Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dhz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N TYR 3.A O no hydrogen 3.230 N/A ILE 7.A N ASP 4.A O no hydrogen 2.964 N/A MET 8.A N ASP 4.A O no hydrogen 3.237 N/A GLN 11.A N ILE 7.A O no hydrogen 2.928 N/A ARG 13.A N ALA 9.A O no hydrogen 2.990 N/A ILE 14.A N GLN 10.A O no hydrogen 2.860 N/A GLN 16.A N ASP 12.A O no hydrogen 2.910 N/A GLU 17.A N ARG 13.A O no hydrogen 3.369 N/A ILE 18.A N ILE 14.A O no hydrogen 3.062 N/A VAL 20.A N GLN 16.A O no hydrogen 3.022 N/A VAL 25.A N ASN 142.A OD1 no hydrogen 2.823 N/A ALA 26.A N TYR 62.A O no hydrogen 3.109 N/A THR 27.A OG1 LEU 28.A O no hydrogen 3.192 N/A ALA 29.A N ILE 60.A O no hydrogen 3.145 N/A PHE 31.A N GLY 58.A O no hydrogen 3.023 N/A ILE 33.A N PRO 30.A O no hydrogen 2.952 N/A LEU 34.A N PHE 31.A O no hydrogen 3.006 N/A ALA 36.A N SER 32.A O no hydrogen 3.204 N/A GLU 37.A N LEU 34.A O no hydrogen 3.081 N/A TYR 38.A N CYS 35.A O no hydrogen 2.660 N/A ASP 39.A N SER 43.A OG no hydrogen 3.232 N/A GLU 41.A N ASP 39.A OD1 no hydrogen 3.362 N/A THR 42.A N ASP 39.A OD1 no hydrogen 2.762 N/A THR 42.A OG1 ASP 39.A OD1 no hydrogen 2.594 N/A THR 42.A OG1 ASP 39.A OD2 no hydrogen 2.775 N/A SER 43.A N ASP 39.A O no hydrogen 3.067 N/A LEU 47.A N SER 43.A O no hydrogen 3.327 N/A SER 48.A N ALA 44.A O no hydrogen 3.056 N/A SER 48.A N ALA 45.A O no hydrogen 3.263 N/A SER 48.A OG ALA 44.A O no hydrogen 3.272 N/A LYS 49.A N ALA 45.A O no hydrogen 3.377 N/A LYS 49.A NZ ASP 216.A O no hydrogen 2.634 N/A LYS 49.A NZ THR 218.A O no hydrogen 2.849 N/A ALA 50.A N PHE 46.A O no hydrogen 2.814 N/A THR 51.A N LEU 47.A O no hydrogen 3.031 N/A THR 51.A OG1 LEU 47.A O no hydrogen 2.522 N/A GLU 52.A N SER 48.A O no hydrogen 2.793 N/A LEU 53.A N LYS 49.A O no hydrogen 2.919 N/A SER 54.A N ALA 50.A O no hydrogen 3.281 N/A SER 54.A OG THR 51.A O no hydrogen 2.510 N/A GLU 55.A N GLU 52.A O no hydrogen 3.197 N/A VAL 56.A N LEU 53.A O no hydrogen 2.870 N/A TYR 57.A N LEU 53.A O no hydrogen 2.771 N/A TYR 57.A OH GLU 213.A OE2 no hydrogen 3.030 N/A GLY 58.A N TYR 253.A O no hydrogen 2.805 N/A ILE 60.A N ALA 29.A O no hydrogen 2.686 N/A ARG 61.A N VAL 251.A O no hydrogen 2.716 N/A ARG 61.A NE TYR 253.A OH no hydrogen 3.015 N/A ARG 61.A NH1 ALA 26.A O no hydrogen 3.183 N/A TYR 62.A OH GLU 37.A OE2 no hydrogen 3.263 N/A ILE 63.A N ASP 250.A OD1 no hydrogen 2.632 N/A ARG 64.A N LEU 24.A O no hydrogen 3.124 N/A ARG 64.A NE ASN 22.A O no hydrogen 2.982 N/A ARG 64.A NH1 ASP 144.A OD1 no hydrogen 3.514 N/A ARG 64.A NH2 ASN 22.A O no hydrogen 2.811 N/A ASN 68.A N ASP 66.A OD1 no hydrogen 3.101 N/A ASN 68.A ND2 ASP 66.A OD2 no hydrogen 3.086 N/A CYS 69.A SG HIS 248.A ND1 no hydrogen 3.920 N/A ARG 72.A N ASN 68.A O no hydrogen 2.960 N/A ARG 72.A NH1 ASN 148.A OD1 no hydrogen 3.428 N/A ARG 72.A NH2 ASP 66.A OD2 no hydrogen 3.317 N/A ARG 72.A NH2 ASN 148.A OD1 no hydrogen 2.777 N/A ALA 73.A N CYS 69.A O no hydrogen 2.681 N/A ILE 74.A N PHE 70.A O no hydrogen 2.984 N/A LEU 75.A N TYR 71.A O no hydrogen 3.023 N/A VAL 76.A N ARG 72.A O no hydrogen 3.095 N/A GLY 77.A N ALA 73.A O no hydrogen 3.102 N/A LEU 78.A N ILE 74.A O no hydrogen 2.843 N/A ILE 79.A N LEU 75.A O no hydrogen 2.870 N/A GLU 80.A N VAL 76.A O no hydrogen 2.965 N/A ILE 81.A N GLY 77.A O no hydrogen 3.261 N/A MET 82.A N LEU 78.A O no hydrogen 2.982 N/A LEU 83.A N GLU 80.A O no hydrogen 3.320 N/A LYS 84.A N ILE 81.A O no hydrogen 2.961 N/A ASP 85.A N ILE 81.A O no hydrogen 2.942 N/A ARG 86.A NH1 HIS 128.A O no hydrogen 2.893 N/A ARG 86.A NH2 HIS 128.A O no hydrogen 3.009 N/A ARG 88.A N ASP 85.A OD1 no hydrogen 3.304 N/A ARG 88.A NH1 GLU 239.A OE1 no hydrogen 2.638 N/A ARG 88.A NH1 GLU 239.A OE2 no hydrogen 3.081 N/A ARG 88.A NH2 GLU 239.A OE2 no hydrogen 3.009 N/A LEU 89.A N ASP 85.A O no hydrogen 3.302 N/A GLU 90.A N ARG 86.A O no hydrogen 2.976 N/A LYS 91.A N ALA 87.A O no hydrogen 2.704 N/A PHE 92.A N ARG 88.A O no hydrogen 2.864 N/A ILE 93.A N LEU 89.A O no hydrogen 3.043 N/A ALA 94.A N GLU 90.A O no hydrogen 3.321 N/A SER 95.A N LYS 91.A O no hydrogen 3.182 N/A SER 95.A OG PHE 92.A O no hydrogen 3.336 N/A SER 96.A N PHE 92.A O no hydrogen 3.008 N/A SER 96.A N ILE 93.A O no hydrogen 3.303 N/A SER 96.A OG PHE 92.A O no hydrogen 2.811 N/A ARG 97.A N ILE 93.A O no hydrogen 3.289 N/A ARG 97.A NH1 GLU 125.A OE2 no hydrogen 2.877 N/A ARG 97.A NH2 GLU 125.A OE2 no hydrogen 2.785 N/A TRP 99.A N SER 95.A O no hydrogen 3.330 N/A THR 100.A N SER 96.A O no hydrogen 3.217 N/A THR 100.A OG1 SER 96.A O no hydrogen 3.273 N/A THR 100.A OG1 ARG 97.A O no hydrogen 3.504 N/A ARG 101.A N ARG 97.A O no hydrogen 3.515 N/A ARG 101.A NH1 ASP 98.A OD1 no hydrogen 3.472 N/A ARG 101.A NH2 ASP 98.A OD1 no hydrogen 3.092 N/A THR 102.A N ASP 98.A O no hydrogen 2.802 N/A THR 102.A OG1 ASP 98.A O no hydrogen 2.870 N/A LEU 103.A N TRP 99.A O no hydrogen 2.799 N/A LEU 103.A N THR 100.A O no hydrogen 3.048 N/A VAL 104.A N THR 100.A O no hydrogen 3.352 N/A GLU 105.A N ARG 101.A O no hydrogen 3.153 N/A LEU 106.A N LEU 103.A O no hydrogen 3.015 N/A GLY 107.A N VAL 104.A O no hydrogen 3.052 N/A PHE 108.A N LEU 103.A O no hydrogen 3.236 N/A THR 112.A OG1 PRO 109.A O no hydrogen 3.168 N/A CYS 113.A N PRO 109.A O no hydrogen 3.355 N/A CYS 113.A SG PRO 109.A O no hydrogen 3.223 N/A THR 114.A N ASP 110.A O no hydrogen 2.986 N/A THR 114.A OG1 ASP 110.A O no hydrogen 2.981 N/A THR 114.A OG1 ASP 110.A OD2 no hydrogen 3.155 N/A ASP 115.A N TRP 111.A O no hydrogen 2.880 N/A PHE 116.A N THR 112.A O no hydrogen 3.073 N/A CYS 117.A N CYS 113.A O no hydrogen 3.159 N/A CYS 117.A SG CYS 113.A O no hydrogen 3.509 N/A ASP 118.A N THR 114.A O no hydrogen 2.792 N/A PHE 119.A N ASP 115.A O no hydrogen 2.891 N/A PHE 120.A N PHE 116.A O no hydrogen 3.065 N/A ILE 121.A N CYS 117.A O no hydrogen 2.868 N/A GLU 122.A N ASP 118.A O no hydrogen 3.087 N/A PHE 123.A N PHE 119.A O no hydrogen 3.278 N/A LEU 124.A N PHE 120.A O no hydrogen 2.876 N/A GLU 125.A N ILE 121.A O no hydrogen 2.757 N/A LYS 126.A N GLU 122.A O no hydrogen 3.012 N/A ILE 127.A N PHE 123.A O no hydrogen 3.050 N/A ILE 127.A N LEU 124.A O no hydrogen 3.134 N/A HIS 128.A N LEU 124.A O no hydrogen 3.011 N/A HIS 128.A NE2 GLU 90.A OE2 no hydrogen 3.040 N/A SER 129.A N GLU 125.A O no hydrogen 2.897 N/A SER 129.A OG LYS 126.A O no hydrogen 3.374 N/A GLY 130.A N LYS 126.A O no hydrogen 3.183 N/A VAL 131.A N SER 129.A OG no hydrogen 3.395 N/A HIS 132.A N LYS 126.A O no hydrogen 3.135 N/A VAL 137.A N THR 133.A O no hydrogen 3.133 N/A TYR 138.A OH GLU 80.A OE2 no hydrogen 3.188 N/A THR 139.A N ALA 136.A O no hydrogen 2.955 N/A THR 139.A OG1 GLU 135.A O no hydrogen 2.897 N/A ILE 140.A N ALA 136.A O no hydrogen 2.951 N/A LEU 141.A N VAL 137.A O no hydrogen 2.807 N/A ASN 142.A N THR 139.A O no hydrogen 3.367 N/A ASN 142.A ND2 VAL 25.A O no hydrogen 3.136 N/A ASN 142.A ND2 TYR 138.A O no hydrogen 2.648 N/A ASP 143.A N THR 139.A O no hydrogen 3.212 N/A SER 146.A N ASP 143.A OD1 no hydrogen 3.055 N/A ALA 147.A N ASP 143.A O no hydrogen 2.789 N/A ASN 148.A N ASP 144.A O no hydrogen 3.224 N/A TYR 149.A N SER 146.A O no hydrogen 2.997 N/A TYR 149.A OH ASP 115.A OD1 no hydrogen 3.335 N/A ILE 150.A N SER 146.A O no hydrogen 3.115 N/A LEU 151.A N ALA 147.A O no hydrogen 2.927 N/A MET 152.A N ASN 148.A O no hydrogen 3.128 N/A PHE 153.A N ILE 150.A O no hydrogen 3.147 N/A ARG 155.A N LEU 151.A O no hydrogen 3.087 N/A ARG 155.A NH1 ILE 187.A O no hydrogen 3.064 N/A ARG 155.A NH1 LYS 192.A O no hydrogen 3.315 N/A ARG 155.A NH2 GLY 67.A O no hydrogen 3.312 N/A ARG 155.A NH2 ASN 68.A OD1 no hydrogen 2.769 N/A ARG 155.A NH2 LYS 192.A O no hydrogen 2.932 N/A LEU 156.A N MET 152.A O no hydrogen 2.801 N/A ILE 157.A N PHE 153.A O no hydrogen 2.895 N/A THR 158.A N PHE 154.A O no hydrogen 3.107 N/A THR 158.A OG1 PHE 154.A O no hydrogen 2.632 N/A SER 159.A N ARG 155.A O no hydrogen 3.125 N/A SER 159.A OG GLU 188.A OE2 no hydrogen 2.926 N/A ALA 160.A N LEU 156.A O no hydrogen 2.731 N/A PHE 161.A N ILE 157.A O no hydrogen 2.698 N/A LEU 162.A N THR 158.A O no hydrogen 3.397 N/A LYS 163.A N SER 159.A O no hydrogen 3.089 N/A LYS 163.A NZ GLU 188.A OE2 no hydrogen 2.860 N/A GLN 164.A N ALA 160.A O no hydrogen 2.857 N/A ASN 165.A N LEU 162.A O no hydrogen 3.020 N/A ASN 165.A ND2 PHE 161.A O no hydrogen 3.231 N/A SER 166.A N LYS 163.A O no hydrogen 3.250 N/A SER 166.A OG LYS 163.A O no hydrogen 3.556 N/A GLU 168.A N ASN 165.A O no hydrogen 3.207 N/A TYR 169.A N ASN 165.A O no hydrogen 3.203 N/A TYR 169.A N SER 166.A O no hydrogen 3.023 N/A ALA 170.A N SER 166.A O no hydrogen 2.880 N/A PHE 172.A N TYR 169.A O no hydrogen 2.816 N/A ILE 173.A N ALA 170.A O no hydrogen 3.133 N/A MET 177.A N ASP 174.A O no hydrogen 3.296 N/A THR 178.A N GLN 181.A OE1 no hydrogen 3.060 N/A GLN 181.A N THR 178.A OG1 no hydrogen 3.086 N/A TYR 182.A N THR 178.A O no hydrogen 2.836 N/A CYS 183.A N VAL 179.A O no hydrogen 2.982 N/A CYS 183.A SG SER 159.A O no hydrogen 3.847 N/A CYS 183.A SG SER 159.A OG no hydrogen 3.199 N/A CYS 183.A SG VAL 179.A O no hydrogen 3.436 N/A GLU 184.A N ALA 180.A O no hydrogen 3.105 N/A GLN 185.A N GLN 181.A O no hydrogen 3.165 N/A GLU 186.A N TYR 182.A O no hydrogen 2.696 N/A ILE 187.A N CYS 183.A O no hydrogen 2.828 N/A GLU 188.A N CYS 183.A O no hydrogen 2.831 N/A TRP 191.A N ASN 68.A OD1 no hydrogen 2.779 N/A LYS 192.A NZ GLN 185.A O no hydrogen 3.053 N/A HIS 196.A N ASP 195.A OD1 no hydrogen 3.004 N/A ILE 199.A N ASP 195.A O no hydrogen 2.794 N/A ASN 200.A N HIS 196.A O no hydrogen 2.793 N/A SER 201.A N LEU 197.A O no hydrogen 3.264 N/A SER 201.A OG LEU 197.A O no hydrogen 2.670 N/A LEU 202.A N ALA 198.A O no hydrogen 2.940 N/A ILE 203.A N ILE 199.A O no hydrogen 3.256 N/A LYS 204.A N ASN 200.A O no hydrogen 3.004 N/A ALA 205.A N SER 201.A O no hydrogen 2.692 N/A ALA 206.A N LEU 202.A O no hydrogen 2.711 N/A GLY 207.A N LYS 204.A O no hydrogen 2.997 N/A THR 208.A N ILE 203.A O no hydrogen 3.210 N/A THR 208.A OG1 GLU 239.A OE2 no hydrogen 3.176 N/A ARG 209.A N THR 208.A OG1 no hydrogen 2.453 N/A ARG 209.A NH1 ILE 236.A O no hydrogen 3.097 N/A VAL 210.A N ILE 229.A O no hydrogen 2.890 N/A ARG 211.A N ILE 240.A O no hydrogen 2.978 N/A ARG 211.A NE ASP 228.A OD1 no hydrogen 3.113 N/A ARG 211.A NH2 ASP 228.A OD1 no hydrogen 3.208 N/A ARG 211.A NH2 ASP 228.A OD2 no hydrogen 2.865 N/A ILE 212.A N TYR 227.A O no hydrogen 2.762 N/A GLU 213.A N LEU 242.A O no hydrogen 2.803 N/A TYR 214.A N TRP 225.A O no hydrogen 2.989 N/A MET 215.A N GLU 213.A O no hydrogen 3.201 N/A MET 215.A N TYR 244.A O no hydrogen 2.831 N/A THR 218.A N ASP 216.A OD1 no hydrogen 2.917 N/A THR 218.A OG1 ASP 216.A OD1 no hydrogen 2.578 N/A THR 218.A OG1 ASP 216.A OD2 no hydrogen 3.116 N/A THR 218.A OG1 ALA 219.A O no hydrogen 3.544 N/A GLY 224.A N PRO 221.A O no hydrogen 2.849 N/A TRP 225.A NE1 THR 218.A OG1 no hydrogen 2.871 N/A TYR 227.A N ILE 212.A O no hydrogen 2.839 N/A ILE 229.A N VAL 210.A O no hydrogen 2.819 N/A GLU 239.A N ARG 209.A O no hydrogen 2.900 N/A LEU 242.A N ARG 211.A O no hydrogen 2.938 N/A LEU 243.A N ASP 250.A O no hydrogen 2.800 N/A TYR 244.A N GLU 213.A O no hydrogen 2.644 N/A ARG 245.A N HIS 248.A O no hydrogen 3.214 N/A ARG 245.A NH1 GLU 37.A OE2 no hydrogen 3.157 N/A ARG 245.A NH1 TYR 38.A OH no hydrogen 3.249 N/A GLY 247.A N TYR 244.A OH no hydrogen 3.150 N/A HIS 248.A N ARG 245.A O no hydrogen 2.762 N/A HIS 248.A NE2 ASP 250.A OD1 no hydrogen 2.998 N/A ASP 250.A N LEU 243.A O no hydrogen 3.205 N/A VAL 251.A N ARG 61.A O no hydrogen 3.064 N/A ILE 252.A N THR 241.A O no hydrogen 2.993 N/A TYR 253.A N GLU 59.A O no hydrogen 3.025 N/A TYR 253.A OH GLU 80.A OE1 no hydrogen 2.605 N/A TYR 253.A OH GLU 80.A OE2 no hydrogen 2.351 N/A LYS 255.A N VAL 56.A O no hydrogen 2.881 N/A LYS 255.A NZ SER 54.A O no hydrogen 2.919 N/A