Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qen_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 ALA 95.A O no hydrogen 2.342 N/A ARG 2.A NH2 GLU 96.A O no hydrogen 3.350 N/A LYS 4.A N PRO 98.A O no hydrogen 3.323 N/A LYS 5.A N ASP 149.A OD2 no hydrogen 2.534 N/A LYS 5.A NZ GLU 147.A O no hydrogen 2.840 N/A LYS 5.A NZ ASP 149.A OD2 no hydrogen 2.861 N/A ILE 6.A N LEU 100.A O no hydrogen 2.993 N/A SER 7.A N GLY 150.A O no hydrogen 3.219 N/A SER 7.A OG GLU 9.A OE1 no hydrogen 2.342 N/A ILE 8.A N PHE 102.A O no hydrogen 2.674 N/A GLU 9.A N ILE 152.A O no hydrogen 2.965 N/A ASN 11.A ND2 LEU 181.A O no hydrogen 2.800 N/A ALA 14.A N ASN 11.A O no hydrogen 2.888 N/A LYS 16.A NZ GLY 10.A O no hydrogen 2.335 N/A PHE 19.A N GLY 15.A O no hydrogen 2.863 N/A VAL 20.A N LYS 16.A O no hydrogen 2.891 N/A ASN 21.A N SER 17.A O no hydrogen 2.820 N/A ILE 22.A N THR 18.A O no hydrogen 3.025 N/A ILE 22.A N PHE 19.A O no hydrogen 3.119 N/A LEU 23.A N PHE 19.A O no hydrogen 2.957 N/A LYS 24.A N VAL 20.A O no hydrogen 3.166 N/A LEU 26.A N LEU 23.A O no hydrogen 3.076 N/A ASP 29.A N SER 27.A OG no hydrogen 3.181 N/A TRP 30.A N SER 27.A O no hydrogen 2.933 N/A GLU 31.A N VAL 99.A O no hydrogen 2.812 N/A VAL 33.A N PHE 101.A O no hydrogen 3.268 N/A GLU 35.A N GLU 103.A OE2 no hydrogen 2.789 N/A ALA 38.A N GLU 35.A O no hydrogen 2.964 N/A ARG 39.A N PRO 36.A O no hydrogen 3.163 N/A TRP 40.A N VAL 37.A O no hydrogen 3.368 N/A SER 41.A OG ALA 38.A O no hydrogen 2.928 N/A GLN 51.A N THR 48.A OG1 no hydrogen 2.966 N/A LYS 52.A N THR 48.A O no hydrogen 2.756 N/A ASN 53.A N MET 49.A O no hydrogen 3.107 N/A GLY 54.A N GLU 50.A O no hydrogen 2.652 N/A GLY 55.A N GLN 51.A O no hydrogen 2.502 N/A ASN 56.A N LYS 52.A O no hydrogen 2.948 N/A VAL 57.A N ASN 53.A O no hydrogen 3.052 N/A LEU 58.A N GLY 54.A O no hydrogen 2.923 N/A GLN 59.A N GLY 55.A O no hydrogen 3.239 N/A MET 60.A N ASN 56.A O no hydrogen 2.967 N/A MET 61.A N VAL 57.A O no hydrogen 2.707 N/A TYR 62.A N LEU 58.A O no hydrogen 3.061 N/A GLU 63.A N GLN 59.A O no hydrogen 3.211 N/A LYS 64.A N MET 60.A O no hydrogen 2.958 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.725 N/A ARG 67.A N LYS 64.A O no hydrogen 3.095 N/A ARG 67.A NH1 ARG 67.A O no hydrogen 2.801 N/A TRP 68.A N LYS 64.A O no hydrogen 3.188 N/A TRP 68.A N PRO 65.A O no hydrogen 3.197 N/A SER 69.A N PRO 65.A O no hydrogen 2.878 N/A SER 69.A OG PRO 65.A O no hydrogen 2.740 N/A PHE 72.A N TRP 68.A O no hydrogen 2.874 N/A GLN 73.A N SER 69.A O no hydrogen 2.917 N/A THR 74.A N PHE 70.A O no hydrogen 2.887 N/A THR 74.A OG1 PHE 70.A O no hydrogen 2.645 N/A TYR 75.A N THR 71.A O no hydrogen 3.103 N/A ALA 76.A N PHE 72.A O no hydrogen 2.731 N/A CYS 77.A N GLN 73.A O no hydrogen 3.144 N/A CYS 77.A SG ASP 109.A OD2 no hydrogen 3.818 N/A LEU 78.A N THR 74.A O no hydrogen 3.194 N/A SER 79.A N TYR 75.A O no hydrogen 2.972 N/A SER 79.A OG TYR 75.A O no hydrogen 3.162 N/A ARG 80.A N ALA 76.A O no hydrogen 2.898 N/A ARG 80.A NH1 ASP 109.A OD2 no hydrogen 3.116 N/A ARG 80.A NH2 GLU 35.A OE1 no hydrogen 3.134 N/A ARG 80.A NH2 GLU 103.A O no hydrogen 2.358 N/A ILE 81.A N CYS 77.A O no hydrogen 2.759 N/A ARG 82.A N LEU 78.A O no hydrogen 2.745 N/A ARG 82.A NH1 GLU 50.A OE1 no hydrogen 3.517 N/A ALA 83.A N SER 79.A O no hydrogen 3.057 N/A GLN 84.A N ARG 80.A O no hydrogen 2.872 N/A GLN 84.A NE2 ARG 104.A O no hydrogen 3.566 N/A LEU 85.A N ILE 81.A O no hydrogen 3.084 N/A ALA 86.A N ARG 82.A O no hydrogen 3.015 N/A SER 87.A N ALA 83.A O no hydrogen 3.219 N/A LEU 88.A N GLN 84.A O no hydrogen 3.066 N/A ASN 89.A N LEU 85.A O no hydrogen 2.785 N/A ASN 89.A ND2 LEU 85.A O no hydrogen 3.117 N/A GLY 90.A N SER 87.A O no hydrogen 3.225 N/A LYS 91.A N SER 87.A O no hydrogen 2.785 N/A LYS 91.A NZ SER 87.A OG no hydrogen 3.006 N/A LYS 93.A NZ ASN 89.A O no hydrogen 2.980 N/A ASP 94.A N ASP 94.A OD2 no hydrogen 2.531 N/A ALA 95.A N LEU 92.A O no hydrogen 3.207 N/A LYS 97.A N ASP 29.A OD2 no hydrogen 2.612 N/A VAL 99.A N ASP 29.A O no hydrogen 2.953 N/A LEU 100.A N LYS 4.A O no hydrogen 2.882 N/A PHE 101.A N GLU 31.A O no hydrogen 2.875 N/A PHE 102.A N ILE 6.A O no hydrogen 2.674 N/A GLU 103.A N VAL 33.A O no hydrogen 3.043 N/A ARG 104.A N ILE 8.A O no hydrogen 2.918 N/A ARG 104.A NE GLY 10.A O no hydrogen 3.476 N/A ARG 104.A NH1 GLU 35.A OE1 no hydrogen 2.958 N/A ARG 104.A NH2 GLY 10.A O no hydrogen 2.898 N/A SER 105.A N SER 108.A OG no hydrogen 2.984 N/A SER 105.A OG GLU 9.A OE1 no hydrogen 2.862 N/A TYR 107.A N SER 105.A OG no hydrogen 3.201 N/A TYR 107.A OH TYR 203.A OH no hydrogen 2.345 N/A SER 108.A N SER 105.A OG no hydrogen 3.355 N/A SER 108.A OG GLU 9.A OE1 no hydrogen 3.412 N/A SER 108.A OG GLU 9.A OE2 no hydrogen 2.842 N/A SER 108.A OG SER 105.A O no hydrogen 3.068 N/A ASP 109.A N SER 105.A O no hydrogen 3.415 N/A ARG 110.A N VAL 106.A O no hydrogen 3.338 N/A ARG 110.A NH1 HIS 135.A ND1 no hydrogen 3.222 N/A ARG 110.A NH1 ASP 136.A OD1 no hydrogen 2.827 N/A TYR 111.A N TYR 107.A O no hydrogen 2.753 N/A ILE 112.A N SER 108.A O no hydrogen 3.218 N/A PHE 113.A N SER 108.A O no hydrogen 3.162 N/A ALA 114.A N ASP 109.A O no hydrogen 2.851 N/A SER 115.A N ARG 110.A O no hydrogen 2.827 N/A ASN 116.A N ILE 112.A O no hydrogen 3.109 N/A LEU 117.A N PHE 113.A O no hydrogen 2.992 N/A TYR 118.A N ALA 114.A O no hydrogen 3.159 N/A GLU 119.A N SER 115.A O no hydrogen 2.942 N/A SER 120.A N ASN 116.A O no hydrogen 2.686 N/A SER 120.A OG ASN 116.A O no hydrogen 2.593 N/A SER 120.A OG ASN 116.A OD1 no hydrogen 3.359 N/A GLU 121.A N TYR 118.A O no hydrogen 2.808 N/A SER 122.A N LEU 117.A O no hydrogen 2.722 N/A SER 122.A OG LEU 117.A O no hydrogen 3.569 N/A SER 122.A OG SER 120.A O no hydrogen 3.506 N/A ASN 124.A N GLU 127.A OE1 no hydrogen 2.911 N/A GLU 127.A N ASN 124.A OD1 no hydrogen 2.783 N/A TRP 128.A N ASN 124.A O no hydrogen 2.912 N/A THR 129.A N GLU 125.A O no hydrogen 2.763 N/A ILE 130.A N THR 126.A O no hydrogen 2.842 N/A TYR 131.A N GLU 127.A O no hydrogen 2.874 N/A GLN 132.A N TRP 128.A O no hydrogen 2.905 N/A ASP 133.A N THR 129.A O no hydrogen 3.096 N/A TRP 134.A N ILE 130.A O no hydrogen 2.771 N/A HIS 135.A N TYR 131.A O no hydrogen 2.653 N/A HIS 135.A NE2 VAL 106.A O no hydrogen 3.038 N/A ASP 136.A N GLN 132.A O no hydrogen 2.832 N/A TRP 137.A N ASP 133.A O no hydrogen 2.985 N/A MET 138.A N TRP 134.A O no hydrogen 2.773 N/A ASN 139.A N HIS 135.A O no hydrogen 3.179 N/A ASN 139.A ND2 HIS 135.A O no hydrogen 3.119 N/A ASN 140.A N ASP 136.A O no hydrogen 3.027 N/A ASN 140.A N TRP 137.A O no hydrogen 3.272 N/A PHE 142.A N MET 138.A O no hydrogen 3.125 N/A GLN 144.A NE2 ASN 140.A O no hydrogen 2.418 N/A SER 145.A N PHE 142.A O no hydrogen 3.411 N/A LEU 146.A N GLY 143.A O no hydrogen 2.870 N/A LEU 148.A N TYR 203.A OH no hydrogen 3.013 N/A ASP 149.A N LYS 5.A O no hydrogen 2.683 N/A GLY 150.A N LYS 5.A O no hydrogen 3.259 N/A ILE 151.A N PRO 208.A O no hydrogen 3.008 N/A ILE 152.A N SER 7.A O no hydrogen 2.821 N/A TYR 153.A N LEU 210.A O no hydrogen 2.696 N/A TYR 153.A OH GLU 189.A OE2 no hydrogen 2.579 N/A LEU 154.A N GLU 9.A O no hydrogen 2.880 N/A GLN 155.A N LEU 212.A O no hydrogen 2.741 N/A GLN 155.A NE2 GLU 189.A OE2 no hydrogen 2.735 N/A THR 157.A N ASN 215.A OD1 no hydrogen 3.017 N/A THR 157.A OG1 THR 160.A OG1 no hydrogen 2.985 N/A THR 157.A OG1 ASN 215.A OD1 no hydrogen 3.152 N/A THR 160.A N THR 157.A OG1 no hydrogen 3.111 N/A THR 160.A OG1 THR 157.A OG1 no hydrogen 2.985 N/A THR 160.A OG1 ASN 215.A OD1 no hydrogen 2.355 N/A CYS 161.A N THR 157.A O no hydrogen 3.176 N/A CYS 161.A SG THR 157.A O no hydrogen 3.813 N/A LEU 162.A N PRO 158.A O no hydrogen 3.132 N/A HIS 163.A N GLU 159.A O no hydrogen 3.223 N/A ARG 164.A N THR 160.A O no hydrogen 2.785 N/A ARG 164.A NH1 VAL 214.A O no hydrogen 3.303 N/A ARG 164.A NH2 VAL 214.A O no hydrogen 3.061 N/A ILE 165.A N CYS 161.A O no hydrogen 2.632 N/A TYR 166.A N LEU 162.A O no hydrogen 2.671 N/A LEU 167.A N HIS 163.A O no hydrogen 2.461 N/A ARG 168.A N ILE 165.A O no hydrogen 3.207 N/A ARG 168.A NH1 GLU 173.A OE1 no hydrogen 2.749 N/A GLY 169.A N ILE 165.A O no hydrogen 3.354 N/A ARG 170.A NH1 GLU 173.A OE1 no hydrogen 3.427 N/A ARG 170.A NH1 GLU 173.A OE2 no hydrogen 2.967 N/A GLN 174.A N ARG 170.A O no hydrogen 3.165 N/A GLN 174.A N ASN 171.A O no hydrogen 2.759 N/A GLN 174.A NE2 ILE 165.A O no hydrogen 3.431 N/A GLN 174.A NE2 ARG 170.A O no hydrogen 2.622 N/A ILE 176.A N GLU 173.A O no hydrogen 2.831 N/A TYR 180.A N PRO 177.A O no hydrogen 3.101 N/A LEU 181.A N PRO 177.A O no hydrogen 3.274 N/A GLU 182.A N LEU 178.A O no hydrogen 2.472 N/A LYS 183.A N GLU 179.A O no hydrogen 3.084 N/A LYS 183.A NZ SER 120.A OG no hydrogen 3.418 N/A LEU 184.A N TYR 180.A O no hydrogen 3.228 N/A HIS 185.A N LEU 181.A O no hydrogen 3.097 N/A TYR 186.A N GLU 182.A O no hydrogen 3.042 N/A LYS 187.A N LYS 183.A O no hydrogen 3.202 N/A LYS 187.A NZ SER 115.A OG no hydrogen 3.311 N/A LYS 187.A NZ GLU 119.A OE1 no hydrogen 2.870 N/A HIS 188.A N LEU 184.A O no hydrogen 2.796 N/A GLU 189.A N HIS 185.A O no hydrogen 2.869 N/A SER 190.A N TYR 186.A O no hydrogen 2.883 N/A SER 190.A OG THR 196.A OG1 no hydrogen 2.498 N/A TRP 191.A N LYS 187.A O no hydrogen 2.994 N/A LEU 192.A N HIS 188.A O no hydrogen 2.649 N/A HIS 194.A N GLU 189.A O no hydrogen 3.033 N/A ARG 195.A NH1 VAL 207.A O no hydrogen 2.692 N/A ARG 195.A NH2 VAL 207.A O no hydrogen 2.764 N/A THR 196.A OG1 SER 190.A O no hydrogen 3.033 N/A LEU 197.A N SER 190.A O no hydrogen 3.401 N/A THR 199.A OG1 PHE 201.A O no hydrogen 3.250 N/A ASN 200.A N TYR 111.A OH no hydrogen 2.825 N/A PHE 201.A N THR 199.A OG1 no hydrogen 3.366 N/A TYR 203.A OH TYR 107.A OH no hydrogen 2.345 N/A LEU 204.A N PHE 201.A O no hydrogen 3.000 N/A GLN 205.A N ASP 202.A O no hydrogen 3.137 N/A GLU 206.A N TYR 203.A O no hydrogen 3.130 N/A VAL 207.A N LEU 204.A O no hydrogen 3.054 N/A LEU 210.A N ILE 151.A O no hydrogen 2.803 N/A LEU 212.A N TYR 153.A O no hydrogen 3.061 N/A VAL 214.A N GLN 155.A O no hydrogen 2.806 N/A ASN 215.A ND2 ASP 213.A OD2 no hydrogen 3.163 N/A LYS 219.A N ASP 217.A OD1 no hydrogen 3.452 N/A LYS 221.A N PHE 218.A O no hydrogen 3.321 N/A LYS 221.A NZ GLU 216.A OE2 no hydrogen 2.974 N/A VAL 226.A N TYR 222.A O no hydrogen 3.036 N/A GLU 227.A N GLU 223.A O no hydrogen 2.891 N/A LYS 228.A N SER 224.A O no hydrogen 3.095 N/A LYS 228.A N LEU 225.A O no hydrogen 3.072 N/A VAL 229.A N LEU 225.A O no hydrogen 2.927 N/A LYS 230.A N VAL 226.A O no hydrogen 2.648 N/A GLU 231.A N GLU 227.A O no hydrogen 3.127 N/A PHE 232.A N LYS 228.A O no hydrogen 2.850 N/A LEU 233.A N VAL 229.A O no hydrogen 2.810 N/A SER 234.A N GLU 231.A O no hydrogen 3.044 N/A SER 234.A OG LYS 230.A O no hydrogen 3.122 N/A THR 235.A N GLU 231.A O no hydrogen 3.423 N/A THR 235.A N PHE 232.A O no hydrogen 3.210 N/A THR 235.A OG1 PHE 232.A O no hydrogen 2.747 N/A