Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ut9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N THR 88.A O no hydrogen 2.836 N/A VAL 7.A N TYR 90.A O no hydrogen 2.993 N/A ARG 8.A N THR 23.A O no hydrogen 2.673 N/A ARG 8.A NE PRO 5.A O no hydrogen 2.669 N/A ARG 8.A NH1 ASN 507.A O no hydrogen 3.109 N/A ARG 8.A NH2 PRO 5.A O no hydrogen 3.357 N/A ASN 10.A N TYR 14.A OH no hydrogen 3.034 N/A ASN 10.A ND2 TYR 101.A OH no hydrogen 3.249 N/A GLN 11.A N LEU 504.A O no hydrogen 2.928 N/A GLN 11.A NE2 ASP 510.A O no hydrogen 2.917 N/A GLN 11.A NE2 ASP 510.A OD2 no hydrogen 3.089 N/A VAL 12.A N ASN 10.A OD1 no hydrogen 2.965 N/A GLY 13.A N ASN 10.A OD1 no hydrogen 2.965 N/A TYR 14.A N ASP 95.A O no hydrogen 2.907 N/A LYS 19.A N ASP 494.A OD1 no hydrogen 3.025 N/A LYS 20.A N SER 68.A OG no hydrogen 2.824 N/A LYS 20.A NZ PRO 16.A O no hydrogen 2.630 N/A LYS 20.A NZ GLY 18.A O no hydrogen 3.144 N/A LYS 20.A NZ SER 68.A O no hydrogen 2.937 N/A LYS 20.A NZ PHE 70.A O no hydrogen 2.779 N/A ALA 22.A N LEU 65.A O no hydrogen 2.918 N/A THR 23.A N ARG 8.A O no hydrogen 3.107 N/A THR 23.A OG1 GLY 450.A O no hydrogen 2.705 N/A VAL 24.A N HIS 63.A O no hydrogen 2.878 N/A VAL 25.A N ASP 6.A O no hydrogen 2.815 N/A CYS 26.A N TYR 61.A O no hydrogen 2.964 N/A SER 28.A OG GLN 30.A O no hydrogen 2.537 N/A GLN 30.A N SER 28.A OG no hydrogen 3.116 N/A VAL 32.A N THR 49.A OG1 no hydrogen 2.999 N/A TRP 34.A N GLY 47.A O no hydrogen 2.893 N/A GLN 35.A N GLU 80.A O no hydrogen 2.960 N/A LEU 36.A N LEU 45.A O no hydrogen 2.758 N/A LYS 37.A N TYR 78.A O no hydrogen 2.944 N/A LYS 37.A NZ GLU 80.A OE1 no hydrogen 2.455 N/A ASN 38.A N VAL 42.A O no hydrogen 2.961 N/A GLY 41.A N ASN 38.A O no hydrogen 2.855 N/A VAL 44.A N LEU 36.A O no hydrogen 2.792 N/A GLY 47.A N TRP 34.A O no hydrogen 3.086 N/A THR 49.A N VAL 32.A O no hydrogen 2.934 N/A THR 49.A OG1 VAL 32.A O no hydrogen 3.505 N/A GLU 50.A N TRP 64.A O no hydrogen 2.874 N/A LYS 52.A N VAL 62.A O no hydrogen 2.857 N/A ASP 55.A N ASP 60.A O no hydrogen 2.788 N/A SER 58.A N ASP 55.A O no hydrogen 3.379 N/A SER 58.A OG ASP 55.A O no hydrogen 3.550 N/A SER 58.A OG ASP 55.A OD2 no hydrogen 2.695 N/A GLN 59.A N ASP 55.A O no hydrogen 2.711 N/A GLN 59.A NE2 LYS 56.A O no hydrogen 3.049 N/A ASP 60.A N SER 58.A OG no hydrogen 3.138 N/A VAL 62.A N GLY 53.A O no hydrogen 3.048 N/A HIS 63.A N VAL 24.A O no hydrogen 2.873 N/A HIS 63.A NE2 GLN 30.A O no hydrogen 3.324 N/A TRP 64.A N GLU 50.A O no hydrogen 2.856 N/A TRP 64.A NE1 GLY 450.A O no hydrogen 2.908 N/A LEU 65.A N ALA 22.A O no hydrogen 2.840 N/A PHE 67.A N LYS 20.A O no hydrogen 3.002 N/A SER 68.A N ASP 66.A OD1 no hydrogen 3.027 N/A SER 68.A OG LYS 20.A O no hydrogen 3.549 N/A SER 68.A OG ASP 66.A OD1 no hydrogen 2.720 N/A PHE 70.A N PHE 67.A O no hydrogen 2.999 N/A GLY 74.A N ILE 96.A O no hydrogen 2.909 N/A GLY 76.A N ASP 95.A OD1 no hydrogen 2.971 N/A TYR 77.A OH THR 72.A O no hydrogen 2.583 N/A TYR 78.A N LYS 37.A O no hydrogen 3.015 N/A PHE 79.A N SER 91.A OG no hydrogen 3.016 N/A GLU 80.A N GLN 35.A O no hydrogen 2.924 N/A LEU 81.A N ASN 89.A O no hydrogen 2.869 N/A VAL 84.A N LEU 81.A O no hydrogen 3.128 N/A SER 86.A N VAL 84.A O no hydrogen 3.194 N/A SER 86.A OG ASP 6.A OD2 no hydrogen 2.601 N/A SER 86.A OG THR 88.A OG1 no hydrogen 3.320 N/A THR 88.A N SER 86.A OG no hydrogen 3.046 N/A THR 88.A OG1 ASP 6.A OD1 no hydrogen 2.838 N/A THR 88.A OG1 SER 86.A OG no hydrogen 3.320 N/A ASN 89.A ND2 LEU 81.A O no hydrogen 2.950 N/A TYR 90.A N THR 88.A O no hydrogen 2.845 N/A SER 91.A N PHE 79.A O no hydrogen 3.069 N/A SER 91.A OG HIS 92.A O no hydrogen 2.758 N/A PHE 94.A N TYR 77.A O no hydrogen 2.812 N/A ASP 95.A N VAL 12.A O no hydrogen 3.051 N/A ILE 96.A N GLY 74.A O no hydrogen 2.959 N/A ARG 97.A N TYR 14.A O no hydrogen 3.074 N/A ARG 97.A NE ASP 95.A OD2 no hydrogen 2.886 N/A ARG 97.A NH1 ASP 99.A OD1 no hydrogen 2.729 N/A ARG 97.A NH2 ASP 95.A OD2 no hydrogen 3.421 N/A THR 102.A N ASP 99.A O no hydrogen 3.371 N/A THR 102.A OG1 ASP 601.A OD2 no hydrogen 2.588 N/A LYS 105.A N TYR 101.A O no hydrogen 3.181 N/A LYS 105.A NZ THR 102.A O no hydrogen 2.848 N/A LYS 105.A NZ ASP 601.A OD1 no hydrogen 2.784 N/A ASP 107.A N GLN 103.A O no hydrogen 3.017 N/A ALA 108.A N MET 104.A O no hydrogen 2.860 N/A LEU 109.A N LYS 105.A O no hydrogen 3.335 N/A ALA 110.A N TYR 106.A O no hydrogen 2.955 N/A PHE 112.A N LEU 109.A O no hydrogen 3.179 N/A HIS 114.A N ALA 110.A O no hydrogen 3.061 N/A LYS 115.A N PHE 111.A O no hydrogen 2.951 N/A LYS 115.A N PHE 112.A O no hydrogen 3.171 N/A LYS 115.A NZ ALA 177.A O no hydrogen 3.003 N/A ARG 116.A N TYR 113.A O no hydrogen 3.065 N/A ARG 116.A NE GLU 232.A OE1 no hydrogen 3.386 N/A ARG 116.A NE GLU 232.A OE2 no hydrogen 2.921 N/A ARG 116.A NH1 GLU 232.A OE1 no hydrogen 2.798 N/A ARG 116.A NH2 GLU 221.A OE2 no hydrogen 2.695 N/A SER 117.A N GLY 173.A O no hydrogen 2.780 N/A SER 117.A OG GLY 136.A O no hydrogen 3.212 N/A SER 117.A OG TYR 175.A OH no hydrogen 2.724 N/A GLY 118.A N GLY 136.A O no hydrogen 2.949 N/A ILE 121.A N ARG 133.A O no hydrogen 2.856 N/A GLU 122.A N TYR 113.A OH no hydrogen 3.126 N/A ALA 126.A N GLU 122.A O no hydrogen 2.809 N/A GLY 127.A N PRO 124.A O no hydrogen 3.204 N/A TRP 131.A N GLY 128.A O no hydrogen 2.923 N/A TRP 131.A NE1 ALA 540.A O no hydrogen 2.683 N/A THR 132.A N GLU 129.A O no hydrogen 3.226 N/A THR 132.A OG1 ILE 121.A O no hydrogen 3.084 N/A ARG 133.A N ILE 121.A O no hydrogen 3.027 N/A ARG 133.A NH1 PRO 134.A O no hydrogen 3.171 N/A ARG 133.A NH2 HIS 114.A O no hydrogen 2.921 N/A ARG 133.A NH2 ARG 116.A O no hydrogen 2.942 N/A HIS 137.A ND1 TYR 175.A OH no hydrogen 2.706 N/A HIS 137.A NE2 ASP 276.A OD2 no hydrogen 2.933 N/A GLY 139.A N GLY 145.A O no hydrogen 2.851 N/A ASN 143.A N ILE 140.A O no hydrogen 3.123 N/A LYS 144.A NZ GLU 141.A OE2 no hydrogen 3.543 N/A ASP 146.A N HIS 137.A O no hydrogen 2.887 N/A VAL 149.A N LYS 168.A O no hydrogen 2.876 N/A THR 151.A N TYR 166.A O no hydrogen 3.040 N/A THR 151.A OG1 LYS 164.A O no hydrogen 2.719 N/A TRP 152.A N LEU 282.A O no hydrogen 2.942 N/A TRP 152.A NE1 ASP 156.A OD2 no hydrogen 2.784 N/A ASP 156.A N PRO 153.A O no hydrogen 3.138 N/A ALA 159.A N ASP 156.A O no hydrogen 3.095 N/A GLN 163.A NE2 LEU 282.A O no hydrogen 3.226 N/A TYR 166.A OH HIS 258.A NE2 no hydrogen 2.763 N/A LYS 168.A N VAL 149.A O no hydrogen 3.057 N/A LYS 168.A NZ LYS 242.A O no hydrogen 3.001 N/A LYS 168.A NZ GLN 244.A O no hydrogen 2.766 N/A LYS 168.A NZ GLU 249.A OE1 no hydrogen 3.026 N/A LYS 168.A NZ GLU 249.A OE2 no hydrogen 2.777 N/A VAL 170.A N ASP 146.A O no hydrogen 2.869 N/A THR 171.A N ASP 169.A OD1 no hydrogen 3.023 N/A THR 171.A OG1 ASP 169.A OD1 no hydrogen 2.884 N/A TRP 174.A N GLU 236.A OE1 no hydrogen 2.950 N/A TRP 174.A NE1 GLU 232.A OE2 no hydrogen 3.046 N/A TYR 175.A N LYS 115.A O no hydrogen 2.715 N/A TYR 175.A OH HIS 137.A ND1 no hydrogen 2.706 N/A ASP 176.A N GLY 181.A O no hydrogen 3.020 N/A GLY 178.A N GLU 584.A OE2 no hydrogen 3.275 N/A GLY 181.A N ASP 179.A OD2 no hydrogen 3.003 N/A LYS 182.A N ILE 261.A O no hydrogen 2.987 N/A LYS 182.A NZ ASP 146.A OD2 no hydrogen 2.809 N/A LYS 182.A NZ VAL 170.A O no hydrogen 2.726 N/A LYS 182.A NZ GLY 172.A O no hydrogen 2.895 N/A TYR 183.A OH ASP 179.A OD2 no hydrogen 2.740 N/A VAL 184.A N HIS 259.A O no hydrogen 3.017 N/A GLY 187.A N TYR 183.A O no hydrogen 3.149 N/A ALA 190.A N ASN 186.A O no hydrogen 3.226 N/A VAL 191.A N GLY 187.A O no hydrogen 2.940 N/A TRP 192.A N GLY 188.A O no hydrogen 2.878 N/A TRP 192.A NE1 GLU 363.A OE2 no hydrogen 2.799 N/A THR 193.A N ILE 189.A O no hydrogen 2.937 N/A THR 193.A OG1 ILE 189.A O no hydrogen 2.674 N/A LEU 194.A N ALA 190.A O no hydrogen 3.168 N/A MET 195.A N VAL 191.A O no hydrogen 3.033 N/A ASN 196.A N TRP 192.A O no hydrogen 2.760 N/A ASN 196.A ND2 TYR 482.A OH no hydrogen 2.616 N/A MET 197.A N THR 193.A O no hydrogen 3.096 N/A TYR 198.A N LEU 194.A O no hydrogen 3.293 N/A GLU 199.A N MET 195.A O no hydrogen 2.852 N/A ARG 200.A N ASN 196.A O no hydrogen 2.889 N/A ARG 200.A NE ASP 485.A OD2 no hydrogen 2.656 N/A ARG 200.A NH1 GLN 602.A OE1 no hydrogen 2.868 N/A ARG 200.A NH2 ASP 485.A OD1 no hydrogen 3.162 N/A ARG 200.A NH2 ASP 485.A OD2 no hydrogen 3.450 N/A ALA 201.A N MET 197.A O no hydrogen 3.129 N/A LYS 202.A N TYR 198.A O no hydrogen 2.912 N/A ILE 203.A N GLU 199.A O no hydrogen 2.974 N/A ARG 204.A N ARG 200.A O no hydrogen 2.985 N/A GLY 205.A N LYS 202.A O no hydrogen 2.993 N/A LEU 206.A N ALA 201.A O no hydrogen 2.642 N/A TRP 209.A N LEU 206.A O no hydrogen 3.051 N/A TYR 212.A N TRP 209.A O no hydrogen 3.158 N/A GLY 215.A N ASP 228.A OD1 no hydrogen 3.059 N/A GLY 216.A N ARG 213.A O no hydrogen 2.978 N/A MET 217.A N ASP 228.A OD2 no hydrogen 2.840 N/A ASN 218.A ND2 GLN 222.A OE1 no hydrogen 3.407 N/A ILE 219.A N MET 217.A O no hydrogen 2.952 N/A GLN 222.A N ILE 219.A O no hydrogen 3.098 N/A ASN 224.A N ASP 214.A OD2 no hydrogen 3.187 N/A ASN 224.A ND2 ASP 231.A OD1 no hydrogen 2.913 N/A ASN 224.A ND2 ASP 231.A OD2 no hydrogen 3.486 N/A GLY 225.A N ASP 214.A OD1 no hydrogen 2.744 N/A TYR 226.A N ASN 224.A OD1 no hydrogen 2.864 N/A ASP 228.A N ARG 213.A O no hydrogen 3.205 N/A ILE 229.A N PRO 211.A O no hydrogen 3.220 N/A ASP 231.A N PRO 227.A O no hydrogen 3.012 N/A GLU 232.A N ASP 228.A O no hydrogen 3.032 N/A ALA 233.A N ILE 229.A O no hydrogen 3.015 N/A ARG 234.A N LEU 230.A O no hydrogen 2.718 N/A ARG 234.A NE GLU 238.A OE1 no hydrogen 3.133 N/A ARG 234.A NH1 ASP 308.A OD2 no hydrogen 2.846 N/A ARG 234.A NH2 ASP 308.A OD2 no hydrogen 3.119 N/A TRP 235.A N ASP 231.A O no hydrogen 3.170 N/A TRP 235.A NE1 GLY 173.A O no hydrogen 3.157 N/A ILE 237.A N ALA 233.A O no hydrogen 3.044 N/A GLU 238.A N ARG 234.A O no hydrogen 2.815 N/A PHE 240.A N GLU 236.A O no hydrogen 2.920 N/A LYS 241.A N ILE 237.A O no hydrogen 3.091 N/A LYS 241.A NZ ASP 314.A OD1 no hydrogen 3.051 N/A LYS 242.A N GLU 238.A O no hydrogen 3.459 N/A MET 243.A N PHE 239.A O no hydrogen 3.241 N/A MET 243.A N PHE 240.A O no hydrogen 2.908 N/A GLN 244.A N LYS 241.A O no hydrogen 3.311 N/A VAL 245.A N MET 256.A O no hydrogen 2.933 N/A THR 246.A N GLU 249.A OE1 no hydrogen 2.877 N/A GLU 249.A N THR 246.A O no hydrogen 3.062 N/A GLU 249.A N THR 246.A OG1 no hydrogen 3.247 N/A ASP 250.A N THR 246.A O no hydrogen 3.133 N/A SER 252.A N ASP 250.A OD1 no hydrogen 3.052 N/A SER 252.A OG ASP 250.A OD1 no hydrogen 2.564 N/A SER 252.A OG ASP 250.A OD2 no hydrogen 3.486 N/A ILE 253.A N ASP 250.A O no hydrogen 3.164 N/A GLY 255.A N VAL 245.A O no hydrogen 2.882 N/A MET 256.A N ILE 253.A O no hydrogen 2.915 N/A VAL 257.A N THR 290.A OG1 no hydrogen 2.898 N/A HIS 258.A N MET 243.A O no hydrogen 3.075 N/A HIS 258.A ND1 ARG 283.A O no hydrogen 2.619 N/A HIS 258.A NE2 TYR 166.A OH no hydrogen 2.763 N/A HIS 259.A N PRO 284.A O no hydrogen 3.102 N/A LYS 260.A NZ GLY 345.A O no hydrogen 3.415 N/A LYS 260.A NZ GLY 346.A O no hydrogen 2.809 N/A ILE 261.A N LYS 182.A O no hydrogen 2.921 N/A HIS 262.A N TYR 281.A O no hydrogen 3.355 N/A PHE 264.A N PRO 279.A O no hydrogen 2.951 N/A ARG 265.A N GLN 278.A OE1 no hydrogen 2.888 N/A ARG 265.A NH1 ASP 156.A OD2 no hydrogen 3.110 N/A ARG 265.A NH1 PHE 264.A O no hydrogen 3.086 N/A ARG 265.A NH2 ASP 156.A OD1 no hydrogen 2.830 N/A GLY 270.A N ARG 528.A O no hydrogen 2.927 N/A MET 271.A N ARG 528.A O no hydrogen 2.913 N/A LEU 272.A N GLU 275.A OE2 no hydrogen 2.833 N/A GLU 275.A N LEU 272.A O no hydrogen 2.792 N/A ASP 276.A N PRO 273.A O no hydrogen 3.245 N/A GLN 278.A N ASP 276.A OD1 no hydrogen 3.012 N/A ARG 280.A NE ASP 146.A OD1 no hydrogen 2.890 N/A ARG 280.A NH1 ASP 146.A OD1 no hydrogen 3.467 N/A ARG 280.A NH1 ASP 146.A OD2 no hydrogen 2.902 N/A ARG 280.A NH1 HIS 180.A O no hydrogen 3.007 N/A ARG 280.A NH2 HIS 180.A O no hydrogen 2.939 N/A ARG 280.A NH2 ASP 263.A OD1 no hydrogen 3.049 N/A TYR 281.A N HIS 262.A O no hydrogen 3.159 N/A LEU 282.A N PRO 150.A O no hydrogen 2.843 N/A ARG 283.A N LYS 260.A O no hydrogen 2.983 N/A ARG 283.A NH1 TYR 158.A O no hydrogen 3.137 N/A ARG 283.A NH1 GLU 335.A OE2 no hydrogen 3.546 N/A ARG 283.A NH2 TYR 158.A O no hydrogen 2.694 N/A SER 286.A N VAL 257.A O no hydrogen 3.264 N/A THR 287.A N ILE 332.A O no hydrogen 2.836 N/A THR 287.A OG1 HIS 329.A O no hydrogen 2.622 N/A THR 287.A OG1 ILE 332.A O no hydrogen 3.260 N/A ALA 289.A N SER 286.A OG no hydrogen 2.988 N/A THR 290.A N SER 286.A O no hydrogen 3.033 N/A THR 290.A OG1 SER 286.A O no hydrogen 2.833 N/A LEU 291.A N THR 287.A O no hydrogen 2.950 N/A ASN 292.A N ALA 288.A O no hydrogen 2.864 N/A PHE 293.A N ALA 289.A O no hydrogen 2.898 N/A ALA 294.A N THR 290.A O no hydrogen 2.945 N/A ALA 295.A N LEU 291.A O no hydrogen 2.806 N/A THR 296.A N ASN 292.A O no hydrogen 3.033 N/A THR 296.A OG1 ASN 292.A O no hydrogen 2.848 N/A THR 296.A OG1 PHE 293.A O no hydrogen 3.534 N/A LEU 297.A N PHE 293.A O no hydrogen 2.977 N/A ALA 298.A N ALA 294.A O no hydrogen 3.165 N/A GLN 299.A N ALA 295.A O no hydrogen 3.107 N/A GLN 299.A NE2 TRP 192.A O no hydrogen 3.313 N/A SER 300.A N THR 296.A O no hydrogen 2.749 N/A ALA 301.A N LEU 297.A O no hydrogen 2.816 N/A ARG 302.A N ALA 298.A O no hydrogen 3.357 N/A ARG 302.A NE GLU 199.A OE1 no hydrogen 2.813 N/A ARG 302.A NH1 GLU 363.A OE1 no hydrogen 2.873 N/A ARG 302.A NH1 THR 367.A OG1 no hydrogen 3.044 N/A ARG 302.A NH2 GLU 199.A OE2 no hydrogen 2.929 N/A ARG 302.A NH2 GLU 363.A OE1 no hydrogen 2.714 N/A LEU 303.A N GLN 299.A O no hydrogen 3.166 N/A TRP 304.A N SER 300.A O no hydrogen 2.965 N/A ASP 308.A N TRP 304.A O no hydrogen 2.824 N/A PHE 311.A N ASP 308.A OD1 no hydrogen 3.300 N/A ALA 312.A N ASP 308.A O no hydrogen 2.931 N/A ALA 313.A N PRO 309.A O no hydrogen 2.779 N/A ASP 314.A N THR 310.A O no hydrogen 3.091 N/A CYS 315.A N PHE 311.A O no hydrogen 2.867 N/A CYS 315.A SG SER 300.A OG no hydrogen 3.348 N/A CYS 315.A SG PHE 311.A O no hydrogen 3.481 N/A LEU 316.A N ALA 312.A O no hydrogen 3.007 N/A GLU 317.A N ALA 313.A O no hydrogen 2.942 N/A LYS 318.A N ASP 314.A O no hydrogen 3.002 N/A LYS 318.A NZ ASP 314.A OD2 no hydrogen 3.175 N/A ALA 319.A N CYS 315.A O no hydrogen 2.966 N/A GLU 320.A N LEU 316.A O no hydrogen 2.961 N/A ILE 321.A N GLU 317.A O no hydrogen 3.216 N/A ALA 322.A N LYS 318.A O no hydrogen 2.974 N/A TRP 323.A N ALA 319.A O no hydrogen 2.951 N/A GLN 324.A N GLU 320.A O no hydrogen 3.125 N/A ALA 325.A N ILE 321.A O no hydrogen 3.115 N/A ALA 326.A N ALA 322.A O no hydrogen 2.919 N/A LEU 327.A N TRP 323.A O no hydrogen 3.111 N/A LYS 328.A N GLN 324.A O no hydrogen 3.329 N/A LYS 328.A N ALA 325.A O no hydrogen 3.123 N/A HIS 329.A N ALA 326.A O no hydrogen 3.021 N/A HIS 329.A ND1 ALA 325.A O no hydrogen 3.199 N/A ILE 332.A N THR 287.A OG1 no hydrogen 3.063 N/A GLU 335.A N GLU 335.A OE2 no hydrogen 2.713 N/A GLY 344.A N ASP 263.A O no hydrogen 3.127 N/A GLY 344.A N PHE 264.A O no hydrogen 3.079 N/A GLY 345.A N PRO 343.A O no hydrogen 2.897 N/A GLY 346.A N TYR 183.A OH no hydrogen 3.108 N/A TYR 348.A OH ASP 176.A OD1 no hydrogen 2.632 N/A ASP 350.A N ALA 334.A O no hydrogen 3.373 N/A TYR 352.A N ASP 350.A OD1 no hydrogen 3.102 N/A TYR 352.A OH HIS 382.A NE2 no hydrogen 2.635 N/A GLU 356.A N GLU 356.A OE1 no hydrogen 2.886 N/A PHE 357.A N VAL 353.A O no hydrogen 3.005 N/A TYR 358.A N GLY 354.A O no hydrogen 3.205 N/A TYR 358.A OH THR 413.A OG1 no hydrogen 2.905 N/A TRP 359.A N ASP 355.A O no hydrogen 2.844 N/A ALA 360.A N GLU 356.A O no hydrogen 2.820 N/A ALA 361.A N PHE 357.A O no hydrogen 2.950 N/A CYS 362.A N TYR 358.A O no hydrogen 2.907 N/A CYS 362.A SG TYR 358.A O no hydrogen 3.306 N/A GLU 363.A N TRP 359.A O no hydrogen 3.100 N/A LEU 364.A N ALA 360.A O no hydrogen 2.877 N/A TYR 365.A N ALA 361.A O no hydrogen 2.857 N/A VAL 366.A N CYS 362.A O no hydrogen 3.028 N/A THR 367.A N GLU 363.A O no hydrogen 2.969 N/A THR 367.A OG1 ALA 298.A O no hydrogen 2.584 N/A THR 367.A OG1 GLU 363.A O no hydrogen 3.194 N/A THR 368.A N LEU 364.A O no hydrogen 2.885 N/A THR 368.A OG1 LEU 364.A O no hydrogen 2.676 N/A GLY 369.A N TYR 365.A O no hydrogen 2.681 N/A LYS 370.A N THR 368.A OG1 no hydrogen 3.248 N/A LYS 370.A NZ GLU 320.A OE2 no hydrogen 2.665 N/A TYR 373.A N LYS 370.A O no hydrogen 3.230 N/A TYR 373.A OH GLU 320.A OE2 no hydrogen 2.534 N/A LYS 374.A N LYS 370.A O no hydrogen 3.274 N/A ASN 375.A N ASP 371.A O no hydrogen 2.727 N/A TYR 376.A N GLU 372.A O no hydrogen 3.161 N/A LEU 377.A N TYR 373.A O no hydrogen 2.968 N/A MET 378.A N LYS 374.A O no hydrogen 3.037 N/A ASN 379.A N ASN 375.A O no hydrogen 3.279 N/A ASN 379.A N TYR 376.A O no hydrogen 3.298 N/A ASN 379.A ND2 ASN 375.A O no hydrogen 2.869 N/A SER 380.A N LEU 377.A O no hydrogen 3.278 N/A HIS 382.A N SER 380.A OG no hydrogen 3.032 N/A HIS 382.A ND1 GLU 385.A OE1 no hydrogen 2.702 N/A HIS 382.A NE2 TYR 352.A OH no hydrogen 2.635 N/A TYR 383.A N SER 380.A O no hydrogen 3.220 N/A TYR 383.A OH ASP 427.A OD1 no hydrogen 2.321 N/A LEU 384.A N TYR 358.A OH no hydrogen 2.935 N/A GLU 385.A N HIS 382.A O no hydrogen 2.876 N/A LYS 389.A NZ GLU 459.A OE1 no hydrogen 2.710 N/A LYS 389.A NZ GLU 459.A OE2 no hydrogen 3.357 N/A MET 390.A N LEU 399.A O no hydrogen 2.781 N/A ASN 393.A N THR 407.A OG1 no hydrogen 2.997 N/A ASP 396.A N ASN 393.A O no hydrogen 2.749 N/A ASN 397.A N GLY 394.A O no hydrogen 3.071 N/A GLY 398.A N MET 390.A O no hydrogen 2.778 N/A LEU 399.A N ASP 396.A O no hydrogen 2.986 N/A GLY 401.A N ALA 388.A O no hydrogen 3.062 N/A CYS 402.A SG ASN 475.A O no hydrogen 3.259 N/A THR 404.A N THR 407.A O no hydrogen 3.034 N/A THR 404.A OG1 ASP 396.A OD2 no hydrogen 2.565 N/A GLY 406.A N THR 404.A OG1 no hydrogen 3.249 N/A THR 407.A N THR 404.A OG1 no hydrogen 3.122 N/A THR 407.A OG1 ASP 396.A OD2 no hydrogen 2.580 N/A THR 408.A N ASP 355.A OD1 no hydrogen 2.799 N/A THR 408.A OG1 ASP 355.A OD1 no hydrogen 2.958 N/A GLN 409.A N GLN 409.A OE1 no hydrogen 2.871 N/A GLN 409.A NE2 GLU 385.A OE2 no hydrogen 3.136 N/A LEU 411.A N THR 408.A O no hydrogen 3.015 N/A THR 413.A N GLN 409.A O no hydrogen 3.194 N/A THR 413.A OG1 TYR 358.A OH no hydrogen 2.905 N/A THR 413.A OG1 GLU 385.A O no hydrogen 2.656 N/A ILE 414.A N GLY 410.A O no hydrogen 2.991 N/A THR 415.A N LEU 411.A O no hydrogen 3.254 N/A THR 415.A OG1 GLU 363.A OE1 no hydrogen 3.472 N/A THR 415.A OG1 GLU 363.A OE2 no hydrogen 2.545 N/A LEU 416.A N GLY 412.A O no hydrogen 2.999 N/A ALA 417.A N THR 413.A O no hydrogen 2.920 N/A LEU 418.A N ILE 414.A O no hydrogen 2.873 N/A VAL 419.A N THR 415.A O no hydrogen 2.941 N/A ILE 428.A N PRO 424.A O no hydrogen 3.216 N/A GLN 429.A N ALA 425.A O no hydrogen 2.988 N/A LYS 430.A N THR 426.A O no hydrogen 2.900 N/A ALA 431.A N ASP 427.A O no hydrogen 2.950 N/A ARG 432.A N ILE 428.A O no hydrogen 3.043 N/A ARG 432.A NE ALA 417.A O no hydrogen 2.881 N/A ARG 432.A NH1 ALA 417.A O no hydrogen 2.978 N/A ASN 433.A N GLN 429.A O no hydrogen 2.821 N/A ASN 434.A N LYS 430.A O no hydrogen 2.815 N/A ASN 434.A ND2 LEU 384.A O no hydrogen 2.770 N/A ILE 435.A N ALA 431.A O no hydrogen 3.049 N/A ALA 436.A N ARG 432.A O no hydrogen 3.124 N/A LYS 437.A N ASN 433.A O no hydrogen 2.856 N/A ALA 438.A N ASN 434.A O no hydrogen 3.011 N/A ALA 439.A N ILE 435.A O no hydrogen 3.030 N/A ASP 440.A N ALA 436.A O no hydrogen 2.862 N/A ARG 441.A N LYS 437.A O no hydrogen 3.233 N/A TRP 442.A N ALA 438.A O no hydrogen 3.246 N/A TRP 442.A NE1 ALA 388.A O no hydrogen 2.840 N/A LEU 443.A N ALA 439.A O no hydrogen 2.938 N/A GLU 444.A N ASP 440.A O no hydrogen 3.113 N/A ASN 445.A N ARG 441.A O no hydrogen 3.010 N/A ASN 445.A ND2 PRO 454.A O no hydrogen 3.089 N/A ILE 446.A N TRP 442.A O no hydrogen 2.986 N/A GLU 447.A N LEU 443.A O no hydrogen 3.207 N/A GLU 448.A N GLU 444.A O no hydrogen 3.010 N/A GLU 448.A N ASN 445.A O no hydrogen 2.990 N/A GLN 449.A N ILE 446.A O no hydrogen 3.243 N/A GLN 449.A NE2 ASP 57.A OD1 no hydrogen 3.401 N/A GLY 450.A N ASP 55.A OD1 no hydrogen 2.842 N/A TYR 451.A OH ASP 60.A OD1 no hydrogen 2.790 N/A ARG 452.A N GLN 449.A O no hydrogen 3.011 N/A ARG 452.A NE ASP 498.A OD1 no hydrogen 2.924 N/A ARG 452.A NH1 GLU 447.A OE1 no hydrogen 3.507 N/A ARG 452.A NH1 GLU 447.A OE2 no hydrogen 3.112 N/A ARG 452.A NH2 GLU 447.A OE1 no hydrogen 3.030 N/A ARG 452.A NH2 ASP 498.A OD2 no hydrogen 2.776 N/A LYS 456.A NZ GLU 448.A OE1 no hydrogen 3.182 N/A GLN 457.A NE2 ASP 57.A OD2 no hydrogen 2.990 N/A ALA 458.A N GLY 464.A O no hydrogen 2.855 N/A GLU 459.A N GLY 398.A O no hydrogen 2.771 N/A ARG 462.A NH1 GLU 555.A OE2 no hydrogen 3.447 N/A GLY 463.A N ASP 460.A OD1 no hydrogen 3.110 N/A GLY 464.A N GLN 457.A OE1 no hydrogen 3.308 N/A TYR 465.A N SER 552.A OG no hydrogen 2.909 N/A TYR 465.A OH ASP 57.A OD1 no hydrogen 2.526 N/A TYR 465.A OH GLN 570.A OE1 no hydrogen 3.163 N/A SER 469.A OG PRO 550.A O no hydrogen 2.791 N/A ASN 470.A N GLY 548.A O no hydrogen 2.887 N/A ASN 470.A ND2 SER 547.A O no hydrogen 2.977 N/A SER 471.A N GLY 468.A O no hydrogen 2.897 N/A SER 471.A OG GLY 468.A O no hydrogen 2.874 N/A PHE 472.A N SER 469.A O no hydrogen 3.200 N/A LEU 474.A N ASN 470.A O no hydrogen 3.132 N/A ASN 475.A N SER 471.A O no hydrogen 2.983 N/A GLN 476.A N PHE 472.A O no hydrogen 2.997 N/A MET 477.A N ILE 473.A O no hydrogen 2.983 N/A ILE 478.A N LEU 474.A O no hydrogen 3.164 N/A VAL 479.A N ASN 475.A O no hydrogen 3.392 N/A MET 480.A N GLN 476.A O no hydrogen 2.947 N/A GLY 481.A N MET 477.A O no hydrogen 2.954 N/A TYR 482.A N ILE 478.A O no hydrogen 3.005 N/A ALA 483.A N VAL 479.A O no hydrogen 2.870 N/A TYR 484.A N MET 480.A O no hydrogen 2.909 N/A ASP 485.A N GLY 481.A O no hydrogen 2.939 N/A PHE 486.A N TYR 482.A O no hydrogen 2.933 N/A THR 487.A N ALA 483.A O no hydrogen 3.068 N/A THR 487.A OG1 ALA 483.A O no hydrogen 2.644 N/A GLY 488.A N TYR 484.A O no hydrogen 2.759 N/A ASP 489.A N THR 487.A OG1 no hydrogen 3.121 N/A LYS 491.A N ASP 489.A OD1 no hydrogen 3.052 N/A LYS 491.A NZ ASP 440.A OD1 no hydrogen 3.224 N/A TYR 492.A N ASP 489.A O no hydrogen 3.111 N/A TYR 492.A OH ASP 440.A OD1 no hydrogen 2.666 N/A ASP 494.A N SER 490.A O no hydrogen 2.930 N/A GLY 495.A N LYS 491.A O no hydrogen 3.007 N/A MET 496.A N TYR 492.A O no hydrogen 3.196 N/A PHE 497.A N LEU 493.A O no hydrogen 2.972 N/A ASP 498.A N ASP 494.A O no hydrogen 2.887 N/A GLY 499.A N GLY 495.A O no hydrogen 3.047 N/A ILE 500.A N MET 496.A O no hydrogen 2.925 N/A SER 501.A N PHE 497.A O no hydrogen 3.114 N/A SER 501.A OG PHE 497.A O no hydrogen 3.425 N/A TYR 502.A N ASP 498.A O no hydrogen 3.134 N/A LEU 503.A N GLY 499.A O no hydrogen 3.177 N/A LEU 504.A N SER 501.A O no hydrogen 3.111 N/A GLY 505.A N TYR 502.A O no hydrogen 3.418 N/A ARG 506.A N SER 501.A O no hydrogen 2.967 N/A ARG 506.A NE VAL 21.A O no hydrogen 3.081 N/A ARG 506.A NH1 TYR 451.A O no hydrogen 2.957 N/A ARG 506.A NH1 ASP 498.A O no hydrogen 2.972 N/A ARG 506.A NH2 VAL 21.A O no hydrogen 3.028 N/A ARG 506.A NH2 ASP 498.A OD1 no hydrogen 2.742 N/A ASP 510.A N ASN 507.A O no hydrogen 3.015 N/A SER 512.A N ARG 520.A O no hydrogen 3.003 N/A SER 512.A OG VAL 514.A O no hydrogen 3.295 N/A SER 512.A OG TYR 517.A O no hydrogen 2.690 N/A TYR 513.A N LEU 503.A O no hydrogen 2.967 N/A VAL 514.A N SER 512.A OG no hydrogen 3.394 N/A THR 515.A N ILE 545.A O no hydrogen 2.897 N/A THR 515.A OG1 PRO 542.A O no hydrogen 2.661 N/A THR 515.A OG1 ILE 545.A O no hydrogen 3.439 N/A TYR 517.A OH ASP 107.A OD2 no hydrogen 2.684 N/A ARG 520.A N GLN 11.A OE1 no hydrogen 2.866 N/A ARG 520.A NE ASP 510.A O no hydrogen 2.858 N/A ARG 520.A NE ASP 510.A OD1 no hydrogen 3.368 N/A ARG 520.A NH1 LEU 2.A O no hydrogen 2.756 N/A ARG 520.A NH2 LEU 2.A O no hydrogen 2.920 N/A ARG 520.A NH2 PRO 3.A O no hydrogen 3.002 N/A ARG 520.A NH2 ASP 510.A OD1 no hydrogen 2.814 N/A LEU 522.A N VAL 514.A O no hydrogen 3.339 N/A GLN 523.A N ASP 575.A OD1 no hydrogen 2.873 N/A ASN 524.A N ASP 575.A OD2 no hydrogen 2.794 N/A HIS 526.A N ASN 583.A O no hydrogen 2.839 N/A ARG 528.A N GLY 178.A O no hydrogen 3.195 N/A ARG 528.A NE GLY 178.A O no hydrogen 2.627 N/A PHE 529.A N ASP 527.A OD1 no hydrogen 2.988 N/A TRP 530.A N ASP 527.A OD1 no hydrogen 3.057 N/A THR 531.A N PHE 529.A O no hydrogen 2.962 N/A THR 531.A OG1 THR 534.A OG1 no hydrogen 2.602 N/A THR 531.A OG1 THR 577.A OG1 no hydrogen 2.873 N/A THR 534.A N THR 531.A O no hydrogen 2.917 N/A THR 534.A OG1 THR 531.A OG1 no hydrogen 2.602 N/A SER 535.A N THR 531.A O no hydrogen 3.410 N/A ARG 537.A N SER 535.A OG no hydrogen 3.387 N/A PHE 538.A N SER 535.A O no hydrogen 3.031 N/A GLY 544.A N THR 515.A O no hydrogen 2.947 N/A ILE 545.A N THR 515.A OG1 no hydrogen 2.946 N/A ILE 546.A N ASN 590.A OD1 no hydrogen 2.912 N/A SER 547.A N TYR 513.A O no hydrogen 2.873 N/A SER 547.A OG ASN 583.A OD1 no hydrogen 2.801 N/A GLY 548.A N GLU 584.A O no hydrogen 3.050 N/A GLY 549.A N SER 547.A OG no hydrogen 3.186 N/A ASN 551.A N CYS 572.A O no hydrogen 2.925 N/A ASN 551.A ND2 TYR 465.A O no hydrogen 3.466 N/A SER 552.A N TYR 465.A O no hydrogen 3.026 N/A SER 552.A OG TYR 465.A O no hydrogen 3.491 N/A ARG 553.A NE GLY 463.A O no hydrogen 2.893 N/A ARG 553.A NH2 ASP 460.A OD2 no hydrogen 3.002 N/A ARG 553.A NH2 GLY 463.A O no hydrogen 2.907 N/A ILE 559.A N ASP 556.A OD2 no hydrogen 2.805 N/A ASN 560.A N ASP 556.A O no hydrogen 3.212 N/A ASN 560.A ND2 PHE 554.A O no hydrogen 2.913 N/A ASN 560.A ND2 ASP 556.A O no hydrogen 3.078 N/A ALA 561.A N PRO 557.A O no hydrogen 3.012 N/A ALA 561.A N THR 558.A O no hydrogen 3.159 N/A ALA 562.A N THR 558.A O no hydrogen 2.953 N/A ALA 562.A N ILE 559.A O no hydrogen 3.193 N/A VAL 563.A N ILE 559.A O no hydrogen 3.194 N/A THR 567.A N LYS 564.A O no hydrogen 3.169 N/A THR 567.A OG1 LYS 564.A O no hydrogen 2.679 N/A GLN 570.A N ASP 57.A O no hydrogen 3.112 N/A LYS 571.A N PRO 568.A O no hydrogen 2.845 N/A LYS 571.A NZ SER 58.A O no hydrogen 3.255 N/A LYS 571.A NZ ASP 60.A OD2 no hydrogen 2.724 N/A CYS 572.A N PRO 569.A O no hydrogen 3.148 N/A CYS 572.A SG THR 567.A O no hydrogen 3.414 N/A CYS 572.A SG PRO 568.A O no hydrogen 3.561 N/A PHE 573.A N LYS 571.A O no hydrogen 2.919 N/A HIS 576.A N ILE 574.A O no hydrogen 2.862 N/A THR 577.A N GLN 533.A OE1 no hydrogen 2.804 N/A THR 577.A OG1 PRO 525.A O no hydrogen 3.117 N/A THR 577.A OG1 THR 531.A OG1 no hydrogen 2.873 N/A ASP 578.A N HIS 576.A ND1 no hydrogen 2.874 N/A SER 579.A N HIS 576.A O no hydrogen 3.104 N/A SER 579.A OG ASP 556.A OD1 no hydrogen 2.817 N/A SER 579.A OG ASP 556.A OD2 no hydrogen 3.565 N/A TRP 580.A N ASP 578.A O no hydrogen 3.051 N/A SER 581.A N ASP 556.A OD1 no hydrogen 3.088 N/A SER 581.A OG ASP 556.A OD1 no hydrogen 2.719 N/A THR 582.A N SER 579.A O no hydrogen 3.429 N/A THR 582.A OG1 CYS 572.A O no hydrogen 3.448 N/A ASN 583.A ND2 ASP 575.A OD2 no hydrogen 3.040 N/A ASN 583.A ND2 HIS 576.A O no hydrogen 3.543 N/A VAL 587.A N ASP 176.A O no hydrogen 2.859 N/A TRP 589.A N THR 586.A O no hydrogen 3.378 N/A TRP 589.A N THR 586.A OG1 no hydrogen 2.933 N/A ASN 590.A N THR 586.A O no hydrogen 2.940 N/A ASN 590.A ND2 ALA 108.A O no hydrogen 2.864 N/A ASN 590.A ND2 GLY 544.A O no hydrogen 3.112 N/A ALA 591.A N VAL 587.A O no hydrogen 3.030 N/A PHE 593.A N TRP 589.A O no hydrogen 3.303 N/A ALA 594.A N ASN 590.A O no hydrogen 2.865 N/A TRP 595.A N ALA 591.A O no hydrogen 2.979 N/A VAL 596.A N PRO 592.A O no hydrogen 2.884 N/A THR 597.A N PHE 593.A O no hydrogen 3.003 N/A THR 597.A OG1 PHE 593.A O no hydrogen 2.877 N/A THR 597.A OG1 ALA 594.A O no hydrogen 3.305 N/A ALA 598.A N ALA 594.A O no hydrogen 3.062 N/A TYR 599.A N TRP 595.A O no hydrogen 3.052 N/A TYR 599.A OH GLY 481.A O no hydrogen 2.898 N/A TYR 599.A OH ASP 485.A OD1 no hydrogen 2.905 N/A LEU 600.A N VAL 596.A O no hydrogen 2.934 N/A ASP 601.A N THR 597.A O no hydrogen 2.992 N/A GLN 602.A N ALA 598.A O no hydrogen 2.943 N/A TYR 603.A N TYR 599.A O no hydrogen 2.939 N/A THR 604.A N LEU 600.A O no hydrogen 2.907 N/A ASP 605.A N ASP 601.A O no hydrogen 3.190 N/A