Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e45_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 112.A OE1 no hydrogen 2.622 N/A SER 1.A OG GLU 112.A OE2 no hydrogen 3.338 N/A PHE 2.A N GLU 112.A OE2 no hydrogen 2.876 N/A ILE 3.A N SER 1.A OG no hydrogen 3.328 N/A ILE 6.A N ILE 3.A O no hydrogen 2.931 N/A TYR 7.A N LYS 4.A O no hydrogen 2.921 N/A TYR 7.A OH THR 173.A OG1 no hydrogen 2.994 N/A ILE 10.A N ILE 6.A O no hydrogen 3.251 N/A ASN 11.A N TYR 7.A O no hydrogen 2.804 N/A SER 12.A N GLN 8.A O no hydrogen 2.889 N/A ILE 13.A N ASP 9.A O no hydrogen 3.029 N/A LEU 14.A N ILE 10.A O no hydrogen 3.063 N/A ILE 15.A N ASN 11.A O no hydrogen 3.403 N/A GLY 16.A N CYS 170.A O no hydrogen 3.158 N/A GLN 17.A N LEU 14.A O no hydrogen 2.951 N/A VAL 19.A N LEU 168.A O no hydrogen 2.831 N/A ARG 21.A N GLU 166.A O no hydrogen 3.260 N/A PHE 25.A N GLY 22.A O no hydrogen 3.155 N/A LYS 27.A N PRO 24.A O no hydrogen 3.297 N/A VAL 29.A N PHE 25.A O no hydrogen 3.050 N/A TYR 30.A N GLU 26.A O no hydrogen 3.012 N/A TYR 30.A OH GLU 46.A OE2 no hydrogen 2.696 N/A LYS 31.A N LYS 27.A O no hydrogen 2.727 N/A PHE 32.A N LEU 28.A O no hydrogen 2.881 N/A LEU 33.A N VAL 29.A O no hydrogen 3.103 N/A LYS 34.A N TYR 30.A O no hydrogen 2.863 N/A GLU 35.A N LYS 31.A O no hydrogen 2.981 N/A ASN 36.A N PHE 32.A O no hydrogen 2.872 N/A ASN 36.A N LEU 33.A O no hydrogen 2.968 N/A LEU 37.A N LEU 33.A O no hydrogen 2.552 N/A LEU 40.A N LEU 37.A O no hydrogen 3.037 N/A THR 41.A OG1 LEU 37.A O no hydrogen 3.070 N/A PHE 42.A N LEU 104.A O no hydrogen 2.851 N/A LYS 43.A N GLU 46.A OE2 no hydrogen 2.756 N/A LYS 43.A NZ ASP 102.A O no hydrogen 2.722 N/A GLN 44.A NE2 LEU 77.A O no hydrogen 2.802 N/A TYR 47.A N LYS 43.A O no hydrogen 2.862 N/A LEU 48.A N GLN 44.A O no hydrogen 3.224 N/A ASN 49.A N TYR 45.A O no hydrogen 2.877 N/A ASN 49.A ND2 PHE 93.A O no hydrogen 3.097 N/A ASP 50.A N GLU 46.A O no hydrogen 2.793 N/A LEU 51.A N TYR 47.A O no hydrogen 2.927 N/A PHE 52.A N LEU 48.A O no hydrogen 3.209 N/A MET 53.A N ASN 49.A O no hydrogen 3.221 N/A LYS 54.A N LEU 51.A O no hydrogen 3.319 N/A ASN 55.A ND2 LEU 51.A O no hydrogen 2.728 N/A HIS 61.A N GLU 85.A OE2 no hydrogen 2.348 N/A ARG 64.A N GLY 60.A O no hydrogen 3.107 N/A ARG 64.A NE ILE 58.A O no hydrogen 3.151 N/A ARG 64.A NH1 THR 84.A O no hydrogen 2.493 N/A ARG 64.A NH1 TRP 87.A O no hydrogen 3.341 N/A TYR 65.A N HIS 61.A O no hydrogen 2.752 N/A TYR 65.A OH ARG 79.A O no hydrogen 2.858 N/A LYS 66.A N GLU 62.A O no hydrogen 3.375 N/A LEU 67.A N ARG 64.A O no hydrogen 2.792 N/A PHE 68.A N TYR 65.A O no hydrogen 3.192 N/A ASN 69.A N LYS 66.A O no hydrogen 3.235 N/A SER 70.A OG GLU 148.A OE1 no hydrogen 2.893 N/A SER 70.A OG GLU 148.A OE2 no hydrogen 2.889 N/A THR 72.A N GLU 148.A OE2 no hydrogen 3.028 N/A THR 72.A OG1 GLU 148.A OE2 no hydrogen 2.477 N/A LEU 73.A N SER 70.A OG no hydrogen 3.167 N/A LEU 74.A N SER 70.A O no hydrogen 2.841 N/A LEU 76.A N THR 72.A O no hydrogen 3.080 N/A SER 78.A N LEU 74.A O no hydrogen 3.229 N/A SER 78.A OG LEU 74.A O no hydrogen 2.852 N/A ARG 79.A NE ASP 99.A OD1 no hydrogen 3.074 N/A ARG 79.A NE ASP 99.A OD2 no hydrogen 3.109 N/A ARG 79.A NH1 GLU 94.A O no hydrogen 2.441 N/A ARG 79.A NH1 ASP 99.A OD1 no hydrogen 2.805 N/A ARG 79.A NH2 GLU 94.A O no hydrogen 3.200 N/A THR 84.A N GLY 80.A O no hydrogen 3.117 N/A THR 84.A OG1 GLY 80.A O no hydrogen 2.715 N/A GLU 85.A N LYS 81.A O no hydrogen 3.113 N/A ASN 86.A N ALA 82.A O no hydrogen 2.780 N/A ASN 86.A ND2 ALA 82.A O no hydrogen 3.148 N/A TRP 87.A N THR 84.A O no hydrogen 3.238 N/A TRP 87.A NE1 ASN 49.A OD1 no hydrogen 3.113 N/A SER 88.A N ASN 91.A O no hydrogen 2.993 N/A GLU 90.A N SER 88.A OG no hydrogen 3.321 N/A PHE 93.A N ASN 49.A OD1 no hydrogen 2.981 N/A ASP 99.A N LYS 96.A O no hydrogen 2.653 N/A THR 100.A OG1 LEU 76.A O no hydrogen 2.654 N/A ALA 101.A N GLN 44.A OE1 no hydrogen 2.996 N/A ILE 103.A N LEU 114.A O no hydrogen 3.024 N/A LEU 104.A N PHE 42.A O no hydrogen 2.645 N/A LEU 105.A N GLU 112.A O no hydrogen 2.984 N/A VAL 106.A N LEU 40.A O no hydrogen 2.986 N/A LYS 107.A N PHE 110.A O no hydrogen 3.253 N/A PHE 110.A N LYS 107.A O no hydrogen 3.459 N/A TYR 111.A N LEU 151.A O no hydrogen 2.868 N/A TYR 111.A OH TYR 47.A OH no hydrogen 2.429 N/A GLU 112.A N LEU 105.A O no hydrogen 2.874 N/A LEU 113.A N ASP 153.A O no hydrogen 2.831 N/A LEU 114.A N ILE 103.A O no hydrogen 2.836 N/A ASP 115.A N ASN 155.A O no hydrogen 3.052 N/A VAL 116.A N ASP 102.A OD1 no hydrogen 3.047 N/A LYS 117.A N LEU 157.A O no hydrogen 2.792 N/A LYS 117.A NZ ASP 115.A OD2 no hydrogen 3.357 N/A LYS 117.A NZ ASN 129.A O no hydrogen 2.991 N/A ARG 119.A N VAL 159.A O no hydrogen 3.194 N/A ARG 119.A NH1 GLU 158.A OE1 no hydrogen 2.698 N/A ILE 121.A N TRP 161.A O no hydrogen 3.167 N/A SER 122.A N ASN 120.A OD1 no hydrogen 2.892 N/A SER 122.A OG ASN 120.A OD1 no hydrogen 3.062 N/A LYS 123.A N ASN 120.A O no hydrogen 3.222 N/A ILE 130.A N ILE 196.A O no hydrogen 2.652 N/A ALA 133.A N MET 194.A O no hydrogen 2.839 N/A TYR 134.A N SER 132.A OG no hydrogen 3.215 N/A LYS 135.A N SER 132.A OG no hydrogen 3.078 N/A LYS 135.A NZ THR 100.A OG1 no hydrogen 2.954 N/A LEU 136.A N SER 132.A O no hydrogen 2.943 N/A ALA 137.A N ALA 133.A O no hydrogen 2.898 N/A GLN 138.A N TYR 134.A O no hydrogen 3.023 N/A GLN 138.A NE2 TYR 134.A O no hydrogen 3.423 N/A THR 139.A N LYS 135.A O no hydrogen 3.088 N/A THR 139.A OG1 LYS 135.A O no hydrogen 2.956 N/A CYS 140.A N LEU 136.A O no hydrogen 2.846 N/A CYS 140.A SG LEU 136.A O no hydrogen 3.514 N/A CYS 140.A SG ALA 215.A O no hydrogen 3.966 N/A ALA 141.A N ALA 137.A O no hydrogen 2.781 N/A LYS 142.A N GLN 138.A O no hydrogen 2.876 N/A MET 143.A N THR 139.A O no hydrogen 2.824 N/A ILE 144.A N CYS 140.A O no hydrogen 2.872 N/A ASP 145.A N ALA 141.A O no hydrogen 2.792 N/A ASN 146.A N LYS 142.A O no hydrogen 3.002 N/A LYS 147.A N ILE 144.A O no hydrogen 2.855 N/A GLU 148.A N MET 143.A O no hydrogen 2.870 N/A ASP 153.A N TYR 111.A O no hydrogen 2.680 N/A ASN 155.A N LEU 113.A O no hydrogen 2.892 N/A ASN 155.A ND2 GLU 112.A OE1 no hydrogen 3.246 N/A TYR 156.A N ALA 176.A O no hydrogen 2.872 N/A LEU 157.A N ASP 115.A O no hydrogen 3.220 N/A GLU 158.A N SER 174.A O no hydrogen 2.858 N/A VAL 159.A N LYS 117.A O no hydrogen 2.725 N/A ASP 160.A N SER 172.A O no hydrogen 2.678 N/A TRP 161.A N ARG 119.A O no hydrogen 3.081 N/A GLU 162.A N VAL 169.A O no hydrogen 2.854 N/A LEU 168.A N VAL 19.A O no hydrogen 2.721 N/A VAL 169.A N GLU 162.A O no hydrogen 3.003 N/A CYS 170.A N GLN 17.A O no hydrogen 3.054 N/A CYS 170.A SG ASP 160.A O no hydrogen 3.377 N/A CYS 170.A SG SER 172.A O no hydrogen 3.530 N/A VAL 171.A N ASP 160.A O no hydrogen 2.660 N/A SER 172.A N ASP 160.A O no hydrogen 3.331 N/A SER 172.A OG ASP 160.A OD2 no hydrogen 3.448 N/A THR 173.A OG1 TYR 7.A OH no hydrogen 2.994 N/A THR 173.A OG1 ASN 11.A OD1 no hydrogen 2.927 N/A SER 174.A N GLU 158.A O no hydrogen 3.070 N/A SER 174.A OG GLU 158.A OE2 no hydrogen 3.493 N/A ALA 176.A N TYR 156.A O no hydrogen 3.113 N/A GLU 177.A N GLN 205.A OE1 no hydrogen 2.746 N/A LEU 178.A N ILE 154.A O no hydrogen 3.169 N/A LYS 180.A N GLU 177.A O no hydrogen 2.927 N/A SER 181.A N LEU 178.A O no hydrogen 2.886 N/A SER 181.A OG LEU 178.A O no hydrogen 2.623 N/A GLU 185.A N GLU 182.A O no hydrogen 2.920 N/A LEU 186.A N PRO 183.A O no hydrogen 3.198 N/A ASN 189.A N GLN 195.A O no hydrogen 3.107 N/A ASN 189.A ND2 GLN 197.A OE1 no hydrogen 2.736 N/A ALA 192.A N ASN 189.A O no hydrogen 3.024 N/A ALA 192.A N ASN 189.A OD1 no hydrogen 3.384 N/A ALA 193.A N ALA 191.A O no hydrogen 2.874 N/A MET 194.A N TRP 190.A O no hydrogen 2.997 N/A GLN 195.A N ALA 192.A O no hydrogen 3.069 N/A ILE 196.A N ILE 131.A O no hydrogen 2.914 N/A GLN 197.A N TYR 187.A O no hydrogen 2.804 N/A GLN 197.A NE2 ASN 129.A OD1 no hydrogen 2.632 N/A PHE 198.A N PRO 128.A O no hydrogen 3.365 N/A ARG 201.A N GLU 158.A OE2 no hydrogen 3.169 N/A ARG 201.A NH2 ASP 160.A OD2 no hydrogen 2.640 N/A ASP 202.A N HIS 199.A O no hydrogen 2.532 N/A LEU 203.A N VAL 200.A O no hydrogen 2.921 N/A GLN 205.A NE2 GLU 177.A O no hydrogen 2.911 N/A GLN 205.A NE2 ASP 204.A O no hydrogen 3.164 N/A PHE 207.A N LYS 180.A O no hydrogen 2.732 N/A THR 210.A N GLU 213.A OE1 no hydrogen 2.430 N/A ARG 211.A NH2 ASP 153.A OD1 no hydrogen 2.897 N/A GLU 213.A N THR 210.A OG1 no hydrogen 3.020 N/A TRP 214.A N THR 210.A O no hydrogen 3.014 N/A TRP 214.A NE1 SER 181.A O no hydrogen 2.917 N/A ALA 215.A N ARG 211.A O no hydrogen 3.074 N/A LYS 216.A N GLU 212.A O no hydrogen 3.152 N/A SER 217.A N GLU 213.A O no hydrogen 2.922 N/A TYR 218.A N TRP 214.A O no hydrogen 2.885 N/A TYR 218.A OH ALA 133.A O no hydrogen 2.790 N/A LEU 219.A N ALA 215.A O no hydrogen 2.983 N/A LYS 220.A N LYS 216.A O no hydrogen 2.964 N/A HIS 221.A N SER 217.A O no hydrogen 2.963 N/A HIS 221.A NE2 LEU 186.A O no hydrogen 2.826 N/A PHE 222.A N TYR 218.A O no hydrogen 2.640 N/A VAL 223.A N LEU 219.A O no hydrogen 2.969 N/A THR 224.A N LYS 220.A O no hydrogen 3.023 N/A THR 224.A OG1 LYS 220.A O no hydrogen 2.704 N/A GLN 225.A N HIS 221.A O no hydrogen 2.756 N/A ALA 226.A N PHE 222.A O no hydrogen 2.718 N/A GLU 227.A N VAL 223.A O no hydrogen 3.080 N/A GLN 228.A N THR 224.A O no hydrogen 3.115 N/A ARG 229.A N GLN 225.A O no hydrogen 3.148 N/A ALA 230.A N ALA 226.A O no hydrogen 3.027 N/A ILE 231.A N GLU 227.A O no hydrogen 3.469 N/A SER 232.A N GLN 228.A O no hydrogen 2.837 N/A SER 232.A OG GLN 228.A O no hydrogen 3.145 N/A MET 233.A N ARG 229.A O no hydrogen 2.967 N/A ILE 234.A N ILE 231.A O no hydrogen 3.104 N/A LYS 236.A N SER 232.A O no hydrogen 2.943 N/A PHE 237.A N MET 233.A O no hydrogen 2.536 N/A VAL 238.A N ILE 234.A O no hydrogen 3.186 N/A LYS 239.A N ILE 234.A O no hydrogen 2.645 N/A PHE 241.A N VAL 238.A O no hydrogen 3.213 N/A LYS 242.A N VAL 238.A O no hydrogen 3.175 N/A LYS 242.A N LYS 239.A O no hydrogen 3.311 N/A TYR 244.A N PHE 241.A O no hydrogen 3.174 N/A ILE 245.A N LYS 242.A O no hydrogen 3.209 N/A LEU 246.A N LYS 242.A O no hydrogen 3.307 N/A