Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3moy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH ASP 39.A OD2 no hydrogen 2.582 N/A THR 4.A N GLU 36.A OE1 no hydrogen 3.254 N/A THR 4.A N GLU 36.A OE2 no hydrogen 2.824 N/A THR 4.A OG1 GLU 36.A OE2 no hydrogen 3.072 N/A THR 5.A N GLU 36.A OE1 no hydrogen 2.760 N/A THR 5.A OG1 GLU 36.A OE1 no hydrogen 2.593 N/A ALA 7.A N ARG 19.A O no hydrogen 2.901 N/A SER 9.A N LEU 17.A O no hydrogen 3.050 N/A ARG 10.A NH2 ASP 47.A OD2 no hydrogen 2.574 N/A VAL 15.A N VAL 12.A O no hydrogen 3.212 N/A GLY 16.A N ALA 52.A O no hydrogen 3.063 N/A LEU 17.A N SER 9.A O no hydrogen 2.857 N/A ILE 18.A N VAL 54.A O no hydrogen 2.817 N/A ARG 19.A N ALA 7.A O no hydrogen 2.872 N/A LEU 20.A N THR 56.A O no hydrogen 2.794 N/A ASP 21.A N THR 5.A O no hydrogen 2.777 N/A ARG 22.A N ASN 27.A OD1 no hydrogen 2.858 N/A ARG 22.A NH1 ALA 28.A O no hydrogen 2.812 N/A ARG 22.A NH1 ASP 67.A OD2 no hydrogen 2.826 N/A ARG 22.A NH2 ASP 67.A OD2 no hydrogen 3.141 N/A ALA 25.A N ARG 22.A O no hydrogen 2.947 N/A LEU 26.A N PRO 23.A O no hydrogen 3.151 N/A ASN 27.A N ARG 22.A O no hydrogen 2.928 N/A ASN 27.A ND2 LEU 20.A O no hydrogen 3.444 N/A ASN 27.A ND2 ALA 61.A O no hydrogen 2.900 N/A ASN 27.A ND2 PHE 62.A O no hydrogen 3.325 N/A ALA 28.A N ALA 25.A O no hydrogen 3.019 N/A LEU 29.A N GLY 65.A O no hydrogen 2.957 N/A GLN 31.A N GLU 70.A OE1 no hydrogen 2.861 N/A LEU 33.A N ASN 30.A OD1 no hydrogen 2.837 N/A GLU 34.A N ASN 30.A O no hydrogen 3.077 N/A ALA 35.A N GLN 31.A O no hydrogen 3.071 N/A GLU 36.A N THR 32.A O no hydrogen 2.866 N/A VAL 37.A N LEU 33.A O no hydrogen 2.805 N/A LEU 38.A N GLU 34.A O no hydrogen 3.045 N/A ASP 39.A N ALA 35.A O no hydrogen 2.921 N/A ALA 40.A N GLU 36.A O no hydrogen 2.900 N/A ALA 41.A N VAL 37.A O no hydrogen 2.886 N/A ARG 42.A N LEU 38.A O no hydrogen 2.911 N/A ASP 43.A N ASP 39.A O no hydrogen 3.010 N/A PHE 44.A N ALA 40.A O no hydrogen 2.983 N/A ASP 45.A N ALA 41.A O no hydrogen 2.846 N/A ALA 46.A N ARG 42.A O no hydrogen 3.025 N/A ASP 47.A N PHE 44.A O no hydrogen 3.186 N/A GLU 49.A N ASP 47.A OD1 no hydrogen 2.855 N/A ILE 50.A N ASP 47.A O no hydrogen 2.998 N/A GLY 51.A N GLY 14.A O no hydrogen 2.716 N/A ALA 52.A N GLY 14.A O no hydrogen 3.347 N/A ILE 53.A N PRO 97.A O no hydrogen 2.969 N/A VAL 54.A N GLY 16.A O no hydrogen 2.850 N/A VAL 55.A N VAL 99.A O no hydrogen 2.931 N/A THR 56.A N ILE 18.A O no hydrogen 2.947 N/A THR 56.A OG1 ALA 101.A O no hydrogen 2.733 N/A SER 58.A N ALA 61.A O no hydrogen 2.854 N/A SER 58.A OG ALA 61.A O no hydrogen 3.373 N/A ARG 60.A N SER 58.A OG no hydrogen 3.157 N/A ALA 61.A N SER 58.A OG no hydrogen 3.059 N/A ALA 63.A N TYR 105.A O no hydrogen 2.996 N/A ALA 64.A N LEU 26.A O no hydrogen 2.963 N/A GLY 65.A N LEU 107.A O no hydrogen 2.826 N/A ASP 67.A N LEU 29.A O no hydrogen 2.829 N/A GLU 70.A N ASP 67.A OD1 no hydrogen 2.991 N/A MET 71.A N ASP 67.A O no hydrogen 3.205 N/A VAL 72.A N ILE 68.A O no hydrogen 2.890 N/A LEU 74.A N MET 71.A O no hydrogen 2.974 N/A THR 75.A OG1 GLN 78.A OE1 no hydrogen 2.862 N/A GLN 78.A N THR 75.A OG1 no hydrogen 3.160 N/A ALA 79.A N THR 75.A O no hydrogen 2.954 N/A ARG 80.A N PRO 76.A O no hydrogen 3.041 N/A GLU 81.A N HIS 77.A O no hydrogen 2.792 N/A ARG 82.A N GLN 78.A O no hydrogen 2.968 N/A ASN 83.A N ARG 80.A O no hydrogen 3.025 N/A LEU 84.A N ALA 79.A O no hydrogen 3.066 N/A SER 86.A N ASN 83.A O no hydrogen 3.058 N/A SER 86.A OG.A ASN 83.A O no hydrogen 2.923 N/A TRP 88.A N GLU 34.A OE2 no hydrogen 3.029 N/A ASP 89.A N LEU 85.A O no hydrogen 3.178 N/A SER 90.A N SER 86.A O no hydrogen 2.976 N/A SER 90.A OG SER 86.A O no hydrogen 3.149 N/A LEU 91.A N GLY 87.A O no hydrogen 3.087 N/A LEU 91.A N TRP 88.A O no hydrogen 3.109 N/A THR 92.A N ASP 89.A O no hydrogen 3.027 N/A THR 92.A OG1 ASP 89.A O no hydrogen 2.622 N/A GLN 93.A N SER 90.A O no hydrogen 2.916 N/A GLN 93.A NE2.B THR 92.A OG1 no hydrogen 3.144 N/A VAL 94.A N LEU 91.A O no hydrogen 3.224 N/A ARG 95.A N ASP 45.A OD2 no hydrogen 2.936 N/A ARG 95.A NH2 ASP 210.A OD2.A no hydrogen 2.861 N/A LYS 96.A N ASP 45.A OD1 no hydrogen 3.106 N/A LYS 96.A NZ PHE 44.A O no hydrogen 2.937 N/A LYS 96.A NZ ASP 45.A O no hydrogen 3.041 N/A LYS 96.A NZ ILE 50.A O no hydrogen 2.708 N/A ILE 98.A N ASP 118.A OD2 no hydrogen 2.776 N/A VAL 99.A N ILE 53.A O no hydrogen 2.782 N/A ALA 100.A N LEU 119.A O no hydrogen 2.882 N/A ALA 101.A N VAL 55.A O no hydrogen 2.835 N/A VAL 102.A N ILE 121.A O no hydrogen 2.817 N/A GLY 104.A N THR 125.A OG1 no hydrogen 3.253 N/A TYR 105.A N ARG 60.A O no hydrogen 3.104 N/A ALA 106.A N ARG 127.A O no hydrogen 2.801 N/A LEU 107.A N ALA 63.A O no hydrogen 3.076 N/A GLY 108.A N GLY 129.A O no hydrogen 2.818 N/A GLY 110.A N LEU 107.A O no hydrogen 2.875 N/A CYS 111.A SG GLN 130.A OE1 no hydrogen 3.388 N/A GLU 112.A N GLY 108.A O no hydrogen 3.025 N/A LEU 113.A N GLY 109.A O no hydrogen 2.800 N/A ALA 114.A N GLY 110.A O no hydrogen 3.126 N/A MET 115.A N CYS 111.A O no hydrogen 2.955 N/A LEU 116.A N GLU 112.A O no hydrogen 2.936 N/A CYS 117.A N LEU 113.A O no hydrogen 3.308 N/A CYS 117.A N ALA 114.A O no hydrogen 3.253 N/A CYS 117.A SG LEU 113.A O no hydrogen 3.385 N/A ASP 118.A N ILE 98.A O no hydrogen 2.859 N/A LEU 119.A N ILE 98.A O no hydrogen 3.294 N/A VAL 120.A N SER 178.A OG no hydrogen 3.081 N/A ILE 121.A N ALA 100.A O no hydrogen 2.804 N/A ALA 122.A N ARG 179.A O no hydrogen 2.897 N/A ALA 123.A N VAL 102.A O no hydrogen 2.835 N/A ASP 124.A N VAL 181.A O no hydrogen 2.894 N/A ALA 126.A N ALA 123.A O no hydrogen 2.920 N/A ARG 127.A N GLY 104.A O no hydrogen 2.977 N/A ARG 127.A NH1 ASP 124.A O no hydrogen 3.169 N/A ARG 127.A NH1 ALA 126.A O no hydrogen 2.817 N/A PHE 128.A N LEU 166.A O no hydrogen 2.968 N/A GLY 129.A N ALA 106.A O no hydrogen 3.214 N/A GLN 130.A NE2 GLY 108.A O no hydrogen 3.423 N/A GLN 130.A NE2 GLU 132.A OE1 no hydrogen 3.012 N/A GLU 132.A N GLU 132.A OE1 no hydrogen 2.774 N/A THR 134.A N PRO 131.A O no hydrogen 2.873 N/A THR 134.A OG1 PRO 131.A O no hydrogen 2.678 N/A LEU 135.A N GLU 132.A O no hydrogen 2.886 N/A GLY 136.A N ILE 133.A O no hydrogen 2.981 N/A ILE 137.A N GLU 132.A O no hydrogen 3.264 N/A LEU 141.A N GLU 112.A OE2 no hydrogen 2.759 N/A GLY 143.A N GLU 112.A OE2 no hydrogen 2.777 N/A GLN 145.A N GLY 142.A O no hydrogen 2.976 N/A GLN 145.A NE2 THR 144.A OG1 no hydrogen 2.967 N/A ARG 146.A N GLY 142.A O no hydrogen 2.738 N/A LEU 147.A N GLY 142.A O no hydrogen 3.282 N/A THR 148.A OG1 THR 144.A O no hydrogen 2.781 N/A ARG 149.A N GLN 145.A O no hydrogen 3.268 N/A ARG 149.A NH1 GLN 145.A O no hydrogen 2.998 N/A ARG 149.A NH1 GLN 145.A OE1 no hydrogen 3.013 N/A ALA 150.A N ARG 146.A O no hydrogen 3.011 N/A ALA 150.A N LEU 147.A O no hydrogen 3.061 N/A VAL 151.A N LEU 147.A O no hydrogen 2.884 N/A GLY 152.A N THR 148.A O no hydrogen 2.942 N/A LYS 155.A NZ GLU 170.A OE2 no hydrogen 2.825 N/A ALA 156.A N GLY 152.A O no hydrogen 3.048 N/A MET 157.A N LYS 153.A O no hydrogen 2.793 N/A ASP 158.A N ALA 154.A O no hydrogen 3.123 N/A LEU 159.A N LYS 155.A O no hydrogen 2.953 N/A CYS 160.A N ALA 156.A O no hydrogen 2.916 N/A CYS 160.A SG GLY 143.A O no hydrogen 3.441 N/A CYS 160.A SG ALA 156.A O no hydrogen 3.486 N/A LEU 161.A N MET 157.A O no hydrogen 2.874 N/A THR 162.A N ASP 158.A O no hydrogen 2.894 N/A THR 162.A OG1 ASP 158.A O no hydrogen 2.782 N/A THR 162.A OG1 ASP 158.A OD1 no hydrogen 2.926 N/A GLY 163.A N LEU 159.A O no hydrogen 2.977 N/A ARG 164.A N THR 162.A OG1 no hydrogen 3.213 N/A ARG 164.A NE ASP 158.A OD1 no hydrogen 3.390 N/A ARG 164.A NE ASP 158.A OD2 no hydrogen 2.925 N/A ARG 164.A NH1 ASP 158.A OD2 no hydrogen 3.093 N/A ARG 164.A NH1 GLU 170.A OE2 no hydrogen 3.141 N/A ARG 164.A NH2 SER 165.A O no hydrogen 3.321 N/A ARG 164.A NH2 GLU 170.A OE1 no hydrogen 2.820 N/A ARG 164.A NH2 GLU 170.A OE2 no hydrogen 3.498 N/A LEU 166.A N PHE 128.A O no hydrogen 2.714 N/A GLU 170.A N THR 167.A OG1 no hydrogen 3.131 N/A ALA 171.A N THR 167.A O no hydrogen 2.880 N/A GLU 172.A N ALA 168.A O no hydrogen 2.867 N/A ARG 173.A N GLU 169.A O no hydrogen 3.089 N/A VAL 174.A N GLU 170.A O no hydrogen 3.235 N/A GLY 175.A N GLU 172.A O no hydrogen 3.336 N/A LEU 176.A N ALA 171.A O no hydrogen 2.870 N/A SER 178.A N VAL 120.A O no hydrogen 2.801 N/A ARG 179.A N VAL 120.A O no hydrogen 3.384 N/A ARG 179.A NH1 GLU 189.A OE2 no hydrogen 2.890 N/A VAL 181.A N ALA 122.A O no hydrogen 2.985 N/A ALA 183.A N ASP 124.A OD1 no hydrogen 2.959 N/A ASP 185.A N PRO 182.A O no hydrogen 2.882 N/A LEU 186.A N ALA 183.A O no hydrogen 3.276 N/A GLU 189.A N ASP 185.A O no hydrogen 2.905 N/A ALA 190.A N LEU 186.A O no hydrogen 2.925 N/A LEU 191.A N LEU 187.A O no hydrogen 2.847 N/A ALA 192.A N ASP 188.A O no hydrogen 2.951 N/A VAL 193.A N GLU 189.A O no hydrogen 2.858 N/A ALA 194.A N ALA 190.A O no hydrogen 2.890 N/A GLN 195.A N LEU 191.A O no hydrogen 2.869 N/A ARG 196.A N ALA 192.A O no hydrogen 2.992 N/A ILE 197.A N VAL 193.A O no hydrogen 3.002 N/A ALA 198.A N ALA 194.A O no hydrogen 2.901 N/A ARG 199.A N GLN 195.A O no hydrogen 2.971 N/A ARG 199.A N ARG 196.A O no hydrogen 3.102 N/A MET 200.A N ILE 197.A O no hydrogen 3.003 N/A SER 201.A OG ASP 239.A OD2 no hydrogen 2.782 N/A ARG 202.A NH1 LEU 48.A O no hydrogen 2.772 N/A ARG 202.A NH2 LEU 48.A O no hydrogen 2.841 N/A ALA 204.A N SER 201.A OG no hydrogen 3.244 N/A GLY 205.A N SER 201.A O no hydrogen 2.932 N/A ARG 206.A N ARG 202.A O no hydrogen 3.027 N/A ARG 206.A NH1 ARG 258.A O no hydrogen 3.400 N/A ARG 206.A NH1 ARG 258.A OXT no hydrogen 2.877 N/A ARG 206.A NH2 ARG 258.A O no hydrogen 2.900 N/A ALA 207.A N PRO 203.A O no hydrogen 2.940 N/A VAL 208.A N ALA 204.A O no hydrogen 2.871 N/A LYS 209.A N GLY 205.A O no hydrogen 3.075 N/A LYS 209.A NZ VAL 94.A O no hydrogen 3.027 N/A LYS 209.A NZ LYS 96.A O no hydrogen 2.832 N/A LYS 209.A NZ ASP 118.A OD2 no hydrogen 2.794 N/A ASP 210.A N ARG 206.A O no hydrogen 2.905 N/A ALA 211.A N ALA 207.A O no hydrogen 2.890 N/A ILE 212.A N VAL 208.A O no hydrogen 2.942 N/A ASN 213.A N LYS 209.A O no hydrogen 2.937 N/A GLU 214.A N ASP 210.A O no hydrogen 2.912 N/A ALA 215.A N ALA 211.A O no hydrogen 3.129 N/A ALA 215.A N ILE 212.A O no hydrogen 3.078 N/A PHE 216.A N ASN 213.A O no hydrogen 3.233 N/A GLU 217.A N GLU 214.A O no hydrogen 2.931 N/A ARG 218.A NE GLU 214.A OE2 no hydrogen 2.819 N/A ARG 218.A NH1 ALA 222.A O no hydrogen 3.347 N/A GLY 223.A N PRO 219.A O no hydrogen 2.860 N/A MET 224.A N LEU 220.A O no hydrogen 2.771 N/A ARG 225.A N SER 221.A O no hydrogen 3.173 N/A TYR 226.A N ALA 222.A O no hydrogen 2.968 N/A TYR 226.A OH.A ASP 210.A OD1.B no hydrogen 2.483 N/A TYR 226.A OH.A ASP 210.A OD2.B no hydrogen 3.415 N/A GLU 227.A N GLY 223.A O no hydrogen 2.896 N/A ARG 228.A N MET 224.A O no hydrogen 2.889 N/A ASP 229.A N ARG 225.A O no hydrogen 2.992 N/A ALA 230.A N TYR 226.A O no hydrogen 3.039 N/A PHE 231.A N GLU 227.A O no hydrogen 2.850 N/A TYR 232.A N ARG 228.A O no hydrogen 2.980 N/A ALA 233.A N ASP 229.A O no hydrogen 3.103 N/A MET 234.A N ALA 230.A O no hydrogen 3.222 N/A MET 234.A N PHE 231.A O no hydrogen 3.069 N/A PHE 235.A N TYR 232.A O no hydrogen 3.145 N/A ASP 236.A N ALA 233.A O no hydrogen 3.168 N/A THR 237.A N MET 234.A O no hydrogen 3.095 N/A THR 237.A OG1 MET 234.A O no hydrogen 2.818 N/A ASP 239.A N ASP 257.A OD2 no hydrogen 2.856 N/A GLN 240.A N THR 237.A OG1 no hydrogen 3.144 N/A THR 241.A OG1 GLN 240.A OE1 no hydrogen 3.538 N/A GLU 242.A N HIS 238.A O no hydrogen 2.930 N/A GLY 243.A N ASP 239.A O no hydrogen 2.772 N/A MET 244.A N GLN 240.A O no hydrogen 3.061 N/A THR 245.A N THR 241.A O no hydrogen 2.887 N/A THR 245.A OG1 THR 241.A O no hydrogen 2.812 N/A ALA 246.A N GLU 242.A O no hydrogen 2.886 N/A PHE 247.A N GLY 243.A O no hydrogen 3.178 N/A LEU 248.A N MET 244.A O no hydrogen 3.077 N/A GLU 249.A N THR 245.A O no hydrogen 2.847 N/A LYS 250.A N PHE 247.A O no hydrogen 3.063 N/A ARG 251.A N ALA 246.A O no hydrogen 2.953 N/A ARG 251.A NE GLU 249.A OE1 no hydrogen 2.725 N/A ARG 251.A NH1 GLU 242.A OE2 no hydrogen 2.738 N/A ARG 251.A NH1 THR 252.A O no hydrogen 3.279 N/A ARG 251.A NH2 GLU 242.A OE1 no hydrogen 3.064 N/A ARG 251.A NH2 GLU 249.A OE1 no hydrogen 3.328 N/A GLU 254.A N GLU 242.A OE2 no hydrogen 2.813 N/A THR 256.A N ASP 239.A OD1 no hydrogen 2.995 N/A THR 256.A OG1 HIS 238.A ND1 no hydrogen 3.046 N/A ASP 257.A N ASP 239.A OD1 no hydrogen 3.093 N/A