Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3frx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N GLN 300.A O no hydrogen 2.956 N/A ARG 7.A N VAL 298.A O no hydrogen 2.680 N/A LEU 10.A N ILE 296.A O no hydrogen 2.739 N/A HIS 13.A ND1 ASP 36.A OD2 no hydrogen 2.986 N/A HIS 13.A NE2 SER 32.A OG no hydrogen 2.658 N/A ASN 14.A N ASP 36.A OD2 no hydrogen 2.870 N/A VAL 17.A N TYR 291.A O no hydrogen 3.209 N/A THR 18.A N ALA 33.A O no hydrogen 2.875 N/A THR 18.A OG1 ALA 33.A O no hydrogen 3.326 N/A THR 18.A OG1 VAL 65.A O no hydrogen 2.530 N/A THR 18.A OG1 GLN 66.A O no hydrogen 3.403 N/A SER 19.A OG ASP 67.A OD1 no hydrogen 2.971 N/A SER 19.A OG CYS 68.A O no hydrogen 3.450 N/A ALA 21.A N LEU 31.A O no hydrogen 2.885 N/A THR 22.A OG1 TRP 280.A O no hydrogen 2.657 N/A SER 23.A OG GLN 26.A O no hydrogen 3.455 N/A GLY 25.A N ALA 72.A O no hydrogen 3.152 N/A GLN 26.A N SER 23.A OG no hydrogen 3.018 N/A GLN 26.A NE2 ASP 73.A O no hydrogen 3.512 N/A LEU 29.A N GLN 26.A O no hydrogen 2.959 N/A LEU 30.A N TRP 42.A O no hydrogen 3.156 N/A LEU 31.A N ALA 21.A O no hydrogen 2.870 N/A SER 32.A N ILE 40.A O no hydrogen 2.883 N/A SER 32.A OG HIS 13.A NE2 no hydrogen 2.658 N/A SER 32.A OG ILE 40.A O no hydrogen 3.222 N/A ALA 33.A N SER 19.A O no hydrogen 2.915 N/A SER 34.A N THR 38.A O no hydrogen 3.146 N/A SER 34.A OG GLY 15.A O no hydrogen 2.846 N/A SER 34.A OG TRP 16.A O no hydrogen 3.056 N/A ARG 35.A N TRP 16.A O no hydrogen 2.962 N/A ASP 36.A N SER 34.A OG no hydrogen 2.943 N/A LYS 37.A N SER 34.A O no hydrogen 3.102 N/A THR 38.A N ASP 36.A OD1 no hydrogen 2.895 N/A THR 38.A OG1 ASP 36.A OD1 no hydrogen 2.657 N/A THR 38.A OG1 ASP 36.A OD2 no hydrogen 3.419 N/A LEU 39.A N PHE 58.A O no hydrogen 3.134 N/A ILE 40.A N SER 32.A O no hydrogen 2.870 N/A SER 41.A N ARG 56.A O no hydrogen 3.147 N/A TRP 42.A N LEU 30.A O no hydrogen 2.703 N/A TRP 42.A NE1 SER 32.A OG no hydrogen 2.720 N/A LYS 43.A N VAL 53.A O no hydrogen 2.756 N/A LEU 44.A N ASN 28.A O no hydrogen 2.829 N/A THR 45.A N PHE 51.A O no hydrogen 2.850 N/A THR 45.A OG1 PHE 51.A O no hydrogen 3.316 N/A GLY 46.A N PHE 51.A O no hydrogen 2.643 N/A LYS 50.A N ASP 47.A O no hydrogen 2.998 N/A VAL 53.A N LYS 43.A O no hydrogen 2.983 N/A VAL 55.A N SER 41.A O no hydrogen 2.841 N/A ARG 56.A NE ALA 92.A O no hydrogen 2.620 N/A ARG 56.A NH1 VAL 55.A O no hydrogen 2.989 N/A ARG 56.A NH2 ALA 92.A O no hydrogen 3.189 N/A PHE 58.A N LEU 39.A O no hydrogen 2.748 N/A HIS 61.A ND1 ASP 83.A OD2 no hydrogen 2.853 N/A HIS 61.A NE2 SER 79.A OG no hydrogen 2.737 N/A SER 62.A N ASP 83.A OD2 no hydrogen 3.189 N/A ILE 64.A N HIS 63.A ND1 no hydrogen 2.684 N/A VAL 65.A N SER 34.A O no hydrogen 3.307 N/A GLN 66.A N ALA 80.A O no hydrogen 2.873 N/A CYS 68.A N SER 19.A OG no hydrogen 2.943 N/A CYS 68.A SG SER 19.A OG no hydrogen 3.477 N/A THR 69.A N LEU 78.A O no hydrogen 3.083 N/A THR 69.A OG1 LEU 70.A O no hydrogen 3.535 N/A THR 71.A N TYR 76.A O no hydrogen 2.971 N/A THR 71.A OG1 ASP 73.A OD1 no hydrogen 2.770 N/A THR 71.A OG1 TYR 76.A O no hydrogen 3.427 N/A GLY 74.A N THR 71.A O no hydrogen 2.955 N/A ALA 75.A N ASP 73.A OD1 no hydrogen 2.892 N/A TYR 76.A N THR 71.A OG1 no hydrogen 3.110 N/A ALA 77.A N TRP 89.A O no hydrogen 2.952 N/A LEU 78.A N THR 69.A O no hydrogen 2.924 N/A SER 79.A N ARG 87.A O no hydrogen 2.962 N/A SER 79.A OG HIS 61.A NE2 no hydrogen 2.737 N/A SER 79.A OG ARG 87.A O no hydrogen 3.387 N/A ALA 80.A N ASP 67.A O no hydrogen 2.963 N/A SER 81.A N THR 85.A O no hydrogen 3.049 N/A SER 81.A OG ILE 64.A O no hydrogen 2.947 N/A TRP 82.A N ILE 64.A O no hydrogen 2.823 N/A TRP 82.A NE1 GLN 66.A OE1 no hydrogen 2.877 N/A ASP 83.A N SER 81.A OG no hydrogen 3.003 N/A LYS 84.A N SER 81.A O no hydrogen 3.087 N/A THR 85.A N ASP 83.A OD1 no hydrogen 2.963 N/A THR 85.A OG1 ASP 83.A OD1 no hydrogen 2.893 N/A LEU 86.A N PHE 100.A O no hydrogen 3.143 N/A ARG 87.A N SER 79.A O no hydrogen 3.088 N/A ARG 87.A NH1 THR 96.A OG1 no hydrogen 2.883 N/A LEU 88.A N GLN 98.A O no hydrogen 2.866 N/A TRP 89.A N ALA 77.A O no hydrogen 2.680 N/A TRP 89.A NE1 SER 79.A OG no hydrogen 2.762 N/A ASP 90.A N GLU 95.A O no hydrogen 2.888 N/A VAL 91.A N ALA 75.A O no hydrogen 2.958 N/A THR 93.A N ASP 90.A O no hydrogen 3.278 N/A THR 93.A N ASP 90.A OD1 no hydrogen 3.098 N/A GLY 94.A N ASP 90.A O no hydrogen 2.730 N/A GLU 95.A N THR 93.A OG1 no hydrogen 3.232 N/A TYR 97.A N LEU 88.A O no hydrogen 2.782 N/A TYR 97.A OH ASP 90.A OD2 no hydrogen 3.166 N/A GLN 98.A N LEU 88.A O no hydrogen 3.378 N/A GLN 98.A NE2 ARG 99.A O no hydrogen 3.181 N/A PHE 100.A N LEU 86.A O no hydrogen 2.726 N/A HIS 103.A ND1 ASP 123.A OD2 no hydrogen 2.911 N/A HIS 103.A NE2 SER 119.A OG no hydrogen 2.677 N/A LYS 104.A N ASP 123.A OD2 no hydrogen 3.055 N/A ASP 106.A N SER 105.A OG no hydrogen 2.735 N/A VAL 107.A N SER 81.A O no hydrogen 2.951 N/A SER 108.A OG ASP 67.A OD2 no hydrogen 3.337 N/A SER 108.A OG VAL 149.A O no hydrogen 3.237 N/A VAL 109.A N ASP 67.A OD2 no hydrogen 2.915 N/A ASP 110.A N ILE 118.A O no hydrogen 2.890 N/A ILE 111.A N ASP 110.A OD1 no hydrogen 2.791 N/A ALA 115.A N ASP 112.A O no hydrogen 3.003 N/A SER 116.A N ASP 112.A OD2 no hydrogen 2.675 N/A SER 116.A OG ASP 112.A OD1 no hydrogen 2.699 N/A SER 116.A OG ASP 112.A OD2 no hydrogen 3.547 N/A ILE 118.A N ASP 110.A O no hydrogen 2.833 N/A SER 119.A N LYS 127.A O no hydrogen 2.970 N/A SER 119.A OG HIS 103.A NE2 no hydrogen 2.677 N/A GLY 120.A N SER 108.A O no hydrogen 3.042 N/A SER 121.A N THR 125.A O no hydrogen 3.259 N/A SER 121.A OG SER 105.A O no hydrogen 3.302 N/A SER 121.A OG ASP 106.A O no hydrogen 2.733 N/A ARG 122.A N ASP 106.A O no hydrogen 2.904 N/A ARG 122.A NH1 ASP 106.A OD2 no hydrogen 2.809 N/A ASP 123.A N SER 121.A OG no hydrogen 2.978 N/A LYS 124.A N SER 121.A O no hydrogen 3.065 N/A THR 125.A N ASP 123.A OD1 no hydrogen 2.853 N/A THR 125.A OG1 ASP 123.A OD1 no hydrogen 2.752 N/A THR 125.A OG1 ASP 123.A OD2 no hydrogen 3.344 N/A ILE 126.A N LEU 139.A O no hydrogen 3.206 N/A LYS 127.A N SER 119.A O no hydrogen 2.978 N/A LYS 127.A NZ THR 138.A OG1 no hydrogen 2.732 N/A VAL 128.A N ALA 137.A O no hydrogen 2.894 N/A TRP 129.A N ILE 117.A O no hydrogen 2.779 N/A TRP 129.A NE1 SER 119.A OG no hydrogen 2.913 N/A THR 130.A N GLN 134.A O no hydrogen 2.826 N/A LYS 132.A N THR 130.A OG1 no hydrogen 3.259 N/A GLY 133.A N THR 130.A O no hydrogen 3.017 N/A GLN 134.A N THR 130.A OG1 no hydrogen 3.137 N/A CYS 135.A SG VAL 128.A O no hydrogen 4.023 N/A CYS 135.A SG ALA 137.A O no hydrogen 3.898 N/A LEU 136.A N VAL 128.A O no hydrogen 2.718 N/A ALA 137.A N VAL 128.A O no hydrogen 3.356 N/A LEU 139.A N ILE 126.A O no hydrogen 2.596 N/A HIS 142.A ND1 ASP 164.A OD1 no hydrogen 3.302 N/A HIS 142.A ND1 ASP 164.A OD2 no hydrogen 3.095 N/A HIS 142.A NE2 SER 160.A OG no hydrogen 2.675 N/A ASN 143.A N ASP 164.A OD2 no hydrogen 2.991 N/A TRP 145.A N ASP 144.A OD1 no hydrogen 2.696 N/A VAL 146.A N SER 121.A O no hydrogen 3.056 N/A SER 147.A N ALA 161.A O no hydrogen 2.961 N/A SER 147.A OG ALA 161.A O no hydrogen 3.353 N/A SER 147.A OG ILE 187.A O no hydrogen 2.672 N/A VAL 149.A N SER 108.A OG no hydrogen 2.886 N/A ARG 150.A N ILE 159.A O no hydrogen 2.885 N/A ARG 150.A NH1 ASP 67.A OD2 no hydrogen 3.070 N/A ARG 150.A NH1 VAL 149.A O no hydrogen 2.823 N/A ARG 150.A NH2 ASP 67.A OD1 no hydrogen 3.437 N/A ARG 150.A NH2 ASP 67.A OD2 no hydrogen 3.320 N/A VAL 151.A N ASP 110.A OD2 no hydrogen 2.798 N/A VAL 152.A N THR 157.A O no hydrogen 2.766 N/A ASN 154.A ND2 SER 155.A O no hydrogen 3.234 N/A ILE 158.A N TRP 169.A O no hydrogen 3.120 N/A ILE 159.A N ARG 150.A O no hydrogen 2.773 N/A SER 160.A N LYS 167.A O no hydrogen 2.748 N/A SER 160.A OG HIS 142.A NE2 no hydrogen 2.675 N/A ALA 161.A N GLN 148.A O no hydrogen 3.131 N/A ASN 163.A N TRP 145.A O no hydrogen 2.918 N/A LYS 165.A N GLY 162.A O no hydrogen 3.295 N/A LYS 165.A NZ ASN 163.A O no hydrogen 3.258 N/A LYS 165.A NZ ASN 186.A OD1 no hydrogen 3.066 N/A LYS 167.A N SER 160.A O no hydrogen 2.858 N/A LYS 167.A NZ ASP 179.A OD1 no hydrogen 2.856 N/A ALA 168.A N ALA 178.A O no hydrogen 3.063 N/A TRP 169.A N ILE 158.A O no hydrogen 2.807 N/A TRP 169.A NE1 SER 160.A OG no hydrogen 2.791 N/A ASN 170.A N GLN 175.A O no hydrogen 2.830 N/A LEU 171.A N VAL 156.A O no hydrogen 3.002 N/A ASN 172.A N ASN 170.A OD1 no hydrogen 2.686 N/A GLN 173.A N ASN 170.A O no hydrogen 3.003 N/A GLN 175.A N ASN 170.A O no hydrogen 3.262 N/A GLN 175.A NE2 GLN 173.A O no hydrogen 3.375 N/A GLU 177.A N ALA 168.A O no hydrogen 2.698 N/A ALA 178.A N ALA 168.A O no hydrogen 3.276 N/A PHE 180.A N VAL 166.A O no hydrogen 2.760 N/A HIS 183.A NE2 SER 201.A OG no hydrogen 2.626 N/A SER 185.A OG ASN 186.A O no hydrogen 3.411 N/A ASN 188.A N ALA 202.A O no hydrogen 2.941 N/A ASN 188.A ND2 GLU 225.A OE2 no hydrogen 2.771 N/A ASN 188.A ND2 VAL 226.A O no hydrogen 2.890 N/A THR 189.A N ALA 202.A O no hydrogen 3.114 N/A THR 189.A OG1 GLN 148.A OE1 no hydrogen 2.708 N/A LEU 190.A N GLN 148.A OE1 no hydrogen 2.935 N/A THR 191.A N ALA 200.A O no hydrogen 2.761 N/A THR 191.A OG1 ALA 192.A O no hydrogen 3.489 N/A SER 193.A N LEU 198.A O no hydrogen 2.971 N/A SER 193.A OG ASP 195.A OD1 no hydrogen 2.685 N/A SER 193.A OG LEU 198.A O no hydrogen 3.569 N/A GLY 196.A N SER 193.A O no hydrogen 2.803 N/A THR 197.A N ASP 195.A OD1 no hydrogen 3.103 N/A THR 197.A OG1 ASP 195.A OD1 no hydrogen 2.681 N/A THR 197.A OG1 ASP 195.A OD2 no hydrogen 3.087 N/A LEU 198.A N SER 193.A OG no hydrogen 2.953 N/A ILE 199.A N TRP 210.A O no hydrogen 2.948 N/A ALA 200.A N THR 191.A O no hydrogen 2.799 N/A SER 201.A OG HIS 183.A NE2 no hydrogen 2.626 N/A ALA 202.A N THR 189.A O no hydrogen 2.982 N/A LYS 204.A N ASN 186.A O no hydrogen 2.964 N/A LYS 204.A NZ GLU 225.A OE1 no hydrogen 3.112 N/A ASP 205.A N SER 185.A OG no hydrogen 3.142 N/A GLY 206.A N GLY 203.A O no hydrogen 3.048 N/A GLU 207.A N ASP 205.A OD1 no hydrogen 2.955 N/A ILE 208.A N LEU 220.A O no hydrogen 2.821 N/A TRP 210.A N ILE 199.A O no hydrogen 2.737 N/A TRP 210.A NE1 SER 201.A OG no hydrogen 2.852 N/A ASN 211.A N LYS 216.A O no hydrogen 2.754 N/A LEU 212.A N THR 197.A O no hydrogen 3.134 N/A ALA 214.A N ASN 211.A OD1 no hydrogen 2.976 N/A LYS 215.A N LEU 212.A O no hydrogen 3.022 N/A LYS 215.A NZ GLU 177.A O no hydrogen 2.713 N/A LYS 216.A N ASN 211.A O no hydrogen 3.172 N/A LEU 220.A N ILE 208.A O no hydrogen 2.770 N/A SER 221.A OG GLU 207.A OE1 no hydrogen 2.898 N/A ALA 222.A N GLY 206.A O no hydrogen 2.874 N/A ASP 224.A N ALA 222.A O no hydrogen 2.764 N/A VAL 226.A N GLY 203.A O no hydrogen 2.969 N/A PHE 227.A N ALA 241.A O no hydrogen 2.772 N/A LEU 229.A N THR 189.A OG1 no hydrogen 3.325 N/A ALA 230.A N ALA 239.A O no hydrogen 2.906 N/A SER 232.A N TRP 237.A O no hydrogen 2.836 N/A ASN 234.A N SER 232.A OG no hydrogen 3.299 N/A ARG 235.A N SER 232.A OG no hydrogen 2.891 N/A ARG 235.A NE GLU 2.A OE1 no hydrogen 3.445 N/A ARG 235.A NH1 GLN 285.A OE1 no hydrogen 2.955 N/A ARG 235.A NH2 GLU 2.A OE2 no hydrogen 2.627 N/A ARG 235.A NH2 GLN 285.A OE1 no hydrogen 2.835 N/A LEU 238.A N PHE 249.A O no hydrogen 2.759 N/A ALA 239.A N ALA 230.A O no hydrogen 2.927 N/A ALA 240.A N LYS 247.A O no hydrogen 2.802 N/A ALA 241.A N SER 228.A O no hydrogen 2.904 N/A THR 242.A N GLY 245.A O no hydrogen 2.807 N/A THR 242.A OG1 THR 244.A OG1 no hydrogen 3.411 N/A THR 242.A OG1 GLY 245.A O no hydrogen 2.737 N/A ALA 243.A N GLU 225.A O no hydrogen 3.079 N/A THR 244.A N THR 242.A OG1 no hydrogen 3.162 N/A THR 244.A OG1 ASP 224.A OD2 no hydrogen 2.522 N/A THR 244.A OG1 THR 242.A OG1 no hydrogen 3.411 N/A GLY 245.A N THR 242.A O no hydrogen 3.235 N/A ILE 246.A N LEU 260.A O no hydrogen 2.912 N/A LYS 247.A N ALA 240.A O no hydrogen 2.913 N/A LYS 247.A NZ ALA 222.A O no hydrogen 2.918 N/A LYS 247.A NZ ASP 259.A OD2 no hydrogen 3.448 N/A VAL 248.A N ASP 258.A O no hydrogen 2.832 N/A PHE 249.A N LEU 238.A O no hydrogen 2.746 N/A SER 250.A N TYR 255.A O no hydrogen 2.735 N/A SER 250.A OG PRO 253.A O no hydrogen 2.723 N/A LEU 251.A N TYR 236.A O no hydrogen 2.901 N/A GLN 254.A NE2 TYR 218.A OH no hydrogen 3.019 N/A TYR 255.A N SER 250.A O no hydrogen 3.022 N/A VAL 257.A N VAL 248.A O no hydrogen 2.709 N/A ASP 258.A N VAL 248.A O no hydrogen 3.361 N/A ASP 259.A N ASP 258.A OD1 no hydrogen 2.616 N/A LEU 260.A N ILE 246.A O no hydrogen 2.757 N/A ARG 261.A NE ASP 259.A OD1 no hydrogen 3.041 N/A ARG 261.A NH2 ASP 259.A OD2 no hydrogen 2.910 N/A TYR 267.A N PHE 264.A O no hydrogen 3.039 N/A ALA 271.A N SER 268.A O no hydrogen 2.874 N/A GLU 272.A N LYS 269.A O no hydrogen 3.185 N/A HIS 274.A N THR 292.A OG1 no hydrogen 3.148 N/A VAL 276.A N GLY 290.A O no hydrogen 2.837 N/A SER 277.A OG VAL 17.A O no hydrogen 2.796 N/A ALA 279.A N PHE 288.A O no hydrogen 2.932 N/A TRP 280.A NE1 ALA 230.A O no hydrogen 2.970 N/A SER 281.A N THR 286.A O no hydrogen 2.862 N/A SER 281.A OG ASP 283.A OD1 no hydrogen 2.638 N/A SER 281.A OG THR 286.A O no hydrogen 3.395 N/A GLY 284.A N SER 281.A O no hydrogen 2.990 N/A GLN 285.A N ASP 283.A OD1 no hydrogen 2.827 N/A THR 286.A N SER 281.A OG no hydrogen 3.002 N/A LEU 287.A N TRP 299.A O no hydrogen 2.814 N/A PHE 288.A N ALA 279.A O no hydrogen 2.751 N/A ALA 289.A N ARG 297.A O no hydrogen 3.029 N/A GLY 290.A N SER 277.A O no hydrogen 3.035 N/A TYR 291.A N VAL 295.A O no hydrogen 2.944 N/A THR 292.A N HIS 274.A O no hydrogen 3.069 N/A ASN 294.A N TYR 291.A O no hydrogen 3.136 N/A VAL 295.A N ASP 293.A OD1 no hydrogen 3.118 N/A ILE 296.A N LEU 10.A O no hydrogen 3.164 N/A ARG 297.A N ALA 289.A O no hydrogen 2.866 N/A ARG 297.A NH1 ASP 293.A OD1 no hydrogen 3.246 N/A ARG 297.A NH1 ASP 293.A OD2 no hydrogen 3.376 N/A ARG 297.A NH2 ASP 293.A OD2 no hydrogen 2.849 N/A VAL 298.A N GLY 8.A O no hydrogen 2.947 N/A TRP 299.A N LEU 287.A O no hydrogen 2.976 N/A GLN 300.A N VAL 5.A O no hydrogen 2.928 N/A VAL 301.A N GLN 285.A O no hydrogen 2.939 N/A ALA 303.A N ASN 1.A O no hydrogen 3.010 N/A