Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ubi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N HIS 25.A O no hydrogen 3.185 N/A ALA 5.A N ARG 23.A O no hydrogen 2.822 N/A GLN 6.A N GLN 114.A OE1 no hydrogen 3.046 N/A GLN 6.A NE2 TYR 94.A O no hydrogen 2.912 N/A SER 7.A N SER 21.A O no hydrogen 3.042 N/A SER 7.A OG SER 21.A O no hydrogen 3.543 N/A SER 9.A OG THR 117.A OG1 no hydrogen 3.391 N/A GLU 10.A N THR 117.A O no hydrogen 2.959 N/A LYS 12.A N ILE 119.A O no hydrogen 2.746 N/A LYS 12.A NZ GLU 10.A OE2 no hydrogen 3.557 N/A GLY 15.A N LEU 86C.A O no hydrogen 2.728 N/A ALA 16.A N LYS 13.A O no hydrogen 2.989 N/A VAL 18.A N VAL 83.A O no hydrogen 2.954 N/A VAL 20.A N LEU 81.A O no hydrogen 2.736 N/A SER 21.A N SER 7.A OG no hydrogen 3.136 N/A CYS 22.A N GLY 79.A O no hydrogen 2.788 N/A ARG 23.A N ALA 5.A O no hydrogen 2.819 N/A ARG 23.A NE ILE 76.A O no hydrogen 2.931 N/A ARG 23.A NH1 ILE 76.A O no hydrogen 3.541 N/A LEU 24.A N SER 77.A O no hydrogen 3.029 N/A HIS 25.A N TYR 3.A O no hydrogen 2.874 N/A LYS 28.A N ASP 27.A OD1 no hydrogen 2.398 N/A ALA 31.A N LYS 28.A O no hydrogen 3.259 N/A TYR 33.A N THR 101.A OG1 no hydrogen 3.007 N/A TYR 33.A OH ASP 104.A O no hydrogen 3.333 N/A ILE 34.A N PHE 51.A O no hydrogen 3.463 N/A HIS 35.A N ALA 97.A O no hydrogen 2.765 N/A HIS 35.A NE2 ASP 99.A OD2 no hydrogen 2.608 N/A TRP 36.A N GLY 49.A O no hydrogen 2.835 N/A VAL 37.A N TYR 95.A O no hydrogen 2.892 N/A ARG 38.A N GLU 46.A O no hydrogen 2.948 N/A ARG 38.A NE GLU 46.A OE2 no hydrogen 2.950 N/A ARG 38.A NH1 ASP 90.A OD1 no hydrogen 2.953 N/A ARG 38.A NH1 TYR 94.A OH no hydrogen 3.108 N/A ARG 38.A NH2 GLU 46.A OE2 no hydrogen 3.478 N/A GLN 39.A N VAL 93.A O no hydrogen 3.030 N/A GLN 39.A NE2 GLN 43.A O no hydrogen 3.206 N/A GLN 43.A N ALA 40.A O no hydrogen 3.014 N/A GLU 46.A N ARG 38.A O no hydrogen 2.877 N/A TRP 47.A NE1 HIS 35.A ND1 no hydrogen 3.241 N/A LEU 48.A N TRP 36.A O no hydrogen 3.053 N/A PHE 50.A N VAL 59.A O no hydrogen 2.990 N/A PHE 51.A N ILE 34.A O no hydrogen 3.045 N/A HIS 52.A N ASP 57.A O no hydrogen 2.593 N/A THR 55.A N HIS 52.A ND1 no hydrogen 3.096 N/A GLY 56.A N HIS 52.A O no hydrogen 2.716 N/A ASP 57.A N THR 55.A OG1 no hydrogen 3.342 N/A VAL 59.A N PHE 50.A O no hydrogen 2.980 N/A ALA 61.A N LEU 48.A O no hydrogen 2.688 N/A LYS 63.A NZ GLU 46.A OE1 no hydrogen 2.633 N/A PHE 64.A N ALA 61.A O no hydrogen 2.933 N/A GLN 65.A N GLN 62.A O no hydrogen 3.276 N/A GLN 65.A NE2 SER 60.A O no hydrogen 3.118 N/A ARG 67.A N PHE 64.A O no hydrogen 2.842 N/A ARG 67.A NE ARG 84A.A O no hydrogen 2.981 N/A ARG 67.A NH1 ASP 90.A OD1 no hydrogen 3.152 N/A ARG 67.A NH2 ASP 90.A OD1 no hydrogen 2.854 N/A ARG 67.A NH2 ASP 90.A OD2 no hydrogen 2.158 N/A ARG 67.A NH2 ARG 85B.A O no hydrogen 3.337 N/A ILE 68.A N PHE 64.A O no hydrogen 3.113 N/A SER 69.A N GLU 82.A O no hydrogen 3.143 N/A SER 69.A OG GLU 82.A OE1 no hydrogen 3.220 N/A THR 71.A N TYR 80.A O no hydrogen 3.137 N/A ARG 72.A NE PRO 53A.A O no hydrogen 2.725 N/A ARG 72.A NH2 GLY 54.A O no hydrogen 2.926 N/A ASP 73.A N THR 78.A O no hydrogen 2.773 N/A SER 75.A OG ASP 73.A OD1 no hydrogen 2.845 N/A SER 77.A N THR 74.A O no hydrogen 3.170 N/A THR 78.A N ASP 73.A O no hydrogen 3.282 N/A THR 78.A OG1 ILE 76.A O no hydrogen 3.118 N/A GLY 79.A N CYS 22.A O no hydrogen 2.738 N/A TYR 80.A N THR 71.A O no hydrogen 2.726 N/A LEU 81.A N VAL 20.A O no hydrogen 2.764 N/A GLU 82.A N SER 69.A O no hydrogen 3.075 N/A VAL 83.A N VAL 18.A O no hydrogen 2.936 N/A SER 87.A N ASP 90.A OD2 no hydrogen 2.777 N/A ASP 89.A N SER 87.A OG no hydrogen 3.255 N/A ASP 90.A N SER 87.A O no hydrogen 3.007 N/A THR 91.A N SER 88.A O no hydrogen 3.171 N/A ALA 92.A N VAL 118.A O no hydrogen 3.180 N/A VAL 93.A N GLN 39.A O no hydrogen 3.104 N/A TYR 94.A N THR 116.A O no hydrogen 2.932 N/A TYR 94.A OH ASP 90.A O no hydrogen 2.534 N/A TYR 95.A N VAL 37.A O no hydrogen 2.662 N/A CYS 96.A N GLN 6.A OE1 no hydrogen 3.045 N/A ALA 97.A N HIS 35.A O no hydrogen 2.874 N/A ARG 98.A N ILE 111.A O no hydrogen 2.707 N/A ARG 98.A NE ASP 110.A OD1 no hydrogen 3.220 N/A ARG 98.A NH2 ASP 110.A OD1 no hydrogen 3.446 N/A ARG 98.A NH2 ASP 110.A OD2 no hydrogen 2.567 N/A ASP 99.A N TYR 33.A O no hydrogen 2.984 N/A LYS 100.A N GLY 108D.A O no hydrogen 2.753 N/A LYS 100.A NZ ASP 110.A OD2 no hydrogen 3.174 N/A THR 101.A N ASP 99.A OD1 no hydrogen 2.919 N/A THR 101.A OG1 ASP 99.A O no hydrogen 3.001 N/A TYR 102.A N THR 107C.A OG1 no hydrogen 2.601 N/A ASP 110.A N ARG 98.A O no hydrogen 2.948 N/A ILE 111.A N ARG 98.A O no hydrogen 3.501 N/A TRP 112.A NE1 MET 109E.A O no hydrogen 2.851 N/A GLY 113.A N CYS 96.A O no hydrogen 2.747 N/A GLN 114.A N GLN 114.A OE1 no hydrogen 2.758 N/A GLN 114.A NE2 GLN 6.A O no hydrogen 3.371 N/A GLY 115.A N GLN 6.A OE1 no hydrogen 2.965 N/A THR 116.A N TYR 94.A O no hydrogen 2.935 N/A VAL 118.A N ALA 92.A O no hydrogen 2.780 N/A ILE 119.A N GLU 10.A O no hydrogen 2.953 N/A VAL 120.A N THR 91.A OG1 no hydrogen 3.059 N/A SER 121.A N LYS 12.A O no hydrogen 2.754 N/A ALA 123.A N SER 121.A OG no hydrogen 2.960 N/A LYS 126.A N PHE 148.A O no hydrogen 2.738 N/A LYS 126.A NZ GLY 127.A O no hydrogen 3.069 N/A LYS 126.A NZ ASP 146.A O no hydrogen 3.045 N/A SER 129.A N LYS 145.A O no hydrogen 2.987 N/A PHE 131.A N LEU 143.A O no hydrogen 2.806 N/A LEU 133.A N GLY 141.A O no hydrogen 2.485 N/A THR 137.A OG1 SER 188.A OG no hydrogen 2.741 N/A ALA 138.A N VAL 186.A O no hydrogen 2.945 N/A LEU 140.A N VAL 184.A O no hydrogen 3.110 N/A GLY 141.A N LEU 133.A O no hydrogen 2.915 N/A CYS 142.A N SER 182.A O no hydrogen 3.008 N/A LEU 143.A N PHE 131.A O no hydrogen 2.604 N/A VAL 144.A N LEU 180.A O no hydrogen 2.721 N/A LYS 145.A N SER 129.A O no hydrogen 2.814 N/A LYS 145.A NZ GLN 173.A OE1 no hydrogen 3.211 N/A TYR 147.A N TYR 178.A O no hydrogen 3.111 N/A PHE 148.A N LYS 126.A O no hydrogen 2.924 N/A THR 153.A N ASN 201.A O no hydrogen 2.977 N/A SER 155.A N ASN 199.A O no hydrogen 2.993 N/A SER 155.A OG ASN 199.A OD1 no hydrogen 2.780 N/A TRP 156.A NE1 SER 182.A OG no hydrogen 3.087 N/A ASN 157.A N ILE 197.A O no hydrogen 2.769 N/A ASN 157.A ND2 THR 195.A O no hydrogen 3.216 N/A SER 158.A N ASN 199.A OD1 no hydrogen 2.747 N/A GLY 159.A N TRP 156.A O no hydrogen 3.165 N/A ALA 160.A N ASN 157.A O no hydrogen 3.211 N/A LEU 161.A N TRP 156.A O no hydrogen 3.098 N/A VAL 165.A N THR 162.A O no hydrogen 3.048 N/A HIS 166.A N VAL 183.A O no hydrogen 2.868 N/A THR 167.A OG1 SER 182.A OG no hydrogen 2.692 N/A PHE 168.A N SER 181.A O no hydrogen 3.033 N/A VAL 171.A N SER 179.A O no hydrogen 2.868 N/A GLN 173.A N LEU 177.A O no hydrogen 2.962 N/A GLN 173.A NE2 ASP 146.A OD1 no hydrogen 2.571 N/A GLN 173.A NE2 LEU 177.A O no hydrogen 3.537 N/A GLY 176.A N GLN 173.A O no hydrogen 3.010 N/A LEU 177.A N SER 175.A OG no hydrogen 3.221 N/A TYR 178.A N TYR 147.A O no hydrogen 2.865 N/A SER 179.A N VAL 171.A O no hydrogen 2.974 N/A SER 179.A OG VAL 144.A O no hydrogen 3.367 N/A LEU 180.A N VAL 144.A O no hydrogen 2.939 N/A SER 182.A N CYS 142.A O no hydrogen 3.136 N/A SER 182.A OG THR 167.A OG1 no hydrogen 2.692 N/A VAL 183.A N HIS 166.A O no hydrogen 2.762 N/A VAL 184.A N LEU 140.A O no hydrogen 2.934 N/A VAL 186.A N ALA 138.A O no hydrogen 2.907 N/A SER 188.A OG THR 137.A OG1 no hydrogen 2.741 N/A SER 190.A N PRO 187.A O no hydrogen 2.950 N/A SER 190.A OG PRO 187.A O no hydrogen 2.700 N/A SER 190.A OG TYR 196.A OH no hydrogen 2.559 N/A LEU 191.A N SER 188.A O no hydrogen 3.381 N/A GLN 194.A N SER 190.A O no hydrogen 2.634 N/A TYR 196.A OH SER 190.A OG no hydrogen 2.559 N/A ILE 197.A N ASN 157.A OD1 no hydrogen 2.772 N/A CYS 198.A N LYS 211.A O no hydrogen 2.918 N/A CYS 198.A SG LYS 211.A O no hydrogen 3.980 N/A ASN 199.A N SER 155.A O no hydrogen 2.877 N/A ASN 199.A ND2 ASP 210.A OD2 no hydrogen 3.029 N/A VAL 200.A N VAL 209.A O no hydrogen 2.739 N/A ASN 201.A N THR 153.A O no hydrogen 2.866 N/A HIS 202.A N THR 207.A O no hydrogen 2.828 N/A HIS 202.A ND1 SER 205.A OG no hydrogen 2.538 N/A HIS 202.A NE2 PRO 149.A O no hydrogen 2.581 N/A SER 205.A OG HIS 202.A ND1 no hydrogen 2.538 N/A SER 205.A OG HIS 202.A O no hydrogen 3.470 N/A SER 205.A OG THR 207.A OG1 no hydrogen 3.271 N/A ASN 206.A N LYS 203.A O no hydrogen 2.956 N/A THR 207.A N HIS 202.A O no hydrogen 2.905 N/A THR 207.A OG1 SER 205.A OG no hydrogen 3.271 N/A LYS 208.A NZ ASP 210.A OD2 no hydrogen 2.930 N/A VAL 209.A N VAL 200.A O no hydrogen 2.898 N/A LYS 211.A N CYS 198.A O no hydrogen 2.987 N/A LYS 212.A NZ GLU 214.A OE1 no hydrogen 3.395 N/A LYS 212.A NZ GLU 214.A OE2 no hydrogen 3.114 N/A VAL 213.A N TYR 196.A O no hydrogen 2.648 N/A ARG 84A.A N ARG 67.A O no hydrogen 3.099 N/A ARG 84A.A NE GLU 82.A OE1 no hydrogen 2.589 N/A ARG 84A.A NH1 SER 69.A OG no hydrogen 2.988 N/A ARG 84A.A NH1 GLU 82.A OE1 no hydrogen 3.479 N/A GLU 105A.A N TYR 102.A O no hydrogen 3.085 N/A LEU 86C.A N ALA 16.A O no hydrogen 3.016 N/A THR 107C.A N ASP 99.A OD1 no hydrogen 2.774 N/A THR 107C.A N ASP 99.A OD2 no hydrogen 3.161 N/A THR 107C.A OG1 GLU 105A.A O no hydrogen 2.888 N/A GLY 108D.A N ASP 99.A OD1 no hydrogen 2.944 N/A GLY 108D.A N ASP 99.A OD2 no hydrogen 3.443 N/A