Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xe3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N TYR 81.A OH no hydrogen 3.407 N/A SER 3.A OG ILE 6.A O no hydrogen 3.472 N/A SER 3.A OG GLU 76.A OE1 no hydrogen 2.657 N/A HIS 5.A N GLU 76.A OE1 no hydrogen 3.139 N/A HIS 5.A ND1 GLU 76.A OE2 no hydrogen 2.614 N/A GLU 7.A N ASN 41.A OD1 no hydrogen 3.078 N/A LYS 9.A N GLU 12.A OE1 no hydrogen 2.552 N/A GLN 10.A NE2 HIS 1.A O no hydrogen 2.991 N/A GLN 10.A NE2 SER 80.A O no hydrogen 2.913 N/A GLU 12.A N LYS 9.A O no hydrogen 3.067 N/A ALA 14.A N SER 59.A OG no hydrogen 2.959 N/A ILE 17.A N ASN 85.A O no hydrogen 2.866 N/A LEU 18.A N SER 59.A O no hydrogen 2.862 N/A LEU 19.A N ILE 87.A O no hydrogen 2.849 N/A LEU 24.A N ASP 22.A OD1 no hydrogen 2.852 N/A ARG 25.A N ASP 22.A O no hydrogen 2.915 N/A ARG 25.A NE PRO 20.A O no hydrogen 2.915 N/A ARG 25.A NH2 VAL 89.A O no hydrogen 3.526 N/A ALA 26.A N ASP 22.A O no hydrogen 3.211 N/A LYS 27.A N PRO 23.A O no hydrogen 3.078 N/A LYS 27.A NZ GLU 31.A OE2 no hydrogen 3.409 N/A TYR 28.A N LEU 24.A O no hydrogen 3.054 N/A TYR 28.A OH ASN 223.A OD1 no hydrogen 2.668 N/A ILE 29.A N ARG 25.A O no hydrogen 2.920 N/A ALA 30.A N ALA 26.A O no hydrogen 2.994 N/A GLU 31.A N LYS 27.A O no hydrogen 2.972 N/A THR 32.A N TYR 28.A O no hydrogen 2.951 N/A THR 32.A OG1 TYR 28.A O no hydrogen 2.717 N/A PHE 33.A N ILE 29.A O no hydrogen 2.850 N/A LEU 34.A N ALA 30.A O no hydrogen 3.128 N/A GLU 35.A N THR 52.A O no hydrogen 2.851 N/A THR 38.A N THR 50.A O no hydrogen 2.844 N/A CYS 39.A SG ASN 41.A O no hydrogen 3.336 N/A CYS 39.A SG GLY 48.A O no hydrogen 3.614 N/A TYR 40.A N GLY 48.A O no hydrogen 2.873 N/A TYR 40.A OH GLN 61.A OE1 no hydrogen 2.551 N/A ASN 41.A ND2 VAL 43.A O no hydrogen 3.620 N/A ASN 41.A ND2 MET 46.A O no hydrogen 2.762 N/A ASN 42.A N GLU 7.A OE2 no hydrogen 2.731 N/A VAL 43.A N ASN 41.A OD1 no hydrogen 3.223 N/A GLY 45.A N ASN 42.A O no hydrogen 2.787 N/A MET 46.A N VAL 43.A O no hydrogen 3.016 N/A GLY 48.A N ASN 41.A O no hydrogen 3.399 N/A PHE 49.A N VAL 60.A O no hydrogen 2.865 N/A THR 50.A N THR 38.A O no hydrogen 2.909 N/A THR 50.A OG1 GLU 12.A O no hydrogen 2.540 N/A THR 50.A OG1 SER 59.A OG no hydrogen 2.801 N/A GLY 51.A N VAL 58.A O no hydrogen 2.989 N/A THR 52.A N GLU 35.A O no hydrogen 2.724 N/A TYR 53.A N LYS 56.A O no hydrogen 2.868 N/A TYR 53.A OH ASP 231.A OD2 no hydrogen 3.049 N/A LYS 54.A NZ ASP 231.A OD2 no hydrogen 2.916 N/A LYS 56.A N TYR 53.A O no hydrogen 3.003 N/A ARG 57.A NH1 ASP 36.A O no hydrogen 3.296 N/A VAL 58.A N GLY 51.A O no hydrogen 3.015 N/A SER 59.A N SER 16.A O no hydrogen 3.062 N/A SER 59.A OG PHE 49.A O no hydrogen 3.559 N/A SER 59.A OG THR 50.A OG1 no hydrogen 2.801 N/A VAL 60.A N PHE 49.A O no hydrogen 2.924 N/A GLN 61.A N LEU 18.A O no hydrogen 2.975 N/A GLN 61.A NE2 MET 46.A O no hydrogen 3.211 N/A GLN 61.A NE2 GLY 62.A O no hydrogen 2.872 N/A GLY 62.A N LEU 47.A O no hydrogen 2.927 N/A THR 63.A N GLY 21.A O no hydrogen 2.993 N/A GLY 66.A N GLU 182.A OE2 no hydrogen 2.770 N/A ILE 70.A N GLY 66.A O no hydrogen 3.088 N/A SER 71.A N VAL 67.A O no hydrogen 2.866 N/A SER 71.A OG VAL 67.A O no hydrogen 2.579 N/A ILE 72.A N PRO 68.A O no hydrogen 3.296 N/A TYR 73.A N SER 69.A O no hydrogen 3.384 N/A VAL 74.A N ILE 70.A O no hydrogen 2.868 N/A ASN 75.A N SER 71.A O no hydrogen 2.940 N/A GLU 76.A N ILE 72.A O no hydrogen 3.164 N/A LEU 77.A N TYR 73.A O no hydrogen 2.887 N/A ILE 78.A N VAL 74.A O no hydrogen 3.060 N/A GLN 79.A N ASN 75.A O no hydrogen 2.986 N/A SER 80.A N GLU 76.A O no hydrogen 2.872 N/A TYR 81.A N LEU 77.A O no hydrogen 3.171 N/A TYR 81.A OH ILE 6.A O no hydrogen 3.078 N/A TYR 81.A OH ALA 8.A O no hydrogen 2.621 N/A GLY 82.A N ILE 78.A O no hydrogen 3.084 N/A VAL 83.A N LEU 77.A O no hydrogen 3.219 N/A LYS 84.A N GLU 15.A O no hydrogen 2.694 N/A LYS 84.A NZ GLY 82.A O no hydrogen 3.160 N/A ASN 85.A N GLU 15.A O no hydrogen 2.989 N/A ASN 85.A ND2 SER 16.A OG no hydrogen 3.423 N/A LEU 86.A N ASN 196.A O no hydrogen 2.850 N/A ILE 87.A N ILE 17.A O no hydrogen 2.978 N/A ARG 88.A N LEU 198.A O no hydrogen 2.835 N/A ARG 88.A NE GLU 182.A OE1 no hydrogen 3.335 N/A ARG 88.A NH1 LEU 19.A O no hydrogen 3.132 N/A ARG 88.A NH2 GLU 182.A OE1 no hydrogen 2.855 N/A VAL 89.A N LEU 19.A O no hydrogen 3.306 N/A GLY 90.A N VAL 200.A O no hydrogen 3.099 N/A CYS 92.A N THR 202.A O no hydrogen 2.908 N/A GLY 93.A N VAL 179.A O no hydrogen 2.998 N/A ALA 94.A N ASP 205.A O no hydrogen 2.809 N/A ILE 95.A N LEU 177.A O no hydrogen 2.940 N/A LYS 97.A NZ ASP 98.A OD2 no hydrogen 3.558 N/A VAL 99.A N GLN 96.A O no hydrogen 3.206 N/A LYS 100.A N ASP 103.A OD2 no hydrogen 2.768 N/A ARG 102.A N VAL 203.A O no hydrogen 2.789 N/A ARG 102.A NH1 THR 221.A OG1 no hydrogen 3.163 N/A ASP 103.A N LYS 100.A O no hydrogen 3.104 N/A VAL 104.A N HIS 148.A O no hydrogen 2.948 N/A ILE 105.A N LEU 201.A O no hydrogen 2.723 N/A ILE 106.A N ARG 150.A O no hydrogen 2.932 N/A ALA 107.A N SER 199.A O no hydrogen 3.207 N/A MET 108.A N GLY 152.A O no hydrogen 2.709 N/A THR 109.A OG1 PRO 128.A O no hydrogen 2.634 N/A ALA 110.A N THR 109.A OG1 no hydrogen 2.817 N/A CYS 111.A N VAL 154.A O no hydrogen 2.683 N/A CYS 111.A SG ASN 153.A OD1 no hydrogen 4.039 N/A THR 112.A OG1 THR 156.A O no hydrogen 2.763 N/A SER 114.A N THR 112.A OG1 no hydrogen 3.075 N/A MET 116.A N SER 114.A OG no hydrogen 3.095 N/A ARG 118.A NH1 ASP 125.A OD1 no hydrogen 2.828 N/A LEU 119.A N ASN 115.A O no hydrogen 3.188 N/A THR 120.A OG1 MET 116.A O no hydrogen 3.365 N/A PHE 121.A N ASN 117.A O no hydrogen 2.897 N/A PHE 124.A N PHE 121.A O no hydrogen 2.983 N/A ALA 130.A N MET 108.A O no hydrogen 3.029 N/A ASN 131.A N ALA 197.A O no hydrogen 2.939 N/A LEU 135.A N ASN 131.A O no hydrogen 3.034 N/A LYS 136.A N PHE 132.A O no hydrogen 2.800 N/A LYS 136.A NZ ASP 140.A OD2 no hydrogen 3.437 N/A LYS 137.A N ASP 133.A O no hydrogen 3.099 N/A ALA 138.A N LEU 134.A O no hydrogen 2.906 N/A TYR 139.A N LEU 135.A O no hydrogen 2.872 N/A ASP 140.A N LYS 136.A O no hydrogen 2.937 N/A ALA 141.A N LYS 137.A O no hydrogen 2.893 N/A GLY 142.A N ALA 138.A O no hydrogen 2.836 N/A THR 143.A N TYR 139.A O no hydrogen 2.853 N/A GLU 144.A N ASP 140.A O no hydrogen 3.001 N/A LYS 145.A N ALA 141.A O no hydrogen 3.182 N/A GLY 146.A N THR 143.A O no hydrogen 3.081 N/A LEU 147.A N GLY 142.A O no hydrogen 3.170 N/A ARG 150.A N VAL 104.A O no hydrogen 2.827 N/A ARG 150.A NH1 ASP 103.A OD2 no hydrogen 2.782 N/A GLY 152.A N ILE 106.A O no hydrogen 3.257 N/A ASN 153.A ND2 GLY 175.A O no hydrogen 3.438 N/A VAL 154.A N THR 109.A O no hydrogen 3.395 N/A LEU 155.A N ALA 178.A O no hydrogen 2.792 N/A THR 156.A N CYS 111.A O no hydrogen 2.738 N/A THR 156.A OG1 GLU 180.A OE2 no hydrogen 2.783 N/A ALA 157.A N GLU 180.A O no hydrogen 2.640 N/A ASP 158.A N ASP 113.A OD1 no hydrogen 2.712 N/A ARG 162.A NH1 ASP 113.A OD2 no hydrogen 3.143 N/A ARG 162.A NH2 ASP 113.A OD2 no hydrogen 2.959 N/A LYS 169.A N MET 165.A O no hydrogen 3.011 N/A LYS 170.A N ASP 166.A O no hydrogen 3.058 N/A LEU 171.A N MET 167.A O no hydrogen 2.985 N/A GLY 172.A N VAL 168.A O no hydrogen 2.985 N/A ASP 173.A N LYS 169.A O no hydrogen 2.918 N/A TYR 174.A N LYS 170.A O no hydrogen 3.210 N/A TYR 174.A N LEU 171.A O no hydrogen 3.046 N/A GLY 175.A N GLY 172.A O no hydrogen 3.102 N/A VAL 176.A N LEU 171.A O no hydrogen 2.961 N/A LEU 177.A N ASN 153.A O no hydrogen 2.940 N/A VAL 179.A N GLY 93.A O no hydrogen 2.812 N/A GLU 180.A N LEU 155.A O no hydrogen 2.782 N/A GLU 182.A N GLU 180.A OE1 no hydrogen 3.187 N/A THR 183.A N GLU 180.A OE1 no hydrogen 2.975 N/A THR 183.A OG1 GLU 180.A OE1 no hydrogen 2.799 N/A THR 183.A OG1 SER 199.A OG no hydrogen 2.637 N/A THR 184.A N THR 156.A OG1 no hydrogen 2.984 N/A LEU 186.A N GLU 182.A O no hydrogen 3.247 N/A TYR 187.A N THR 183.A O no hydrogen 2.897 N/A TYR 187.A OH ALA 107.A O no hydrogen 2.497 N/A THR 188.A N THR 184.A O no hydrogen 2.889 N/A THR 188.A OG1 ASN 117.A OD1 no hydrogen 3.211 N/A THR 188.A OG1 THR 184.A O no hydrogen 2.757 N/A LEU 189.A N ALA 185.A O no hydrogen 3.090 N/A ALA 190.A N LEU 186.A O no hydrogen 3.115 N/A ALA 191.A N TYR 187.A O no hydrogen 3.122 N/A LYS 192.A N THR 188.A O no hydrogen 2.974 N/A LYS 192.A NZ TYR 193.A OH no hydrogen 3.194 N/A TYR 193.A N LEU 189.A O no hydrogen 3.060 N/A GLY 194.A N ALA 191.A O no hydrogen 3.238 N/A VAL 195.A N ALA 190.A O no hydrogen 2.861 N/A ASN 196.A N LYS 84.A O no hydrogen 2.910 N/A LEU 198.A N LEU 86.A O no hydrogen 3.162 N/A SER 199.A N TYR 187.A OH no hydrogen 2.819 N/A SER 199.A OG THR 183.A OG1 no hydrogen 2.637 N/A VAL 200.A N ARG 88.A O no hydrogen 2.739 N/A LEU 201.A N ILE 105.A O no hydrogen 2.838 N/A THR 202.A N GLY 90.A O no hydrogen 2.903 N/A VAL 203.A N ASP 103.A O no hydrogen 2.789 N/A SER 204.A N CYS 92.A O no hydrogen 2.964 N/A SER 204.A OG CYS 92.A O no hydrogen 3.338 N/A SER 204.A OG ASP 205.A OD1 no hydrogen 2.988 N/A HIS 206.A N GLU 211.A O no hydrogen 2.696 N/A HIS 206.A NE2 GLN 96.A O no hydrogen 2.814 N/A ILE 207.A N ALA 94.A O no hydrogen 3.099 N/A PHE 208.A N HIS 206.A ND1 no hydrogen 3.197 N/A THR 209.A N HIS 206.A ND1 no hydrogen 3.116 N/A GLY 210.A N HIS 206.A O no hydrogen 3.064 N/A GLU 211.A N THR 209.A OG1 no hydrogen 3.273 N/A THR 214.A N GLU 217.A OE1 no hydrogen 3.149 N/A ARG 218.A N THR 214.A O no hydrogen 3.097 N/A ARG 218.A N SER 215.A O no hydrogen 3.076 N/A GLN 219.A N GLU 216.A O no hydrogen 3.363 N/A GLN 219.A NE2 TYR 28.A OH no hydrogen 3.492 N/A PHE 222.A N ARG 218.A O no hydrogen 2.871 N/A ASN 223.A N GLN 219.A O no hydrogen 2.963 N/A ASN 223.A ND2 GLN 219.A OE1 no hydrogen 3.664 N/A GLU 224.A N THR 220.A O no hydrogen 3.284 N/A MET 225.A N THR 221.A O no hydrogen 2.860 N/A ILE 226.A N PHE 222.A O no hydrogen 2.861 N/A GLU 227.A N ASN 223.A O no hydrogen 3.255 N/A ILE 228.A N GLU 224.A O no hydrogen 2.977 N/A ALA 229.A N MET 225.A O no hydrogen 2.885 N/A LEU 230.A N ILE 226.A O no hydrogen 2.863 N/A ASP 231.A N GLU 227.A O no hydrogen 3.042 N/A ALA 232.A N ILE 228.A O no hydrogen 2.913 N/A ALA 233.A N ALA 229.A O no hydrogen 2.990 N/A ALA 233.A N LEU 230.A O no hydrogen 3.168 N/A