Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6f3e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N LEU 76.A O no hydrogen 3.199 N/A PHE 5.A N PHE 78.A O no hydrogen 3.289 N/A GLU 9.A N SER 6.A OG no hydrogen 3.374 N/A LYS 11.A N TYR 8.A O no hydrogen 3.136 N/A VAL 13.A N ASN 12.A OD1 no hydrogen 3.030 N/A THR 14.A OG1 LEU 10.A O no hydrogen 3.441 N/A THR 14.A OG1 LYS 11.A O no hydrogen 2.713 N/A ASN 15.A N ASN 12.A O no hydrogen 2.944 N/A ASN 15.A ND2 ASN 27.A OD1 no hydrogen 3.587 N/A PHE 17.A N THR 14.A OG1 no hydrogen 3.172 N/A ASP 18.A N THR 14.A O no hydrogen 3.045 N/A ARG 20.A NH1 ASP 18.A OD2 no hydrogen 2.871 N/A VAL 24.A N PRO 21.A O no hydrogen 3.342 N/A GLY 25.A N PRO 21.A O no hydrogen 3.084 N/A GLY 25.A N ILE 22.A O no hydrogen 3.098 N/A LYS 28.A N ARG 20.A O no hydrogen 2.967 N/A LYS 28.A NZ GLU 31.A OE1 no hydrogen 3.425 N/A MET 29.A N VAL 37.A O no hydrogen 3.305 N/A GLY 32.A N GLY 35.A O no hydrogen 2.793 N/A PHE 34.A N GLY 32.A O no hydrogen 2.839 N/A VAL 36.A N LYS 51.A O no hydrogen 2.803 N/A VAL 37.A N GLY 30.A O no hydrogen 2.991 N/A TYR 38.A N VAL 49.A O no hydrogen 2.818 N/A TYR 38.A OH GLU 19.A OE1 no hydrogen 2.723 N/A LYS 39.A N ASN 27.A O no hydrogen 3.071 N/A LYS 39.A NZ TYR 41.A OH no hydrogen 3.028 N/A GLY 40.A N VAL 47.A O no hydrogen 2.858 N/A VAL 42.A N THR 45.A O no hydrogen 2.988 N/A THR 45.A OG1 VAL 42.A O no hydrogen 3.289 N/A THR 45.A OG1 ASN 43.A O no hydrogen 2.733 N/A VAL 47.A N GLY 40.A O no hydrogen 2.789 N/A ALA 48.A N TYR 84.A O no hydrogen 2.971 N/A VAL 49.A N TYR 38.A O no hydrogen 2.863 N/A LYS 50.A N LEU 82.A O no hydrogen 2.771 N/A LYS 50.A NZ GLY 32.A O no hydrogen 2.799 N/A LYS 50.A NZ ASP 151.A OD1 no hydrogen 3.220 N/A LYS 51.A N VAL 36.A O no hydrogen 2.934 N/A LEU 52.A N LEU 80.A O no hydrogen 2.958 N/A LYS 54.A NZ ASP 58.A OD1 no hydrogen 3.197 N/A PHE 57.A N LEU 53.A O no hydrogen 3.055 N/A ASP 58.A N LYS 54.A O no hydrogen 3.055 N/A GLN 59.A N GLN 55.A O no hydrogen 2.872 N/A GLU 60.A N GLN 56.A O no hydrogen 3.287 N/A LYS 62.A N ASP 58.A O no hydrogen 3.180 N/A LYS 62.A NZ GLN 55.A OE1 no hydrogen 3.544 N/A VAL 63.A N GLN 59.A O no hydrogen 3.039 N/A MET 64.A N GLU 60.A O no hydrogen 2.806 N/A ALA 65.A N ILE 61.A O no hydrogen 2.974 N/A LYS 66.A N LYS 62.A O no hydrogen 3.359 N/A LYS 66.A N VAL 63.A O no hydrogen 3.206 N/A LYS 66.A NZ LYS 62.A O no hydrogen 3.093 N/A CYS 67.A N VAL 63.A O no hydrogen 2.849 N/A CYS 67.A SG HIS 129.A ND1 no hydrogen 3.818 N/A ASN 71.A N HIS 69.A ND1 no hydrogen 2.901 N/A ASN 71.A ND2 ALA 147.A O no hydrogen 2.851 N/A LEU 72.A N HIS 69.A O no hydrogen 3.133 N/A VAL 73.A N ILE 149.A O no hydrogen 2.934 N/A LEU 76.A N VAL 83.A O no hydrogen 2.750 N/A GLY 77.A N VAL 83.A O no hydrogen 3.256 N/A SER 79.A N CYS 81.A O no hydrogen 3.003 N/A CYS 81.A N SER 79.A O no hydrogen 3.499 N/A LEU 82.A N LYS 50.A O no hydrogen 3.163 N/A VAL 83.A N GLY 77.A O no hydrogen 2.815 N/A TYR 84.A N ALA 48.A O no hydrogen 2.939 N/A TYR 84.A OH GLU 60.A OE2 no hydrogen 2.736 N/A VAL 85.A N GLU 74.A O no hydrogen 3.021 N/A TYR 86.A N THR 46.A O no hydrogen 3.454 N/A ASN 89.A N LEU 141.A O no hydrogen 2.956 N/A ASN 89.A ND2 ASP 142.A O no hydrogen 2.803 N/A GLY 90.A N MET 87.A O no hydrogen 3.287 N/A LEU 92.A N ILE 139.A O no hydrogen 2.763 N/A LEU 93.A N SER 136.A O no hydrogen 3.242 N/A ARG 95.A N SER 91.A O no hydrogen 3.166 N/A ARG 95.A NE THR 102.A OG1 no hydrogen 2.856 N/A ARG 95.A NH1 LEU 99.A O no hydrogen 2.859 N/A ARG 95.A NH1 THR 102.A OG1 no hydrogen 3.283 N/A ARG 95.A NH2 ASN 89.A O no hydrogen 2.923 N/A LEU 96.A N LEU 92.A O no hydrogen 2.818 N/A SER 97.A N LEU 93.A O no hydrogen 3.231 N/A SER 97.A OG LEU 93.A O no hydrogen 2.854 N/A SER 97.A OG ASP 94.A O no hydrogen 3.264 N/A CYS 98.A N ARG 95.A O no hydrogen 3.247 N/A CYS 98.A SG ARG 95.A O no hydrogen 3.965 N/A LEU 99.A N ASP 94.A O no hydrogen 2.944 N/A GLY 101.A N CYS 98.A O no hydrogen 3.278 N/A THR 102.A OG1 LEU 99.A O no hydrogen 3.453 N/A TRP 107.A N ASP 232.A OD1 no hydrogen 2.819 N/A TRP 107.A NE1 SER 237.A OG no hydrogen 2.740 N/A HIS 108.A N ASP 232.A OD2 no hydrogen 3.063 N/A MET 109.A N SER 106.A OG no hydrogen 3.029 N/A ARG 110.A N SER 106.A O no hydrogen 2.927 N/A ARG 110.A NE LEU 105.A O no hydrogen 2.821 N/A ARG 110.A NH1 ILE 192.A O no hydrogen 2.844 N/A ARG 110.A NH1 ASP 227.A OD2 no hydrogen 2.812 N/A ARG 110.A NH2 LEU 105.A O no hydrogen 2.846 N/A ARG 110.A NH2 ASP 227.A OD2 no hydrogen 2.845 N/A CYS 111.A N TRP 107.A O no hydrogen 2.990 N/A CYS 111.A SG TRP 107.A O no hydrogen 3.539 N/A LYS 112.A N HIS 108.A O no hydrogen 3.367 N/A LYS 112.A NZ ALA 144.A O no hydrogen 2.878 N/A LYS 112.A NZ THR 146.A OG1 no hydrogen 3.348 N/A ILE 113.A N MET 109.A O no hydrogen 3.006 N/A ALA 114.A N ARG 110.A O no hydrogen 2.938 N/A GLN 115.A N CYS 111.A O no hydrogen 3.019 N/A GLY 116.A N LYS 112.A O no hydrogen 2.949 N/A ALA 117.A N ILE 113.A O no hydrogen 2.922 N/A ALA 118.A N ALA 114.A O no hydrogen 3.181 N/A ASN 119.A N GLN 115.A O no hydrogen 2.986 N/A GLY 120.A N GLY 116.A O no hydrogen 2.975 N/A ILE 121.A N ALA 117.A O no hydrogen 2.934 N/A ASN 122.A N ALA 118.A O no hydrogen 2.818 N/A PHE 123.A N ASN 119.A O no hydrogen 2.972 N/A LEU 124.A N GLY 120.A O no hydrogen 3.215 N/A HIS 125.A N ILE 121.A O no hydrogen 2.939 N/A HIS 125.A NE2 ASP 181.A OD2 no hydrogen 2.978 N/A GLU 126.A N ASN 122.A O no hydrogen 2.861 N/A ASN 127.A N PHE 123.A O no hydrogen 3.165 N/A ASN 127.A N LEU 124.A O no hydrogen 3.182 N/A ASN 127.A ND2 PHE 123.A O no hydrogen 2.779 N/A HIS 128.A N HIS 125.A O no hydrogen 2.961 N/A HIS 129.A N LEU 124.A O no hydrogen 2.906 N/A HIS 131.A N ASP 181.A OD2 no hydrogen 2.735 N/A HIS 131.A NE2 SER 150.A O no hydrogen 2.767 N/A ARG 132.A N ASP 181.A OD1 no hydrogen 3.035 N/A ARG 132.A NE LEU 154.A O no hydrogen 2.849 N/A ASP 133.A N HIS 131.A ND1 no hydrogen 2.987 N/A LYS 135.A NZ THR 163.A OG1 no hydrogen 3.008 N/A SER 136.A OG TYR 166.A OH no hydrogen 3.268 N/A SER 136.A OG GLU 191.A OE1 no hydrogen 2.812 N/A SER 136.A OG GLU 191.A OE2 no hydrogen 3.105 N/A ASN 138.A N LYS 135.A O no hydrogen 2.905 N/A ASN 138.A ND2 ASP 133.A O no hydrogen 2.699 N/A ILE 139.A N SER 136.A O no hydrogen 3.375 N/A LEU 140.A N LYS 148.A O no hydrogen 2.891 N/A LEU 141.A N GLY 90.A O no hydrogen 2.809 N/A ASP 142.A N THR 146.A O no hydrogen 3.227 N/A ALA 144.A N ASP 142.A OD1 no hydrogen 2.812 N/A PHE 145.A N ASP 142.A O no hydrogen 2.994 N/A THR 146.A N ASP 142.A OD1 no hydrogen 2.792 N/A LYS 148.A N LEU 140.A O no hydrogen 2.910 N/A LYS 148.A NZ GLU 70.A O no hydrogen 2.969 N/A ILE 149.A N ASN 71.A O no hydrogen 2.780 N/A SER 150.A N ASN 138.A O no hydrogen 2.974 N/A SER 150.A OG ASN 138.A O no hydrogen 2.811 N/A PHE 152.A N GLU 60.A OE1 no hydrogen 2.806 N/A ALA 155.A N PHE 152.A O no hydrogen 3.461 N/A THR 163.A N ASP 133.A OD1 no hydrogen 3.307 N/A THR 163.A OG1 ASP 133.A OD1 no hydrogen 3.340 N/A TYR 166.A N THR 163.A O no hydrogen 3.047 N/A TYR 166.A OH SER 136.A OG no hydrogen 3.268 N/A TYR 166.A OH GLU 191.A OE1 no hydrogen 2.989 N/A TYR 166.A OH GLU 191.A OE2 no hydrogen 2.685 N/A MET 167.A N THR 164.A O no hydrogen 3.240 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.808 N/A ALA 171.A N ALA 168.A O no hydrogen 3.015 N/A LEU 172.A N ALA 168.A O no hydrogen 3.208 N/A ARG 173.A N PRO 169.A O no hydrogen 3.273 N/A ARG 173.A N GLU 170.A O no hydrogen 3.041 N/A GLY 174.A N ALA 171.A O no hydrogen 3.059 N/A GLU 175.A N GLU 170.A O no hydrogen 2.812 N/A ILE 176.A N VAL 156.A O no hydrogen 2.783 N/A LYS 179.A N THR 177.A OG1 no hydrogen 3.189 N/A LYS 179.A NZ ASN 254.A OD1 no hydrogen 3.240 N/A SER 180.A N THR 177.A O no hydrogen 3.002 N/A SER 180.A OG GLU 170.A OE2 no hydrogen 2.999 N/A SER 180.A OG THR 177.A O no hydrogen 3.284 N/A ASP 181.A N PRO 178.A O no hydrogen 3.160 N/A TYR 183.A N LYS 179.A O no hydrogen 3.299 N/A SER 184.A N SER 180.A O no hydrogen 3.045 N/A SER 184.A OG TYR 166.A O no hydrogen 2.822 N/A SER 184.A OG SER 180.A O no hydrogen 3.220 N/A PHE 185.A N ASP 181.A O no hydrogen 2.975 N/A GLY 186.A N ILE 182.A O no hydrogen 2.932 N/A VAL 187.A N TYR 183.A O no hydrogen 3.300 N/A VAL 187.A N SER 184.A O no hydrogen 3.276 N/A VAL 188.A N SER 184.A O no hydrogen 3.256 N/A LEU 189.A N PHE 185.A O no hydrogen 2.950 N/A LEU 190.A N GLY 186.A O no hydrogen 3.104 N/A GLU 191.A N VAL 187.A O no hydrogen 2.991 N/A ILE 192.A N VAL 188.A O no hydrogen 2.916 N/A ILE 193.A N LEU 189.A O no hydrogen 3.012 N/A THR 194.A N LEU 190.A O no hydrogen 3.004 N/A THR 194.A OG1 LEU 190.A O no hydrogen 2.680 N/A GLY 195.A N GLU 191.A O no hydrogen 2.755 N/A LEU 196.A N THR 194.A OG1 no hydrogen 3.212 N/A ALA 198.A N GLU 191.A OE2 no hydrogen 3.223 N/A ASP 200.A N GLN 206.A O no hydrogen 2.988 N/A GLU 201.A N GLU 201.A OE2 no hydrogen 2.813 N/A HIS 202.A N ASP 200.A OD1 no hydrogen 3.021 N/A ARG 203.A NE PRO 205.A O no hydrogen 2.930 N/A ARG 203.A NH1 PRO 197.A O no hydrogen 2.895 N/A ARG 203.A NH2 PRO 197.A O no hydrogen 2.813 N/A ARG 203.A NH2 GLN 206.A O no hydrogen 3.077 N/A LEU 208.A N ALA 198.A O no hydrogen 2.807 N/A ASP 210.A N LEU 207.A O no hydrogen 3.037 N/A ILE 211.A N LEU 208.A O no hydrogen 2.890 N/A LYS 212.A NZ GLU 216.A OE2 no hydrogen 2.927 N/A GLU 213.A N ASP 210.A O no hydrogen 3.202 N/A GLU 214.A N ASP 210.A O no hydrogen 3.354 N/A ILE 215.A N ILE 211.A O no hydrogen 2.940 N/A GLU 216.A N LYS 212.A O no hydrogen 2.948 N/A ASP 217.A N GLU 213.A O no hydrogen 2.954 N/A GLU 218.A N ILE 215.A O no hydrogen 3.076 N/A LYS 220.A N GLU 214.A O no hydrogen 3.220 N/A LYS 220.A NZ GLU 214.A OE1 no hydrogen 2.882 N/A THR 221.A N ASP 224.A OD2 no hydrogen 2.927 N/A ASP 224.A N THR 221.A O no hydrogen 3.240 N/A TYR 225.A N ILE 222.A O no hydrogen 2.997 N/A ILE 226.A N ILE 222.A O no hydrogen 3.158 N/A ASP 227.A N ILE 193.A O no hydrogen 2.809 N/A LYS 229.A N ASP 227.A OD1 no hydrogen 3.123 N/A LYS 229.A NZ ASP 227.A OD1 no hydrogen 3.067 N/A SER 235.A OG GLU 223.A OE1 no hydrogen 3.425 N/A SER 237.A N ASP 234.A OD2 no hydrogen 2.862 N/A SER 237.A OG ASP 234.A O no hydrogen 3.383 N/A SER 237.A OG ASP 234.A OD1 no hydrogen 2.701 N/A SER 237.A OG ASP 234.A OD2 no hydrogen 2.957 N/A VAL 238.A N ASP 234.A O no hydrogen 2.969 N/A GLU 239.A N SER 235.A O no hydrogen 2.792 N/A ALA 240.A N THR 236.A O no hydrogen 2.916 N/A MET 241.A N SER 237.A O no hydrogen 2.943 N/A TYR 242.A N VAL 238.A O no hydrogen 2.882 N/A SER 243.A N GLU 239.A O no hydrogen 2.876 N/A VAL 244.A N ALA 240.A O no hydrogen 3.221 N/A ALA 245.A N MET 241.A O no hydrogen 3.066 N/A SER 246.A N TYR 242.A O no hydrogen 2.876 N/A GLN 247.A N SER 243.A O no hydrogen 3.036 N/A CYS 248.A N VAL 244.A O no hydrogen 2.913 N/A CYS 248.A SG VAL 244.A O no hydrogen 3.288 N/A LEU 249.A N ALA 245.A O no hydrogen 2.865 N/A LYS 255.A N LYS 252.A O no hydrogen 2.892 N/A ARG 256.A N LYS 253.A O no hydrogen 3.366 N/A ARG 256.A NE HIS 250.A O no hydrogen 2.761 N/A ARG 256.A NH1 GLU 170.A OE1 no hydrogen 3.491 N/A ARG 256.A NH1 GLU 170.A OE2 no hydrogen 2.819 N/A ARG 256.A NH1 LYS 179.A O no hydrogen 3.167 N/A ARG 256.A NH2 GLU 170.A OE1 no hydrogen 3.084 N/A ARG 256.A NH2 HIS 250.A O no hydrogen 3.127 N/A LYS 260.A NZ GLU 126.A OE2 no hydrogen 3.434 N/A LYS 260.A NZ GLN 263.A OE1 no hydrogen 3.246 N/A LYS 261.A N ASP 258.A OD1 no hydrogen 3.084 N/A LYS 261.A NZ GLN 264.A OE1 no hydrogen 3.554 N/A VAL 262.A N ASP 258.A O no hydrogen 3.015 N/A GLN 263.A N ILE 259.A O no hydrogen 2.830 N/A GLN 263.A NE2 ASN 119.A OD1 no hydrogen 2.787 N/A GLN 264.A N LYS 260.A O no hydrogen 3.162 N/A LEU 265.A N LYS 261.A O no hydrogen 3.061 N/A LEU 266.A N VAL 262.A O no hydrogen 3.090 N/A GLN 267.A N GLN 263.A O no hydrogen 2.842 N/A GLU 268.A N GLN 264.A O no hydrogen 2.901 N/A MET 269.A N LEU 265.A O no hydrogen 3.136 N/A THR 270.A N GLN 267.A O no hydrogen 3.208 N/A THR 270.A OG1 GLN 115.A OE1 no hydrogen 2.729 N/A