Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qqc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ASP 64.A OD2 no hydrogen 2.799 N/A LEU 4.A N ASP 64.A OD1 no hydrogen 3.000 N/A ALA 5.A N ASP 1.A O no hydrogen 2.732 N/A GLY 6.A N PRO 2.A O no hydrogen 2.629 N/A LEU 7.A N LEU 3.A O no hydrogen 3.266 N/A LEU 12.A N LEU 10.A O no hydrogen 3.004 N/A LEU 17.A N ASP 15.A OD1 no hydrogen 3.283 N/A TRP 18.A N ASP 15.A O no hydrogen 3.036 N/A GLU 19.A N ASP 15.A O no hydrogen 3.060 N/A PHE 20.A N VAL 92.A O no hydrogen 2.719 N/A ARG 22.A NE GLN 95.A O no hydrogen 2.872 N/A ARG 22.A NH1 GLN 95.A O no hydrogen 3.181 N/A ARG 22.A NH1 PRO 98.A O no hydrogen 2.811 N/A ARG 22.A NH2 PRO 98.A O no hydrogen 2.892 N/A ARG 24.A N PRO 21.A O no hydrogen 3.016 N/A ARG 24.A NE PHE 45.A O no hydrogen 3.261 N/A LEU 25.A N ARG 22.A O no hydrogen 3.160 N/A VAL 26.A N GLU 43.A O no hydrogen 2.827 N/A GLY 28.A N ARG 41.A O no hydrogen 2.723 N/A LEU 31.A N VAL 39.A O no hydrogen 2.771 N/A VAL 40.A N VAL 55.A O no hydrogen 2.923 N/A ARG 41.A N LYS 29.A O no hydrogen 2.842 N/A ALA 42.A N VAL 53.A O no hydrogen 2.882 N/A GLU 43.A N VAL 26.A O no hydrogen 2.942 N/A ALA 44.A N SER 51.A O no hydrogen 2.916 N/A PHE 45.A N ARG 24.A O no hydrogen 2.927 N/A GLY 46.A N GLN 49.A O no hydrogen 3.322 N/A SER 51.A N ALA 44.A O no hydrogen 2.929 N/A THR 52.A OG1 GLU 43.A OE1 no hydrogen 3.500 N/A THR 52.A OG1 GLU 43.A OE2 no hydrogen 2.966 N/A VAL 53.A N ALA 42.A O no hydrogen 2.841 N/A ALA 54.A N VAL 103.A O no hydrogen 2.829 N/A VAL 55.A N VAL 40.A O no hydrogen 2.756 N/A LYS 56.A N VAL 101.A O no hydrogen 2.869 N/A LYS 56.A NZ PHE 36.A O no hydrogen 3.361 N/A LYS 56.A NZ GLU 73.A OE2 no hydrogen 3.212 N/A MET 57.A N GLN 38.A O no hydrogen 2.951 N/A ALA 62.A N LYS 59.A O no hydrogen 2.893 N/A SER 63.A N ASP 66.A OD2 no hydrogen 2.968 N/A ASP 64.A N ASP 1.A OD1 no hydrogen 3.029 N/A ASP 66.A N SER 63.A OG no hydrogen 3.317 N/A LEU 67.A N SER 63.A O no hydrogen 3.167 N/A ALA 68.A N ASP 64.A O no hydrogen 3.004 N/A ASP 69.A N LYS 65.A O no hydrogen 2.912 N/A LEU 70.A N ASP 66.A O no hydrogen 2.933 N/A VAL 71.A N LEU 67.A O no hydrogen 2.992 N/A SER 72.A N ALA 68.A O no hydrogen 2.845 N/A GLU 73.A N ASP 69.A O no hydrogen 2.928 N/A MET 74.A N LEU 70.A O no hydrogen 3.014 N/A GLU 75.A N VAL 71.A O no hydrogen 2.859 N/A VAL 76.A N SER 72.A O no hydrogen 2.888 N/A MET 77.A N GLU 73.A O no hydrogen 2.938 N/A LYS 78.A N MET 74.A O no hydrogen 3.002 N/A LYS 78.A NZ ASP 15.A OD2 no hydrogen 3.177 N/A LYS 78.A NZ GLU 75.A OE2 no hydrogen 2.966 N/A LEU 79.A N GLU 75.A O no hydrogen 3.386 N/A HIS 83.A N ASN 88.A OD1 no hydrogen 2.905 N/A ASN 85.A N HIS 83.A ND1 no hydrogen 2.995 N/A ASN 85.A ND2 GLN 135.A OE1 no hydrogen 3.448 N/A ASN 85.A ND2 MET 166.A O no hydrogen 2.905 N/A ILE 86.A N HIS 83.A O no hydrogen 3.221 N/A ILE 87.A N ILE 168.A O no hydrogen 3.002 N/A ASN 88.A N GLU 104.A OE2 no hydrogen 2.983 N/A ASN 88.A ND2 HIS 83.A O no hydrogen 2.800 N/A ASN 88.A ND2 GLU 104.A OE1 no hydrogen 3.231 N/A ASN 88.A ND2 GLU 104.A OE2 no hydrogen 3.033 N/A LEU 90.A N ILE 102.A O no hydrogen 2.772 N/A GLY 91.A N ILE 102.A O no hydrogen 3.265 N/A VAL 92.A N TRP 18.A O no hydrogen 2.955 N/A CYS 93.A N TYR 100.A O no hydrogen 2.806 N/A CYS 93.A SG PHE 20.A O no hydrogen 3.221 N/A THR 94.A N GLU 19.A OE2 no hydrogen 2.855 N/A THR 94.A OG1 GLU 19.A OE1 no hydrogen 2.668 N/A THR 94.A OG1 GLU 19.A OE2 no hydrogen 3.485 N/A GLN 95.A N GLU 19.A OE2 no hydrogen 3.207 N/A GLN 95.A NE2 LEU 12.A O no hydrogen 2.870 N/A GLN 95.A NE2 THR 94.A OG1 no hydrogen 2.922 N/A TYR 100.A N CYS 93.A O no hydrogen 2.959 N/A VAL 101.A N LYS 56.A O no hydrogen 2.923 N/A ILE 102.A N GLY 91.A O no hydrogen 2.787 N/A VAL 103.A N ALA 54.A O no hydrogen 2.767 N/A GLU 104.A N ASN 88.A O no hydrogen 3.110 N/A LYS 108.A N VAL 160.A O no hydrogen 2.858 N/A LYS 108.A NZ ASN 164.A OD1 no hydrogen 2.606 N/A GLY 109.A N ALA 106.A O no hydrogen 3.377 N/A LEU 111.A N ALA 155.A O no hydrogen 3.235 N/A LEU 111.A N VAL 158.A O no hydrogen 2.651 N/A ARG 112.A NH2 SER 211.A OG no hydrogen 3.173 N/A GLU 113.A N ASN 110.A OD1 no hydrogen 2.964 N/A PHE 114.A N ASN 110.A O no hydrogen 3.056 N/A LEU 115.A N LEU 111.A O no hydrogen 2.960 N/A ARG 116.A N ARG 112.A O no hydrogen 2.979 N/A ARG 116.A NH2 GLY 209.A O no hydrogen 2.575 N/A ALA 117.A N GLU 113.A O no hydrogen 2.939 N/A ARG 118.A N LEU 115.A O no hydrogen 3.016 N/A ARG 118.A NH1 PHE 114.A O no hydrogen 2.820 N/A ARG 119.A N ARG 116.A O no hydrogen 3.378 N/A ARG 119.A NE LEU 208.A O no hydrogen 2.758 N/A ARG 119.A NH2 THR 207.A O no hydrogen 3.069 N/A ARG 119.A NH2 LEU 208.A O no hydrogen 3.061 N/A SER 125.A N GLY 122.A O no hydrogen 3.242 N/A LEU 129.A N SER 125.A O no hydrogen 3.147 N/A VAL 130.A N PHE 126.A O no hydrogen 2.983 N/A SER 131.A N PRO 127.A O no hydrogen 2.955 N/A CYS 132.A N VAL 128.A O no hydrogen 2.960 N/A CYS 132.A SG VAL 128.A O no hydrogen 3.369 N/A ALA 133.A N LEU 129.A O no hydrogen 3.027 N/A TYR 134.A N VAL 130.A O no hydrogen 2.758 N/A GLN 135.A N SER 131.A O no hydrogen 2.971 N/A GLN 135.A NE2 SER 131.A O no hydrogen 3.462 N/A GLN 135.A NE2 SER 131.A OG no hydrogen 3.028 N/A GLN 135.A NE2 ASN 164.A O no hydrogen 3.490 N/A VAL 136.A N CYS 132.A O no hydrogen 3.131 N/A ALA 137.A N ALA 133.A O no hydrogen 2.996 N/A ARG 138.A N TYR 134.A O no hydrogen 2.992 N/A GLY 139.A N GLN 135.A O no hydrogen 3.084 N/A MET 140.A N VAL 136.A O no hydrogen 2.925 N/A GLN 141.A N ALA 137.A O no hydrogen 2.800 N/A TYR 142.A N ARG 138.A O no hydrogen 2.993 N/A TYR 142.A OH ILE 80.A O no hydrogen 2.796 N/A LEU 143.A N GLY 139.A O no hydrogen 2.842 N/A GLU 144.A N MET 140.A O no hydrogen 2.758 N/A SER 145.A N GLN 141.A O no hydrogen 3.014 N/A SER 145.A OG TYR 142.A O no hydrogen 2.586 N/A ARG 146.A N TYR 142.A O no hydrogen 3.146 N/A ARG 146.A N LEU 143.A O no hydrogen 2.828 N/A LYS 147.A N GLU 144.A O no hydrogen 2.858 N/A CYS 148.A N LEU 143.A O no hydrogen 3.078 N/A CYS 148.A SG PHE 171.A O.B no hydrogen 3.486 N/A HIS 150.A N ASP 194.A OD2 no hydrogen 2.720 N/A HIS 150.A NE2 ALA 169.A O no hydrogen 2.887 N/A ARG 151.A N ASP 194.A OD1 no hydrogen 2.914 N/A ASP 152.A N HIS 150.A ND1 no hydrogen 3.106 N/A ALA 155.A N GLU 204.A OE2 no hydrogen 2.920 N/A ARG 156.A NH1 ASP 152.A OD2 no hydrogen 3.306 N/A ASN 157.A N ALA 154.A O no hydrogen 2.807 N/A ASN 157.A ND2 ASP 152.A O no hydrogen 2.614 N/A ASN 157.A ND2 ASP 152.A OD2 no hydrogen 3.024 N/A VAL 158.A N ALA 155.A O no hydrogen 2.998 N/A LEU 159.A N LYS 167.A O no hydrogen 2.699 N/A VAL 160.A N GLY 109.A O no hydrogen 2.775 N/A THR 161.A N VAL 165.A O no hydrogen 3.140 N/A ASP 163.A N THR 161.A OG1 no hydrogen 3.239 N/A ASN 164.A N THR 161.A O no hydrogen 2.901 N/A VAL 165.A N THR 161.A OG1 no hydrogen 3.314 N/A MET 166.A N GLN 135.A OE1 no hydrogen 2.881 N/A LYS 167.A N LEU 159.A O no hydrogen 2.772 N/A LYS 167.A NZ LYS 84.A O no hydrogen 2.737 N/A LYS 167.A NZ ILE 86.A O no hydrogen 3.449 N/A LYS 167.A NZ GLU 104.A OE1 no hydrogen 3.436 N/A LYS 167.A NZ GLU 104.A OE2 no hydrogen 2.779 N/A ILE 168.A N ASN 85.A O no hydrogen 2.945 N/A ALA 169.A N ASN 157.A O no hydrogen 2.868 N/A LYS 177.A N LEU 174.A O no hydrogen 3.323 N/A LYS 177.A NZ PRO 212.A O no hydrogen 3.170 N/A LYS 177.A NZ TYR 213.A O no hydrogen 3.027 N/A LYS 177.A NZ ILE 216.A O no hydrogen 3.126 N/A TRP 178.A N PRO 175.A O no hydrogen 3.065 N/A TRP 178.A NE1 GLU 204.A OE2 no hydrogen 2.859 N/A MET 179.A N VAL 176.A O no hydrogen 3.157 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.964 N/A ALA 183.A N ALA 180.A O no hydrogen 2.882 N/A LEU 184.A N ALA 180.A O no hydrogen 2.797 N/A PHE 185.A N PRO 181.A O no hydrogen 2.899 N/A ASP 186.A N GLU 182.A O no hydrogen 3.143 N/A VAL 188.A N GLU 182.A O no hydrogen 3.047 N/A THR 190.A N SER 193.A OG no hydrogen 2.633 N/A GLN 192.A N THR 190.A OG1 no hydrogen 3.019 N/A GLN 192.A NE2 PRO 253.A O no hydrogen 3.015 N/A GLN 192.A NE2 ARG 256.A O no hydrogen 3.249 N/A GLN 192.A NE2 PRO 257.A O no hydrogen 3.312 N/A SER 193.A N THR 190.A O no hydrogen 3.106 N/A SER 193.A N THR 190.A OG1 no hydrogen 3.308 N/A SER 193.A OG THR 190.A O no hydrogen 2.616 N/A ASP 194.A N THR 190.A O no hydrogen 3.327 N/A VAL 195.A N HIS 191.A O no hydrogen 3.089 N/A TRP 196.A N GLN 192.A O no hydrogen 3.278 N/A SER 197.A N SER 193.A O no hydrogen 3.121 N/A SER 197.A OG TRP 178.A O no hydrogen 2.655 N/A SER 197.A OG SER 193.A O no hydrogen 3.129 N/A PHE 198.A N ASP 194.A O no hydrogen 2.737 N/A GLY 199.A N VAL 195.A O no hydrogen 2.933 N/A ILE 200.A N TRP 196.A O no hydrogen 3.100 N/A LEU 201.A N SER 197.A O no hydrogen 2.856 N/A LEU 202.A N PHE 198.A O no hydrogen 2.800 N/A TRP 203.A N GLY 199.A O no hydrogen 3.077 N/A GLU 204.A N ILE 200.A O no hydrogen 2.838 N/A ILE 205.A N LEU 201.A O no hydrogen 2.761 N/A PHE 206.A N LEU 202.A O no hydrogen 3.028 N/A THR 207.A N TRP 203.A O no hydrogen 2.973 N/A THR 207.A OG1 TRP 203.A O no hydrogen 3.004 N/A THR 207.A OG1 GLU 204.A O no hydrogen 3.299 N/A LEU 208.A N ILE 205.A O no hydrogen 2.937 N/A GLY 209.A N GLU 204.A O no hydrogen 2.844 N/A GLY 210.A N THR 207.A OG1 no hydrogen 2.936 N/A ILE 216.A N TYR 213.A O no hydrogen 3.250 N/A GLU 220.A N PRO 217.A O no hydrogen 3.061 N/A LEU 221.A N VAL 218.A O no hydrogen 3.302 N/A SER 223.A OG GLU 220.A O no hydrogen 3.165 N/A LEU 224.A N GLU 220.A O no hydrogen 2.914 N/A LEU 225.A N LEU 221.A O no hydrogen 2.842 N/A ARG 226.A N PHE 222.A O no hydrogen 2.962 N/A GLU 227.A N SER 223.A O no hydrogen 2.692 N/A GLY 228.A N LEU 225.A O no hydrogen 2.830 N/A HIS 229.A N LEU 224.A O no hydrogen 2.861 N/A ARG 230.A NE TRP 249.A O no hydrogen 2.931 N/A ARG 230.A NH1 HIS 229.A O no hydrogen 2.943 N/A ARG 230.A NH2 TRP 249.A O no hydrogen 2.776 N/A ARG 233.A N ASP 232.A OD1 no hydrogen 2.544 N/A ARG 233.A NH2 CYS 237.A O no hydrogen 2.618 N/A CYS 237.A SG PRO 238.A O no hydrogen 3.652 N/A LEU 241.A N PRO 238.A O no hydrogen 2.855 N/A TYR 242.A N PRO 238.A O no hydrogen 3.208 N/A TYR 242.A OH MET 231.A O no hydrogen 2.790 N/A GLY 243.A N PRO 239.A O no hydrogen 3.015 N/A LEU 244.A N GLU 240.A O no hydrogen 3.400 N/A MET 245.A N LEU 241.A O no hydrogen 3.142 N/A ARG 246.A N TYR 242.A O no hydrogen 2.940 N/A ARG 246.A NH1 TYR 242.A OH no hydrogen 3.241 N/A GLU 247.A N GLY 243.A O no hydrogen 2.997 N/A CYS 248.A N LEU 244.A O no hydrogen 2.994 N/A CYS 248.A SG LEU 244.A O no hydrogen 3.276 N/A TRP 249.A N MET 245.A O no hydrogen 3.054 N/A TRP 249.A N ARG 246.A O no hydrogen 3.164 N/A HIS 250.A N GLU 247.A O no hydrogen 3.108 N/A ALA 252.A N HIS 250.A ND1 no hydrogen 3.337 N/A SER 254.A OG GLN 255.A OE1 no hydrogen 2.874 N/A GLN 255.A N ALA 252.A O no hydrogen 2.985 N/A ARG 256.A N PRO 253.A O no hydrogen 3.222 N/A ARG 256.A NE HIS 250.A O no hydrogen 2.690 N/A ARG 256.A NH1 GLU 182.A OE1 no hydrogen 3.424 N/A ARG 256.A NH1 GLU 182.A OE2 no hydrogen 2.841 N/A ARG 256.A NH1 GLN 192.A O no hydrogen 2.823 N/A ARG 256.A NH2 GLU 182.A OE1 no hydrogen 2.862 N/A ARG 256.A NH2 HIS 250.A O no hydrogen 3.104 N/A LYS 260.A NZ GLU 264.A OE2 no hydrogen 2.572 N/A GLN 261.A N THR 258.A OG1 no hydrogen 3.283 N/A LEU 262.A N THR 258.A O no hydrogen 3.028 N/A VAL 263.A N PHE 259.A O no hydrogen 2.971 N/A GLU 264.A N LYS 260.A O no hydrogen 3.121 N/A ALA 265.A N GLN 261.A O no hydrogen 2.859 N/A LEU 266.A N LEU 262.A O no hydrogen 2.929 N/A ASP 267.A N VAL 263.A O no hydrogen 2.820 N/A LYS 268.A N GLU 264.A O no hydrogen 3.130 N/A VAL 269.A N ALA 265.A O no hydrogen 3.324 N/A LEU 270.A N LEU 266.A O no hydrogen 3.091 N/A LEU 271.A N ASP 267.A O no hydrogen 3.106 N/A ALA 272.A N LYS 268.A O no hydrogen 3.237 N/A VAL 273.A N VAL 269.A O no hydrogen 3.234 N/A VAL 273.A N LEU 270.A O no hydrogen 3.053 N/A