Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rar_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ILE 12.A O no hydrogen 2.993 N/A THR 5.A OG1 THR 11.A OG1 no hydrogen 3.277 N/A LEU 6.A N ASP 10.A O no hydrogen 2.743 N/A ALA 7.A N ASN 192.A OD1 no hydrogen 3.161 N/A ASN 8.A ND2 ASP 10.A OD1 no hydrogen 2.718 N/A GLY 9.A N LEU 6.A O no hydrogen 3.195 N/A THR 11.A N ASP 49.A OD2 no hydrogen 3.373 N/A THR 11.A OG1 THR 5.A OG1 no hydrogen 3.277 N/A ILE 12.A N ALA 4.A O no hydrogen 2.782 N/A THR 13.A N GLN 51.A O no hydrogen 3.148 N/A GLY 14.A N PRO 2.A O no hydrogen 2.756 N/A LEU 15.A N ALA 22.A O no hydrogen 2.647 N/A ALA 17.A N ASN 20.A O no hydrogen 2.884 N/A ILE 18.A N ASN 16.A OD1 no hydrogen 3.059 N/A ILE 19.A N ALA 17.A O no hydrogen 2.783 N/A GLU 21.A N ARG 104.A O no hydrogen 3.037 N/A ALA 22.A N LEU 15.A O no hydrogen 2.824 N/A PHE 23.A N VAL 102.A O no hydrogen 2.857 N/A LEU 24.A N PHE 53.A O no hydrogen 2.958 N/A ILE 26.A N ILE 100.A O no hydrogen 3.070 N/A PHE 28.A N LEU 98.A O no hydrogen 3.170 N/A GLU 30.A N VAL 42.A O no hydrogen 2.818 N/A VAL 33.A N PRO 31.A O no hydrogen 2.485 N/A LEU 36.A N VAL 33.A O no hydrogen 2.850 N/A ARG 37.A N GLY 34.A O no hydrogen 3.433 N/A ARG 37.A NE GLU 95.A OE1 no hydrogen 3.031 N/A ARG 37.A NE GLU 95.A OE2 no hydrogen 3.471 N/A ARG 37.A NH1 LEU 278.A O no hydrogen 2.838 N/A ARG 37.A NH1 VAL 281.A O no hydrogen 2.679 N/A ARG 37.A NH2 GLU 95.A OE2 no hydrogen 2.912 N/A ARG 37.A NH2 VAL 281.A O no hydrogen 3.125 N/A LYS 39.A N LEU 36.A O no hydrogen 2.993 N/A LYS 39.A NZ ASN 35.A O no hydrogen 3.015 N/A TYR 44.A N PHE 28.A O no hydrogen 3.319 N/A SER 45.A N GLU 30.A OE1 no hydrogen 2.990 N/A SER 47.A OG ASP 10.A OD1 no hydrogen 3.115 N/A SER 47.A OG ASP 10.A OD2 no hydrogen 3.056 N/A LEU 48.A N ASP 10.A OD1 no hydrogen 2.551 N/A GLY 50.A N THR 11.A O no hydrogen 2.944 N/A GLN 51.A N LEU 48.A O no hydrogen 2.981 N/A PHE 53.A N THR 13.A O no hydrogen 2.818 N/A SER 59.A N PRO 92.A O no hydrogen 2.977 N/A CYS 60.A SG TYR 156.A O no hydrogen 3.355 N/A GLN 62.A NE2 CYS 60.A O no hydrogen 2.633 N/A GLN 62.A NE2 GLY 128.A O no hydrogen 2.911 N/A GLN 63.A N GLU 126.A O no hydrogen 2.980 N/A GLN 63.A NE2 THR 293.A O no hydrogen 3.240 N/A GLN 63.A NE2 PRO 294.A O no hydrogen 3.310 N/A ASN 64.A N ASN 291.A OD1 no hydrogen 2.782 N/A ASN 64.A ND2 LYS 75.A O no hydrogen 3.154 N/A GLU 66.A N ASN 64.A OD1 no hydrogen 2.692 N/A GLY 67.A N ASN 64.A O no hydrogen 2.703 N/A THR 68.A N ASN 291.A O no hydrogen 3.115 N/A GLU 70.A N THR 68.A OG1 no hydrogen 3.204 N/A LYS 75.A N ASN 72.A OD1 no hydrogen 2.792 N/A LYS 75.A NZ THR 68.A O no hydrogen 2.561 N/A LYS 75.A NZ GLU 70.A O no hydrogen 2.872 N/A LYS 75.A NZ GLU 71.A OE2 no hydrogen 3.240 N/A LYS 75.A NZ ASN 292.A OD1 no hydrogen 2.778 N/A ALA 76.A N ASN 72.A O no hydrogen 3.190 N/A ALA 77.A N LEU 73.A O no hydrogen 2.676 N/A LEU 78.A N PRO 74.A O no hydrogen 2.973 N/A ASP 79.A N LYS 75.A O no hydrogen 2.993 N/A LEU 80.A N ALA 76.A O no hydrogen 3.074 N/A VAL 81.A N ALA 77.A O no hydrogen 3.132 N/A MET 82.A N LEU 78.A O no hydrogen 2.760 N/A GLN 83.A NE2 GLU 287.A OE1 no hydrogen 3.206 N/A SER 84.A N VAL 81.A O no hydrogen 2.867 N/A SER 84.A OG VAL 81.A O no hydrogen 2.629 N/A PHE 87.A N SER 84.A OG no hydrogen 3.094 N/A GLU 88.A N SER 84.A O no hydrogen 2.968 N/A ALA 89.A N VAL 86.A O no hydrogen 3.137 N/A VAL 90.A N VAL 86.A O no hydrogen 3.047 N/A SER 91.A N PHE 87.A O no hydrogen 2.839 N/A SER 94.A N SER 59.A O no hydrogen 2.711 N/A ASP 96.A N SER 94.A OG no hydrogen 3.177 N/A CYS 97.A SG SER 94.A O no hydrogen 3.524 N/A CYS 97.A SG GLU 95.A O no hydrogen 3.587 N/A THR 99.A N CYS 97.A O no hydrogen 2.804 N/A THR 99.A OG1 ASN 155.A OD1 no hydrogen 3.522 N/A ILE 100.A N ILE 26.A O no hydrogen 2.628 N/A ASN 101.A N SER 153.A O no hydrogen 2.935 N/A VAL 102.A N PHE 23.A O no hydrogen 2.979 N/A VAL 103.A N HIS 151.A O no hydrogen 2.820 N/A ARG 104.A N GLU 21.A O no hydrogen 2.964 N/A ARG 104.A NE GLU 21.A OE1 no hydrogen 2.901 N/A ARG 104.A NH1 PHE 196.A O no hydrogen 2.946 N/A ARG 104.A NH2 GLU 21.A OE1 no hydrogen 2.647 N/A GLY 107.A N GLU 21.A OE2 no hydrogen 2.735 N/A THR 108.A N PRO 105.A O no hydrogen 3.159 N/A THR 108.A OG1 PRO 105.A O no hydrogen 2.634 N/A ALA 112.A N LYS 109.A O no hydrogen 3.105 N/A LEU 114.A N GLY 197.A O no hydrogen 2.844 N/A VAL 116.A N LYS 202.A O no hydrogen 2.786 N/A MET 117.A N ILE 150.A O no hydrogen 2.940 N/A LEU 118.A N THR 204.A O no hydrogen 2.961 N/A TRP 119.A N VAL 152.A O no hydrogen 2.665 N/A ILE 120.A N PHE 206.A O no hydrogen 2.916 N/A GLU 126.A N GLY 123.A O no hydrogen 3.009 N/A VAL 127.A N GLY 123.A O no hydrogen 3.020 N/A GLY 128.A N GLN 62.A OE1 no hydrogen 2.702 N/A THR 130.A OG1 ASN 101.A OD1 no hydrogen 2.972 N/A THR 132.A OG1 GLY 129.A O no hydrogen 3.520 N/A PHE 133.A N THR 130.A O no hydrogen 3.261 N/A ILE 139.A N PRO 135.A O no hydrogen 2.981 N/A THR 140.A N ALA 136.A O no hydrogen 2.866 N/A THR 140.A OG1 ALA 136.A O no hydrogen 2.959 N/A LYS 141.A N GLN 137.A O no hydrogen 3.067 N/A LYS 141.A NZ ASN 468.A OD1 no hydrogen 2.925 N/A SER 142.A N MET 138.A O no hydrogen 2.861 N/A SER 142.A OG MET 138.A O no hydrogen 3.503 N/A SER 142.A OG ILE 139.A O no hydrogen 2.621 N/A ILE 143.A N ILE 139.A O no hydrogen 3.076 N/A ALA 144.A N THR 140.A O no hydrogen 3.027 N/A MET 145.A N LYS 141.A O no hydrogen 2.990 N/A GLY 146.A N ILE 143.A O no hydrogen 2.846 N/A LYS 147.A N SER 142.A O no hydrogen 2.809 N/A LYS 147.A NZ ASP 477.A OD1 no hydrogen 2.814 N/A ILE 149.A N SER 142.A OG no hydrogen 3.363 N/A ILE 150.A N PRO 115.A O no hydrogen 3.034 N/A HIS 151.A N VAL 103.A O no hydrogen 2.840 N/A VAL 152.A N MET 117.A O no hydrogen 2.897 N/A SER 153.A N ASN 101.A O no hydrogen 3.068 N/A SER 153.A OG ASN 101.A OD1 no hydrogen 2.902 N/A ASN 155.A N THR 99.A O no hydrogen 3.135 N/A TYR 156.A OH PHE 121.A O no hydrogen 2.656 N/A ARG 157.A N ASP 181.A OD1 no hydrogen 3.014 N/A ARG 157.A NE ASP 181.A OD1 no hydrogen 2.776 N/A ARG 157.A NH1 LYS 39.A O no hydrogen 2.965 N/A ARG 157.A NH2 LYS 39.A O no hydrogen 2.899 N/A ARG 157.A NH2 ASP 181.A OD1 no hydrogen 3.536 N/A ARG 157.A NH2 ASP 181.A OD2 no hydrogen 2.650 N/A SER 159.A N PHE 125.A O no hydrogen 2.677 N/A SER 159.A OG GLN 63.A OE1 no hydrogen 2.808 N/A SER 160.A OG THR 290.A OG1 no hydrogen 2.809 N/A GLY 162.A N SER 159.A O no hydrogen 3.022 N/A PHE 163.A N SER 159.A O no hydrogen 2.799 N/A GLY 166.A N VAL 250.A O no hydrogen 2.926 N/A GLU 168.A N GLU 168.A OE2 no hydrogen 2.491 N/A LYS 170.A N GLY 166.A O no hydrogen 3.042 N/A ALA 171.A N ASP 167.A O no hydrogen 2.938 N/A GLU 172.A N GLU 168.A O no hydrogen 3.036 N/A GLY 173.A N ILE 169.A O no hydrogen 2.979 N/A GLY 173.A N LYS 170.A O no hydrogen 2.968 N/A SER 174.A N ILE 169.A O no hydrogen 3.155 N/A SER 174.A OG GLU 172.A OE1 no hydrogen 2.563 N/A ASN 176.A ND2 ARG 309.A O no hydrogen 2.918 N/A ASN 176.A ND2 ASP 311.A OD2 no hydrogen 2.989 N/A GLY 178.A N GLY 162.A O no hydrogen 2.858 N/A LYS 180.A N ASN 176.A O no hydrogen 3.137 N/A LYS 180.A NZ ASP 40.A OD1 no hydrogen 3.479 N/A LYS 180.A NZ ASP 40.A OD2 no hydrogen 2.763 N/A LYS 180.A NZ ALA 175.A O no hydrogen 3.039 N/A ASP 181.A N ALA 177.A O no hydrogen 2.977 N/A GLN 182.A N GLY 178.A O no hydrogen 3.347 N/A GLN 182.A NE2 HIS 218.A NE2 no hydrogen 2.629 N/A ARG 183.A N LEU 179.A O no hydrogen 2.918 N/A ARG 183.A NH1 HIS 218.A ND1 no hydrogen 2.989 N/A ARG 183.A NH1 HIS 218.A O no hydrogen 3.091 N/A LEU 184.A N LYS 180.A O no hydrogen 3.008 N/A GLY 185.A N ASP 181.A O no hydrogen 3.043 N/A MET 186.A N GLN 182.A O no hydrogen 2.993 N/A GLN 187.A N ARG 183.A O no hydrogen 3.147 N/A TRP 188.A N LEU 184.A O no hydrogen 2.920 N/A VAL 189.A N GLY 185.A O no hydrogen 3.039 N/A ALA 190.A N MET 186.A O no hydrogen 2.982 N/A ASP 191.A N GLN 187.A O no hydrogen 3.108 N/A ASN 192.A N TRP 188.A O no hydrogen 2.962 N/A ASN 192.A ND2 TRP 188.A O no hydrogen 2.864 N/A ILE 193.A N VAL 189.A O no hydrogen 2.825 N/A ALA 195.A N ASN 192.A O no hydrogen 3.035 N/A PHE 196.A N ILE 193.A O no hydrogen 2.932 N/A GLY 197.A N ALA 194.A O no hydrogen 3.137 N/A GLY 198.A N ILE 193.A O no hydrogen 3.161 N/A ASP 199.A N LEU 114.A O no hydrogen 2.869 N/A THR 201.A N ASP 199.A OD2 no hydrogen 2.812 N/A THR 201.A OG1 ASP 199.A OD1 no hydrogen 3.252 N/A THR 201.A OG1 ASP 199.A OD2 no hydrogen 2.750 N/A LYS 202.A N ASP 199.A O no hydrogen 2.870 N/A THR 204.A N VAL 116.A O no hydrogen 2.780 N/A ILE 205.A N ALA 236.A O no hydrogen 2.937 N/A PHE 206.A N LEU 118.A O no hydrogen 3.147 N/A GLY 207.A N ILE 238.A O no hydrogen 3.305 N/A SER 209.A N GLN 240.A O no hydrogen 2.740 N/A SER 209.A OG HIS 449.A NE2 no hydrogen 2.793 N/A GLY 211.A N GLU 208.A O no hydrogen 2.740 N/A SER 212.A OG GLY 242.A O no hydrogen 2.487 N/A MET 213.A N SER 209.A O no hydrogen 2.840 N/A SER 214.A N ALA 210.A O no hydrogen 3.000 N/A SER 214.A OG GLN 182.A OE1 no hydrogen 3.137 N/A SER 214.A OG ALA 210.A O no hydrogen 2.922 N/A VAL 215.A N GLY 211.A O no hydrogen 3.106 N/A MET 216.A N SER 212.A O no hydrogen 3.188 N/A CYS 217.A N MET 213.A O no hydrogen 2.946 N/A CYS 217.A SG MET 213.A O no hydrogen 3.414 N/A HIS 218.A N SER 214.A O no hydrogen 2.913 N/A ILE 219.A N VAL 215.A O no hydrogen 3.129 N/A ILE 219.A N MET 216.A O no hydrogen 2.984 N/A LEU 220.A N MET 216.A O no hydrogen 3.103 N/A ASN 222.A N ASN 314.A O no hydrogen 2.799 N/A GLY 224.A N TRP 221.A O no hydrogen 3.022 N/A ASP 225.A N ASN 222.A O no hydrogen 3.295 N/A THR 227.A N ASP 225.A OD1 no hydrogen 2.893 N/A THR 227.A OG1 ASP 225.A OD1 no hydrogen 2.552 N/A THR 227.A OG1 ASP 225.A OD2 no hydrogen 3.477 N/A TYR 228.A N LYS 231.A O no hydrogen 2.627 N/A TYR 228.A OH ASP 191.A OD1 no hydrogen 2.542 N/A LYS 229.A NZ ASP 191.A OD1 no hydrogen 3.402 N/A LYS 229.A NZ ASP 191.A OD2 no hydrogen 3.276 N/A LYS 231.A N TYR 228.A O no hydrogen 2.886 N/A LYS 231.A NZ PRO 232.A O no hydrogen 2.960 N/A LEU 233.A N ASN 226.A O no hydrogen 2.728 N/A ARG 235.A N VAL 203.A O no hydrogen 2.774 N/A ILE 238.A N ILE 205.A O no hydrogen 2.846 N/A MET 239.A N ILE 334.A O no hydrogen 2.705 N/A GLN 240.A N GLY 207.A O no hydrogen 3.092 N/A GLN 240.A NE2 GLN 456.A OE1 no hydrogen 3.025 N/A SER 241.A N GLY 336.A O no hydrogen 3.015 N/A SER 241.A OG GLU 341.A OE1 no hydrogen 2.474 N/A SER 241.A OG GLU 341.A OE2 no hydrogen 3.229 N/A SER 247.A N VAL 245.A O no hydrogen 2.940 N/A SER 247.A OG PRO 308.A O no hydrogen 2.747 N/A ASP 248.A N VAL 534.A OXT no hydrogen 2.778 N/A VAL 250.A N PRO 310.A O no hydrogen 2.854 N/A GLY 252.A N ALA 249.A O no hydrogen 2.939 N/A ASN 256.A N GLY 252.A O no hydrogen 3.302 N/A GLU 257.A N ILE 253.A O no hydrogen 2.962 N/A ILE 258.A N TYR 254.A O no hydrogen 3.061 N/A PHE 259.A N GLY 255.A O no hydrogen 3.275 N/A ASP 260.A N ASN 256.A O no hydrogen 2.973 N/A LEU 261.A N GLU 257.A O no hydrogen 3.095 N/A LEU 262.A N ILE 258.A O no hydrogen 2.919 N/A ALA 263.A N PHE 259.A O no hydrogen 3.054 N/A SER 264.A N ASP 260.A O no hydrogen 2.953 N/A SER 264.A OG ASP 260.A O no hydrogen 2.764 N/A ASN 265.A N LEU 261.A O no hydrogen 2.895 N/A ASN 265.A ND2 ALA 289.A O no hydrogen 3.294 N/A ASN 265.A ND2 ASN 292.A O no hydrogen 3.515 N/A ALA 266.A N LEU 262.A O no hydrogen 2.908 N/A GLY 267.A N SER 264.A O no hydrogen 2.752 N/A CYS 268.A N ALA 263.A O no hydrogen 2.629 N/A ALA 271.A N CYS 268.A O no hydrogen 3.194 N/A LYS 274.A NZ ASP 260.A OD1 no hydrogen 3.162 N/A ALA 276.A N ASP 273.A OD2 no hydrogen 3.000 N/A CYS 277.A N ASP 273.A O no hydrogen 3.204 N/A LEU 278.A N LYS 274.A O no hydrogen 3.010 N/A ARG 279.A N LEU 275.A O no hydrogen 3.242 N/A ARG 279.A NE ARG 37.A O no hydrogen 3.001 N/A ARG 279.A NH1 GLU 172.A OE2 no hydrogen 2.686 N/A ARG 279.A NH2 ARG 37.A O no hydrogen 3.236 N/A ARG 279.A NH2 GLU 172.A OE1 no hydrogen 2.450 N/A ARG 279.A NH2 GLU 172.A OE2 no hydrogen 3.079 N/A GLY 280.A N CYS 277.A O no hydrogen 3.002 N/A SER 282.A OG THR 285.A OG1 no hydrogen 3.065 N/A SER 283.A OG GLU 95.A OE2 no hydrogen 2.891 N/A THR 285.A OG1 SER 282.A OG no hydrogen 3.065 N/A LEU 286.A N SER 282.A O no hydrogen 3.112 N/A GLU 287.A N SER 283.A O no hydrogen 2.762 N/A ASP 288.A N ASP 284.A O no hydrogen 2.788 N/A ALA 289.A N THR 285.A O no hydrogen 2.835 N/A THR 290.A N LEU 286.A O no hydrogen 2.858 N/A THR 290.A OG1 SER 160.A OG no hydrogen 2.809 N/A THR 290.A OG1 LEU 286.A O no hydrogen 2.670 N/A ASN 291.A N GLU 287.A O no hydrogen 2.995 N/A ASN 292.A N ALA 289.A O no hydrogen 3.133 N/A THR 293.A N THR 290.A O no hydrogen 2.931 N/A THR 293.A OG1 THR 290.A O no hydrogen 2.696 N/A THR 293.A OG1 TYR 306.A OH no hydrogen 3.092 N/A GLY 295.A N GLY 67.A O no hydrogen 2.723 N/A LEU 297.A N PRO 65.A O no hydrogen 2.889 N/A ALA 298.A N GLY 295.A O no hydrogen 3.287 N/A SER 301.A N ALA 298.A O no hydrogen 2.775 N/A SER 301.A OG PHE 345.A O no hydrogen 3.267 N/A ARG 303.A N SER 300.A O no hydrogen 2.923 N/A LEU 304.A N LEU 302.A O no hydrogen 2.735 N/A SER 305.A OG PRO 294.A O no hydrogen 2.670 N/A TYR 306.A OH THR 293.A OG1 no hydrogen 3.092 N/A ARG 309.A N ASN 176.A OD1 no hydrogen 3.028 N/A ARG 309.A NH1 ASP 248.A O no hydrogen 3.153 N/A ARG 309.A NH1 VAL 534.A O no hydrogen 3.432 N/A ARG 309.A NH1 VAL 534.A OXT no hydrogen 2.743 N/A ARG 309.A NH2 VAL 534.A O no hydrogen 2.845 N/A ASP 311.A N ILE 315.A O no hydrogen 3.044 N/A GLY 312.A N ILE 315.A O no hydrogen 3.021 N/A VAL 313.A N ASP 311.A OD1 no hydrogen 2.665 N/A ASN 314.A N ASP 311.A OD1 no hydrogen 2.686 N/A ILE 315.A N ASP 311.A OD1 no hydrogen 3.063 N/A THR 316.A OG1 ASP 223.A OD2 no hydrogen 2.661 N/A TYR 320.A N ASP 318.A OD2 no hydrogen 2.706 N/A ALA 321.A N ASP 318.A OD2 no hydrogen 3.202 N/A LEU 322.A N ASP 318.A O no hydrogen 2.925 N/A VAL 323.A N MET 319.A O no hydrogen 3.432 N/A ARG 324.A N TYR 320.A O no hydrogen 3.181 N/A ARG 324.A NH1 TYR 421.A OH no hydrogen 3.004 N/A GLU 325.A N ALA 321.A O no hydrogen 2.863 N/A GLY 326.A N VAL 323.A O no hydrogen 3.081 N/A LYS 327.A N LEU 322.A O no hydrogen 2.810 N/A TYR 328.A N GLY 326.A O no hydrogen 2.975 N/A TYR 328.A OH HIS 425.A O no hydrogen 3.322 N/A TYR 328.A OH THR 427.A OG1 no hydrogen 3.338 N/A ALA 329.A N ILE 219.A O no hydrogen 2.911 N/A ILE 331.A N TYR 426.A OH no hydrogen 3.014 N/A VAL 333.A N THR 430.A O no hydrogen 2.882 N/A ILE 334.A N GLY 237.A O no hydrogen 3.149 N/A ILE 335.A N TYR 432.A O no hydrogen 2.963 N/A GLY 336.A N MET 239.A O no hydrogen 3.024 N/A ASP 337.A N PHE 434.A O no hydrogen 3.146 N/A GLN 338.A N GLU 341.A OE1 no hydrogen 2.811 N/A ASN 339.A N SER 436.A O no hydrogen 2.773 N/A ASP 340.A N THR 447.A O no hydrogen 3.044 N/A THR 343.A OG1 ASP 340.A O no hydrogen 3.283 N/A THR 343.A OG1 LEU 445.A O no hydrogen 2.756 N/A GLY 346.A N GLY 342.A O no hydrogen 2.989 N/A THR 347.A N PHE 344.A O no hydrogen 3.264 N/A THR 347.A OG1 PHE 344.A O no hydrogen 2.773 N/A SER 348.A N PHE 345.A O no hydrogen 3.255 N/A SER 348.A OG LEU 297.A O no hydrogen 2.780 N/A SER 349.A N GLY 346.A O no hydrogen 3.501 N/A ASN 351.A N ASN 351.A OD1 no hydrogen 2.680 N/A VAL 352.A N SER 349.A O no hydrogen 3.162 N/A THR 353.A N GLN 357.A OE1 no hydrogen 2.995 N/A THR 353.A OG1 GLN 357.A OE1 no hydrogen 3.365 N/A THR 354.A N GLN 357.A OE1 no hydrogen 3.313 N/A GLN 357.A N THR 354.A OG1 no hydrogen 3.183 N/A ALA 358.A N THR 354.A O no hydrogen 2.885 N/A ARG 359.A N ASP 355.A O no hydrogen 2.819 N/A ARG 359.A NE ASP 375.A OD2 no hydrogen 3.099 N/A ARG 359.A NH1 ASP 371.A OD2 no hydrogen 3.125 N/A ARG 359.A NH2 ASP 375.A OD2 no hydrogen 2.555 N/A GLU 360.A N ALA 356.A O no hydrogen 3.026 N/A TYR 361.A N GLN 357.A O no hydrogen 2.858 N/A TYR 361.A OH TYR 299.A O no hydrogen 2.714 N/A PHE 362.A N ALA 358.A O no hydrogen 2.988 N/A LYS 363.A N ARG 359.A O no hydrogen 2.947 N/A LYS 363.A NZ GLU 360.A OE1 no hydrogen 3.397 N/A GLN 364.A N GLU 360.A O no hydrogen 2.989 N/A SER 365.A N TYR 361.A O no hydrogen 3.028 N/A SER 365.A OG TYR 361.A O no hydrogen 2.746 N/A PHE 366.A N PHE 362.A O no hydrogen 2.969 N/A HIS 368.A NE2 ASP 248.A OD1 no hydrogen 2.556 N/A ALA 369.A N PHE 366.A O no hydrogen 3.240 N/A SER 370.A N GLU 373.A OE2 no hydrogen 2.767 N/A SER 370.A OG GLU 373.A OE2 no hydrogen 3.092 N/A GLU 373.A N SER 370.A OG no hydrogen 3.166 N/A ILE 374.A N SER 370.A O no hydrogen 2.900 N/A ASP 375.A N ASP 371.A O no hydrogen 2.835 N/A THR 376.A N ALA 372.A O no hydrogen 2.975 N/A THR 376.A OG1 ALA 372.A O no hydrogen 2.953 N/A LEU 377.A N GLU 373.A O no hydrogen 3.078 N/A MET 378.A N ILE 374.A O no hydrogen 3.023 N/A THR 379.A N THR 376.A O no hydrogen 3.121 N/A THR 379.A OG1 ASP 375.A O no hydrogen 2.766 N/A ALA 380.A N THR 376.A O no hydrogen 2.914 N/A TYR 381.A N LEU 377.A O no hydrogen 2.715 N/A TYR 381.A OH ASP 412.A OD1 no hydrogen 2.635 N/A THR 386.A N ASP 384.A OD1 no hydrogen 2.811 N/A THR 386.A OG1 ASP 384.A OD1 no hydrogen 2.519 N/A THR 386.A OG1 ASP 384.A OD2 no hydrogen 3.330 N/A GLN 387.A N ASP 384.A O no hydrogen 2.978 N/A SER 389.A N LYS 404.A O no hydrogen 2.992 N/A SER 389.A OG ASP 340.A OD2 no hydrogen 2.799 N/A PHE 391.A N ASP 340.A OD2 no hydrogen 2.893 N/A THR 393.A OG1 PRO 390.A O no hydrogen 2.799 N/A LEU 396.A N THR 393.A O no hydrogen 2.927 N/A ASN 397.A ND2 THR 393.A OG1 no hydrogen 2.998 N/A THR 400.A OG1 VAL 352.A O no hydrogen 3.548 N/A GLN 402.A N THR 400.A OG1 no hydrogen 3.034 N/A GLN 402.A NE2 ASP 355.A OD1 no hydrogen 2.902 N/A PHE 403.A N THR 400.A OG1 no hydrogen 2.822 N/A LYS 404.A NZ ILE 385.A O no hydrogen 2.977 N/A LYS 404.A NZ THR 393.A OG1 no hydrogen 3.075 N/A LYS 404.A NZ GLY 394.A O no hydrogen 2.994 N/A LYS 404.A NZ LEU 396.A O no hydrogen 2.977 N/A ARG 405.A NE TYR 381.A O no hydrogen 2.682 N/A ARG 405.A NH1 GLN 402.A OE1 no hydrogen 3.025 N/A ARG 405.A NH2 MET 378.A O no hydrogen 2.920 N/A ARG 405.A NH2 TYR 381.A O no hydrogen 3.213 N/A ILE 406.A N GLN 402.A O no hydrogen 2.910 N/A SER 407.A N PHE 403.A O no hydrogen 2.962 N/A SER 407.A OG PHE 403.A O no hydrogen 2.833 N/A ALA 408.A N LYS 404.A O no hydrogen 3.073 N/A VAL 409.A N ARG 405.A O no hydrogen 3.054 N/A LEU 410.A N ILE 406.A O no hydrogen 3.056 N/A GLY 411.A N SER 407.A O no hydrogen 2.991 N/A ASP 412.A N ALA 408.A O no hydrogen 2.997 N/A LEU 413.A N VAL 409.A O no hydrogen 3.002 N/A GLY 414.A N LEU 410.A O no hydrogen 3.138 N/A PHE 415.A N GLY 411.A O no hydrogen 3.125 N/A THR 416.A N GLY 411.A O no hydrogen 3.204 N/A LEU 417.A N ASP 412.A O no hydrogen 3.024 N/A ALA 418.A N ASP 412.A O no hydrogen 3.282 N/A ARG 419.A N PHE 415.A O no hydrogen 2.982 N/A ARG 419.A NE ASP 337.A OD1 no hydrogen 2.980 N/A ARG 419.A NE THR 416.A O no hydrogen 3.272 N/A ARG 419.A NH1 SER 433.A OG no hydrogen 3.122 N/A ARG 419.A NH1 ASP 515.A OD1 no hydrogen 3.015 N/A ARG 419.A NH2 THR 416.A O no hydrogen 3.152 N/A ARG 419.A NH2 ASP 515.A OD1 no hydrogen 3.465 N/A ARG 419.A NH2 ASP 515.A OD2 no hydrogen 3.015 N/A ARG 420.A NE ASP 515.A OD1 no hydrogen 3.425 N/A ARG 420.A NE ASP 515.A OD2 no hydrogen 3.029 N/A ARG 420.A NH1 PHE 517.A O no hydrogen 2.904 N/A ARG 420.A NH2 ASP 515.A OD2 no hydrogen 2.887 N/A ARG 420.A NH2 PHE 517.A O no hydrogen 2.803 N/A TYR 421.A N LEU 417.A O no hydrogen 3.154 N/A PHE 422.A N ALA 418.A O no hydrogen 3.206 N/A LEU 423.A N ARG 419.A O no hydrogen 2.935 N/A ASN 424.A N ARG 420.A O no hydrogen 2.841 N/A HIS 425.A N PHE 422.A O no hydrogen 3.100 N/A HIS 425.A ND1 TYR 421.A O no hydrogen 2.800 N/A TYR 426.A N PHE 422.A O no hydrogen 2.844 N/A TYR 426.A OH ALA 329.A O no hydrogen 3.087 N/A TYR 426.A OH ILE 331.A O no hydrogen 2.717 N/A THR 427.A N TYR 328.A OH no hydrogen 3.052 N/A THR 427.A OG1 TYR 328.A OH no hydrogen 3.338 N/A LYS 431.A NZ LEU 423.A O no hydrogen 3.008 N/A LYS 431.A NZ TYR 426.A O no hydrogen 2.859 N/A LYS 431.A NZ THR 493.A O no hydrogen 3.462 N/A TYR 432.A N VAL 333.A O no hydrogen 2.911 N/A SER 433.A OG ILE 335.A O no hydrogen 2.653 N/A LEU 435.A N MET 503.A O no hydrogen 2.861 N/A SER 436.A N ASP 337.A O no hydrogen 2.927 N/A SER 436.A OG TYR 467.A OH no hydrogen 3.385 N/A LYS 437.A N ILE 505.A O no hydrogen 2.740 N/A GLN 438.A N SER 436.A OG no hydrogen 3.261 N/A LEU 439.A N THR 447.A OG1 no hydrogen 3.274 N/A SER 440.A N LYS 437.A O no hydrogen 3.189 N/A SER 440.A OG LYS 437.A O no hydrogen 2.951 N/A LEU 442.A N LEU 439.A O no hydrogen 3.012 N/A VAL 444.A N ASN 397.A OD1 no hydrogen 2.686 N/A LEU 445.A N PRO 443.A O no hydrogen 2.688 N/A GLY 446.A N LEU 442.A O no hydrogen 2.873 N/A THR 447.A N ASP 340.A OD1 no hydrogen 2.936 N/A HIS 449.A ND1 GLU 341.A OE2 no hydrogen 2.781 N/A HIS 449.A NE2 SER 209.A OG no hydrogen 2.793 N/A SER 450.A OG HIS 449.A O no hydrogen 2.325 N/A ASN 451.A N PHE 448.A O no hydrogen 3.152 N/A ASN 451.A ND2 PHE 448.A O no hydrogen 2.831 N/A ASP 452.A N ASP 452.A OD1 no hydrogen 2.564 N/A ILE 453.A N SER 450.A O no hydrogen 3.033 N/A VAL 454.A N ASN 451.A O no hydrogen 3.168 N/A GLN 456.A N ILE 453.A O no hydrogen 3.308 N/A GLN 456.A NE2 GLN 240.A OE1 no hydrogen 3.560 N/A ASP 457.A N ILE 453.A O no hydrogen 2.998 N/A TYR 458.A N VAL 454.A O no hydrogen 2.889 N/A TYR 458.A OH THR 132.A O no hydrogen 2.824 N/A LEU 459.A N VAL 454.A O no hydrogen 2.675 N/A GLY 461.A N SER 464.A OG no hydrogen 2.807 N/A SER 462.A OG ASN 506.A O no hydrogen 2.643 N/A SER 462.A OG ALA 507.A O no hydrogen 3.561 N/A SER 464.A N GLY 461.A O no hydrogen 2.742 N/A SER 464.A OG PHE 455.A O no hydrogen 2.625 N/A SER 464.A OG LEU 459.A O no hydrogen 3.365 N/A SER 464.A OG GLY 461.A O no hydrogen 3.216 N/A LEU 465.A N SER 462.A O no hydrogen 3.064 N/A ILE 466.A N GLY 463.A O no hydrogen 2.939 N/A TYR 467.A N GLY 463.A O no hydrogen 2.871 N/A ASN 468.A N SER 464.A O no hydrogen 2.903 N/A ASN 468.A ND2 GLN 456.A O no hydrogen 3.147 N/A ASN 468.A ND2 TYR 467.A O no hydrogen 3.270 N/A ALA 470.A N LEU 465.A O no hydrogen 3.084 N/A PHE 471.A N ILE 466.A O no hydrogen 3.238 N/A ILE 472.A N ASN 468.A O no hydrogen 2.800 N/A ALA 473.A N ASN 469.A O no hydrogen 2.945 N/A PHE 474.A N ALA 470.A O no hydrogen 2.988 N/A ALA 475.A N PHE 471.A O no hydrogen 3.031 N/A THR 476.A N ILE 472.A O no hydrogen 3.050 N/A THR 476.A OG1 ILE 472.A O no hydrogen 3.025 N/A ASP 477.A N ALA 473.A O no hydrogen 2.689 N/A LEU 478.A N PHE 474.A O no hydrogen 2.538 N/A ASN 481.A N ASP 479.A OD1 no hydrogen 2.817 N/A ASN 481.A ND2 ASP 479.A OD1 no hydrogen 3.173 N/A ASN 481.A ND2 TRP 489.A O no hydrogen 3.185 N/A THR 482.A N ASP 479.A O no hydrogen 3.357 N/A THR 482.A OG1 ASP 477.A OD1 no hydrogen 2.759 N/A THR 482.A OG1 ASP 479.A O no hydrogen 3.283 N/A ALA 483.A N PRO 480.A O no hydrogen 3.181 N/A TRP 489.A N ASN 481.A OD1 no hydrogen 2.797 N/A TRP 489.A NE1 SER 433.A O no hydrogen 3.101 N/A TYR 492.A N LYS 431.A O no hydrogen 2.796 N/A TYR 492.A OH ASP 515.A OD1 no hydrogen 2.640 N/A THR 493.A N GLN 497.A OE1 no hydrogen 2.701 N/A THR 493.A OG1 GLN 497.A OE1 no hydrogen 2.979 N/A SER 494.A N GLN 497.A OE1 no hydrogen 3.032 N/A SER 495.A OG ASN 424.A OD1 no hydrogen 2.859 N/A SER 496.A N SER 494.A OG no hydrogen 2.812 N/A GLN 497.A N SER 494.A O no hydrogen 3.013 N/A GLN 497.A NE2 GLU 491.A O no hydrogen 3.573 N/A ASN 501.A N GLY 513.A O no hydrogen 3.034 N/A ASN 501.A ND2 SER 494.A O no hydrogen 3.197 N/A LEU 502.A N GLY 513.A O no hydrogen 3.012 N/A MET 503.A N SER 433.A O no hydrogen 2.974 N/A MET 504.A N TYR 511.A O no hydrogen 2.576 N/A ASN 506.A N GLY 509.A O no hydrogen 2.947 N/A GLY 509.A N ASN 506.A OD1 no hydrogen 2.620 N/A TYR 511.A N MET 504.A O no hydrogen 3.114 N/A THR 512.A OG1 ASN 500.A OD1 no hydrogen 2.837 N/A GLY 513.A N LEU 502.A O no hydrogen 2.908 N/A ASP 515.A N ASN 501.A OD1 no hydrogen 3.113 N/A ARG 518.A NE ASP 412.A OD1 no hydrogen 2.655 N/A ARG 518.A NH2 ASP 412.A OD2 no hydrogen 3.023 N/A TYR 522.A N ARG 518.A O no hydrogen 3.174 N/A ASP 523.A N THR 519.A O no hydrogen 3.086 N/A ALA 524.A N ALA 520.A O no hydrogen 2.920 N/A LEU 525.A N GLY 521.A O no hydrogen 2.730 N/A PHE 526.A N TYR 522.A O no hydrogen 2.756 N/A SER 527.A N ASP 523.A O no hydrogen 3.163 N/A SER 527.A OG ASP 523.A O no hydrogen 2.614 N/A SER 531.A N ASN 528.A O no hydrogen 3.053 N/A SER 531.A OG GLU 373.A OE1 no hydrogen 2.572 N/A SER 531.A OG ASN 528.A O no hydrogen 3.317 N/A SER 531.A OG ASN 528.A OD1 no hydrogen 2.654 N/A PHE 532.A N PRO 529.A O no hydrogen 2.878 N/A PHE 533.A N PRO 530.A O no hydrogen 3.328 N/A VAL 534.A N PRO 246.A O no hydrogen 2.895 N/A