Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n24_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N TYR 22.A O no hydrogen 2.773 N/A ARG 3.A NH1 VAL 16.A O no hydrogen 2.707 N/A VAL 5.A N TRP 24.A O no hydrogen 3.084 N/A ARG 6.A NH1 ASP 26.A OD2 no hydrogen 2.777 N/A LEU 7.A N ASP 26.A O no hydrogen 3.211 N/A SER 11.A N GLN 8.A O no hydrogen 3.327 N/A SER 11.A OG ARG 12.A O no hydrogen 3.167 N/A VAL 13.A N GLY 108.A O no hydrogen 2.845 N/A ALA 15.A N PHE 110.A O no hydrogen 2.906 N/A TYR 17.A N THR 112.A O no hydrogen 2.797 N/A LEU 19.A N ILE 114.A O no hydrogen 2.963 N/A THR 21.A N VAL 18.A O no hydrogen 3.161 N/A THR 21.A OG1 VAL 18.A O no hydrogen 2.659 N/A TYR 22.A N ARG 1.A O no hydrogen 3.065 N/A LEU 23.A N VAL 77.A O no hydrogen 2.885 N/A TRP 24.A N ARG 3.A O no hydrogen 2.884 N/A TRP 24.A NE1 THR 4.A OG1 no hydrogen 2.353 N/A THR 25.A N LEU 75.A O no hydrogen 2.813 N/A THR 25.A OG1 VAL 5.A O no hydrogen 3.385 N/A TYR 28.A N ASP 26.A OD1 no hydrogen 2.679 N/A SER 29.A N ASP 26.A OD1 no hydrogen 3.026 N/A SER 29.A OG ASP 26.A OD2 no hydrogen 2.482 N/A ALA 31.A N TYR 28.A O no hydrogen 3.420 N/A ALA 35.A N PRO 32.A O no hydrogen 3.233 N/A GLN 36.A N TYR 96.A O no hydrogen 2.707 N/A THR 37.A N TYR 96.A O no hydrogen 3.300 N/A PHE 38.A N TRP 67.A O no hydrogen 2.827 N/A SER 39.A N ASN 94.A O no hydrogen 2.991 N/A SER 39.A OG TYR 96.A OH no hydrogen 2.750 N/A LYS 41.A N THR 92.A O no hydrogen 2.792 N/A HIS 42.A N THR 61.A O no hydrogen 2.908 N/A HIS 42.A ND1 SER 43.A O no hydrogen 2.895 N/A HIS 42.A NE2 VAL 59.A O no hydrogen 2.791 N/A SER 43.A N LYS 90.A O no hydrogen 3.056 N/A SER 43.A OG SER 88.A O no hydrogen 3.428 N/A VAL 46.A N SER 43.A O no hydrogen 3.416 N/A TRP 47.A N THR 78.A O no hydrogen 2.777 N/A GLU 49.A N ARG 76.A O no hydrogen 2.965 N/A VAL 50.A N GLU 57.A O no hydrogen 2.770 N/A VAL 51.A N THR 74.A O no hydrogen 2.800 N/A ARG 52.A N GLU 55.A O no hydrogen 2.920 N/A ASP 53.A N SER 72.A O no hydrogen 3.174 N/A GLU 55.A N ARG 52.A O no hydrogen 2.996 N/A GLU 57.A N VAL 50.A O no hydrogen 2.828 N/A VAL 59.A N VAL 48.A O no hydrogen 2.880 N/A GLN 65.A NE2 GLU 57.A OE2 no hydrogen 3.257 N/A ARG 66.A NH1 SER 101.A OG no hydrogen 3.299 N/A TRP 67.A N PHE 38.A O no hydrogen 2.912 N/A LEU 69.A N GLN 36.A O no hydrogen 2.770 N/A SER 70.A OG SER 72.A OG no hydrogen 3.003 N/A SER 72.A N SER 70.A OG no hydrogen 3.057 N/A SER 72.A OG SER 70.A OG no hydrogen 3.003 N/A THR 73.A N SER 70.A O no hydrogen 2.845 N/A THR 74.A N VAL 51.A O no hydrogen 2.942 N/A LEU 75.A N THR 25.A O no hydrogen 2.975 N/A ARG 76.A N GLU 49.A O no hydrogen 2.892 N/A ARG 76.A NE GLU 49.A OE1 no hydrogen 2.995 N/A ARG 76.A NH2 GLU 49.A OE2 no hydrogen 3.242 N/A VAL 77.A N LEU 23.A O no hydrogen 2.826 N/A THR 78.A N TRP 47.A O no hydrogen 3.016 N/A MET 79.A N TYR 17.A OH no hydrogen 3.030 N/A SER 83.A N ALA 113.A O no hydrogen 2.702 N/A SER 83.A OG ASP 89.A OD2 no hydrogen 2.515 N/A THR 84.A N SER 87.A OG no hydrogen 2.865 N/A ALA 86.A N THR 84.A OG1 no hydrogen 3.053 N/A SER 87.A N THR 84.A O no hydrogen 3.091 N/A SER 87.A OG THR 84.A O no hydrogen 3.349 N/A LYS 90.A N SER 43.A OG no hydrogen 3.090 N/A VAL 91.A N LEU 109.A O no hydrogen 2.937 N/A THR 92.A N LYS 41.A O no hydrogen 2.814 N/A VAL 93.A N ALA 107.A O no hydrogen 2.830 N/A ASN 94.A N SER 39.A O no hydrogen 2.932 N/A TYR 95.A N ASP 105.A O no hydrogen 2.902 N/A TYR 95.A OH VAL 27.A O no hydrogen 2.531 N/A TYR 96.A N THR 37.A O no hydrogen 3.004 N/A TYR 96.A OH SER 39.A OG no hydrogen 2.750 N/A ILE 104.A N TYR 95.A O no hydrogen 2.811 N/A GLN 106.A NE2 ASN 94.A OD1 no hydrogen 2.968 N/A ALA 107.A N VAL 93.A O no hydrogen 2.833 N/A LEU 109.A N VAL 91.A O no hydrogen 2.864 N/A PHE 110.A N VAL 13.A O no hydrogen 2.791 N/A LEU 111.A N ASP 89.A O no hydrogen 2.941 N/A THR 112.A N ALA 15.A O no hydrogen 3.061 N/A ALA 113.A N SER 83.A OG no hydrogen 2.789 N/A ILE 114.A N TYR 17.A O no hydrogen 2.827 N/A GLU 115.A N LYS 175.A O no hydrogen 2.741 N/A SER 117.A N ARG 173.A O no hydrogen 2.914 N/A SER 117.A OG ASP 119.A OD1 no hydrogen 2.562 N/A LEU 118.A N ASP 274.A OD2 no hydrogen 2.893 N/A ASP 119.A N ILE 171.A O no hydrogen 2.781 N/A ALA 122.A N GLU 129.A OE2 no hydrogen 3.083 N/A ASP 123.A N GLU 129.A OE2 no hydrogen 2.954 N/A ARG 124.A NE GLY 146.A O no hydrogen 2.759 N/A ARG 124.A NH1 THR 139.A O no hydrogen 3.277 N/A ARG 124.A NH2 THR 139.A O no hydrogen 2.820 N/A ARG 124.A NH2 GLY 146.A O no hydrogen 3.303 N/A ASP 125.A N ASP 121.A OD1 no hydrogen 3.051 N/A GLY 126.A N ASP 121.A OD2 no hydrogen 2.759 N/A VAL 127.A N ASP 125.A OD1 no hydrogen 2.997 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.795 N/A ASN 131.A N ASP 119.A OD1 no hydrogen 3.030 N/A ASN 132.A ND2 GLU 129.A OE2 no hydrogen 2.625 N/A ASN 132.A ND2 GLN 145.A OE1 no hydrogen 3.137 N/A LYS 134.A N ASN 132.A OD1 no hydrogen 2.921 N/A LYS 135.A N ASN 132.A O no hydrogen 2.935 N/A LYS 135.A NZ LEU 118.A O no hydrogen 2.716 N/A LYS 135.A NZ ASP 119.A OD1 no hydrogen 3.439 N/A LYS 135.A NZ ASN 131.A OD1 no hydrogen 2.811 N/A LYS 135.A NZ ASP 274.A OD2 no hydrogen 2.679 N/A SER 137.A N LYS 134.A O no hydrogen 3.030 N/A TRP 138.A NE1 ALA 147.A O no hydrogen 3.049 N/A THR 139.A N GLN 145.A O no hydrogen 2.887 N/A THR 139.A OG1 GLN 145.A O no hydrogen 3.531 N/A GLY 141.A N TRP 638.A O no hydrogen 3.021 N/A GLY 144.A N GLY 141.A O no hydrogen 2.886 N/A GLN 145.A N THR 139.A OG1 no hydrogen 2.899 N/A GLN 145.A NE2 GLY 144.A O no hydrogen 3.015 N/A GLY 146.A N ALA 122.A O no hydrogen 2.657 N/A LEU 149.A N ARG 279.A O no hydrogen 2.896 N/A ASN 152.A N GLY 240.A O no hydrogen 2.950 N/A ASN 152.A ND2 GLU 239.A OE1 no hydrogen 2.901 N/A CYS 153.A SG VAL 151.A O no hydrogen 3.816 N/A ASP 154.A N ASN 152.A OD1 no hydrogen 2.853 N/A TYR 159.A N TYR 212.A O no hydrogen 3.031 N/A LYS 165.A N GLU 162.A O no hydrogen 3.134 N/A MET 167.A N LEU 164.A O no hydrogen 2.908 N/A SER 168.A N VAL 238.A O no hydrogen 2.942 N/A SER 168.A OG ILE 148.A O no hydrogen 2.828 N/A MET 170.A N PHE 236.A O no hydrogen 2.990 N/A ILE 171.A N ASP 119.A O no hydrogen 2.851 N/A LEU 172.A N LEU 234.A O no hydrogen 2.882 N/A ARG 173.A N SER 117.A O no hydrogen 2.859 N/A ARG 173.A NE GLU 233.A OE2 no hydrogen 2.563 N/A ARG 173.A NH1 ASP 119.A OD2 no hydrogen 2.834 N/A ARG 173.A NH1 VAL 128.A O no hydrogen 3.366 N/A ARG 173.A NH1 GLU 129.A O no hydrogen 3.263 N/A ARG 173.A NH2 VAL 128.A O no hydrogen 3.121 N/A THR 174.A N ALA 232.A O no hydrogen 2.873 N/A LYS 175.A N GLU 115.A O no hydrogen 3.074 N/A GLY 176.A N GLY 230.A O no hydrogen 3.245 N/A ASP 178.A N GLU 85.A OE2 no hydrogen 2.855 N/A GLU 185.A N LEU 259.A O no hydrogen 3.125 N/A VAL 187.A N SER 257.A O no hydrogen 2.894 N/A LEU 188.A N HIS 223.A O no hydrogen 2.909 N/A TYR 189.A N HIS 255.A O no hydrogen 2.773 N/A ILE 190.A N LEU 221.A O no hydrogen 2.915 N/A ASP 194.A N SER 191.A OG no hydrogen 3.210 N/A SER 195.A N MET 192.A O no hydrogen 3.160 N/A SER 195.A OG MET 192.A O no hydrogen 2.548 N/A LYS 197.A N ASP 194.A O no hydrogen 2.779 N/A LYS 197.A NZ SER 193.A O no hydrogen 3.016 N/A LYS 197.A NZ ASP 196.A OD1 no hydrogen 2.753 N/A GLY 199.A N GLU 239.A O no hydrogen 3.003 N/A VAL 200.A N LEU 216.A O no hydrogen 3.013 N/A PHE 201.A N PHE 237.A O no hydrogen 2.884 N/A TYR 202.A N ILE 213.A O no hydrogen 2.920 N/A PHE 208.A N ASN 205.A O no hydrogen 3.033 N/A GLY 209.A N PRO 206.A O no hydrogen 3.128 N/A TYR 212.A N TYR 159.A O no hydrogen 2.646 N/A ILE 213.A N TYR 202.A O no hydrogen 2.688 N/A ILE 215.A N VAL 200.A O no hydrogen 2.840 N/A GLY 217.A N LYS 220.A O no hydrogen 2.995 N/A LYS 220.A N GLY 217.A O no hydrogen 2.993 N/A LYS 220.A NZ HIS 214.A O no hydrogen 3.559 N/A HIS 223.A N LEU 188.A O no hydrogen 2.712 N/A HIS 223.A NE2 GLU 204.A OE1 no hydrogen 2.478 N/A VAL 225.A N ILE 186.A O no hydrogen 2.858 N/A TYR 227.A OH PRO 177.A O no hydrogen 2.616 N/A GLY 230.A N GLY 176.A O no hydrogen 2.867 N/A ALA 232.A N THR 174.A O no hydrogen 2.862 N/A LEU 234.A N LEU 172.A O no hydrogen 2.894 N/A PHE 236.A N MET 170.A O no hydrogen 2.751 N/A PHE 237.A N PHE 201.A O no hydrogen 3.078 N/A VAL 238.A N SER 168.A O no hydrogen 2.722 N/A GLU 239.A N GLY 199.A O no hydrogen 2.952 N/A GLY 240.A N LEU 150.A O no hydrogen 3.054 N/A LEU 241.A N LYS 197.A O no hydrogen 2.706 N/A CYS 242.A SG PHE 243.A O no hydrogen 4.040 N/A ASP 245.A N PHE 248.A O no hydrogen 2.943 N/A GLU 246.A N ASP 245.A OD1 no hydrogen 2.838 N/A PHE 248.A N ASP 245.A O no hydrogen 2.965 N/A LEU 251.A N SER 249.A OG no hydrogen 3.038 N/A VAL 252.A N PHE 278.A O no hydrogen 2.994 N/A SER 253.A N ASP 194.A OD2 no hydrogen 3.243 N/A ILE 254.A N VAL 276.A O no hydrogen 3.029 N/A HIS 255.A N TYR 189.A O no hydrogen 2.850 N/A HIS 255.A ND1 THR 275.A OG1 no hydrogen 2.671 N/A VAL 256.A N ASP 274.A O no hydrogen 2.974 N/A SER 257.A N VAL 187.A O no hydrogen 2.840 N/A SER 257.A OG THR 273.A OG1 no hydrogen 2.723 N/A LEU 258.A N PHE 272.A O no hydrogen 2.960 N/A LEU 259.A N GLU 185.A O no hydrogen 2.860 N/A GLU 260.A N THR 269.A O no hydrogen 2.750 N/A TYR 261.A N GLY 183.A O no hydrogen 2.703 N/A ILE 266.A N ALA 263.A O no hydrogen 3.185 N/A THR 269.A N GLU 260.A O no hydrogen 2.909 N/A THR 273.A OG1 SER 257.A OG no hydrogen 2.723 N/A ASP 274.A N VAL 256.A O no hydrogen 2.911 N/A THR 275.A OG1 HIS 255.A ND1 no hydrogen 2.671 N/A VAL 276.A N ILE 254.A O no hydrogen 3.114 N/A ILE 277.A N LYS 135.A O no hydrogen 3.151 N/A PHE 278.A N VAL 252.A O no hydrogen 2.865 N/A ARG 279.A N ALA 147.A O no hydrogen 2.977 N/A ARG 279.A NH1 SER 249.A O no hydrogen 3.008 N/A ILE 280.A N GLY 250.A O no hydrogen 2.854 N/A ALA 281.A N LEU 149.A O no hydrogen 2.786 N/A TRP 283.A N GLN 431.A OE1 no hydrogen 2.901 N/A TRP 283.A NE1 VAL 353.A O no hydrogen 2.996 N/A ILE 284.A N TYR 343.A O no hydrogen 3.049 N/A MET 285.A N GLN 434.A OE1 no hydrogen 2.843 N/A ASN 288.A ND2 PHE 455.A O no hydrogen 3.016 N/A LEU 290.A N PRO 287.A O no hydrogen 3.151 N/A VAL 293.A N ARG 629.A O no hydrogen 2.734 N/A SER 294.A N ARG 629.A O no hydrogen 3.316 N/A VAL 295.A N GLU 320.A O no hydrogen 2.723 N/A PHE 296.A N ASN 627.A O no hydrogen 2.744 N/A VAL 297.A N LYS 322.A O no hydrogen 3.013 N/A CYS 298.A N GLY 625.A O no hydrogen 2.886 N/A CYS 298.A SG ASP 332.A O no hydrogen 3.385 N/A CYS 299.A N CYS 324.A O no hydrogen 3.319 N/A CYS 299.A SG MET 300.A O no hydrogen 3.494 N/A ASN 303.A N MET 300.A O no hydrogen 3.089 N/A ASN 303.A ND2 ASP 611.A O no hydrogen 3.217 N/A LEU 307.A N ASN 303.A O no hydrogen 3.384 N/A LYS 308.A N TYR 304.A O no hydrogen 2.926 N/A GLU 309.A N LEU 305.A O no hydrogen 2.829 N/A VAL 310.A N PHE 306.A O no hydrogen 2.852 N/A LYS 311.A N LEU 307.A O no hydrogen 2.917 N/A LYS 311.A NZ GLU 315.A OE2 no hydrogen 2.860 N/A ASN 312.A N LYS 308.A O no hydrogen 2.951 N/A LEU 313.A N GLU 309.A O no hydrogen 2.948 N/A VAL 314.A N VAL 310.A O no hydrogen 2.965 N/A GLU 315.A N LYS 311.A O no hydrogen 2.999 N/A LYS 316.A N LEU 313.A O no hydrogen 3.012 N/A LYS 316.A NZ ASP 574.A OD1 no hydrogen 2.816 N/A LYS 316.A NZ GLU 605.A OE1 no hydrogen 2.707 N/A THR 317.A N VAL 314.A O no hydrogen 2.821 N/A THR 317.A OG1 VAL 314.A O no hydrogen 2.656 N/A CYS 319.A N THR 317.A OG1 no hydrogen 2.992 N/A CYS 319.A SG PRO 292.A O no hydrogen 3.616 N/A CYS 319.A SG THR 317.A OG1 no hydrogen 3.403 N/A GLU 320.A N VAL 293.A O no hydrogen 3.223 N/A LYS 322.A N VAL 295.A O no hydrogen 2.729 N/A LYS 322.A NZ GLU 320.A OE2 no hydrogen 3.360 N/A CYS 324.A N VAL 297.A O no hydrogen 2.769 N/A GLN 326.A NE2 ASP 332.A O no hydrogen 3.166 N/A GLN 326.A NE2 HIS 623.A O no hydrogen 3.249 N/A ASN 329.A ND2 GLY 361.A O no hydrogen 2.813 N/A ARG 330.A N TYR 327.A O no hydrogen 3.186 N/A ARG 330.A NE GLU 338.A OE1 no hydrogen 2.922 N/A ARG 330.A NH1 GLU 338.A OE1 no hydrogen 3.303 N/A ARG 330.A NH1 ASP 356.A OD2 no hydrogen 2.480 N/A GLY 331.A N GLU 338.A OE2 no hydrogen 2.829 N/A ARG 333.A NE CYS 624.A O no hydrogen 2.920 N/A ARG 333.A NH2 ASN 567.A OD1 no hydrogen 3.363 N/A TRP 334.A N GLY 331.A O no hydrogen 3.353 N/A TRP 334.A NE1 PHE 325.A O no hydrogen 3.129 N/A GLN 336.A N ARG 333.A O no hydrogen 2.783 N/A GLN 336.A NE2 ASP 450.A OD2 no hydrogen 3.075 N/A GLN 336.A NE2 ASN 567.A OD1 no hydrogen 2.921 N/A ASP 337.A N ARG 333.A O no hydrogen 2.905 N/A GLU 338.A N TRP 334.A O no hydrogen 2.710 N/A GLU 340.A N LEU 355.A O no hydrogen 3.013 N/A GLY 342.A N VAL 353.A O no hydrogen 3.033 N/A TYR 343.A N ILE 284.A O no hydrogen 2.856 N/A ILE 344.A N PHE 351.A O no hydrogen 3.073 N/A ALA 346.A N LYS 349.A O no hydrogen 2.606 N/A LYS 349.A N ALA 346.A O no hydrogen 3.216 N/A PHE 351.A N ILE 344.A O no hydrogen 3.130 N/A VAL 353.A N GLY 342.A O no hydrogen 2.795 N/A VAL 354.A N GLY 373.A O no hydrogen 2.856 N/A LEU 355.A N GLU 340.A O no hydrogen 2.978 N/A ASP 356.A N VAL 375.A O no hydrogen 2.723 N/A SER 357.A N GLU 338.A O no hydrogen 2.806 N/A ARG 359.A N GLU 338.A OE1 no hydrogen 3.295 N/A ARG 359.A NE ASP 360.A OD1 no hydrogen 3.308 N/A ARG 359.A NE ASP 360.A OD2 no hydrogen 3.338 N/A ARG 359.A NH2 LEU 328.A O no hydrogen 3.291 N/A ARG 359.A NH2 ASP 360.A OD2 no hydrogen 3.143 N/A ASP 360.A N ASN 329.A O no hydrogen 3.004 N/A GLY 361.A N PRO 358.A O no hydrogen 3.368 N/A LYS 365.A NZ ASN 362.A OD1 no hydrogen 3.157 N/A GLY 373.A N PRO 352.A O no hydrogen 2.806 N/A TYR 374.A N CYS 153.A O no hydrogen 2.977 N/A TYR 374.A OH ASP 356.A OD1 no hydrogen 2.808 N/A VAL 375.A N VAL 354.A O no hydrogen 2.880 N/A ARG 377.A N ASP 356.A O no hydrogen 3.218 N/A ARG 377.A NH2 PRO 358.A O no hydrogen 2.913 N/A THR 380.A N ASP 383.A OD1 no hydrogen 2.882 N/A SER 381.A OG VAL 446.A O no hydrogen 2.650 N/A SER 381.A OG HIS 448.A NE2 no hydrogen 3.417 N/A LEU 382.A N THR 380.A OG1 no hydrogen 3.081 N/A ASP 383.A N THR 380.A O no hydrogen 3.077 N/A SER 384.A N SER 381.A O no hydrogen 3.366 N/A SER 384.A OG ASP 337.A O no hydrogen 3.474 N/A PHE 385.A N ASP 337.A O no hydrogen 2.839 N/A GLY 386.A N SER 384.A OG no hydrogen 2.776 N/A ASN 387.A N SER 384.A O no hydrogen 2.837 N/A ASN 387.A ND2 LEU 382.A O no hydrogen 2.830 N/A ASN 387.A ND2 GLY 409.A O no hydrogen 3.002 N/A LEU 388.A N PHE 385.A O no hydrogen 3.167 N/A GLU 389.A N LEU 407.A O no hydrogen 2.935 N/A SER 391.A N ARG 405.A O no hydrogen 2.843 N/A SER 391.A OG PRO 392.A O no hydrogen 2.849 N/A SER 391.A OG ARG 405.A O no hydrogen 3.484 N/A VAL 394.A N TYR 401.A O no hydrogen 3.292 N/A VAL 396.A N LYS 399.A O no hydrogen 2.876 N/A LYS 399.A N VAL 396.A O no hydrogen 3.003 N/A TYR 401.A N VAL 394.A O no hydrogen 2.759 N/A GLY 404.A N TYR 401.A O no hydrogen 2.954 N/A ARG 405.A N SER 391.A OG no hydrogen 2.814 N/A ARG 405.A NE ALA 435.A O no hydrogen 2.797 N/A ARG 405.A NH1 GLU 535.A O no hydrogen 3.154 N/A ARG 405.A NH1 GLU 535.A OE1 no hydrogen 2.952 N/A ARG 405.A NH2 ALA 435.A O no hydrogen 3.163 N/A ILE 406.A N GLN 434.A O no hydrogen 2.929 N/A LEU 407.A N GLU 389.A O no hydrogen 2.594 N/A ILE 408.A N VAL 437.A O no hydrogen 2.937 N/A GLY 409.A N ASN 387.A O no hydrogen 3.400 N/A SER 410.A N LEU 439.A O no hydrogen 2.845 N/A SER 410.A OG SER 411.A O no hydrogen 3.500 N/A SER 410.A OG GLU 438.A OE2 no hydrogen 3.294 N/A SER 411.A N SER 410.A OG no hydrogen 2.653 N/A SER 411.A OG ARG 418.A O no hydrogen 2.674 N/A SER 415.A N PHE 412.A O no hydrogen 3.014 N/A SER 415.A OG PHE 412.A O no hydrogen 2.497 N/A GLY 417.A N SER 415.A OG no hydrogen 3.049 N/A ARG 418.A N ASP 442.A OD1 no hydrogen 3.054 N/A ARG 418.A NE ASP 442.A OD2 no hydrogen 2.686 N/A ARG 418.A NH1 THR 445.A O no hydrogen 3.116 N/A ARG 418.A NH2 ASP 442.A OD2 no hydrogen 2.919 N/A ARG 418.A NH2 LEU 444.A O no hydrogen 2.883 N/A ARG 418.A NH2 THR 445.A O no hydrogen 3.155 N/A ARG 419.A NE GLU 438.A OE2 no hydrogen 3.109 N/A ARG 419.A NH2 GLU 438.A OE1 no hydrogen 2.891 N/A THR 421.A N ASP 383.A OD2 no hydrogen 2.587 N/A THR 421.A OG1 ASP 383.A OD2 no hydrogen 3.397 N/A LYS 422.A NZ ASP 426.A OD2 no hydrogen 2.940 N/A ARG 425.A N THR 421.A O no hydrogen 3.107 N/A ARG 425.A NE MET 420.A O no hydrogen 2.879 N/A ASP 426.A N LYS 422.A O no hydrogen 2.743 N/A PHE 427.A N VAL 423.A O no hydrogen 2.971 N/A LEU 428.A N VAL 424.A O no hydrogen 3.051 N/A LYS 429.A N ARG 425.A O no hydrogen 3.038 N/A ALA 430.A N ASP 426.A O no hydrogen 2.895 N/A GLN 431.A N LEU 428.A O no hydrogen 3.383 N/A GLN 431.A NE2 PRO 244.A O no hydrogen 2.965 N/A GLN 431.A NE2 PHE 427.A O no hydrogen 2.885 N/A GLN 432.A N LYS 429.A O no hydrogen 3.158 N/A VAL 433.A N GLN 431.A O no hydrogen 2.751 N/A GLN 434.A NE2 MET 285.A O no hydrogen 2.721 N/A GLN 434.A NE2 LEU 403.A O no hydrogen 2.946 N/A ALA 435.A N GLN 432.A O no hydrogen 3.246 N/A VAL 437.A N ILE 406.A O no hydrogen 2.763 N/A LEU 439.A N ILE 408.A O no hydrogen 2.698 N/A TYR 440.A N ASN 528.A OD1 no hydrogen 2.806 N/A SER 441.A N SER 410.A O no hydrogen 2.958 N/A SER 441.A OG ASN 387.A OD1 no hydrogen 3.313 N/A SER 441.A OG GLY 447.A O no hydrogen 2.862 N/A ASP 442.A N SER 410.A O no hydrogen 3.118 N/A TRP 443.A NE1 TYR 440.A O no hydrogen 2.958 N/A LEU 444.A N SER 441.A O no hydrogen 3.049 N/A THR 445.A N ALA 558.A O no hydrogen 2.771 N/A THR 445.A OG1 ASP 553.A OD2 no hydrogen 2.671 N/A THR 445.A OG1 ALA 558.A O no hydrogen 3.305 N/A HIS 448.A N GLU 451.A OE2 no hydrogen 2.833 N/A HIS 448.A NE2 SER 381.A O no hydrogen 2.756 N/A VAL 449.A N ASN 387.A OD1 no hydrogen 2.987 N/A ASP 450.A N GLY 386.A O no hydrogen 3.179 N/A GLU 451.A N HIS 448.A O no hydrogen 3.038 N/A PHE 452.A N VAL 449.A O no hydrogen 3.149 N/A MET 453.A N VAL 449.A O no hydrogen 3.246 N/A SER 454.A N LEU 467.A O no hydrogen 3.055 N/A VAL 456.A N LEU 465.A O no hydrogen 3.023 N/A ILE 458.A N LYS 463.A O no hydrogen 2.963 N/A THR 461.A N ILE 458.A O no hydrogen 3.082 N/A THR 461.A OG1 ILE 458.A O no hydrogen 2.824 N/A LYS 463.A N THR 461.A OG1 no hydrogen 2.962 N/A LEU 465.A N VAL 456.A O no hydrogen 2.759 N/A LEU 466.A N ASP 542.A O no hydrogen 2.793 N/A LEU 467.A N SER 454.A O no hydrogen 2.773 N/A MET 468.A N ILE 544.A O no hydrogen 2.934 N/A ALA 469.A N PHE 452.A O no hydrogen 2.960 N/A SER 470.A N LEU 546.A O no hydrogen 2.682 N/A SER 470.A OG GLN 522.A OE1 no hydrogen 3.397 N/A THR 471.A OG1 ASN 518.A O no hydrogen 2.842 N/A THR 471.A OG1 GLN 522.A OE1 no hydrogen 3.317 N/A SER 472.A N GLN 522.A OE1 no hydrogen 3.045 N/A SER 472.A OG SER 470.A OG no hydrogen 2.890 N/A ALA 473.A N SER 470.A OG no hydrogen 2.939 N/A TYR 475.A N THR 471.A O no hydrogen 2.949 N/A LYS 476.A N SER 472.A O no hydrogen 2.971 N/A LEU 477.A N ALA 473.A O no hydrogen 3.083 N/A PHE 478.A N CYS 474.A O no hydrogen 2.846 N/A ARG 479.A N TYR 475.A O no hydrogen 2.927 N/A GLU 480.A N LYS 476.A O no hydrogen 3.023 N/A LYS 481.A N LEU 477.A O no hydrogen 3.027 N/A GLN 482.A N PHE 478.A O no hydrogen 2.856 N/A GLN 482.A NE2 ASN 506.A OD1 no hydrogen 2.854 N/A LYS 483.A N ARG 479.A O no hydrogen 2.934 N/A ASP 484.A N GLU 480.A O no hydrogen 2.804 N/A GLY 485.A N GLN 482.A O no hydrogen 2.834 N/A HIS 486.A N LYS 481.A O no hydrogen 2.837 N/A ALA 489.A N HIS 486.A O no hydrogen 2.924 N/A MET 491.A N ILE 503.A O no hydrogen 2.902 N/A PHE 492.A N PHE 581.A O no hydrogen 2.856 N/A LEU 495.A N PHE 492.A O no hydrogen 2.938 N/A GLY 497.A N HIS 616.A O no hydrogen 2.858 N/A MET 498.A N LEU 495.A O no hydrogen 2.980 N/A SER 499.A N GLY 496.A O no hydrogen 3.383 N/A SER 499.A OG LEU 495.A O no hydrogen 3.520 N/A SER 499.A OG GLY 496.A O no hydrogen 3.506 N/A LYS 501.A N MET 498.A O no hydrogen 3.052 N/A ARG 502.A N SER 499.A O no hydrogen 2.859 N/A ILE 505.A N ALA 489.A O no hydrogen 3.198 N/A ASN 506.A N GLY 487.A O no hydrogen 2.827 N/A ASN 506.A ND2 GLU 488.A OE2 no hydrogen 3.104 N/A LYS 507.A N THR 504.A OG1 no hydrogen 3.071 N/A LYS 507.A NZ LYS 501.A O no hydrogen 3.489 N/A ILE 508.A N THR 504.A O no hydrogen 3.004 N/A LEU 509.A N ILE 505.A O no hydrogen 2.860 N/A SER 510.A N.A ASN 506.A O no hydrogen 2.969 N/A SER 510.A N.B ASN 506.A O no hydrogen 2.962 N/A SER 510.A OG.A ASN 506.A O no hydrogen 3.296 N/A SER 510.A OG.A LYS 507.A O no hydrogen 3.450 N/A SER 510.A OG.B ASN 506.A O no hydrogen 3.170 N/A ASN 511.A N ILE 508.A O no hydrogen 3.157 N/A SER 513.A OG ASN 511.A OD1 no hydrogen 3.198 N/A LEU 514.A N ASN 511.A OD1 no hydrogen 3.224 N/A VAL 515.A N ASN 511.A O no hydrogen 3.130 N/A GLN 516.A N GLU 512.A O no hydrogen 3.137 N/A GLU 517.A N SER 513.A O no hydrogen 2.830 N/A ASN 518.A N LEU 514.A O no hydrogen 3.007 N/A ASN 518.A ND2 LEU 514.A O no hydrogen 2.961 N/A ASN 518.A ND2 PHE 550.A O no hydrogen 2.846 N/A LEU 519.A N VAL 515.A O no hydrogen 2.943 N/A TYR 520.A N GLN 516.A O no hydrogen 3.214 N/A PHE 521.A N GLU 517.A O no hydrogen 3.013 N/A GLN 522.A N ASN 518.A O no hydrogen 3.008 N/A GLN 522.A NE2 ASP 526.A OD1 no hydrogen 2.975 N/A ARG 523.A N LEU 519.A O no hydrogen 3.119 N/A CYS 524.A N TYR 520.A O no hydrogen 3.064 N/A CYS 524.A SG TYR 520.A O no hydrogen 3.470 N/A LEU 525.A N PHE 521.A O no hydrogen 2.855 N/A ASP 526.A N GLN 522.A O no hydrogen 2.820 N/A TRP 527.A N ARG 523.A O no hydrogen 2.982 N/A ASN 528.A N CYS 524.A O no hydrogen 3.274 N/A ASN 528.A ND2 TYR 440.A O no hydrogen 2.857 N/A ASN 528.A ND2 CYS 524.A O no hydrogen 2.970 N/A ARG 529.A N LEU 525.A O no hydrogen 2.879 N/A ARG 529.A NE GLU 540.A OE1 no hydrogen 3.497 N/A ARG 529.A NE GLU 540.A OE2 no hydrogen 2.843 N/A ARG 529.A NH1 ASP 545.A OD1 no hydrogen 3.473 N/A ARG 529.A NH1 ASP 545.A OD2 no hydrogen 2.783 N/A ARG 529.A NH2 GLU 540.A OE1 no hydrogen 3.033 N/A ARG 529.A NH2 ASP 545.A OD1 no hydrogen 2.780 N/A ASP 530.A N ASP 526.A O no hydrogen 3.055 N/A ILE 531.A N TRP 527.A O no hydrogen 3.270 N/A LEU 532.A N ASN 528.A O no hydrogen 2.846 N/A LYS 533.A N ARG 529.A O no hydrogen 2.940 N/A LYS 533.A NZ GLU 540.A OE2 no hydrogen 2.921 N/A LYS 534.A N ASP 530.A O no hydrogen 3.001 N/A GLU 535.A N ILE 531.A O no hydrogen 2.789 N/A LEU 536.A N LEU 532.A O no hydrogen 2.761 N/A LEU 538.A N LYS 533.A O no hydrogen 3.069 N/A THR 539.A N ASP 542.A OD2 no hydrogen 2.937 N/A THR 539.A OG1 GLN 541.A OE1 no hydrogen 3.177 N/A THR 539.A OG1 ASP 542.A OD2 no hydrogen 3.532 N/A GLN 541.A N THR 539.A OG1 no hydrogen 3.193 N/A ASP 542.A N THR 539.A O no hydrogen 2.975 N/A ILE 543.A N GLU 540.A O no hydrogen 3.404 N/A ILE 544.A N LEU 466.A O no hydrogen 2.988 N/A LEU 546.A N MET 468.A O no hydrogen 2.789 N/A ALA 548.A N SER 470.A O no hydrogen 2.959 N/A PHE 550.A N ASN 518.A OD1 no hydrogen 3.020 N/A LYS 551.A N ARG 559.A O no hydrogen 2.959 N/A ASP 553.A N ARG 557.A O no hydrogen 2.795 N/A GLU 554.A N GLU 554.A OE2 no hydrogen 2.777 N/A ASP 555.A N ASP 553.A OD1 no hydrogen 2.774 N/A HIS 556.A N ASP 553.A O no hydrogen 3.055 N/A ARG 557.A N ASP 553.A OD1 no hydrogen 2.902 N/A ARG 557.A NE ASP 442.A O no hydrogen 2.778 N/A ARG 557.A NH2 ASP 442.A OD1 no hydrogen 3.120 N/A ALA 558.A N TRP 443.A O no hydrogen 2.730 N/A ARG 559.A N LYS 551.A O no hydrogen 2.981 N/A PHE 561.A N LEU 549.A O no hydrogen 2.778 N/A ASN 567.A N ASN 564.A O no hydrogen 3.364 N/A ILE 569.A N GLY 576.A O no hydrogen 2.868 N/A LEU 571.A N ASP 574.A O no hydrogen 2.799 N/A LYS 573.A NZ ASP 574.A OD2 no hydrogen 2.846 N/A LYS 573.A NZ GLU 605.A OE1 no hydrogen 3.566 N/A LYS 573.A NZ GLU 605.A OE2 no hydrogen 3.494 N/A ASP 574.A N LEU 571.A O no hydrogen 2.963 N/A LEU 575.A N GLU 605.A O no hydrogen 2.939 N/A GLY 576.A N ILE 569.A O no hydrogen 2.920 N/A ILE 577.A N THR 607.A O no hydrogen 2.761 N/A LYS 579.A N ILE 609.A O no hydrogen 2.938 N/A GLN 584.A N ILE 490.A O no hydrogen 3.346 N/A VAL 585.A N GLU 588.A O no hydrogen 2.846 N/A GLU 588.A N VAL 585.A O no hydrogen 3.116 N/A CYS 590.A N PRO 583.A O no hydrogen 3.046 N/A CYS 590.A SG PRO 583.A O no hydrogen 3.479 N/A MET 593.A N CYS 589.A O no hydrogen 2.997 N/A HIS 594.A N CYS 590.A O no hydrogen 3.045 N/A VAL 595.A N LEU 591.A O no hydrogen 2.970 N/A ARG 596.A N GLU 592.A O no hydrogen 2.994 N/A ARG 596.A NH1 GLU 600.A OE2 no hydrogen 2.824 N/A ARG 596.A NH1 CYS 606.A O no hydrogen 2.941 N/A ARG 596.A NH2 CYS 606.A O no hydrogen 3.299 N/A GLY 597.A N MET 593.A O no hydrogen 3.047 N/A LEU 598.A N HIS 594.A O no hydrogen 3.121 N/A LEU 598.A N VAL 595.A O no hydrogen 3.138 N/A LEU 599.A N VAL 595.A O no hydrogen 2.985 N/A GLU 600.A N ARG 596.A O no hydrogen 2.817 N/A LEU 602.A N LEU 599.A O no hydrogen 3.052 N/A GLY 603.A N GLU 600.A O no hydrogen 2.728 N/A GLU 605.A N LYS 573.A O no hydrogen 2.735 N/A THR 607.A N LEU 575.A O no hydrogen 2.941 N/A ILE 609.A N ILE 577.A O no hydrogen 2.699 N/A ASP 610.A N GLU 309.A OE1 no hydrogen 2.740 N/A SER 613.A N ASP 610.A OD2 no hydrogen 2.890 N/A SER 613.A OG ASP 610.A OD1 no hydrogen 2.573 N/A SER 613.A OG ASP 610.A OD2 no hydrogen 3.413 N/A TYR 615.A N ILE 612.A O no hydrogen 2.912 N/A HIS 616.A N SER 613.A O no hydrogen 2.911 N/A HIS 623.A ND1 ASP 332.A OD2 no hydrogen 2.806 N/A CYS 624.A SG ASP 611.A O no hydrogen 3.940 N/A GLY 625.A N CYS 298.A O no hydrogen 3.040 N/A THR 626.A N GLN 336.A OE1 no hydrogen 3.205 N/A ASN 627.A N PHE 296.A O no hydrogen 2.735 N/A ASN 627.A ND2 ILE 335.A O no hydrogen 2.880 N/A ARG 629.A N SER 294.A O no hydrogen 2.842 N/A ARG 630.A NH1 LEU 290.A O no hydrogen 2.974 N/A ARG 630.A NH1 VAL 570.A O no hydrogen 3.181 N/A ARG 630.A NH2 VAL 570.A O no hydrogen 2.685 N/A LYS 631.A N PRO 291.A O no hydrogen 2.881 N/A LYS 636.A NZ GLU 345.A OE2 no hydrogen 2.638 N/A TRP 637.A NE1 GLU 345.A O no hydrogen 2.826 N/A HIS 639.A N LYS 636.A O no hydrogen 2.892 N/A MET 640.A N TRP 637.A O no hydrogen 3.046 N/A