Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1etp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 79.A OE1 no hydrogen 3.215 N/A ASP 3.A N ASP 80.A OD1 no hydrogen 2.793 N/A GLY 7.A N ASP 3.A O no hydrogen 2.926 N/A GLN 8.A N ALA 4.A O no hydrogen 2.934 N/A GLN 8.A NE2 GLN 8.A O no hydrogen 3.636 N/A GLY 9.A N ALA 6.A O no hydrogen 3.109 N/A LYS 10.A N GLY 7.A O no hydrogen 2.978 N/A LYS 10.A NZ ASP 77.A OD1 no hydrogen 2.672 N/A LYS 10.A NZ ASP 80.A OD2 no hydrogen 2.788 N/A CYS 14.A N VAL 11.A O no hydrogen 2.930 N/A GLY 15.A N VAL 11.A O no hydrogen 3.380 N/A CYS 17.A N CYS 14.A O no hydrogen 3.055 N/A HIS 18.A N CYS 14.A O no hydrogen 3.006 N/A HIS 18.A ND1 PRO 30.A O no hydrogen 2.929 N/A GLY 19.A N GLY 15.A O no hydrogen 2.852 N/A GLY 22.A N GLY 19.A O no hydrogen 3.112 N/A ASN 23.A N ASP 21.A OD1 no hydrogen 3.442 N/A ASN 23.A ND2 ASP 21.A OD2 no hydrogen 3.201 N/A ASN 23.A ND2 LYS 89.A O no hydrogen 2.855 N/A SER 24.A OG CYS 17.A O no hydrogen 3.160 N/A SER 24.A OG ALA 26.A O no hydrogen 3.242 N/A SER 24.A OG PHE 29.A O no hydrogen 2.682 N/A PHE 29.A N ALA 26.A O no hydrogen 2.986 N/A LYS 31.A N GLN 141.A OE1 no hydrogen 2.740 N/A LYS 31.A NZ SER 91.A O no hydrogen 3.168 N/A LYS 31.A NZ SER 91.A OG no hydrogen 2.770 N/A LYS 31.A NZ GLY 140.A O no hydrogen 2.834 N/A LEU 32.A N GLY 22.A O no hydrogen 2.755 N/A ALA 33.A N GLY 22.A O no hydrogen 3.213 N/A GLY 34.A N PHE 85.A O no hydrogen 3.031 N/A GLN 35.A N LEU 32.A O no hydrogen 3.283 N/A GLN 35.A NE2 LYS 137.A O no hydrogen 3.036 N/A GLY 36.A N GLN 35.A OE1 no hydrogen 2.889 N/A LEU 40.A N GLY 36.A O no hydrogen 2.927 N/A LEU 41.A N GLU 37.A O no hydrogen 2.807 N/A LYS 42.A N ARG 38.A O no hydrogen 2.927 N/A LYS 42.A NZ ASP 46.A OD2 no hydrogen 2.721 N/A LYS 42.A NZ ASN 160.A O no hydrogen 2.848 N/A GLN 43.A N TYR 39.A O no hydrogen 2.860 N/A LEU 44.A N LEU 40.A O no hydrogen 2.932 N/A GLN 45.A N LEU 41.A O no hydrogen 3.146 N/A GLN 45.A NE2 ASP 75.A OD2 no hydrogen 2.820 N/A ASP 46.A N LYS 42.A O no hydrogen 3.061 N/A ILE 47.A N GLN 43.A O no hydrogen 2.751 N/A LYS 48.A N LEU 44.A O no hydrogen 2.880 N/A LYS 48.A NZ LEU 73.A O no hydrogen 2.693 N/A ALA 49.A N GLN 45.A O no hydrogen 2.808 N/A GLY 50.A N ASP 46.A O no hydrogen 2.840 N/A SER 51.A N ILE 47.A O no hydrogen 2.772 N/A SER 51.A OG ILE 47.A O no hydrogen 2.888 N/A SER 51.A OG ARG 61.A O no hydrogen 3.282 N/A SER 51.A OG VAL 63.A O no hydrogen 3.299 N/A THR 52.A OG1 ASP 71.A OD1 no hydrogen 3.048 N/A THR 52.A OG1 ASP 71.A OD2 no hydrogen 2.878 N/A ALA 55.A N THR 52.A O no hydrogen 2.867 N/A VAL 59.A N PRO 56.A O no hydrogen 3.368 N/A ARG 61.A N ASP 46.A O no hydrogen 2.733 N/A ARG 61.A NH1 GLN 43.A OE1 no hydrogen 2.835 N/A ARG 61.A NH2 TYR 145.A OH no hydrogen 2.973 N/A VAL 63.A N SER 51.A OG no hydrogen 2.861 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.802 N/A MET 66.A N VAL 63.A O no hydrogen 3.076 N/A THR 67.A OG1 LEU 64.A O no hydrogen 3.324 N/A GLY 68.A N SER 51.A O no hydrogen 2.961 N/A MET 69.A N MET 66.A O no hydrogen 3.074 N/A LEU 73.A N LEU 70.A O no hydrogen 3.157 N/A SER 74.A N ASP 77.A OD2 no hydrogen 2.904 N/A GLN 76.A NE2 GLN 76.A O no hydrogen 3.449 N/A GLN 76.A NE2 ASP 80.A OD1 no hydrogen 3.260 N/A ASP 77.A N SER 74.A OG no hydrogen 3.380 N/A LEU 78.A N SER 74.A O no hydrogen 3.009 N/A GLU 79.A N ASP 75.A O no hydrogen 3.001 N/A ASP 80.A N GLN 76.A O no hydrogen 2.950 N/A ILE 81.A N ASP 77.A O no hydrogen 2.886 N/A ALA 82.A N LEU 78.A O no hydrogen 2.894 N/A ALA 83.A N GLU 79.A O no hydrogen 2.934 N/A TYR 84.A N ASP 80.A O no hydrogen 2.812 N/A TYR 84.A OH VAL 20.A O no hydrogen 2.976 N/A PHE 85.A N ILE 81.A O no hydrogen 3.076 N/A SER 86.A N ALA 82.A O no hydrogen 3.063 N/A SER 86.A OG GLN 35.A O no hydrogen 3.222 N/A SER 87.A OG ALA 83.A O no hydrogen 2.842 N/A SER 87.A OG TYR 84.A O no hydrogen 2.991 N/A GLN 88.A N PHE 85.A O no hydrogen 2.735 N/A GLN 88.A NE2 TYR 84.A O no hydrogen 2.945 N/A LYS 89.A NZ GLY 90.A O no hydrogen 3.457 N/A SER 91.A N ASN 23.A OD1 no hydrogen 3.089 N/A SER 91.A OG ASN 23.A OD1 no hydrogen 3.252 N/A GLY 93.A N GLN 187.A O no hydrogen 3.057 N/A LEU 99.A N ASP 96.A O no hydrogen 2.831 N/A ALA 100.A N ASP 96.A O no hydrogen 2.776 N/A GLN 102.A N LEU 99.A O no hydrogen 2.972 N/A GLY 103.A N LEU 99.A O no hydrogen 3.113 N/A GLU 104.A N ALA 100.A O no hydrogen 2.744 N/A LYS 105.A N LYS 101.A O no hydrogen 3.361 N/A LEU 106.A N GLN 102.A O no hydrogen 3.114 N/A PHE 107.A N GLY 103.A O no hydrogen 2.773 N/A ARG 108.A N GLU 104.A O no hydrogen 2.886 N/A GLY 109.A N LYS 105.A O no hydrogen 2.894 N/A GLY 110.A N LEU 106.A O no hydrogen 2.822 N/A LYS 111.A N MET 116.A O no hydrogen 2.927 N/A LYS 111.A NZ LYS 173.A O no hydrogen 2.730 N/A LYS 111.A NZ ASP 178.A OD2 no hydrogen 2.699 N/A GLN 114.A N LYS 111.A O no hydrogen 2.729 N/A GLY 115.A N LEU 112.A O no hydrogen 2.841 N/A MET 116.A N LYS 111.A O no hydrogen 3.066 N/A CYS 119.A N PHE 107.A O no hydrogen 2.798 N/A CYS 119.A SG PHE 107.A O no hydrogen 3.710 N/A HIS 123.A N CYS 119.A O no hydrogen 2.828 N/A HIS 123.A ND1 PRO 136.A O no hydrogen 2.981 N/A GLY 127.A N ALA 124.A O no hydrogen 2.826 N/A GLY 129.A N HIS 123.A O no hydrogen 3.046 N/A ASN 130.A N PHE 135.A O no hydrogen 2.759 N/A GLY 134.A N ASP 131.A O no hydrogen 3.011 N/A PHE 135.A N ASN 130.A O no hydrogen 2.756 N/A LYS 137.A N GLN 35.A OE1 no hydrogen 2.821 N/A LYS 137.A NZ GLY 139.A O no hydrogen 3.483 N/A LEU 138.A N GLY 127.A O no hydrogen 2.663 N/A GLY 139.A N GLY 127.A O no hydrogen 3.020 N/A GLY 140.A N ILE 186.A O no hydrogen 2.749 N/A GLN 141.A N LEU 138.A O no hydrogen 3.283 N/A GLN 141.A NE2 LYS 31.A O no hydrogen 3.217 N/A HIS 142.A N GLN 141.A OE1 no hydrogen 3.146 N/A HIS 142.A NE2 SER 24.A O no hydrogen 3.104 N/A ALA 143.A N GLN 187.A OE1 no hydrogen 2.973 N/A TYR 145.A N HIS 142.A O no hydrogen 2.898 N/A THR 146.A N HIS 142.A O no hydrogen 3.008 N/A THR 146.A OG1 HIS 142.A O no hydrogen 3.473 N/A ALA 147.A N ALA 143.A O no hydrogen 2.731 N/A LYS 148.A N ALA 144.A O no hydrogen 3.138 N/A LYS 148.A NZ ASP 152.A OD2 no hydrogen 2.839 N/A GLN 149.A N TYR 145.A O no hydrogen 3.058 N/A GLN 149.A NE2 TYR 145.A O no hydrogen 3.687 N/A LEU 150.A N THR 146.A O no hydrogen 3.064 N/A THR 151.A N ALA 147.A O no hydrogen 3.002 N/A THR 151.A OG1 ALA 147.A O no hydrogen 3.049 N/A ASP 152.A N LYS 148.A O no hydrogen 2.848 N/A PHE 153.A N GLN 149.A O no hydrogen 2.760 N/A ARG 154.A N LEU 150.A O no hydrogen 3.145 N/A ARG 154.A NH1 LEU 174.A O no hydrogen 3.055 N/A ARG 154.A NH1 ASN 176.A OD1 no hydrogen 3.103 N/A ARG 154.A NH2 ASN 176.A OD1 no hydrogen 2.914 N/A GLU 155.A N THR 151.A O no hydrogen 2.866 N/A GLY 156.A N PHE 153.A O no hydrogen 3.133 N/A ASN 157.A N ASP 152.A O no hydrogen 2.648 N/A ARG 158.A N ASP 152.A O no hydrogen 3.131 N/A ARG 158.A NE ASN 160.A OD1 no hydrogen 2.800 N/A ARG 158.A NH1 GLN 149.A OE1 no hydrogen 2.966 N/A ARG 158.A NH2 TYR 39.A OH no hydrogen 2.975 N/A ASN 160.A ND2 GLN 43.A OE1 no hydrogen 2.841 N/A ASN 160.A ND2 ASP 46.A OD2 no hydrogen 3.113 N/A MET 165.A N GLY 162.A O no hydrogen 3.039 N/A MET 167.A N ASP 161.A OD2 no hydrogen 2.716 N/A ARG 168.A N ASP 161.A OD2 no hydrogen 2.948 N/A ARG 168.A NE ASP 161.A OD1 no hydrogen 2.813 N/A ARG 168.A NH2 ASP 161.A OD1 no hydrogen 3.030 N/A GLY 169.A N MET 165.A O no hydrogen 3.146 N/A ALA 171.A N MET 167.A O no hydrogen 2.798 N/A ALA 172.A N ARG 168.A O no hydrogen 3.091 N/A LYS 173.A N VAL 170.A O no hydrogen 3.265 N/A LYS 173.A NZ GLY 115.A O no hydrogen 3.020 N/A LEU 174.A N ALA 171.A O no hydrogen 2.966 N/A SER 175.A N ASP 178.A OD2 no hydrogen 2.961 N/A ASP 178.A N SER 175.A OG no hydrogen 2.935 N/A ILE 179.A N SER 175.A O no hydrogen 2.871 N/A GLU 180.A N ASN 176.A O no hydrogen 2.988 N/A ALA 181.A N LYS 177.A O no hydrogen 2.849 N/A LEU 182.A N ASP 178.A O no hydrogen 2.767 N/A SER 183.A N ILE 179.A O no hydrogen 2.800 N/A SER 183.A OG ILE 179.A O no hydrogen 2.703 N/A SER 184.A N GLU 180.A O no hydrogen 3.219 N/A TYR 185.A N ALA 181.A O no hydrogen 3.121 N/A ILE 186.A N LEU 182.A O no hydrogen 2.985 N/A GLN 187.A N SER 183.A O no hydrogen 3.283 N/A GLN 187.A NE2 TYR 94.A O no hydrogen 2.745 N/A GLY 188.A N TYR 185.A O no hydrogen 3.337 N/A LEU 189.A N ILE 186.A O no hydrogen 3.202 N/A HIS 190.A ND1 GLY 188.A O no hydrogen 2.968 N/A