Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9hrr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N LYS 11.A O no hydrogen 2.883 N/A SER 2.A OG LEU 3.A O no hydrogen 3.303 N/A THR 4.A N SER 9.A O no hydrogen 2.993 N/A THR 4.A OG1 ASP 6.A OD1 no hydrogen 2.964 N/A THR 4.A OG1 SER 9.A O no hydrogen 3.307 N/A THR 4.A OG1 SER 9.A OG no hydrogen 3.005 N/A GLY 7.A N THR 4.A O no hydrogen 2.980 N/A LEU 8.A N ASP 6.A OD1 no hydrogen 3.014 N/A SER 9.A OG THR 4.A OG1 no hydrogen 3.005 N/A SER 9.A OG GLU 87.A OE2 no hydrogen 2.685 N/A TYR 10.A N THR 88.A O no hydrogen 2.938 N/A LYS 11.A N SER 2.A O no hydrogen 2.973 N/A GLU 12.A N ILE 86.A O no hydrogen 3.062 N/A PHE 14.A N VAL 84.A O no hydrogen 2.988 N/A VAL 16.A N ASP 82.A O no hydrogen 2.999 N/A ARG 17.A N GLU 20.A OE1 no hydrogen 2.800 N/A ARG 17.A NH1 TYR 19.A OH no hydrogen 2.874 N/A GLU 20.A N ARG 17.A O no hydrogen 3.049 N/A GLY 22.A N THR 26.A O no hydrogen 2.983 N/A LYS 25.A N GLY 22.A O no hydrogen 2.935 N/A THR 26.A N ASN 24.A OD1 no hydrogen 3.384 N/A THR 26.A OG1 ASN 24.A OD1 no hydrogen 2.598 N/A ALA 27.A N PRO 78.A O no hydrogen 2.929 N/A THR 28.A N GLU 20.A O no hydrogen 3.308 N/A THR 28.A OG1 THR 31.A OG1 no hydrogen 3.246 N/A THR 31.A N THR 28.A OG1 no hydrogen 3.058 N/A THR 31.A OG1 GLU 20.A O no hydrogen 2.775 N/A THR 31.A OG1 THR 28.A OG1 no hydrogen 3.246 N/A ILE 32.A N THR 28.A O no hydrogen 3.074 N/A ALA 33.A N VAL 29.A O no hydrogen 2.886 N/A ASN 34.A N GLU 30.A O no hydrogen 2.918 N/A LEU 35.A N THR 31.A O no hydrogen 2.973 N/A LEU 36.A N ILE 32.A O no hydrogen 2.955 N/A GLN 37.A N ALA 33.A O no hydrogen 3.057 N/A GLN 37.A NE2 ASN 189.A OD1 no hydrogen 3.288 N/A GLU 38.A N ASN 34.A O no hydrogen 2.853 N/A VAL 39.A N LEU 35.A O no hydrogen 3.015 N/A GLY 40.A N LEU 36.A O no hydrogen 3.008 N/A CYS 41.A N GLN 37.A O no hydrogen 2.967 N/A CYS 41.A SG.A GLN 37.A O no hydrogen 3.434 N/A ASN 42.A N GLU 38.A O no hydrogen 2.990 N/A ASN 42.A ND2 GLU 12.A OE1 no hydrogen 2.800 N/A ASN 42.A ND2 GLU 38.A OE2 no hydrogen 3.185 N/A HIS 43.A N VAL 39.A O no hydrogen 2.917 N/A ALA 44.A N GLY 40.A O no hydrogen 3.064 N/A GLN 45.A N CYS 41.A O no hydrogen 2.982 N/A SER 46.A N ASN 42.A O no hydrogen 2.980 N/A SER 46.A OG HIS 43.A O no hydrogen 2.753 N/A VAL 47.A N HIS 43.A O no hydrogen 3.151 N/A VAL 47.A N ALA 44.A O no hydrogen 3.373 N/A GLY 48.A N GLN 45.A O no hydrogen 3.260 N/A PHE 49.A N ALA 44.A O no hydrogen 2.828 N/A SER 50.A N THR 54.A O no hydrogen 3.433 N/A SER 50.A OG THR 54.A OG1 no hydrogen 3.262 N/A THR 54.A OG1 SER 50.A OG no hydrogen 3.262 N/A THR 55.A OG1 GLU 140.A OE1 no hydrogen 2.809 N/A THR 57.A N GLU 140.A OE2 no hydrogen 3.478 N/A THR 57.A OG1 GLU 140.A OE2 no hydrogen 2.692 N/A MET 58.A N THR 55.A OG1 no hydrogen 3.300 N/A ARG 59.A N THR 55.A O no hydrogen 2.994 N/A LYS 60.A N THR 56.A O no hydrogen 3.020 N/A LEU 61.A N THR 57.A O no hydrogen 2.938 N/A HIS 62.A N ARG 59.A O no hydrogen 3.224 N/A LEU 63.A N MET 58.A O no hydrogen 2.739 N/A ILE 64.A N MET 123.A O no hydrogen 2.981 N/A VAL 66.A N VAL 121.A O no hydrogen 2.922 N/A ALA 68.A N LYS 119.A O no hydrogen 2.716 N/A ARG 69.A N LYS 119.A O no hydrogen 3.303 N/A ARG 69.A NE ASP 217.A OD1 no hydrogen 2.726 N/A ARG 69.A NH1 SER 157.A O no hydrogen 2.953 N/A ARG 69.A NH1 LYS 159.A O no hydrogen 2.859 N/A ARG 69.A NH2 LYS 159.A O no hydrogen 2.812 N/A ARG 69.A NH2 ASP 217.A OD1 no hydrogen 3.064 N/A ARG 69.A NH2 ASP 217.A OD2 no hydrogen 3.479 N/A MET 70.A N LEU 216.A O no hydrogen 2.949 N/A HIS 71.A N THR 117.A O no hydrogen 2.842 N/A HIS 71.A ND1 THR 215.A OG1 no hydrogen 2.665 N/A HIS 71.A NE2 GLU 73.A OE2.B no hydrogen 2.793 N/A ILE 72.A N ILE 214.A O no hydrogen 2.977 N/A GLU 73.A N ARG 115.A O no hydrogen 2.876 N/A ILE 74.A N GLN 212.A O no hydrogen 2.880 N/A TYR 75.A N THR 113.A O no hydrogen 2.729 N/A TYR 75.A OH GLU 73.A OE1.A no hydrogen 3.273 N/A LYS 76.A N THR 113.A O no hydrogen 3.130 N/A TYR 77.A OH LEU 211.A O no hydrogen 2.679 N/A ALA 79.A N ASP 82.A OD2 no hydrogen 2.858 N/A TRP 80.A N LYS 25.A O no hydrogen 3.095 N/A GLY 81.A N VAL 16.A O no hydrogen 3.028 N/A ASP 82.A N ALA 79.A O no hydrogen 2.838 N/A VAL 84.A N PHE 14.A O no hydrogen 2.943 N/A GLU 85.A N LYS 105.A O no hydrogen 2.870 N/A ILE 86.A N GLU 12.A O no hydrogen 2.871 N/A GLU 87.A N ILE 103.A O no hydrogen 2.951 N/A THR 88.A N TYR 10.A O no hydrogen 2.927 N/A THR 88.A OG1 ASP 101.A O no hydrogen 2.890 N/A TRP 89.A N ASP 101.A O no hydrogen 3.206 N/A TRP 89.A NE1 ARG 150.A O no hydrogen 2.925 N/A GLN 91.A N ARG 99.A O no hydrogen 2.937 N/A GLN 91.A NE2 PRO 146.A O no hydrogen 3.033 N/A GLN 91.A NE2 GLU 148.A O no hydrogen 3.035 N/A GLU 93.A N GLY 97.A O no hydrogen 2.834 N/A ILE 96.A N GLU 93.A O no hydrogen 3.216 N/A THR 98.A N TRP 120.A O no hydrogen 3.135 N/A ARG 99.A N GLN 91.A O no hydrogen 2.897 N/A ARG 99.A NE ASP 101.A OD1 no hydrogen 3.074 N/A ARG 99.A NE ASP 101.A OD2 no hydrogen 3.308 N/A ARG 99.A NH1 GLN 91.A OE1 no hydrogen 3.227 N/A ARG 99.A NH1 ASP 101.A OD2 no hydrogen 3.147 N/A ARG 99.A NH2 GLN 91.A OE1 no hydrogen 3.517 N/A ARG 99.A NH2 GLU 93.A OE2 no hydrogen 3.027 N/A ARG 100.A N SER 118.A O no hydrogen 2.985 N/A ARG 100.A NH1 HIS 43.A ND1 no hydrogen 3.409 N/A ARG 100.A NH2 HIS 43.A ND1 no hydrogen 2.938 N/A ARG 100.A NH2 THR 88.A OG1 no hydrogen 2.891 N/A ASP 101.A N TRP 89.A O no hydrogen 2.874 N/A TRP 102.A N ALA 116.A O no hydrogen 2.868 N/A TRP 102.A NE1 LEU 36.A O no hydrogen 2.939 N/A ILE 103.A N GLU 87.A O no hydrogen 2.835 N/A LEU 104.A N GLY 114.A O no hydrogen 2.840 N/A LYS 105.A N GLU 85.A O no hydrogen 2.796 N/A ASP 106.A N GLU 111.A O no hydrogen 2.876 N/A SER 107.A N VAL 83.A O no hydrogen 3.380 N/A SER 107.A OG VAL 83.A O no hydrogen 3.549 N/A VAL 108.A N ASP 106.A OD1 no hydrogen 2.902 N/A THR 109.A N ASP 106.A OD1 no hydrogen 2.992 N/A GLY 110.A N ASP 106.A O no hydrogen 2.619 N/A GLU 111.A N THR 109.A OG1 no hydrogen 3.213 N/A THR 113.A N LEU 104.A O no hydrogen 2.740 N/A THR 113.A OG1 LEU 104.A O no hydrogen 3.257 N/A GLY 114.A N LEU 104.A O no hydrogen 3.316 N/A ARG 115.A N GLU 73.A O no hydrogen 2.941 N/A ARG 115.A NE.B ALA 152.A O no hydrogen 3.200 N/A ARG 115.A NE.C TYR 75.A OH no hydrogen 2.479 N/A ARG 115.A NH1.C ALA 152.A O no hydrogen 2.953 N/A ARG 115.A NH2.B TYR 75.A OH no hydrogen 3.030 N/A ARG 115.A NH2.C GLU 73.A OE1.A no hydrogen 3.469 N/A ARG 115.A NH2.C TYR 75.A OH no hydrogen 3.396 N/A ALA 116.A N TRP 102.A O no hydrogen 3.018 N/A THR 117.A N HIS 71.A O no hydrogen 2.903 N/A THR 117.A OG1 ASP 101.A OD1 no hydrogen 2.637 N/A SER 118.A N ARG 100.A O no hydrogen 2.876 N/A SER 118.A OG ARG 100.A O no hydrogen 2.995 N/A LYS 119.A N ARG 69.A O no hydrogen 2.946 N/A LYS 119.A NZ GLU 93.A OE1 no hydrogen 2.852 N/A TRP 120.A N THR 98.A O no hydrogen 2.950 N/A TRP 120.A NE1 SER 118.A OG no hydrogen 2.896 N/A VAL 121.A N VAL 66.A O no hydrogen 2.875 N/A MET 123.A N ILE 64.A O no hydrogen 2.872 N/A ASN 124.A N ARG 129.A O no hydrogen 2.940 N/A GLN 125.A N HIS 62.A O no hydrogen 2.954 N/A ASP 126.A N ASN 124.A OD1 no hydrogen 2.581 N/A THR 127.A N ASN 124.A OD1 no hydrogen 2.970 N/A ARG 129.A N THR 127.A OG1 no hydrogen 3.213 N/A GLN 131.A N MET 122.A O no hydrogen 3.053 N/A VAL 133.A N ARG 95.A O no hydrogen 3.023 N/A VAL 137.A N SER 134.A OG no hydrogen 3.428 N/A ARG 138.A N SER 134.A O no hydrogen 3.175 N/A ASP 139.A N ASP 135.A O no hydrogen 3.201 N/A GLU 140.A N ASP 136.A O no hydrogen 3.357 N/A TYR 141.A N VAL 137.A O no hydrogen 3.116 N/A LEU 142.A N ARG 138.A O no hydrogen 3.072 N/A PHE 144.A N TYR 141.A O no hydrogen 2.938 N/A CYS 145.A SG CYS 90.A O no hydrogen 3.084 N/A CYS 145.A SG TYR 141.A O no hydrogen 3.178 N/A GLN 147.A NE2 CYS 145.A O no hydrogen 3.552 N/A GLU 148.A N GLU 148.A OE1 no hydrogen 2.823 N/A ARG 150.A N GLN 91.A OE1 no hydrogen 3.160 N/A ARG 150.A NH1 GLU 87.A OE2 no hydrogen 3.161 N/A ARG 150.A NH2 GLU 87.A OE1 no hydrogen 3.171 N/A ARG 150.A NH2 GLU 87.A OE2 no hydrogen 3.092 N/A ALA 152.A N ASP 101.A OD2 no hydrogen 2.841 N/A ASN 155.A ND2 PHE 153.A O no hydrogen 2.794 N/A SER 157.A N ASN 155.A OD1 no hydrogen 3.266 N/A SER 157.A OG ASN 155.A OD1 no hydrogen 3.107 N/A LEU 158.A N ASN 155.A O no hydrogen 2.924 N/A LYS 159.A N ARG 156.A O no hydrogen 3.198 N/A GLN 169.A N THR 233.A OG1 no hydrogen 3.094 N/A TYR 170.A N THR 232.A O no hydrogen 2.832 N/A MET 172.A N SER 230.A O no hydrogen 2.920 N/A GLY 174.A N ASP 229.A OD1 no hydrogen 3.162 N/A LEU 175.A N VAL 228.A O no hydrogen 2.863 N/A ARG 178.A N ASP 181.A OD2 no hydrogen 2.791 N/A ASP 181.A N ARG 178.A O no hydrogen 2.770 N/A LEU 182.A N ARG 179.A O no hydrogen 3.096 N/A ASP 183.A N HIS 187.A O no hydrogen 2.825 N/A ASN 185.A N ASP 183.A OD1 no hydrogen 2.923 N/A GLN 186.A N ASP 183.A O no hydrogen 2.872 N/A HIS 187.A N ASP 183.A OD1 no hydrogen 3.001 N/A HIS 187.A ND1 GLU 221.A OE2 no hydrogen 2.831 N/A ASN 189.A N ASP 181.A O no hydrogen 2.786 N/A ASN 189.A ND2 GLN 37.A OE1 no hydrogen 3.023 N/A VAL 191.A N ASN 189.A OD1 no hydrogen 2.777 N/A THR 192.A N ASN 189.A O no hydrogen 3.030 N/A THR 192.A OG1 ASP 181.A O no hydrogen 3.522 N/A THR 192.A OG1 ASP 181.A OD1 no hydrogen 3.166 N/A GLY 195.A N VAL 191.A O no hydrogen 3.202 N/A TRP 196.A N THR 192.A O no hydrogen 2.886 N/A VAL 197.A N TYR 193.A O no hydrogen 2.905 N/A LEU 198.A N ILE 194.A O no hydrogen 3.125 N/A GLU 199.A N GLY 195.A O no hydrogen 3.068 N/A GLU 199.A N TRP 196.A O no hydrogen 3.170 N/A SER 200.A N VAL 197.A O no hydrogen 3.441 N/A SER 200.A OG VAL 197.A O no hydrogen 3.246 N/A SER 200.A OG SER 230.A OG no hydrogen 2.705 N/A SER 200.A OG THR 232.A OG1 no hydrogen 2.632 N/A ILE 201.A N LEU 198.A O no hydrogen 3.030 N/A GLN 203.A NE2 ASP 207.A OD1 no hydrogen 3.107 N/A GLU 204.A N GLU 204.A OE1 no hydrogen 2.933 N/A VAL 206.A N PRO 202.A O no hydrogen 3.325 N/A ASP 207.A N GLN 203.A O no hydrogen 2.733 N/A THR 208.A N ILE 205.A O no hydrogen 3.233 N/A THR 208.A OG1 GLU 204.A O no hydrogen 2.888 N/A THR 208.A OG1 ILE 205.A O no hydrogen 3.449 N/A THR 208.A OG1 HIS 209.A ND1 no hydrogen 2.685 N/A HIS 209.A N ILE 205.A O no hydrogen 2.740 N/A HIS 209.A ND1 THR 208.A OG1 no hydrogen 2.685 N/A GLU 210.A N ARG 261.A O no hydrogen 2.942 N/A GLN 212.A N LEU 259.A O no hydrogen 2.817 N/A VAL 213.A N LEU 259.A O no hydrogen 3.247 N/A ILE 214.A N ILE 72.A O no hydrogen 2.950 N/A THR 215.A N THR 257.A O no hydrogen 2.936 N/A THR 215.A OG1 HIS 71.A ND1 no hydrogen 2.665 N/A LEU 216.A N MET 70.A O no hydrogen 2.844 N/A ASP 217.A N ARG 255.A O no hydrogen 2.808 N/A TYR 218.A N ALA 68.A O no hydrogen 2.958 N/A TYR 218.A OH ASN 190.A O no hydrogen 2.846 N/A ARG 219.A N ILE 253.A O no hydrogen 2.916 N/A ARG 220.A N ILE 253.A O no hydrogen 3.288 N/A CYS 222.A N TYR 193.A OH no hydrogen 2.837 N/A CYS 222.A SG GLN 223.A O no hydrogen 3.360 N/A GLN 223.A N ASP 226.A OD2 no hydrogen 2.786 N/A ASP 226.A N GLN 223.A O no hydrogen 3.063 N/A VAL 228.A N LEU 175.A O no hydrogen 2.801 N/A ASP 229.A N ARG 245.A O no hydrogen 2.849 N/A SER 230.A N MET 172.A O no hydrogen 2.962 N/A SER 230.A OG TRP 196.A O no hydrogen 2.820 N/A SER 230.A OG VAL 197.A O no hydrogen 3.413 N/A SER 230.A OG SER 200.A OG no hydrogen 2.705 N/A LEU 231.A N LEU 243.A O no hydrogen 2.827 N/A THR 232.A N TYR 170.A O no hydrogen 3.062 N/A THR 232.A OG1 SER 200.A OG no hydrogen 2.632 N/A THR 232.A OG1 HIS 242.A ND1 no hydrogen 2.765 N/A THR 233.A N LEU 241.A O no hydrogen 3.012 N/A THR 234.A N GLN 169.A OE1 no hydrogen 2.958 N/A THR 234.A OG1 GLN 169.A OE1 no hydrogen 2.729 N/A THR 235.A N GLN 239.A O no hydrogen 2.862 N/A SER 236.A N GLN 239.A O no hydrogen 3.333 N/A SER 238.A N TRP 260.A O no hydrogen 2.841 N/A SER 238.A OG HIS 209.A NE2 no hydrogen 3.248 N/A GLN 239.A N SER 236.A OG no hydrogen 2.900 N/A PHE 240.A N THR 258.A O no hydrogen 3.088 N/A LEU 241.A N THR 233.A O no hydrogen 2.878 N/A HIS 242.A N GLY 256.A O no hydrogen 2.852 N/A HIS 242.A ND1 THR 232.A OG1 no hydrogen 2.765 N/A HIS 242.A NE2 THR 258.A OG1 no hydrogen 2.859 N/A LEU 243.A N LEU 231.A O no hydrogen 2.915 N/A LEU 244.A N ASN 254.A O no hydrogen 2.937 N/A ARG 245.A N ASP 229.A O no hydrogen 3.056 N/A ARG 245.A NH1 ASP 166.A OD1 no hydrogen 3.288 N/A ARG 245.A NH1 ASP 166.A OD2 no hydrogen 3.142 N/A ARG 245.A NH2 ASP 166.A OD2 no hydrogen 3.452 N/A LEU 246.A N GLN 251.A O no hydrogen 2.865 N/A SER 247.A N VAL 227.A O no hydrogen 2.764 N/A SER 247.A OG ASP 229.A OD1 no hydrogen 2.807 N/A SER 247.A OG ASP 229.A OD2 no hydrogen 3.460 N/A GLY 250.A N LEU 246.A O no hydrogen 2.956 N/A GLN 251.A N ASP 249.A OD1 no hydrogen 2.913 N/A ILE 253.A N LEU 244.A O no hydrogen 2.870 N/A ASN 254.A N LEU 244.A O no hydrogen 3.275 N/A ASN 254.A ND2 ASP 217.A O no hydrogen 3.083 N/A ARG 255.A N ASP 217.A O no hydrogen 3.261 N/A ARG 255.A NE GLU 252.A OE1 no hydrogen 2.845 N/A ARG 255.A NH1 ILE 161.A O no hydrogen 2.942 N/A ARG 255.A NH2 GLU 252.A OE1 no hydrogen 3.445 N/A ARG 255.A NH2 GLU 252.A OE2 no hydrogen 2.901 N/A GLY 256.A N HIS 242.A O no hydrogen 3.100 N/A THR 257.A N THR 215.A O no hydrogen 3.001 N/A THR 258.A N PHE 240.A O no hydrogen 3.141 N/A THR 258.A OG1 HIS 242.A NE2 no hydrogen 2.859 N/A LEU 259.A N VAL 213.A O no hydrogen 2.833 N/A TRP 260.A N SER 238.A O no hydrogen 2.747 N/A TRP 260.A NE1 THR 258.A OG1 no hydrogen 2.834 N/A ARG 261.A N GLU 210.A O no hydrogen 2.933 N/A ARG 261.A NH2 ILE 74.A O no hydrogen 2.859 N/A LYS 263.A N THR 208.A O no hydrogen 3.167 N/A LYS 263.A NZ VAL 206.A O no hydrogen 3.498 N/A LYS 263.A NZ ASP 207.A O no hydrogen 3.067 N/A