Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qrq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N PHE 87.A O no hydrogen 3.043 N/A TRP 4.A N THR 65.A O no hydrogen 2.742 N/A LEU 5.A N LYS 85.A O no hydrogen 3.464 N/A THR 6.A N VAL 63.A O no hydrogen 2.904 N/A LEU 8.A N VAL 61.A O no hydrogen 2.891 N/A VAL 9.A N GLN 80.A O no hydrogen 3.305 N/A LEU 10.A N PRO 59.A O no hydrogen 2.934 N/A ASN 11.A N TYR 78.A O no hydrogen 2.971 N/A ASN 11.A ND2 GLY 77.A O no hydrogen 2.905 N/A ALA 13.A N ASN 11.A OD1 no hydrogen 3.354 N/A SER 14.A N ASN 11.A O no hydrogen 2.944 N/A ALA 17.A N SER 14.A OG no hydrogen 3.107 N/A ARG 18.A N SER 14.A O no hydrogen 2.887 N/A ARG 18.A NH1 PRO 12.A O no hydrogen 3.017 N/A ARG 19.A N ARG 15.A O no hydrogen 3.101 N/A ARG 19.A NE ASP 20.A OD1 no hydrogen 2.751 N/A ARG 19.A NH2 ASP 20.A OD1 no hydrogen 3.019 N/A ASP 20.A N ALA 16.A O no hydrogen 3.276 N/A LEU 21.A N ALA 17.A O no hydrogen 2.855 N/A ALA 22.A N ARG 18.A O no hydrogen 3.312 N/A ASN 23.A N ARG 19.A O no hydrogen 2.949 N/A GLU 26.A N ASN 23.A OD1 no hydrogen 2.922 N/A MET 27.A N ASN 23.A O no hydrogen 2.981 N/A HIS 28.A N PRO 24.A O no hydrogen 3.013 N/A ARG 29.A N TYR 25.A O no hydrogen 2.963 N/A THR 30.A N GLU 26.A O no hydrogen 3.230 N/A THR 30.A OG1 ASP 20.A OD2 no hydrogen 2.715 N/A THR 30.A OG1 GLU 26.A O no hydrogen 3.006 N/A LEU 31.A N MET 27.A O no hydrogen 2.900 N/A SER 32.A N HIS 28.A O no hydrogen 2.954 N/A SER 32.A OG HIS 28.A O no hydrogen 3.060 N/A SER 32.A OG ARG 29.A O no hydrogen 3.093 N/A LYS 33.A N THR 30.A O no hydrogen 3.058 N/A ALA 34.A N LEU 31.A O no hydrogen 3.206 N/A LEU 39.A N VAL 35.A O no hydrogen 3.214 N/A GLU 40.A N SER 36.A O no hydrogen 3.135 N/A GLU 41.A N ARG 37.A O no hydrogen 2.992 N/A GLY 42.A N LEU 39.A O no hydrogen 2.798 N/A ARG 43.A N ALA 38.A O no hydrogen 2.826 N/A ARG 43.A NE GLU 41.A OE1 no hydrogen 3.035 N/A ARG 45.A N GLU 44.A OE2 no hydrogen 3.005 N/A ARG 45.A NE LEU 46.A O no hydrogen 3.231 N/A ARG 45.A NH2 LEU 46.A O no hydrogen 2.815 N/A LEU 47.A N GLN 64.A O no hydrogen 2.990 N/A TRP 48.A NE1 HIS 28.A ND1 no hydrogen 3.067 N/A ARG 49.A N LEU 62.A O no hydrogen 2.881 N/A ARG 49.A NE GLU 51.A OE1 no hydrogen 2.668 N/A ARG 49.A NH1 GLU 51.A OE1 no hydrogen 3.297 N/A ARG 49.A NH1 GLU 51.A OE2 no hydrogen 2.996 N/A ARG 49.A NH1 SER 201.A OG no hydrogen 3.233 N/A GLU 51.A N VAL 60.A O no hydrogen 2.948 N/A VAL 61.A N LEU 8.A O no hydrogen 2.740 N/A LEU 62.A N ARG 49.A O no hydrogen 2.949 N/A VAL 63.A N THR 6.A O no hydrogen 2.920 N/A GLN 64.A N LEU 47.A O no hydrogen 2.633 N/A GLN 64.A NE2 LEU 185.A O no hydrogen 2.998 N/A THR 65.A N TRP 4.A O no hydrogen 3.004 N/A THR 65.A OG1 THR 67.A O no hydrogen 2.900 N/A LEU 66.A N GLU 44.A OE2 no hydrogen 2.680 N/A THR 67.A N GLU 44.A OE1 no hydrogen 3.129 N/A THR 67.A OG1 GLU 44.A OE1 no hydrogen 2.580 N/A ASP 70.A N ALA 34.A O no hydrogen 2.846 N/A TRP 71.A NE1 THR 6.A OG1 no hydrogen 3.010 N/A SER 72.A N ASP 70.A OD1 no hydrogen 3.412 N/A SER 72.A OG ASP 70.A OD1 no hydrogen 2.654 N/A SER 72.A OG ASP 70.A OD2 no hydrogen 3.406 N/A VAL 73.A N ASP 70.A O no hydrogen 3.312 N/A LEU 74.A N TRP 71.A O no hydrogen 3.298 N/A TYR 78.A N ASP 75.A O no hydrogen 3.036 N/A TYR 78.A OH ASP 20.A OD2 no hydrogen 2.708 N/A GLN 80.A N VAL 9.A O no hydrogen 2.834 N/A PHE 82.A N LYS 7.A O no hydrogen 3.180 N/A LYS 85.A N LEU 5.A O no hydrogen 3.282 N/A PHE 87.A N MET 3.A O no hydrogen 2.884 N/A ALA 90.A N HIS 88.A O no hydrogen 2.968 N/A GLY 94.A N VAL 175.A O no hydrogen 2.595 N/A GLN 95.A N LYS 92.A O no hydrogen 3.439 N/A ARG 96.A NH2 GLU 174.A OE2 no hydrogen 3.511 N/A LEU 97.A N LEU 173.A O no hydrogen 2.819 N/A ARG 98.A N ALA 203.A O no hydrogen 2.751 N/A ARG 98.A NE PRO 204.A OXT no hydrogen 3.140 N/A PHE 99.A N GLY 171.A O no hydrogen 2.909 N/A ARG 100.A N SER 201.A O no hydrogen 2.799 N/A ARG 100.A NH1 GLU 51.A OE1 no hydrogen 3.094 N/A ARG 100.A NH2 GLU 170.A OE2 no hydrogen 3.567 N/A LEU 101.A N PHE 169.A O no hydrogen 3.206 N/A ARG 102.A NH1 GLN 152.A OE1 no hydrogen 3.435 N/A ARG 102.A NH2 LEU 50.A O no hydrogen 2.604 N/A ALA 103.A N VAL 167.A O no hydrogen 2.881 N/A ASN 104.A ND2 GLN 165.A O no hydrogen 2.628 N/A LYS 107.A N VAL 116.A O no hydrogen 2.998 N/A LEU 109.A N LYS 114.A O no hydrogen 2.758 N/A GLY 113.A N LEU 109.A O no hydrogen 2.862 N/A LEU 118.A N PRO 105.A O no hydrogen 3.150 N/A LYS 119.A N GLU 123.A OE2 no hydrogen 2.775 N/A THR 120.A N GLU 123.A OE2 no hydrogen 3.134 N/A GLU 123.A N THR 120.A O no hydrogen 3.111 N/A GLU 123.A N THR 120.A OG1 no hydrogen 3.390 N/A LYS 124.A N THR 120.A O no hydrogen 2.945 N/A LYS 124.A NZ LEU 118.A O no hydrogen 3.399 N/A LYS 124.A NZ ASP 153.A OD1 no hydrogen 3.068 N/A LYS 124.A NZ ASP 153.A OD2 no hydrogen 3.174 N/A VAL 125.A N PRO 121.A O no hydrogen 2.930 N/A ALA 126.A N ALA 122.A O no hydrogen 3.322 N/A TRP 127.A N GLU 123.A O no hydrogen 3.305 N/A TRP 127.A N LYS 124.A O no hydrogen 3.234 N/A LEU 128.A N LYS 124.A O no hydrogen 3.290 N/A GLU 129.A N VAL 125.A O no hydrogen 2.761 N/A ARG 130.A N ALA 126.A O no hydrogen 3.009 N/A ARG 131.A N TRP 127.A O no hydrogen 2.840 N/A LEU 132.A N LEU 128.A O no hydrogen 2.881 N/A GLU 133.A N GLU 129.A O no hydrogen 3.387 N/A GLU 134.A N ARG 130.A O no hydrogen 2.828 N/A GLY 135.A N ARG 131.A O no hydrogen 3.202 N/A PHE 137.A N LEU 132.A O no hydrogen 2.850 N/A ARG 138.A N GLU 174.A O no hydrogen 2.869 N/A ARG 138.A NH2 GLU 174.A OE2 no hydrogen 2.795 N/A LEU 140.A N ARG 172.A O no hydrogen 3.184 N/A GLY 142.A N GLY 145.A O no hydrogen 3.050 N/A TRP 147.A N LEU 140.A O no hydrogen 2.776 N/A GLN 149.A N GLU 170.A O no hydrogen 2.985 N/A LEU 151.A N LEU 168.A O no hydrogen 2.829 N/A THR 154.A N ALA 166.A O no hydrogen 2.825 N/A LEU 156.A N VAL 164.A O no hydrogen 2.651 N/A LEU 162.A N VAL 158.A O no hydrogen 2.606 N/A VAL 164.A N LEU 156.A O no hydrogen 2.949 N/A ALA 166.A N THR 154.A O no hydrogen 2.683 N/A VAL 167.A N ALA 103.A O no hydrogen 2.902 N/A LEU 168.A N GLN 152.A O no hydrogen 2.813 N/A PHE 169.A N LEU 101.A O no hydrogen 2.865 N/A GLU 170.A N GLN 149.A O no hydrogen 3.103 N/A GLY 171.A N PHE 99.A O no hydrogen 3.259 N/A ARG 172.A N TRP 147.A O no hydrogen 3.169 N/A LEU 173.A N LEU 97.A O no hydrogen 2.972 N/A GLU 174.A N ARG 138.A O no hydrogen 2.600 N/A VAL 175.A N GLN 95.A O no hydrogen 2.743 N/A VAL 176.A N GLY 136.A O no hydrogen 2.872 N/A ASP 177.A N GLY 136.A O no hydrogen 3.137 N/A GLU 179.A N ASP 177.A OD1 no hydrogen 3.095 N/A ARG 180.A N ASP 177.A OD1 no hydrogen 3.424 N/A ALA 181.A N ASP 177.A O no hydrogen 2.864 N/A LEU 182.A N PRO 178.A O no hydrogen 3.036 N/A ALA 183.A N GLU 179.A O no hydrogen 3.173 N/A THR 184.A N ARG 180.A O no hydrogen 3.126 N/A THR 184.A OG1 GLY 135.A O no hydrogen 2.619 N/A THR 184.A OG1 ARG 180.A O no hydrogen 2.586 N/A LEU 185.A N ALA 181.A O no hydrogen 3.100 N/A ARG 186.A N LEU 182.A O no hydrogen 3.096 N/A ARG 186.A NH1 GLN 2.A O no hydrogen 3.011 N/A ARG 187.A N ALA 183.A O no hydrogen 2.899 N/A GLY 188.A N THR 184.A O no hydrogen 2.781 N/A VAL 189.A N GLY 198.A O no hydrogen 2.852 N/A LYS 193.A NZ GLY 190.A O no hydrogen 2.773 N/A LEU 195.A N GLY 192.A O no hydrogen 2.991 N/A LEU 197.A N GLY 192.A O no hydrogen 3.037 N/A GLY 198.A N ARG 102.A O no hydrogen 2.963 N/A SER 201.A N ARG 100.A O no hydrogen 2.846 N/A ALA 203.A N ARG 98.A O no hydrogen 2.828 N/A