Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w80_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N ASN 123.A OD1 no hydrogen 2.964 N/A ALA 8.A N SER 125.A O no hydrogen 2.875 N/A SER 11.A N ALA 8.A O no hydrogen 2.982 N/A ASN 14.A N GLY 10.A O no hydrogen 2.925 N/A ASN 14.A ND2 GLY 10.A O no hydrogen 2.967 N/A PHE 15.A N SER 11.A O no hydrogen 2.804 N/A ALA 16.A N GLU 12.A O no hydrogen 3.085 N/A ARG 17.A N ASN 14.A O no hydrogen 3.144 N/A PHE 18.A N PHE 15.A O no hydrogen 2.987 N/A CYS 20.A SG LYS 178.A O no hydrogen 3.463 N/A LYS 21.A NZ ASN 23.A O no hydrogen 2.563 N/A GLY 24.A N LEU 36.A O no hydrogen 3.179 N/A LEU 26.A N ILE 34.A O no hydrogen 2.782 N/A PHE 27.A N ILE 34.A O no hydrogen 3.188 N/A ASN 29.A N LEU 32.A O no hydrogen 2.895 N/A LEU 31.A N ASN 29.A OD1 no hydrogen 2.911 N/A LEU 32.A N ASN 29.A OD1 no hydrogen 3.038 N/A GLN 33.A N GLY 52.A O no hydrogen 2.952 N/A GLN 33.A NE2 GLU 28.A OE2 no hydrogen 3.108 N/A ILE 34.A N PHE 27.A O no hydrogen 2.693 N/A GLY 35.A N PHE 50.A O no hydrogen 2.991 N/A LEU 36.A N GLY 24.A O no hydrogen 2.889 N/A LYS 37.A N PHE 48.A O no hydrogen 3.110 N/A LYS 37.A NZ ASN 23.A OD1 no hydrogen 2.821 N/A GLU 39.A N ARG 46.A O no hydrogen 2.962 N/A ARG 41.A N LEU 44.A O no hydrogen 3.063 N/A ASN 43.A ND2 CYS 101.A O no hydrogen 3.164 N/A LEU 44.A N ARG 41.A O no hydrogen 3.018 N/A GLY 45.A N ILE 99.A O no hydrogen 2.943 N/A ARG 46.A N GLU 39.A O no hydrogen 2.899 N/A ARG 46.A NE ASN 98.A OD1 no hydrogen 3.332 N/A MET 47.A N ILE 97.A O no hydrogen 2.865 N/A PHE 48.A N LYS 37.A O no hydrogen 2.858 N/A ILE 49.A N GLN 95.A O no hydrogen 2.858 N/A PHE 50.A N GLY 35.A O no hydrogen 2.920 N/A TYR 51.A N VAL 93.A O no hydrogen 2.669 N/A GLY 52.A N GLN 33.A O no hydrogen 2.833 N/A ASN 53.A N ALA 91.A O no hydrogen 2.804 N/A ASN 53.A ND2 THR 57.A O no hydrogen 2.888 N/A ASN 53.A ND2 VAL 87.A O no hydrogen 3.188 N/A LYS 54.A N LEU 31.A O no hydrogen 2.803 N/A LYS 54.A NZ GLU 28.A OE1 no hydrogen 2.644 N/A LYS 54.A NZ ASN 29.A O no hydrogen 2.701 N/A THR 55.A N ASN 53.A OD1 no hydrogen 2.901 N/A THR 55.A OG1 ASN 53.A OD1 no hydrogen 2.741 N/A THR 57.A N THR 55.A OG1 no hydrogen 3.109 N/A GLN 58.A NE2 ASP 88.A OD1 no hydrogen 2.453 N/A PHE 59.A N VAL 87.A O no hydrogen 2.809 N/A LEU 60.A N ARG 116.A O no hydrogen 3.029 N/A PHE 62.A N PRO 85.A O no hydrogen 2.643 N/A THR 63.A N GLN 114.A O no hydrogen 2.730 N/A THR 63.A OG1 ASN 61.A O no hydrogen 2.576 N/A THR 65.A N ASN 112.A O no hydrogen 2.724 N/A ILE 67.A N VAL 110.A O no hydrogen 2.739 N/A GLN 73.A N ALA 69.A O no hydrogen 2.931 N/A GLN 73.A NE2 CYS 68.A O no hydrogen 2.702 N/A THR 74.A OG1 ASP 71.A O no hydrogen 2.774 N/A ASN 75.A N ASP 71.A O no hydrogen 3.168 N/A ASN 75.A N LEU 72.A O no hydrogen 2.773 N/A LEU 76.A N LEU 72.A O no hydrogen 2.848 N/A ASN 77.A N.A GLU 100.A O no hydrogen 2.904 N/A ASN 77.A N.B GLU 100.A O no hydrogen 2.943 N/A ASN 77.A ND2.A GLU 100.A OE1 no hydrogen 2.975 N/A ASN 77.A ND2.B GLU 100.A OE1 no hydrogen 3.282 N/A GLN 79.A N ASN 98.A O no hydrogen 2.769 N/A THR 80.A OG1 GLN 95.A OE1 no hydrogen 2.975 N/A THR 80.A OG1 VAL 96.A O no hydrogen 2.746 N/A THR 86.A N ASP 84.A OD1 no hydrogen 3.125 N/A VAL 87.A N PHE 59.A O no hydrogen 2.841 N/A GLY 90.A N THR 55.A O no hydrogen 2.992 N/A ALA 91.A N ASP 88.A O no hydrogen 2.949 N/A VAL 93.A N TYR 51.A O no hydrogen 2.845 N/A GLN 95.A N ILE 49.A O no hydrogen 2.992 N/A ILE 97.A N MET 47.A O no hydrogen 2.726 N/A ASN 98.A N GLN 79.A O no hydrogen 2.775 N/A ASN 98.A ND2 GLN 79.A OE1 no hydrogen 2.947 N/A ILE 99.A N GLY 45.A O no hydrogen 2.814 N/A GLU 100.A N ASN 77.A O.A no hydrogen 2.846 N/A GLU 100.A N ASN 77.A O.B no hydrogen 2.796 N/A CYS 101.A N ASN 43.A O no hydrogen 2.708 N/A CYS 101.A SG SER 103.A O.A no hydrogen 3.438 N/A CYS 101.A SG SER 103.A O.B no hydrogen 3.131 N/A ILE 102.A N ASN 75.A O no hydrogen 2.644 N/A SER 103.A N.A ASN 75.A O no hydrogen 3.204 N/A SER 103.A N.B ASN 75.A O no hydrogen 3.190 N/A VAL 110.A N ILE 67.A O no hydrogen 2.811 N/A LEU 111.A N VAL 126.A O no hydrogen 2.813 N/A ASN 112.A N THR 65.A O no hydrogen 2.841 N/A ASN 112.A ND2 ASN 123.A OD1 no hydrogen 2.897 N/A ASN 112.A ND2 SER 125.A OG no hydrogen 2.916 N/A ILE 113.A N VAL 124.A O no hydrogen 2.875 N/A GLN 114.A N THR 63.A O no hydrogen 3.106 N/A GLN 114.A NE2 PRO 1.A O no hydrogen 2.464 N/A GLN 114.A NE2 ASN 112.A OD1 no hydrogen 2.949 N/A PHE 115.A N GLN 122.A O no hydrogen 3.348 N/A ARG 116.A N LEU 60.A O no hydrogen 2.839 N/A TYR 117.A N THR 120.A O no hydrogen 3.086 N/A THR 120.A N TYR 117.A O no hydrogen 2.871 N/A THR 120.A OG1 TYR 117.A O no hydrogen 2.657 N/A GLN 122.A N PHE 115.A O no hydrogen 2.901 N/A GLN 122.A NE2 THR 120.A OG1 no hydrogen 2.978 N/A ASN 123.A ND2 ILE 3.A O no hydrogen 2.756 N/A VAL 124.A N ILE 113.A O no hydrogen 2.827 N/A SER 125.A OG ALA 5.A O no hydrogen 2.742 N/A VAL 126.A N LEU 111.A O no hydrogen 2.907 N/A LYS 127.A N SER 11.A OG no hydrogen 3.262 N/A LYS 127.A NZ GLU 12.A OE1 no hydrogen 2.804 N/A LEU 128.A N PRO 109.A O no hydrogen 2.883 N/A ILE 130.A N LEU 128.A O no hydrogen 2.793 N/A THR 131.A OG1 ASN 133.A OD1 no hydrogen 2.726 N/A ASN 133.A ND2 VAL 19.A O no hydrogen 2.793 N/A ASN 133.A ND2 PHE 182.A O no hydrogen 3.221 N/A LYS 134.A N THR 131.A O no hydrogen 3.006 N/A LYS 134.A NZ PHE 18.A O no hydrogen 3.043 N/A LYS 134.A NZ VAL 19.A O no hydrogen 3.084 N/A LYS 134.A NZ LYS 21.A O no hydrogen 3.117 N/A LYS 134.A NZ ASN 22.A OD1 no hydrogen 3.181 N/A PHE 135.A N LEU 132.A O no hydrogen 3.039 N/A PHE 136.A N ASN 133.A O no hydrogen 2.925 N/A GLN 137.A N ILE 202.A O no hydrogen 2.901 N/A THR 139.A N ALA 200.A O no hydrogen 3.030 N/A PHE 146.A N ALA 142.A O no hydrogen 2.971 N/A PHE 147.A N SER 143.A O no hydrogen 3.063 N/A GLN 148.A N GLN 144.A O no hydrogen 3.113 N/A ARG 149.A N ASP 145.A O no hydrogen 3.132 N/A ARG 149.A NH1 ASP 145.A O no hydrogen 2.751 N/A ARG 149.A NH1 GLN 148.A OE1 no hydrogen 3.375 N/A TRP 150.A N PHE 146.A O no hydrogen 2.708 N/A LYS 151.A N PHE 147.A O no hydrogen 2.975 N/A GLN 152.A N GLN 148.A O no hydrogen 3.182 N/A LEU 153.A N TRP 150.A O no hydrogen 3.037 N/A SER 154.A OG LYS 151.A O no hydrogen 3.418 N/A ASN 155.A N GLN 158.A OE1 no hydrogen 3.232 N/A GLN 158.A N ASN 155.A O no hydrogen 3.115 N/A GLU 159.A N PRO 156.A O no hydrogen 3.379 N/A VAL 160.A N LEU 229.A O no hydrogen 2.876 N/A GLN 161.A NE2 THR 228.A OG1 no hydrogen 2.865 N/A ASN 162.A N LEU 227.A O no hydrogen 2.982 N/A ASN 162.A ND2 SER 245.A OG no hydrogen 3.163 N/A PHE 164.A N TYR 225.A O no hydrogen 3.025 N/A ALA 166.A N GLN 223.A O no hydrogen 2.951 N/A LYS 167.A N PHE 248.A OXT no hydrogen 2.723 N/A LYS 167.A NZ GLU 246.A OE1 no hydrogen 3.374 N/A HIS 168.A N PHE 248.A O no hydrogen 2.949 N/A GLU 173.A N ASP 171.A OD1 no hydrogen 3.158 N/A ILE 174.A N ASP 171.A OD1 no hydrogen 3.316 N/A THR 175.A N ASP 171.A O no hydrogen 2.854 N/A THR 175.A OG1 ASP 171.A O no hydrogen 3.311 N/A LYS 176.A N THR 172.A O no hydrogen 2.933 N/A LYS 176.A NZ GLU 173.A OE1 no hydrogen 2.985 N/A ALA 177.A N GLU 173.A O no hydrogen 3.067 N/A LYS 178.A N ILE 174.A O no hydrogen 3.005 N/A LYS 178.A NZ GLN 247.A O no hydrogen 3.017 N/A ILE 179.A N THR 175.A O no hydrogen 3.097 N/A ILE 180.A N LYS 176.A O no hydrogen 3.082 N/A GLY 181.A N ALA 177.A O no hydrogen 2.812 N/A PHE 182.A N ILE 179.A O no hydrogen 3.103 N/A GLY 183.A N ILE 180.A O no hydrogen 2.821 N/A SER 184.A N ILE 179.A O no hydrogen 3.381 N/A SER 184.A OG ALA 185.A O no hydrogen 2.745 N/A ALA 185.A N ALA 200.A O no hydrogen 2.982 N/A LEU 187.A N VAL 198.A O no hydrogen 2.865 N/A ASN 193.A N ASP 191.A OD1 no hydrogen 2.963 N/A ALA 195.A N ASN 193.A OD1 no hydrogen 3.007 N/A ASN 196.A N ASN 193.A O no hydrogen 3.081 N/A ASN 196.A ND2 ASP 191.A OD1 no hydrogen 3.470 N/A ASN 196.A ND2 ASP 191.A OD2 no hydrogen 2.862 N/A PHE 197.A N LEU 216.A O no hydrogen 2.814 N/A GLY 199.A N LEU 214.A O no hydrogen 3.020 N/A ALA 200.A N ALA 185.A O no hydrogen 3.392 N/A GLY 201.A N CYS 212.A O no hydrogen 2.808 N/A ILE 202.A N GLN 137.A O no hydrogen 3.067 N/A ILE 203.A N ILE 210.A O no hydrogen 2.790 N/A HIS 204.A N PHE 135.A O no hydrogen 2.874 N/A THR 205.A N THR 208.A O no hydrogen 3.158 N/A THR 205.A OG1 ILE 102.A O no hydrogen 3.397 N/A THR 205.A OG1 THR 208.A O no hydrogen 2.735 N/A LYS 206.A N CYS 101.A O no hydrogen 2.948 N/A LYS 206.A NZ GLU 100.A OE2 no hydrogen 2.678 N/A THR 207.A N ILE 102.A O no hydrogen 3.062 N/A THR 207.A OG1 ILE 102.A O no hydrogen 2.837 N/A THR 208.A N THR 205.A OG1 no hydrogen 3.164 N/A ILE 210.A N ILE 203.A O no hydrogen 3.014 N/A CYS 212.A N GLY 201.A O no hydrogen 2.762 N/A CYS 212.A SG ILE 210.A O no hydrogen 3.445 N/A LEU 213.A N ARG 230.A O no hydrogen 2.944 N/A LEU 214.A N GLY 199.A O no hydrogen 2.911 N/A ARG 215.A N THR 228.A O no hydrogen 2.907 N/A ARG 215.A NE ASP 191.A OD2 no hydrogen 2.933 N/A ARG 215.A NH2 ASP 191.A OD2 no hydrogen 3.182 N/A LEU 216.A N PHE 197.A O no hydrogen 2.655 N/A GLU 217.A N ARG 226.A O no hydrogen 2.810 N/A ASN 219.A N MET 224.A O no hydrogen 2.828 N/A ALA 222.A N ASN 219.A OD1 no hydrogen 2.934 N/A MET 224.A N ASN 219.A O no hydrogen 3.298 N/A TYR 225.A N PHE 164.A O no hydrogen 2.964 N/A ARG 226.A N GLU 217.A O no hydrogen 2.955 N/A ARG 226.A NE GLU 217.A OE1 no hydrogen 2.929 N/A ARG 226.A NH2 GLU 217.A OE1 no hydrogen 2.865 N/A LEU 227.A N ASN 162.A O no hydrogen 2.922 N/A THR 228.A N ARG 215.A O no hydrogen 2.907 N/A LEU 229.A N VAL 160.A O no hydrogen 2.813 N/A ARG 230.A N LEU 213.A O no hydrogen 2.933 N/A ARG 230.A NE GLU 159.A OE2 no hydrogen 2.941 N/A ARG 230.A NH1 TRP 150.A O no hydrogen 2.830 N/A ARG 230.A NH2 GLU 159.A OE2 no hydrogen 3.041 N/A THR 231.A N GLN 158.A O no hydrogen 3.265 N/A THR 231.A OG1 SER 237.A OG no hydrogen 2.877 N/A LYS 233.A N THR 231.A OG1 no hydrogen 3.013 N/A LYS 233.A NZ ASP 104.A OD1 no hydrogen 2.512 N/A THR 235.A N ASP 234.A OD1 no hydrogen 2.910 N/A THR 235.A OG1 ASP 104.A OD2 no hydrogen 2.827 N/A SER 237.A N LYS 233.A O no hydrogen 2.974 N/A SER 237.A OG GLN 158.A O no hydrogen 2.792 N/A SER 237.A OG THR 231.A OG1 no hydrogen 2.877 N/A SER 237.A OG LYS 233.A O no hydrogen 3.345 N/A GLN 238.A N.A ASP 234.A O no hydrogen 2.881 N/A GLN 238.A N.B ASP 234.A O no hydrogen 2.928 N/A ARG 239.A N THR 235.A O no hydrogen 2.884 N/A ARG 239.A NH1 GLU 242.A OE1 no hydrogen 2.843 N/A LEU 240.A N VAL 236.A O no hydrogen 2.969 N/A CYS 241.A N SER 237.A O no hydrogen 2.940 N/A GLU 242.A N GLN 238.A O.A no hydrogen 2.893 N/A GLU 242.A N GLN 238.A O.B no hydrogen 3.022 N/A LEU 243.A N ARG 239.A O no hydrogen 2.993 N/A LEU 244.A N LEU 240.A O no hydrogen 2.853 N/A SER 245.A N CYS 241.A O no hydrogen 3.025 N/A SER 245.A OG CYS 241.A O no hydrogen 2.869 N/A GLU 246.A N LEU 243.A O no hydrogen 3.257 N/A GLN 247.A N LEU 244.A O no hydrogen 3.173 N/A GLN 247.A NE2 ALA 16.A O no hydrogen 3.108 N/A GLN 247.A NE2 LEU 243.A O no hydrogen 3.413 N/A