Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qa3_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 3.A N PHE 103.A O no hydrogen 2.800 N/A ILE 4.A N LEU 39.A O no hydrogen 2.767 N/A ALA 5.A N ILE 105.A O no hydrogen 2.814 N/A PHE 6.A N SER 41.A O no hydrogen 2.831 N/A LEU 7.A N VAL 107.A O no hydrogen 2.819 N/A ILE 8.A N MET 43.A O no hydrogen 2.990 N/A ASP 9.A N ILE 109.A O no hydrogen 2.941 N/A GLY 10.A N TYR 45.A O no hydrogen 2.806 N/A SER 11.A N ASP 9.A OD1 no hydrogen 2.918 N/A SER 11.A OG ASP 9.A OD1 no hydrogen 2.653 N/A SER 11.A OG ASP 9.A OD2 no hydrogen 3.203 N/A GLY 12.A N GLY 76.A O no hydrogen 3.007 N/A SER 13.A OG ASP 111.A OD2 no hydrogen 2.844 N/A ILE 14.A N SER 11.A O no hydrogen 3.121 N/A PHE 19.A N ILE 15.A O no hydrogen 3.015 N/A ARG 20.A N PRO 16.A O no hydrogen 3.044 N/A ARG 20.A NH1 HIS 17.A ND1 no hydrogen 3.052 N/A ARG 20.A NH2 HIS 17.A ND1 no hydrogen 3.045 N/A ARG 21.A N HIS 17.A O no hydrogen 2.913 N/A ARG 21.A NH1 ASP 18.A OD1 no hydrogen 3.421 N/A MET 22.A N ASP 18.A O no hydrogen 3.032 N/A LYS 23.A N PHE 19.A O no hydrogen 2.791 N/A LYS 23.A NZ VAL 68.A O no hydrogen 3.118 N/A LYS 23.A NZ ILE 71.A O no hydrogen 2.749 N/A GLU 24.A N ARG 20.A O no hydrogen 2.773 N/A PHE 25.A N ARG 21.A O no hydrogen 3.010 N/A VAL 26.A N MET 22.A O no hydrogen 3.106 N/A SER 27.A N LYS 23.A O no hydrogen 3.011 N/A SER 27.A OG LYS 23.A O no hydrogen 2.941 N/A SER 27.A OG GLU 24.A O no hydrogen 3.143 N/A THR 28.A N GLU 24.A O no hydrogen 2.941 N/A THR 28.A OG1 GLU 24.A O no hydrogen 2.920 N/A VAL 29.A N PHE 25.A O no hydrogen 2.972 N/A MET 30.A N VAL 26.A O no hydrogen 3.183 N/A GLU 31.A N SER 27.A O no hydrogen 3.256 N/A GLN 32.A N THR 28.A O no hydrogen 2.843 N/A GLN 32.A NE2 GLN 178.A O no hydrogen 2.695 N/A LEU 33.A N MET 30.A O no hydrogen 3.380 N/A LYS 34.A N GLU 31.A O no hydrogen 3.249 N/A THR 38.A N LYS 35.A O no hydrogen 3.302 N/A LEU 39.A N SER 2.A O no hydrogen 3.050 N/A SER 41.A N ILE 4.A O no hydrogen 3.028 N/A SER 41.A OG PHE 53.A O no hydrogen 2.782 N/A LEU 42.A N PHE 53.A O no hydrogen 2.992 N/A MET 43.A N PHE 6.A O no hydrogen 2.939 N/A GLN 44.A N ARG 50.A O no hydrogen 2.829 N/A GLN 44.A NE2 HIS 52.A NE2 no hydrogen 3.164 N/A GLN 44.A NE2 THR 72.A O no hydrogen 2.919 N/A TYR 45.A N ILE 8.A O no hydrogen 2.933 N/A TYR 45.A OH THR 80.A OG1 no hydrogen 2.844 N/A SER 46.A N GLU 48.A O no hydrogen 2.996 N/A SER 46.A OG LEU 75.A O no hydrogen 2.940 N/A GLU 48.A N SER 46.A OG no hydrogen 3.401 N/A ARG 50.A N GLN 44.A O no hydrogen 2.968 N/A HIS 52.A N LEU 42.A O no hydrogen 2.782 N/A THR 54.A OG1 GLU 57.A OE1 no hydrogen 3.148 N/A LYS 56.A N ASN 96.A O no hydrogen 3.156 N/A LYS 56.A NZ THR 95.A O no hydrogen 3.065 N/A GLU 57.A N THR 54.A OG1 no hydrogen 3.080 N/A PHE 58.A N THR 54.A O no hydrogen 3.073 N/A GLN 59.A N PHE 55.A O no hydrogen 2.927 N/A GLN 59.A NE2 ASN 60.A OD1 no hydrogen 3.312 N/A ASN 60.A N LYS 56.A O no hydrogen 3.093 N/A ASN 61.A N PHE 58.A O no hydrogen 3.351 N/A ASN 63.A N ASN 61.A OD1 no hydrogen 3.398 N/A SER 66.A OG ASN 61.A OD1 no hydrogen 3.399 N/A SER 66.A OG ASN 63.A O no hydrogen 2.925 N/A LEU 67.A N ASN 63.A O no hydrogen 3.372 N/A VAL 68.A N PRO 64.A O no hydrogen 2.934 N/A LYS 69.A N ARG 65.A O no hydrogen 3.093 N/A ILE 71.A N VAL 68.A O no hydrogen 3.117 N/A GLN 73.A NE2 GLY 10.A O no hydrogen 3.471 N/A GLN 73.A NE2 SER 11.A O no hydrogen 3.010 N/A GLN 73.A NE2 ILE 14.A O no hydrogen 2.878 N/A LEU 74.A N GLN 44.A OE1 no hydrogen 2.688 N/A LEU 75.A N GLY 10.A O no hydrogen 2.765 N/A ARG 77.A N GLU 47.A OE2 no hydrogen 2.957 N/A ARG 77.A NH1 GLU 47.A OE2 no hydrogen 2.905 N/A HIS 79.A N SER 46.A O no hydrogen 2.842 N/A THR 80.A OG1 TYR 45.A OH no hydrogen 2.844 N/A THR 82.A N ASP 117.A OD2 no hydrogen 3.247 N/A THR 82.A OG1 ASP 117.A OD1 no hydrogen 2.476 N/A GLY 83.A N HIS 79.A O no hydrogen 3.183 N/A ILE 84.A N THR 80.A O no hydrogen 3.016 N/A ARG 85.A N ALA 81.A O no hydrogen 3.105 N/A ARG 85.A NH2 ASP 123.A O no hydrogen 2.847 N/A LYS 86.A N THR 82.A O no hydrogen 2.940 N/A LYS 86.A NZ GLU 90.A OE1 no hydrogen 3.240 N/A VAL 87.A N GLY 83.A O no hydrogen 2.832 N/A VAL 88.A N ILE 84.A O no hydrogen 3.004 N/A ARG 89.A N ARG 85.A O no hydrogen 2.864 N/A ARG 89.A NE GLU 127.A OE2 no hydrogen 2.870 N/A ARG 89.A NH2 GLU 127.A OE1 no hydrogen 3.091 N/A GLU 90.A N LYS 86.A O no hydrogen 2.827 N/A PHE 92.A N VAL 87.A O no hydrogen 3.167 N/A THR 95.A OG1 ASN 93.A OD1 no hydrogen 3.094 N/A ASN 96.A N ASN 93.A O no hydrogen 2.784 N/A ASN 96.A ND2 GLU 90.A O no hydrogen 2.667 N/A GLY 97.A N ILE 94.A O no hydrogen 3.330 N/A ARG 99.A N ASP 3.A OD2 no hydrogen 3.212 N/A ARG 99.A NH1 SER 2.A O no hydrogen 3.371 N/A ARG 99.A NH1 LYS 37.A O no hydrogen 2.694 N/A ARG 99.A NH2 LYS 37.A O no hydrogen 2.636 N/A PHE 103.A N ASP 1.A O no hydrogen 2.877 N/A LYS 104.A NZ GLU 131.A O no hydrogen 3.206 N/A LYS 104.A NZ GLU 131.A OE1 no hydrogen 3.320 N/A ILE 105.A N ASP 3.A O no hydrogen 3.028 N/A LEU 106.A N ILE 134.A O no hydrogen 2.892 N/A VAL 107.A N ALA 5.A O no hydrogen 2.822 N/A VAL 108.A N TYR 136.A O no hydrogen 2.782 N/A ILE 109.A N LEU 7.A O no hydrogen 2.946 N/A THR 110.A N ILE 138.A O no hydrogen 3.092 N/A THR 110.A OG1 ASP 9.A OD2 no hydrogen 2.932 N/A THR 110.A OG1 TYR 45.A OH no hydrogen 3.164 N/A THR 110.A OG1 GLY 112.A O no hydrogen 2.970 N/A ASP 111.A N ASP 9.A OD2 no hydrogen 3.277 N/A GLY 112.A N THR 110.A OG1 no hydrogen 3.325 N/A LYS 114.A N GLU 152.A OE2 no hydrogen 2.947 N/A LYS 114.A NZ LEU 119.A O no hydrogen 3.121 N/A PHE 115.A N THR 78.A O no hydrogen 3.008 N/A LEU 119.A N ASP 117.A OD1 no hydrogen 3.225 N/A GLY 120.A N ASP 123.A OD2 no hydrogen 2.926 N/A TYR 121.A OH GLU 152.A OE2 no hydrogen 2.653 N/A ASP 123.A N GLY 120.A O no hydrogen 3.118 N/A VAL 124.A N TYR 121.A O no hydrogen 3.036 N/A ILE 125.A N TYR 121.A O no hydrogen 2.752 N/A ALA 128.A N VAL 124.A O no hydrogen 3.201 N/A ASP 129.A N ILE 125.A O no hydrogen 2.983 N/A ARG 130.A N PRO 126.A O no hydrogen 2.949 N/A GLU 131.A N GLU 127.A O no hydrogen 3.006 N/A GLY 132.A N ASP 129.A O no hydrogen 2.718 N/A VAL 133.A N ALA 128.A O no hydrogen 2.886 N/A ILE 134.A N LYS 104.A O no hydrogen 2.802 N/A ARG 135.A N SER 158.A OG no hydrogen 2.919 N/A ARG 135.A NE ILE 156.A O no hydrogen 2.745 N/A ARG 135.A NH1 ASP 129.A OD1 no hydrogen 3.181 N/A ARG 135.A NH1 VAL 133.A O no hydrogen 3.083 N/A ARG 135.A NH2 ASP 129.A OD1 no hydrogen 3.305 N/A TYR 136.A N LEU 106.A O no hydrogen 2.799 N/A VAL 137.A N HIS 164.A O no hydrogen 3.080 N/A ILE 138.A N VAL 108.A O no hydrogen 2.762 N/A GLY 139.A N PHE 166.A O no hydrogen 2.942 N/A VAL 140.A N THR 110.A O no hydrogen 2.808 N/A GLY 141.A N VAL 168.A O no hydrogen 3.146 N/A SER 146.A OG SER 149.A OG no hydrogen 2.555 N/A SER 149.A OG SER 146.A O no hydrogen 3.105 N/A SER 149.A OG SER 146.A OG no hydrogen 2.555 N/A ARG 150.A N SER 146.A O no hydrogen 3.344 N/A ARG 150.A NH1 GLU 147.A OE2 no hydrogen 2.753 N/A GLN 151.A N GLU 147.A O no hydrogen 3.095 N/A GLN 151.A NE2 GLU 147.A OE1 no hydrogen 3.125 N/A GLU 152.A N LYS 148.A O no hydrogen 3.353 N/A LEU 153.A N SER 149.A O no hydrogen 3.339 N/A ASN 154.A N ARG 150.A O no hydrogen 3.065 N/A THR 155.A N GLN 151.A O no hydrogen 2.726 N/A THR 155.A OG1 GLN 151.A O no hydrogen 2.559 N/A ILE 156.A N GLU 152.A O no hydrogen 3.147 N/A ALA 157.A N LEU 153.A O no hydrogen 2.892 N/A SER 158.A N ARG 135.A O no hydrogen 3.065 N/A ASP 163.A N PRO 160.A O no hydrogen 3.096 N/A HIS 164.A N PRO 161.A O no hydrogen 3.163 N/A HIS 164.A ND1 PRO 160.A O no hydrogen 3.075 N/A VAL 165.A N PRO 161.A O no hydrogen 2.876 N/A PHE 166.A N VAL 137.A O no hydrogen 2.856 N/A GLN 167.A NE2 PHE 144.A O no hydrogen 3.124 N/A VAL 168.A N GLY 139.A O no hydrogen 3.162 N/A ALA 173.A N ASN 170.A OD1 no hydrogen 3.074 N/A LEU 174.A N PHE 171.A O no hydrogen 3.217 N/A LYS 175.A N GLU 172.A O no hydrogen 3.414 N/A ASN 179.A N ILE 177.A O no hydrogen 2.297 N/A ARG 182.A N ASN 179.A O no hydrogen 3.352 N/A