Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5yay_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A N ASP 57.A OD2 no hydrogen 2.641 N/A MET 8.A N SER 5.A OG no hydrogen 3.019 N/A LEU 9.A N SER 5.A O no hydrogen 2.876 N/A SER 10.A N GLU 6.A O no hydrogen 2.881 N/A ALA 11.A N LYS 7.A O no hydrogen 2.944 N/A CYS 12.A N MET 8.A O no hydrogen 2.874 N/A CYS 12.A SG MET 8.A O no hydrogen 3.437 N/A ASN 13.A N LEU 9.A O no hydrogen 3.019 N/A LEU 14.A N SER 10.A O no hydrogen 3.048 N/A LEU 15.A N ALA 11.A O no hydrogen 2.996 N/A LYS 16.A N CYS 12.A O no hydrogen 2.971 N/A TYR 17.A N ASN 13.A O no hydrogen 3.143 N/A ASN 18.A N LEU 15.A O no hydrogen 2.920 N/A ASP 21.A N ASN 18.A O no hydrogen 2.982 N/A ALA 24.A N ASP 21.A OD1 no hydrogen 2.937 N/A LEU 25.A N ASP 21.A O no hydrogen 2.877 N/A ALA 26.A N PRO 22.A O no hydrogen 3.068 N/A SER 27.A N ALA 24.A O no hydrogen 3.004 N/A SER 27.A OG ALA 24.A O no hydrogen 2.773 N/A MET 30.A N SER 27.A OG no hydrogen 3.348 N/A ARG 31.A N SER 27.A O no hydrogen 3.333 N/A ARG 31.A N LYS 28.A O no hydrogen 3.240 N/A ILE 32.A N ASP 29.A O no hydrogen 3.254 N/A CYS 33.A SG ALA 11.A O no hydrogen 3.497 N/A LEU 34.A N MET 30.A O no hydrogen 2.924 N/A ASN 35.A N ARG 31.A O no hydrogen 2.736 N/A THR 36.A N ILE 32.A O no hydrogen 3.116 N/A THR 36.A OG1 ILE 32.A O no hydrogen 3.261 N/A LEU 37.A N CYS 33.A O no hydrogen 3.074 N/A GLN 38.A N LEU 34.A O no hydrogen 2.790 N/A HIS 39.A N ASN 35.A O no hydrogen 2.881 N/A ASP 40.A N THR 36.A O no hydrogen 3.073 N/A TRP 41.A N LEU 37.A O no hydrogen 2.901 N/A PHE 42.A N GLN 38.A O no hydrogen 2.945 N/A ARG 43.A N HIS 39.A O no hydrogen 2.990 N/A ARG 43.A NE ASP 40.A OD1.A no hydrogen 3.134 N/A ARG 43.A NH1 ASP 40.A OD1.A no hydrogen 2.395 N/A VAL 44.A N ASP 40.A O no hydrogen 3.130 N/A SER 45.A N TRP 41.A O no hydrogen 2.990 N/A SER 45.A OG TRP 41.A O no hydrogen 2.763 N/A SER 45.A OG SER 46.A OG no hydrogen 2.958 N/A SER 46.A N PHE 42.A O no hydrogen 3.132 N/A SER 46.A OG SER 45.A OG no hydrogen 2.958 N/A LYS 48.A NZ HIS 91.A O no hydrogen 2.735 N/A ALA 50.A N GLN 47.A O no hydrogen 3.036 N/A VAL 55.A N VAL 51.A O no hydrogen 3.075 N/A GLY 56.A N PRO 52.A O no hydrogen 2.859 N/A ASP 57.A N ALA 53.A O no hydrogen 2.928 N/A TYR 58.A N MET 54.A O no hydrogen 2.896 N/A ILE 59.A N VAL 55.A O no hydrogen 2.883 N/A ALA 60.A N GLY 56.A O no hydrogen 2.990 N/A ALA 61.A N ASP 57.A O no hydrogen 2.964 N/A PHE 62.A N TYR 58.A O no hydrogen 2.829 N/A GLU 63.A N ILE 59.A O no hydrogen 2.988 N/A ALA 64.A N ALA 60.A O no hydrogen 3.022 N/A VAL 65.A N ALA 61.A O no hydrogen 3.203 N/A SER 66.A N PHE 62.A O no hydrogen 2.995 N/A ASP 68.A N SER 66.A OG no hydrogen 2.997 N/A LEU 70.A N SER 66.A O no hydrogen 3.053 N/A ARG 71.A N PRO 67.A O no hydrogen 2.982 N/A TYR 72.A N ASP 68.A O no hydrogen 2.966 N/A ILE 73.A N VAL 69.A O no hydrogen 2.975 N/A ILE 74.A N LEU 70.A O no hydrogen 3.057 N/A ASN 75.A N ARG 71.A O no hydrogen 3.348 N/A ASN 75.A ND2 ARG 71.A O no hydrogen 2.960 N/A ASN 75.A ND2 VAL 105.A O no hydrogen 2.766 N/A MET 76.A N ILE 73.A O no hydrogen 3.012 N/A ASP 78.A N ASN 82.A O no hydrogen 2.921 N/A ASN 80.A N ASP 78.A OD1 no hydrogen 2.828 N/A GLY 81.A N ASP 78.A O no hydrogen 2.841 N/A ASN 82.A N ASP 78.A OD1 no hydrogen 3.083 N/A ASN 82.A ND2 TYR 87.A OH no hydrogen 3.172 N/A THR 83.A N HIS 86.A ND1 no hydrogen 3.165 N/A THR 83.A OG1 HIS 86.A ND1 no hydrogen 2.920 N/A HIS 86.A N THR 83.A OG1 no hydrogen 3.214 N/A HIS 86.A ND1 THR 83.A OG1 no hydrogen 2.920 N/A HIS 86.A NE2 TYR 116.A O no hydrogen 3.032 N/A TYR 87.A N THR 83.A O no hydrogen 3.150 N/A TYR 87.A OH ASP 78.A OD2 no hydrogen 2.526 N/A SER 88.A N ALA 84.A O no hydrogen 2.822 N/A SER 88.A OG ALA 84.A O no hydrogen 2.856 N/A SER 88.A OG LEU 85.A O no hydrogen 3.435 N/A VAL 89.A N LEU 85.A O no hydrogen 3.018 N/A SER 90.A N HIS 86.A O no hydrogen 2.909 N/A HIS 91.A N TYR 87.A O no hydrogen 2.883 N/A SER 92.A N VAL 89.A O no hydrogen 2.961 N/A SER 92.A OG ALA 126.A O no hydrogen 2.727 N/A ASN 93.A N SER 88.A O no hydrogen 2.836 N/A ASN 93.A ND2 LYS 48.A O no hydrogen 3.000 N/A VAL 97.A N ASN 93.A O no hydrogen 2.942 N/A LYS 98.A N PHE 94.A O no hydrogen 2.933 N/A LYS 98.A NZ ASP 102.A OD1 no hydrogen 2.981 N/A LYS 98.A NZ GLU 138.A OE1.A no hydrogen 2.829 N/A LYS 98.A NZ GLU 138.A OE1.B no hydrogen 2.793 N/A LYS 98.A NZ GLU 138.A OE2.A no hydrogen 3.486 N/A LYS 98.A NZ GLU 138.A OE2.B no hydrogen 3.537 N/A LEU 99.A N GLN 95.A O no hydrogen 3.060 N/A LEU 100.A N ILE 96.A O no hydrogen 2.953 N/A LEU 101.A N VAL 97.A O no hydrogen 2.906 N/A ASP 102.A N LYS 98.A O no hydrogen 2.839 N/A ALA 103.A N LEU 99.A O no hydrogen 3.175 N/A ALA 103.A N LEU 100.A O no hydrogen 3.198 N/A ASP 104.A N LEU 101.A O no hydrogen 2.968 N/A CYS 106.A SG LEU 100.A O no hydrogen 3.768 N/A ASN 107.A N ASN 75.A OD1 no hydrogen 2.645 N/A ASP 109.A N ASN 107.A OD1 no hydrogen 3.035 N/A HIS 110.A N ASN 107.A O no hydrogen 3.482 N/A GLN 111.A NE2 LYS 148.A O no hydrogen 2.995 N/A ASN 112.A N TYR 116.A O no hydrogen 2.998 N/A ASN 112.A ND2 ASN 82.A OD1 no hydrogen 2.886 N/A LYS 113.A N ASN 80.A O no hydrogen 2.903 N/A GLY 115.A N ASN 112.A O no hydrogen 2.925 N/A GLY 115.A N ASN 112.A OD1 no hydrogen 2.940 N/A TYR 116.A N ASN 112.A OD1 no hydrogen 2.911 N/A MET 120.A N THR 117.A OG1 no hydrogen 3.297 N/A LEU 121.A N THR 117.A O no hydrogen 3.075 N/A ALA 122.A N PRO 118.A O no hydrogen 2.882 N/A ALA 123.A N ILE 119.A O no hydrogen 3.287 N/A ALA 123.A N MET 120.A O no hydrogen 3.168 N/A LEU 124.A N LEU 121.A O no hydrogen 3.114 N/A ALA 125.A N ALA 122.A O no hydrogen 3.075 N/A ASP 132.A N ALA 129.A O no hydrogen 2.881 N/A MET 133.A N ALA 129.A O no hydrogen 3.357 N/A GLN 134.A N GLU 130.A O no hydrogen 3.154 N/A VAL 136.A N ASP 132.A O no hydrogen 3.072 N/A GLU 137.A N MET 133.A O no hydrogen 2.813 N/A GLU 138.A N GLN 134.A O no hydrogen 3.027 N/A LEU 139.A N VAL 135.A O no hydrogen 2.932 N/A PHE 140.A N VAL 136.A O no hydrogen 2.878 N/A SER 141.A N GLU 137.A O no hydrogen 3.026 N/A SER 141.A OG GLU 137.A O no hydrogen 3.043 N/A CYS 142.A N LEU 139.A O no hydrogen 3.075 N/A CYS 142.A SG GLU 138.A O no hydrogen 3.411 N/A ASP 144.A N ASP 109.A OD1 no hydrogen 2.764 N/A ASN 146.A N ASP 144.A OD1 no hydrogen 2.872 N/A ALA 147.A N ASP 144.A O no hydrogen 3.206 N/A LYS 148.A NZ GLN 182.A O no hydrogen 2.806 N/A ALA 149.A N GLN 154.A O no hydrogen 2.807 N/A SER 150.A N GLY 115.A O no hydrogen 3.040 N/A GLY 153.A N ALA 149.A O no hydrogen 3.046 N/A MET 158.A N THR 155.A OG1 no hydrogen 3.060 N/A LEU 159.A N THR 155.A O no hydrogen 3.004 N/A ALA 160.A N ALA 156.A O no hydrogen 2.915 N/A VAL 161.A N LEU 157.A O no hydrogen 2.897 N/A SER 162.A N MET 158.A O no hydrogen 2.862 N/A SER 162.A OG MET 158.A O no hydrogen 2.854 N/A HIS 163.A N LEU 159.A O no hydrogen 3.243 N/A HIS 163.A N ALA 160.A O no hydrogen 3.230 N/A GLY 164.A N VAL 161.A O no hydrogen 2.938 N/A ARG 165.A N ALA 160.A O no hydrogen 2.994 N/A ARG 165.A NE.A ASP 167.A OD1 no hydrogen 3.467 N/A ARG 165.A NH1.B ALA 123.A O no hydrogen 2.820 N/A ARG 165.A NH1.B ALA 125.A O no hydrogen 2.732 N/A ARG 165.A NH2.A ASP 167.A OD2 no hydrogen 3.205 N/A ARG 165.A NH2.B ALA 125.A O no hydrogen 2.947 N/A ILE 166.A N GLY 164.A O no hydrogen 3.056 N/A VAL 169.A N ARG 165.A O no hydrogen 2.944 N/A LYS 170.A N ILE 166.A O no hydrogen 2.922 N/A GLY 171.A N ASP 167.A O no hydrogen 2.952 N/A LEU 172.A N MET 168.A O no hydrogen 2.805 N/A LEU 173.A N VAL 169.A O no hydrogen 2.912 N/A ALA 174.A N LYS 170.A O no hydrogen 2.934 N/A CYS 175.A N GLY 171.A O no hydrogen 3.003 N/A CYS 175.A N LEU 172.A O no hydrogen 3.187 N/A CYS 175.A SG GLU 137.A O no hydrogen 3.740 N/A CYS 175.A SG GLY 171.A O no hydrogen 3.408 N/A GLY 176.A N LEU 173.A O no hydrogen 3.157 N/A ALA 177.A N LEU 172.A O no hydrogen 2.980 N/A ASP 178.A N ASN 146.A OD1 no hydrogen 2.837 N/A ASN 180.A N ASP 178.A OD1 no hydrogen 2.854 N/A ASN 180.A ND2 GLY 210.A O no hydrogen 2.919 N/A GLN 182.A NE2 GLY 186.A O no hydrogen 2.922 N/A ASP 183.A N SER 187.A O no hydrogen 2.923 N/A ASP 184.A N ALA 152.A O no hydrogen 2.873 N/A GLU 185.A N ASP 183.A OD1 no hydrogen 2.885 N/A GLY 186.A N ASP 183.A O no hydrogen 2.854 N/A SER 187.A N ASP 183.A OD1 no hydrogen 2.832 N/A MET 191.A N THR 188.A OG1 no hydrogen 3.122 N/A CYS 192.A N THR 188.A O no hydrogen 2.985 N/A CYS 192.A SG SER 162.A OG no hydrogen 3.768 N/A CYS 192.A SG THR 188.A O no hydrogen 3.525 N/A ALA 193.A N ALA 189.A O no hydrogen 2.887 N/A SER 194.A N LEU 190.A O no hydrogen 2.930 N/A SER 194.A OG LEU 190.A O no hydrogen 2.983 N/A SER 194.A OG ALA 223.A O no hydrogen 3.428 N/A GLU 195.A N MET 191.A O no hydrogen 2.988 N/A HIS 196.A N CYS 192.A O no hydrogen 3.244 N/A HIS 196.A N ALA 193.A O no hydrogen 3.276 N/A HIS 196.A ND1 CYS 192.A O no hydrogen 3.058 N/A GLY 197.A N ALA 193.A O no hydrogen 2.983 N/A HIS 198.A N ALA 193.A O no hydrogen 3.147 N/A VAL 202.A N HIS 198.A O no hydrogen 2.966 N/A LYS 203.A N VAL 199.A O no hydrogen 3.058 N/A LYS 203.A NZ GLU 200.A OE2 no hydrogen 3.334 N/A LEU 204.A N GLU 200.A O no hydrogen 2.999 N/A LEU 205.A N ILE 201.A O no hydrogen 2.933 N/A LEU 206.A N VAL 202.A O no hydrogen 2.891 N/A ALA 207.A N LYS 203.A O no hydrogen 2.946 N/A GLN 208.A N LEU 205.A O no hydrogen 3.099 N/A CYS 211.A N GLN 208.A O no hydrogen 3.069 N/A CYS 211.A SG LEU 205.A O no hydrogen 3.302 N/A ASN 212.A N ASN 180.A OD1 no hydrogen 2.924 N/A HIS 214.A N ASN 212.A OD1 no hydrogen 2.965 N/A ASP 217.A N SER 221.A O no hydrogen 3.000 N/A ASN 218.A N GLU 185.A O no hydrogen 2.949 N/A ASN 218.A ND2 ASP 184.A O no hydrogen 3.132 N/A ASP 219.A N ASP 217.A OD1 no hydrogen 2.996 N/A GLY 220.A N ASP 217.A O no hydrogen 2.992 N/A SER 221.A N ASP 217.A OD1 no hydrogen 2.734 N/A THR 222.A N SER 225.A OG no hydrogen 3.007 N/A SER 225.A N THR 222.A OG1 no hydrogen 3.261 N/A SER 225.A OG THR 222.A O no hydrogen 3.060 N/A ILE 226.A N THR 222.A O no hydrogen 2.885 N/A ALA 227.A N ALA 223.A O no hydrogen 2.937 N/A LEU 228.A N LEU 224.A O no hydrogen 3.212 N/A GLU 229.A N SER 225.A O no hydrogen 3.077 N/A ALA 230.A N ILE 226.A O no hydrogen 2.921 N/A GLY 231.A N LEU 228.A O no hydrogen 3.058 N/A HIS 232.A N ALA 227.A O no hydrogen 2.806 N/A HIS 232.A ND1 SER 194.A O no hydrogen 3.107 N/A ILE 235.A N ASP 234.A OD1 no hydrogen 2.693 N/A ALA 236.A N HIS 232.A O no hydrogen 3.123 N/A VAL 237.A N LYS 233.A O no hydrogen 2.931 N/A LEU 238.A N ASP 234.A O no hydrogen 3.099 N/A LEU 239.A N ILE 235.A O no hydrogen 2.759 N/A TYR 240.A N ALA 236.A O no hydrogen 2.889 N/A ALA 241.A N VAL 237.A O no hydrogen 2.981 N/A HIS 242.A N LEU 238.A O no hydrogen 3.065 N/A LEU 243.A N LEU 239.A O no hydrogen 2.874 N/A ASN 244.A N TYR 240.A O no hydrogen 3.009 N/A