Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5n61_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 9.A N ARG 5.A O no hydrogen 2.296 N/A GLU 10.A N THR 6.A O no hydrogen 2.776 N/A SER 11.A N LEU 7.A O no hydrogen 2.898 N/A ARG 12.A N GLU 8.A O no hydrogen 3.391 N/A ARG 12.A N ARG 9.A O no hydrogen 2.726 N/A ARG 12.A NH1 GLU 8.A OE2 no hydrogen 2.335 N/A ARG 12.A NH2 GLU 8.A OE2 no hydrogen 2.553 N/A PHE 13.A N ARG 9.A O no hydrogen 3.164 N/A ILE 14.A N GLU 10.A O no hydrogen 2.766 N/A ASN 15.A N SER 11.A O no hydrogen 2.845 N/A LYS 20.A N ASP 19.A OD1 no hydrogen 2.397 N/A PHE 23.A N SER 21.A OG no hydrogen 3.060 N/A GLU 28.A N PRO 24.A O no hydrogen 2.918 N/A ALA 29.A N LEU 25.A O no hydrogen 2.782 N/A GLN 31.A N GLN 27.A O no hydrogen 3.105 N/A HIS 33.A N VAL 30.A O no hydrogen 2.902 N/A GLY 35.A N GLN 31.A O no hydrogen 2.575 N/A SER 36.A N PRO 32.A O no hydrogen 2.912 N/A SER 36.A OG PRO 32.A O no hydrogen 3.197 N/A SER 36.A OG HIS 33.A O no hydrogen 2.185 N/A PHE 37.A N HIS 33.A O no hydrogen 2.745 N/A ASN 38.A N ILE 34.A O no hydrogen 2.747 N/A ALA 39.A N GLY 35.A O no hydrogen 3.334 N/A LEU 40.A N PHE 37.A O no hydrogen 3.013 N/A THR 41.A N ASN 38.A O no hydrogen 3.073 N/A THR 41.A OG1 ASN 38.A O no hydrogen 3.337 N/A GLY 46.A N GLY 43.A O no hydrogen 3.048 N/A GLY 47.A N ASP 45.A OD1 no hydrogen 3.454 N/A LEU 48.A N ALA 39.A O no hydrogen 3.335 N/A LEU 49.A N LEU 40.A O no hydrogen 3.197 N/A ASN 50.A ND2 GLY 46.A O no hydrogen 2.715 N/A LEU 51.A N GLY 47.A O no hydrogen 3.002 N/A GLY 52.A N LEU 48.A O no hydrogen 2.370 N/A VAL 53.A N LEU 49.A O no hydrogen 2.610 N/A ASP 55.A N LEU 51.A O no hydrogen 3.296 N/A ASP 55.A N GLY 52.A O no hydrogen 2.859 N/A LYS 59.A N VAL 80.A O no hydrogen 2.405 N/A LYS 59.A NZ ASP 401.A OD1 no hydrogen 3.493 N/A ILE 61.A N LEU 78.A O no hydrogen 3.259 N/A ASP 63.A N ASN 76.A O no hydrogen 3.254 N/A GLY 64.A N ASP 63.A OD1 no hydrogen 2.525 N/A LYS 65.A NZ ILE 421.A O no hydrogen 3.022 N/A SER 69.A OG SER 71.A OG no hydrogen 3.254 N/A SER 71.A OG SER 69.A OG no hydrogen 3.254 N/A ASN 76.A N ASP 63.A OD2 no hydrogen 2.852 N/A ASN 76.A ND2 ASP 63.A OD2 no hydrogen 3.036 N/A LYS 77.A N ASN 129.A OD1 no hydrogen 2.444 N/A LYS 77.A NZ ASN 130.A OD1 no hydrogen 2.984 N/A LYS 77.A NZ ASP 326.A OD2 no hydrogen 2.591 N/A LEU 78.A N ILE 61.A O no hydrogen 2.929 N/A SER 79.A N SER 127.A O no hydrogen 2.368 N/A VAL 80.A N LYS 59.A O no hydrogen 2.849 N/A SER 81.A N LYS 125.A O no hydrogen 3.231 N/A GLU 83.A N LYS 123.A O no hydrogen 2.705 N/A VAL 85.A N ASN 50.A OD1 no hydrogen 2.655 N/A SER 86.A N LEU 121.A O no hydrogen 2.949 N/A ALA 88.A N LYS 119.A O no hydrogen 2.678 N/A SER 92.A N ARG 102.A O no hydrogen 2.654 N/A SER 92.A OG ASN 93.A O no hydrogen 3.434 N/A SER 98.A OG SER 97.A O no hydrogen 2.517 N/A ARG 102.A N SER 92.A O no hydrogen 2.881 N/A ARG 102.A NH1 GLU 108.A OE1 no hydrogen 2.796 N/A ARG 102.A NH2 GLU 108.A OE1 no hydrogen 3.087 N/A ARG 102.A NH2 GLU 108.A OE2 no hydrogen 2.358 N/A GLU 108.A N TYR 105.A O no hydrogen 2.754 N/A SER 109.A OG SER 115.A O no hydrogen 3.403 N/A ARG 110.A N PRO 106.A O no hydrogen 2.689 N/A ARG 110.A NE GLU 183.A OE2 no hydrogen 3.057 N/A ARG 110.A NH1 GLU 168.A OE1 no hydrogen 2.630 N/A ARG 110.A NH2 TYR 176.A OH no hydrogen 2.504 N/A GLN 111.A N SER 107.A O no hydrogen 3.133 N/A ARG 112.A N GLU 108.A O no hydrogen 2.781 N/A ARG 112.A NH1 GLY 872.A O no hydrogen 2.684 N/A ARG 112.A NH2 GLY 872.A O no hydrogen 2.883 N/A LEU 113.A N ARG 110.A O no hydrogen 2.764 N/A THR 114.A N SER 109.A O no hydrogen 3.101 N/A THR 114.A OG1 SER 115.A O no hydrogen 3.125 N/A TYR 116.A N ILE 178.A O no hydrogen 2.884 N/A TYR 116.A OH VAL 104.A O no hydrogen 2.754 N/A ARG 117.A NH2 GLN 445.A OE1 no hydrogen 2.622 N/A GLY 118.A N LEU 144.A O no hydrogen 2.525 N/A LEU 120.A N GLY 142.A O no hydrogen 3.091 N/A LEU 121.A N SER 86.A O no hydrogen 2.836 N/A LEU 122.A N ARG 139.A O no hydrogen 3.157 N/A LYS 123.A N GLN 84.A O no hydrogen 2.907 N/A LYS 123.A NZ GLU 83.A OE2 no hydrogen 3.500 N/A LEU 124.A N GLU 137.A O no hydrogen 3.004 N/A LYS 125.A N SER 81.A O no hydrogen 2.878 N/A LYS 125.A NZ SER 81.A OG no hydrogen 2.973 N/A TRP 126.A N LEU 135.A O no hydrogen 2.427 N/A TRP 126.A NE1 PHE 423.A O no hydrogen 2.973 N/A SER 127.A N SER 79.A O no hydrogen 2.598 N/A SER 127.A OG GLU 133.A O no hydrogen 3.413 N/A VAL 128.A N GLU 133.A O no hydrogen 2.226 N/A ASN 129.A N LYS 77.A O no hydrogen 2.269 N/A ASN 129.A ND2 ASN 76.A OD1 no hydrogen 2.487 N/A ASN 129.A ND2 GLU 132.A OE1 no hydrogen 3.322 N/A GLY 131.A N SER 127.A OG no hydrogen 3.004 N/A GLU 132.A N ASN 129.A O no hydrogen 3.033 N/A GLU 133.A N VAL 128.A O no hydrogen 2.908 N/A LEU 135.A N TRP 126.A O no hydrogen 2.280 N/A GLU 137.A N LEU 124.A O no hydrogen 2.772 N/A ARG 139.A N LEU 122.A O no hydrogen 2.748 N/A CYS 141.A N LEU 120.A O no hydrogen 3.206 N/A GLY 142.A N ASP 140.A OD1 no hydrogen 2.782 N/A LEU 144.A N GLY 118.A O no hydrogen 2.252 N/A VAL 146.A N TYR 116.A O no hydrogen 3.148 N/A LEU 148.A N TYR 176.A O no hydrogen 2.859 N/A SER 150.A OG MET 147.A O no hydrogen 2.419 N/A ASN 151.A N ASN 38.A OD1 no hydrogen 2.530 N/A ASN 151.A ND2 ASN 38.A O no hydrogen 3.261 N/A ASN 151.A ND2 GLU 42.A OE2 no hydrogen 2.585 N/A ARG 152.A NE ILE 87.A O no hydrogen 2.854 N/A CYS 153.A N SER 150.A O no hydrogen 2.759 N/A HIS 154.A NE2 PRO 90.A O no hydrogen 2.212 N/A ASN 156.A N CYS 153.A O no hydrogen 2.952 N/A MET 158.A N LEU 155.A O no hydrogen 3.209 N/A SER 159.A N GLU 162.A OE1 no hydrogen 3.227 N/A SER 159.A OG LYS 18.A O no hydrogen 3.054 N/A TYR 161.A N PRO 17.A O no hydrogen 2.725 N/A GLU 162.A N SER 159.A O no hydrogen 2.582 N/A LEU 163.A N SER 159.A O no hydrogen 3.117 N/A VAL 164.A N PRO 160.A O no hydrogen 3.122 N/A GLN 165.A N TYR 161.A O no hydrogen 3.298 N/A HIS 166.A N GLU 162.A O no hydrogen 2.808 N/A LYS 167.A N VAL 164.A O no hydrogen 3.008 N/A GLU 168.A N LEU 163.A O no hydrogen 2.881 N/A GLU 172.A N GLU 169.A O no hydrogen 2.576 N/A GLY 174.A N GLU 172.A OE2 no hydrogen 2.983 N/A GLY 175.A N LEU 148.A O no hydrogen 2.880 N/A TYR 176.A OH GLU 172.A OE2 no hydrogen 2.873 N/A PHE 177.A N LYS 184.A O no hydrogen 2.593 N/A VAL 179.A N ILE 182.A O no hydrogen 2.498 N/A ASN 180.A N SER 115.A OG no hydrogen 3.119 N/A GLY 181.A N THR 114.A O no hydrogen 2.743 N/A ILE 182.A N VAL 179.A O no hydrogen 2.658 N/A LYS 184.A N PHE 177.A O no hydrogen 2.557 N/A LYS 184.A NZ LEU 448.A O no hydrogen 2.782 N/A LEU 185.A N VAL 469.A O no hydrogen 3.108 N/A ARG 187.A N TYR 467.A O no hydrogen 3.268 N/A ARG 187.A NE GLY 466.A O no hydrogen 3.090 N/A ARG 187.A NH2 GLY 466.A O no hydrogen 3.388 N/A LEU 189.A N LEU 386.A O no hydrogen 3.405 N/A VAL 191.A N GLU 384.A O no hydrogen 2.696 N/A GLN 192.A NE2 GLN 218.A O no hydrogen 3.272 N/A ARG 193.A NE GLN 383.A O no hydrogen 3.099 N/A ARG 193.A NH1 GLU 608.A OE1 no hydrogen 2.923 N/A ARG 193.A NH2 GLN 383.A O no hydrogen 3.291 N/A ASN 195.A N ARG 220.A O no hydrogen 3.344 N/A MET 198.A N GLN 218.A O no hydrogen 2.752 N/A ALA 199.A N ASP 375.A OD2 no hydrogen 3.119 N/A ILE 200.A N GLY 216.A O no hydrogen 2.572 N/A ARG 202.A N HIS 214.A O no hydrogen 2.782 N/A PHE 205.A N ARG 202.A O no hydrogen 3.221 N/A ASN 207.A N PRO 203.A O no hydrogen 3.192 N/A ARG 208.A N PHE 205.A O no hydrogen 2.794 N/A ARG 208.A NH1 GLU 251.A OE2 no hydrogen 3.279 N/A ARG 208.A NH2 GLU 251.A OE1 no hydrogen 2.235 N/A GLY 209.A N ALA 206.A O no hydrogen 3.388 N/A SER 213.A N TYR 235.A O no hydrogen 3.024 N/A SER 213.A OG TYR 235.A O no hydrogen 2.411 N/A TYR 215.A N SER 213.A OG no hydrogen 3.187 N/A GLY 216.A N ILE 200.A O no hydrogen 2.732 N/A ILE 217.A N LEU 233.A O no hydrogen 3.031 N/A GLN 218.A N MET 198.A O no hydrogen 2.729 N/A ILE 219.A N ASN 231.A O no hydrogen 3.130 N/A ARG 220.A NH2 ASP 460.A O no hydrogen 3.334 N/A SER 221.A N GLN 229.A O no hydrogen 2.772 N/A SER 221.A OG HIS 344.A ND1 no hydrogen 2.853 N/A ARG 223.A N THR 227.A O no hydrogen 2.702 N/A ARG 223.A NH1 THR 227.A OG1 no hydrogen 2.592 N/A ARG 223.A NH2 ARG 339.A O no hydrogen 2.938 N/A GLN 226.A N ARG 223.A O no hydrogen 2.718 N/A GLN 229.A N SER 221.A O no hydrogen 2.351 N/A GLN 229.A NE2 THR 230.A O no hydrogen 3.050 N/A GLN 229.A NE2 SER 246.A O no hydrogen 3.290 N/A THR 230.A OG1 ASP 460.A OD1 no hydrogen 2.215 N/A ASN 231.A N ILE 219.A O no hydrogen 3.082 N/A ASN 231.A ND2 ILE 340.A O no hydrogen 3.616 N/A VAL 232.A N ARG 244.A O no hydrogen 2.820 N/A LEU 233.A N ILE 217.A O no hydrogen 2.836 N/A HIS 234.A N THR 242.A O no hydrogen 3.192 N/A LEU 236.A N GLN 240.A O no hydrogen 2.680 N/A ASN 237.A N SER 211.A O no hydrogen 2.355 N/A ASN 237.A ND2 SER 211.A O no hydrogen 2.505 N/A GLY 239.A N LEU 236.A O no hydrogen 2.939 N/A GLN 240.A N ASP 238.A OD1 no hydrogen 2.698 N/A THR 242.A N HIS 234.A O no hydrogen 3.029 N/A PHE 243.A N VAL 254.A O no hydrogen 2.583 N/A ARG 244.A N VAL 232.A O no hydrogen 2.600 N/A ARG 244.A NE HIS 234.A NE2 no hydrogen 2.774 N/A PHE 245.A N TYR 252.A O no hydrogen 2.941 N/A SER 246.A OG ASN 250.A O no hydrogen 3.326 N/A TRP 247.A N ASN 250.A O no hydrogen 2.534 N/A LYS 249.A NZ SER 455.A O no hydrogen 3.241 N/A ASN 250.A N TRP 247.A O no hydrogen 2.612 N/A ASN 250.A ND2 TRP 247.A O no hydrogen 3.575 N/A TYR 252.A N PHE 245.A O no hydrogen 2.809 N/A VAL 254.A N PHE 243.A O no hydrogen 2.645 N/A VAL 256.A N VAL 241.A O no hydrogen 3.140 N/A ILE 259.A N VAL 256.A O no hydrogen 2.809 N/A LEU 260.A N VAL 256.A O no hydrogen 3.065 N/A LYS 261.A N VAL 257.A O no hydrogen 3.094 N/A ALA 262.A N MET 258.A O no hydrogen 2.884 N/A LEU 263.A N ILE 259.A O no hydrogen 2.736 N/A CYS 264.A N LEU 260.A O no hydrogen 3.465 N/A CYS 264.A SG SER 350.A O no hydrogen 3.087 N/A CYS 264.A SG GLN 351.A OE1 no hydrogen 3.199 N/A THR 266.A OG1 SER 267.A O no hydrogen 3.272 N/A GLU 270.A N SER 267.A OG no hydrogen 3.196 N/A ILE 271.A N SER 267.A O no hydrogen 3.173 N/A PHE 272.A N ASP 268.A O no hydrogen 3.050 N/A ASP 273.A N ARG 269.A O no hydrogen 2.753 N/A GLY 274.A N GLU 270.A O no hydrogen 2.554 N/A ILE 275.A N PHE 272.A O no hydrogen 2.986 N/A ILE 276.A N PHE 272.A O no hydrogen 2.956 N/A GLY 277.A N ASP 273.A O no hydrogen 3.276 N/A ASP 279.A N ILE 276.A O no hydrogen 2.892 N/A ASP 282.A N ASP 279.A O no hydrogen 2.693 N/A SER 283.A OG ASP 287.A OD1 no hydrogen 3.249 N/A SER 283.A OG ASP 287.A OD2 no hydrogen 2.374 N/A PHE 284.A N ASP 282.A OD1 no hydrogen 2.346 N/A LEU 285.A N ASP 282.A OD2 no hydrogen 3.075 N/A THR 286.A OG1 ASP 282.A O no hydrogen 3.290 N/A THR 286.A OG1 SER 283.A O no hydrogen 2.319 N/A THR 286.A OG1 ASP 287.A OD1 no hydrogen 3.413 N/A ASP 287.A N SER 283.A O no hydrogen 2.725 N/A ARG 288.A N PHE 284.A O no hydrogen 2.801 N/A LEU 289.A N LEU 285.A O no hydrogen 2.426 N/A GLU 290.A N THR 286.A O no hydrogen 2.684 N/A LEU 292.A N LEU 289.A O no hydrogen 2.657 N/A LEU 293.A N LEU 289.A O no hydrogen 3.043 N/A ARG 294.A N GLU 290.A O no hydrogen 2.791 N/A PHE 296.A N LEU 292.A O no hydrogen 2.980 N/A LYS 297.A N LEU 293.A O no hydrogen 2.857 N/A ARG 299.A N LYS 297.A O no hydrogen 2.493 N/A TYR 300.A N PHE 296.A O no hydrogen 2.999 N/A ARG 306.A NE LEU 263.A O no hydrogen 2.763 N/A ARG 306.A NH2 LEU 263.A O no hydrogen 2.674 N/A ARG 306.A NH2 GLN 334.A OE1 no hydrogen 3.355 N/A THR 307.A N ASN 305.A OD1 no hydrogen 2.439 N/A THR 307.A OG1 ASN 305.A OD1 no hydrogen 3.142 N/A VAL 309.A N ASN 305.A O no hydrogen 2.823 N/A LEU 310.A N ARG 306.A O no hydrogen 2.806 N/A GLN 311.A N THR 307.A O no hydrogen 2.664 N/A TYR 312.A N GLN 308.A O no hydrogen 2.722 N/A LEU 313.A N VAL 309.A O no hydrogen 2.793 N/A GLY 314.A N LEU 310.A O no hydrogen 2.871 N/A ASP 315.A N GLN 311.A O no hydrogen 2.739 N/A LYS 316.A N TYR 312.A O no hydrogen 3.187 N/A PHE 317.A N LEU 313.A O no hydrogen 2.921 N/A ARG 318.A N GLY 314.A O no hydrogen 2.657 N/A ARG 318.A NH1 ASP 329.A OD1 no hydrogen 3.293 N/A ARG 318.A NH2 SER 324.A O no hydrogen 3.444 N/A PHE 321.A N PHE 317.A O no hydrogen 2.649 N/A GLN 322.A N VAL 319.A O no hydrogen 3.287 N/A ALA 323.A N ARG 318.A O no hydrogen 3.097 N/A SER 324.A N GLN 327.A OE1 no hydrogen 2.826 N/A SER 324.A OG ASP 326.A OD1 no hydrogen 2.261 N/A GLN 327.A N SER 324.A O no hydrogen 2.841 N/A GLU 331.A N SER 328.A OG no hydrogen 2.765 N/A VAL 332.A N SER 328.A O no hydrogen 2.565 N/A GLY 333.A N ASP 329.A O no hydrogen 2.784 N/A GLN 334.A N LEU 330.A O no hydrogen 3.175 N/A GLN 334.A NE2 ASP 338.A OD1 no hydrogen 2.912 N/A GLN 334.A NE2 ASP 338.A OD2 no hydrogen 3.041 N/A GLU 335.A N GLU 331.A O no hydrogen 3.223 N/A VAL 336.A N VAL 332.A O no hydrogen 2.912 N/A LEU 337.A N GLY 333.A O no hydrogen 3.318 N/A ASP 338.A N GLN 334.A O no hydrogen 3.110 N/A ARG 339.A N GLU 335.A O no hydrogen 2.529 N/A ARG 339.A N VAL 336.A O no hydrogen 3.193 N/A ARG 339.A NE GLU 335.A OE2 no hydrogen 2.683 N/A ILE 340.A N LEU 337.A O no hydrogen 3.191 N/A VAL 341.A N LEU 337.A O no hydrogen 2.918 N/A LEU 342.A N ASN 231.A OD1 no hydrogen 2.945 N/A HIS 344.A ND1 SER 221.A OG no hydrogen 2.853 N/A HIS 344.A NE2 GLY 573.A O no hydrogen 2.824 N/A LEU 345.A N LEU 342.A O no hydrogen 2.952 N/A GLY 346.A N VAL 343.A O no hydrogen 2.778 N/A GLY 349.A N GLY 346.A O no hydrogen 3.005 N/A SER 350.A OG LYS 347.A O no hydrogen 3.247 N/A LYS 353.A N GLY 349.A O no hydrogen 2.242 N/A LYS 353.A NZ VAL 341.A O no hydrogen 2.901 N/A LYS 353.A NZ GLY 346.A O no hydrogen 3.312 N/A PHE 354.A N SER 350.A O no hydrogen 3.264 N/A ARG 355.A NE ALA 556.A O no hydrogen 2.947 N/A MET 356.A N ASP 352.A O no hydrogen 2.904 N/A LEU 357.A N LYS 353.A O no hydrogen 2.666 N/A LEU 358.A N PHE 354.A O no hydrogen 2.903 N/A PHE 359.A N ARG 355.A O no hydrogen 2.759 N/A MET 360.A N MET 356.A O no hydrogen 3.011 N/A ILE 361.A N LEU 357.A O no hydrogen 3.282 N/A ARG 362.A N LEU 358.A O no hydrogen 2.804 N/A LYS 363.A N PHE 359.A O no hydrogen 2.794 N/A LEU 364.A N MET 360.A O no hydrogen 2.402 N/A TYR 365.A N ILE 361.A O no hydrogen 2.971 N/A SER 366.A N ARG 362.A O no hydrogen 3.106 N/A LEU 367.A N LYS 363.A O no hydrogen 2.699 N/A VAL 368.A N LEU 364.A O no hydrogen 2.702 N/A ALA 369.A N TYR 365.A O no hydrogen 2.370 N/A GLY 370.A N LEU 367.A O no hydrogen 2.725 N/A GLU 371.A N SER 366.A O no hydrogen 2.873 N/A CYS 372.A SG SER 366.A OG no hydrogen 3.311 N/A SER 373.A N GLY 618.A O no hydrogen 2.368 N/A SER 373.A OG PRO 374.A O no hydrogen 3.537 N/A ASP 375.A N ALA 199.A O no hydrogen 2.664 N/A ASP 378.A N ASN 376.A OD1 no hydrogen 3.141 N/A ALA 379.A N ASN 376.A O no hydrogen 3.137 N/A THR 380.A OG1 GLN 383.A OE1 no hydrogen 3.238 N/A THR 380.A OG1 SER 507.A OG no hydrogen 3.181 N/A GLN 381.A N GLU 506.A OE1 no hydrogen 2.740 N/A GLN 381.A NE2 GLN 619.A OE1 no hydrogen 2.419 N/A GLN 383.A NE2 PRO 377.A O no hydrogen 3.420 N/A GLU 384.A N VAL 191.A O no hydrogen 2.548 N/A LEU 386.A N LEU 189.A O no hydrogen 2.773 N/A GLY 389.A N SER 36.A OG no hydrogen 2.985 N/A LEU 391.A N LEU 387.A O no hydrogen 3.260 N/A TYR 392.A N GLY 388.A O no hydrogen 2.709 N/A TYR 392.A OH PRO 145.A O no hydrogen 2.815 N/A GLY 393.A N GLY 389.A O no hydrogen 2.782 N/A MET 394.A N PHE 390.A O no hydrogen 2.845 N/A ILE 395.A N LEU 391.A O no hydrogen 2.963 N/A LEU 396.A N TYR 392.A O no hydrogen 3.403 N/A LYS 397.A N GLY 393.A O no hydrogen 2.737 N/A LYS 397.A NZ ASP 55.A OD2 no hydrogen 3.567 N/A GLU 398.A N MET 394.A O no hydrogen 2.905 N/A LYS 399.A N ILE 395.A O no hydrogen 2.866 N/A ILE 400.A N LEU 396.A O no hydrogen 2.858 N/A ASP 401.A N LYS 397.A O no hydrogen 2.788 N/A GLU 402.A N GLU 398.A O no hydrogen 2.692 N/A TYR 403.A N LYS 399.A O no hydrogen 2.656 N/A LEU 404.A N ILE 400.A O no hydrogen 3.027 N/A GLN 405.A N ASP 401.A O no hydrogen 3.144 N/A ASN 406.A N GLU 402.A O no hydrogen 2.756 N/A ASN 406.A ND2 ASN 437.A O no hydrogen 3.273 N/A ILE 407.A N TYR 403.A O no hydrogen 2.989 N/A ILE 408.A N LEU 404.A O no hydrogen 2.963 N/A ALA 409.A N GLN 405.A O no hydrogen 2.829 N/A GLN 410.A N ASN 406.A O no hydrogen 2.870 N/A VAL 411.A N ILE 407.A O no hydrogen 2.930 N/A ARG 412.A N ILE 408.A O no hydrogen 2.814 N/A MET 413.A N ALA 409.A O no hydrogen 2.992 N/A ASP 414.A N GLN 410.A O no hydrogen 2.901 N/A ILE 415.A N VAL 411.A O no hydrogen 2.430 N/A ASN 416.A N ARG 412.A O no hydrogen 2.497 N/A ARG 417.A N MET 413.A O no hydrogen 2.723 N/A GLY 418.A N ILE 415.A O no hydrogen 2.312 N/A ASP 425.A N ASN 422.A O no hydrogen 3.140 N/A ASP 425.A N ASN 422.A OD1 no hydrogen 3.133 N/A TYR 428.A OH ASP 414.A OD2 no hydrogen 2.696 N/A MET 429.A N ASP 425.A O no hydrogen 3.158 N/A SER 430.A N LYS 426.A O no hydrogen 3.020 N/A SER 430.A OG LYS 426.A O no hydrogen 3.560 N/A ARG 431.A N ARG 427.A O no hydrogen 2.579 N/A VAL 432.A N TYR 428.A O no hydrogen 2.761 N/A LEU 433.A N MET 429.A O no hydrogen 2.952 N/A MET 434.A N SER 430.A O no hydrogen 2.759 N/A ARG 435.A N ARG 431.A O no hydrogen 3.381 N/A ARG 435.A NE ARG 431.A O no hydrogen 2.519 N/A ARG 435.A NH1 ASP 414.A OD2 no hydrogen 3.510 N/A ARG 435.A NH2 ASP 414.A OD2 no hydrogen 3.326 N/A VAL 436.A N VAL 432.A O no hydrogen 2.591 N/A ILE 440.A N CYS 141.A O no hydrogen 2.322 N/A GLY 441.A N CYS 141.A O no hydrogen 3.069 N/A SER 442.A N ASN 439.A OD1 no hydrogen 2.755 N/A SER 442.A OG ASN 439.A O no hydrogen 3.347 N/A LYS 443.A NZ ASN 439.A O no hydrogen 3.086 N/A MET 444.A N ILE 440.A O no hydrogen 2.799 N/A GLN 445.A N GLY 441.A O no hydrogen 2.499 N/A GLN 445.A NE2 ASN 180.A OD1 no hydrogen 3.270 N/A TYR 446.A N SER 442.A O no hydrogen 2.403 N/A PHE 447.A N LYS 443.A O no hydrogen 2.759 N/A LEU 448.A N MET 444.A O no hydrogen 2.933 N/A SER 449.A N GLN 445.A O no hydrogen 3.066 N/A THR 450.A N TYR 446.A O no hydrogen 2.853 N/A THR 450.A OG1 TYR 446.A O no hydrogen 2.882 N/A THR 450.A OG1 PHE 447.A O no hydrogen 3.429 N/A GLY 451.A N PHE 447.A O no hydrogen 2.313 N/A ASN 452.A N THR 450.A OG1 no hydrogen 3.293 N/A LEU 453.A N VAL 464.A O no hydrogen 3.017 N/A SER 455.A OG SER 457.A O no hydrogen 2.736 N/A LEU 461.A N GLY 458.A O no hydrogen 2.805 N/A GLY 466.A N GLY 451.A O no hydrogen 3.222 N/A TYR 467.A N GLY 451.A O no hydrogen 3.501 N/A THR 468.A OG1 LEU 448.A O no hydrogen 3.099 N/A VAL 469.A N LEU 185.A O no hydrogen 2.947 N/A ALA 471.A N GLU 183.A O no hydrogen 2.638 N/A GLU 472.A N HIS 482.A NE2 no hydrogen 2.968 N/A ASN 475.A ND2 THR 708.A OG1 no hydrogen 2.924 N/A ARG 478.A N ASN 475.A OD1 no hydrogen 2.305 N/A ILE 480.A N PHE 476.A O no hydrogen 2.996 N/A SER 481.A N TYR 477.A O no hydrogen 2.572 N/A SER 481.A OG TYR 477.A O no hydrogen 2.368 N/A HIS 482.A N PHE 479.A O no hydrogen 3.104 N/A PHE 483.A N ILE 480.A O no hydrogen 3.018 N/A ARG 484.A N SER 481.A O no hydrogen 3.357 N/A ARG 484.A NH1 ALA 29.A O no hydrogen 2.646 N/A ARG 484.A NH2 ALA 529.A O no hydrogen 3.413 N/A ARG 484.A NH2 CYS 532.A O no hydrogen 2.843 N/A MET 485.A N HIS 482.A O no hydrogen 2.912 N/A VAL 486.A N ASN 526.A O no hydrogen 2.846 N/A HIS 487.A N MET 188.A O no hydrogen 3.418 N/A ARG 488.A NH1 ASP 378.A OD1 no hydrogen 3.109 N/A ARG 488.A NH2 ASP 378.A OD1 no hydrogen 3.481 N/A SER 490.A N GLN 463.A OE1 no hydrogen 2.241 N/A SER 490.A OG GLN 463.A OE1 no hydrogen 2.595 N/A PHE 492.A N GLY 489.A O no hydrogen 3.227 N/A ALA 493.A N SER 490.A O no hydrogen 2.880 N/A ARG 501.A N THR 498.A O no hydrogen 2.844 N/A LYS 502.A N THR 499.A O no hydrogen 3.218 N/A LEU 504.A N LYS 502.A O no hydrogen 2.970 N/A SER 507.A N LEU 504.A O no hydrogen 3.105 N/A SER 507.A OG THR 380.A OG1 no hydrogen 3.181 N/A SER 507.A OG LEU 504.A O no hydrogen 3.550 N/A TRP 508.A N PRO 505.A O no hydrogen 3.405 N/A PHE 510.A N SER 507.A O no hydrogen 2.801 N/A CYS 512.A N HIS 527.A O no hydrogen 2.569 N/A THR 516.A OG1 PRO 517.A O no hydrogen 3.357 N/A THR 516.A OG1 LEU 525.A O no hydrogen 2.795 N/A ASP 518.A N GLN 703.A OE1 no hydrogen 2.916 N/A CYS 522.A N GLY 519.A O no hydrogen 3.205 N/A GLY 523.A N THR 516.A OG1 no hydrogen 3.355 N/A LEU 524.A N PRO 521.A O no hydrogen 2.764 N/A LEU 525.A N PRO 521.A O no hydrogen 3.298 N/A ASN 526.A N VAL 486.A O no hydrogen 2.594 N/A HIS 527.A ND1 HIS 515.A O no hydrogen 3.167 N/A PHE 528.A N ARG 484.A O no hydrogen 3.083 N/A ALA 529.A N PHE 510.A O no hydrogen 2.322 N/A HIS 530.A N LEU 680.A O no hydrogen 2.714 N/A CYS 532.A N ALA 529.A O no hydrogen 2.476 N/A CYS 532.A SG ARG 533.A O no hydrogen 3.810 N/A CYS 532.A SG MET 632.A O no hydrogen 3.237 N/A ARG 533.A N LEU 633.A O no hydrogen 2.782 N/A ARG 533.A NH1 HIS 530.A O no hydrogen 2.929 N/A ARG 533.A NH1 CYS 532.A O no hydrogen 3.026 N/A ARG 533.A NH2 GLU 28.A OE1 no hydrogen 3.398 N/A SER 535.A N ARG 631.A O no hydrogen 2.814 N/A SER 535.A OG GLY 628.A O no hydrogen 2.868 N/A GLN 538.A NE2 SER 539.A O no hydrogen 3.219 N/A GLN 538.A NE2 ASP 572.A OD2 no hydrogen 3.268 N/A SER 539.A OG ASP 606.A OD1 no hydrogen 3.075 N/A SER 539.A OG ASP 606.A OD2 no hydrogen 2.439 N/A SER 542.A N ASP 540.A OD1 no hydrogen 2.685 N/A SER 542.A OG ASP 540.A OD1 no hydrogen 3.044 N/A SER 542.A OG ASP 540.A OD2 no hydrogen 2.966 N/A ILE 544.A N VAL 541.A O no hydrogen 2.931 N/A SER 546.A OG ARG 543.A O no hydrogen 2.162 N/A ILE 547.A N ARG 543.A O no hydrogen 2.823 N/A LEU 548.A N ILE 544.A O no hydrogen 2.592 N/A TYR 549.A N PRO 545.A O no hydrogen 2.446 N/A TYR 549.A OH ILE 576.A O no hydrogen 3.085 N/A SER 550.A N SER 546.A O no hydrogen 2.998 N/A SER 550.A OG SER 546.A O no hydrogen 2.906 N/A SER 550.A OG ILE 547.A O no hydrogen 2.136 N/A LEU 551.A N ILE 547.A O no hydrogen 2.935 N/A LEU 551.A N LEU 548.A O no hydrogen 2.579 N/A GLY 552.A N TYR 549.A O no hydrogen 3.176 N/A VAL 553.A N LEU 548.A O no hydrogen 3.390 N/A ALA 554.A N TRP 578.A O no hydrogen 3.196 N/A ALA 556.A N ILE 576.A O no hydrogen 2.877 N/A HIS 558.A N PRO 555.A O no hydrogen 3.225 N/A HIS 558.A ND1 THR 559.A OG1 no hydrogen 2.484 N/A THR 559.A OG1 HIS 558.A ND1 no hydrogen 2.484 N/A LEU 566.A N GLY 563.A O no hydrogen 3.205 N/A CYS 567.A SG CYS 568.A O no hydrogen 3.137 N/A VAL 569.A N GLY 577.A O no hydrogen 2.837 N/A GLN 570.A N LEU 623.A O no hydrogen 2.974 N/A ILE 571.A N LYS 574.A O no hydrogen 2.798 N/A ASP 572.A N LEU 625.A O no hydrogen 2.820 N/A ILE 576.A N VAL 569.A O no hydrogen 2.681 N/A GLY 577.A N VAL 569.A O no hydrogen 3.459 N/A TRP 578.A N ALA 554.A O no hydrogen 3.183 N/A VAL 579.A N CYS 567.A O no hydrogen 3.076 N/A HIS 581.A NE2 PRO 564.A O no hydrogen 2.580 N/A GLU 582.A N GLU 582.A OE1 no hydrogen 2.432 N/A GLN 583.A N SER 580.A OG no hydrogen 3.329 N/A GLY 584.A N SER 580.A O no hydrogen 2.922 N/A LYS 585.A N HIS 581.A O no hydrogen 2.900 N/A ILE 586.A N GLU 582.A O no hydrogen 3.304 N/A ILE 587.A N GLN 583.A O no hydrogen 2.672 N/A ALA 588.A N GLY 584.A O no hydrogen 2.598 N/A ASP 589.A N LYS 585.A O no hydrogen 3.099 N/A THR 590.A N ILE 586.A O no hydrogen 2.958 N/A THR 590.A OG1 ILE 586.A O no hydrogen 2.756 N/A LEU 591.A N ILE 587.A O no hydrogen 2.573 N/A ARG 592.A N ALA 588.A O no hydrogen 2.679 N/A ARG 592.A NH1 HIS 671.A NE2 no hydrogen 3.262 N/A TYR 593.A N ASP 589.A O no hydrogen 2.733 N/A TRP 594.A N THR 590.A O no hydrogen 2.854 N/A LYS 595.A N LEU 591.A O no hydrogen 2.695 N/A LYS 595.A NZ ILE 605.A O no hydrogen 3.326 N/A LYS 595.A NZ LEU 607.A O no hydrogen 2.812 N/A LYS 595.A NZ ASP 645.A OD1 no hydrogen 3.406 N/A LYS 595.A NZ ILE 646.A O no hydrogen 3.220 N/A VAL 596.A N ARG 592.A O no hydrogen 3.178 N/A GLU 597.A N TYR 593.A O no hydrogen 2.813 N/A GLY 598.A N TRP 594.A O no hydrogen 2.736 N/A LEU 607.A N PRO 604.A O no hydrogen 3.105 N/A GLU 608.A N PHE 626.A O no hydrogen 3.482 N/A ILE 609.A N GLU 651.A OE1 no hydrogen 2.434 N/A GLY 610.A N TYR 624.A O no hydrogen 2.335 N/A VAL 612.A N GLY 622.A O no hydrogen 2.628 N/A ARG 617.A NH1 GLY 370.A O no hydrogen 2.541 N/A GLY 622.A N VAL 612.A O no hydrogen 3.279 N/A LEU 623.A N CYS 568.A O no hydrogen 2.513 N/A LEU 625.A N GLN 570.A O no hydrogen 3.108 N/A GLY 627.A N ASP 572.A OD1 no hydrogen 2.742 N/A SER 630.A N SER 535.A O no hydrogen 2.431 N/A ARG 631.A N SER 535.A OG no hydrogen 2.707 N/A ARG 631.A NE GLY 628.A O no hydrogen 2.456 N/A ARG 631.A NH1 ASP 606.A O no hydrogen 3.025 N/A ARG 631.A NH2 GLY 628.A O no hydrogen 3.163 N/A ARG 634.A N VAL 647.A O no hydrogen 2.927 N/A ARG 634.A NH1 GLU 673.A OE1 no hydrogen 2.524 N/A ARG 634.A NH2 GLU 673.A OE2 no hydrogen 2.227 N/A VAL 636.A N ASP 645.A O no hydrogen 2.500 N/A ARG 637.A N VAL 672.A O no hydrogen 2.838 N/A TYR 638.A N LYS 643.A O no hydrogen 2.829 N/A LEU 639.A N THR 670.A O no hydrogen 3.056 N/A LYS 643.A NZ VAL 596.A O no hydrogen 2.288 N/A ASP 645.A N VAL 636.A O no hydrogen 2.540 N/A VAL 647.A N ARG 634.A O no hydrogen 2.699 N/A GLY 648.A N GLU 651.A OE2 no hydrogen 2.349 N/A GLN 652.A N PRO 649.A O no hydrogen 2.862 N/A GLN 652.A NE2 TRP 508.A O no hydrogen 2.876 N/A TYR 654.A OH GLN 619.A OE1 no hydrogen 3.058 N/A MET 655.A N GLN 652.A O no hydrogen 2.885 N/A ASN 656.A ND2 VAL 668.A O no hydrogen 3.016 N/A ALA 658.A N HIS 671.A O no hydrogen 2.824 N/A THR 660.A OG1 GLN 662.A OE1 no hydrogen 3.389 N/A GLN 662.A N GLN 662.A OE1 no hydrogen 2.382 N/A GLU 663.A N THR 660.A O no hydrogen 2.853 N/A ILE 664.A N PRO 661.A O no hydrogen 3.037 N/A GLN 665.A N HIS 669.A ND1 no hydrogen 3.054 N/A VAL 668.A N GLN 665.A O no hydrogen 3.214 N/A THR 670.A N ASN 656.A O no hydrogen 3.037 N/A THR 670.A OG1 HIS 671.A ND1 no hydrogen 2.500 N/A HIS 671.A ND1 THR 670.A OG1 no hydrogen 2.500 N/A HIS 671.A NE2 ASP 645.A OD2 no hydrogen 2.855 N/A VAL 672.A N ARG 637.A O no hydrogen 2.852 N/A GLU 673.A N ALA 658.A O no hydrogen 2.891 N/A THR 675.A OG1 THR 677.A OG1 no hydrogen 2.602 N/A THR 675.A OG1 ASN 678.A OD1 no hydrogen 2.942 N/A THR 677.A OG1 THR 675.A OG1 no hydrogen 2.602 N/A ASN 678.A N THR 675.A O no hydrogen 2.935 N/A ILE 679.A N PRO 676.A O no hydrogen 3.289 N/A LEU 680.A N THR 677.A O no hydrogen 3.296 N/A ASN 685.A N SER 681.A O no hydrogen 2.859 N/A ASN 685.A ND2 SER 681.A O no hydrogen 2.249 N/A LEU 686.A N ILE 682.A O no hydrogen 3.092 N/A LEU 686.A N LEU 683.A O no hydrogen 2.674 N/A THR 687.A N LEU 683.A O no hydrogen 3.059 N/A THR 687.A N ALA 684.A O no hydrogen 3.313 N/A PHE 689.A N SER 964.A O no hydrogen 3.171 N/A SER 690.A N THR 687.A O no hydrogen 3.379 N/A PHE 692.A N PHE 689.A O no hydrogen 2.522 N/A ASN 693.A N SER 690.A O no hydrogen 3.260 N/A ASN 693.A ND2 ASN 698.A OD1 no hydrogen 3.255 N/A ASN 693.A ND2 HIS 904.A ND1 no hydrogen 2.937 N/A GLN 694.A N MET 941.A O no hydrogen 3.111 N/A ARG 697.A N GLN 694.A O no hydrogen 2.822 N/A ARG 697.A NH1 GLY 905.A O no hydrogen 3.287 N/A ASN 698.A N GLN 694.A O no hydrogen 3.022 N/A ASN 698.A ND2 SER 690.A O no hydrogen 3.248 N/A MET 699.A N SER 695.A O no hydrogen 2.951 N/A TYR 700.A N PRO 696.A O no hydrogen 3.384 N/A TYR 700.A N ARG 697.A O no hydrogen 3.073 N/A GLN 701.A N ARG 697.A O no hydrogen 3.306 N/A GLN 701.A NE2 GLN 1017.A OE1 no hydrogen 3.220 N/A CYS 702.A N ASN 698.A O no hydrogen 3.241 N/A GLN 703.A NE2 ASP 518.A OD1 no hydrogen 2.679 N/A MET 704.A N TYR 700.A O no hydrogen 2.406 N/A GLY 705.A N GLN 701.A O no hydrogen 2.457 N/A LYS 706.A N CYS 702.A O no hydrogen 3.441 N/A LYS 706.A NZ HIS 515.A NE2 no hydrogen 3.045 N/A GLN 707.A N MET 704.A O no hydrogen 2.696 N/A GLN 707.A NE2 HIS 1021.A NE2 no hydrogen 3.104 N/A THR 708.A N GLY 705.A O no hydrogen 3.374 N/A THR 708.A OG1 GLY 705.A O no hydrogen 3.061 N/A THR 708.A OG1 ASN 750.A OD1 no hydrogen 2.401 N/A MET 709.A N ARG 1018.A O no hydrogen 2.567 N/A THR 711.A OG1 PRO 749.A O no hydrogen 3.258 N/A VAL 714.A N GLU 169.A OE1 no hydrogen 2.435 N/A VAL 714.A N GLU 169.A OE2 no hydrogen 2.820 N/A CYS 717.A SG HIS 718.A ND1 no hydrogen 2.998 N/A HIS 718.A N ALA 715.A O no hydrogen 2.710 N/A ARG 719.A N LEU 716.A O no hydrogen 2.950 N/A ARG 719.A NH1 ASP 721.A OD2 no hydrogen 3.307 N/A LEU 724.A N TYR 787.A O no hydrogen 2.543 N/A ARG 726.A N THR 785.A O no hydrogen 2.692 N/A ARG 726.A NH1 GLN 728.A OE1 no hydrogen 2.931 N/A LEU 727.A N GLY 710.A O no hydrogen 2.698 N/A GLN 728.A N TYR 783.A O no hydrogen 2.811 N/A GLN 731.A N GLY 751.A O no hydrogen 2.621 N/A ILE 734.A N ASN 753.A OD1 no hydrogen 3.415 N/A LYS 736.A N GLN 962.A O no hydrogen 2.986 N/A LYS 736.A NZ ASP 3.A O no hydrogen 3.377 N/A ASN 738.A N THR 965.A OG1 no hydrogen 3.263 N/A ASN 738.A ND2 THR 965.A OG1 no hydrogen 3.109 N/A TYR 740.A N ALA 737.A O no hydrogen 2.785 N/A ASP 741.A N ASN 738.A O no hydrogen 3.017 N/A ASP 742.A N ASN 738.A O no hydrogen 3.250 N/A TYR 743.A N LEU 739.A O no hydrogen 2.672 N/A TYR 743.A OH HIS 530.A ND1 no hydrogen 2.262 N/A MET 745.A N TYR 740.A O no hydrogen 2.813 N/A ASN 747.A N GLY 744.A O no hydrogen 3.289 N/A ASN 747.A ND2 GLY 744.A O no hydrogen 3.450 N/A PHE 748.A N MET 745.A O no hydrogen 2.747 N/A PHE 752.A N TYR 1016.A O no hydrogen 3.052 N/A ASN 753.A N GLN 731.A OE1 no hydrogen 2.416 N/A ASN 753.A ND2 GLN 731.A OE1 no hydrogen 3.424 N/A ASN 753.A ND2 THR 732.A O no hydrogen 2.870 N/A ALA 754.A N VAL 1014.A O no hydrogen 2.801 N/A VAL 755.A N ASP 929.A OD2 no hydrogen 3.139 N/A VAL 756.A N GLY 1012.A O no hydrogen 2.641 N/A ALA 757.A N ILE 930.A O no hydrogen 3.242 N/A VAL 758.A N TYR 1010.A O no hydrogen 2.872 N/A ILE 759.A N ILE 932.A O no hydrogen 3.189 N/A SER 760.A OG ASN 933.A OD1 no hydrogen 3.292 N/A SER 760.A OG HIS 935.A NE2 no hydrogen 2.567 N/A TYR 761.A OH ASP 918.A O no hydrogen 2.951 N/A TYR 761.A OH SER 998.A OG no hydrogen 2.871 N/A THR 762.A OG1 ASP 765.A OD1 no hydrogen 3.480 N/A TYR 764.A N THR 762.A OG1 no hydrogen 3.288 N/A ALA 769.A N ASP 768.A OD1 no hydrogen 2.562 N/A ILE 771.A N ILE 931.A O no hydrogen 3.193 N/A ILE 772.A N ARG 912.A O no hydrogen 3.472 N/A ASN 773.A N ASP 929.A O no hydrogen 2.722 N/A ASN 773.A ND2 THR 916.A OG1 no hydrogen 3.268 N/A ASN 773.A ND2 PRO 928.A O no hydrogen 3.300 N/A LYS 774.A N TRP 914.A O no hydrogen 2.669 N/A ALA 776.A N ASN 773.A OD1 no hydrogen 3.215 N/A ASP 777.A N ASN 773.A O no hydrogen 3.046 N/A GLU 778.A N LYS 774.A O no hydrogen 3.064 N/A ARG 779.A N SER 775.A O no hydrogen 3.088 N/A ARG 779.A N ALA 776.A O no hydrogen 3.097 N/A GLY 780.A N ASP 777.A O no hydrogen 2.577 N/A TYR 783.A N GLY 780.A O no hydrogen 3.133 N/A GLY 784.A N ARG 892.A O no hydrogen 2.891 N/A THR 785.A N ARG 726.A O no hydrogen 2.787 N/A THR 785.A OG1 GLY 784.A O no hydrogen 2.729 N/A MET 786.A N ILE 890.A O no hydrogen 3.045 N/A TYR 787.A N LEU 724.A O no hydrogen 2.384 N/A LYS 788.A N TYR 888.A O no hydrogen 3.225 N/A THR 789.A N ASN 722.A O no hydrogen 2.496 N/A THR 789.A OG1 ASP 721.A O no hydrogen 3.059 N/A GLU 790.A N ILE 886.A O no hydrogen 2.405 N/A VAL 792.A N VAL 884.A O no hydrogen 2.560 N/A ALA 795.A N ASP 793.A OD1 no hydrogen 2.467 N/A ARG 798.A N ASN 797.A OD1 no hydrogen 2.638 N/A HIS 807.A N PHE 845.A O no hydrogen 2.977 N/A HIS 807.A ND1 GLU 880.A OE2 no hydrogen 2.532 N/A HIS 807.A NE2 ASP 847.A OD2 no hydrogen 2.910 N/A GLY 809.A N ALA 843.A O no hydrogen 2.459 N/A GLY 811.A N THR 852.A OG1 no hydrogen 2.747 N/A GLU 818.A N GLU 818.A OE1 no hydrogen 2.717 N/A GLU 821.A N GLU 818.A O no hydrogen 2.786 N/A LEU 823.A N TRP 819.A O no hydrogen 2.598 N/A ASP 824.A N LEU 828.A O no hydrogen 2.202 N/A GLU 825.A N ASP 824.A OD1 no hydrogen 2.378 N/A GLY 827.A N ASP 824.A O no hydrogen 2.914 N/A LEU 828.A N ASP 826.A OD1 no hydrogen 3.123 N/A TYR 830.A N LYS 822.A O no hydrogen 3.218 N/A TYR 830.A OH ASP 824.A OD1 no hydrogen 3.101 N/A GLY 832.A N ILE 865.A O no hydrogen 2.614 N/A THR 833.A N TYR 830.A O no hydrogen 3.210 N/A THR 833.A OG1 TYR 830.A O no hydrogen 2.839 N/A VAL 835.A N ALA 863.A O no hydrogen 2.821 N/A GLU 836.A N ASP 839.A OD2 no hydrogen 2.932 N/A GLY 838.A N TYR 857.A O no hydrogen 2.709 N/A ASP 839.A N GLU 836.A O no hydrogen 3.037 N/A ILE 841.A N LYS 855.A O no hydrogen 2.671 N/A CYS 842.A N LYS 855.A O no hydrogen 3.330 N/A CYS 842.A SG GLY 827.A O no hydrogen 3.908 N/A ALA 843.A N GLY 827.A O no hydrogen 2.782 N/A TYR 844.A N LYS 853.A O no hydrogen 2.926 N/A PHE 845.A N HIS 807.A O no hydrogen 2.790 N/A ASP 846.A N LYS 851.A O no hydrogen 2.581 N/A ASP 847.A N THR 805.A O no hydrogen 3.174 N/A THR 848.A N ASP 846.A OD1 no hydrogen 2.964 N/A THR 848.A OG1 ASP 846.A OD1 no hydrogen 2.921 N/A THR 848.A OG1 ASP 846.A OD2 no hydrogen 2.606 N/A LEU 849.A N ASP 846.A OD2 no hydrogen 3.367 N/A ASN 850.A N ASP 847.A O no hydrogen 2.956 N/A THR 852.A OG1 ASP 813.A OD1 no hydrogen 2.351 N/A THR 852.A OG1 ASP 813.A OD2 no hydrogen 3.220 N/A LYS 853.A N TYR 844.A O no hydrogen 2.854 N/A LYS 855.A N CYS 842.A O no hydrogen 3.235 N/A TYR 857.A N ASP 839.A O no hydrogen 2.883 N/A TYR 857.A OH GLU 861.A O no hydrogen 2.223 N/A GLU 861.A N SER 859.A OG no hydrogen 3.210 N/A ALA 863.A N VAL 835.A O no hydrogen 2.942 N/A TYR 864.A N ARG 889.A O no hydrogen 2.616 N/A ILE 865.A N THR 833.A O no hydrogen 3.131 N/A GLU 866.A N LYS 887.A O no hydrogen 2.798 N/A GLU 867.A N LYS 887.A O no hydrogen 3.404 N/A ASN 869.A N SER 885.A O no hydrogen 2.934 N/A ASN 869.A ND2 SER 885.A OG no hydrogen 3.119 N/A ILE 871.A N THR 883.A O no hydrogen 3.318 N/A SER 875.A OG ASP 873.A OD2 no hydrogen 3.518 N/A SER 875.A OG GLU 874.A O no hydrogen 2.248 N/A VAL 884.A N VAL 792.A O no hydrogen 2.910 N/A SER 885.A N ASN 869.A O no hydrogen 3.358 N/A ILE 886.A N GLU 790.A O no hydrogen 2.379 N/A LYS 887.A N GLU 867.A O no hydrogen 3.005 N/A LYS 887.A NZ LEU 716.A O no hydrogen 3.067 N/A LYS 887.A NZ ARG 719.A O no hydrogen 2.260 N/A LYS 887.A NZ GLU 867.A OE1 no hydrogen 3.026 N/A TYR 888.A N LYS 788.A O no hydrogen 2.620 N/A TYR 888.A OH GLU 790.A OE1 no hydrogen 2.574 N/A ARG 889.A N TYR 864.A O no hydrogen 2.908 N/A ARG 889.A NH1 GLU 866.A OE1 no hydrogen 2.189 N/A ILE 890.A N MET 786.A O no hydrogen 2.890 N/A ARG 891.A NE TYR 783.A OH no hydrogen 3.372 N/A ARG 892.A N GLY 784.A O no hydrogen 3.292 N/A GLN 895.A N THR 893.A O no hydrogen 2.785 N/A GLN 895.A NE2 THR 893.A OG1 no hydrogen 2.530 N/A GLY 897.A N CYS 910.A O no hydrogen 3.215 N/A ASP 898.A N GLN 895.A O no hydrogen 3.199 N/A PHE 900.A N GLY 908.A O no hydrogen 2.772 N/A SER 901.A N GLN 1017.A O no hydrogen 2.987 N/A SER 901.A OG SER 902.A O no hydrogen 2.604 N/A SER 901.A OG GLN 906.A O no hydrogen 3.122 N/A SER 902.A N GLN 906.A O no hydrogen 3.342 N/A ARG 903.A NH1 VAL 735.A O no hydrogen 2.649 N/A ARG 903.A NH2 VAL 735.A O no hydrogen 2.953 N/A ARG 903.A NH2 GLU 948.A OE2 no hydrogen 2.721 N/A HIS 904.A N SER 902.A OG no hydrogen 2.928 N/A HIS 904.A NE2 GLU 948.A OE1 no hydrogen 2.194 N/A GLY 908.A N PHE 900.A O no hydrogen 2.976 N/A CYS 910.A N ASP 898.A O no hydrogen 3.097 N/A CYS 910.A SG MET 770.A O no hydrogen 3.839 N/A SER 911.A N MET 770.A O no hydrogen 2.578 N/A SER 911.A OG TYR 764.A O no hydrogen 2.613 N/A LYS 913.A NZ ASP 777.A OD2 no hydrogen 3.092 N/A TRP 914.A N ILE 772.A O no hydrogen 2.601 N/A THR 916.A OG1 ASN 773.A OD1 no hydrogen 3.314 N/A ASP 918.A N PRO 915.A O no hydrogen 2.771 N/A MET 919.A N PRO 915.A O no hydrogen 3.202 N/A MET 919.A N THR 916.A O no hydrogen 3.007 N/A PHE 921.A N TYR 997.A O no hydrogen 3.262 N/A SER 922.A N ILE 926.A O no hydrogen 3.343 N/A GLU 923.A N PRO 995.A O no hydrogen 2.903 N/A GLY 925.A N SER 922.A O no hydrogen 2.969 N/A ILE 926.A N SER 922.A OG no hydrogen 2.398 N/A GLN 927.A N GLN 927.A OE1 no hydrogen 2.690 N/A ASP 929.A N VAL 755.A O no hydrogen 2.550 N/A ILE 930.A N VAL 755.A O no hydrogen 3.183 N/A ILE 931.A N ILE 771.A O no hydrogen 2.691 N/A ILE 932.A N ALA 757.A O no hydrogen 3.223 N/A ASN 933.A ND2 ASP 765.A O no hydrogen 2.662 N/A HIS 935.A N ASN 933.A OD1 no hydrogen 2.753 N/A PHE 937.A N HIS 935.A O no hydrogen 2.797 N/A MET 941.A N PHE 937.A O no hydrogen 2.856 N/A THR 942.A OG1 THR 942.A O no hydrogen 2.402 N/A GLY 944.A N ASN 693.A OD1 no hydrogen 2.868 N/A VAL 947.A N ILE 943.A O no hydrogen 3.093 N/A GLU 948.A N GLY 944.A O no hydrogen 2.613 N/A SER 949.A N MET 945.A O no hydrogen 2.707 N/A LEU 950.A N PHE 946.A O no hydrogen 3.006 N/A ALA 951.A N VAL 947.A O no hydrogen 2.919 N/A GLY 952.A N GLU 948.A O no hydrogen 2.632 N/A LYS 953.A N SER 949.A O no hydrogen 3.328 N/A LYS 953.A NZ GLY 992.A O no hydrogen 3.084 N/A LYS 953.A NZ GLU 994.A OE2 no hydrogen 2.388 N/A LYS 953.A NZ VAL 1011.A O no hydrogen 2.846 N/A ALA 954.A N LEU 950.A O no hydrogen 2.676 N/A GLY 955.A N ALA 951.A O no hydrogen 2.577 N/A ALA 956.A N GLY 952.A O no hydrogen 3.038 N/A LEU 957.A N LYS 953.A O no hydrogen 3.004 N/A HIS 958.A N ALA 954.A O no hydrogen 3.338 N/A ILE 960.A N GLY 955.A O no hydrogen 3.124 N/A GLN 962.A N ILE 734.A O no hydrogen 3.391 N/A SER 964.A N LYS 736.A O no hydrogen 2.245 N/A THR 965.A N ASP 963.A OD2 no hydrogen 3.341 N/A THR 965.A OG1 ASP 963.A OD1 no hydrogen 2.685 N/A THR 965.A OG1 ASP 963.A OD2 no hydrogen 3.186 N/A TRP 967.A N ASP 691.A OD2 no hydrogen 3.179 N/A ASN 970.A N ASP 973.A O no hydrogen 3.085 N/A ASP 973.A N ASN 970.A OD1 no hydrogen 2.243 N/A ASP 977.A N THR 974.A OG1 no hydrogen 3.147 N/A TYR 978.A N THR 974.A O no hydrogen 2.848 N/A PHE 979.A N PRO 975.A O no hydrogen 2.477 N/A GLY 980.A N ALA 976.A O no hydrogen 3.120 N/A GLU 981.A N ASP 977.A O no hydrogen 3.339 N/A LEU 983.A N PHE 979.A O no hydrogen 2.921 N/A ALA 984.A N GLY 980.A O no hydrogen 2.652 N/A LYS 985.A N GLU 981.A O no hydrogen 3.082 N/A ALA 986.A N GLN 982.A O no hydrogen 2.694 N/A ALA 986.A N LEU 983.A O no hydrogen 2.853 N/A GLY 987.A N ALA 984.A O no hydrogen 2.741 N/A TYR 988.A N LEU 983.A O no hydrogen 2.811 N/A ASN 989.A ND2 ASN 993.A O no hydrogen 3.569 N/A TYR 990.A OH ASP 977.A O no hydrogen 3.259 N/A HIS 991.A N ASN 989.A OD1 no hydrogen 2.815 N/A GLY 992.A N ASN 989.A O no hydrogen 2.620 N/A GLU 994.A N ILE 1009.A O no hydrogen 2.447 N/A TYR 997.A N PHE 921.A O no hydrogen 3.280 N/A SER 998.A N GLU 1003.A O no hydrogen 2.876 N/A SER 998.A OG TYR 761.A OH no hydrogen 2.871 N/A GLY 1002.A N SER 998.A O no hydrogen 2.663 N/A GLU 1003.A N THR 1001.A OG1 no hydrogen 3.090 N/A LEU 1005.A N MET 996.A O no hydrogen 3.071 N/A ILE 1009.A N GLU 994.A O no hydrogen 2.750 N/A TYR 1010.A OH PHE 946.A O no hydrogen 2.308 N/A GLY 1012.A N VAL 756.A O no hydrogen 2.775 N/A VAL 1014.A N ALA 754.A O no hydrogen 2.887 N/A TYR 1015.A N GLU 948.A OE2 no hydrogen 2.941 N/A TYR 1016.A N PHE 752.A O no hydrogen 2.636 N/A GLN 1017.A N SER 901.A O no hydrogen 2.622 N/A ARG 1018.A NH1 GLY 782.A O no hydrogen 2.877 N/A ARG 1018.A NH2 THR 893.A O no hydrogen 2.329 N/A LEU 1019.A N LYS 899.A O no hydrogen 3.205 N/A ARG 1020.A N GLN 707.A O no hydrogen 3.132 N/A VAL 1023.A N ASP 898.A OD1 no hydrogen 3.263 N/A ASP 1025.A N MET 1022.A O no hydrogen 2.894 N/A LYS 1026.A N VAL 1023.A O no hydrogen 2.630 N/A GLN 1028.A NE2 GLY 1051.A O no hydrogen 3.280 N/A ASN 1036.A N GLN 1041.A O no hydrogen 2.288 N/A THR 1039.A OG1 GLN 1041.A OE1 no hydrogen 3.283 N/A GLN 1041.A NE2 SER 1079.A O no hydrogen 2.556 N/A GLN 1041.A NE2 ASP 1080.A OD2 no hydrogen 2.789 N/A ARG 1048.A N GLY 1045.A O no hydrogen 3.147 N/A GLU 1058.A N GLU 1058.A OE1 no hydrogen 2.398 N/A ARG 1059.A N GLY 1055.A O no hydrogen 2.549 N/A ASP 1060.A N GLU 1056.A O no hydrogen 2.479 N/A ALA 1061.A N MET 1057.A O no hydrogen 3.467 N/A LEU 1062.A N GLU 1058.A O no hydrogen 3.390 N/A ILE 1063.A N ARG 1059.A O no hydrogen 3.281 N/A GLY 1064.A N ASP 1060.A O no hydrogen 2.754 N/A HIS 1065.A N ALA 1061.A O no hydrogen 1.753 N/A GLY 1066.A N LEU 1062.A O no hydrogen 3.014 N/A THR 1067.A OG1 THR 1067.A O no hydrogen 2.615 N/A SER 1068.A N GLY 1066.A O no hydrogen 2.690 N/A LEU 1071.A N THR 1067.A O no hydrogen 2.685 N/A GLN 1072.A N SER 1068.A O no hydrogen 2.913 N/A ASP 1073.A N PHE 1069.A O no hydrogen 2.881 N/A ARG 1074.A N LEU 1070.A O no hydrogen 2.809 N/A LEU 1075.A N LEU 1071.A O no hydrogen 2.969 N/A LEU 1076.A N GLN 1072.A O no hydrogen 2.891 N/A ASN 1077.A N ASP 1073.A O no hydrogen 2.878 N/A SER 1078.A N ARG 1074.A O no hydrogen 2.842 N/A SER 1079.A N LEU 1076.A O no hydrogen 3.202 N/A SER 1079.A OG SER 1078.A O no hydrogen 3.455 N/A THR 1082.A N ILE 1152.A O no hydrogen 3.312 N/A THR 1082.A OG1 GLN 1083.A O no hydrogen 3.074 N/A GLN 1083.A N THR 1082.A OG1 no hydrogen 2.378 N/A ALA 1084.A N VAL 1150.A O no hydrogen 2.711 N/A CYS 1087.A N SER 1092.A O no hydrogen 3.088 N/A CYS 1087.A SG GLU 1146.A O no hydrogen 3.437 N/A ARG 1088.A N GLU 1146.A O no hydrogen 3.271 N/A ARG 1088.A NH1 GLU 1146.A OE1 no hydrogen 2.256 N/A CYS 1090.A SG THR 1095.A OG1 no hydrogen 3.259 N/A GLY 1091.A N CYS 1087.A O no hydrogen 2.614 N/A LEU 1094.A N SER 1092.A OG no hydrogen 3.147 N/A THR 1096.A OG1 SER 1085.A O no hydrogen 3.210 N/A THR 1096.A OG1 ILE 1093.A O no hydrogen 2.829 N/A GLN 1097.A N CYS 1110.A O no hydrogen 2.848 N/A GLN 1097.A NE2 GLN 1098.A O no hydrogen 3.611 N/A SER 1099.A N THR 1108.A O no hydrogen 2.437 N/A SER 1099.A OG SER 1107.A OG no hydrogen 3.312 N/A SER 1099.A OG THR 1108.A O no hydrogen 2.764 N/A VAL 1100.A N GLU 1134.A O no hydrogen 2.731 N/A SER 1105.A N ARG 1102.A O no hydrogen 2.819 N/A SER 1107.A OG GLN 1098.A OE1 no hydrogen 3.087 N/A SER 1107.A OG SER 1099.A O no hydrogen 2.245 N/A SER 1107.A OG SER 1099.A OG no hydrogen 3.312 N/A THR 1108.A N SER 1099.A OG no hydrogen 2.484 N/A CYS 1110.A N GLN 1097.A O no hydrogen 2.774 N/A CYS 1110.A SG VAL 1109.A O no hydrogen 3.107 N/A CYS 1111.A N GLY 1144.A O no hydrogen 2.297 N/A CYS 1111.A SG THR 1095.A OG1 no hydrogen 2.638 N/A ARG 1112.A N THR 1095.A O no hydrogen 2.608 N/A ARG 1112.A NH2 GLN 1097.A OE1 no hydrogen 2.382 N/A SER 1115.A N ARG 1112.A O no hydrogen 3.055 N/A SER 1115.A OG CYS 1111.A O no hydrogen 3.199 N/A SER 1115.A OG ARG 1112.A O no hydrogen 2.527 N/A MET 1116.A N VAL 1142.A O no hydrogen 2.608 N/A PHE 1118.A N LYS 1140.A O no hydrogen 3.003 N/A ASP 1120.A N ARG 1117.A O no hydrogen 2.855 N/A ALA 1121.A N PHE 1118.A O no hydrogen 3.179 N/A LYS 1123.A N ASP 1120.A O no hydrogen 3.235 N/A LYS 1123.A NZ ASP 1120.A OD1 no hydrogen 2.702 N/A LEU 1124.A N ALA 1121.A O no hydrogen 2.947 N/A SER 1130.A N ASP 1128.A OD1 no hydrogen 3.378 N/A SER 1130.A OG ASP 1128.A OD2 no hydrogen 3.192 N/A TRP 1133.A N PHE 1141.A O no hydrogen 2.543 N/A TRP 1133.A NE1 GLY 1143.A O no hydrogen 2.927 N/A ASP 1135.A N ASN 1139.A O no hydrogen 3.322 N/A GLY 1138.A N ASP 1135.A O no hydrogen 2.799 N/A ASN 1139.A N ASP 1135.A OD1 no hydrogen 2.277 N/A PHE 1141.A N TRP 1133.A O no hydrogen 2.400 N/A VAL 1142.A N MET 1116.A O no hydrogen 2.785 N/A THR 1148.A N VAL 1086.A O no hydrogen 3.074 N/A VAL 1150.A N ALA 1084.A O no hydrogen 2.870 N/A VAL 1155.A N ASP 1080.A OD2 no hydrogen 3.171 N/A LEU 1156.A N PRO 1153.A O no hydrogen 3.281 N/A TYR 1158.A N PHE 1154.A O no hydrogen 3.449 N/A LEU 1159.A N VAL 1155.A O no hydrogen 2.614 N/A ASP 1160.A N LEU 1156.A O no hydrogen 2.916 N/A SER 1161.A N LYS 1157.A O no hydrogen 2.859 N/A GLU 1162.A N TYR 1158.A O no hydrogen 3.041 N/A LEU 1163.A N LEU 1159.A O no hydrogen 2.977 N/A SER 1164.A N ASP 1160.A O no hydrogen 2.571 N/A SER 1164.A OG ASP 1160.A O no hydrogen 3.035 N/A SER 1164.A OG SER 1161.A O no hydrogen 2.268 N/A ALA 1165.A N SER 1161.A O no hydrogen 3.070 N/A MET 1166.A N GLU 1162.A O no hydrogen 3.146 N/A GLY 1167.A N SER 1164.A O no hydrogen 2.748 N/A ILE 1168.A N LEU 1163.A O no hydrogen 2.713 N/A ARG 1169.A NH2 CYS 1090.A O no hydrogen 2.254 N/A ARG 1171.A NH1 GLU 1089.A O no hydrogen 2.709 N/A ARG 1171.A NH2 GLU 1089.A O no hydrogen 2.377 N/A TYR 1172.A N GLY 1091.A O no hydrogen 2.921 N/A