Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8f4j_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 6.A N GLY 2.A O no hydrogen 3.156 N/A LEU 7.A N TRP 3.A O no hydrogen 2.865 N/A ASP 8.A N PHE 4.A O no hydrogen 2.842 N/A ASP 9.A N ASP 5.A O no hydrogen 2.949 N/A TRP 10.A N ILE 6.A O no hydrogen 3.167 N/A LEU 11.A N LEU 7.A O no hydrogen 2.844 N/A LYS 12.A N ASP 8.A O no hydrogen 3.075 N/A LYS 12.A N ASP 9.A O no hydrogen 3.315 N/A LYS 12.A NZ ASP 8.A OD1 no hydrogen 3.249 N/A LYS 12.A NZ ASP 8.A OD2 no hydrogen 3.333 N/A ARG 13.A N TRP 10.A O no hydrogen 3.488 N/A ARG 15.A NH1 TRP 10.A O no hydrogen 3.064 N/A ARG 15.A NH2 TRP 10.A O no hydrogen 3.322 N/A GLY 20.A N LEU 11.A O no hydrogen 2.824 N/A TRP 21.A N GLU 120.A OE2 no hydrogen 2.900 N/A TRP 21.A NE1 ASP 8.A OD1 no hydrogen 2.525 N/A SER 22.A N GLU 120.A OE1 no hydrogen 2.804 N/A SER 22.A OG GLU 120.A OE1 no hydrogen 2.650 N/A GLY 23.A N GLY 20.A O no hydrogen 3.144 N/A ILE 24.A N TRP 21.A O no hydrogen 3.124 N/A LEU 26.A N SER 22.A O no hydrogen 2.823 N/A PHE 27.A N GLY 23.A O no hydrogen 2.972 N/A CYS 29.A SG LEU 25.A O no hydrogen 3.525 N/A ALA 30.A N LEU 26.A O no hydrogen 2.767 N/A TYR 31.A N PHE 27.A O no hydrogen 3.074 N/A LEU 32.A N PRO 28.A O no hydrogen 2.875 N/A ALA 33.A N CYS 29.A O no hydrogen 2.945 N/A LEU 34.A N ALA 30.A O no hydrogen 2.993 N/A GLY 35.A N TYR 31.A O no hydrogen 2.730 N/A GLY 36.A N LEU 32.A O no hydrogen 2.698 N/A TRP 37.A N ALA 33.A O no hydrogen 3.025 N/A TRP 37.A NE1 PHE 162.A O no hydrogen 2.802 N/A LEU 38.A N LEU 34.A O no hydrogen 3.045 N/A THR 39.A N GLY 35.A O no hydrogen 2.840 N/A THR 39.A OG1 GLY 35.A O no hydrogen 2.823 N/A GLY 40.A N GLY 36.A O no hydrogen 2.922 N/A THR 41.A N TRP 37.A O no hydrogen 2.887 N/A THR 41.A OG1 TRP 37.A O no hydrogen 2.950 N/A THR 41.A OG1 LEU 38.A O no hydrogen 3.246 N/A THR 42.A N LEU 38.A O no hydrogen 3.017 N/A THR 42.A OG1 LEU 38.A O no hydrogen 2.897 N/A PHE 43.A N THR 39.A O no hydrogen 3.090 N/A VAL 44.A N GLY 40.A O no hydrogen 2.983 N/A THR 45.A OG1 LEU 52.A O no hydrogen 3.559 N/A THR 45.A OG1 GLU 58.A OE2 no hydrogen 2.803 N/A SER 46.A N LEU 52.A O no hydrogen 3.056 N/A SER 46.A OG SER 54.A OG no hydrogen 2.602 N/A SER 46.A OG SER 68.A OG no hydrogen 2.729 N/A TRP 47.A N THR 45.A OG1 no hydrogen 2.860 N/A THR 49.A OG1 SER 46.A O no hydrogen 3.425 N/A THR 49.A OG1 HIS 50.A ND1 no hydrogen 3.115 N/A HIS 50.A N SER 46.A O no hydrogen 2.807 N/A HIS 50.A ND1 THR 49.A OG1 no hydrogen 3.115 N/A GLY 51.A N TRP 47.A O no hydrogen 2.958 N/A LEU 52.A N SER 46.A O no hydrogen 3.362 N/A SER 54.A N GLU 58.A OE1 no hydrogen 2.976 N/A SER 54.A OG VAL 44.A O no hydrogen 3.207 N/A SER 54.A OG SER 46.A OG no hydrogen 2.602 N/A SER 54.A OG ALA 66.A O no hydrogen 3.505 N/A SER 55.A OG GLU 58.A OE1 no hydrogen 2.895 N/A TYR 56.A N THR 41.A O no hydrogen 2.901 N/A LEU 57.A N THR 42.A O no hydrogen 2.973 N/A GLU 58.A N SER 55.A O no hydrogen 3.076 N/A GLY 59.A N TYR 56.A O no hydrogen 3.088 N/A CYS 60.A N SER 55.A O no hydrogen 3.119 N/A ASN 61.A N THR 64.A OG1 no hydrogen 3.248 N/A LEU 63.A N ASN 61.A OD1 no hydrogen 2.766 N/A THR 64.A N ASN 61.A O no hydrogen 3.062 N/A VAL 65.A N ASN 61.A O no hydrogen 3.002 N/A ALA 66.A N SER 54.A O no hydrogen 2.966 N/A VAL 67.A N PHE 162.A O no hydrogen 3.013 N/A SER 68.A OG SER 46.A OG no hydrogen 2.729 N/A THR 69.A N SER 161.A OG no hydrogen 3.165 N/A THR 69.A OG1 PHE 157.A O no hydrogen 2.820 N/A MET 74.A N ALA 71.A O no hydrogen 3.019 N/A GLY 75.A N ASN 72.A O no hydrogen 3.023 N/A HIS 76.A NE2 PRO 150.A O no hydrogen 2.734 N/A SER 77.A N MET 74.A O no hydrogen 3.035 N/A SER 77.A OG GLU 85.A OE2 no hydrogen 2.777 N/A LEU 79.A N SER 77.A OG no hydrogen 2.854 N/A GLY 83.A N LEU 80.A O no hydrogen 2.896 N/A GLN 87.A N GLY 83.A O no hydrogen 2.886 N/A GLN 87.A NE2 PRO 84.A O no hydrogen 3.246 N/A GLY 88.A N LEU 81.A O no hydrogen 2.906 N/A ASP 89.A N ALA 86.A O no hydrogen 3.064 N/A ARG 92.A N ASP 89.A OD1 no hydrogen 3.124 N/A ARG 92.A NH1 GLN 95.A OE1 no hydrogen 2.770 N/A TRP 93.A N ASP 89.A O no hydrogen 2.982 N/A TRP 93.A NE1 LEU 79.A O no hydrogen 2.848 N/A CYS 94.A N PHE 90.A O no hydrogen 3.072 N/A CYS 94.A SG PHE 90.A O no hydrogen 3.539 N/A GLN 95.A N THR 91.A O no hydrogen 3.019 N/A LEU 96.A N ARG 92.A O no hydrogen 2.820 N/A GLY 97.A N CYS 94.A O no hydrogen 3.429 N/A GLY 98.A N TRP 93.A O no hydrogen 2.858 N/A TRP 100.A N GLY 97.A O no hydrogen 2.963 N/A TRP 100.A NE1 PRO 160.A O no hydrogen 3.016 N/A THR 101.A OG1 LEU 78.A O no hydrogen 3.037 N/A THR 101.A OG1 GLY 98.A O no hydrogen 3.082 N/A PHE 102.A N GLY 98.A O no hydrogen 2.967 N/A ILE 103.A N LEU 99.A O no hydrogen 2.922 N/A ALA 104.A N TRP 100.A O no hydrogen 2.838 N/A LEU 105.A N THR 101.A O no hydrogen 2.775 N/A HIS 106.A N PHE 102.A O no hydrogen 3.009 N/A HIS 106.A ND1 PHE 102.A O no hydrogen 2.703 N/A GLY 107.A N ILE 103.A O no hydrogen 2.763 N/A ALA 108.A N ALA 104.A O no hydrogen 2.836 N/A PHE 109.A N LEU 105.A O no hydrogen 3.090 N/A GLY 110.A N HIS 106.A O no hydrogen 2.785 N/A LEU 111.A N GLY 107.A O no hydrogen 2.849 N/A ILE 112.A N ALA 108.A O no hydrogen 3.126 N/A GLY 113.A N PHE 109.A O no hydrogen 2.961 N/A PHE 114.A N GLY 110.A O no hydrogen 2.831 N/A MET 115.A N LEU 111.A O no hydrogen 3.040 N/A LEU 116.A N ILE 112.A O no hydrogen 2.812 N/A ARG 117.A N GLY 113.A O no hydrogen 2.786 N/A ARG 117.A NH1 PHE 18.A O no hydrogen 2.878 N/A ARG 117.A NH2 PHE 18.A O no hydrogen 3.311 N/A GLN 118.A N PHE 114.A O no hydrogen 3.013 N/A GLN 118.A NE2 ASN 131.A OD1 no hydrogen 2.964 N/A PHE 119.A N MET 115.A O no hydrogen 3.030 N/A GLU 120.A N LEU 116.A O no hydrogen 2.718 N/A ILE 121.A N ARG 117.A O no hydrogen 2.907 N/A ALA 122.A N GLN 118.A O no hydrogen 3.214 N/A ARG 123.A N PHE 119.A O no hydrogen 3.043 N/A ARG 123.A NE ARG 123.A O no hydrogen 3.212 N/A LEU 124.A N GLU 120.A O no hydrogen 3.135 N/A VAL 125.A N ILE 121.A O no hydrogen 2.890 N/A GLY 126.A N ALA 122.A O no hydrogen 2.990 N/A VAL 127.A N ALA 122.A O no hydrogen 3.173 N/A ILE 133.A N PRO 129.A O no hydrogen 3.196 N/A ALA 134.A N TYR 130.A O no hydrogen 2.857 N/A PHE 135.A N ASN 131.A O no hydrogen 3.135 N/A SER 136.A N ILE 133.A O no hydrogen 2.990 N/A SER 136.A OG ILE 133.A O no hydrogen 2.744 N/A ALA 137.A N ALA 134.A O no hydrogen 3.184 N/A ILE 139.A N PHE 135.A O no hydrogen 3.400 N/A ALA 140.A N SER 136.A O no hydrogen 2.956 N/A VAL 141.A N ALA 137.A O no hydrogen 3.109 N/A PHE 142.A N PRO 138.A O no hydrogen 2.941 N/A VAL 143.A N ILE 139.A O no hydrogen 2.901 N/A SER 144.A N ALA 140.A O no hydrogen 3.001 N/A SER 144.A OG ALA 140.A O no hydrogen 2.795 N/A SER 144.A OG VAL 141.A O no hydrogen 3.172 N/A VAL 145.A N VAL 141.A O no hydrogen 2.927 N/A PHE 146.A N PHE 142.A O no hydrogen 2.843 N/A LEU 147.A N VAL 143.A O no hydrogen 2.961 N/A ILE 148.A N VAL 143.A O no hydrogen 2.767 N/A TYR 149.A N SER 144.A O no hydrogen 2.866 N/A TYR 149.A OH HIS 178.A NE2 no hydrogen 2.848 N/A LEU 151.A N LEU 147.A O no hydrogen 3.085 N/A GLY 152.A N ILE 148.A O no hydrogen 3.067 N/A GLY 152.A N TYR 149.A O no hydrogen 3.289 N/A GLN 153.A N PRO 150.A O no hydrogen 3.152 N/A GLN 153.A NE2 LEU 278.A O no hydrogen 3.200 N/A GLN 153.A NE2 ASN 281.A OD1 no hydrogen 2.904 N/A SER 154.A OG ASN 72.A OD1 no hydrogen 2.966 N/A SER 155.A OG ASN 72.A OD1 no hydrogen 2.644 N/A TRP 156.A N GLY 75.A O no hydrogen 3.222 N/A TRP 156.A NE1 SER 77.A O no hydrogen 2.861 N/A PHE 157.A N SER 155.A OG no hydrogen 3.088 N/A PHE 158.A N SER 155.A O no hydrogen 3.494 N/A ALA 159.A N TRP 156.A O no hydrogen 2.786 N/A PHE 162.A N VAL 67.A O no hydrogen 2.866 N/A GLY 163.A N SER 161.A O no hydrogen 3.048 N/A ALA 165.A N LEU 63.A O no hydrogen 2.859 N/A ILE 167.A N GLY 163.A O no hydrogen 3.025 N/A PHE 168.A N VAL 164.A O no hydrogen 3.157 N/A ARG 169.A N ALA 165.A O no hydrogen 2.855 N/A ARG 169.A NE ASP 322.A OD1 no hydrogen 2.800 N/A ARG 169.A NH2 ASP 322.A OD1 no hydrogen 3.465 N/A ARG 169.A NH2 ASP 322.A OD2 no hydrogen 2.854 N/A PHE 170.A N ALA 166.A O no hydrogen 3.047 N/A LEU 171.A N ILE 167.A O no hydrogen 2.925 N/A LEU 172.A N PHE 168.A O no hydrogen 3.106 N/A PHE 173.A N ARG 169.A O no hydrogen 2.852 N/A PHE 174.A N PHE 170.A O no hydrogen 3.075 N/A GLN 175.A N LEU 171.A O no hydrogen 3.218 N/A GLN 175.A NE2 ASN 179.A OD1 no hydrogen 3.004 N/A GLN 175.A NE2 ASN 311.A OD1 no hydrogen 2.839 N/A GLY 176.A N LEU 172.A O no hydrogen 3.031 N/A PHE 177.A N PHE 173.A O no hydrogen 2.922 N/A HIS 178.A N PHE 174.A O no hydrogen 3.044 N/A HIS 178.A NE2 TYR 149.A OH no hydrogen 2.848 N/A ASN 179.A N GLN 175.A O no hydrogen 3.027 N/A ASN 179.A ND2 TYR 285.A O no hydrogen 2.926 N/A TRP 180.A N PHE 174.A O no hydrogen 3.182 N/A THR 181.A OG1 GLN 175.A OE1 no hydrogen 2.586 N/A LEU 182.A N ASN 179.A O no hydrogen 3.001 N/A ASN 183.A N TRP 180.A O no hydrogen 3.007 N/A PHE 185.A N ASN 183.A OD1 no hydrogen 3.002 N/A MET 187.A N ASN 183.A O no hydrogen 3.080 N/A MET 188.A N PRO 184.A O no hydrogen 2.967 N/A GLY 189.A N PHE 185.A O no hydrogen 3.051 N/A VAL 190.A N HIS 186.A O no hydrogen 2.697 N/A ALA 191.A N MET 187.A O no hydrogen 2.917 N/A GLY 192.A N MET 188.A O no hydrogen 2.990 N/A VAL 193.A N GLY 189.A O no hydrogen 2.874 N/A LEU 194.A N VAL 190.A O no hydrogen 2.886 N/A GLY 195.A N ALA 191.A O no hydrogen 2.796 N/A GLY 196.A N GLY 192.A O no hydrogen 2.881 N/A ALA 197.A N VAL 193.A O no hydrogen 2.889 N/A LEU 198.A N LEU 194.A O no hydrogen 2.842 N/A LEU 199.A N GLY 195.A O no hydrogen 2.812 N/A CYS 200.A N GLY 196.A O no hydrogen 2.813 N/A ALA 201.A N ALA 197.A O no hydrogen 3.048 N/A ILE 202.A N LEU 198.A O no hydrogen 2.848 N/A HIS 203.A N LEU 199.A O no hydrogen 3.040 N/A GLY 204.A N CYS 200.A O no hydrogen 3.110 N/A ALA 205.A N ALA 201.A O no hydrogen 2.913 N/A THR 206.A N ILE 202.A O no hydrogen 2.942 N/A THR 206.A OG1 ILE 202.A O no hydrogen 2.692 N/A VAL 207.A N HIS 203.A O no hydrogen 3.088 N/A GLU 208.A N GLY 204.A O no hydrogen 3.113 N/A ASN 209.A N THR 206.A O no hydrogen 3.129 N/A ASN 209.A ND2 ALA 205.A O no hydrogen 2.951 N/A THR 210.A N VAL 207.A O no hydrogen 3.380 N/A THR 210.A OG1 THR 206.A O no hydrogen 2.768 N/A THR 210.A OG1 VAL 207.A O no hydrogen 3.562 N/A PHE 212.A N THR 232.A O no hydrogen 3.132 N/A GLN 213.A NE2 GLY 215.A O no hydrogen 3.271 N/A ALA 223.A N THR 220.A O no hydrogen 3.303 N/A ASN 225.A N GLN 228.A OE1 no hydrogen 2.825 N/A ASN 225.A ND2 THR 227.A OG1 no hydrogen 2.826 N/A THR 227.A N ASN 225.A OD1 no hydrogen 3.337 N/A GLN 228.A N ASN 225.A O no hydrogen 2.955 N/A GLN 228.A NE2 GLU 230.A O no hydrogen 2.942 N/A ALA 229.A N GLU 230.A OE2 no hydrogen 2.892 N/A SER 234.A N THR 210.A O no hydrogen 2.958 N/A THR 237.A N SER 234.A OG no hydrogen 2.943 N/A ALA 238.A N SER 234.A O no hydrogen 3.081 N/A ASN 239.A N MET 235.A O no hydrogen 2.920 N/A ASN 239.A ND2 PHE 250.A O no hydrogen 2.663 N/A ARG 240.A N VAL 236.A O no hydrogen 3.107 N/A ARG 240.A NE GLN 244.A OE1 no hydrogen 3.152 N/A PHE 241.A N THR 237.A O no hydrogen 2.904 N/A TRP 242.A N ALA 238.A O no hydrogen 3.120 N/A TRP 242.A NE1 THR 206.A OG1 no hydrogen 2.883 N/A SER 243.A N ASN 239.A O no hydrogen 2.921 N/A SER 243.A OG ASN 239.A O no hydrogen 2.790 N/A GLN 244.A N ARG 240.A O no hydrogen 3.093 N/A GLN 244.A N PHE 241.A O no hydrogen 3.152 N/A ILE 245.A N PHE 241.A O no hydrogen 2.808 N/A PHE 246.A N TRP 242.A O no hydrogen 2.767 N/A GLY 247.A N TRP 242.A O no hydrogen 3.277 N/A LYS 253.A NZ TYR 233.A OH no hydrogen 3.276 N/A TRP 255.A N ASN 252.A OD1 no hydrogen 3.018 N/A LEU 256.A N ASN 252.A O no hydrogen 2.998 N/A HIS 257.A N LYS 253.A O no hydrogen 3.168 N/A HIS 257.A ND1 LYS 253.A O no hydrogen 2.766 N/A PHE 258.A N ARG 254.A O no hydrogen 2.960 N/A PHE 259.A N TRP 255.A O no hydrogen 2.762 N/A MET 260.A N LEU 256.A O no hydrogen 3.012 N/A LEU 261.A N HIS 257.A O no hydrogen 3.146 N/A PHE 262.A N PHE 258.A O no hydrogen 2.745 N/A VAL 263.A N PHE 259.A O no hydrogen 2.939 N/A THR 266.A N PHE 262.A O no hydrogen 2.952 N/A THR 266.A OG1 PHE 262.A O no hydrogen 2.855 N/A GLY 267.A N VAL 263.A O no hydrogen 3.128 N/A LEU 268.A N PRO 264.A O no hydrogen 3.092 N/A TRP 269.A N VAL 265.A O no hydrogen 3.058 N/A TRP 269.A NE1 SER 136.A OG no hydrogen 3.023 N/A MET 270.A N THR 266.A O no hydrogen 2.915 N/A SER 271.A N GLY 267.A O no hydrogen 3.096 N/A SER 271.A OG LEU 268.A O no hydrogen 2.917 N/A ALA 272.A N LEU 268.A O no hydrogen 3.019 N/A ILE 273.A N TRP 269.A O no hydrogen 3.253 N/A GLY 274.A N MET 270.A O no hydrogen 3.336 N/A VAL 275.A N SER 271.A O no hydrogen 3.083 N/A VAL 276.A N ALA 272.A O no hydrogen 3.062 N/A GLY 277.A N ILE 273.A O no hydrogen 3.231 N/A LEU 278.A N GLY 274.A O no hydrogen 2.998 N/A ALA 279.A N VAL 275.A O no hydrogen 2.916 N/A ALA 279.A N VAL 276.A O no hydrogen 3.218 N/A LEU 280.A N GLY 277.A O no hydrogen 2.983 N/A ASN 281.A N LEU 278.A O no hydrogen 3.003 N/A LEU 282.A N GLY 277.A O no hydrogen 2.895 N/A ARG 283.A NE HIS 178.A ND1 no hydrogen 3.047 N/A PHE 287.A N TYR 304.A OH no hydrogen 2.932 N/A GLU 291.A N PHE 287.A O no hydrogen 3.291 N/A ILE 292.A N ILE 288.A O no hydrogen 2.960 N/A ARG 293.A N SER 289.A O no hydrogen 3.187 N/A ARG 293.A NE ASP 297.A OD2 no hydrogen 2.819 N/A ARG 293.A NH2 ASP 297.A OD2 no hydrogen 3.038 N/A ALA 294.A N GLN 290.A O no hydrogen 2.893 N/A ALA 295.A N GLU 291.A O no hydrogen 2.930 N/A GLU 296.A N ILE 292.A O no hydrogen 3.410 N/A GLU 296.A N ARG 293.A O no hydrogen 3.187 N/A ASP 297.A N ARG 293.A O no hydrogen 2.891 N/A GLU 299.A N ASP 297.A OD1 no hydrogen 3.021 N/A PHE 300.A N ASP 297.A O no hydrogen 3.088 N/A THR 302.A N THR 305.A OG1 no hydrogen 3.160 N/A THR 302.A OG1 GLN 290.A OE1 no hydrogen 3.078 N/A TYR 304.A N THR 302.A OG1 no hydrogen 3.082 N/A TYR 304.A OH GLU 291.A OE2 no hydrogen 2.463 N/A THR 305.A N THR 302.A OG1 no hydrogen 3.273 N/A THR 305.A OG1 THR 302.A O no hydrogen 3.073 N/A LYS 306.A N THR 302.A O no hydrogen 3.068 N/A ASN 307.A N PHE 303.A O no hydrogen 3.101 N/A LEU 308.A N TYR 304.A O no hydrogen 3.329 N/A LEU 309.A N THR 305.A O no hydrogen 3.369 N/A LEU 310.A N LYS 306.A O no hydrogen 3.397 N/A ASN 311.A N ASN 307.A O no hydrogen 2.939 N/A GLU 312.A N LEU 308.A O no hydrogen 2.820 N/A GLY 313.A N LEU 309.A O no hydrogen 3.064 N/A ILE 314.A N LEU 310.A O no hydrogen 3.003 N/A ARG 315.A N ASN 311.A O no hydrogen 2.988 N/A ARG 315.A NH1 GLY 176.A O no hydrogen 2.779 N/A ARG 315.A NH1 TYR 285.A OH no hydrogen 2.805 N/A ALA 316.A N GLU 312.A O no hydrogen 3.227 N/A TRP 317.A N GLY 313.A O no hydrogen 3.072 N/A TRP 317.A NE1 PRO 336.A O no hydrogen 3.132 N/A MET 318.A N ILE 314.A O no hydrogen 3.016 N/A ALA 319.A N ARG 315.A O no hydrogen 2.975 N/A ASP 322.A N MET 318.A O no hydrogen 2.843 N/A GLN 323.A N ALA 319.A O no hydrogen 2.880 N/A GLU 326.A N GLN 323.A O no hydrogen 3.089 N/A ASN 327.A N PRO 324.A O no hydrogen 3.334 N/A VAL 334.A N PRO 331.A O no hydrogen 3.000 N/A LEU 335.A N GLU 332.A O no hydrogen 3.307 N/A ARG 337.A NE LEU 341.A O.C no hydrogen 3.195 N/A ARG 337.A NE LEU 341.A OXT.A no hydrogen 2.977 N/A ARG 337.A NH2 LEU 341.A O.A no hydrogen 2.995 N/A ARG 337.A NH2 LEU 341.A O.B no hydrogen 2.833 N/A ARG 337.A NH2 LEU 341.A O.C no hydrogen 2.771 N/A LEU 341.A N.A ASN 339.A O no hydrogen 2.550 N/A LEU 341.A N.B ASN 339.A O no hydrogen 2.684 N/A LEU 341.A N.C ASN 339.A O no hydrogen 2.619 N/A