Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s1q_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 7.A N GLU 3.A O no hydrogen 3.087 N/A ILE 8.A N ASN 4.A O no hydrogen 2.969 N/A SER 9.A N GLU 5.A O no hydrogen 3.346 N/A ARG 10.A N ARG 6.A O no hydrogen 3.310 N/A LEU 11.A N ASN 7.A O no hydrogen 3.249 N/A TRP 12.A N ILE 8.A O no hydrogen 2.860 N/A TRP 12.A NE1 LEU 36.A O no hydrogen 3.085 N/A ARG 13.A N SER 9.A O no hydrogen 2.865 N/A ALA 14.A N ARG 10.A O no hydrogen 2.944 N/A PHE 15.A N LEU 11.A O no hydrogen 2.780 N/A ARG 16.A N TRP 12.A O no hydrogen 3.164 N/A ARG 16.A NE GLU 20.A OE2 no hydrogen 3.326 N/A THR 17.A N ARG 13.A O no hydrogen 3.298 N/A THR 17.A OG1 ARG 13.A O no hydrogen 3.499 N/A THR 17.A OG1 LEU 139.A O no hydrogen 3.197 N/A VAL 18.A N ALA 14.A O no hydrogen 3.266 N/A LYS 19.A N PHE 15.A O no hydrogen 3.084 N/A LYS 19.A NZ GLU 33.A O no hydrogen 2.639 N/A GLU 20.A N ARG 16.A O no hydrogen 2.793 N/A MET 21.A N THR 17.A O no hydrogen 2.627 N/A VAL 22.A N VAL 18.A O no hydrogen 2.788 N/A LYS 23.A N LYS 19.A O no hydrogen 3.111 N/A LYS 23.A NZ ILE 29.A O no hydrogen 3.488 N/A LYS 23.A NZ GLN 31.A OE1 no hydrogen 3.089 N/A ASP 24.A N GLU 20.A O no hydrogen 2.911 N/A ARG 25.A N VAL 22.A O no hydrogen 3.131 N/A ARG 25.A NE TYR 186.A O no hydrogen 3.092 N/A ARG 25.A NH1 GLU 132.A OE1 no hydrogen 2.855 N/A ARG 25.A NH1 GLU 132.A OE2 no hydrogen 3.369 N/A ARG 25.A NH2 GLU 132.A OE1 no hydrogen 2.786 N/A GLY 26.A N LYS 23.A O no hydrogen 3.166 N/A PHE 28.A N ASN 62.A O no hydrogen 2.827 N/A VAL 34.A N THR 30.A O no hydrogen 3.164 N/A GLU 35.A N GLN 31.A O no hydrogen 3.196 N/A PHE 41.A N PRO 37.A O no hydrogen 3.213 N/A LYS 42.A N LEU 38.A O no hydrogen 3.024 N/A ALA 43.A N GLU 39.A O no hydrogen 2.811 N/A TYR 45.A N PHE 41.A O no hydrogen 2.922 N/A CYS 46.A N LYS 42.A O no hydrogen 3.237 N/A CYS 46.A SG GLY 50.A O no hydrogen 3.570 N/A ASP 47.A N ARG 51.A O no hydrogen 2.947 N/A MET 49.A N ASP 47.A OD2 no hydrogen 2.953 N/A GLY 50.A N ASP 47.A O no hydrogen 2.778 N/A GLY 50.A N ASP 47.A OD2 no hydrogen 3.179 N/A ARG 51.A N ASP 47.A OD2 no hydrogen 3.224 N/A GLN 53.A N TYR 45.A O no hydrogen 2.729 N/A GLN 53.A NE2 ASP 47.A OD1 no hydrogen 3.040 N/A ARG 54.A N ASP 83.A OD1 no hydrogen 3.422 N/A ARG 54.A NH2 GLU 136.A OE1 no hydrogen 2.767 N/A LYS 55.A N ASP 83.A OD2 no hydrogen 3.254 N/A MET 56.A N GLN 53.A O no hydrogen 3.229 N/A MET 57.A N ARG 54.A O no hydrogen 3.186 N/A SER 58.A OG GLU 80.A OE2 no hydrogen 2.616 N/A PHE 59.A N VAL 79.A O no hydrogen 3.184 N/A ALA 61.A N LEU 77.A O no hydrogen 2.832 N/A THR 64.A OG1 GLY 26.A O no hydrogen 2.923 N/A THR 64.A OG1 SER 67.A OG no hydrogen 2.723 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.822 N/A SER 67.A OG GLY 26.A O no hydrogen 2.670 N/A SER 67.A OG THR 64.A OG1 no hydrogen 2.723 N/A ILE 68.A N THR 64.A O no hydrogen 2.887 N/A ILE 68.A N GLU 65.A O no hydrogen 3.267 N/A SER 69.A N GLU 65.A O no hydrogen 3.284 N/A LYS 70.A N GLU 66.A O no hydrogen 3.020 N/A PHE 71.A N SER 67.A O no hydrogen 3.206 N/A MET 74.A N PHE 71.A O no hydrogen 3.256 N/A SER 76.A OG ALA 61.A O no hydrogen 2.883 N/A SER 76.A OG ASN 62.A OD1 no hydrogen 2.727 N/A LEU 77.A N ALA 61.A O no hydrogen 3.181 N/A TRP 78.A N THR 106.A O no hydrogen 2.895 N/A TRP 78.A NE1 GLU 80.A OE1 no hydrogen 2.744 N/A VAL 79.A N PHE 59.A O no hydrogen 2.934 N/A GLU 80.A N ILE 108.A O no hydrogen 2.834 N/A PHE 81.A N SER 58.A OG no hydrogen 3.282 N/A CYS 82.A N VAL 110.A O no hydrogen 3.286 N/A CYS 82.A SG GLU 84.A O no hydrogen 3.543 N/A SER 86.A OG ASN 114.A OD1 no hydrogen 2.958 N/A VAL 87.A N ASN 114.A O no hydrogen 3.224 N/A GLY 88.A N THR 91.A OG1 no hydrogen 2.761 N/A THR 91.A OG1 GLY 88.A O no hydrogen 2.981 N/A MET 92.A N GLY 88.A O no hydrogen 3.322 N/A LYS 93.A N VAL 89.A O no hydrogen 3.436 N/A THR 94.A OG1 LYS 90.A O no hydrogen 3.274 N/A THR 94.A OG1 THR 91.A O no hydrogen 2.447 N/A PHE 95.A N MET 92.A O no hydrogen 3.050 N/A VAL 96.A N MET 92.A O no hydrogen 2.796 N/A ILE 97.A N LYS 93.A O no hydrogen 2.953 N/A ILE 99.A N PHE 95.A O no hydrogen 3.308 N/A GLN 100.A N VAL 96.A O no hydrogen 3.361 N/A LYS 102.A N HIS 98.A O no hydrogen 2.861 N/A PHE 104.A N ILE 99.A O no hydrogen 3.221 N/A GLN 105.A N SER 76.A O no hydrogen 2.888 N/A GLY 107.A N THR 130.A O no hydrogen 2.967 N/A ILE 108.A N TRP 78.A O no hydrogen 2.770 N/A PHE 109.A N GLU 132.A O no hydrogen 2.977 N/A VAL 110.A N GLU 80.A O no hydrogen 2.956 N/A TYR 111.A N PHE 109.A O no hydrogen 3.203 N/A GLN 112.A NE2 CYS 82.A O no hydrogen 3.187 N/A THR 116.A N VAL 87.A O no hydrogen 2.803 N/A THR 116.A OG1 VAL 87.A O no hydrogen 2.788 N/A ALA 119.A N THR 116.A O no hydrogen 3.208 N/A MET 120.A N THR 116.A O no hydrogen 3.158 N/A LYS 121.A N PRO 117.A O no hydrogen 3.121 N/A LEU 122.A N ALA 119.A O no hydrogen 3.206 N/A VAL 123.A N MET 120.A O no hydrogen 3.439 N/A SER 125.A OG LEU 122.A O no hydrogen 2.618 N/A THR 130.A N GLN 105.A O no hydrogen 3.001 N/A GLU 132.A N GLY 107.A O no hydrogen 2.729 N/A PHE 134.A N PHE 109.A O no hydrogen 2.995 N/A GLU 136.A N TYR 111.A O no hydrogen 2.869 N/A ALA 137.A N ASN 135.A OD1 no hydrogen 3.358 N/A LEU 139.A N ASN 135.A O no hydrogen 3.406 N/A ASN 142.A ND2 GLU 20.A OE1 no hydrogen 2.873 N/A ASN 142.A ND2 TYR 186.A OH no hydrogen 3.103 N/A THR 144.A N ASN 142.A OD1 no hydrogen 3.290 N/A THR 144.A OG1 ASN 142.A OD1 no hydrogen 2.606 N/A HIS 145.A N ASN 142.A O no hydrogen 2.808 N/A HIS 146.A N ILE 143.A O no hydrogen 3.389 N/A VAL 149.A N HIS 146.A O no hydrogen 3.130 N/A HIS 152.A ND1 PRO 150.A O no hydrogen 2.737 N/A ILE 153.A N LYS 196.A O no hydrogen 2.818 N/A ARG 154.A NE GLU 193.A OE2 no hydrogen 3.054 N/A LEU 155.A N VAL 194.A O no hydrogen 3.061 N/A SER 156.A N GLU 159.A OE1 no hydrogen 2.735 N/A SER 156.A OG ASP 158.A OD2 no hydrogen 3.423 N/A SER 156.A OG GLU 159.A OE1 no hydrogen 3.281 N/A GLU 159.A N SER 156.A OG no hydrogen 2.883 N/A LYS 160.A N SER 156.A O no hydrogen 2.835 N/A LYS 160.A NZ GLU 171.A OE2 no hydrogen 2.651 N/A LYS 160.A NZ GLY 192.A O no hydrogen 2.709 N/A ARG 161.A N SER 157.A O no hydrogen 3.096 N/A GLU 162.A N ASP 158.A O no hydrogen 3.306 N/A LEU 163.A N GLU 159.A O no hydrogen 3.009 N/A LEU 164.A N LYS 160.A O no hydrogen 2.855 N/A LYS 165.A N ARG 161.A O no hydrogen 2.856 N/A ARG 166.A N GLU 162.A O no hydrogen 2.834 N/A TYR 167.A N LEU 163.A O no hydrogen 3.030 N/A ARG 168.A N LYS 165.A O no hydrogen 3.104 N/A LEU 169.A N LEU 164.A O no hydrogen 2.800 N/A GLN 173.A N LYS 170.A O no hydrogen 3.106 N/A LEU 174.A N GLU 171.A O no hydrogen 3.281 N/A ILE 177.A N ILE 212.A O no hydrogen 2.861 N/A ARG 179.A NE MET 214.A O no hydrogen 2.956 N/A ARG 179.A NH2 MET 214.A OXT no hydrogen 3.310 N/A ASP 181.A N GLN 178.A O no hydrogen 3.120 N/A LEU 185.A N ASP 181.A O no hydrogen 2.915 N/A TYR 186.A N PRO 182.A O no hydrogen 3.042 N/A TYR 186.A OH ASP 24.A OD2 no hydrogen 2.907 N/A TYR 186.A OH ASN 142.A OD1 no hydrogen 3.347 N/A LEU 187.A N VAL 183.A O no hydrogen 3.075 N/A GLY 188.A N LEU 185.A O no hydrogen 2.886 N/A LEU 189.A N ALA 184.A O no hydrogen 2.881 N/A LYS 190.A N GLU 193.A OE1 no hydrogen 2.831 N/A LYS 190.A NZ GLY 188.A O no hydrogen 3.552 N/A LYS 190.A NZ GLU 193.A OE1 no hydrogen 3.465 N/A GLU 193.A N LYS 190.A O no hydrogen 3.009 N/A VAL 195.A N ARG 211.A O no hydrogen 2.982 N/A LYS 196.A N ILE 153.A O no hydrogen 2.900 N/A ILE 197.A N SER 209.A O no hydrogen 2.726 N/A ILE 198.A N LYS 151.A O no hydrogen 3.237 N/A ARG 199.A N TYR 207.A O no hydrogen 2.876 N/A SER 201.A N GLY 205.A O no hydrogen 2.930 N/A SER 204.A OG ARG 206.A O no hydrogen 2.829 N/A GLY 205.A N SER 201.A O no hydrogen 2.826 N/A TYR 207.A N ARG 199.A O no hydrogen 2.874 N/A SER 209.A N ILE 197.A O no hydrogen 2.955 N/A ARG 211.A N VAL 195.A O no hydrogen 3.012 N/A ARG 211.A NE ARG 176.A O no hydrogen 2.793 N/A ARG 211.A NH2 ARG 176.A O no hydrogen 2.956 N/A ILE 212.A N PRO 175.A O no hydrogen 2.929 N/A CYS 213.A N GLU 193.A O no hydrogen 2.815 N/A CYS 213.A SG MET 214.A O no hydrogen 3.856 N/A