Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3o1e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N GLN 7.A OE1 no hydrogen 2.951 N/A GLN 7.A N SER 4.A OG no hydrogen 3.417 N/A MET 8.A N SER 4.A O no hydrogen 2.979 N/A MET 8.A N ASP 5.A O no hydrogen 3.259 N/A GLN 9.A N ASP 5.A O no hydrogen 2.948 N/A ILE 10.A N GLU 6.A O no hydrogen 3.014 N/A ILE 11.A N GLN 7.A O no hydrogen 3.292 N/A ASN 12.A N MET 8.A O no hydrogen 2.950 N/A SER 13.A N GLN 9.A O no hydrogen 2.826 N/A SER 13.A OG GLN 9.A O no hydrogen 3.140 N/A LEU 14.A N ILE 10.A O no hydrogen 2.961 N/A VAL 15.A N ILE 11.A O no hydrogen 2.919 N/A GLU 16.A N ASN 12.A O no hydrogen 3.206 N/A ALA 17.A N SER 13.A O no hydrogen 3.121 N/A HIS 18.A N LEU 14.A O no hydrogen 3.028 N/A HIS 18.A N VAL 15.A O no hydrogen 3.146 N/A HIS 18.A NE2 GLN 91.A OE1 no hydrogen 2.443 N/A HIS 19.A N VAL 15.A O no hydrogen 2.976 N/A HIS 19.A NE2 GLU 141.A OE1 no hydrogen 2.779 N/A HIS 19.A NE2 GLU 141.A OE2 no hydrogen 2.940 N/A LYS 20.A N GLU 16.A O no hydrogen 2.694 N/A THR 21.A N HIS 18.A O no hydrogen 3.191 N/A THR 21.A OG1 ALA 17.A O no hydrogen 2.624 N/A TYR 22.A OH TYR 26.A OH no hydrogen 2.897 N/A SER 25.A N ASP 23.A OD1 no hydrogen 2.580 N/A SER 25.A OG ASP 23.A OD1 no hydrogen 2.679 N/A SER 25.A OG ASP 23.A OD2 no hydrogen 3.303 N/A SER 25.A OG SER 27.A OG no hydrogen 3.305 N/A TYR 26.A N ASP 23.A O no hydrogen 3.036 N/A TYR 26.A N ASP 23.A OD1 no hydrogen 3.268 N/A TYR 26.A OH TYR 22.A OH no hydrogen 2.897 N/A SER 27.A N ASP 23.A OD2 no hydrogen 3.419 N/A SER 27.A OG ASP 23.A OD2 no hydrogen 3.045 N/A SER 27.A OG SER 25.A OG no hydrogen 3.305 N/A PHE 29.A N TYR 26.A O no hydrogen 3.190 N/A ARG 31.A N ASP 28.A O no hydrogen 2.921 N/A ARG 31.A NH2 ASP 28.A OD1 no hydrogen 3.313 N/A PHE 32.A N PHE 29.A O no hydrogen 3.497 N/A ARG 33.A N ASP 46.A OD2 no hydrogen 2.685 N/A ARG 33.A NE ASP 46.A OD1 no hydrogen 3.243 N/A ARG 33.A NE ASP 46.A OD2 no hydrogen 2.917 N/A ARG 33.A NH1 GLN 225.A O no hydrogen 2.950 N/A ARG 33.A NH2 ASP 46.A OD1 no hydrogen 2.641 N/A ARG 33.A NH2 GLN 225.A O no hydrogen 2.841 N/A ARG 37.A NH2 ASP 113.A OD2 no hydrogen 2.874 N/A SER 39.A OG VAL 36.A O no hydrogen 2.708 N/A MET 40.A N LYS 116.A O no hydrogen 2.941 N/A LEU 41.A N LEU 38.A O no hydrogen 3.165 N/A HIS 43.A ND1 ARG 33.A O no hydrogen 2.700 N/A HIS 43.A NE2 TYR 109.A OH no hydrogen 2.822 N/A LEU 44.A N MET 40.A O no hydrogen 2.985 N/A ALA 45.A N LEU 41.A O no hydrogen 3.077 N/A ASP 46.A N PRO 42.A O no hydrogen 3.112 N/A LEU 47.A N HIS 43.A O no hydrogen 2.824 N/A VAL 48.A N LEU 44.A O no hydrogen 2.636 N/A SER 49.A N ALA 45.A O no hydrogen 2.845 N/A SER 49.A OG THR 227.A OG1 no hydrogen 2.718 N/A TYR 50.A N ASP 46.A O no hydrogen 3.011 N/A TYR 50.A OH ASP 28.A OD2 no hydrogen 2.465 N/A SER 51.A N LEU 47.A O no hydrogen 2.832 N/A SER 51.A OG LEU 47.A O no hydrogen 2.785 N/A ILE 52.A N VAL 48.A O no hydrogen 2.867 N/A GLN 53.A N SER 49.A O no hydrogen 3.120 N/A LYS 54.A N TYR 50.A O no hydrogen 3.085 N/A VAL 55.A N SER 51.A O no hydrogen 2.890 N/A ILE 56.A N ILE 52.A O no hydrogen 2.930 N/A GLY 57.A N GLN 53.A O no hydrogen 3.090 N/A PHE 58.A N LYS 54.A O no hydrogen 2.703 N/A ALA 59.A N VAL 55.A O no hydrogen 2.788 N/A LYS 60.A N ILE 56.A O no hydrogen 3.045 N/A MET 61.A N PHE 58.A O no hydrogen 2.877 N/A ILE 62.A N ALA 59.A O no hydrogen 2.789 N/A PHE 65.A N ILE 62.A O no hydrogen 3.002 N/A LEU 68.A N PHE 65.A O no hydrogen 3.287 N/A ASP 72.A N THR 69.A OG1 no hydrogen 3.096 N/A GLN 73.A N THR 69.A O no hydrogen 2.891 N/A GLN 73.A NE2 LEU 68.A O no hydrogen 2.878 N/A ILE 74.A N ALA 70.A O no hydrogen 2.927 N/A ALA 75.A N GLU 71.A O no hydrogen 2.852 N/A LEU 76.A N ASP 72.A O no hydrogen 2.733 N/A LEU 77.A N GLN 73.A O no hydrogen 2.823 N/A LYS 78.A N ILE 74.A O no hydrogen 2.802 N/A LYS 78.A NZ GLY 235.A O no hydrogen 2.865 N/A SER 79.A N ALA 75.A O no hydrogen 3.387 N/A SER 79.A OG ALA 75.A O no hydrogen 2.604 N/A SER 79.A OG LEU 76.A O no hydrogen 3.353 N/A SER 80.A N LEU 76.A O no hydrogen 2.894 N/A SER 80.A OG LEU 76.A O no hydrogen 2.704 N/A ALA 81.A N LEU 77.A O no hydrogen 2.783 N/A ILE 84.A N SER 80.A O no hydrogen 2.896 N/A ILE 85.A N ALA 81.A O no hydrogen 2.863 N/A MET 86.A N ILE 82.A O no hydrogen 3.000 N/A LEU 87.A N GLU 83.A O no hydrogen 2.868 N/A ARG 88.A N ILE 84.A O no hydrogen 2.787 N/A ARG 88.A NH2 THR 21.A O no hydrogen 2.905 N/A SER 89.A N ILE 85.A O no hydrogen 2.890 N/A SER 89.A OG MET 86.A O no hydrogen 2.976 N/A ASN 90.A N LEU 87.A O no hydrogen 2.963 N/A ASN 90.A ND2 GLN 131.A O no hydrogen 3.014 N/A ASN 90.A ND2 GLN 131.A OE1 no hydrogen 3.104 N/A GLN 91.A N ARG 88.A O no hydrogen 3.183 N/A SER 92.A N SER 89.A O no hydrogen 2.933 N/A SER 92.A OG SER 89.A O no hydrogen 3.039 N/A PHE 93.A N SER 89.A O no hydrogen 3.115 N/A PHE 93.A N ASN 90.A O no hydrogen 3.127 N/A SER 94.A N SER 99.A O no hydrogen 2.820 N/A SER 94.A OG ASP 97.A OD1 no hydrogen 2.921 N/A SER 99.A OG ASP 97.A OD1 no hydrogen 2.988 N/A SER 99.A OG SER 101.A OG no hydrogen 3.258 N/A TRP 100.A N TYR 109.A O no hydrogen 2.955 N/A TRP 100.A NE1 SER 89.A OG no hydrogen 2.858 N/A SER 101.A N SER 92.A O no hydrogen 2.845 N/A SER 101.A OG SER 99.A OG no hydrogen 3.258 N/A CYS 102.A N PHE 107.A O no hydrogen 2.670 N/A PHE 107.A N GLY 104.A O no hydrogen 2.992 N/A TYR 109.A N TRP 100.A O no hydrogen 2.688 N/A TYR 109.A OH HIS 43.A NE2 no hydrogen 2.822 N/A CYS 110.A N ASP 113.A OD2 no hydrogen 2.702 N/A CYS 110.A SG ASP 113.A OD2 no hydrogen 3.563 N/A THR 115.A N ILE 111.A O no hydrogen 3.340 N/A THR 115.A OG1 ILE 111.A O no hydrogen 3.268 N/A THR 115.A OG1 ASN 112.A O no hydrogen 2.745 N/A ALA 117.A N VAL 114.A O no hydrogen 2.882 N/A GLY 118.A N THR 115.A O no hydrogen 3.355 N/A THR 120.A N GLN 212.A OE1 no hydrogen 3.333 N/A THR 120.A OG1 GLN 212.A OE1 no hydrogen 3.357 N/A LEU 123.A N THR 120.A O no hydrogen 3.078 N/A LEU 123.A N THR 120.A OG1 no hydrogen 2.969 N/A VAL 128.A N LEU 124.A O no hydrogen 3.059 N/A LYS 129.A N GLU 125.A O no hydrogen 2.820 N/A PHE 130.A N PRO 126.A O no hydrogen 2.833 N/A GLN 131.A N LEU 127.A O no hydrogen 2.945 N/A GLN 131.A NE2 MET 86.A O no hydrogen 2.721 N/A VAL 132.A N VAL 128.A O no hydrogen 2.905 N/A GLY 133.A N LYS 129.A O no hydrogen 3.227 N/A LEU 134.A N PHE 130.A O no hydrogen 2.887 N/A LYS 135.A N GLN 131.A O no hydrogen 2.854 N/A LYS 135.A NZ ASN 90.A O no hydrogen 3.494 N/A LYS 136.A N VAL 132.A O no hydrogen 2.956 N/A LEU 137.A N GLY 133.A O no hydrogen 3.234 N/A LEU 137.A N LEU 134.A O no hydrogen 3.312 N/A LYS 138.A N LYS 135.A O no hydrogen 2.872 N/A LYS 138.A NZ LYS 136.A O no hydrogen 2.765 N/A HIS 140.A N GLU 143.A OE1 no hydrogen 2.953 N/A HIS 140.A ND1 TYR 180.A OH no hydrogen 2.728 N/A GLU 142.A N GLU 142.A OE1 no hydrogen 2.699 N/A GLU 143.A N HIS 140.A O no hydrogen 2.760 N/A HIS 144.A N HIS 140.A O no hydrogen 2.873 N/A VAL 145.A N GLU 141.A O no hydrogen 2.889 N/A LEU 146.A N GLU 142.A O no hydrogen 3.046 N/A LEU 147.A N GLU 143.A O no hydrogen 2.859 N/A MET 148.A N HIS 144.A O no hydrogen 3.233 N/A ALA 149.A N VAL 145.A O no hydrogen 3.235 N/A ILE 150.A N LEU 146.A O no hydrogen 2.899 N/A CYS 151.A N LEU 147.A O no hydrogen 2.828 N/A CYS 151.A SG GLU 83.A OE1 no hydrogen 3.097 N/A LEU 152.A N MET 148.A O no hydrogen 2.984 N/A LEU 153.A N ALA 149.A O no hydrogen 3.057 N/A SER 154.A N CYS 151.A O no hydrogen 2.984 N/A SER 154.A OG ILE 150.A O no hydrogen 3.537 N/A SER 154.A OG CYS 151.A O no hydrogen 2.759 N/A ASP 156.A N ASP 156.A OD1 no hydrogen 2.432 N/A ARG 157.A NH1 GLU 83.A OE1 no hydrogen 3.065 N/A ARG 157.A NH1 GLU 83.A OE2 no hydrogen 2.800 N/A ARG 157.A NH2 GLU 83.A OE1 no hydrogen 2.833 N/A ARG 157.A NH2 CYS 151.A O no hydrogen 2.946 N/A GLN 161.A N ASP 72.A OD1 no hydrogen 2.561 N/A ASP 162.A N ASP 72.A OD2 no hydrogen 3.023 N/A ARG 165.A N ASP 162.A O no hydrogen 3.047 N/A ARG 165.A N ASP 162.A OD1 no hydrogen 3.232 N/A ARG 165.A NH1 ASP 67.A O no hydrogen 2.614 N/A ILE 166.A N ASP 162.A O no hydrogen 3.178 N/A ALA 168.A N VAL 164.A O no hydrogen 3.192 N/A LEU 169.A N ARG 165.A O no hydrogen 3.240 N/A GLN 170.A N ILE 166.A O no hydrogen 2.882 N/A GLN 170.A NE2 ILE 150.A O no hydrogen 3.334 N/A ASP 171.A N GLU 167.A O no hydrogen 2.914 N/A ARG 172.A N ALA 168.A O no hydrogen 3.126 N/A LEU 173.A N LEU 169.A O no hydrogen 3.196 N/A CYS 174.A N GLN 170.A O no hydrogen 2.843 N/A CYS 174.A SG GLN 170.A O no hydrogen 3.436 N/A ASP 175.A N ASP 171.A O no hydrogen 2.767 N/A VAL 176.A N ARG 172.A O no hydrogen 3.131 N/A LEU 177.A N LEU 173.A O no hydrogen 2.744 N/A GLN 178.A N CYS 174.A O no hydrogen 2.825 N/A ALA 179.A N ASP 175.A O no hydrogen 3.092 N/A TYR 180.A N VAL 176.A O no hydrogen 2.862 N/A TYR 180.A OH HIS 140.A ND1 no hydrogen 2.728 N/A ILE 181.A N LEU 177.A O no hydrogen 3.136 N/A ARG 182.A N GLN 178.A O no hydrogen 3.232 N/A ILE 183.A N ALA 179.A O no hydrogen 2.698 N/A GLN 184.A N TYR 180.A O no hydrogen 2.631 N/A HIS 185.A N ILE 181.A O no hydrogen 2.865 N/A HIS 185.A ND1 GLU 143.A OE2 no hydrogen 2.636 N/A GLY 188.A N HIS 185.A O no hydrogen 3.103 N/A LYS 194.A N LEU 190.A O no hydrogen 3.390 N/A MET 195.A N LEU 191.A O no hydrogen 2.745 N/A ILE 196.A N TYR 192.A O no hydrogen 2.790 N/A GLN 197.A N ALA 193.A O no hydrogen 2.868 N/A GLN 197.A NE2 ASP 201.A OD1 no hydrogen 3.342 N/A LYS 198.A N LYS 194.A O no hydrogen 3.059 N/A LEU 199.A N MET 195.A O no hydrogen 3.140 N/A ALA 200.A N ILE 196.A O no hydrogen 3.436 N/A ASP 201.A N GLN 197.A O no hydrogen 2.900 N/A LEU 202.A N LYS 198.A O no hydrogen 2.888 N/A ARG 203.A N LEU 199.A O no hydrogen 3.228 N/A ARG 203.A NH1 ASP 156.A O no hydrogen 3.141 N/A ARG 203.A NH2 ASP 156.A OD1 no hydrogen 2.982 N/A ARG 203.A NH2 ASP 156.A OD2 no hydrogen 3.148 N/A SER 204.A N ALA 200.A O no hydrogen 3.466 N/A LEU 205.A N ASP 201.A O no hydrogen 3.160 N/A ASN 206.A N LEU 202.A O no hydrogen 2.670 N/A ASN 206.A ND2 SER 79.A O no hydrogen 2.870 N/A ASN 206.A ND2 GLU 83.A OE2 no hydrogen 2.783 N/A GLU 207.A N ARG 203.A O no hydrogen 2.952 N/A GLU 208.A N SER 204.A O no hydrogen 2.979 N/A HIS 209.A N LEU 205.A O no hydrogen 2.888 N/A SER 210.A N ASN 206.A O no hydrogen 2.983 N/A SER 210.A OG ASN 206.A O no hydrogen 3.409 N/A LYS 211.A N GLU 207.A O no hydrogen 3.122 N/A GLN 212.A N GLU 208.A O no hydrogen 3.137 N/A TYR 213.A N HIS 209.A O no hydrogen 2.662 N/A ARG 214.A N SER 210.A O no hydrogen 2.826 N/A SER 215.A N LYS 211.A O no hydrogen 3.210 N/A SER 215.A OG LYS 211.A O no hydrogen 3.217 N/A LEU 216.A N GLN 212.A O no hydrogen 3.015 N/A SER 217.A N TYR 213.A O no hydrogen 2.798 N/A SER 217.A OG ARG 214.A O no hydrogen 3.315 N/A PHE 218.A N SER 215.A O no hydrogen 3.433 N/A GLN 219.A N LEU 216.A O no hydrogen 3.041 N/A GLN 219.A NE2 SER 215.A O no hydrogen 2.958 N/A GLU 221.A N GLU 221.A OE1 no hydrogen 2.651 N/A HIS 222.A N GLN 219.A O no hydrogen 2.508 N/A SER 223.A N GLN 219.A O no hydrogen 2.987 N/A SER 223.A OG PRO 220.A O no hydrogen 3.399 N/A MET 224.A N PRO 220.A O no hydrogen 2.842 N/A GLN 225.A N HIS 222.A O no hydrogen 2.814 N/A LEU 226.A N SER 223.A O no hydrogen 2.866 N/A THR 227.A OG1 SER 49.A OG no hydrogen 2.718 N/A VAL 230.A N THR 227.A OG1 no hydrogen 3.092 N/A LEU 231.A N THR 227.A O no hydrogen 2.914 N/A GLU 232.A N PRO 228.A O no hydrogen 2.983 N/A GLU 232.A N LEU 229.A O no hydrogen 2.959 N/A VAL 233.A N LEU 229.A O no hydrogen 2.812 N/A PHE 234.A N VAL 230.A O no hydrogen 2.877 N/A GLY 235.A N GLU 232.A O no hydrogen 3.306 N/A