen 3.106 N/A ARG 161.A NH2 GLU 176.A OE1 no hydrogen 3.017 N/A LEU 163.A N ILE 175.A O no hydrogen 3.035 N/A TYR 164.A N CYS 157.A O no hydrogen 2.984 N/A TYR 165.A N THR 172.A O no hydrogen 2.976 N/A LYS 167.A N TYR 170.A O no hydrogen 2.768 N/A GLU 168.A N TYR 144.A OH no hydrogen 3.092 N/A TYR 170.A N LYS 167.A O no hydrogen 2.986 N/A THR 172.A N TYR 165.A O no hydrogen 2.808 N/A THR 172.A OG1 TYR 170.A O no hydrogen 2.837 N/A TYR 174.A N LEU 163.A O no hydrogen 2.765 N/A TYR 174.A OH VAL 137.A O no hydrogen 3.142 N/A TYR 174.A OH THR 156.A OG1 no hydrogen 3.276 N/A ILE 175.A N LEU 163.A O no hydrogen 3.332 N/A PHE 177.A N ARG 161.A O no hydrogen 2.798 N/A GLU 180.A N GLU 176.A O no hydrogen 3.167 N/A CYS 181.A N PHE 177.A O no hydrogen 2.822 N/A GLU 182.A N LYS 178.A O no hydrogen 2.923 N/A LYS 183.A NZ TYR 184.A OH no hydrogen 2.744 N/A TYR 184.A N CYS 181.A O no hydrogen 3.069 N/A GLY 185.A N CYS 181.A O no hydrogen 3.030 N/A ASN 186.A N CYS 181.A O no hydrogen 3.183 N/A THR 187.A OG1 ASP 127.A OD1 no hydrogen 2.460 N/A THR 187.A OG1 THR 189.A OG1 no hydrogen 2.635 N/A THR 189.A OG1 THR 187.A OG1 no hydrogen 2.635 N/A TRP 190.A NE1 HIS 160.A O no hydrogen 2.986 N/A GLU 191.A N TYR 125.A O no hydrogen 2.857 N/A HIS 193.A N GLN 123.A O no hydrogen 2.738 N/A HIS 193.A NE2 GLU 191.A OE1 no hydrogen 2.827 N/A