Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pjr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 1.A N GLN 4.A OE1 no hydrogen 2.996 N/A LEU 6.A N GLU 3.A O no hydrogen 2.505 N/A GLN 14.A N ASN 10.A O no hydrogen 2.879 N/A GLU 15.A N LYS 11.A O no hydrogen 2.830 N/A VAL 17.A N GLN 13.A O no hydrogen 3.150 N/A ARG 18.A N GLN 14.A O no hydrogen 2.748 N/A THR 19.A N GLU 15.A O no hydrogen 2.885 N/A THR 19.A OG1 GLU 15.A O no hydrogen 2.858 N/A THR 20.A OG1 GLU 21.A OE1 no hydrogen 2.220 N/A LEU 24.A N ILE 243.A O no hydrogen 3.092 N/A LEU 25.A N LYS 275.A O no hydrogen 3.355 N/A ILE 26.A N ALA 245.A O no hydrogen 3.006 N/A MET 27.A N ILE 277.A O no hydrogen 3.277 N/A GLY 31.A N GLY 29.A O no hydrogen 2.384 N/A SER 32.A N GLY 29.A O no hydrogen 3.221 N/A SER 32.A OG GLY 29.A O no hydrogen 2.446 N/A THR 35.A OG1 ASP 220.A OD2 no hydrogen 3.256 N/A ARG 36.A N GLY 33.A O no hydrogen 2.722 N/A ARG 36.A NH1 HIS 40.A NE2 no hydrogen 2.808 N/A VAL 37.A N GLY 33.A O no hydrogen 2.726 N/A LEU 38.A N LYS 34.A O no hydrogen 3.167 N/A THR 39.A N THR 35.A O no hydrogen 3.261 N/A THR 39.A OG1 THR 35.A O no hydrogen 3.175 N/A HIS 40.A N ARG 36.A O no hydrogen 2.919 N/A HIS 40.A ND1 LEU 5.A O no hydrogen 2.524 N/A ARG 41.A N VAL 37.A O no hydrogen 3.108 N/A ARG 41.A NE ALA 16.A O no hydrogen 3.472 N/A ARG 41.A NH2 THR 19.A O no hydrogen 2.478 N/A ILE 42.A N LEU 38.A O no hydrogen 3.120 N/A ALA 43.A N THR 39.A O no hydrogen 3.344 N/A TYR 44.A N HIS 40.A O no hydrogen 2.638 N/A LEU 45.A N ARG 41.A O no hydrogen 3.008 N/A ALA 47.A N ALA 43.A O no hydrogen 2.871 N/A GLU 48.A N TYR 44.A O no hydrogen 2.805 N/A VAL 51.A N LEU 45.A O no hydrogen 3.102 N/A ASN 55.A N PRO 53.A O no hydrogen 2.653 N/A ILE 56.A N PRO 53.A O no hydrogen 3.005 N/A LEU 57.A N TYR 216.A O no hydrogen 3.256 N/A ALA 58.A N TRP 85.A O no hydrogen 2.714 N/A ILE 59.A N HIS 218.A O no hydrogen 2.720 N/A THR 60.A N SER 87.A O no hydrogen 2.607 N/A THR 60.A OG1 THR 62.A O no hydrogen 3.025 N/A ALA 65.A N THR 62.A OG1 no hydrogen 3.108 N/A ALA 66.A N THR 62.A O no hydrogen 3.509 N/A ARG 67.A N ASN 63.A O no hydrogen 3.016 N/A GLU 68.A N LYS 64.A O no hydrogen 2.838 N/A MET 69.A N ALA 65.A O no hydrogen 2.929 N/A ARG 70.A N ALA 66.A O no hydrogen 2.996 N/A ARG 70.A NE ALA 81.A O no hydrogen 2.800 N/A ARG 70.A NH2 ALA 81.A O no hydrogen 3.149 N/A GLU 71.A N ARG 67.A O no hydrogen 3.186 N/A ARG 72.A N GLU 68.A O no hydrogen 2.746 N/A ARG 72.A NH2 GLU 68.A OE1 no hydrogen 3.425 N/A VAL 73.A N MET 69.A O no hydrogen 2.980 N/A GLN 74.A N ARG 70.A O no hydrogen 3.121 N/A GLN 74.A N GLU 71.A O no hydrogen 2.846 N/A GLN 74.A NE2 GLY 79.A O no hydrogen 2.715 N/A SER 75.A N GLU 71.A O no hydrogen 3.049 N/A SER 75.A OG ARG 72.A O no hydrogen 3.358 N/A LEU 76.A N VAL 73.A O no hydrogen 3.321 N/A LEU 77.A N VAL 73.A O no hydrogen 3.415 N/A ASP 83.A N ALA 80.A O no hydrogen 3.046 N/A TRP 85.A N ILE 56.A O no hydrogen 3.241 N/A SER 87.A N ALA 58.A O no hydrogen 2.921 N/A SER 87.A OG THR 88.A O no hydrogen 3.126 N/A THR 88.A OG1 THR 60.A O no hydrogen 3.489 N/A MET 92.A N THR 88.A O no hydrogen 3.110 N/A CYS 93.A N PHE 89.A O no hydrogen 3.091 N/A CYS 93.A SG PHE 89.A O no hydrogen 3.637 N/A CYS 93.A SG THR 196.A OG1 no hydrogen 3.662 N/A VAL 94.A N HIS 90.A O no hydrogen 2.946 N/A ARG 95.A N SER 91.A O no hydrogen 3.025 N/A ILE 96.A N MET 92.A O no hydrogen 3.199 N/A LEU 97.A N CYS 93.A O no hydrogen 2.884 N/A ARG 98.A N VAL 94.A O no hydrogen 2.966 N/A ARG 98.A NE THR 533.A OG1 no hydrogen 3.368 N/A ARG 98.A NH1 PHE 110.A O no hydrogen 2.966 N/A ARG 98.A NH2 PHE 110.A O no hydrogen 3.556 N/A ARG 98.A NH2 THR 533.A OG1 no hydrogen 3.166 N/A ARG 99.A N ILE 96.A O no hydrogen 3.327 N/A ARG 99.A NH1 TYR 209.A OH no hydrogen 3.055 N/A ASP 100.A N ILE 96.A O no hydrogen 3.160 N/A ILE 104.A N ILE 101.A O no hydrogen 3.219 N/A GLY 105.A N ASP 102.A O no hydrogen 2.341 N/A ASN 107.A N HIS 185.A ND1 no hydrogen 2.830 N/A ASN 107.A ND2 ASN 109.A OD1 no hydrogen 2.205 N/A ASN 109.A N ASN 107.A O no hydrogen 2.669 N/A PHE 110.A N ASN 107.A O no hydrogen 2.799 N/A SER 111.A N HIS 185.A O no hydrogen 2.785 N/A SER 111.A OG ASP 404.A OD2 no hydrogen 3.181 N/A LEU 113.A N LEU 187.A O no hydrogen 2.972 N/A ASP 114.A N ASP 114.A OD1 no hydrogen 2.351 N/A THR 116.A OG1 ASP 114.A OD2 no hydrogen 3.499 N/A ASP 117.A N ASP 114.A OD1 no hydrogen 3.259 N/A GLN 118.A N ASP 114.A O no hydrogen 2.919 N/A LEU 119.A N PRO 115.A O no hydrogen 3.262 N/A SER 120.A N THR 116.A O no hydrogen 3.329 N/A SER 120.A N ASP 117.A O no hydrogen 2.797 N/A VAL 121.A N ASP 117.A O no hydrogen 3.160 N/A MET 122.A N GLN 118.A O no hydrogen 2.809 N/A LYS 123.A N LEU 119.A O no hydrogen 2.992 N/A THR 124.A N MET 122.A O no hydrogen 2.798 N/A THR 124.A OG1 SER 120.A O no hydrogen 3.319 N/A ILE 125.A N VAL 121.A O no hydrogen 3.350 N/A LEU 126.A N MET 122.A O no hydrogen 3.222 N/A GLU 128.A N THR 124.A O no hydrogen 2.593 N/A LYS 129.A N ILE 125.A O no hydrogen 3.187 N/A LYS 129.A NZ ASP 172.A O no hydrogen 3.292 N/A ILE 131.A N LYS 129.A O no hydrogen 2.453 N/A ILE 141.A N GLU 137.A O no hydrogen 3.150 N/A LEU 142.A N PRO 138.A O no hydrogen 3.109 N/A LEU 142.A N ARG 139.A O no hydrogen 2.901 N/A GLY 143.A N ARG 139.A O no hydrogen 3.292 N/A THR 144.A N THR 140.A O no hydrogen 3.240 N/A THR 144.A OG1 THR 140.A O no hydrogen 2.823 N/A THR 144.A OG1 ILE 141.A O no hydrogen 3.451 N/A ILE 145.A N ILE 141.A O no hydrogen 3.355 N/A SER 146.A N LEU 142.A O no hydrogen 2.761 N/A SER 146.A OG ASP 190.A OD2 no hydrogen 3.289 N/A ALA 147.A N GLY 143.A O no hydrogen 2.809 N/A ALA 148.A N THR 144.A O no hydrogen 3.044 N/A LYS 149.A N ILE 145.A O no hydrogen 2.717 N/A LYS 149.A NZ ASP 188.A OD1 no hydrogen 2.777 N/A LYS 149.A NZ ASP 188.A OD2 no hydrogen 2.874 N/A LYS 149.A NZ ASP 191.A OD1 no hydrogen 2.946 N/A LYS 149.A NZ ASP 191.A OD2 no hydrogen 3.273 N/A GLU 151.A N ALA 147.A O no hydrogen 3.127 N/A GLU 151.A N ALA 148.A O no hydrogen 2.769 N/A LEU 152.A N LYS 149.A O no hydrogen 3.208 N/A LEU 153.A N ALA 148.A O no hydrogen 3.135 N/A PHE 158.A N PRO 155.A O no hydrogen 2.858 N/A ALA 159.A N PRO 155.A O no hydrogen 3.087 N/A ALA 159.A N GLU 156.A O no hydrogen 3.210 N/A SER 163.A OG ARG 161.A O no hydrogen 3.553 N/A SER 163.A OG GLU 167.A OE1 no hydrogen 2.322 N/A LYS 168.A N THR 164.A O no hydrogen 2.532 N/A VAL 169.A N TYR 165.A O no hydrogen 2.618 N/A VAL 170.A N TYR 166.A O no hydrogen 2.515 N/A SER 171.A N GLU 167.A O no hydrogen 2.709 N/A VAL 173.A N VAL 169.A O no hydrogen 3.412 N/A TYR 174.A N VAL 170.A O no hydrogen 2.620 N/A TYR 174.A OH LEU 153.A O no hydrogen 2.575 N/A GLN 175.A N SER 171.A O no hydrogen 2.811 N/A GLU 176.A N ASP 172.A O no hydrogen 3.429 N/A TYR 177.A N VAL 173.A O no hydrogen 2.933 N/A TYR 177.A OH ASP 188.A OD2 no hydrogen 2.579 N/A GLN 178.A N TYR 174.A O no hydrogen 3.001 N/A GLN 179.A N GLN 175.A O no hydrogen 3.046 N/A ARG 180.A N GLU 176.A O no hydrogen 2.896 N/A LEU 181.A N TYR 177.A O no hydrogen 2.985 N/A LEU 182.A N GLN 178.A O no hydrogen 2.960 N/A ARG 183.A N GLN 179.A O no hydrogen 2.966 N/A ARG 183.A NE LEU 436.A O no hydrogen 3.282 N/A ASN 184.A N LEU 181.A O no hydrogen 2.748 N/A HIS 185.A N LEU 182.A O no hydrogen 3.410 N/A SER 186.A N LEU 181.A O no hydrogen 3.195 N/A SER 186.A OG ASN 184.A O no hydrogen 2.553 N/A LEU 187.A N SER 111.A O no hydrogen 2.918 N/A ASP 188.A N ASP 191.A OD2 no hydrogen 3.100 N/A ASP 191.A N ASP 188.A O no hydrogen 3.043 N/A ASP 191.A N ASP 188.A OD1 no hydrogen 3.244 N/A ILE 193.A N ASP 190.A O no hydrogen 3.141 N/A MET 194.A N ASP 190.A O no hydrogen 3.006 N/A THR 195.A N ASP 191.A O no hydrogen 2.866 N/A THR 195.A OG1 ASP 191.A O no hydrogen 3.056 N/A THR 196.A OG1 LEU 192.A O no hydrogen 2.789 N/A ILE 197.A N ILE 193.A O no hydrogen 3.264 N/A GLN 198.A N MET 194.A O no hydrogen 2.760 N/A LEU 199.A N THR 195.A O no hydrogen 2.586 N/A PHE 200.A N THR 196.A O no hydrogen 2.915 N/A ASP 201.A N ILE 197.A O no hydrogen 2.691 N/A ARG 202.A N GLN 198.A O no hydrogen 2.911 N/A VAL 203.A N LEU 199.A O no hydrogen 2.705 N/A VAL 206.A N VAL 203.A O no hydrogen 3.066 N/A LEU 207.A N PRO 204.A O no hydrogen 2.734 N/A HIS 208.A N PRO 204.A O no hydrogen 3.016 N/A TYR 209.A N ASP 205.A O no hydrogen 2.932 N/A TYR 210.A N VAL 206.A O no hydrogen 3.379 N/A GLN 211.A N LEU 207.A O no hydrogen 3.013 N/A GLN 211.A NE2 LYS 235.A O no hydrogen 3.368 N/A GLN 211.A NE2 GLU 238.A OE2 no hydrogen 2.726 N/A TYR 212.A N HIS 208.A O no hydrogen 3.206 N/A LYS 213.A N TYR 209.A O no hydrogen 2.926 N/A LYS 213.A NZ TRP 54.A O no hydrogen 3.223 N/A PHE 214.A N TYR 210.A O no hydrogen 2.867 N/A GLN 215.A N LYS 213.A O no hydrogen 3.110 N/A TYR 216.A N ASN 55.A O no hydrogen 3.259 N/A TYR 216.A OH GLU 21.A OE2 no hydrogen 2.507 N/A HIS 218.A N LEU 57.A O no hydrogen 2.636 N/A HIS 218.A ND1 LEU 57.A O no hydrogen 2.952 N/A ILE 219.A N CYS 244.A O no hydrogen 3.238 N/A ASP 220.A N ILE 59.A O no hydrogen 3.281 N/A GLU 221.A N ASP 220.A OD1 no hydrogen 2.442 N/A TYR 222.A N VAL 246.A O no hydrogen 3.070 N/A TYR 222.A OH ASN 263.A O no hydrogen 3.207 N/A ASP 224.A N GLU 221.A O no hydrogen 3.305 N/A THR 225.A OG1 TYR 222.A O no hydrogen 3.430 N/A ASN 226.A ND2 GLN 229.A OE1 no hydrogen 3.329 N/A ARG 227.A NH1 GLU 151.A OE2 no hydrogen 2.577 N/A ARG 227.A NH2 GLU 151.A OE2 no hydrogen 2.914 N/A ALA 228.A N ASN 150.A O no hydrogen 3.002 N/A TYR 230.A N ASN 226.A O no hydrogen 3.355 N/A THR 231.A N ARG 227.A O no hydrogen 3.224 N/A THR 231.A OG1 ARG 227.A O no hydrogen 3.265 N/A LEU 232.A N ALA 228.A O no hydrogen 2.905 N/A VAL 233.A N GLN 229.A O no hydrogen 2.945 N/A LYS 234.A N TYR 230.A O no hydrogen 2.875 N/A LYS 235.A N THR 231.A O no hydrogen 3.094 N/A LEU 236.A N LEU 232.A O no hydrogen 3.135 N/A ALA 237.A N VAL 233.A O no hydrogen 2.987 N/A GLU 238.A N LYS 235.A O no hydrogen 3.009 N/A GLN 241.A N ALA 237.A O no hydrogen 3.096 N/A CYS 244.A N ILE 217.A O no hydrogen 2.985 N/A VAL 246.A N ILE 219.A O no hydrogen 2.951 N/A GLY 247.A N ILE 26.A O no hydrogen 3.149 N/A ASP 248.A N GLN 223.A OE1 no hydrogen 3.249 N/A ASP 250.A N ASP 248.A OD1 no hydrogen 2.584 N/A GLN 251.A N ASP 248.A O no hydrogen 2.586 N/A GLN 251.A NE2 ASP 248.A OD2 no hydrogen 3.132 N/A SER 252.A OG ASP 224.A OD1 no hydrogen 3.177 N/A ILE 253.A N ASP 224.A OD2 no hydrogen 3.024 N/A TYR 254.A N ASP 224.A OD1 no hydrogen 2.916 N/A TRP 256.A NE1 ILE 253.A O no hydrogen 3.223 N/A ARG 257.A N TYR 254.A O no hydrogen 3.118 N/A GLY 258.A N ARG 255.A O no hydrogen 3.157 N/A ALA 259.A N TYR 254.A O no hydrogen 3.087 N/A ASP 260.A N THR 225.A O no hydrogen 2.728 N/A ASN 263.A ND2 ASN 226.A O no hydrogen 3.562 N/A LEU 265.A N GLN 262.A O no hydrogen 2.737 N/A SER 266.A OG ASP 270.A OD2 no hydrogen 3.359 N/A PHE 267.A N ASN 263.A O no hydrogen 3.303 N/A GLU 268.A N LEU 265.A O no hydrogen 3.464 N/A TYR 271.A N PHE 267.A O no hydrogen 2.938 N/A ASN 273.A ND2 GLN 241.A OE1 no hydrogen 3.674 N/A ALA 274.A N TYR 271.A O no hydrogen 3.074 N/A LYS 275.A N PRO 23.A O no hydrogen 3.209 N/A ILE 277.A N LEU 25.A O no hydrogen 2.933 N/A ASN 282.A N TRP 309.A O no hydrogen 2.822 N/A TYR 283.A N GLY 31.A O no hydrogen 3.395 N/A ARG 284.A N ASN 282.A OD1 no hydrogen 2.538 N/A ARG 284.A NE GLU 565.A OE1 no hydrogen 2.791 N/A ARG 284.A NH1 THR 603.A O no hydrogen 3.424 N/A ARG 284.A NH2 GLY 563.A O no hydrogen 3.348 N/A SER 285.A N ASN 282.A OD1 no hydrogen 3.077 N/A SER 285.A OG ALA 605.A O no hydrogen 2.370 N/A THR 286.A OG1 PRO 313.A O no hydrogen 3.112 N/A LYS 287.A N ASN 312.A O no hydrogen 3.366 N/A LYS 287.A N PRO 313.A O no hydrogen 3.023 N/A LEU 290.A N THR 286.A O no hydrogen 2.810 N/A ALA 292.A N ARG 288.A O no hydrogen 3.353 N/A ALA 293.A N ILE 289.A O no hydrogen 3.112 N/A ASN 294.A N LEU 290.A O no hydrogen 2.766 N/A ASN 294.A ND2 ILE 308.A O no hydrogen 3.286 N/A GLU 295.A N GLN 291.A O no hydrogen 2.817 N/A VAL 296.A N ALA 292.A O no hydrogen 3.145 N/A ILE 297.A N ALA 293.A O no hydrogen 3.062 N/A ILE 297.A N ASN 294.A O no hydrogen 3.210 N/A GLU 298.A N GLU 295.A O no hydrogen 3.116 N/A HIS 299.A ND1 GLU 634.A OE2 no hydrogen 2.575 N/A ARG 303.A NE ILE 297.A O no hydrogen 2.842 N/A LYS 306.A NZ ALA 28.A O no hydrogen 2.700 N/A LYS 306.A NZ ASP 248.A OD2 no hydrogen 3.189 N/A TRP 309.A N GLU 280.A O no hydrogen 2.707 N/A ILE 318.A N LEU 639.A O no hydrogen 3.174 N/A ALA 323.A N SER 613.A O no hydrogen 3.008 N/A ALA 330.A N GLU 326.A O no hydrogen 2.576 N/A GLN 331.A N ALA 327.A O no hydrogen 2.632 N/A PHE 332.A N ASP 328.A O no hydrogen 2.532 N/A VAL 333.A N GLU 329.A O no hydrogen 3.207 N/A GLY 335.A N GLN 331.A O no hydrogen 3.294 N/A ARG 336.A N PHE 332.A O no hydrogen 2.876 N/A ARG 336.A NH1 GLU 608.A OE2 no hydrogen 3.354 N/A ILE 337.A N VAL 333.A O no hydrogen 2.753 N/A ARG 338.A N ALA 334.A O no hydrogen 2.704 N/A GLU 339.A N GLY 335.A O no hydrogen 2.489 N/A ALA 340.A N ARG 336.A O no hydrogen 3.209 N/A VAL 341.A N ILE 337.A O no hydrogen 2.921 N/A GLU 342.A N ARG 338.A O no hydrogen 3.225 N/A GLU 342.A N GLU 339.A O no hydrogen 3.344 N/A ARG 347.A N ASP 350.A OD2 no hydrogen 2.630 N/A ASP 350.A N ARG 347.A O no hydrogen 3.444 N/A VAL 353.A N MET 554.A O no hydrogen 2.872 N/A LEU 354.A N PHE 570.A O no hydrogen 3.128 N/A TYR 355.A N MET 556.A O no hydrogen 3.121 N/A ARG 356.A NH1 GLU 594.A OE1 no hydrogen 2.583 N/A ARG 356.A NH1 GLU 594.A OE2 no hydrogen 2.569 N/A ARG 356.A NH2 GLU 594.A OE2 no hydrogen 2.541 N/A THR 357.A OG1 ALA 359.A O no hydrogen 3.501 N/A GLN 360.A N ASN 358.A O no hydrogen 2.637 N/A GLN 360.A NE2 ILE 572.A O no hydrogen 3.583 N/A SER 361.A N ASN 358.A O no hydrogen 2.757 N/A SER 361.A OG ASN 358.A O no hydrogen 3.120 N/A GLU 365.A N SER 361.A O no hydrogen 3.163 N/A GLU 365.A N ARG 362.A O no hydrogen 2.548 N/A GLU 366.A N ARG 362.A O no hydrogen 2.874 N/A MET 367.A N VAL 363.A O no hydrogen 2.722 N/A LEU 368.A N GLU 365.A O no hydrogen 2.873 N/A LEU 369.A N GLU 365.A O no hydrogen 3.152 N/A LEU 369.A N GLU 366.A O no hydrogen 3.087 N/A LYS 370.A N GLU 366.A O no hydrogen 3.397 N/A ALA 371.A N MET 367.A O no hydrogen 2.956 N/A ASN 372.A N LEU 369.A O no hydrogen 2.547 N/A ILE 373.A N LEU 368.A O no hydrogen 2.883 N/A TYR 375.A OH GLU 365.A OE1 no hydrogen 2.171 N/A GLN 376.A N VAL 553.A O no hydrogen 2.825 N/A ARG 386.A NH1 GLU 388.A OE2 no hydrogen 2.597 N/A LYS 387.A NZ ASP 391.A OD2 no hydrogen 3.553 N/A LYS 390.A N ARG 386.A O no hydrogen 2.566 N/A LYS 390.A NZ ASP 385.A O no hydrogen 3.283 N/A LYS 390.A NZ ASP 385.A OD2 no hydrogen 2.727 N/A ASP 391.A N LYS 387.A O no hydrogen 2.810 N/A ILE 392.A N GLU 388.A O no hydrogen 3.385 N/A LEU 393.A N ILE 389.A O no hydrogen 3.282 N/A TYR 395.A N ASP 391.A O no hydrogen 3.438 N/A LEU 396.A N ILE 392.A O no hydrogen 2.940 N/A ARG 397.A N LEU 393.A O no hydrogen 2.648 N/A ARG 397.A NH1 ASP 404.A OD2 no hydrogen 3.345 N/A ARG 397.A NH2 ASP 117.A OD2 no hydrogen 3.219 N/A VAL 398.A N ALA 394.A O no hydrogen 2.909 N/A ILE 399.A N TYR 395.A O no hydrogen 2.785 N/A ALA 400.A N LEU 396.A O no hydrogen 2.938 N/A ASN 401.A N ARG 397.A O no hydrogen 2.698 N/A ASN 401.A ND2 SER 111.A OG no hydrogen 2.974 N/A ASN 401.A ND2 ASN 184.A O no hydrogen 3.356 N/A ASP 403.A N ASN 401.A OD1 no hydrogen 3.243 N/A ASP 404.A N ASN 401.A O no hydrogen 2.988 N/A SER 407.A N ASP 404.A OD1 no hydrogen 3.493 N/A SER 407.A OG ASP 404.A OD2 no hydrogen 2.442 N/A LEU 408.A N ASP 404.A O no hydrogen 3.081 N/A LEU 409.A N ASP 405.A O no hydrogen 2.976 N/A ARG 410.A N LEU 406.A O no hydrogen 3.474 N/A ARG 410.A NH1 ASP 391.A OD1 no hydrogen 2.517 N/A ILE 412.A N LEU 408.A O no hydrogen 2.878 N/A VAL 414.A N ILE 411.A O no hydrogen 2.926 N/A ARG 417.A N ASN 413.A OD1 no hydrogen 2.817 N/A ARG 417.A NH1 ILE 412.A O no hydrogen 3.233 N/A THR 423.A OG1 GLY 420.A O no hydrogen 3.533 N/A ILE 424.A N GLY 420.A O no hydrogen 3.214 N/A ASP 425.A N ALA 421.A O no hydrogen 3.145 N/A LYS 426.A N SER 422.A O no hydrogen 2.576 N/A LYS 426.A NZ GLY 449.A O no hydrogen 2.436 N/A LEU 427.A N THR 423.A O no hydrogen 2.458 N/A VAL 428.A N ILE 424.A O no hydrogen 2.550 N/A ARG 429.A N ASP 425.A O no hydrogen 2.764 N/A TYR 430.A N LEU 427.A O no hydrogen 2.866 N/A ALA 431.A N VAL 428.A O no hydrogen 3.452 N/A ALA 432.A N TYR 430.A O no hydrogen 2.164 N/A ASP 433.A N TYR 430.A O no hydrogen 2.687 N/A SER 437.A OG ASP 403.A O no hydrogen 3.488 N/A SER 437.A OG ASP 405.A OD1 no hydrogen 2.334 N/A SER 437.A OG ASP 405.A OD2 no hydrogen 2.640 N/A LEU 438.A N ASP 405.A OD1 no hydrogen 3.036 N/A ALA 441.A N SER 437.A O no hydrogen 3.155 N/A LEU 442.A N LEU 438.A O no hydrogen 2.658 N/A GLY 443.A N GLU 440.A O no hydrogen 2.501 N/A GLU 444.A N GLU 440.A O no hydrogen 3.329 N/A GLU 444.A N ALA 441.A O no hydrogen 2.548 N/A ILE 448.A N LEU 445.A O no hydrogen 2.963 N/A ALA 454.A N GLY 451.A O no hydrogen 2.618 N/A GLY 456.A N ALA 452.A O no hydrogen 2.528 N/A LEU 458.A N ALA 454.A O no hydrogen 2.535 N/A ALA 460.A N GLY 456.A O no hydrogen 3.004 N/A PHE 461.A N ALA 457.A O no hydrogen 3.039 N/A ARG 462.A N LEU 458.A O no hydrogen 2.890 N/A SER 463.A N ALA 459.A O no hydrogen 3.036 N/A SER 463.A OG ALA 459.A O no hydrogen 3.462 N/A GLN 464.A N ALA 460.A O no hydrogen 2.967 N/A LEU 465.A N PHE 461.A O no hydrogen 3.123 N/A GLU 466.A N ARG 462.A O no hydrogen 3.113 N/A GLN 467.A N SER 463.A O no hydrogen 3.022 N/A TRP 468.A N GLN 464.A O no hydrogen 3.204 N/A THR 469.A N LEU 465.A O no hydrogen 2.772 N/A THR 469.A OG1 LEU 465.A O no hydrogen 2.953 N/A GLN 470.A N GLU 466.A O no hydrogen 3.264 N/A GLN 470.A N GLN 467.A O no hydrogen 3.293 N/A LEU 471.A N GLN 467.A O no hydrogen 3.098 N/A GLN 472.A N TRP 468.A O no hydrogen 2.858 N/A GLU 473.A N GLN 470.A O no hydrogen 3.279 N/A TYR 474.A N LEU 471.A O no hydrogen 2.805 N/A SER 476.A N GLU 479.A OE2 no hydrogen 3.458 N/A SER 476.A OG GLU 479.A OE2 no hydrogen 3.041 N/A SER 476.A OG GLU 520.A OE2 no hydrogen 3.201 N/A THR 478.A OG1 THR 516.A OG1 no hydrogen 2.662 N/A THR 478.A OG1 GLU 520.A OE1 no hydrogen 2.983 N/A LEU 480.A N SER 476.A O no hydrogen 2.949 N/A VAL 481.A N VAL 477.A O no hydrogen 2.820 N/A GLU 482.A N THR 478.A O no hydrogen 2.845 N/A GLU 483.A N GLU 479.A O no hydrogen 3.222 N/A GLU 483.A N LEU 480.A O no hydrogen 2.778 N/A VAL 484.A N LEU 480.A O no hydrogen 3.095 N/A LEU 485.A N VAL 481.A O no hydrogen 2.957 N/A LYS 487.A N GLU 483.A O no hydrogen 2.807 N/A SER 488.A N VAL 484.A O no hydrogen 2.961 N/A SER 488.A OG VAL 484.A O no hydrogen 2.491 N/A GLY 489.A N ASP 486.A O no hydrogen 2.651 N/A TYR 490.A N SER 488.A OG no hydrogen 3.005 N/A TYR 490.A OH ASP 391.A OD2 no hydrogen 2.328 N/A MET 493.A N GLY 489.A O no hydrogen 3.309 N/A LYS 495.A N ARG 491.A O no hydrogen 2.976 N/A ALA 496.A N GLU 492.A O no hydrogen 2.718 N/A LEU 506.A N ALA 502.A O no hydrogen 2.728 N/A GLU 507.A N SER 504.A O no hydrogen 2.753 N/A ASN 508.A N SER 504.A O no hydrogen 3.085 N/A LEU 509.A N ARG 505.A O no hydrogen 3.102 N/A GLU 511.A N GLU 507.A O no hydrogen 3.037 N/A PHE 512.A N ASN 508.A O no hydrogen 2.771 N/A LEU 513.A N LEU 509.A O no hydrogen 2.905 N/A LEU 513.A N ASP 510.A O no hydrogen 2.984 N/A SER 514.A N ASP 510.A O no hydrogen 3.288 N/A SER 514.A N GLU 511.A O no hydrogen 3.058 N/A VAL 515.A N GLU 511.A O no hydrogen 3.154 N/A THR 516.A N PHE 512.A O no hydrogen 3.240 N/A THR 516.A OG1 THR 478.A OG1 no hydrogen 2.662 N/A THR 516.A OG1 LEU 513.A O no hydrogen 3.377 N/A LYS 517.A N LEU 513.A O no hydrogen 3.078 N/A HIS 518.A N SER 514.A O no hydrogen 2.737 N/A PHE 519.A N VAL 515.A O no hydrogen 3.222 N/A GLU 520.A N THR 516.A O no hydrogen 3.134 N/A ASN 521.A N HIS 518.A O no hydrogen 2.288 N/A ASN 521.A ND2 ASN 521.A O no hydrogen 2.712 N/A VAL 522.A N PHE 519.A O no hydrogen 3.120 N/A SER 523.A OG ASP 524.A O no hydrogen 2.551 N/A SER 523.A OG ASP 525.A O no hydrogen 2.830 N/A LYS 526.A NZ GLU 520.A O no hydrogen 2.589 N/A LYS 526.A NZ SER 523.A O no hydrogen 2.580 N/A PHE 531.A N SER 527.A O no hydrogen 3.181 N/A LEU 532.A N LEU 528.A O no hydrogen 2.902 N/A THR 533.A N ILE 529.A O no hydrogen 2.594 N/A THR 533.A OG1 ILE 529.A O no hydrogen 2.529 N/A ASP 534.A N ALA 530.A O no hydrogen 3.199 N/A ALA 536.A N LEU 532.A O no hydrogen 3.201 N/A LEU 537.A N ASP 534.A O no hydrogen 2.877 N/A SER 539.A OG LEU 541.A O no hydrogen 2.392 N/A ASP 540.A N LEU 541.A O no hydrogen 3.084 N/A GLU 543.A N ASP 542.A OD1 no hydrogen 2.593 N/A ALA 552.A N ASP 551.A OD1 no hydrogen 2.253 N/A VAL 553.A N PRO 374.A O no hydrogen 3.240 N/A MET 554.A N PHE 351.A O no hydrogen 3.419 N/A LEU 555.A N GLN 376.A O no hydrogen 3.355 N/A MET 556.A N VAL 353.A O no hydrogen 2.900 N/A THR 557.A OG1 TYR 355.A O no hydrogen 3.424 N/A LEU 558.A N TYR 355.A O no hydrogen 2.914 N/A HIS 559.A NE2 ILE 253.A O no hydrogen 2.949 N/A ALA 561.A N LEU 558.A O no hydrogen 2.949 N/A LYS 562.A N HIS 559.A O no hydrogen 3.391 N/A LYS 562.A NZ GLU 221.A OE1 no hydrogen 2.959 N/A LYS 562.A NZ ASP 224.A OD2 no hydrogen 3.285 N/A PHE 566.A N ARG 604.A O no hydrogen 3.438 N/A VAL 568.A N ASP 350.A O no hydrogen 3.156 N/A VAL 569.A N GLU 608.A O no hydrogen 3.231 N/A PHE 570.A N ALA 352.A O no hydrogen 2.929 N/A LEU 571.A N VAL 610.A O no hydrogen 3.062 N/A GLY 573.A N GLU 329.A OE2 no hydrogen 2.695 N/A MET 574.A N THR 612.A O no hydrogen 3.254 N/A GLY 577.A N PRO 580.A O no hydrogen 3.075 N/A HIS 581.A N GLU 594.A OE1 no hydrogen 3.391 N/A SER 584.A N HIS 581.A O no hydrogen 2.564 N/A MET 591.A N ASP 588.A O no hydrogen 3.146 N/A GLU 592.A N ASP 588.A O no hydrogen 3.392 N/A ARG 595.A N MET 591.A O no hydrogen 3.220 N/A ARG 595.A N GLU 592.A O no hydrogen 2.832 N/A ARG 595.A NH1 GLU 634.A OE1 no hydrogen 3.519 N/A ARG 596.A N GLU 592.A O no hydrogen 3.062 N/A ARG 596.A NH1 SER 252.A O no hydrogen 3.350 N/A LEU 597.A N GLU 593.A O no hydrogen 2.962 N/A ALA 598.A N GLU 594.A O no hydrogen 3.175 N/A TYR 599.A N ARG 595.A O no hydrogen 2.613 N/A VAL 600.A N ARG 596.A O no hydrogen 2.891 N/A GLY 601.A N LEU 597.A O no hydrogen 3.471 N/A ILE 602.A N ALA 598.A O no hydrogen 2.993 N/A THR 603.A OG1 ALA 30.A O no hydrogen 3.431 N/A ARG 604.A N GLY 601.A O no hydrogen 2.903 N/A ARG 604.A NE LEU 564.A O no hydrogen 3.062 N/A ARG 604.A NH1 GLN 251.A OE1 no hydrogen 2.972 N/A ARG 604.A NH1 VAL 600.A O no hydrogen 3.228 N/A GLU 606.A N PHE 566.A O no hydrogen 3.146 N/A GLU 607.A N PRO 567.A O no hydrogen 2.977 N/A GLU 608.A N PRO 567.A O no hydrogen 3.166 N/A VAL 610.A N VAL 569.A O no hydrogen 3.143 N/A LEU 611.A N LEU 319.A O no hydrogen 3.213 N/A THR 612.A OG1 GLU 329.A OE2 no hydrogen 2.319 N/A SER 613.A N TYR 321.A O no hydrogen 2.939 N/A GLN 615.A N ALA 323.A O no hydrogen 2.978 N/A MET 616.A N MET 324.A O no hydrogen 3.295 N/A ARG 617.A N GLN 624.A O no hydrogen 2.843 N/A ARG 617.A NH1 GLU 329.A OE1 no hydrogen 2.469 N/A ARG 617.A NH1 GLU 575.A OE2 no hydrogen 2.556 N/A THR 618.A N GLU 326.A OE1 no hydrogen 2.533 N/A THR 618.A N GLU 326.A OE2 no hydrogen 2.937 N/A THR 618.A OG1 GLU 326.A OE2 no hydrogen 2.737 N/A LEU 619.A N ASN 622.A O no hydrogen 3.164 N/A ASN 622.A N LEU 619.A O no hydrogen 2.624 N/A GLN 624.A N ARG 617.A O no hydrogen 3.127 N/A SER 629.A N MET 574.A O no hydrogen 3.444 N/A ARG 630.A N GLU 576.A OE2 no hydrogen 3.040 N/A ARG 630.A NE GLU 576.A OE1 no hydrogen 3.175 N/A ARG 630.A NE GLU 576.A OE2 no hydrogen 2.176 N/A ARG 630.A NH2 GLU 576.A OE1 no hydrogen 2.937 N/A PHE 631.A N SER 629.A OG no hydrogen 3.115 N/A LEU 632.A N SER 629.A O no hydrogen 2.687 N/A GLU 634.A N ARG 630.A O no hydrogen 3.021 N/A ILE 635.A N LEU 632.A O no hydrogen 2.593 N/A LEU 639.A N PRO 636.A O no hydrogen 2.404 N/A LEU 640.A N PRO 636.A O no hydrogen 3.353 N/A