Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7l18_AAA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ TYR 55.A O no hydrogen 2.962 N/A GLU 4.A N GLU 54.A O no hydrogen 2.826 N/A GLU 9.A N SER 6.A OG no hydrogen 3.202 N/A LYS 10.A N SER 6.A O no hydrogen 3.105 N/A LYS 10.A NZ SER 5.A O no hydrogen 3.534 N/A MET 11.A N PHE 7.A O no hydrogen 2.931 N/A LYS 12.A N VAL 8.A O no hydrogen 2.698 N/A LYS 12.A NZ GLU 65.A OE2 no hydrogen 2.613 N/A LYS 13.A N GLU 9.A O no hydrogen 2.804 N/A THR 14.A N LYS 10.A O no hydrogen 2.983 N/A THR 14.A OG1 LYS 10.A O no hydrogen 2.584 N/A THR 14.A OG1 MET 11.A O no hydrogen 3.109 N/A ARG 16.A N MET 11.A O no hydrogen 2.866 N/A ARG 16.A NH1 ASP 287.A OD2 no hydrogen 2.974 N/A ASN 17.A N ARG 46.A O no hydrogen 2.927 N/A ASN 17.A ND2 LYS 68.A O no hydrogen 3.160 N/A ILE 18.A N ARG 46.A O no hydrogen 3.217 N/A ILE 19.A N LEU 70.A O no hydrogen 3.305 N/A VAL 20.A N MET 48.A O no hydrogen 2.944 N/A PHE 21.A N VAL 72.A O no hydrogen 2.815 N/A TYR 22.A N ALA 50.A O no hydrogen 3.179 N/A GLY 23.A N CYS 74.A O no hydrogen 2.958 N/A SER 24.A N ASN 86.A OD1 no hydrogen 3.052 N/A GLN 25.A NE2 ASP 85.A OD2 no hydrogen 3.141 N/A GLN 25.A NE2 TYR 390.A OH no hydrogen 3.352 N/A GLU 31.A N GLY 27.A O no hydrogen 3.066 N/A PHE 32.A N THR 28.A O no hydrogen 2.967 N/A ALA 33.A N ALA 29.A O no hydrogen 2.923 N/A ASN 34.A N GLU 30.A O no hydrogen 3.085 N/A ARG 35.A N GLU 31.A O no hydrogen 3.120 N/A ARG 35.A NH1 GLU 151.A OE1 no hydrogen 3.265 N/A ARG 35.A NH1 GLU 151.A OE2 no hydrogen 3.558 N/A ARG 35.A NH2 GLU 151.A OE2 no hydrogen 3.442 N/A LEU 36.A N PHE 32.A O no hydrogen 3.002 N/A SER 37.A N ALA 33.A O no hydrogen 2.900 N/A LYS 38.A N ASN 34.A O no hydrogen 3.041 N/A LYS 38.A NZ GLN 179.A OE1 no hydrogen 3.073 N/A ASP 39.A N ARG 35.A O no hydrogen 2.882 N/A ALA 40.A N LEU 36.A O no hydrogen 3.199 N/A ALA 40.A N SER 37.A O no hydrogen 3.024 N/A HIS 41.A N LYS 38.A O no hydrogen 3.210 N/A ARG 42.A N ASP 39.A O no hydrogen 3.079 N/A TYR 43.A N ALA 40.A O no hydrogen 2.891 N/A MET 45.A N ALA 40.A O no hydrogen 3.380 N/A ARG 46.A N ASN 17.A OD1 no hydrogen 2.908 N/A MET 48.A N ILE 18.A O no hydrogen 3.131 N/A SER 49.A OG ASN 34.A OD1 no hydrogen 2.245 N/A ALA 50.A N VAL 20.A O no hydrogen 2.937 N/A GLU 53.A N ASP 51.A OD1 no hydrogen 3.102 N/A GLU 54.A N ASP 51.A O no hydrogen 2.857 N/A TYR 55.A N PRO 52.A O no hydrogen 3.106 N/A ASP 59.A N ASP 56.A O no hydrogen 3.118 N/A LEU 60.A N LEU 57.A O no hydrogen 2.727 N/A SER 61.A N ALA 58.A O no hydrogen 3.167 N/A SER 61.A OG ALA 58.A O no hydrogen 2.698 N/A SER 62.A N ASP 59.A O no hydrogen 3.264 N/A LEU 63.A N LEU 60.A O no hydrogen 2.909 N/A GLU 65.A N SER 62.A O no hydrogen 2.868 N/A ILE 66.A N LEU 63.A O no hydrogen 3.201 N/A LYS 68.A NZ PHE 169.A O no hydrogen 3.233 N/A SER 69.A OG LEU 63.A O no hydrogen 2.829 N/A SER 69.A OG ILE 66.A O no hydrogen 3.265 N/A LEU 70.A N ASN 17.A O no hydrogen 3.104 N/A VAL 71.A N LYS 105.A O no hydrogen 3.043 N/A VAL 72.A N ILE 19.A O no hydrogen 2.951 N/A PHE 73.A N ALA 107.A O no hydrogen 3.070 N/A CYS 74.A N PHE 21.A O no hydrogen 2.936 N/A MET 75.A N PHE 109.A O no hydrogen 3.015 N/A ALA 76.A N GLY 23.A O no hydrogen 2.862 N/A THR 77.A N LEU 111.A O no hydrogen 2.935 N/A TYR 78.A N ASP 82.A O no hydrogen 3.283 N/A GLU 80.A N ASP 82.A OD2 no hydrogen 3.434 N/A ASP 82.A N TYR 78.A O no hydrogen 2.967 N/A THR 84.A OG1 ASN 86.A OD1 no hydrogen 2.935 N/A ASP 85.A N GLN 25.A OE1 no hydrogen 3.006 N/A ASN 86.A ND2 TYR 22.A O no hydrogen 2.826 N/A ASN 86.A ND2 ASP 51.A OD1 no hydrogen 2.877 N/A ALA 87.A N THR 84.A O no hydrogen 2.886 N/A GLN 88.A N ASP 85.A O no hydrogen 3.385 N/A GLN 88.A NE2 GLN 88.A O no hydrogen 3.414 N/A GLN 88.A NE2 ASP 92.A OD1 no hydrogen 2.902 N/A GLN 88.A NE2 ASP 92.A OD2 no hydrogen 3.425 N/A TYR 91.A N ALA 87.A O no hydrogen 2.853 N/A ASP 92.A N GLN 88.A O no hydrogen 2.944 N/A TRP 93.A N ASP 89.A O no hydrogen 3.011 N/A LEU 94.A N PHE 90.A O no hydrogen 2.867 N/A GLN 95.A N TYR 91.A O no hydrogen 3.179 N/A GLU 96.A N ASP 92.A O no hydrogen 3.317 N/A THR 97.A N TRP 93.A O no hydrogen 2.838 N/A VAL 99.A N THR 97.A OG1 no hydrogen 3.110 N/A LEU 101.A N LEU 133.A O no hydrogen 2.940 N/A THR 102.A N ASP 100.A OD1 no hydrogen 3.455 N/A THR 102.A OG1 ASP 100.A OD1 no hydrogen 2.538 N/A THR 102.A OG1 ASP 100.A OD2 no hydrogen 3.167 N/A VAL 104.A N LEU 101.A O no hydrogen 3.000 N/A PHE 106.A N GLN 136.A O no hydrogen 2.951 N/A ALA 107.A N VAL 71.A O no hydrogen 3.135 N/A PHE 109.A N PHE 73.A O no hydrogen 2.896 N/A GLY 110.A N GLY 142.A O no hydrogen 2.734 N/A LEU 111.A N MET 75.A O no hydrogen 3.016 N/A GLY 112.A N GLY 144.A O no hydrogen 2.829 N/A LYS 114.A N ASP 145.A OD1 no hydrogen 3.095 N/A LYS 114.A NZ ASP 145.A OD2 no hydrogen 2.893 N/A THR 115.A N ASN 113.A OD1 no hydrogen 2.874 N/A THR 115.A OG1 ASN 113.A OD1 no hydrogen 2.668 N/A TYR 116.A N ASN 113.A O no hydrogen 3.070 N/A ASN 120.A ND2 GLY 144.A O no hydrogen 2.953 N/A ALA 121.A N HIS 118.A O no hydrogen 3.413 N/A MET 122.A N THR 77.A OG1 no hydrogen 3.085 N/A LYS 124.A N ASN 120.A O no hydrogen 3.096 N/A LYS 124.A NZ PHE 119.A O no hydrogen 2.925 N/A TYR 125.A N ALA 121.A O no hydrogen 3.082 N/A VAL 126.A N MET 122.A O no hydrogen 3.172 N/A ASP 127.A N GLY 123.A O no hydrogen 3.125 N/A GLN 128.A N LYS 124.A O no hydrogen 2.927 N/A ARG 129.A N TYR 125.A O no hydrogen 2.816 N/A ARG 129.A NE LEU 94.A O no hydrogen 3.046 N/A ARG 129.A NH2 GLN 132.A OE1 no hydrogen 2.896 N/A LEU 130.A N VAL 126.A O no hydrogen 3.163 N/A GLN 132.A N GLN 128.A O no hydrogen 3.079 N/A LEU 133.A N ARG 129.A O no hydrogen 2.792 N/A GLY 134.A N GLU 131.A O no hydrogen 2.657 N/A ALA 135.A N LEU 130.A O no hydrogen 2.790 N/A GLN 136.A N VAL 104.A O no hydrogen 2.792 N/A ARG 137.A NH1 ASP 127.A OD1 no hydrogen 3.106 N/A ARG 137.A NH2 GLU 131.A OE1 no hydrogen 2.734 N/A ILE 138.A N PHE 106.A O no hydrogen 2.809 N/A GLY 142.A N VAL 108.A O no hydrogen 2.888 N/A GLY 144.A N GLY 110.A O no hydrogen 2.782 N/A ASP 145.A N ASP 153.A OD2 no hydrogen 3.066 N/A ASP 146.A N GLY 112.A O no hydrogen 2.912 N/A ASP 147.A N ASP 145.A OD1 no hydrogen 2.864 N/A GLU 152.A N ASN 149.A OD1 no hydrogen 2.964 N/A ASP 153.A N ASN 149.A O no hydrogen 3.189 N/A PHE 154.A N LEU 150.A O no hydrogen 2.876 N/A ILE 155.A N GLU 151.A O no hydrogen 2.923 N/A THR 156.A N GLU 152.A O no hydrogen 3.127 N/A THR 156.A OG1 GLU 152.A O no hydrogen 2.862 N/A TRP 157.A N ASP 153.A O no hydrogen 3.146 N/A TRP 157.A NE1 GLU 140.A O no hydrogen 3.002 N/A ARG 158.A N PHE 154.A O no hydrogen 2.917 N/A GLU 159.A N ILE 155.A O no hydrogen 3.028 N/A PHE 161.A N TRP 157.A O no hydrogen 2.853 N/A TRP 162.A N ARG 158.A O no hydrogen 3.319 N/A TRP 162.A NE1 ASP 39.A OD2 no hydrogen 3.163 N/A ALA 164.A N GLN 160.A O no hydrogen 3.453 N/A VAL 165.A N PHE 161.A O no hydrogen 3.084 N/A CYS 166.A N TRP 162.A O no hydrogen 2.828 N/A CYS 166.A SG TRP 162.A O no hydrogen 3.419 N/A GLU 167.A N PRO 163.A O no hydrogen 2.734 N/A PHE 168.A N ALA 164.A O no hydrogen 2.763 N/A PHE 169.A N VAL 165.A O no hydrogen 2.940 N/A VAL 171.A N CYS 166.A O no hydrogen 3.016 N/A THR 174.A N ARG 42.A O no hydrogen 3.420 N/A SER 176.A OG GLU 323.A OE2 no hydrogen 2.762 N/A SER 176.A OG GLN 326.A OE1 no hydrogen 3.064 N/A ARG 178.A NE GLU 381.A OE2 no hydrogen 3.103 N/A ARG 178.A NH1 ASP 377.A OD2 no hydrogen 2.602 N/A ARG 178.A NH2 ASP 377.A OD2 no hydrogen 3.290 N/A ARG 178.A NH2 GLU 381.A OE2 no hydrogen 2.827 N/A GLN 179.A N GLU 381.A OE1 no hydrogen 2.853 N/A TYR 180.A N GLU 381.A OE2 no hydrogen 3.366 N/A GLU 181.A N ASN 284.A O no hydrogen 2.980 N/A VAL 183.A N SER 282.A O no hydrogen 2.964 N/A HIS 185.A N ILE 280.A O no hydrogen 2.958 N/A HIS 185.A NE2 SER 282.A OG no hydrogen 2.829 N/A LYS 192.A N ASP 189.A O no hydrogen 3.034 N/A TYR 194.A N PRO 299.A O no hydrogen 2.987 N/A TYR 194.A OH GLY 199.A O no hydrogen 3.144 N/A THR 195.A N GLU 197.A OE2 no hydrogen 2.701 N/A THR 195.A OG1 GLU 197.A OE1 no hydrogen 3.263 N/A THR 195.A OG1 GLU 197.A OE2 no hydrogen 3.340 N/A GLU 197.A N GLU 197.A OE2 no hydrogen 2.666 N/A LYS 202.A N GLU 197.A OE1 no hydrogen 3.158 N/A SER 203.A N ARG 200.A O no hydrogen 3.317 N/A SER 203.A OG ARG 200.A O no hydrogen 2.398 N/A ASN 206.A N LYS 202.A O no hydrogen 3.001 N/A GLN 207.A NE2 SER 203.A O no hydrogen 2.876 N/A GLN 207.A NE2 TYR 204.A O no hydrogen 3.505 N/A GLN 207.A NE2 PRO 216.A O no hydrogen 3.326 N/A ASP 212.A N ASN 215.A O no hydrogen 2.905 N/A LYS 214.A N ASP 212.A OD2 no hydrogen 3.427 N/A ASN 215.A N ASP 212.A O no hydrogen 2.967 N/A ASN 215.A ND2 LYS 208.A O no hydrogen 3.098 N/A ASN 215.A ND2 PRO 210.A O no hydrogen 3.181 N/A PHE 217.A N MET 441.A O no hydrogen 2.791 N/A LEU 218.A N GLN 207.A OE1 no hydrogen 2.672 N/A ALA 219.A N VAL 439.A O no hydrogen 3.068 N/A VAL 221.A N ALA 437.A O no hydrogen 2.791 N/A THR 222.A N ALA 220.A O no hydrogen 3.144 N/A ALA 223.A N GLU 239.A O no hydrogen 3.429 N/A ASN 224.A ND2 ARG 430.A O no hydrogen 3.454 N/A ASN 224.A ND2 LYS 432.A O no hydrogen 2.838 N/A ARG 225.A N HIS 237.A O no hydrogen 3.056 N/A LYS 226.A NZ ASN 228.A O no hydrogen 3.157 N/A LYS 226.A NZ GLY 230.A O no hydrogen 2.442 N/A LEU 227.A N LEU 235.A O no hydrogen 2.993 N/A ASN 228.A ND2 ARG 233.A O no hydrogen 2.641 N/A GLN 229.A N GLU 501.A O no hydrogen 2.677 N/A GLN 229.A NE2 TYR 503.A O no hydrogen 2.850 N/A GLY 230.A N GLU 501.A O no hydrogen 2.943 N/A GLU 232.A N GLU 501.A OE1 no hydrogen 3.313 N/A ARG 233.A NH2 ASP 502.A OD2 no hydrogen 3.064 N/A LEU 235.A N ASN 228.A OD1 no hydrogen 3.182 N/A MET 236.A N ALA 408.A O no hydrogen 2.835 N/A HIS 237.A N ARG 225.A O no hydrogen 3.052 N/A HIS 237.A ND1 TYR 505.A OH no hydrogen 2.796 N/A HIS 237.A NE2 GLU 239.A OE1 no hydrogen 2.661 N/A LEU 238.A N ILE 406.A O no hydrogen 2.876 N/A GLU 239.A N ALA 223.A O no hydrogen 3.103 N/A LEU 240.A N VAL 404.A O no hydrogen 2.874 N/A ASP 241.A N ALA 220.A O no hydrogen 2.921 N/A ILE 242.A N ASN 402.A O no hydrogen 2.907 N/A SER 243.A N ASP 241.A OD1 no hydrogen 2.845 N/A SER 243.A OG ASP 241.A OD1 no hydrogen 2.681 N/A SER 243.A OG ASP 241.A OD2 no hydrogen 3.551 N/A SER 245.A N ILE 242.A O no hydrogen 3.057 N/A SER 245.A OG ILE 242.A O no hydrogen 2.848 N/A ILE 247.A N SER 245.A OG no hydrogen 3.106 N/A TYR 249.A OH SER 395.A OG no hydrogen 2.923 N/A TYR 249.A OH HIS 400.A O no hydrogen 2.681 N/A TYR 249.A OH SER 403.A O no hydrogen 2.523 N/A GLU 250.A N ASP 253.A OD2 no hydrogen 2.755 N/A SER 251.A OG SER 395.A O no hydrogen 3.493 N/A SER 251.A OG GLU 476.A OE1 no hydrogen 3.306 N/A ASP 253.A N GLU 250.A O no hydrogen 3.212 N/A HIS 254.A N ARG 444.A O no hydrogen 3.121 N/A VAL 255.A N TYR 391.A O no hydrogen 2.722 N/A ALA 256.A N PHE 442.A O no hydrogen 2.967 N/A VAL 257.A N ARG 389.A O no hydrogen 2.918 N/A TYR 258.A N PRO 440.A O no hydrogen 3.123 N/A TYR 258.A OH ALA 213.A O no hydrogen 2.781 N/A ASN 261.A N THR 307.A O no hydrogen 2.763 N/A ASN 261.A ND2 LEU 306.A O no hydrogen 2.833 N/A ASN 261.A ND2 LEU 310.A O no hydrogen 2.828 N/A LEU 265.A N ASP 262.A OD2 no hydrogen 3.220 N/A VAL 266.A N ASP 262.A O no hydrogen 3.201 N/A ASN 267.A N SER 263.A O no hydrogen 3.053 N/A GLN 268.A N ALA 264.A O no hydrogen 3.034 N/A ILE 269.A N LEU 265.A O no hydrogen 3.027 N/A GLY 270.A N VAL 266.A O no hydrogen 3.100 N/A GLU 271.A N ASN 267.A O no hydrogen 2.722 N/A ILE 272.A N GLN 268.A O no hydrogen 2.906 N/A LEU 273.A N ILE 269.A O no hydrogen 3.176 N/A GLY 274.A N GLU 271.A O no hydrogen 2.925 N/A ALA 275.A N GLY 270.A O no hydrogen 2.910 N/A ASP 278.A N ASP 276.A OD1 no hydrogen 3.274 N/A VAL 279.A N ASP 276.A O no hydrogen 3.287 N/A MET 281.A N THR 300.A O no hydrogen 2.784 N/A SER 282.A N VAL 183.A O no hydrogen 3.037 N/A SER 282.A OG HIS 185.A NE2 no hydrogen 2.829 N/A ASN 284.A N GLU 181.A O no hydrogen 3.076 N/A ASN 285.A N LYS 293.A O no hydrogen 2.715 N/A ASN 285.A ND2 LYS 292.A O no hydrogen 2.804 N/A LEU 286.A N GLN 179.A O no hydrogen 3.033 N/A ASP 287.A N ASN 285.A OD1 no hydrogen 3.129 N/A GLU 289.A N ASP 287.A OD1 no hydrogen 2.967 N/A SER 290.A N ASP 287.A OD1 no hydrogen 3.155 N/A LYS 292.A N SER 290.A OG no hydrogen 3.332 N/A HIS 294.A ND1 LEU 283.A O no hydrogen 3.020 N/A CYS 298.A SG PHE 296.A O no hydrogen 3.325 N/A THR 300.A N MET 281.A O no hydrogen 2.829 N/A THR 300.A OG1 TYR 194.A O no hydrogen 2.618 N/A THR 301.A OG1 THR 304.A OG1 no hydrogen 2.910 N/A ARG 303.A N LEU 277.A O no hydrogen 2.874 N/A ARG 303.A NE ASP 278.A OD1 no hydrogen 3.122 N/A ARG 303.A NH1 ASP 278.A OD2 no hydrogen 3.250 N/A ARG 303.A NH2 ASN 267.A OD1 no hydrogen 2.408 N/A THR 304.A N THR 301.A OG1 no hydrogen 3.031 N/A THR 304.A OG1 THR 301.A OG1 no hydrogen 2.910 N/A ALA 305.A N THR 301.A O no hydrogen 2.950 N/A LEU 306.A N TYR 302.A O no hydrogen 2.779 N/A THR 307.A N THR 304.A O no hydrogen 2.947 N/A THR 307.A OG1 ARG 303.A O no hydrogen 2.718 N/A TYR 308.A N THR 304.A O no hydrogen 2.878 N/A TYR 309.A N ALA 305.A O no hydrogen 3.008 N/A TYR 309.A OH GLU 197.A O no hydrogen 2.609 N/A ASP 311.A N PRO 384.A O no hydrogen 2.789 N/A THR 313.A N ASP 311.A OD1 no hydrogen 3.177 N/A THR 313.A OG1 ASP 311.A OD1 no hydrogen 3.489 N/A ASN 314.A N ASP 311.A OD1 no hydrogen 2.949 N/A ASN 314.A ND2 ASP 311.A OD2 no hydrogen 3.229 N/A ARG 317.A NH1 GLU 151.A OE1 no hydrogen 2.929 N/A THR 318.A N GLU 151.A OE2 no hydrogen 2.920 N/A THR 318.A OG1 GLU 151.A OE2 no hydrogen 2.484 N/A LEU 321.A N ARG 317.A O no hydrogen 3.383 N/A TYR 322.A N THR 318.A O no hydrogen 2.818 N/A TYR 322.A OH HIS 338.A NE2 no hydrogen 3.096 N/A GLU 323.A N ASN 319.A O no hydrogen 2.913 N/A LEU 324.A N VAL 320.A O no hydrogen 3.207 N/A ALA 325.A N LEU 321.A O no hydrogen 3.093 N/A TYR 327.A N LEU 324.A O no hydrogen 2.581 N/A TYR 327.A OH HIS 378.A ND1 no hydrogen 2.745 N/A ALA 328.A N ALA 325.A O no hydrogen 3.070 N/A SER 329.A N SER 371.A O no hydrogen 3.283 N/A SER 329.A OG SER 371.A O no hydrogen 3.377 N/A GLU 330.A N SER 371.A OG no hydrogen 3.245 N/A GLU 333.A N GLU 330.A O no hydrogen 2.868 N/A GLN 334.A N GLU 330.A O no hydrogen 3.094 N/A GLN 334.A NE2 ALA 325.A O no hydrogen 2.865 N/A GLU 335.A N PRO 331.A O no hydrogen 2.979 N/A HIS 336.A N SER 332.A O no hydrogen 3.094 N/A LEU 337.A N GLU 333.A O no hydrogen 3.145 N/A HIS 338.A N GLN 334.A O no hydrogen 2.985 N/A LYS 339.A N GLU 335.A O no hydrogen 2.999 N/A LYS 339.A N HIS 336.A O no hydrogen 3.050 N/A SER 342.A N LYS 339.A O no hydrogen 2.871 N/A SER 342.A OG LYS 339.A O no hydrogen 2.996 N/A SER 343.A OG GLU 159.A OE1 no hydrogen 2.657 N/A SER 343.A OG GLU 159.A OE2 no hydrogen 2.922 N/A LYS 348.A NZ SER 343.A O no hydrogen 3.231 N/A GLU 349.A N GLY 345.A O no hydrogen 3.203 N/A LEU 350.A N GLU 346.A O no hydrogen 2.787 N/A TYR 351.A N GLY 347.A O no hydrogen 2.905 N/A TYR 351.A OH PRO 316.A O no hydrogen 3.258 N/A LEU 352.A N LYS 348.A O no hydrogen 3.019 N/A SER 353.A N GLU 349.A O no hydrogen 3.081 N/A SER 353.A OG GLU 349.A O no hydrogen 2.884 N/A SER 353.A OG LEU 350.A O no hydrogen 3.471 N/A TRP 354.A N LEU 350.A O no hydrogen 2.808 N/A VAL 356.A N TYR 351.A O no hydrogen 3.151 N/A GLU 357.A N LEU 352.A O no hydrogen 2.808 N/A ARG 359.A N VAL 356.A O no hydrogen 3.053 N/A ARG 359.A NH1 VAL 356.A O no hydrogen 3.427 N/A ARG 360.A N VAL 355.A O no hydrogen 2.859 N/A ARG 360.A NE ASP 368.A OD2 no hydrogen 2.659 N/A ARG 360.A NH1 TRP 354.A O no hydrogen 2.564 N/A ARG 360.A NH2 ASP 368.A OD2 no hydrogen 3.050 N/A ALA 364.A N HIS 361.A ND1 no hydrogen 3.256 N/A ILE 365.A N HIS 361.A O no hydrogen 3.117 N/A LEU 366.A N ILE 362.A O no hydrogen 2.874 N/A GLN 367.A N LEU 363.A O no hydrogen 2.853 N/A ASP 368.A N ALA 364.A O no hydrogen 2.774 N/A TYR 369.A N ILE 365.A O no hydrogen 2.841 N/A SER 371.A N GLU 333.A OE2 no hydrogen 3.025 N/A SER 371.A OG GLU 333.A OE2 no hydrogen 2.684 N/A LEU 372.A N TYR 369.A O no hydrogen 3.130 N/A ARG 373.A N TYR 327.A O no hydrogen 3.139 N/A ARG 373.A NH1 LEU 366.A O no hydrogen 3.271 N/A ARG 373.A NH1 LEU 372.A O no hydrogen 2.948 N/A HIS 378.A ND1 TYR 327.A OH no hydrogen 2.745 N/A LEU 379.A N PRO 375.A O no hydrogen 3.176 N/A CYS 380.A N ILE 376.A O no hydrogen 2.977 N/A CYS 380.A SG ILE 376.A O no hydrogen 3.255 N/A GLU 381.A N ASP 377.A O no hydrogen 3.157 N/A LEU 382.A N HIS 378.A O no hydrogen 2.989 N/A LEU 382.A N LEU 379.A O no hydrogen 2.983 N/A LEU 383.A N LEU 379.A O no hydrogen 2.947 N/A ARG 385.A NE TYR 309.A O no hydrogen 2.650 N/A ARG 385.A NH1 PRO 295.A O no hydrogen 3.412 N/A LEU 386.A N TYR 309.A O no hydrogen 2.929 N/A GLN 387.A NE2 ARG 385.A O no hydrogen 3.490 N/A ARG 389.A N VAL 257.A O no hydrogen 2.997 N/A ARG 389.A NH2 GLN 387.A O no hydrogen 2.690 N/A TYR 391.A N VAL 255.A O no hydrogen 2.816 N/A ILE 393.A N ASP 253.A O no hydrogen 2.982 N/A ALA 394.A N HIS 405.A O no hydrogen 2.774 N/A SER 395.A OG TYR 249.A OH no hydrogen 2.923 N/A SER 395.A OG SER 403.A O no hydrogen 3.481 N/A SER 396.A N GLN 475.A OE1 no hydrogen 3.096 N/A SER 396.A OG GLU 476.A OE1 no hydrogen 2.431 N/A SER 397.A OG TYR 249.A O no hydrogen 2.565 N/A LYS 398.A N SER 396.A OG no hydrogen 3.383 N/A LYS 398.A NZ GLU 250.A OE1 no hydrogen 3.258 N/A VAL 399.A N SER 396.A O no hydrogen 3.279 N/A HIS 400.A N SER 396.A O no hydrogen 2.781 N/A SER 403.A N HIS 400.A O no hydrogen 3.140 N/A SER 403.A OG LEU 240.A O no hydrogen 3.106 N/A VAL 404.A N LEU 240.A O no hydrogen 2.835 N/A HIS 405.A N SER 395.A OG no hydrogen 3.398 N/A ILE 406.A N LEU 238.A O no hydrogen 2.748 N/A ALA 408.A N MET 236.A O no hydrogen 3.031 N/A ALA 410.A N HIS 234.A O no hydrogen 2.910 N/A VAL 411.A N THR 426.A OG1 no hydrogen 3.084 N/A TYR 413.A N ASN 421.A O no hydrogen 3.041 N/A ALA 415.A N ARG 419.A O no hydrogen 3.037 N/A SER 417.A N ALA 358.A O no hydrogen 3.115 N/A GLY 418.A N ALA 415.A O no hydrogen 2.934 N/A ARG 419.A N SER 417.A OG no hydrogen 3.253 N/A ARG 419.A NE SER 417.A O no hydrogen 3.451 N/A ARG 419.A NH1 GLN 367.A OE1 no hydrogen 2.860 N/A ARG 419.A NH2 ASP 368.A OD1 no hydrogen 3.271 N/A ARG 419.A NH2 ASP 368.A OD2 no hydrogen 2.811 N/A ARG 419.A NH2 SER 417.A O no hydrogen 2.893 N/A ASN 421.A N TYR 413.A O no hydrogen 2.898 N/A ASN 421.A ND2 ARG 359.A O no hydrogen 3.135 N/A ASN 421.A ND2 TYR 413.A OH no hydrogen 3.472 N/A LYS 422.A NZ SER 427.A OG no hydrogen 3.347 N/A GLY 423.A N VAL 411.A O no hydrogen 2.862 N/A THR 426.A OG1 GLY 423.A O no hydrogen 3.518 N/A SER 427.A N GLY 423.A O no hydrogen 3.056 N/A SER 427.A OG GLY 423.A O no hydrogen 2.829 N/A TRP 428.A N VAL 424.A O no hydrogen 3.307 N/A LEU 429.A N ALA 425.A O no hydrogen 2.755 N/A ARG 430.A N THR 426.A O no hydrogen 2.946 N/A ALA 431.A N SER 427.A O no hydrogen 3.310 N/A LYS 432.A N LEU 429.A O no hydrogen 3.149 N/A LYS 432.A NZ LEU 438.A O no hydrogen 3.056 N/A VAL 439.A N ALA 219.A O no hydrogen 2.831 N/A MET 441.A N PHE 217.A O no hydrogen 2.754 N/A PHE 442.A N ALA 256.A O no hydrogen 3.169 N/A ARG 444.A N HIS 254.A O no hydrogen 3.078 N/A ARG 444.A NE ASP 85.A OD2 no hydrogen 2.946 N/A ARG 444.A NH2 ASP 85.A OD1 no hydrogen 3.285 N/A SER 446.A N ASP 253.A OD1 no hydrogen 2.757 N/A SER 446.A OG GLY 252.A O no hydrogen 2.616 N/A PHE 448.A N SER 446.A OG no hydrogen 3.044 N/A ARG 449.A NH1 ASP 253.A OD1 no hydrogen 2.983 N/A ARG 449.A NH1 PHE 448.A O no hydrogen 3.558 N/A ARG 449.A NH2 ASP 253.A OD1 no hydrogen 3.297 N/A SER 454.A OG GLU 486.A O no hydrogen 2.396 N/A THR 456.A N LYS 453.A O no hydrogen 3.260 N/A THR 456.A OG1 LYS 453.A O no hydrogen 3.354 N/A VAL 458.A N GLU 489.A O no hydrogen 3.146 N/A ILE 459.A N HIS 556.A O no hydrogen 2.906 N/A MET 460.A N LEU 491.A O no hydrogen 2.857 N/A VAL 461.A N TYR 558.A O no hydrogen 2.790 N/A GLY 462.A N TYR 493.A O no hydrogen 2.883 N/A GLY 464.A N GLY 495.A O no hydrogen 2.959 N/A GLY 466.A N PRO 463.A O no hydrogen 2.851 N/A ILE 467.A N GLY 464.A O no hydrogen 3.389 N/A ALA 468.A N THR 465.A O no hydrogen 2.876 N/A PHE 470.A N ILE 467.A O no hydrogen 2.749 N/A MET 471.A N ILE 467.A O no hydrogen 3.190 N/A MET 471.A N ALA 468.A O no hydrogen 3.399 N/A PHE 473.A N PRO 469.A O no hydrogen 3.060 N/A ILE 474.A N PHE 470.A O no hydrogen 2.786 N/A GLN 475.A N MET 471.A O no hydrogen 2.908 N/A GLU 476.A N GLY 472.A O no hydrogen 2.965 N/A ARG 477.A N PHE 473.A O no hydrogen 2.918 N/A ARG 477.A NE THR 490.A OG1 no hydrogen 2.969 N/A ARG 477.A NH1 THR 456.A O no hydrogen 2.994 N/A ARG 477.A NH1 GLU 489.A O no hydrogen 3.188 N/A ARG 477.A NH1 THR 490.A OG1 no hydrogen 2.946 N/A ARG 477.A NH2 THR 456.A O no hydrogen 3.090 N/A ALA 478.A N ILE 474.A O no hydrogen 2.972 N/A TRP 479.A N GLN 475.A O no hydrogen 2.984 N/A LEU 480.A N GLU 476.A O no hydrogen 2.952 N/A ARG 481.A N ARG 477.A O no hydrogen 3.406 N/A ARG 481.A NH2 ASP 515.A O no hydrogen 3.087 N/A GLU 482.A N ALA 478.A O no hydrogen 3.252 N/A GLN 483.A N TRP 479.A O no hydrogen 2.993 N/A GLN 483.A N LEU 480.A O no hydrogen 3.110 N/A GLY 484.A N ARG 481.A O no hydrogen 2.722 N/A LYS 485.A N LEU 480.A O no hydrogen 3.007 N/A GLY 488.A N SER 454.A O no hydrogen 2.939 N/A THR 490.A N THR 519.A OG1 no hydrogen 3.040 N/A THR 490.A OG1 GLY 488.A O no hydrogen 3.337 N/A LEU 491.A N VAL 458.A O no hydrogen 3.031 N/A LEU 492.A N GLN 520.A O no hydrogen 3.180 N/A TYR 493.A N MET 460.A O no hydrogen 2.671 N/A TYR 493.A OH ASP 542.A OD2 no hydrogen 2.576 N/A TYR 494.A N ASN 522.A O no hydrogen 3.002 N/A TYR 494.A OH ASP 502.A O no hydrogen 3.164 N/A CYS 496.A N ALA 524.A O no hydrogen 3.064 N/A CYS 496.A SG ARG 498.A O no hydrogen 3.750 N/A ARG 497.A N ASP 502.A OD1 no hydrogen 2.969 N/A ARG 497.A NH1 GLU 232.A OE1 no hydrogen 2.409 N/A ARG 498.A N ASP 502.A OD1 no hydrogen 3.458 N/A ARG 498.A NH1 GLU 501.A OE2 no hydrogen 3.460 N/A ARG 498.A NH2 GLU 232.A OE2 no hydrogen 3.179 N/A SER 499.A N GLU 528.A OE1 no hydrogen 2.785 N/A GLU 501.A N ARG 498.A O no hydrogen 3.123 N/A ASP 502.A N ARG 498.A O no hydrogen 3.336 N/A TYR 503.A N GLN 229.A OE1 no hydrogen 2.896 N/A LEU 504.A N TYR 494.A OH no hydrogen 2.952 N/A TYR 505.A OH HIS 237.A ND1 no hydrogen 2.796 N/A ARG 506.A NE GLU 507.A OE2 no hydrogen 3.105 N/A GLU 508.A N GLU 508.A OE1 no hydrogen 2.962 N/A LEU 509.A N TYR 505.A O no hydrogen 2.856 N/A ALA 510.A N ARG 506.A O no hydrogen 2.958 N/A ARG 511.A N GLU 507.A O no hydrogen 3.111 N/A ARG 511.A NH1 ASP 515.A OD1 no hydrogen 2.752 N/A PHE 512.A N GLU 508.A O no hydrogen 3.277 N/A HIS 513.A N LEU 509.A O no hydrogen 3.087 N/A LYS 514.A N ALA 510.A O no hydrogen 3.052 N/A ASP 515.A N ARG 511.A O no hydrogen 3.105 N/A GLY 516.A N HIS 513.A O no hydrogen 3.404 N/A LEU 518.A N PHE 512.A O no hydrogen 3.065 N/A THR 519.A N THR 490.A O no hydrogen 2.857 N/A ASN 522.A N LEU 492.A O no hydrogen 3.000 N/A ASN 522.A ND2 GLN 520.A OE1 no hydrogen 2.716 N/A ALA 524.A N TYR 494.A O no hydrogen 2.998 N/A SER 526.A N CYS 496.A O no hydrogen 2.772 N/A SER 526.A OG CYS 496.A O no hydrogen 3.307 N/A ARG 527.A N ARG 497.A O no hydrogen 2.894 N/A GLN 529.A NE2 PHE 525.A O no hydrogen 2.808 N/A GLN 529.A NE2 HIS 531.A O no hydrogen 3.015 N/A TYR 534.A N HIS 537.A ND1 no hydrogen 2.920 N/A GLN 536.A N GLN 536.A OE1 no hydrogen 2.570 N/A HIS 537.A N TYR 534.A O no hydrogen 3.185 N/A LEU 539.A N VAL 535.A O no hydrogen 2.884 N/A LYS 540.A N GLN 536.A O no hydrogen 3.119 N/A ARG 541.A N HIS 537.A O no hydrogen 3.165 N/A ARG 541.A NE ASP 542.A OD1 no hydrogen 2.858 N/A ARG 541.A NH2 ASN 522.A OD1 no hydrogen 3.086 N/A ARG 541.A NH2 ASP 542.A OD2 no hydrogen 3.150 N/A ASP 542.A N LEU 538.A O no hydrogen 2.985 N/A ARG 543.A N LYS 540.A O no hydrogen 3.165 N/A ARG 543.A NH1 LYS 540.A O no hydrogen 2.495 N/A HIS 545.A NE2 GLU 489.A OE1 no hydrogen 2.841 N/A LEU 546.A N ASP 542.A O no hydrogen 2.760 N/A TRP 547.A N ARG 543.A O no hydrogen 3.047 N/A LYS 548.A N GLU 544.A O no hydrogen 3.334 N/A LEU 549.A N HIS 545.A O no hydrogen 3.163 N/A ILE 550.A N LEU 546.A O no hydrogen 2.890 N/A HIS 551.A N TRP 547.A O no hydrogen 2.604 N/A GLU 552.A N LYS 548.A O no hydrogen 2.730 N/A GLY 553.A N LYS 548.A O no hydrogen 3.212 N/A GLY 553.A N LEU 549.A O no hydrogen 3.175 N/A ALA 555.A N LEU 549.A O no hydrogen 2.873 N/A HIS 556.A N PRO 457.A O no hydrogen 3.003 N/A HIS 556.A ND1 TYR 558.A OH no hydrogen 3.297 N/A TYR 558.A N ILE 459.A O no hydrogen 2.788 N/A TYR 558.A OH ARG 449.A O no hydrogen 2.407 N/A VAL 559.A N ARG 601.A O no hydrogen 2.958 N/A CYS 560.A N VAL 461.A O no hydrogen 2.927 N/A CYS 560.A SG GLY 466.A O no hydrogen 3.234 N/A CYS 560.A SG SER 603.A O no hydrogen 3.245 N/A GLY 561.A N SER 603.A O no hydrogen 3.236 N/A ALA 563.A N TRP 605.A O no hydrogen 3.221 N/A ARG 564.A N ASP 562.A OD1 no hydrogen 3.236 N/A ASN 565.A N ASP 562.A OD2 no hydrogen 3.161 N/A MET 566.A N ASP 562.A OD2 no hydrogen 3.109 N/A ALA 567.A N ASP 562.A O no hydrogen 3.425 N/A LYS 568.A NZ THR 115.A O no hydrogen 3.551 N/A ASP 569.A N ASN 565.A O no hydrogen 3.028 N/A VAL 570.A N MET 566.A O no hydrogen 2.895 N/A GLN 571.A N ALA 567.A O no hydrogen 3.102 N/A ASN 572.A N LYS 568.A O no hydrogen 2.911 N/A THR 573.A N ASP 569.A O no hydrogen 3.106 N/A THR 573.A OG1 ASP 569.A O no hydrogen 3.201 N/A PHE 574.A N VAL 570.A O no hydrogen 3.118 N/A TYR 575.A N GLN 571.A O no hydrogen 2.878 N/A ASP 576.A N ASN 572.A O no hydrogen 2.960 N/A ILE 577.A N THR 573.A O no hydrogen 2.891 N/A VAL 578.A N PHE 574.A O no hydrogen 3.047 N/A ALA 579.A N TYR 575.A O no hydrogen 2.936 N/A GLU 580.A N ASP 576.A O no hydrogen 3.284 N/A PHE 581.A N ILE 577.A O no hydrogen 3.107 N/A GLY 582.A N VAL 578.A O no hydrogen 2.858 N/A MET 584.A N ALA 579.A O no hydrogen 3.315 N/A ALA 589.A N GLU 585.A O no hydrogen 3.097 N/A VAL 590.A N HIS 586.A O no hydrogen 3.049 N/A ASP 591.A N THR 587.A O no hydrogen 3.147 N/A TYR 592.A N GLN 588.A O no hydrogen 3.006 N/A VAL 593.A N ALA 589.A O no hydrogen 2.944 N/A LYS 594.A N VAL 590.A O no hydrogen 2.955 N/A LYS 595.A N ASP 591.A O no hydrogen 3.035 N/A LEU 596.A N TYR 592.A O no hydrogen 3.057 N/A MET 597.A N VAL 593.A O no hydrogen 2.941 N/A THR 598.A OG1 LYS 595.A O no hydrogen 2.608 N/A LYS 599.A NZ GLU 80.A O no hydrogen 3.249 N/A GLY 600.A N GLU 80.A OE1 no hydrogen 2.865 N/A GLY 600.A N GLU 80.A OE2 no hydrogen 3.068 N/A ARG 601.A N GLU 80.A OE2 no hydrogen 3.369 N/A TYR 602.A N GLU 80.A OE2 no hydrogen 3.089 N/A SER 603.A N VAL 559.A O no hydrogen 2.929 N/A TRP 605.A N GLY 561.A O no hydrogen 3.356 N/A