Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pxc_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N THR 37.A OG1 no hydrogen 3.001 N/A MET 4.A N THR 27.A O no hydrogen 2.960 N/A VAL 5.A N HIS 38.A O no hydrogen 3.033 N/A SER 7.A N VAL 40.A O no hydrogen 2.741 N/A SER 7.A OG THR 51.A OG1 no hydrogen 2.830 N/A THR 10.A N GLU 13.A OE1 no hydrogen 3.030 N/A THR 10.A OG1 GLU 12.A OE1 no hydrogen 3.201 N/A GLU 13.A N THR 10.A OG1 no hydrogen 3.372 N/A PHE 14.A N THR 10.A O no hydrogen 2.569 N/A MET 15.A N PRO 11.A O no hydrogen 2.577 N/A LEU 16.A N GLU 12.A O no hydrogen 2.977 N/A VAL 17.A N GLU 13.A O no hydrogen 3.032 N/A TYR 18.A N PHE 14.A O no hydrogen 2.757 N/A LYS 19.A N MET 15.A O no hydrogen 2.745 N/A PHE 20.A N LEU 16.A O no hydrogen 2.821 N/A ALA 21.A N VAL 17.A O no hydrogen 2.745 N/A ARG 22.A N TYR 18.A O no hydrogen 2.611 N/A LYS 23.A N LYS 19.A O no hydrogen 3.019 N/A HIS 24.A N PHE 20.A O no hydrogen 3.024 N/A ILE 26.A N ALA 21.A O no hydrogen 2.988 N/A THR 27.A N MET 2.A O no hydrogen 3.240 N/A THR 29.A N MET 4.A O no hydrogen 3.083 N/A THR 29.A OG1 LEU 31.A O no hydrogen 3.469 N/A LEU 31.A N THR 29.A OG1 no hydrogen 3.228 N/A THR 33.A N THR 36.A OG1 no hydrogen 3.063 N/A THR 33.A OG1 GLU 35.A OE1 no hydrogen 2.875 N/A GLU 35.A N THR 33.A OG1 no hydrogen 3.178 N/A THR 36.A N THR 33.A O no hydrogen 3.235 N/A THR 36.A OG1 THR 33.A O no hydrogen 3.532 N/A THR 37.A N SER 3.A O no hydrogen 2.583 N/A THR 37.A OG1 SER 3.A O no hydrogen 3.066 N/A THR 37.A OG1 HIS 38.A ND1 no hydrogen 2.754 N/A HIS 38.A N SER 3.A O no hydrogen 2.901 N/A HIS 38.A ND1 THR 37.A OG1 no hydrogen 2.754 N/A VAL 39.A N TRP 63.A O no hydrogen 2.701 N/A VAL 40.A N VAL 5.A O no hydrogen 2.929 N/A MET 41.A N VAL 65.A O no hydrogen 2.675 N/A LYS 42.A N SER 7.A O no hydrogen 3.120 N/A LYS 42.A NZ GLU 13.A OE2 no hydrogen 2.860 N/A THR 43.A OG1 ASP 44.A O no hydrogen 2.980 N/A THR 43.A OG1 SER 66.A OG no hydrogen 2.482 N/A ASP 44.A N VAL 47.A O no hydrogen 2.937 N/A CYS 48.A N GLY 89.A O no hydrogen 3.388 N/A CYS 48.A SG GLU 49.A O no hydrogen 3.382 N/A CYS 48.A SG GLY 89.A O no hydrogen 3.724 N/A GLN 50.A NE2 ASP 90.A OD2 no hydrogen 3.229 N/A GLN 50.A NE2 ASN 93.A OD1 no hydrogen 3.019 N/A THR 51.A OG1 SER 7.A OG no hydrogen 2.830 N/A LYS 53.A NZ VAL 6.A O no hydrogen 2.987 N/A LYS 53.A NZ ASN 30.A O no hydrogen 3.387 N/A TYR 54.A N THR 51.A OG1 no hydrogen 2.913 N/A TYR 54.A OH ASP 90.A OD2 no hydrogen 2.938 N/A PHE 55.A N THR 51.A O no hydrogen 3.001 N/A LEU 56.A N LEU 52.A O no hydrogen 2.910 N/A GLY 57.A N LYS 53.A O no hydrogen 2.922 N/A ILE 58.A N TYR 54.A O no hydrogen 3.347 N/A ALA 59.A N PHE 55.A O no hydrogen 2.753 N/A GLY 60.A N LEU 56.A O no hydrogen 3.045 N/A GLY 60.A N GLY 57.A O no hydrogen 3.290 N/A GLY 61.A N ILE 58.A O no hydrogen 2.625 N/A LYS 62.A N GLY 57.A O no hydrogen 2.920 N/A LYS 62.A NZ THR 33.A O no hydrogen 2.539 N/A LYS 62.A NZ GLU 34.A O no hydrogen 3.395 N/A TRP 63.A N THR 37.A O no hydrogen 2.945 N/A VAL 65.A N VAL 39.A O no hydrogen 2.921 N/A SER 66.A OG THR 43.A OG1 no hydrogen 2.482 N/A TYR 67.A N MET 41.A O no hydrogen 2.657 N/A TYR 67.A OH GLU 13.A O no hydrogen 3.384 N/A PHE 68.A N SER 66.A OG no hydrogen 3.390 N/A TRP 69.A N SER 66.A O no hydrogen 2.971 N/A TRP 69.A NE1 LEU 80.A O no hydrogen 3.101 N/A VAL 70.A N TYR 67.A O no hydrogen 2.859 N/A THR 71.A N TYR 67.A O no hydrogen 3.282 N/A GLN 72.A N PHE 68.A O no hydrogen 3.016 N/A SER 73.A N TRP 69.A O no hydrogen 3.205 N/A SER 73.A OG TRP 69.A O no hydrogen 2.816 N/A ILE 74.A N VAL 70.A O no hydrogen 3.024 N/A LYS 75.A N THR 71.A O no hydrogen 2.980 N/A GLU 76.A N GLN 72.A O no hydrogen 2.594 N/A ARG 77.A N ILE 74.A O no hydrogen 2.979 N/A LEU 80.A N SER 73.A OG no hydrogen 2.777 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 3.106 N/A ASP 84.A N ASN 81.A O no hydrogen 2.919 N/A VAL 87.A N VAL 64.A O no hydrogen 3.103 N/A ARG 88.A N PHE 46.A O no hydrogen 3.179 N/A ASP 90.A N GLY 94.A O no hydrogen 3.107 N/A VAL 91.A N CYS 48.A O no hydrogen 3.289 N/A ASN 93.A N ASP 90.A OD1 no hydrogen 2.873 N/A ASN 93.A ND2 ASP 187.A OD1 no hydrogen 2.853 N/A HIS 97.A N ARG 88.A O no hydrogen 2.942 N/A HIS 97.A NE2 ASP 90.A OD2 no hydrogen 2.611 N/A GLN 98.A N ARG 88.A O no hydrogen 2.778 N/A GLN 98.A NE2 ASN 96.A OD1 no hydrogen 3.100 N/A GLY 99.A N HIS 97.A ND1 no hydrogen 2.991 N/A LYS 101.A NZ GLU 105.A OE1 no hydrogen 2.760 N/A LYS 101.A NZ GLU 105.A OE2 no hydrogen 2.795 N/A ARG 102.A N GLN 98.A O no hydrogen 3.174 N/A ARG 102.A NE LEU 191.A O no hydrogen 3.234 N/A ARG 102.A NH2 LEU 191.A O no hydrogen 3.308 N/A ALA 103.A N GLY 99.A O no hydrogen 2.868 N/A ARG 104.A N PRO 100.A O no hydrogen 2.828 N/A ARG 104.A NE GLU 86.A OE2 no hydrogen 2.796 N/A ARG 104.A NH2 GLU 86.A OE2 no hydrogen 3.088 N/A GLU 105.A N LYS 101.A O no hydrogen 3.125 N/A SER 106.A N ALA 103.A O no hydrogen 3.248 N/A SER 106.A OG ARG 102.A O no hydrogen 2.732 N/A GLN 107.A NE2 ALA 103.A O no hydrogen 2.574 N/A PHE 112.A N CYS 138.A O no hydrogen 2.870 N/A ARG 113.A N LYS 110.A O no hydrogen 2.657 N/A GLU 116.A N HIS 156.A O no hydrogen 2.910 N/A ILE 117.A N SER 141.A O no hydrogen 2.931 N/A CYS 118.A N ILE 158.A O no hydrogen 3.010 N/A CYS 118.A SG VAL 143.A O no hydrogen 4.032 N/A TYR 120.A N VAL 160.A O no hydrogen 2.716 N/A THR 124.A N GLN 162.A OE1 no hydrogen 2.901 N/A THR 124.A OG1 ASN 125.A OD1 no hydrogen 2.783 N/A ASN 125.A N THR 124.A OG1 no hydrogen 2.420 N/A LEU 131.A N PRO 127.A O no hydrogen 2.961 N/A GLU 132.A N THR 128.A O no hydrogen 2.571 N/A TRP 133.A N ASP 129.A O no hydrogen 2.588 N/A MET 134.A N GLN 130.A O no hydrogen 2.731 N/A VAL 135.A N LEU 131.A O no hydrogen 3.090 N/A GLN 136.A N GLU 132.A O no hydrogen 3.030 N/A LEU 137.A N TRP 133.A O no hydrogen 3.080 N/A CYS 138.A N VAL 135.A O no hydrogen 3.006 N/A CYS 138.A SG MET 134.A O no hydrogen 3.683 N/A GLY 139.A N GLN 136.A O no hydrogen 2.940 N/A ALA 140.A N VAL 135.A O no hydrogen 2.955 N/A SER 141.A N LEU 115.A O no hydrogen 2.643 N/A VAL 143.A N ILE 117.A O no hydrogen 2.787 N/A SER 148.A N GLU 145.A O no hydrogen 2.764 N/A SER 148.A OG GLU 145.A O no hydrogen 3.333 N/A THR 150.A N GLU 116.A OE1 no hydrogen 2.904 N/A THR 150.A OG1 GLU 116.A OE2 no hydrogen 2.732 N/A VAL 155.A N GLY 152.A O no hydrogen 3.392 N/A ILE 158.A N GLU 116.A O no hydrogen 2.714 N/A VAL 159.A N PRO 178.A O no hydrogen 2.843 N/A VAL 160.A N CYS 118.A O no hydrogen 2.949 N/A VAL 161.A N VAL 180.A O no hydrogen 2.811 N/A GLN 162.A NE2 THR 124.A OG1 no hydrogen 3.058 N/A ALA 165.A N GLN 162.A O no hydrogen 3.142 N/A TRP 166.A N PRO 163.A O no hydrogen 3.267 N/A GLY 172.A N GLN 204.A OE1 no hydrogen 2.953 N/A GLN 173.A N ALA 170.A O no hydrogen 3.094 N/A GLN 173.A NE2 PRO 206.A O no hydrogen 3.263 N/A GLN 173.A NE2 PRO 206.A OXT no hydrogen 2.975 N/A MET 174.A N ILE 171.A O no hydrogen 2.487 N/A CYS 175.A N ILE 171.A O no hydrogen 3.081 N/A VAL 180.A N VAL 159.A O no hydrogen 2.751 N/A THR 181.A OG1 VAL 161.A O no hydrogen 3.305 N/A THR 181.A OG1 GLU 183.A OE2 no hydrogen 3.521 N/A ARG 182.A N VAL 161.A O no hydrogen 2.728 N/A TRP 184.A N THR 181.A O no hydrogen 2.665 N/A TRP 184.A NE1 GLN 195.A O no hydrogen 3.338 N/A LEU 186.A N ARG 182.A O no hydrogen 2.910 N/A ASP 187.A N GLU 183.A O no hydrogen 2.612 N/A SER 188.A N TRP 184.A O no hydrogen 2.837 N/A SER 188.A OG TRP 184.A O no hydrogen 2.360 N/A VAL 189.A N VAL 185.A O no hydrogen 2.628 N/A ALA 190.A N LEU 186.A O no hydrogen 2.858 N/A LEU 191.A N ASP 187.A O no hydrogen 3.238 N/A TYR 192.A N VAL 189.A O no hydrogen 3.021 N/A GLN 195.A N SER 188.A OG no hydrogen 3.276 N/A GLN 195.A NE2 GLN 193.A O no hydrogen 2.691 N/A THR 199.A OG1 GLU 196.A O no hydrogen 3.031 N/A TYR 200.A N LEU 197.A O no hydrogen 2.690 N/A TYR 200.A OH ASP 187.A OD2 no hydrogen 3.124 N/A LEU 201.A N ASP 198.A O no hydrogen 3.297 N/A ILE 202.A N VAL 179.A O no hydrogen 2.882 N/A GLN 204.A NE2 ILE 202.A O no hydrogen 3.024 N/A ILE 205.A N HIS 169.A O no hydrogen 2.528 N/A