Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bb0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 7.A N LEU 4.A O no hydrogen 3.295 N/A ASP 8.A N VAL 23.A O no hydrogen 3.013 N/A TYR 9.A OH HIS 40.A NE2 no hydrogen 2.831 N/A LEU 10.A N VAL 21.A O no hydrogen 2.764 N/A LEU 12.A N LEU 19.A O no hydrogen 2.829 N/A THR 14.A N ALA 17.A O no hydrogen 2.914 N/A THR 14.A OG1 ALA 17.A O no hydrogen 3.279 N/A SER 15.A OG GLU 86.A OE1 no hydrogen 3.420 N/A SER 15.A OG GLU 86.A OE2 no hydrogen 2.878 N/A ARG 18.A N ARG 68.A O no hydrogen 2.805 N/A LEU 19.A N LEU 12.A O no hydrogen 2.804 N/A ARG 20.A N SER 67.A OG no hydrogen 2.887 N/A ARG 20.A NE GLU 66.A OE1 no hydrogen 2.907 N/A ARG 20.A NH1 LEU 10.A O no hydrogen 2.890 N/A ARG 20.A NH2 GLU 66.A OE2 no hydrogen 3.029 N/A VAL 21.A N LEU 10.A O no hydrogen 3.025 N/A ALA 22.A N LEU 58.A O no hydrogen 2.845 N/A VAL 23.A N ASP 8.A O no hydrogen 3.034 N/A LYS 24.A N VAL 56.A O no hydrogen 2.956 N/A LYS 24.A NZ PRO 5.A O no hydrogen 2.928 N/A SER 26.A N TYR 54.A O no hydrogen 3.274 N/A LEU 30.A N SER 55.A O no hydrogen 2.782 N/A LEU 31.A N ALA 97.A O no hydrogen 2.872 N/A LEU 32.A N VAL 57.A O no hydrogen 2.900 N/A LEU 33.A N ILE 99.A O no hydrogen 2.960 N/A HIS 34.A ND1 GLY 35.A O no hydrogen 2.896 N/A TYR 36.A N ASP 102.A OD1 no hydrogen 2.878 N/A GLN 38.A N GLY 35.A O no hydrogen 3.074 N/A GLN 38.A NE2 GLU 273.A OE1 no hydrogen 2.752 N/A HIS 40.A N ASP 60.A OD1 no hydrogen 3.027 N/A HIS 40.A ND1 ASP 60.A OD1 no hydrogen 2.689 N/A HIS 40.A NE2 TYR 9.A OH no hydrogen 2.831 N/A LEU 41.A N THR 39.A OG1 no hydrogen 3.321 N/A ALA 42.A N THR 39.A O no hydrogen 2.941 N/A TRP 43.A N HIS 40.A O no hydrogen 3.102 N/A HIS 44.A N LEU 41.A O no hydrogen 2.938 N/A ARG 45.A NH1 ILE 183.A O no hydrogen 2.670 N/A ARG 45.A NH1 GLU 273.A O no hydrogen 2.940 N/A ARG 45.A NH2 ILE 183.A O no hydrogen 3.437 N/A ILE 46.A N TRP 43.A O no hydrogen 2.958 N/A ALA 47.A N TRP 43.A O no hydrogen 2.982 N/A ARG 49.A NH1 ARG 49.A O no hydrogen 2.836 N/A ARG 49.A NH1 ASP 53.A OD2 no hydrogen 2.846 N/A LEU 50.A N ILE 46.A O no hydrogen 3.263 N/A ALA 51.A N ALA 47.A O no hydrogen 2.908 N/A GLU 52.A N ARG 49.A O no hydrogen 3.206 N/A ASP 53.A N LEU 50.A O no hydrogen 3.002 N/A TYR 54.A N LEU 50.A O no hydrogen 3.016 N/A SER 55.A N PRO 28.A O no hydrogen 2.953 N/A SER 55.A OG GLY 27.A O no hydrogen 2.835 N/A VAL 56.A N LYS 24.A O no hydrogen 2.723 N/A VAL 57.A N LEU 30.A O no hydrogen 2.982 N/A LEU 58.A N ALA 22.A O no hydrogen 2.885 N/A ASP 60.A N ARG 20.A O no hydrogen 2.956 N/A LEU 61.A N HIS 34.A NE2 no hydrogen 3.093 N/A ARG 62.A NE ASP 83.A OD2 no hydrogen 2.884 N/A ARG 62.A NH2 ASP 83.A OD1 no hydrogen 2.630 N/A ARG 62.A NH2 ASP 83.A OD2 no hydrogen 3.275 N/A GLY 63.A N SER 67.A O no hydrogen 3.040 N/A TYR 64.A N LEU 61.A O no hydrogen 2.897 N/A TYR 64.A OH ASP 208.A OD2 no hydrogen 2.477 N/A GLU 66.A N ASP 60.A OD2 no hydrogen 2.780 N/A SER 67.A N TYR 64.A O no hydrogen 3.044 N/A SER 67.A OG ASP 60.A O no hydrogen 2.690 N/A ARG 68.A N ARG 18.A O no hydrogen 2.877 N/A LEU 70.A N ALA 16.A O no hydrogen 3.067 N/A SER 76.A N ASP 74.A OD1 no hydrogen 2.932 N/A SER 76.A OG ASP 74.A OD1 no hydrogen 2.644 N/A SER 76.A OG ASP 74.A OD2 no hydrogen 3.545 N/A LYS 77.A N ASP 216.A OD1 no hydrogen 2.984 N/A LYS 77.A NZ ASP 208.A O no hydrogen 3.430 N/A LYS 77.A NZ ASP 208.A OD1 no hydrogen 2.691 N/A LYS 77.A NZ ASP 216.A OD2 no hydrogen 2.809 N/A ALA 79.A N SER 76.A OG no hydrogen 3.391 N/A LEU 80.A N SER 76.A O no hydrogen 3.124 N/A ALA 81.A N LYS 77.A O no hydrogen 2.830 N/A ARG 82.A N ALA 78.A O no hydrogen 3.004 N/A ASP 83.A N ALA 79.A O no hydrogen 3.112 N/A GLN 84.A N LEU 80.A O no hydrogen 3.171 N/A GLN 84.A NE2 LEU 80.A O no hydrogen 3.109 N/A LEU 85.A N ALA 81.A O no hydrogen 3.096 N/A GLU 86.A N ARG 82.A O no hydrogen 2.987 N/A THR 87.A N ASP 83.A O no hydrogen 2.879 N/A THR 87.A OG1 ASP 83.A O no hydrogen 2.843 N/A MET 88.A N GLN 84.A O no hydrogen 2.972 N/A GLY 89.A N LEU 85.A O no hydrogen 2.905 N/A GLN 90.A N GLU 86.A O no hydrogen 2.951 N/A GLN 90.A NE2 HIS 13.A O no hydrogen 3.006 N/A LEU 91.A N THR 87.A O no hydrogen 3.036 N/A GLY 92.A N GLY 89.A O no hydrogen 3.056 N/A PHE 93.A N MET 88.A O no hydrogen 2.798 N/A ARG 95.A NH1.A ALA 293.A O no hydrogen 2.820 N/A ARG 95.A NH1.A LEU 294.A O no hydrogen 3.537 N/A ARG 95.A NH1.B PRO 116.A O no hydrogen 3.237 N/A ARG 95.A NH1.B GLN 117.A O no hydrogen 2.823 N/A ARG 95.A NH2.A ALA 293.A O no hydrogen 2.511 N/A PHE 96.A N ALA 118.A O no hydrogen 2.840 N/A ALA 97.A N PRO 29.A O no hydrogen 2.891 N/A VAL 98.A N ALA 121.A O no hydrogen 3.050 N/A ILE 99.A N LEU 31.A O no hydrogen 2.869 N/A GLY 100.A N VAL 123.A O no hydrogen 3.015 N/A HIS 101.A N LEU 33.A O no hydrogen 2.886 N/A HIS 101.A NE2 HIS 269.A O no hydrogen 2.841 N/A ASP 102.A N LEU 125.A O no hydrogen 3.334 N/A ARG 103.A N ASP 102.A OD1 no hydrogen 2.805 N/A ARG 103.A NE ASP 208.A OD1 no hydrogen 3.119 N/A ARG 103.A NE ASP 208.A OD2 no hydrogen 3.309 N/A ARG 103.A NH2 ASP 208.A OD1 no hydrogen 2.950 N/A GLY 104.A N HIS 101.A O no hydrogen 2.979 N/A ALA 105.A N ASP 102.A O no hydrogen 2.935 N/A ARG 106.A N ASP 102.A O no hydrogen 3.397 N/A ARG 106.A N ARG 103.A O no hydrogen 2.944 N/A ARG 106.A NH1 VAL 128.A O no hydrogen 2.799 N/A ARG 106.A NH1 ASN 133.A OD1 no hydrogen 3.108 N/A ARG 106.A NH2 VAL 128.A O no hydrogen 3.387 N/A ARG 106.A NH2 ASN 133.A OD1 no hydrogen 2.799 N/A VAL 107.A N ARG 103.A O no hydrogen 3.102 N/A GLY 108.A N GLY 104.A O no hydrogen 2.901 N/A TYR 109.A N ALA 105.A O no hydrogen 2.952 N/A TYR 109.A OH ASP 220.A OD1 no hydrogen 3.316 N/A TYR 109.A OH ASP 220.A OD2 no hydrogen 2.487 N/A ARG 110.A N ARG 106.A O no hydrogen 3.385 N/A ARG 110.A NH1 ASP 114.A OD1 no hydrogen 2.789 N/A ARG 110.A NH1 ASP 223.A OD2 no hydrogen 2.814 N/A ARG 110.A NH2 ASP 220.A OD1 no hydrogen 2.826 N/A ARG 110.A NH2 ASP 223.A OD2 no hydrogen 2.943 N/A LEU 111.A N VAL 107.A O no hydrogen 2.911 N/A ALA 112.A N GLY 108.A O no hydrogen 2.999 N/A LEU 113.A N TYR 109.A O no hydrogen 2.898 N/A ASP 114.A N ARG 110.A O no hydrogen 2.869 N/A HIS 115.A N LEU 111.A O no hydrogen 2.831 N/A ALA 118.A N HIS 115.A O no hydrogen 2.977 N/A ALA 120.A N PHE 96.A O no hydrogen 2.913 N/A PHE 122.A N PRO 233.A O no hydrogen 2.954 N/A VAL 123.A N VAL 98.A O no hydrogen 2.844 N/A SER 124.A N GLN 235.A O no hydrogen 2.863 N/A SER 124.A OG VAL 127.A O no hydrogen 2.719 N/A LEU 125.A N GLY 100.A O no hydrogen 2.856 N/A THR 126.A N LEU 237.A O no hydrogen 2.764 N/A THR 126.A OG1 LEU 125.A O no hydrogen 2.560 N/A ILE 130.A N TYR 109.A OH no hydrogen 3.047 N/A LEU 131.A N ASP 220.A OD2 no hydrogen 3.423 N/A ASP 132.A N PRO 129.A O no hydrogen 2.910 N/A ASN 133.A N PRO 129.A O no hydrogen 3.187 N/A TRP 134.A N ILE 130.A O no hydrogen 2.872 N/A TRP 134.A NE1 ALA 212.A O no hydrogen 3.018 N/A ALA 135.A N LEU 131.A O no hydrogen 3.254 N/A ALA 136.A N ASP 132.A O no hydrogen 3.277 N/A ALA 136.A N ASN 133.A O no hydrogen 3.116 N/A VAL 137.A N TRP 134.A O no hydrogen 3.309 N/A PHE 141.A N ASN 138.A OD1 no hydrogen 3.072 N/A ALA 142.A N ASN 138.A O no hydrogen 2.974 N/A LEU 143.A N LYS 139.A O no hydrogen 3.132 N/A ASN 144.A N VAL 140.A O no hydrogen 2.848 N/A ALA 145.A N PHE 141.A O no hydrogen 2.775 N/A TRP 148.A N ALA 145.A O no hydrogen 3.048 N/A PHE 149.A N TYR 146.A O no hydrogen 3.026 N/A LEU 150.A N TYR 146.A O no hydrogen 3.040 N/A LEU 151.A N HIS 147.A O no hydrogen 2.849 N/A GLN 153.A N LEU 150.A O no hydrogen 3.227 N/A GLN 153.A NE2 PHE 149.A O no hydrogen 2.834 N/A LEU 157.A N PRO 154.A O no hydrogen 3.001 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.891 N/A ARG 160.A N ASP 156.A O no hydrogen 2.995 N/A ARG 160.A NE ASP 156.A OD1 no hydrogen 3.080 N/A ARG 160.A NE ASP 156.A OD2 no hydrogen 2.948 N/A LEU 161.A N LEU 157.A O no hydrogen 3.192 N/A ILE 162.A N PRO 158.A O no hydrogen 2.865 N/A HIS 168.A N ASP 165.A OD1 no hydrogen 3.299 N/A PHE 169.A N ASP 165.A O no hydrogen 3.259 N/A LEU 170.A N PRO 166.A O no hydrogen 2.903 N/A ASP 171.A N GLU 167.A O no hydrogen 2.933 N/A TYR 172.A N HIS 168.A O no hydrogen 2.996 N/A THR 173.A N PHE 169.A O no hydrogen 3.009 N/A THR 173.A OG1 PHE 169.A O no hydrogen 2.796 N/A LEU 174.A N LEU 170.A O no hydrogen 2.913 N/A ARG 175.A N ASP 171.A O no hydrogen 2.815 N/A ARG 176.A N TYR 172.A O no hydrogen 2.887 N/A ARG 176.A NH1 TYR 172.A OH no hydrogen 2.866 N/A ARG 176.A NH2 LEU 143.A O no hydrogen 3.349 N/A ARG 176.A NH2 ASN 144.A O no hydrogen 3.119 N/A MET 177.A N THR 173.A O no hydrogen 2.833 N/A ALA 178.A N LEU 174.A O no hydrogen 3.067 N/A GLN 179.A N ARG 176.A O no hydrogen 3.031 N/A GLY 180.A N ARG 175.A O no hydrogen 2.910 N/A ARG 181.A N ALA 178.A O no hydrogen 3.032 N/A ILE 183.A N ARG 181.A O no hydrogen 2.885 N/A TYR 184.A OH LEU 174.A O no hydrogen 2.731 N/A GLN 187.A N HIS 185.A ND1 no hydrogen 3.125 N/A LEU 189.A N HIS 185.A O no hydrogen 2.937 N/A GLU 190.A N PRO 186.A O no hydrogen 3.418 N/A SER 191.A N ALA 188.A O no hydrogen 2.900 N/A TYR 192.A N ALA 188.A O no hydrogen 3.072 N/A TYR 192.A OH GLU 273.A OE2 no hydrogen 2.732 N/A ARG 193.A N LEU 189.A O no hydrogen 2.839 N/A ARG 193.A NE ASP 171.A OD1 no hydrogen 2.839 N/A ARG 193.A NH1 GLU 190.A OE2 no hydrogen 2.779 N/A ARG 193.A NH2 ASP 171.A OD1 no hydrogen 3.382 N/A ARG 193.A NH2 ASP 171.A OD2 no hydrogen 2.959 N/A ARG 194.A N.A GLU 190.A O no hydrogen 3.063 N/A ARG 194.A N.B GLU 190.A O no hydrogen 3.015 N/A ARG 194.A NH2.B GLY 65.A O no hydrogen 2.745 N/A ALA 195.A N SER 191.A O no hydrogen 3.188 N/A PHE 196.A N TYR 192.A O no hydrogen 3.212 N/A ARG 197.A N ARG 193.A O no hydrogen 3.033 N/A ARG 197.A NH1 GLU 167.A OE2 no hydrogen 2.684 N/A ASP 198.A N ALA 195.A O no hydrogen 2.887 N/A ALA 200.A N ASP 198.A OD1 no hydrogen 2.830 N/A ARG 202.A N ASP 198.A O no hydrogen 3.108 N/A ARG 202.A NH1 PHE 196.A O no hydrogen 2.814 N/A HIS 203.A N PRO 199.A O no hydrogen 2.930 N/A HIS 203.A ND1 GLU 159.A OE2 no hydrogen 2.768 N/A ALA 204.A N ALA 200.A O no hydrogen 3.034 N/A MET 205.A N VAL 201.A O no hydrogen 2.951 N/A CYS 206.A N ARG 202.A O no hydrogen 3.140 N/A CYS 206.A SG ARG 202.A O no hydrogen 3.459 N/A GLU 207.A N HIS 203.A O no hydrogen 3.007 N/A ASP 208.A N ALA 204.A O no hydrogen 3.016 N/A TYR 209.A N MET 205.A O no hydrogen 3.144 N/A ARG 210.A N CYS 206.A O no hydrogen 2.832 N/A ARG 210.A NE GLN 153.A O no hydrogen 2.837 N/A ARG 210.A NH1 GLU 159.A OE2 no hydrogen 2.769 N/A ARG 210.A NH1 GLU 207.A OE2 no hydrogen 2.891 N/A ARG 210.A NH2 GLN 153.A O no hydrogen 2.884 N/A ARG 210.A NH2 GLU 159.A OE1 no hydrogen 2.830 N/A ARG 210.A NH2 GLU 159.A OE2 no hydrogen 3.311 N/A ALA 211.A N GLU 207.A O no hydrogen 2.946 N/A ALA 212.A N ASP 208.A O no hydrogen 2.839 N/A VAL 213.A N TYR 209.A O no hydrogen 3.358 N/A GLY 214.A N ARG 210.A O no hydrogen 3.168 N/A GLY 214.A N ALA 211.A O no hydrogen 3.089 N/A ASP 216.A N ALA 211.A O no hydrogen 2.962 N/A ASP 218.A N GLY 214.A O no hydrogen 3.077 N/A ALA 219.A N VAL 215.A O no hydrogen 3.033 N/A ASP 220.A N ASP 216.A O no hydrogen 3.069 N/A GLN 221.A N ALA 217.A O no hydrogen 2.872 N/A GLN 221.A NE2 GLN 221.A O no hydrogen 3.393 N/A GLN 221.A NE2 ASP 225.A OD1 no hydrogen 3.066 N/A ALA 222.A N ASP 218.A O no hydrogen 2.971 N/A ASP 223.A N ALA 219.A O no hydrogen 3.041 N/A ARG 224.A N ASP 220.A O no hydrogen 2.954 N/A ARG 224.A NH1.B THR 255.A O no hydrogen 3.061 N/A ARG 224.A NH2.A ASP 132.A OD1 no hydrogen 2.932 N/A ASP 225.A N GLN 221.A O no hydrogen 2.689 N/A ALA 226.A N ALA 222.A O no hydrogen 3.035 N/A GLY 227.A N ARG 224.A O no hydrogen 2.959 N/A ARG 228.A N ASP 223.A O no hydrogen 2.863 N/A ARG 228.A NE LEU 113.A O no hydrogen 2.908 N/A ARG 228.A NH2 LEU 113.A O no hydrogen 2.925 N/A LEU 230.A N TRP 256.A O no hydrogen 2.974 N/A GLN 231.A NE2 ARG 229.A O no hydrogen 3.077 N/A CYS 232.A SG PRO 233.A O no hydrogen 3.656 N/A VAL 234.A N GLN 259.A O no hydrogen 2.961 N/A GLN 235.A N PHE 122.A O no hydrogen 2.957 N/A GLN 235.A NE2 HIS 282.A O no hydrogen 3.150 N/A VAL 236.A N GLU 261.A O no hydrogen 2.965 N/A LEU 237.A N SER 124.A O no hydrogen 2.909 N/A TRP 238.A N ALA 263.A O no hydrogen 3.141 N/A GLU 240.A N ILE 265.A O no hydrogen 3.061 N/A ARG 241.A NH1 PRO 242.A O no hydrogen 3.277 N/A TYR 243.A OH GLU 239.A O no hydrogen 2.781 N/A GLN 247.A N ALA 244.A O no hydrogen 2.900 N/A GLN 247.A NE2 ALA 245.A O no hydrogen 3.488 N/A LEU 250.A N HIS 248.A ND1 no hydrogen 3.118 N/A ILE 252.A N HIS 248.A O no hydrogen 2.921 N/A TRP 253.A N PRO 249.A O no hydrogen 3.031 N/A TRP 253.A NE1 VAL 127.A O no hydrogen 2.803 N/A LYS 254.A N LEU 250.A O no hydrogen 3.080 N/A THR 255.A N ILE 252.A O no hydrogen 2.892 N/A THR 255.A OG1 ILE 252.A O no hydrogen 2.489 N/A TRP 256.A N TRP 253.A O no hydrogen 2.810 N/A TRP 256.A NE1 ASP 132.A OD2 no hydrogen 2.880 N/A GLU 261.A N VAL 234.A O no hydrogen 2.823 N/A ALA 263.A N VAL 236.A O no hydrogen 3.050 N/A ILE 265.A N TRP 238.A O no hydrogen 2.689 N/A ALA 267.A N ILE 265.A O no hydrogen 2.898 N/A SER 268.A N ASP 274.A OD2 no hydrogen 2.778 N/A SER 268.A OG ASP 274.A OD2 no hydrogen 2.879 N/A HIS 269.A NE2 ASP 102.A OD2 no hydrogen 2.684 N/A MET 270.A N SER 268.A OG no hydrogen 3.170 N/A GLU 273.A N MET 270.A O no hydrogen 3.206 N/A ASP 274.A N MET 270.A O no hydrogen 2.963 N/A ALA 275.A N LEU 271.A O no hydrogen 3.016 N/A VAL 279.A N ALA 275.A O no hydrogen 3.034 N/A LEU 280.A N PRO 276.A O no hydrogen 2.892 N/A GLU 281.A N ASP 277.A O no hydrogen 2.981 N/A HIS 282.A N ALA 278.A O no hydrogen 3.256 N/A LEU 283.A N VAL 279.A O no hydrogen 2.811 N/A LEU 284.A N LEU 280.A O no hydrogen 2.821 N/A GLY 285.A N GLU 281.A O no hydrogen 3.125 N/A PHE 286.A N HIS 282.A O no hydrogen 3.001 N/A LEU 287.A N LEU 283.A O no hydrogen 2.985 N/A ALA 288.A N LEU 284.A O no hydrogen 2.987 N/A SER 289.A N GLY 285.A O no hydrogen 3.048 N/A SER 289.A OG.A GLY 285.A O no hydrogen 3.174 N/A SER 289.A OG.A PHE 286.A O no hydrogen 2.754 N/A SER 289.A OG.B GLY 285.A O no hydrogen 2.724 N/A HIS 290.A N PHE 286.A O no hydrogen 3.052 N/A HIS 290.A N LEU 287.A O no hydrogen 3.300 N/A HIS 290.A NE2 GLU 261.A OE2 no hydrogen 2.978 N/A ARG 291.A NH1 ALA 288.A O no hydrogen 2.782 N/A LEU 294.A N HIS 290.A O no hydrogen 3.335 N/A ARG 295.A N ARG 291.A O no hydrogen 3.230 N/A ARG 295.A N GLU 292.A O no hydrogen 3.170 N/A ARG 295.A NE GLU 292.A OE1 no hydrogen 3.073 N/A ARG 295.A NH2 GLU 292.A OE1 no hydrogen 3.282 N/A