Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1p3e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N THR 166.A O no hydrogen 3.060 N/A VAL 1.A N THR 166.A OG1 no hydrogen 2.885 N/A VAL 1.A N ASN 196.A OD1 no hydrogen 2.567 N/A ILE 3.A N ASP 165.A OD1 no hydrogen 2.818 N/A GLY 7.A N ASP 165.A OD2 no hydrogen 2.828 N/A ARG 8.A N ASP 6.A OD1 no hydrogen 2.993 N/A ARG 8.A NE ASP 6.A OD1 no hydrogen 2.894 N/A ARG 8.A NE ASP 6.A OD2 no hydrogen 3.357 N/A ARG 8.A NH1 ASP 135.A OD2 no hydrogen 3.146 N/A ARG 8.A NH2 ASP 6.A OD2 no hydrogen 2.703 N/A ARG 8.A NH2 ASP 135.A OD1 no hydrogen 2.720 N/A ARG 8.A NH2 ASP 135.A OD2 no hydrogen 3.547 N/A THR 9.A N GLU 147.A O no hydrogen 2.943 N/A THR 9.A OG1 GLU 147.A O no hydrogen 3.556 N/A VAL 11.A N GLN 145.A O no hydrogen 2.919 N/A THR 14.A OG1 GLY 66.A O no hydrogen 2.701 N/A ARG 15.A N ASN 13.A OD1 no hydrogen 3.015 N/A ARG 15.A NE ASN 13.A OD1 no hydrogen 3.618 N/A TYR 19.A OH GLU 147.A OE1 no hydrogen 2.622 N/A ASN 20.A N VAL 16.A O no hydrogen 2.975 N/A ASN 20.A ND2 ARG 15.A O no hydrogen 3.504 N/A SER 21.A N PRO 18.A O no hydrogen 2.995 N/A SER 21.A OG PRO 18.A O no hydrogen 2.681 N/A ILE 22.A N TYR 19.A O no hydrogen 3.290 N/A ALA 23.A N GLY 34.A O no hydrogen 2.760 N/A TYR 24.A N TYR 64.A O no hydrogen 3.130 N/A ILE 25.A N CYS 32.A O no hydrogen 3.187 N/A THR 26.A N SER 62.A O no hydrogen 2.910 N/A THR 26.A OG1 SER 62.A O no hydrogen 3.464 N/A PHE 27.A N SER 30.A O no hydrogen 2.946 N/A GLY 28.A N ALA 59.A O no hydrogen 3.121 N/A CYS 32.A N ILE 25.A O no hydrogen 3.013 N/A CYS 32.A SG SER 31.A O no hydrogen 3.234 N/A THR 33.A N SER 171.A O no hydrogen 2.999 N/A THR 33.A OG1 GLY 169.A O no hydrogen 2.835 N/A GLY 34.A N ALA 23.A O no hydrogen 3.069 N/A THR 35.A N LEU 43.A O no hydrogen 2.989 N/A LEU 36.A N.A SER 21.A O no hydrogen 2.924 N/A LEU 36.A N.B SER 21.A O no hydrogen 2.930 N/A ILE 37.A N LYS 41.A O no hydrogen 2.923 N/A LYS 41.A NZ ALA 212.A O no hydrogen 3.100 N/A LYS 41.A NZ GLN 215.A OXT no hydrogen 2.789 N/A ILE 42.A N ILE 101.A O no hydrogen 2.808 N/A LEU 43.A N THR 35.A O no hydrogen 2.839 N/A THR 44.A N ALA 99.A O no hydrogen 2.941 N/A THR 44.A OG1 THR 33.A O no hydrogen 2.734 N/A ASN 45.A N THR 44.A OG1 no hydrogen 2.847 N/A ASN 45.A ND2 ASP 97.A O no hydrogen 3.222 N/A ASN 45.A ND2 HIS 186.A O no hydrogen 2.973 N/A HIS 47.A N.A ASP 97.A OD2 no hydrogen 2.826 N/A HIS 47.A N.B ASP 97.A OD2 no hydrogen 2.890 N/A HIS 47.A ND1.B TYR 88.A OH no hydrogen 2.533 N/A CYS 48.A N ASN 45.A O no hydrogen 3.361 N/A CYS 48.A SG SER 171.A O no hydrogen 3.896 N/A VAL 49.A N GLY 46.A O no hydrogen 2.975 N/A TYR 50.A N GLY 46.A O no hydrogen 2.944 N/A ASN 51.A N SER 56.A O no hydrogen 2.804 N/A SER 54.A N ASN 51.A OD1 no hydrogen 3.317 N/A SER 56.A N ASN 51.A O no hydrogen 3.257 N/A SER 56.A OG TYR 57.A O no hydrogen 3.240 N/A SER 58.A N VAL 49.A O no hydrogen 2.862 N/A SER 58.A OG CYS 48.A O no hydrogen 2.787 N/A SER 62.A N THR 26.A OG1 no hydrogen 3.155 N/A SER 62.A OG ASN 78.A OD1 no hydrogen 2.965 N/A VAL 63.A N ALA 77.A O no hydrogen 2.873 N/A TYR 64.A N TYR 24.A O no hydrogen 2.904 N/A GLY 66.A N ILE 22.A O no hydrogen 2.813 N/A MET 67.A N TYR 64.A O no hydrogen 3.489 N/A ASN 68.A N THR 71.A O no hydrogen 3.207 N/A ASN 68.A ND2 MET 67.A O no hydrogen 3.638 N/A ASP 69.A N SER 144.A OG no hydrogen 3.020 N/A SER 70.A N VAL 143.A O no hydrogen 2.867 N/A THR 71.A N ASN 68.A O no hydrogen 2.882 N/A THR 71.A OG1 ASP 69.A O no hydrogen 3.048 N/A VAL 73.A N.A THR 71.A O no hydrogen 2.825 N/A VAL 73.A N.B THR 71.A O no hydrogen 2.828 N/A GLY 75.A N ALA 72.A O no hydrogen 3.177 N/A ALA 77.A N VAL 63.A O no hydrogen 3.011 N/A ASN 78.A N ASP 104.A OD1 no hydrogen 2.983 N/A MET 79.A N GLY 61.A O no hydrogen 3.006 N/A THR 80.A N LYS 102.A O no hydrogen 2.882 N/A THR 80.A OG1 LYS 102.A O no hydrogen 3.374 N/A TYR 83.A N VAL 100.A O no hydrogen 2.894 N/A TYR 83.A OH GLU 81.A OE1 no hydrogen 2.831 N/A TYR 88.A N PRO 85.A O no hydrogen 2.898 N/A TYR 88.A OH HIS 47.A ND1.B no hydrogen 2.533 N/A ILE 89.A N PRO 85.A O no hydrogen 3.252 N/A ASN 90.A N SER 86.A O no hydrogen 2.974 N/A THR 91.A N GLY 87.A O no hydrogen 3.020 N/A THR 91.A OG1 GLY 87.A O no hydrogen 2.721 N/A GLY 92.A N TYR 88.A O no hydrogen 2.862 N/A ALA 93.A N THR 91.A OG1 no hydrogen 3.102 N/A SER 94.A OG TYR 190.A OH no hydrogen 2.811 N/A TYR 96.A N ALA 93.A O no hydrogen 3.118 N/A ASP 97.A N SER 94.A O no hydrogen 3.136 N/A PHE 98.A N TYR 96.A O no hydrogen 2.832 N/A ALA 99.A N THR 44.A O no hydrogen 2.983 N/A VAL 100.A N TYR 83.A O no hydrogen 2.994 N/A ILE 101.A N ILE 42.A O no hydrogen 2.749 N/A LYS 102.A N GLU 81.A O no hydrogen 2.901 N/A LYS 102.A NZ GLN 215.A O no hydrogen 2.859 N/A THR 103.A N ASN 40.A O no hydrogen 2.894 N/A THR 103.A OG1 THR 105.A O no hydrogen 2.748 N/A ASP 104.A N ASN 78.A O no hydrogen 2.963 N/A GLY 108.A N PRO 39.A O no hydrogen 2.819 N/A ASN 109.A N ASN 106.A O no hydrogen 3.133 N/A THR 110.A N ILE 107.A O no hydrogen 3.220 N/A THR 110.A OG1 ILE 107.A O no hydrogen 2.737 N/A VAL 111.A N ILE 107.A O no hydrogen 3.433 N/A GLY 112.A N GLY 108.A O no hydrogen 2.788 N/A ARG 114.A N LEU 36.A O.A no hydrogen 3.101 N/A ARG 114.A N LEU 36.A O.B no hydrogen 2.978 N/A ARG 114.A NH1 SER 21.A OG no hydrogen 2.815 N/A ARG 117.A N ILE 182.A O no hydrogen 2.995 N/A ARG 117.A NE ASP 177.A OD2 no hydrogen 2.921 N/A ARG 117.A NH2 ASP 177.A OD2 no hydrogen 2.931 N/A VAL 119.A N ALA 201.A O no hydrogen 3.071 N/A THR 120.A OG1 ASN 121.A OD1 no hydrogen 3.379 N/A ASN 121.A ND2 GLU 155.A OE2 no hydrogen 3.409 N/A LEU 122.A N GLU 155.A OE1 no hydrogen 2.973 N/A LEU 122.A N GLU 155.A OE2 no hydrogen 3.126 N/A THR 123.A N GLU 155.A OE2 no hydrogen 3.009 N/A THR 123.A OG1 GLU 155.A OE2 no hydrogen 2.702 N/A GLY 124.A N VAL 152.A O no hydrogen 2.994 N/A THR 125.A N LEU 122.A O no hydrogen 2.873 N/A THR 125.A OG1 LEU 122.A O no hydrogen 3.114 N/A ILE 127.A N GLY 150.A O no hydrogen 2.923 N/A LYS 128.A N LEU 176.A O no hydrogen 2.835 N/A LYS 128.A NZ TYR 19.A OH no hydrogen 2.876 N/A ILE 129.A N MET 148.A O no hydrogen 3.020 N/A SER 130.A OG GLN 145.A OE1 no hydrogen 2.717 N/A SER 130.A OG TRP 146.A O no hydrogen 3.470 N/A GLY 131.A N TRP 146.A O no hydrogen 2.995 N/A TYR 132.A N THR 33.A OG1 no hydrogen 3.052 N/A TYR 132.A OH MET 67.A O no hydrogen 2.654 N/A GLY 134.A N SER 168.A O no hydrogen 2.735 N/A LYS 136.A N ASP 135.A OD2 no hydrogen 2.981 N/A LYS 136.A NZ ASP 6.A OD2 no hydrogen 3.398 N/A ARG 138.A N GLY 134.A O no hydrogen 3.132 N/A SER 139.A N ASP 135.A O no hydrogen 3.096 N/A SER 139.A OG ASP 135.A O no hydrogen 3.562 N/A THR 140.A N LYS 136.A O no hydrogen 3.019 N/A THR 140.A OG1 LYS 136.A O no hydrogen 2.786 N/A LYS 142.A N THR 140.A OG1 no hydrogen 3.306 N/A VAL 143.A N SER 70.A OG no hydrogen 2.878 N/A SER 144.A OG ASP 69.A OD1 no hydrogen 3.357 N/A GLN 145.A NE2 TYR 19.A O no hydrogen 3.022 N/A GLN 145.A NE2 TYR 132.A OH no hydrogen 3.059 N/A TRP 146.A N GLY 131.A O no hydrogen 2.910 N/A GLU 147.A N THR 9.A O no hydrogen 2.840 N/A MET 148.A N ILE 129.A O no hydrogen 3.174 N/A GLY 150.A N ILE 127.A O no hydrogen 3.007 N/A VAL 152.A N THR 125.A O no hydrogen 2.968 N/A THR 153.A N TYR 161.A O no hydrogen 2.940 N/A THR 153.A OG1 TYR 161.A O no hydrogen 3.405 N/A ASP 156.A N LEU 159.A O no hydrogen 2.958 N/A ASN 158.A N ASP 156.A OD2 no hydrogen 3.071 N/A LEU 159.A N ASP 156.A OD2 no hydrogen 2.832 N/A ALA 160.A N GLY 198.A O no hydrogen 2.932 N/A TYR 161.A N ARG 154.A O no hydrogen 2.969 N/A TYR 161.A OH ASP 156.A OD1 no hydrogen 2.733 N/A TYR 162.A N ASN 196.A O no hydrogen 2.876 N/A TYR 162.A OH HIS 186.A ND1 no hydrogen 2.791 N/A THR 166.A N VAL 1.A O no hydrogen 3.048 N/A THR 166.A OG1 HIS 186.A NE2 no hydrogen 3.354 N/A ASN 170.A N PHE 167.A O no hydrogen 2.788 N/A ASN 170.A ND2 PHE 167.A O no hydrogen 3.279 N/A GLY 172.A N HIS 186.A O no hydrogen 3.116 N/A SER 173.A N ASN 170.A O no hydrogen 2.863 N/A SER 173.A OG SER 130.A O no hydrogen 3.536 N/A SER 173.A OG ASN 170.A O no hydrogen 2.794 N/A SER 173.A OG ASN 170.A OD1 no hydrogen 3.332 N/A MET 175.A N GLY 184.A O no hydrogen 2.907 N/A LEU 176.A N LYS 128.A O no hydrogen 3.026 N/A ASP 177.A N GLN 181.A O no hydrogen 3.014 N/A ASN 179.A N ASP 177.A OD1 no hydrogen 2.961 N/A GLN 180.A N ASP 177.A O no hydrogen 2.973 N/A GLN 181.A N ASP 177.A OD1 no hydrogen 2.953 N/A GLN 181.A NE2 SER 115.A OG no hydrogen 2.652 N/A ILE 182.A N SER 115.A O no hydrogen 2.921 N/A VAL 183.A N MET 175.A O no hydrogen 2.855 N/A VAL 185.A N.A PRO 199.A O no hydrogen 2.895 N/A VAL 185.A N.B PRO 199.A O no hydrogen 2.888 N/A HIS 186.A N SER 173.A O no hydrogen 2.808 N/A HIS 186.A ND1 TYR 162.A OH no hydrogen 2.791 N/A ASN 187.A N GLY 197.A O no hydrogen 3.041 N/A ASN 187.A ND2 SER 94.A OG no hydrogen 3.206 N/A ASN 187.A ND2 ASP 97.A OD1 no hydrogen 2.791 N/A ALA 188.A N GLY 197.A O no hydrogen 3.219 N/A TYR 190.A N ILE 195.A O no hydrogen 2.908 N/A TYR 190.A OH SER 94.A OG no hydrogen 2.811 N/A TYR 190.A OH ASN 187.A OD1 no hydrogen 2.727 N/A GLY 193.A N TYR 190.A O no hydrogen 2.988 N/A THR 194.A N TYR 190.A O no hydrogen 3.209 N/A THR 194.A OG1 SER 191.A O no hydrogen 2.684 N/A ASN 196.A N TYR 162.A O no hydrogen 2.777 N/A ASN 196.A ND2 VAL 1.A O no hydrogen 2.909 N/A ASN 196.A ND2 ILE 164.A O no hydrogen 2.721 N/A GLY 197.A N ALA 188.A O no hydrogen 3.013 N/A GLY 198.A N ALA 160.A O no hydrogen 3.051 N/A LYS 200.A N ASN 158.A O no hydrogen 2.889 N/A LYS 200.A NZ THR 120.A O no hydrogen 2.992 N/A LYS 200.A NZ GLU 155.A OE1 no hydrogen 2.665 N/A LYS 200.A NZ ASP 156.A O no hydrogen 2.785 N/A ALA 201.A N VAL 183.A O no hydrogen 2.827 N/A THR 202.A N LYS 200.A O no hydrogen 2.875 N/A VAL 206.A N THR 202.A O no hydrogen 2.967 N/A GLU 207.A N ALA 203.A O no hydrogen 3.032 N/A PHE 208.A N ALA 204.A O no hydrogen 3.273 N/A ILE 209.A N PHE 205.A O no hydrogen 3.144 N/A ASN 210.A N VAL 206.A O no hydrogen 2.959 N/A TYR 211.A N GLU 207.A O no hydrogen 3.162 N/A ALA 212.A N PHE 208.A O no hydrogen 2.936 N/A LYS 213.A N ILE 209.A O no hydrogen 2.750 N/A ALA 214.A N TYR 211.A O no hydrogen 3.098 N/A GLN 215.A N ALA 212.A O no hydrogen 3.143 N/A GLN 215.A NE2 TYR 211.A O no hydrogen 3.411 N/A