Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xcr_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ILE 38.A O no hydrogen 3.029 N/A CYS 5.A N ASP 4.A OD2 no hydrogen 2.717 N/A CYS 5.A SG ASP 4.A OD2 no hydrogen 3.545 N/A CYS 5.A SG SER 7.A O no hydrogen 3.980 N/A SER 6.A N SER 33.A O no hydrogen 3.174 N/A SER 6.A OG ARG 34.A O no hydrogen 3.306 N/A SER 7.A N ARG 34.A O no hydrogen 2.915 N/A SER 7.A OG GLU 12.A OE2 no hydrogen 3.218 N/A CYS 13.A N SER 9.A O no hydrogen 3.204 N/A GLU 14.A N THR 35.A O no hydrogen 3.363 N/A ILE 15.A N LYS 86.A O no hydrogen 3.005 N/A PHE 16.A N ALA 37.A O no hydrogen 2.998 N/A LEU 17.A N VAL 88.A O no hydrogen 2.972 N/A VAL 18.A N LEU 39.A O no hydrogen 3.259 N/A GLY 24.A N GLY 20.A O no hydrogen 2.924 N/A SER 26.A OG LEU 167.A O no hydrogen 3.422 N/A SER 26.A OG MET 170.A O no hydrogen 2.577 N/A THR 27.A OG1 ALA 23.A O no hydrogen 2.661 N/A LYS 28.A N GLY 25.A O no hydrogen 2.898 N/A GLY 30.A N SER 26.A O no hydrogen 3.194 N/A ARG 31.A NH2 GLN 36.A O no hydrogen 2.403 N/A ASP 32.A N GLN 36.A OE1 no hydrogen 2.872 N/A THR 35.A N ASP 32.A O no hydrogen 3.226 N/A THR 35.A OG1 ASP 32.A OD2 no hydrogen 3.367 N/A GLN 36.A N ASP 32.A O no hydrogen 3.172 N/A GLN 36.A NE2 GLU 14.A OE2 no hydrogen 3.028 N/A GLN 36.A NE2 MET 180.A O no hydrogen 3.362 N/A ALA 37.A N GLU 14.A O no hydrogen 3.047 N/A ILE 38.A N ALA 3.A O no hydrogen 2.871 N/A LEU 39.A N PHE 16.A O no hydrogen 3.406 N/A LEU 41.A N VAL 18.A O no hydrogen 3.095 N/A LYS 44.A NZ TYR 252.A OH no hydrogen 3.437 N/A ASN 47.A ND2 MET 206.A O no hydrogen 3.614 N/A GLU 49.A N ASN 47.A OD1 no hydrogen 3.416 N/A LYS 50.A N ASN 47.A O no hydrogen 3.054 N/A ARG 55.A N ARG 52.A O no hydrogen 3.213 N/A ILE 56.A N ARG 52.A O no hydrogen 2.912 N/A GLU 61.A N ASN 59.A OD1 no hydrogen 3.128 N/A ARG 63.A N ASN 59.A O no hydrogen 3.263 N/A GLN 64.A N ASN 60.A O no hydrogen 3.146 N/A MET 65.A N GLU 61.A O no hydrogen 3.182 N/A ILE 66.A N ILE 62.A O no hydrogen 3.193 N/A THR 67.A N ARG 63.A O no hydrogen 2.955 N/A THR 67.A OG1 ARG 63.A O no hydrogen 2.831 N/A ALA 68.A N GLN 64.A O no hydrogen 3.279 N/A PHE 69.A N MET 65.A O no hydrogen 2.971 N/A GLY 70.A N ILE 66.A O no hydrogen 2.975 N/A THR 71.A OG1 GLY 72.A O no hydrogen 2.809 N/A GLY 74.A N PHE 111.A O no hydrogen 3.243 N/A ASP 76.A N ILE 73.A O no hydrogen 3.272 N/A ALA 80.A N ASP 78.A OD2 no hydrogen 3.438 N/A LYS 81.A N ASP 78.A O no hydrogen 3.163 N/A ARG 83.A N PHE 69.A O no hydrogen 3.324 N/A TYR 84.A OH ASP 4.A OD2 no hydrogen 3.174 N/A HIS 85.A N CYS 13.A O no hydrogen 3.141 N/A ILE 87.A N TYR 120.A O no hydrogen 2.906 N/A VAL 88.A N ILE 15.A O no hydrogen 2.738 N/A MET 90.A N LEU 17.A O no hydrogen 3.026 N/A THR 91.A OG1 GLY 97.A O no hydrogen 3.056 N/A GLY 97.A N ASP 94.A O no hydrogen 2.786 N/A ALA 98.A N VAL 95.A O no hydrogen 2.841 N/A HIS 99.A N VAL 95.A O no hydrogen 3.405 N/A ILE 100.A N ASP 96.A O no hydrogen 3.233 N/A ARG 101.A N GLY 97.A O no hydrogen 3.117 N/A ARG 101.A NH2 SER 248.A OG no hydrogen 3.002 N/A THR 102.A N ALA 98.A O no hydrogen 3.127 N/A THR 102.A OG1 HIS 99.A O no hydrogen 2.630 N/A LEU 103.A N HIS 99.A O no hydrogen 3.425 N/A LEU 104.A N ILE 100.A O no hydrogen 3.045 N/A LEU 105.A N ARG 101.A O no hydrogen 2.812 N/A THR 106.A N THR 102.A O no hydrogen 2.791 N/A THR 106.A OG1 THR 102.A O no hydrogen 2.619 N/A PHE 107.A N LEU 103.A O no hydrogen 2.799 N/A PHE 108.A N LEU 104.A O no hydrogen 2.729 N/A TYR 109.A N LEU 105.A O no hydrogen 2.917 N/A TYR 109.A OH ASP 199.A OD1 no hydrogen 3.007 N/A ARG 110.A N THR 106.A O no hydrogen 3.178 N/A PHE 111.A N PHE 107.A O no hydrogen 3.320 N/A ILE 116.A N ARG 113.A O no hydrogen 3.159 N/A ALA 118.A N PRO 114.A O no hydrogen 3.306 N/A GLY 119.A N ILE 116.A O no hydrogen 3.139 N/A TYR 120.A N LEU 115.A O no hydrogen 3.282 N/A TYR 122.A N ILE 87.A O no hydrogen 2.829 N/A ILE 123.A N LEU 188.A O no hydrogen 2.795 N/A ALA 124.A N ILE 89.A O no hydrogen 3.231 N/A LEU 128.A N VAL 140.A O no hydrogen 3.446 N/A TYR 129.A OH ASP 143.A OD1 no hydrogen 3.005 N/A THR 132.A OG1 LYS 130.A O no hydrogen 3.518 N/A GLN 133.A N GLN 136.A O no hydrogen 3.113 N/A TYR 138.A N LEU 131.A O no hydrogen 2.966 N/A TYR 141.A N GLU 145.A OE1 no hydrogen 3.292 N/A ARG 144.A NH2 ASP 251.A O no hydrogen 3.345 N/A GLU 145.A N ASN 142.A O no hydrogen 3.079 N/A GLU 145.A N ASN 142.A OD1 no hydrogen 3.022 N/A LEU 146.A N ASN 142.A O no hydrogen 3.400 N/A ASP 147.A N ASP 143.A O no hydrogen 3.150 N/A LYS 148.A N ARG 144.A O no hydrogen 3.515 N/A LEU 149.A N GLU 145.A O no hydrogen 3.284 N/A LYS 150.A N LEU 146.A O no hydrogen 2.914 N/A SER 151.A N LYS 148.A O no hydrogen 3.089 N/A GLU 152.A N LEU 149.A O no hydrogen 2.898 N/A ASN 154.A N GLU 152.A O no hydrogen 3.084 N/A THR 156.A N LEU 153.A O no hydrogen 3.175 N/A THR 156.A OG1 LEU 153.A O no hydrogen 3.277 N/A THR 156.A OG1 ASN 154.A O no hydrogen 2.621 N/A SER 160.A N THR 132.A O no hydrogen 3.269 N/A ARG 163.A NH1 TYR 129.A OH no hydrogen 3.391 N/A LYS 165.A NZ LYS 165.A O no hydrogen 3.553 N/A MET 170.A N LEU 167.A O no hydrogen 3.184 N/A GLN 174.A N ASN 171.A O no hydrogen 3.019 N/A TRP 176.A N ASP 173.A O no hydrogen 3.214 N/A GLU 177.A N ASP 173.A O no hydrogen 2.887 N/A THR 178.A OG1 GLN 174.A O no hydrogen 2.612 N/A THR 178.A OG1 THR 179.A OG1 no hydrogen 3.060 N/A THR 179.A OG1 THR 178.A OG1 no hydrogen 3.060 N/A MET 180.A N TRP 176.A O no hydrogen 3.211 N/A ASN 181.A N TRP 176.A O no hydrogen 2.777 N/A ASN 181.A ND2 GLU 183.A OE2 no hydrogen 3.558 N/A HIS 184.A N ASN 181.A O no hydrogen 2.765 N/A ARG 185.A N ASN 181.A O no hydrogen 3.266 N/A ARG 185.A NH1 GLU 14.A OE2 no hydrogen 3.557 N/A ARG 185.A NH1 MET 180.A O no hydrogen 3.143 N/A ARG 185.A NH2 GLU 14.A OE1 no hydrogen 2.993 N/A LEU 188.A N ILE 123.A O no hydrogen 2.959 N/A GLN 189.A N ASN 237.A O no hydrogen 3.028 N/A VAL 190.A N VAL 121.A O no hydrogen 3.398 N/A LYS 191.A N ARG 239.A O no hydrogen 3.200 N/A GLU 197.A N ASP 194.A O no hydrogen 3.109 N/A GLU 197.A N ASP 194.A OD2 no hydrogen 3.353 N/A ALA 198.A N ASP 194.A O no hydrogen 3.277 N/A ASP 199.A N ALA 195.A O no hydrogen 3.510 N/A THR 201.A N GLU 197.A O no hydrogen 3.271 N/A THR 201.A OG1 GLU 197.A O no hydrogen 2.844 N/A PHE 202.A N ALA 198.A O no hydrogen 2.864 N/A MET 204.A N THR 201.A O no hydrogen 3.033 N/A LEU 205.A N THR 201.A O no hydrogen 3.209 N/A MET 206.A N PHE 202.A O no hydrogen 2.834 N/A ASP 208.A N ASP 208.A OD1 no hydrogen 2.491 N/A ARG 213.A NH1 GLY 207.A O no hydrogen 2.529 N/A ARG 214.A N VAL 210.A O no hydrogen 3.172 N/A GLN 215.A N GLU 211.A O no hydrogen 2.888 N/A PHE 216.A N ASN 212.A O no hydrogen 3.017 N/A ILE 217.A N ARG 213.A O no hydrogen 3.194 N/A ILE 217.A N ARG 214.A O no hydrogen 2.762 N/A GLU 218.A N ARG 214.A O no hydrogen 3.238 N/A ASP 219.A N GLN 215.A O no hydrogen 2.993 N/A ASN 220.A N ILE 217.A O no hydrogen 3.031 N/A ASN 220.A ND2 PHE 216.A O no hydrogen 3.059 N/A ALA 221.A N ILE 217.A O no hydrogen 2.990 N/A GLN 233.A NE2 LEU 231.A O no hydrogen 2.935 N/A ILE 236.A N SER 234.A O no hydrogen 2.588 N/A ARG 239.A N GLN 189.A O no hydrogen 2.813 N/A ARG 239.A NE GLU 244.A OE1 no hydrogen 2.694 N/A ARG 239.A NH1 GLU 247.A OE1 no hydrogen 3.283 N/A ARG 239.A NH2 GLU 247.A OE2 no hydrogen 2.500 N/A ILE 241.A N LYS 191.A O no hydrogen 3.138 N/A THR 242.A N ASN 240.A OD1 no hydrogen 3.104 N/A THR 242.A OG1 ASN 240.A OD1 no hydrogen 3.357 N/A GLU 244.A N ASN 240.A O no hydrogen 3.144 N/A MET 245.A N ILE 241.A O no hydrogen 3.028 N/A ARG 246.A N THR 242.A O no hydrogen 2.961 N/A SER 248.A N GLU 244.A O no hydrogen 2.816 N/A SER 248.A OG GLU 244.A O no hydrogen 3.469 N/A SER 248.A OG GLU 244.A OE2 no hydrogen 3.431 N/A PHE 249.A N MET 245.A O no hydrogen 3.032 N/A ASP 251.A N GLU 247.A O no hydrogen 3.012 N/A ALA 253.A N PHE 249.A O no hydrogen 2.865 N/A MET 254.A N LEU 250.A O no hydrogen 2.845 N/A VAL 256.A N TYR 252.A O no hydrogen 2.981 N/A ILE 257.A N MET 254.A O no hydrogen 3.088 N/A VAL 258.A N MET 254.A O no hydrogen 2.921 N/A ALA 259.A N SER 255.A O no hydrogen 3.067 N/A ARG 260.A NH1 ASP 96.A OD1 no hydrogen 3.508 N/A ARG 260.A NH2 ASP 96.A OD1 no hydrogen 3.210 N/A ARG 260.A NH2 ASP 96.A OD2 no hydrogen 3.240 N/A ALA 261.A N VAL 256.A O no hydrogen 3.106 N/A VAL 265.A N ASP 264.A OD2 no hydrogen 3.066 N/A VAL 265.A N LEU 565.A O no hydrogen 3.139 N/A ARG 266.A NH2 ASP 264.A OD1 no hydrogen 2.575 N/A LEU 269.A N ASP 267.A OD1 no hydrogen 2.675 N/A LYS 270.A NZ ALA 261.A O no hydrogen 3.162 N/A ARG 274.A N LYS 270.A O no hydrogen 3.219 N/A ARG 274.A NE ASP 267.A OD2 no hydrogen 3.267 N/A ARG 274.A NH2 ASP 267.A OD2 no hydrogen 2.856 N/A ARG 275.A N PRO 271.A O no hydrogen 2.951 N/A ARG 275.A NH1 HIS 306.A ND1 no hydrogen 3.007 N/A ILE 276.A N VAL 272.A O no hydrogen 3.153 N/A LEU 277.A N HIS 273.A O no hydrogen 3.080 N/A TYR 278.A N ARG 274.A O no hydrogen 3.245 N/A GLY 279.A N ARG 275.A O no hydrogen 2.701 N/A LEU 280.A N ILE 276.A O no hydrogen 2.751 N/A ASN 281.A N LEU 277.A O no hydrogen 3.153 N/A GLU 282.A N TYR 278.A O no hydrogen 2.737 N/A GLN 283.A N GLY 279.A O no hydrogen 3.430 N/A GLY 284.A N ASN 281.A O no hydrogen 3.296 N/A THR 286.A N GLY 284.A O no hydrogen 2.511 N/A THR 286.A OG1 GLY 284.A O no hydrogen 2.851 N/A THR 286.A OG1 ASP 288.A OD1 no hydrogen 3.405 N/A LYS 289.A N THR 286.A O no hydrogen 3.107 N/A TYR 291.A OH ASP 332.A OD1 no hydrogen 3.066 N/A TYR 291.A OH ASP 332.A OD2 no hydrogen 3.120 N/A LYS 292.A NZ SER 290.A OG no hydrogen 3.023 N/A LYS 293.A NZ ARG 349.A O no hydrogen 2.952 N/A SER 294.A N THR 351.A O no hydrogen 2.979 N/A SER 294.A OG THR 351.A O no hydrogen 3.275 N/A SER 294.A OG THR 351.A OG1 no hydrogen 3.316 N/A ARG 296.A N LYS 293.A O no hydrogen 3.368 N/A ARG 296.A NH2 GLN 283.A OE1 no hydrogen 3.220 N/A VAL 298.A N SER 294.A O no hydrogen 3.060 N/A GLY 299.A N ALA 295.A O no hydrogen 3.173 N/A VAL 301.A N ILE 297.A O no hydrogen 2.927 N/A TYR 305.A N VAL 301.A O no hydrogen 3.140 N/A HIS 306.A N VAL 301.A O no hydrogen 2.968 N/A HIS 308.A N HIS 306.A O no hydrogen 2.873 N/A SER 312.A N GLY 309.A O no hydrogen 3.244 N/A TYR 314.A N ASP 310.A O no hydrogen 2.854 N/A TYR 314.A OH ALA 346.A O no hydrogen 2.917 N/A TYR 314.A OH THR 351.A OG1 no hydrogen 2.916 N/A MET 317.A N ILE 313.A O no hydrogen 2.967 N/A VAL 318.A N TYR 314.A O no hydrogen 2.935 N/A MET 320.A N ALA 316.A O no hydrogen 3.516 N/A ALA 321.A N VAL 318.A O no hydrogen 2.744 N/A GLN 322.A N ARG 319.A O no hydrogen 2.903 N/A GLN 322.A NE2 PHE 337.A O no hydrogen 2.904 N/A SER 325.A OG GLN 322.A OE1 no hydrogen 3.384 N/A TYR 326.A N GLN 322.A O no hydrogen 3.203 N/A ARG 327.A NH2 ASP 444.A OD2 no hydrogen 2.532 N/A ARG 327.A NH2 ASP 710.A O no hydrogen 3.003 N/A TYR 328.A N ASN 397.A OD1 no hydrogen 2.808 N/A TYR 328.A OH ASP 709.A OD1 no hydrogen 3.071 N/A LEU 330.A N MET 320.A O no hydrogen 2.913 N/A VAL 331.A N MET 320.A O no hydrogen 3.310 N/A ASP 332.A N ARG 354.A O no hydrogen 3.143 N/A GLN 334.A N GLU 352.A O no hydrogen 3.221 N/A GLN 334.A NE2 GLU 352.A OE1 no hydrogen 3.245 N/A GLY 338.A N ASN 336.A OD1 no hydrogen 2.980 N/A SER 339.A N ASP 343.A O no hydrogen 3.355 N/A ALA 346.A N ASN 336.A O no hydrogen 2.893 N/A PHE 350.A N ALA 347.A O no hydrogen 3.128 N/A THR 351.A OG1 SER 294.A OG no hydrogen 3.316 N/A THR 351.A OG1 TYR 314.A OH no hydrogen 2.916 N/A GLU 352.A N GLN 334.A O no hydrogen 2.981 N/A ALA 353.A N LYS 292.A O no hydrogen 3.060 N/A ARG 354.A N ASP 332.A O no hydrogen 3.020 N/A ARG 354.A NE ASP 332.A OD2 no hydrogen 2.904 N/A ARG 354.A NH1 LYS 289.A O no hydrogen 3.330 N/A ARG 354.A NH2 ASP 332.A OD2 no hydrogen 3.106 N/A THR 356.A OG1 PRO 329.A O no hydrogen 2.949 N/A THR 356.A OG1 THR 359.A OG1 no hydrogen 3.148 N/A THR 359.A N THR 356.A O no hydrogen 3.073 N/A THR 359.A OG1 LEU 330.A O no hydrogen 2.651 N/A THR 359.A OG1 THR 356.A OG1 no hydrogen 3.148 N/A LEU 360.A N LYS 357.A O no hydrogen 3.258 N/A GLU 361.A N ILE 358.A O no hydrogen 3.401 N/A ARG 364.A N GLU 361.A O no hydrogen 3.447 N/A ARG 364.A NH1 GLU 702.A OE2 no hydrogen 3.551 N/A ILE 366.A N LEU 363.A O no hydrogen 3.206 N/A LYS 368.A N ASP 365.A O no hydrogen 3.412 N/A THR 370.A OG1 ASP 365.A O no hydrogen 3.150 N/A ASN 376.A N GLU 381.A O no hydrogen 3.100 N/A ASN 376.A ND2 LYS 304.A O no hydrogen 3.290 N/A TYR 377.A OH GLY 303.A O no hydrogen 3.098 N/A ASP 378.A N ASN 376.A OD1 no hydrogen 3.423 N/A SER 385.A N ASP 372.A O no hydrogen 3.153 N/A SER 385.A OG ASP 372.A O no hydrogen 2.770 N/A LEU 387.A N ASP 267.A OD2 no hydrogen 3.418 N/A ARG 390.A NE GLN 586.A OE1 no hydrogen 3.357 N/A ARG 390.A NH2 GLU 699.A OE1 no hydrogen 2.747 N/A ASN 393.A N PHE 391.A O no hydrogen 2.611 N/A ASN 393.A ND2 ASP 267.A O no hydrogen 3.208 N/A ASN 393.A ND2 GLY 268.A O no hydrogen 3.637 N/A ALA 396.A N PRO 392.A O no hydrogen 2.720 N/A ASN 397.A N ASN 393.A O no hydrogen 3.029 N/A ASN 397.A ND2 TYR 328.A O no hydrogen 2.931 N/A ASN 397.A ND2 ASN 393.A OD1 no hydrogen 3.123 N/A GLY 398.A N ASN 393.A O no hydrogen 3.434 N/A ALA 403.A N MET 406.A O no hydrogen 3.291 N/A THR 408.A N GLY 401.A O no hydrogen 3.258 N/A THR 408.A OG1 ASN 561.A O no hydrogen 3.110 N/A THR 408.A OG1 ILE 563.A O no hydrogen 3.037 N/A ASN 409.A N ASN 561.A O no hydrogen 3.257 N/A ILE 410.A N ALA 399.A O no hydrogen 3.007 N/A HIS 413.A N LEU 395.A O no hydrogen 3.109 N/A HIS 413.A N ALA 396.A O no hydrogen 3.298 N/A ASN 414.A ND2 ASP 444.A OD2 no hydrogen 3.496 N/A ASN 414.A ND2 ASP 709.A O no hydrogen 3.041 N/A LEU 415.A N TYR 328.A OH no hydrogen 2.725 N/A THR 416.A N ASN 414.A OD1 no hydrogen 2.875 N/A GLU 417.A N ASN 414.A OD1 no hydrogen 3.440 N/A LEU 418.A N ASN 414.A O no hydrogen 2.848 N/A ILE 419.A N LEU 415.A O no hydrogen 2.735 N/A ASN 420.A N THR 416.A O no hydrogen 2.893 N/A GLY 421.A N GLU 417.A O no hydrogen 2.774 N/A VAL 422.A N LEU 418.A O no hydrogen 2.985 N/A LEU 423.A N ILE 419.A O no hydrogen 2.911 N/A SER 424.A N ASN 420.A O no hydrogen 3.366 N/A SER 424.A OG ASN 420.A O no hydrogen 2.992 N/A SER 424.A OG ASP 439.A OD2 no hydrogen 3.206 N/A SER 426.A N VAL 422.A O no hydrogen 3.023 N/A SER 426.A OG LEU 423.A O no hydrogen 3.214 N/A LYS 427.A N LEU 423.A O no hydrogen 3.218 N/A ASN 428.A N SER 424.A O no hydrogen 2.899 N/A ASP 430.A N ASN 428.A OD1 no hydrogen 2.910 N/A LEU 436.A N SER 432.A O no hydrogen 3.360 N/A MET 437.A N ALA 434.A O no hydrogen 3.134 N/A GLU 438.A N GLU 435.A O no hydrogen 3.181 N/A ASP 439.A N LEU 436.A O no hydrogen 3.241 N/A ILE 440.A N LEU 436.A O no hydrogen 3.000 N/A ASP 444.A N PRO 412.A O no hydrogen 3.164 N/A PHE 445.A N THR 713.A OG1 no hydrogen 3.105 N/A THR 447.A OG1 ILE 491.A O no hydrogen 3.176 N/A GLY 449.A N GLU 490.A OE2 no hydrogen 2.914 N/A LEU 450.A N ARG 471.A O no hydrogen 2.934 N/A ILE 451.A N GLU 714.A O no hydrogen 3.290 N/A ARG 458.A N LYS 454.A O no hydrogen 2.738 N/A TYR 461.A N ILE 457.A O no hydrogen 3.073 N/A TYR 461.A OH HIS 413.A NE2 no hydrogen 2.751 N/A GLU 462.A N ARG 458.A O no hydrogen 2.971 N/A THR 463.A N ARG 459.A O no hydrogen 3.135 N/A THR 463.A OG1 ARG 459.A O no hydrogen 2.606 N/A THR 463.A OG1 ARG 465.A O no hydrogen 3.536 N/A ILE 468.A N PHE 558.A O no hydrogen 3.184 N/A MET 470.A N THR 556.A O no hydrogen 2.839 N/A ARG 471.A N LEU 450.A O no hydrogen 3.138 N/A SER 472.A N LEU 554.A O no hydrogen 3.306 N/A SER 472.A OG LEU 554.A O no hydrogen 2.422 N/A ARG 473.A N GLU 490.A O no hydrogen 3.116 N/A ARG 473.A NE GLU 490.A OE2 no hydrogen 3.227 N/A VAL 475.A N VAL 487.A O no hydrogen 2.877 N/A GLU 477.A N ARG 485.A O no hydrogen 3.168 N/A ARG 479.A N ARG 483.A O no hydrogen 3.504 N/A ARG 483.A NH1 GLY 480.A O no hydrogen 3.192 N/A ARG 485.A N GLU 477.A O no hydrogen 2.994 N/A ARG 485.A NE GLU 477.A OE2 no hydrogen 3.007 N/A ARG 485.A NH2 GLU 477.A OE2 no hydrogen 3.065 N/A ILE 486.A N ILE 533.A O no hydrogen 2.799 N/A VAL 487.A N VAL 475.A O no hydrogen 2.927 N/A VAL 488.A N VAL 531.A O no hydrogen 2.881 N/A THR 489.A N ARG 473.A O no hydrogen 3.203 N/A LYS 497.A N MET 340.A O no hydrogen 3.056 N/A LYS 497.A NZ ASP 341.A OD1 no hydrogen 3.254 N/A LYS 497.A NZ ASP 341.A OD2 no hydrogen 3.366 N/A LYS 497.A NZ ASP 521.A OD2 no hydrogen 2.680 N/A ARG 499.A N ASN 496.A O no hydrogen 3.157 N/A ARG 499.A N ASN 496.A OD1 no hydrogen 2.725 N/A MET 500.A N ASN 496.A O no hydrogen 2.975 N/A MET 500.A N LYS 497.A O no hydrogen 3.127 N/A ILE 501.A N LYS 497.A O no hydrogen 3.103 N/A LYS 503.A N ARG 499.A O no hydrogen 3.272 N/A ILE 504.A N MET 500.A O no hydrogen 2.931 N/A ILE 504.A N ILE 501.A O no hydrogen 3.253 N/A ALA 505.A N ILE 501.A O no hydrogen 2.895 N/A GLU 506.A N GLU 502.A O no hydrogen 2.718 N/A VAL 508.A N ALA 505.A O no hydrogen 3.074 N/A ARG 509.A N ALA 505.A O no hydrogen 3.183 N/A ASP 510.A N GLU 506.A O no hydrogen 3.269 N/A LYS 511.A N VAL 508.A O no hydrogen 3.072 N/A THR 517.A N ASP 534.A O no hydrogen 3.004 N/A LEU 519.A N ASP 518.A OD2 no hydrogen 2.626 N/A ARG 520.A N VAL 532.A O no hydrogen 3.124 N/A ARG 520.A NE GLU 522.A OE2 no hydrogen 3.127 N/A ARG 520.A NH1 ASP 534.A OD2 no hydrogen 2.670 N/A ARG 520.A NH2 GLU 522.A OE2 no hydrogen 2.692 N/A GLU 522.A N ARG 530.A O no hydrogen 2.972 N/A THR 523.A N ASP 521.A OD1 no hydrogen 2.779 N/A THR 523.A OG1 ASP 521.A OD1 no hydrogen 2.815 N/A THR 523.A OG1 ARG 530.A O no hydrogen 3.248 N/A SER 524.A N GLY 528.A O no hydrogen 3.401 N/A SER 524.A OG GLU 522.A O no hydrogen 3.239 N/A SER 524.A OG THR 527.A OG1 no hydrogen 2.956 N/A THR 527.A N SER 524.A O no hydrogen 3.244 N/A THR 527.A OG1 SER 524.A OG no hydrogen 2.956 N/A ARG 530.A N THR 523.A OG1 no hydrogen 3.059 N/A ARG 530.A NE GLU 522.A OE1 no hydrogen 2.953 N/A VAL 531.A N VAL 488.A O no hydrogen 2.897 N/A VAL 532.A N ARG 520.A O no hydrogen 3.014 N/A ILE 533.A N ILE 486.A O no hydrogen 3.015 N/A ASP 534.A N ASP 518.A O no hydrogen 3.053 N/A ARG 536.A N GLY 515.A O no hydrogen 2.824 N/A ALA 539.A N LYS 537.A O no hydrogen 2.809 N/A SER 542.A N ASN 540.A OD1 no hydrogen 3.324 N/A VAL 543.A N ASN 540.A O no hydrogen 3.320 N/A LEU 545.A N ALA 541.A O no hydrogen 2.806 N/A ASN 546.A N SER 542.A O no hydrogen 3.127 N/A ASN 547.A N ILE 544.A O no hydrogen 2.826 N/A ASN 547.A ND2 VAL 543.A O no hydrogen 2.827 N/A LEU 548.A N ILE 544.A O no hydrogen 2.613 N/A LEU 548.A N LEU 545.A O no hydrogen 2.937 N/A TYR 549.A N LEU 545.A O no hydrogen 3.145 N/A GLN 551.A N ASN 547.A O no hydrogen 3.064 N/A THR 552.A OG1 LEU 548.A O no hydrogen 3.121 N/A GLN 555.A NE2 GLN 469.A OE1 no hydrogen 3.652 N/A THR 556.A N MET 470.A O no hydrogen 3.144 N/A THR 556.A OG1 PRO 553.A O no hydrogen 3.163 N/A PHE 558.A N ILE 468.A O no hydrogen 2.921 N/A VAL 560.A N GLY 466.A O no hydrogen 3.281 N/A ASN 561.A N ASN 409.A O no hydrogen 3.123 N/A MET 562.A N GLY 464.A O no hydrogen 3.189 N/A ILE 563.A N THR 408.A OG1 no hydrogen 3.056 N/A LEU 565.A N PRO 263.A O no hydrogen 2.840 N/A VAL 566.A N ARG 569.A O no hydrogen 2.810 N/A ARG 569.A N VAL 566.A O no hydrogen 2.853 N/A LYS 571.A N ALA 564.A O no hydrogen 3.257 N/A LYS 571.A NZ GLU 577.A OE1 no hydrogen 2.897 N/A ILE 573.A N MET 562.A O no hydrogen 3.000 N/A ASN 574.A ND2 GLU 462.A O no hydrogen 3.503 N/A LEU 575.A N TYR 461.A O no hydrogen 3.263 N/A LYS 576.A NZ PRO 429.A O no hydrogen 3.086 N/A LYS 576.A NZ ILE 431.A O no hydrogen 3.158 N/A GLU 577.A N ASN 574.A OD1 no hydrogen 2.831 N/A LEU 579.A N LYS 576.A O no hydrogen 2.857 N/A VAL 580.A N LYS 576.A O no hydrogen 2.957 N/A HIS 581.A N GLU 577.A O no hydrogen 3.117 N/A TYR 582.A N ALA 578.A O no hydrogen 3.187 N/A LEU 583.A N LEU 579.A O no hydrogen 2.796 N/A GLU 584.A N VAL 580.A O no hydrogen 3.070 N/A HIS 585.A N HIS 581.A O no hydrogen 3.108 N/A HIS 585.A NE2 LEU 387.A O no hydrogen 3.106 N/A GLN 586.A N TYR 582.A O no hydrogen 3.332 N/A GLN 586.A NE2 PRO 388.A O no hydrogen 3.284 N/A LYS 587.A N LEU 583.A O no hydrogen 2.824 N/A LYS 587.A NZ GLU 584.A OE2 no hydrogen 3.330 N/A THR 588.A N GLU 584.A O no hydrogen 2.961 N/A THR 588.A OG1 GLU 584.A O no hydrogen 2.597 N/A VAL 589.A N HIS 585.A O no hydrogen 2.696 N/A VAL 590.A N GLN 586.A O no hydrogen 2.970 N/A ARG 591.A N LYS 587.A O no hydrogen 3.231 N/A ARG 592.A N THR 588.A O no hydrogen 3.046 N/A ARG 592.A NH1 ASP 372.A OD1 no hydrogen 2.941 N/A ARG 592.A NH2 ASP 372.A OD1 no hydrogen 2.879 N/A ARG 593.A N VAL 589.A O no hydrogen 2.954 N/A THR 594.A N ARG 591.A O no hydrogen 3.046 N/A THR 594.A OG1 VAL 590.A O no hydrogen 3.132 N/A GLN 595.A N ARG 591.A O no hydrogen 3.196 N/A TYR 596.A N ARG 592.A O no hydrogen 2.960 N/A ASN 597.A ND2 ARG 593.A O no hydrogen 3.652 N/A ARG 599.A N GLN 595.A O no hydrogen 3.263 N/A LYS 602.A N LEU 598.A O no hydrogen 3.083 N/A ARG 604.A N LYS 600.A O no hydrogen 2.986 N/A ALA 605.A N ALA 601.A O no hydrogen 3.398 N/A HIS 606.A N LYS 602.A O no hydrogen 3.003 N/A ILE 607.A N ASP 603.A O no hydrogen 2.829 N/A LEU 608.A N ARG 604.A O no hydrogen 2.869 N/A GLU 609.A N ALA 605.A O no hydrogen 3.200 N/A GLY 610.A N ILE 607.A O no hydrogen 2.979 N/A LEU 611.A N ILE 607.A O no hydrogen 3.271 N/A ARG 612.A N LEU 608.A O no hydrogen 2.983 N/A ALA 614.A N GLY 610.A O no hydrogen 3.335 N/A HIS 617.A N ILE 613.A O no hydrogen 3.214 N/A ILE 621.A N HIS 617.A O no hydrogen 3.177 N/A ILE 622.A N ILE 618.A O no hydrogen 3.071 N/A SER 623.A N ASP 619.A O no hydrogen 3.505 N/A SER 623.A OG ASP 619.A O no hydrogen 2.901 N/A THR 624.A N ILE 621.A O no hydrogen 2.953 N/A THR 624.A OG1 GLU 620.A O no hydrogen 2.543 N/A ILE 625.A N ILE 621.A O no hydrogen 2.970 N/A ILE 625.A N ILE 622.A O no hydrogen 2.982 N/A ARG 626.A N ILE 622.A O no hydrogen 2.971 N/A SER 628.A OG THR 624.A O no hydrogen 3.407 N/A SER 637.A OG SER 628.A OG no hydrogen 2.981 N/A SER 637.A OG VAL 633.A O no hydrogen 3.452 N/A GLN 639.A N MET 635.A O no hydrogen 3.271 N/A GLN 640.A N GLU 636.A O no hydrogen 3.157 N/A SER 645.A N GLN 648.A OE1 no hydrogen 3.326 N/A SER 645.A OG HIS 606.A NE2 no hydrogen 3.343 N/A SER 645.A OG GLN 648.A OE1 no hydrogen 2.909 N/A GLN 648.A NE2 HIS 606.A O no hydrogen 2.721 N/A ALA 649.A N GLU 646.A O no hydrogen 3.158 N/A GLN 650.A N GLU 646.A O no hydrogen 3.184 N/A ILE 652.A N ALA 649.A O no hydrogen 3.131 N/A LEU 653.A N ALA 649.A O no hydrogen 3.084 N/A ASP 654.A N GLN 650.A O no hydrogen 2.873 N/A MET 655.A N ILE 652.A O no hydrogen 3.401 N/A LEU 660.A N LEU 657.A O no hydrogen 2.783 N/A THR 661.A OG1 ARG 658.A O no hydrogen 2.795 N/A ARG 665.A NH1 ARG 665.A O no hydrogen 2.785 N/A ARG 665.A NH2 ASP 616.A OD2 no hydrogen 3.446 N/A LYS 667.A N GLU 664.A O no hydrogen 3.266 N/A ILE 668.A N GLU 664.A O no hydrogen 3.035 N/A GLU 671.A N ILE 668.A O no hydrogen 2.973 N/A TYR 672.A N ILE 668.A O no hydrogen 2.689 N/A ASN 673.A N GLU 669.A O no hydrogen 3.265 N/A LEU 675.A N TYR 672.A O no hydrogen 3.064 N/A LEU 676.A N TYR 672.A O no hydrogen 3.194 N/A TYR 678.A N GLU 674.A O no hydrogen 3.350 N/A ILE 679.A N LEU 675.A O no hydrogen 2.668 N/A GLU 681.A N ASN 677.A O no hydrogen 3.165 N/A LEU 682.A N ILE 679.A O no hydrogen 3.016 N/A GLU 683.A N ILE 679.A O no hydrogen 3.207 N/A THR 684.A OG1 SER 680.A O no hydrogen 3.168 N/A ILE 685.A N LEU 682.A O no hydrogen 2.800 N/A LEU 686.A N LEU 682.A O no hydrogen 3.054 N/A ALA 687.A N GLU 683.A O no hydrogen 3.327 N/A VAL 691.A N ASP 688.A OD1 no hydrogen 2.762 N/A GLN 694.A N GLU 690.A O no hydrogen 2.893 N/A GLN 694.A NE2 ASP 698.A OD1 no hydrogen 3.020 N/A GLN 694.A NE2 ASP 698.A OD2 no hydrogen 3.430 N/A LEU 695.A N VAL 691.A O no hydrogen 3.079 N/A VAL 696.A N LEU 692.A O no hydrogen 2.991 N/A ARG 697.A N LEU 693.A O no hydrogen 3.237 N/A ARG 697.A NE SER 426.A OG no hydrogen 3.027 N/A ASP 698.A N GLN 694.A O no hydrogen 3.083 N/A GLU 699.A N LEU 695.A O no hydrogen 3.064 N/A LEU 700.A N VAL 696.A O no hydrogen 3.134 N/A THR 701.A N ARG 697.A O no hydrogen 3.224 N/A THR 701.A OG1 ARG 697.A O no hydrogen 2.612 N/A GLU 702.A N ASP 698.A O no hydrogen 3.370 N/A ILE 703.A N GLU 699.A O no hydrogen 2.997 N/A ARG 704.A N LEU 700.A O no hydrogen 3.213 N/A ASP 705.A N THR 701.A O no hydrogen 3.144 N/A ARG 706.A N GLU 702.A O no hydrogen 3.218 N/A PHE 707.A N ILE 703.A O no hydrogen 3.388 N/A ARG 711.A NE GLU 417.A OE2 no hydrogen 3.087 N/A ARG 711.A NH1 PRO 443.A O no hydrogen 3.000 N/A ARG 711.A NH1 THR 713.A O no hydrogen 2.731 N/A ARG 711.A NH2 GLU 417.A OE1 no hydrogen 3.013 N/A ARG 711.A NH2 GLY 442.A O no hydrogen 2.680 N/A ARG 711.A NH2 PRO 443.A O no hydrogen 3.287 N/A ARG 712.A N ASP 444.A OD1 no hydrogen 2.882 N/A ARG 712.A NH1 PRO 446.A O no hydrogen 3.434 N/A THR 713.A N ASP 444.A OD1 no hydrogen 2.929 N/A THR 713.A OG1 ASP 444.A OD1 no hydrogen 3.546 N/A THR 713.A OG1 ALA 448.A O no hydrogen 2.978 N/A GLU 714.A N GLY 449.A O no hydrogen 3.194 N/A GLN 716.A N ILE 451.A O no hydrogen 2.924 N/A