Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q0l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASP 8.A OD2 no hydrogen 2.842 N/A THR 3.A N ASP 8.A O no hydrogen 3.030 N/A THR 3.A OG1 PHE 5.A O no hydrogen 2.847 N/A PHE 5.A N THR 3.A OG1 no hydrogen 3.011 N/A GLY 9.A N GLY 6.A O no hydrogen 3.046 N/A SER 12.A N GLY 9.A O no hydrogen 2.920 N/A SER 12.A OG PRO 7.A O no hydrogen 2.782 N/A TRP 13.A N GLU 10.A O no hydrogen 3.227 N/A TRP 13.A NE1 THR 3.A O no hydrogen 2.787 N/A LYS 15.A N SER 12.A O no hydrogen 2.791 N/A LYS 15.A NZ SER 12.A OG no hydrogen 3.185 N/A LYS 16.A N TRP 13.A O no hydrogen 3.210 N/A TYR 17.A N TRP 13.A O no hydrogen 2.988 N/A CYS 20.A N TYR 17.A O no hydrogen 3.040 N/A GLY 21.A N PRO 18.A O no hydrogen 2.754 N/A GLY 22.A N SER 19.A O no hydrogen 2.815 N/A SER 26.A N SER 194.A OG no hydrogen 2.924 N/A SER 26.A OG TYR 191.A OH no hydrogen 3.155 N/A SER 26.A OG SER 194.A O no hydrogen 3.408 N/A LEU 30.A N THR 104.A O no hydrogen 2.656 N/A HIS 31.A ND1 ASP 29.A O no hydrogen 3.350 N/A ILE 34.A N HIS 31.A O no hydrogen 3.152 N/A LEU 35.A N SER 32.A O no hydrogen 3.209 N/A GLN 36.A N VAL 255.A O no hydrogen 2.887 N/A ASP 38.A N THR 257.A O no hydrogen 2.976 N/A SER 40.A N ASP 38.A OD2 no hydrogen 3.115 N/A SER 40.A OG ASP 38.A OD1 no hydrogen 3.488 N/A SER 40.A OG ASP 38.A OD2 no hydrogen 3.068 N/A LEU 41.A N ASP 38.A O no hydrogen 3.179 N/A GLU 45.A N GLN 77.A O no hydrogen 2.943 N/A GLN 47.A N HIS 75.A O no hydrogen 3.011 N/A GLN 47.A NE2 GLU 45.A OE1 no hydrogen 3.408 N/A TYR 49.A OH HIS 118.A NE2 no hydrogen 2.890 N/A LEU 51.A N PHE 175.A O no hydrogen 3.100 N/A LYS 55.A N SER 52.A O no hydrogen 2.913 N/A LYS 55.A NZ GLN 56.A O no hydrogen 3.163 N/A PHE 57.A N VAL 172.A O no hydrogen 2.596 N/A LEU 59.A N ALA 170.A O no hydrogen 2.707 N/A THR 60.A N LYS 67.A O no hydrogen 2.664 N/A ASN 61.A N GLN 168.A O no hydrogen 3.355 N/A ASN 61.A ND2 VAL 163.A O no hydrogen 3.098 N/A ASN 61.A ND2 TYR 228.A O no hydrogen 3.034 N/A ASN 62.A N SER 65.A O no hydrogen 2.960 N/A GLY 63.A N ASN 61.A OD1 no hydrogen 2.892 N/A HIS 64.A N ASN 62.A OD1 no hydrogen 3.059 N/A SER 65.A N ASN 62.A OD1 no hydrogen 2.816 N/A SER 65.A OG LEU 90.A O no hydrogen 2.704 N/A LYS 67.A N THR 60.A O no hydrogen 2.648 N/A LEU 68.A N LEU 88.A O no hydrogen 2.853 N/A ASN 69.A N LEU 58.A O no hydrogen 2.812 N/A LEU 70.A N THR 86.A O no hydrogen 3.017 N/A MET 74.A N PRO 71.A O no hydrogen 3.005 N/A HIS 75.A N GLN 47.A O no hydrogen 3.020 N/A HIS 75.A ND1 ASP 73.A O no hydrogen 2.804 N/A ILE 76.A N TYR 83.A O no hydrogen 2.800 N/A GLN 77.A N GLU 45.A O no hydrogen 2.870 N/A GLN 77.A NE2 ILE 76.A O no hydrogen 3.457 N/A SER 81.A OG GLN 80.A OE1 no hydrogen 2.144 N/A ARG 82.A N ASP 122.A OD2 no hydrogen 2.867 N/A ARG 82.A NH2 SER 121.A O no hydrogen 2.992 N/A TYR 83.A OH GLU 135.A O no hydrogen 2.284 N/A SER 84.A N TYR 119.A O no hydrogen 2.888 N/A SER 84.A OG SER 121.A OG no hydrogen 2.584 N/A ALA 85.A N MET 74.A O no hydrogen 2.830 N/A THR 86.A N VAL 117.A O no hydrogen 2.845 N/A GLN 87.A N VAL 117.A O no hydrogen 3.377 N/A LEU 88.A N LEU 68.A O no hydrogen 2.907 N/A HIS 89.A N HIS 115.A O no hydrogen 2.918 N/A HIS 89.A ND1 GLN 87.A OE1 no hydrogen 2.873 N/A HIS 89.A NE2 HIS 91.A NE2 no hydrogen 3.051 N/A HIS 91.A N GLU 113.A O no hydrogen 2.993 N/A HIS 91.A ND1 ASN 243.A O no hydrogen 2.478 N/A HIS 91.A NE2 HIS 89.A NE2 no hydrogen 3.051 N/A TRP 92.A N ASN 243.A OD1 no hydrogen 2.732 N/A TRP 92.A NE1 MET 240.A O no hydrogen 3.132 N/A ASN 94.A ND2 ASN 242.A OD1 no hydrogen 2.938 N/A ASN 96.A N ASN 94.A OD1 no hydrogen 2.840 N/A ASP 97.A N ASN 94.A O no hydrogen 2.897 N/A HIS 99.A N ASP 97.A O no hydrogen 2.663 N/A GLY 100.A N ALA 111.A O no hydrogen 3.083 N/A SER 101.A N PHE 110.A O no hydrogen 3.285 N/A SER 101.A OG HIS 103.A O no hydrogen 2.893 N/A SER 101.A OG HIS 109.A ND1 no hydrogen 3.342 N/A SER 101.A OG PHE 110.A O no hydrogen 3.526 N/A GLU 102.A N GLU 113.A OE2 no hydrogen 3.013 N/A HIS 103.A N GLU 113.A OE2 no hydrogen 2.835 N/A HIS 103.A ND1 GLU 113.A OE1 no hydrogen 2.869 N/A HIS 103.A NE2 TYR 191.A OH no hydrogen 2.647 N/A THR 104.A N ILE 28.A O no hydrogen 3.399 N/A THR 104.A OG1 ASP 29.A OD1 no hydrogen 2.548 N/A VAL 105.A N GLN 108.A O no hydrogen 3.139 N/A SER 106.A N LEU 30.A O no hydrogen 2.512 N/A GLY 107.A N ASP 29.A OD1 no hydrogen 2.821 N/A GLN 108.A N VAL 105.A O no hydrogen 3.011 N/A PHE 110.A N SER 101.A OG no hydrogen 2.730 N/A ALA 111.A N ILE 144.A O no hydrogen 2.713 N/A ALA 112.A N ILE 144.A O no hydrogen 3.343 N/A GLU 113.A N HIS 91.A O no hydrogen 3.079 N/A LEU 114.A N VAL 142.A O no hydrogen 2.972 N/A HIS 115.A N HIS 89.A O no hydrogen 2.714 N/A HIS 115.A NE2 GLU 113.A OE1 no hydrogen 2.419 N/A ILE 116.A N LEU 140.A O no hydrogen 2.889 N/A VAL 117.A N GLN 87.A O no hydrogen 2.669 N/A HIS 118.A N ALA 138.A O no hydrogen 2.778 N/A HIS 118.A NE2 TYR 49.A OH no hydrogen 2.890 N/A TYR 119.A N SER 84.A O no hydrogen 2.747 N/A ASN 120.A N GLY 136.A O no hydrogen 2.876 N/A ASN 120.A ND2 TYR 83.A OH no hydrogen 2.745 N/A ASN 120.A ND2 GLU 135.A O no hydrogen 3.171 N/A SER 121.A N ARG 82.A O no hydrogen 3.113 N/A SER 121.A OG SER 84.A OG no hydrogen 2.584 N/A LEU 123.A N ASN 120.A OD1 no hydrogen 3.358 N/A TYR 124.A N ASN 120.A O no hydrogen 2.947 N/A THR 129.A OG1 ASP 126.A OD1 no hydrogen 2.347 N/A ALA 130.A N ASP 126.A O no hydrogen 2.954 N/A SER 131.A N ALA 127.A O no hydrogen 2.899 N/A SER 131.A OG ALA 127.A O no hydrogen 2.904 N/A LYS 133.A N ALA 130.A O no hydrogen 3.030 N/A GLY 136.A N LYS 133.A O no hydrogen 3.209 N/A LEU 137.A N THR 203.A O no hydrogen 2.963 N/A ALA 138.A N HIS 118.A O no hydrogen 2.920 N/A VAL 139.A N LEU 205.A O no hydrogen 3.030 N/A LEU 140.A N ILE 116.A O no hydrogen 3.079 N/A ALA 141.A N THR 207.A O no hydrogen 2.843 N/A VAL 142.A N LEU 114.A O no hydrogen 3.003 N/A ILE 144.A N ALA 112.A O no hydrogen 3.013 N/A GLU 145.A N VAL 213.A O no hydrogen 2.803 N/A GLY 147.A N ILE 215.A O no hydrogen 2.953 N/A ASN 150.A N GLN 219.A OE1 no hydrogen 2.857 N/A ASN 150.A ND2 GLN 214.A O no hydrogen 2.810 N/A SER 152.A OG ASN 150.A OD1 no hydrogen 3.495 N/A TYR 153.A N ASN 150.A OD1 no hydrogen 3.141 N/A TYR 153.A OH LEU 180.A O no hydrogen 2.911 N/A ASP 154.A N ASN 150.A O no hydrogen 2.878 N/A LYS 155.A N PRO 151.A O no hydrogen 3.205 N/A LYS 155.A N SER 152.A O no hydrogen 3.128 N/A ILE 156.A N TYR 153.A O no hydrogen 2.660 N/A PHE 157.A N TYR 153.A O no hydrogen 3.116 N/A SER 158.A N ASP 154.A O no hydrogen 3.053 N/A SER 158.A OG ASP 154.A O no hydrogen 2.841 N/A HIS 159.A N ILE 156.A O no hydrogen 3.110 N/A HIS 162.A N HIS 159.A O no hydrogen 3.337 N/A VAL 163.A N LEU 160.A O no hydrogen 2.692 N/A TYR 165.A N GLN 168.A OE1 no hydrogen 2.949 N/A LYS 166.A N THR 230.A O no hydrogen 2.931 N/A GLY 167.A N ASN 61.A O no hydrogen 3.127 N/A GLN 168.A N TYR 165.A O no hydrogen 3.218 N/A ALA 170.A N LEU 59.A O no hydrogen 2.866 N/A VAL 172.A N PHE 57.A O no hydrogen 3.010 N/A GLY 174.A N LYS 55.A O no hydrogen 2.467 N/A ILE 177.A N TYR 49.A O no hydrogen 3.075 N/A GLU 178.A N ASN 176.A OD1 no hydrogen 2.935 N/A GLU 179.A N ASN 176.A O no hydrogen 2.688 N/A LEU 180.A N ILE 177.A O no hydrogen 2.611 N/A LEU 181.A N GLU 178.A O no hydrogen 2.891 N/A GLU 187.A N ARG 184.A O no hydrogen 2.760 N/A TYR 188.A N SER 258.A OG no hydrogen 2.925 N/A TYR 188.A OH THR 42.A O no hydrogen 2.927 N/A TYR 189.A N VAL 208.A O no hydrogen 2.719 N/A ARG 190.A N TYR 256.A O no hydrogen 2.577 N/A ARG 190.A NE THR 207.A OG1 no hydrogen 2.889 N/A ARG 190.A NH1 THR 207.A OG1 no hydrogen 3.209 N/A TYR 191.A N TRP 206.A O no hydrogen 3.103 N/A TYR 191.A OH SER 26.A OG no hydrogen 3.155 N/A TYR 191.A OH HIS 103.A NE2 no hydrogen 2.647 N/A GLY 193.A N VAL 204.A O no hydrogen 2.724 N/A SER 194.A N SER 26.A OG no hydrogen 2.896 N/A SER 194.A OG LEU 195.A O no hydrogen 3.287 N/A LEU 195.A N ASN 201.A O no hydrogen 2.900 N/A THR 196.A OG1 GLU 102.A OE1 no hydrogen 2.940 N/A THR 196.A OG1 GLU 102.A OE2 no hydrogen 3.452 N/A CYS 200.A N THR 197.A O no hydrogen 2.697 N/A ASN 201.A ND2 SER 131.A O no hydrogen 3.140 N/A THR 203.A OG1 SER 131.A O no hydrogen 2.704 N/A VAL 204.A N GLY 193.A O no hydrogen 3.090 N/A LEU 205.A N LEU 137.A O no hydrogen 3.110 N/A TRP 206.A N TYR 191.A O no hydrogen 2.908 N/A TRP 206.A NE1 SER 194.A O no hydrogen 3.136 N/A THR 207.A N VAL 139.A O no hydrogen 3.009 N/A VAL 208.A N TYR 189.A O no hydrogen 3.001 N/A PHE 209.A N ALA 141.A O no hydrogen 3.092 N/A ARG 210.A N GLU 187.A O no hydrogen 2.950 N/A ASN 211.A ND2 GLU 183.A O no hydrogen 3.233 N/A ASN 211.A ND2 GLU 187.A OE1 no hydrogen 3.444 N/A VAL 213.A N LEU 143.A O no hydrogen 2.825 N/A ILE 215.A N GLU 145.A O no hydrogen 3.107 N/A SER 216.A N GLN 219.A OE1 no hydrogen 3.218 N/A GLU 218.A N SER 216.A OG no hydrogen 3.178 N/A GLN 219.A NE2 ASN 150.A O no hydrogen 2.820 N/A GLN 219.A NE2 ASP 154.A OD2 no hydrogen 2.933 N/A LEU 220.A N SER 216.A O no hydrogen 2.905 N/A LEU 221.A N GLN 217.A O no hydrogen 2.862 N/A ALA 222.A N GLU 218.A O no hydrogen 2.771 N/A LEU 223.A N GLN 219.A O no hydrogen 2.922 N/A GLU 224.A N LEU 220.A O no hydrogen 3.077 N/A THR 225.A N ALA 222.A O no hydrogen 3.302 N/A THR 225.A OG1 LEU 221.A O no hydrogen 2.709 N/A THR 225.A OG1 ALA 222.A O no hydrogen 3.297 N/A ALA 226.A N ALA 222.A O no hydrogen 2.974 N/A TYR 228.A N LYS 164.A O no hydrogen 2.680 N/A CYS 229.A N ARG 238.A O no hydrogen 2.887 N/A CYS 229.A SG GLU 239.A O no hydrogen 4.014 N/A HIS 231.A ND1 LYS 166.A O no hydrogen 3.119 N/A ASP 234.A N HIS 231.A O no hydrogen 3.240 N/A SER 236.A N ASP 234.A OD1 no hydrogen 2.798 N/A SER 236.A OG SER 236.A O no hydrogen 2.585 N/A ARG 238.A N THR 230.A OG1 no hydrogen 3.189 N/A MET 240.A N LEU 227.A O no hydrogen 2.666 N/A ASN 242.A N GLY 93.A O no hydrogen 3.113 N/A ASN 243.A N TRP 92.A O no hydrogen 3.099 N/A ASN 243.A ND2 HIS 64.A O no hydrogen 3.514 N/A ASN 243.A ND2 LEU 90.A O no hydrogen 3.528 N/A ARG 245.A N GLU 102.A OE2 no hydrogen 2.725 N/A ARG 245.A NH1 SER 26.A O no hydrogen 3.025 N/A ARG 245.A NH2 CYS 20.A O no hydrogen 3.058 N/A GLN 246.A N GLU 10.A OE1 no hydrogen 2.732 N/A GLN 248.A N PRO 27.A O no hydrogen 3.122 N/A GLN 248.A NE2 GLN 246.A O no hydrogen 2.539 N/A ARG 253.A NH1 GLN 25.A O no hydrogen 3.217 N/A ARG 253.A NH1 ARG 192.A O no hydrogen 2.912 N/A ARG 253.A NH2 GLN 25.A O no hydrogen 2.799 N/A VAL 255.A N ILE 34.A O no hydrogen 2.732 N/A TYR 256.A N ARG 190.A O no hydrogen 2.832 N/A THR 257.A N GLN 36.A O no hydrogen 2.816 N/A THR 257.A OG1 PHE 259.A O no hydrogen 2.689 N/A SER 258.A N TYR 188.A O no hydrogen 3.010 N/A SER 258.A OG ALA 186.A O no hydrogen 2.470 N/A