Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3l9n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N SER 1.A OG no hydrogen 3.219 N/A PHE 5.A N SER 1.A O no hydrogen 2.684 N/A LEU 6.A N VAL 2.A O no hydrogen 3.005 N/A ALA 7.A N LYS 3.A O no hydrogen 3.030 N/A LYS 8.A N GLU 4.A O no hydrogen 3.499 N/A ALA 9.A N PHE 5.A O no hydrogen 3.147 N/A LYS 10.A N LEU 6.A O no hydrogen 3.055 N/A ASP 12.A N LYS 8.A O no hydrogen 3.059 N/A PHE 13.A N ALA 9.A O no hydrogen 3.001 N/A LEU 14.A N LYS 10.A O no hydrogen 2.850 N/A LYS 15.A N GLU 11.A O no hydrogen 2.955 N/A LYS 16.A N ASP 12.A O no hydrogen 3.059 N/A LYS 16.A NZ ASP 12.A O no hydrogen 3.455 N/A TRP 17.A N PHE 13.A O no hydrogen 2.916 N/A SER 19.A OG LYS 15.A O no hydrogen 3.181 N/A THR 24.A N SER 96.A O no hydrogen 2.862 N/A THR 24.A OG1 SER 96.A O no hydrogen 3.276 N/A HIS 26.A N GLN 29.A OE1 no hydrogen 3.257 N/A GLN 29.A N HIS 26.A O no hydrogen 3.076 N/A GLN 29.A NE2 GLU 51.A OE2 no hydrogen 3.010 N/A PHE 30.A N LEU 27.A O no hydrogen 3.061 N/A GLU 31.A N LYS 48.A O no hydrogen 2.927 N/A ARG 32.A NH1 GLU 316.A O no hydrogen 3.155 N/A ARG 32.A NH2 GLU 316.A O no hydrogen 2.435 N/A ILE 33.A N LEU 46.A O no hydrogen 2.806 N/A LYS 34.A NZ ASP 312.A OD1 no hydrogen 2.623 N/A THR 35.A N GLU 315.A OE2 no hydrogen 2.849 N/A THR 35.A OG1 GLU 315.A OE1 no hydrogen 2.493 N/A LEU 36.A N VAL 44.A O no hydrogen 2.762 N/A GLY 37.A N VAL 44.A O no hydrogen 3.295 N/A THR 38.A OG1 GLY 42.A O no hydrogen 3.467 N/A GLY 39.A N GLY 42.A O no hydrogen 2.820 N/A GLY 42.A N GLY 39.A O no hydrogen 2.964 N/A ARG 43.A N ILE 60.A O no hydrogen 3.383 N/A ARG 43.A NH1 GLU 316.A O no hydrogen 2.990 N/A ARG 43.A NH1 GLU 317.A O no hydrogen 3.127 N/A ARG 43.A NH2 GLU 317.A O no hydrogen 2.833 N/A VAL 44.A N GLY 37.A O no hydrogen 2.903 N/A MET 45.A N MET 58.A O no hydrogen 2.754 N/A LEU 46.A N LYS 34.A O no hydrogen 2.712 N/A VAL 47.A N TYR 56.A O no hydrogen 2.911 N/A LYS 48.A N GLU 31.A O no hydrogen 2.929 N/A HIS 49.A N ASN 54.A O no hydrogen 2.704 N/A LYS 50.A N GLN 29.A O no hydrogen 2.895 N/A LYS 50.A NZ ASP 28.A O no hydrogen 2.992 N/A GLY 53.A N HIS 49.A O no hydrogen 2.833 N/A ASN 54.A N THR 52.A OG1 no hydrogen 3.201 N/A TYR 56.A N VAL 47.A O no hydrogen 2.942 N/A ALA 57.A N MET 107.A O no hydrogen 2.820 N/A MET 58.A N MET 45.A O no hydrogen 2.774 N/A LYS 59.A N MET 105.A O no hydrogen 2.896 N/A LYS 59.A NZ GLU 78.A OE1 no hydrogen 2.744 N/A LYS 59.A NZ GLU 78.A OE2 no hydrogen 3.365 N/A ILE 60.A N ARG 43.A O no hydrogen 2.787 N/A LEU 61.A N LEU 103.A O no hydrogen 3.015 N/A LYS 63.A N SER 101.A O no hydrogen 3.032 N/A LYS 63.A NZ ASP 99.A O no hydrogen 2.750 N/A LYS 63.A NZ ASN 100.A O no hydrogen 2.975 N/A LYS 63.A NZ LYS 324.A O no hydrogen 2.975 N/A LYS 65.A N ASP 62.A OD1 no hydrogen 3.014 N/A VAL 66.A N ASP 62.A O no hydrogen 3.002 N/A VAL 67.A N LYS 63.A O no hydrogen 3.215 N/A LYS 68.A N GLN 64.A O no hydrogen 3.086 N/A LEU 69.A N LYS 65.A O no hydrogen 2.801 N/A LYS 70.A N VAL 67.A O no hydrogen 2.594 N/A GLN 71.A N VAL 66.A O no hydrogen 2.784 N/A THR 75.A N GLN 71.A O no hydrogen 2.823 N/A THR 75.A OG1 GLN 71.A O no hydrogen 2.871 N/A LEU 76.A N ILE 72.A O no hydrogen 2.998 N/A ASN 77.A N GLU 73.A O no hydrogen 2.830 N/A GLU 78.A N HIS 74.A O no hydrogen 2.971 N/A LYS 79.A N THR 75.A O no hydrogen 3.427 N/A LYS 79.A NZ ALA 21.A O no hydrogen 2.648 N/A LYS 79.A NZ PHE 332.A OXT no hydrogen 2.481 N/A ARG 80.A N LEU 76.A O no hydrogen 3.044 N/A ARG 80.A NE TRP 17.A O no hydrogen 3.285 N/A ARG 80.A NH2 TRP 17.A O no hydrogen 3.171 N/A ILE 81.A N ASN 77.A O no hydrogen 2.835 N/A LEU 82.A N GLU 78.A O no hydrogen 2.837 N/A GLN 83.A N LYS 79.A O no hydrogen 3.061 N/A GLN 83.A NE2 LYS 16.A O no hydrogen 3.174 N/A GLN 83.A NE2 ARG 80.A O no hydrogen 2.741 N/A ALA 84.A N ILE 81.A O no hydrogen 2.920 N/A VAL 85.A N ILE 81.A O no hydrogen 2.975 N/A ASN 86.A N TYR 143.A OH no hydrogen 3.013 N/A LEU 90.A N PHE 87.A O no hydrogen 3.175 N/A VAL 91.A N VAL 169.A O no hydrogen 3.189 N/A LYS 92.A N GLU 108.A OE1 no hydrogen 2.980 N/A GLU 94.A N VAL 106.A O no hydrogen 2.725 N/A PHE 95.A N VAL 106.A O no hydrogen 3.054 N/A SER 96.A N THR 24.A OG1 no hydrogen 2.944 N/A PHE 97.A N TYR 104.A O no hydrogen 3.106 N/A LYS 98.A NZ PHE 329.A O no hydrogen 2.796 N/A LYS 98.A NZ PHE 332.A O no hydrogen 3.012 N/A ASP 99.A N ASN 102.A O no hydrogen 3.062 N/A SER 101.A N ASP 99.A OD1 no hydrogen 3.191 N/A ASN 102.A N ASP 99.A OD1 no hydrogen 2.805 N/A ASN 102.A ND2 TYR 104.A OH no hydrogen 3.160 N/A ASN 102.A ND2 ARG 319.A O no hydrogen 3.339 N/A LEU 103.A N LEU 61.A O no hydrogen 2.831 N/A TYR 104.A N PHE 97.A O no hydrogen 2.758 N/A TYR 104.A OH ASP 99.A OD2 no hydrogen 2.576 N/A MET 105.A N LYS 59.A O no hydrogen 3.021 N/A VAL 106.A N PHE 95.A O no hydrogen 2.718 N/A MET 107.A N ALA 57.A O no hydrogen 2.768 N/A GLU 108.A N LYS 92.A O no hydrogen 3.111 N/A TYR 109.A OH ASP 306.A O no hydrogen 2.315 N/A GLY 113.A N ALA 110.A O no hydrogen 3.159 N/A MET 115.A N LEU 159.A O no hydrogen 2.854 N/A SER 117.A OG GLU 114.A O no hydrogen 2.920 N/A HIS 118.A N GLU 114.A O no hydrogen 3.442 N/A LEU 119.A N MET 115.A O no hydrogen 2.930 N/A ARG 120.A N PHE 116.A O no hydrogen 3.001 N/A ARG 120.A NH1 GLU 216.A OE2 no hydrogen 3.222 N/A ARG 120.A NH2 GLU 216.A OE2 no hydrogen 2.939 N/A ARG 121.A N SER 117.A O no hydrogen 2.839 N/A ILE 122.A N HIS 118.A O no hydrogen 2.894 N/A GLY 123.A N LEU 119.A O no hydrogen 2.880 N/A PHE 125.A N MET 217.A O no hydrogen 2.743 N/A HIS 129.A N SER 126.A OG no hydrogen 3.253 N/A HIS 129.A NE2 TYR 133.A OH no hydrogen 2.745 N/A ALA 130.A N SER 126.A O no hydrogen 2.754 N/A ARG 131.A N GLU 127.A O no hydrogen 2.621 N/A ARG 131.A NE TRP 282.A O no hydrogen 2.744 N/A PHE 132.A N PRO 128.A O no hydrogen 2.945 N/A TYR 133.A N HIS 129.A O no hydrogen 3.343 N/A TYR 133.A OH HIS 129.A NE2 no hydrogen 2.745 N/A ALA 134.A N ALA 130.A O no hydrogen 2.882 N/A ALA 135.A N ARG 131.A O no hydrogen 2.825 N/A GLN 136.A NE2 PHE 132.A O no hydrogen 3.201 N/A ILE 137.A N TYR 133.A O no hydrogen 3.141 N/A VAL 138.A N ALA 134.A O no hydrogen 2.902 N/A LEU 139.A N ALA 135.A O no hydrogen 3.110 N/A THR 140.A N GLN 136.A O no hydrogen 2.962 N/A THR 140.A OG1 GLN 136.A O no hydrogen 2.696 N/A PHE 141.A N ILE 137.A O no hydrogen 2.811 N/A GLU 142.A N VAL 138.A O no hydrogen 2.878 N/A TYR 143.A N LEU 139.A O no hydrogen 2.963 N/A LEU 144.A N THR 140.A O no hydrogen 2.800 N/A HIS 145.A N PHE 141.A O no hydrogen 2.723 N/A HIS 145.A ND1 LEU 149.A O no hydrogen 3.209 N/A SER 146.A N GLU 142.A O no hydrogen 3.056 N/A SER 146.A OG TYR 143.A O no hydrogen 2.574 N/A LEU 147.A N LEU 144.A O no hydrogen 2.880 N/A ASP 148.A N HIS 145.A O no hydrogen 2.807 N/A LEU 149.A N LEU 144.A O no hydrogen 2.959 N/A ILE 150.A N LYS 176.A O no hydrogen 2.958 N/A TYR 151.A N ASP 206.A OD2 no hydrogen 2.873 N/A TYR 151.A OH THR 170.A O no hydrogen 2.552 N/A TYR 151.A OH ASP 171.A O no hydrogen 3.301 N/A ARG 152.A N ASP 206.A OD1 no hydrogen 2.895 N/A ARG 152.A NE PHE 174.A O no hydrogen 2.743 N/A ARG 152.A NH1 TYR 201.A OH no hydrogen 2.728 N/A ARG 152.A NH2 PHE 174.A O no hydrogen 2.824 N/A LYS 155.A NZ THR 187.A OG1 no hydrogen 2.857 N/A GLU 157.A N GLU 157.A OE1 no hydrogen 2.786 N/A ASN 158.A N LYS 155.A O no hydrogen 2.956 N/A ASN 158.A ND2 TYR 151.A OH no hydrogen 3.230 N/A ASN 158.A ND2 ASP 153.A O no hydrogen 2.956 N/A ASN 158.A ND2 ASP 153.A OD2 no hydrogen 2.853 N/A LEU 159.A N PRO 156.A O no hydrogen 3.267 N/A MET 160.A N LYS 168.A O no hydrogen 2.943 N/A ILE 161.A N GLY 113.A O no hydrogen 2.855 N/A ASP 162.A N TYR 166.A O no hydrogen 2.793 N/A GLN 164.A N ASP 162.A OD1 no hydrogen 2.763 N/A GLY 165.A N ASP 162.A O no hydrogen 2.901 N/A TYR 166.A N ASP 162.A OD1 no hydrogen 3.009 N/A TYR 166.A OH VAL 296.A O no hydrogen 2.579 N/A ILE 167.A N GLN 136.A OE1 no hydrogen 2.717 N/A LYS 168.A N MET 160.A O no hydrogen 2.816 N/A LYS 168.A NZ PRO 88.A O no hydrogen 2.867 N/A VAL 169.A N PHE 89.A O no hydrogen 2.729 N/A THR 170.A N ASN 158.A O no hydrogen 2.943 N/A THR 170.A OG1 ASN 158.A O no hydrogen 2.839 N/A PHE 172.A N GLU 78.A OE2 no hydrogen 2.889 N/A GLY 173.A N ASP 171.A OD1 no hydrogen 3.235 N/A ALA 175.A N PHE 172.A O no hydrogen 3.311 N/A LYS 176.A N ILE 150.A O no hydrogen 3.019 N/A LYS 176.A NZ THR 182.A OG1 no hydrogen 2.967 N/A VAL 178.A N ASP 148.A O no hydrogen 2.675 N/A THR 182.A N TYR 201.A O no hydrogen 2.828 N/A THR 187.A OG1 ASP 153.A OD1 no hydrogen 2.822 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.730 N/A TYR 190.A N THR 187.A O no hydrogen 2.792 N/A TYR 190.A OH GLU 216.A OE1 no hydrogen 2.524 N/A LEU 191.A N PRO 188.A O no hydrogen 3.088 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 2.822 N/A ILE 195.A N ALA 192.A O no hydrogen 3.046 N/A ILE 196.A N ALA 192.A O no hydrogen 3.284 N/A LEU 197.A N PRO 193.A O no hydrogen 2.870 N/A SER 198.A N ILE 195.A O no hydrogen 3.020 N/A LYS 199.A N GLU 194.A O no hydrogen 3.150 N/A TYR 201.A N THR 182.A O no hydrogen 3.011 N/A LYS 203.A NZ HIS 145.A O no hydrogen 2.858 N/A ALA 204.A N ASN 202.A OD1 no hydrogen 2.876 N/A VAL 205.A N ASN 202.A O no hydrogen 3.180 N/A ASP 206.A N LYS 203.A O no hydrogen 3.001 N/A TRP 208.A N ALA 204.A O no hydrogen 3.177 N/A ALA 209.A N VAL 205.A O no hydrogen 3.057 N/A LEU 210.A N ASP 206.A O no hydrogen 2.903 N/A GLY 211.A N TRP 207.A O no hydrogen 3.195 N/A VAL 212.A N TRP 208.A O no hydrogen 3.060 N/A LEU 213.A N ALA 209.A O no hydrogen 2.785 N/A ILE 214.A N LEU 210.A O no hydrogen 2.853 N/A TYR 215.A N GLY 211.A O no hydrogen 3.006 N/A TYR 215.A OH ARG 242.A O no hydrogen 2.807 N/A GLU 216.A N VAL 212.A O no hydrogen 2.999 N/A MET 217.A N LEU 213.A O no hydrogen 2.896 N/A ALA 218.A N ILE 214.A O no hydrogen 2.940 N/A ALA 219.A N TYR 215.A O no hydrogen 2.735 N/A GLY 220.A N GLU 216.A O no hydrogen 2.618 N/A ILE 232.A N GLN 228.A O no hydrogen 3.094 N/A TYR 233.A N PRO 229.A O no hydrogen 2.789 N/A GLU 234.A N ILE 230.A O no hydrogen 3.223 N/A LYS 235.A N GLN 231.A O no hydrogen 3.359 N/A LYS 235.A NZ PHE 225.A O no hydrogen 2.594 N/A ILE 236.A N ILE 232.A O no hydrogen 3.064 N/A VAL 237.A N TYR 233.A O no hydrogen 3.018 N/A SER 238.A N GLU 234.A O no hydrogen 3.142 N/A SER 238.A OG LYS 235.A O no hydrogen 3.296 N/A GLY 239.A N LYS 235.A O no hydrogen 3.163 N/A GLY 239.A N ILE 236.A O no hydrogen 2.971 N/A LYS 240.A N SER 238.A OG no hydrogen 3.346 N/A PHE 247.A N PRO 244.A O no hydrogen 3.010 N/A SER 248.A N GLU 127.A OE2 no hydrogen 2.818 N/A SER 248.A OG GLU 127.A OE1 no hydrogen 2.752 N/A SER 248.A OG GLU 127.A OE2 no hydrogen 3.278 N/A LEU 251.A N SER 248.A OG no hydrogen 3.053 N/A LYS 252.A N SER 248.A O no hydrogen 3.015 N/A ASP 253.A N SER 249.A O no hydrogen 3.038 N/A LEU 254.A N ASP 250.A O no hydrogen 3.065 N/A LEU 255.A N LEU 251.A O no hydrogen 2.980 N/A ARG 256.A N LYS 252.A O no hydrogen 2.909 N/A ASN 257.A N ASP 253.A O no hydrogen 3.182 N/A ASN 257.A N LEU 254.A O no hydrogen 3.098 N/A LEU 258.A N LEU 254.A O no hydrogen 3.015 N/A LEU 258.A N LEU 255.A O no hydrogen 3.162 N/A LEU 259.A N LEU 255.A O no hydrogen 2.757 N/A ASP 262.A N GLN 260.A OE1 no hydrogen 2.802 N/A THR 264.A OG1 ASP 262.A OD1 no hydrogen 3.343 N/A THR 264.A OG1 ASP 262.A OD2 no hydrogen 2.847 N/A LYS 265.A N ASP 262.A O no hydrogen 2.912 N/A ARG 266.A N ASP 262.A O no hydrogen 3.149 N/A ARG 266.A NE GLN 260.A O no hydrogen 2.863 N/A ARG 266.A NH1 GLU 194.A OE2 no hydrogen 2.818 N/A ARG 266.A NH1 ALA 204.A O no hydrogen 3.011 N/A ARG 266.A NH2 GLU 194.A OE1 no hydrogen 2.884 N/A ARG 266.A NH2 GLU 194.A OE2 no hydrogen 3.390 N/A ARG 266.A NH2 GLN 260.A O no hydrogen 3.108 N/A PHE 267.A N ASN 257.A O no hydrogen 2.896 N/A ASN 269.A N ARG 266.A O no hydrogen 3.016 N/A ASN 269.A ND2 LEU 263.A O no hydrogen 2.767 N/A GLY 273.A N LEU 270.A O no hydrogen 3.003 N/A ASN 275.A N ASN 272.A O no hydrogen 3.226 N/A ASN 275.A ND2 ASN 272.A O no hydrogen 3.348 N/A ASP 276.A N GLY 273.A O no hydrogen 3.284 N/A ILE 277.A N VAL 274.A O no hydrogen 3.040 N/A LYS 278.A N VAL 274.A O no hydrogen 2.891 N/A LYS 278.A NZ GLU 142.A OE1 no hydrogen 3.189 N/A LYS 278.A NZ GLU 142.A OE2 no hydrogen 3.242 N/A ASN 279.A N ASN 275.A O no hydrogen 2.731 N/A HIS 280.A N ILE 277.A O no hydrogen 2.916 N/A HIS 280.A NE2 ASP 253.A OD2 no hydrogen 2.669 N/A TRP 282.A N HIS 280.A ND1 no hydrogen 2.871 N/A TRP 282.A NE1 GLU 127.A OE1 no hydrogen 2.885 N/A PHE 283.A N HIS 280.A O no hydrogen 2.826 N/A ALA 284.A N LYS 281.A O no hydrogen 2.996 N/A THR 286.A N PHE 283.A O no hydrogen 3.102 N/A TRP 288.A NE1 LYS 278.A O no hydrogen 3.235 N/A ALA 290.A N ASP 287.A OD1 no hydrogen 2.929 N/A ILE 291.A N ASP 287.A O no hydrogen 2.944 N/A TYR 292.A N TRP 288.A O no hydrogen 3.091 N/A GLN 293.A N ILE 289.A O no hydrogen 2.978 N/A ARG 294.A N ILE 291.A O no hydrogen 2.775 N/A ARG 294.A NE GLN 164.A OE1 no hydrogen 3.230 N/A ARG 294.A NH2 ASP 162.A OD2 no hydrogen 2.607 N/A LYS 295.A N ALA 290.A O no hydrogen 2.771 N/A VAL 296.A N TYR 166.A OH no hydrogen 2.954 N/A SER 308.A N ASP 306.A OD1 no hydrogen 2.778 N/A SER 308.A OG ASP 306.A OD2 no hydrogen 3.008 N/A PHE 310.A N THR 307.A O no hydrogen 3.028 N/A LYS 324.A N ASN 100.A O no hydrogen 2.904 N/A GLU 328.A N GLU 328.A OE1 no hydrogen 2.539 N/A SER 330.A N LYS 327.A O no hydrogen 3.239 N/A SER 330.A OG LYS 327.A O no hydrogen 3.437 N/A PHE 332.A N PHE 329.A O no hydrogen 3.030 N/A