Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6msl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N ASN 2.A OD1 no hydrogen 3.313 N/A ASN 2.A N ASN 2.A OD1 no hydrogen 2.461 N/A ASN 2.A ND2 LEU 350.A O no hydrogen 2.486 N/A ASN 2.A ND2 ARG 438.A O no hydrogen 3.285 N/A LEU 3.A N GLN 389.A OE1 no hydrogen 3.072 N/A ASP 4.A N ARG 436.A O no hydrogen 2.798 N/A SER 7.A N ASP 4.A OD1 no hydrogen 2.679 N/A SER 7.A OG ASP 4.A OD1 no hydrogen 2.872 N/A SER 7.A OG SER 7.A O no hydrogen 2.524 N/A ALA 9.A N LEU 434.A O no hydrogen 3.225 N/A TYR 11.A N ALA 432.A O no hydrogen 2.866 N/A GLY 13.A N ASP 430.A O no hydrogen 3.120 N/A GLY 16.A N ASP 430.A OD2 no hydrogen 2.475 N/A SER 17.A OG PRO 14.A O no hydrogen 2.873 N/A PHE 19.A N SER 17.A OG no hydrogen 3.321 N/A GLY 20.A N GLY 39.A O no hydrogen 3.131 N/A PHE 21.A N TYR 18.A O no hydrogen 3.016 N/A ASP 24.A N LEU 37.A O no hydrogen 2.924 N/A PHE 25.A N ASP 24.A OD1 no hydrogen 2.388 N/A PHE 26.A N PHE 35.A O no hydrogen 2.892 N/A SER 29.A N ASP 103.A OD2 no hydrogen 3.290 N/A SER 29.A OG ASP 103.A OD2 no hydrogen 2.310 N/A ARG 33.A N SER 31.A OG no hydrogen 3.319 N/A PHE 35.A N PHE 26.A O no hydrogen 2.979 N/A LEU 36.A N CYS 59.A O no hydrogen 3.159 N/A LEU 37.A N ASP 24.A O no hydrogen 2.884 N/A VAL 38.A N LEU 57.A O no hydrogen 2.939 N/A GLY 39.A N ALA 22.A O no hydrogen 2.880 N/A ALA 40.A N GLN 55.A O no hydrogen 3.053 N/A LYS 42.A N SER 17.A O no hydrogen 3.152 N/A LYS 42.A NZ GLU 52.A OE1 no hydrogen 2.438 N/A ALA 43.A N ALA 40.A O no hydrogen 2.809 N/A THR 45.A OG1 GLN 47.A OE1 no hydrogen 3.379 N/A GLN 47.A NE2 THR 75.A O no hydrogen 2.758 N/A ILE 50.A N GLN 47.A O no hydrogen 3.296 N/A GLU 52.A N ASN 44.A OD1 no hydrogen 2.749 N/A GLY 54.A N ALA 43.A O no hydrogen 2.649 N/A GLN 55.A N ALA 40.A O no hydrogen 3.283 N/A GLN 55.A NE2 ASN 44.A O no hydrogen 2.400 N/A LEU 57.A N VAL 38.A O no hydrogen 2.938 N/A LYS 58.A N GLN 68.A O no hydrogen 3.048 N/A CYS 59.A N LEU 36.A O no hydrogen 2.767 N/A ASP 60.A N ARG 66.A O no hydrogen 2.778 N/A THR 64.A OG1 SER 63.A O no hydrogen 2.371 N/A ARG 65.A NH2 TRP 61.A O no hydrogen 3.236 N/A ARG 66.A NE THR 64.A OG1 no hydrogen 2.610 N/A GLN 68.A N LYS 58.A O no hydrogen 2.993 N/A ILE 70.A N VAL 56.A O no hydrogen 2.829 N/A THR 75.A OG1 ASP 73.A OD1 no hydrogen 3.161 N/A THR 75.A OG1 ASP 73.A OD2 no hydrogen 3.327 N/A THR 75.A OG1 GLY 76.A O no hydrogen 3.135 N/A ARG 78.A N GLU 87.A OE1 no hydrogen 3.098 N/A ARG 78.A NE GLU 87.A OE1 no hydrogen 2.929 N/A ARG 78.A NH2 GLU 87.A OE2 no hydrogen 3.388 N/A ARG 78.A NH2 GLU 138.A OE1 no hydrogen 2.748 N/A TYR 80.A N ASP 84.A O no hydrogen 2.905 N/A TYR 80.A OH GLU 117.A O no hydrogen 3.377 N/A LEU 86.A N ARG 78.A O no hydrogen 2.769 N/A PHE 88.A N HIS 113.A O no hydrogen 3.036 N/A LYS 89.A N ASN 77.A OD1 no hydrogen 2.917 N/A LYS 89.A NZ ASP 73.A OD2 no hydrogen 3.032 N/A LYS 89.A NZ THR 75.A O no hydrogen 3.383 N/A LYS 89.A NZ GLY 76.A O no hydrogen 2.429 N/A LYS 89.A NZ GLU 87.A OE1 no hydrogen 3.481 N/A SER 90.A OG GLY 49.A O no hydrogen 3.382 N/A HIS 91.A N VAL 51.A O no hydrogen 3.001 N/A GLN 92.A NE2 GLY 53.A O no hydrogen 3.592 N/A PHE 94.A N GLY 53.A O no hydrogen 3.377 N/A GLY 95.A N CYS 108.A O no hydrogen 2.666 N/A ALA 96.A N TRP 93.A O no hydrogen 3.387 N/A SER 97.A OG GLY 158.A O no hydrogen 2.283 N/A SER 97.A OG PHE 159.A O no hydrogen 3.227 N/A ARG 99.A N LEU 106.A O no hydrogen 2.943 N/A ARG 99.A NE VAL 98.A O no hydrogen 3.103 N/A ARG 99.A NH1 ASP 162.A OD1 no hydrogen 3.494 N/A SER 100.A N ASP 24.A OD2 no hydrogen 3.274 N/A SER 100.A OG PHE 25.A O no hydrogen 3.193 N/A SER 100.A OG LYS 101.A O no hydrogen 2.817 N/A LYS 104.A NZ ASP 132.A OD2 no hydrogen 2.389 N/A ILE 105.A N GLN 131.A O no hydrogen 2.884 N/A LEU 106.A N ARG 99.A O no hydrogen 2.881 N/A ALA 107.A N PHE 129.A O no hydrogen 3.023 N/A CYS 108.A N SER 97.A O no hydrogen 3.219 N/A ALA 109.A N THR 127.A O no hydrogen 2.757 N/A LEU 111.A N GLN 92.A O no hydrogen 3.022 N/A TYR 112.A N ALA 109.A O no hydrogen 3.166 N/A TYR 112.A OH GLU 87.A OE2 no hydrogen 2.402 N/A HIS 113.A N PHE 88.A O no hydrogen 3.214 N/A ARG 115.A N LEU 86.A O no hydrogen 2.691 N/A ARG 115.A NE ASP 84.A OD2 no hydrogen 2.690 N/A ARG 115.A NH1 THR 116.A O no hydrogen 2.438 N/A THR 116.A OG1 LYS 119.A O no hydrogen 2.731 N/A GLU 123.A N TRP 114.A O no hydrogen 2.796 N/A VAL 125.A N GLU 123.A O no hydrogen 2.799 N/A GLY 126.A N TYR 112.A O no hydrogen 3.113 N/A THR 127.A N ALA 109.A O no hydrogen 3.226 N/A THR 127.A OG1 CYS 128.A O no hydrogen 3.319 N/A THR 127.A OG1 GLU 138.A OE2 no hydrogen 2.879 N/A PHE 129.A N ALA 107.A O no hydrogen 2.716 N/A LEU 130.A N VAL 137.A O no hydrogen 3.253 N/A GLN 131.A N ILE 105.A O no hydrogen 3.017 N/A ASP 132.A N LYS 135.A O no hydrogen 2.975 N/A THR 134.A N ASP 132.A O no hydrogen 2.944 N/A THR 136.A OG1 GLN 131.A OE1 no hydrogen 3.470 N/A VAL 137.A N LEU 130.A O no hydrogen 3.051 N/A TYR 139.A N CYS 128.A O no hydrogen 3.266 N/A TYR 139.A OH ASP 186.A OD2 no hydrogen 2.839 N/A CYS 142.A SG GLN 182.A OE1 no hydrogen 3.908 N/A ARG 143.A N ALA 140.A O no hydrogen 2.847 N/A ARG 143.A NE TYR 200.A O no hydrogen 2.907 N/A ARG 143.A NH1 TYR 112.A OH no hydrogen 3.236 N/A ARG 143.A NH1 GLU 138.A OE1 no hydrogen 3.526 N/A ARG 143.A NH1 GLU 138.A OE2 no hydrogen 3.338 N/A ARG 143.A NH2 GLU 138.A OE1 no hydrogen 3.390 N/A ARG 143.A NH2 TYR 200.A O no hydrogen 2.910 N/A SER 144.A OG GLN 152.A OE1 no hydrogen 2.582 N/A GLN 152.A N ASP 146.A O no hydrogen 3.095 N/A GLN 152.A NE2 GLN 182.A OE1 no hydrogen 2.543 N/A GLY 153.A N ASP 148.A O no hydrogen 2.851 N/A CYS 155.A N GLN 152.A O no hydrogen 3.023 N/A GLN 156.A N PRO 124.A O no hydrogen 3.019 N/A GLY 157.A N VAL 125.A O no hydrogen 2.820 N/A GLY 158.A N GLY 172.A O no hydrogen 3.067 N/A PHE 159.A N GLN 156.A O no hydrogen 3.324 N/A SER 160.A OG GLY 223.A O no hydrogen 2.985 N/A ASP 162.A N LEU 170.A O no hydrogen 2.878 N/A PHE 163.A N ASP 162.A OD1 no hydrogen 3.028 N/A THR 164.A N ARG 168.A O no hydrogen 2.768 N/A THR 164.A OG1 ARG 168.A O no hydrogen 3.489 N/A ARG 168.A N THR 164.A OG1 no hydrogen 3.128 N/A ARG 168.A NH1 ASN 206.A O no hydrogen 3.277 N/A ARG 168.A NH2 ASN 206.A O no hydrogen 2.685 N/A VAL 169.A N ASP 186.A O no hydrogen 2.788 N/A LEU 170.A N ASP 162.A O no hydrogen 2.745 N/A LEU 171.A N ILE 184.A O no hydrogen 2.860 N/A GLY 172.A N SER 160.A O no hydrogen 2.825 N/A GLY 173.A N GLN 182.A O no hydrogen 2.970 N/A GLY 175.A N CYS 155.A O no hydrogen 3.087 N/A SER 176.A OG GLN 182.A OE1 no hydrogen 2.896 N/A PHE 177.A N GLY 151.A O no hydrogen 2.656 N/A TYR 178.A N ALA 149.A O no hydrogen 2.727 N/A TRP 179.A N GLY 175.A O no hydrogen 3.383 N/A GLN 180.A N PHE 177.A O no hydrogen 3.015 N/A GLN 180.A NE2 ALA 213.A O no hydrogen 3.161 N/A GLN 180.A NE2 ASP 218.A OD1 no hydrogen 2.792 N/A GLY 181.A N SER 176.A O no hydrogen 3.103 N/A GLN 182.A N LEU 222.A O no hydrogen 3.280 N/A GLN 182.A NE2 THR 210.A O no hydrogen 3.122 N/A LEU 183.A N THR 210.A OG1 no hydrogen 3.222 N/A ILE 184.A N LEU 171.A O no hydrogen 2.892 N/A SER 185.A N LEU 208.A O no hydrogen 2.739 N/A SER 185.A OG VAL 169.A O no hydrogen 2.859 N/A ASP 186.A N VAL 169.A O no hydrogen 3.071 N/A VAL 188.A N ASP 167.A O no hydrogen 2.892 N/A ILE 191.A N GLN 187.A O no hydrogen 3.266 N/A VAL 192.A N VAL 188.A O no hydrogen 3.241 N/A SER 193.A N ALA 189.A O no hydrogen 2.802 N/A SER 193.A OG ALA 189.A O no hydrogen 3.303 N/A LYS 194.A N GLU 190.A O no hydrogen 2.984 N/A TYR 195.A N VAL 192.A O no hydrogen 3.392 N/A VAL 199.A N ASP 196.A O no hydrogen 2.832 N/A SER 201.A OG ARG 143.A O no hydrogen 2.630 N/A ASN 205.A N GLU 190.A OE1 no hydrogen 3.281 N/A GLN 207.A NE2 ASP 186.A OD2 no hydrogen 2.842 N/A LEU 208.A N SER 185.A O no hydrogen 2.962 N/A THR 210.A N LEU 183.A O no hydrogen 3.050 N/A THR 212.A OG1 ALA 213.A O no hydrogen 3.273 N/A ALA 213.A N GLN 180.A OE1 no hydrogen 2.776 N/A GLN 214.A N GLN 214.A OE1 no hydrogen 2.601 N/A PHE 217.A N GLN 214.A O no hydrogen 3.119 N/A ASP 218.A N ALA 215.A O no hydrogen 3.213 N/A ASP 219.A N TYR 178.A O no hydrogen 2.934 N/A SER 220.A N TRP 179.A O no hydrogen 2.766 N/A SER 220.A OG PHE 217.A O no hydrogen 2.754 N/A TYR 221.A N TRP 179.A O no hydrogen 3.026 N/A LEU 222.A N GLN 180.A O no hydrogen 3.160 N/A TYR 224.A N TYR 221.A O no hydrogen 3.170 N/A SER 225.A OG GLY 277.A O no hydrogen 3.142 N/A ALA 227.A N VAL 240.A O no hydrogen 2.694 N/A GLY 229.A N ASP 238.A O no hydrogen 3.121 N/A PHE 231.A N ASP 238.A OD2 no hydrogen 3.071 N/A ASN 232.A ND2 ASP 238.A OD1 no hydrogen 2.941 N/A ASN 232.A ND2 ASP 257.A OD2 no hydrogen 3.537 N/A ASP 238.A N GLY 229.A O no hydrogen 2.731 N/A PHE 239.A N TYR 256.A O no hydrogen 2.628 N/A VAL 240.A N ALA 227.A O no hydrogen 2.836 N/A SER 241.A N TYR 254.A O no hydrogen 2.864 N/A SER 241.A OG SER 225.A O no hydrogen 2.730 N/A GLY 242.A N SER 225.A O no hydrogen 2.899 N/A VAL 243.A N MET 252.A O no hydrogen 2.866 N/A ARG 245.A N SER 220.A O no hydrogen 3.189 N/A ARG 245.A NE ASP 219.A O no hydrogen 3.088 N/A ALA 246.A N VAL 243.A O no hydrogen 3.360 N/A THR 249.A N ALA 246.A O no hydrogen 3.056 N/A LEU 250.A N ALA 247.A O no hydrogen 2.714 N/A GLY 251.A N ALA 246.A O no hydrogen 2.927 N/A MET 252.A N VAL 243.A O no hydrogen 2.875 N/A VAL 253.A N PHE 267.A O no hydrogen 2.862 N/A TYR 254.A N SER 241.A O no hydrogen 2.923 N/A ILE 255.A N TYR 265.A O no hydrogen 3.113 N/A TYR 256.A N PHE 239.A O no hydrogen 2.564 N/A ASP 257.A N SER 262.A O no hydrogen 2.697 N/A GLY 258.A N ASP 238.A OD1 no hydrogen 2.810 N/A LYS 259.A N ASP 257.A OD1 no hydrogen 2.463 N/A SER 262.A OG SER 263.A O no hydrogen 3.485 N/A LEU 264.A N ILE 255.A O no hydrogen 2.882 N/A TYR 265.A N ILE 255.A O no hydrogen 3.460 N/A PHE 267.A N VAL 253.A O no hydrogen 3.158 N/A GLY 269.A N GLY 251.A O no hydrogen 2.713 N/A GLN 271.A NE2 MET 301.A O no hydrogen 2.350 N/A ALA 273.A N THR 249.A O no hydrogen 2.981 N/A GLY 277.A N GLY 296.A O no hydrogen 3.035 N/A PHE 278.A N TYR 275.A O no hydrogen 3.009 N/A SER 279.A OG GLY 341.A O no hydrogen 3.149 N/A ALA 281.A N PHE 294.A O no hydrogen 3.026 N/A THR 283.A N ASP 292.A O no hydrogen 3.096 N/A ILE 285.A N ASP 292.A OD2 no hydrogen 2.820 N/A TYR 290.A N ASP 284.A OD2 no hydrogen 2.679 N/A ASP 292.A N THR 283.A O no hydrogen 2.690 N/A VAL 293.A N SER 318.A O no hydrogen 2.858 N/A PHE 294.A N ALA 281.A O no hydrogen 2.945 N/A ILE 295.A N SER 316.A O no hydrogen 2.954 N/A GLY 296.A N SER 279.A O no hydrogen 3.035 N/A ALA 297.A N GLN 314.A O no hydrogen 2.735 N/A LEU 299.A N ALA 274.A O no hydrogen 3.274 N/A PHE 300.A N ALA 297.A O no hydrogen 3.346 N/A MET 301.A N GLN 271.A OE1 no hydrogen 3.151 N/A ASP 302.A N GLN 310.A O no hydrogen 3.108 N/A ARG 303.A NH1 GLY 307.A O no hydrogen 2.750 N/A GLY 304.A N LYS 308.A O no hydrogen 2.983 N/A GLY 307.A N GLY 304.A O no hydrogen 3.116 N/A LYS 308.A N ASP 306.A OD1 no hydrogen 3.337 N/A GLN 310.A N ASP 302.A O no hydrogen 3.056 N/A GLN 310.A NE2 ASP 302.A OD1 no hydrogen 3.264 N/A VAL 312.A N PHE 300.A O no hydrogen 2.934 N/A GLY 313.A N PHE 300.A O no hydrogen 2.964 N/A GLN 314.A N ALA 297.A O no hydrogen 2.724 N/A GLN 314.A NE2 ASN 332.A OD1 no hydrogen 3.154 N/A VAL 315.A N LEU 331.A O no hydrogen 2.870 N/A SER 316.A N ILE 295.A O no hydrogen 2.644 N/A VAL 317.A N THR 329.A O no hydrogen 2.947 N/A SER 318.A N VAL 293.A O no hydrogen 2.776 N/A SER 318.A OG THR 328.A OG1 no hydrogen 3.401 N/A LEU 319.A N GLN 327.A O no hydrogen 2.745 N/A GLN 320.A N ASP 292.A OD1 no hydrogen 3.230 N/A ARG 321.A N ASP 325.A O no hydrogen 3.432 N/A GLN 327.A N LEU 319.A O no hydrogen 2.954 N/A THR 328.A OG1 SER 318.A OG no hydrogen 3.401 N/A THR 329.A N VAL 317.A O no hydrogen 2.845 N/A GLY 333.A N GLY 313.A O no hydrogen 2.782 N/A PHE 337.A N GLU 311.A O no hydrogen 2.773 N/A SER 342.A N ARG 339.A O no hydrogen 3.378 N/A SER 342.A OG ARG 339.A O no hydrogen 3.075 N/A ALA 345.A N ALA 359.A O no hydrogen 2.862 N/A LEU 347.A N ASP 357.A O no hydrogen 2.787 N/A LEU 350.A N ASP 357.A OD2 no hydrogen 2.898 N/A ASP 351.A N ASP 351.A OD1 no hydrogen 2.421 N/A GLN 352.A N ASP 349.A O no hydrogen 3.247 N/A GLN 352.A NE2 GLY 418.A O no hydrogen 2.357 N/A GLY 354.A N ASP 349.A OD2 no hydrogen 2.649 N/A PHE 355.A N ASP 353.A OD1 no hydrogen 3.152 N/A ASN 356.A ND2 ASP 284.A O no hydrogen 3.007 N/A ASP 357.A N GLY 348.A O no hydrogen 2.480 N/A ILE 358.A N PHE 376.A O no hydrogen 3.077 N/A ALA 359.A N ALA 345.A O no hydrogen 2.928 N/A ILE 360.A N TYR 374.A O no hydrogen 2.913 N/A ALA 361.A N ALA 343.A O no hydrogen 3.176 N/A ALA 362.A N ILE 372.A O no hydrogen 2.803 N/A TYR 364.A N ALA 338.A O no hydrogen 3.246 N/A TYR 364.A OH SER 403.A OG no hydrogen 3.128 N/A GLY 365.A N ALA 362.A O no hydrogen 2.953 N/A GLY 366.A N GLU 335.A OE2 no hydrogen 2.682 N/A LYS 369.A N GLY 366.A O no hydrogen 3.440 N/A LYS 370.A N GLU 367.A O no hydrogen 3.241 N/A LYS 370.A NZ ASP 368.A OD2 no hydrogen 3.431 N/A GLY 371.A N GLY 365.A O no hydrogen 3.065 N/A ILE 372.A N ALA 362.A O no hydrogen 3.133 N/A VAL 373.A N LEU 391.A O no hydrogen 2.855 N/A TYR 374.A N ILE 360.A O no hydrogen 2.703 N/A ILE 375.A N GLN 389.A O no hydrogen 3.050 N/A PHE 376.A N ILE 358.A O no hydrogen 2.847 N/A GLY 378.A N ASP 357.A OD1 no hydrogen 2.993 N/A ARG 379.A N GLY 382.A O no hydrogen 2.927 N/A ARG 379.A NE THR 381.A OG1 no hydrogen 2.480 N/A GLY 382.A N ARG 379.A O no hydrogen 3.134 N/A ASN 384.A N ASN 377.A O no hydrogen 3.267 N/A SER 388.A N ILE 375.A O no hydrogen 3.031 N/A SER 388.A OG ASN 377.A OD1 no hydrogen 2.292 N/A GLN 389.A NE2 LEU 3.A O no hydrogen 2.968 N/A LEU 391.A N VAL 373.A O no hydrogen 2.756 N/A GLY 393.A N GLY 371.A O no hydrogen 3.070 N/A SER 403.A OG TYR 364.A OH no hydrogen 3.128 N/A SER 403.A OG PRO 401.A O no hydrogen 3.198 N/A GLY 405.A N GLY 425.A O no hydrogen 2.858 N/A TYR 406.A N SER 403.A O no hydrogen 2.835 N/A SER 407.A OG GLY 20.A O no hydrogen 2.354 N/A LYS 409.A N ILE 423.A O no hydrogen 3.128 N/A ILE 414.A N ASP 421.A OD2 no hydrogen 2.716 N/A ASP 415.A N ASP 421.A OD2 no hydrogen 3.344 N/A LYS 416.A N ASP 413.A O no hydrogen 3.234 N/A ASN 417.A N ASP 413.A OD1 no hydrogen 3.420 N/A ASN 417.A N ASP 415.A OD1 no hydrogen 3.263 N/A ASN 417.A ND2 ALA 437.A O no hydrogen 2.786 N/A GLY 418.A N ASP 413.A OD2 no hydrogen 2.731 N/A TYR 419.A N ASN 417.A OD1 no hydrogen 3.467 N/A TYR 419.A OH LYS 484.A O no hydrogen 2.990 N/A ASP 421.A N THR 412.A O no hydrogen 3.008 N/A LEU 422.A N TYR 435.A O no hydrogen 2.980 N/A ILE 423.A N LYS 409.A O no hydrogen 2.841 N/A VAL 424.A N ILE 433.A O no hydrogen 2.702 N/A GLY 425.A N SER 407.A O no hydrogen 2.946 N/A ALA 426.A N ARG 431.A O no hydrogen 2.890 N/A GLY 428.A N PRO 402.A O no hydrogen 3.075 N/A VAL 429.A N ALA 426.A O no hydrogen 3.245 N/A ARG 431.A N ALA 426.A O no hydrogen 3.202 N/A ALA 432.A N TYR 11.A O no hydrogen 2.878 N/A ILE 433.A N VAL 424.A O no hydrogen 2.692 N/A LEU 434.A N ALA 9.A O no hydrogen 3.069 N/A TYR 435.A N LEU 422.A O no hydrogen 2.657 N/A ARG 436.A NH1 THR 571.A O no hydrogen 3.189 N/A ARG 436.A NH2 THR 571.A O no hydrogen 3.395 N/A ARG 436.A NH2 THR 571.A OG1 no hydrogen 2.548 N/A ALA 437.A N ASP 421.A OD1 no hydrogen 2.886 N/A ARG 438.A N ASN 2.A O no hydrogen 2.521 N/A VAL 440.A N TYR 419.A OH no hydrogen 3.296 N/A ILE 441.A N ILE 577.A O no hydrogen 2.996 N/A THR 442.A N ASP 482.A O no hydrogen 3.035 N/A THR 442.A OG1 ASP 482.A O no hydrogen 3.454 N/A ASN 444.A N LYS 480.A O no hydrogen 3.137 N/A GLY 446.A N CYS 478.A O no hydrogen 2.857 N/A GLU 448.A N ARG 476.A O no hydrogen 2.805 N/A TYR 450.A N ASN 474.A O no hydrogen 2.978 N/A LEU 454.A N HIS 591.A O no hydrogen 2.652 N/A ASP 457.A N ASN 455.A OD1 no hydrogen 3.031 N/A THR 460.A OG1 ASN 458.A OD1 no hydrogen 2.380 N/A CYS 461.A N LYS 459.A O no hydrogen 2.796 N/A ALA 467.A N LEU 463.A O no hydrogen 2.917 N/A SER 471.A OG ASN 455.A O no hydrogen 3.175 N/A SER 471.A OG ASN 458.A O no hydrogen 3.242 N/A PHE 473.A N ALA 540.A O no hydrogen 2.841 N/A ASN 474.A ND2 GLU 537.A OE2 no hydrogen 3.460 N/A VAL 475.A N LEU 538.A O no hydrogen 3.159 N/A ARG 476.A N GLU 448.A O no hydrogen 2.794 N/A CYS 478.A N GLY 446.A O no hydrogen 2.708 N/A LEU 479.A N GLN 534.A O no hydrogen 2.946 N/A LYS 480.A N ASN 444.A O no hydrogen 3.256 N/A ASP 482.A N THR 442.A O no hydrogen 3.312 N/A VAL 486.A N ASN 417.A O no hydrogen 3.017 N/A LEU 491.A N ILE 527.A O no hydrogen 2.884 N/A PHE 493.A N MET 525.A O no hydrogen 3.108 N/A GLN 494.A N ARG 562.A O no hydrogen 2.672 N/A GLN 494.A NE2 ASN 524.A OD1 no hydrogen 3.001 N/A VAL 495.A N LYS 523.A O no hydrogen 3.072 N/A GLU 496.A N GLU 560.A O no hydrogen 2.893 N/A LEU 497.A N HIS 521.A O no hydrogen 3.000 N/A LEU 498.A N PHE 558.A O no hydrogen 2.719 N/A LEU 499.A N PRO 519.A O no hydrogen 3.078 N/A LYS 501.A N THR 556.A O no hydrogen 3.022 N/A LYS 503.A N ASP 500.A O no hydrogen 3.066 N/A LYS 503.A NZ ILE 508.A O no hydrogen 3.320 N/A ARG 510.A N ASP 500.A OD2 no hydrogen 3.326 N/A ARG 510.A NH2 THR 553.A O no hydrogen 2.141 N/A LEU 512.A N TYR 541.A O no hydrogen 2.858 N/A PHE 513.A N SER 518.A O no hydrogen 2.759 N/A LEU 514.A N ILE 539.A O no hydrogen 2.551 N/A ARG 517.A N PHE 513.A O no hydrogen 2.872 N/A ARG 517.A NH2 PRO 464.A O no hydrogen 3.058 N/A HIS 521.A N LEU 497.A O no hydrogen 3.241 N/A SER 522.A OG GLU 496.A OE1 no hydrogen 3.356 N/A SER 522.A OG GLU 496.A OE2 no hydrogen 3.387 N/A LYS 523.A N VAL 495.A O no hydrogen 3.181 N/A LYS 523.A NZ GLU 536.A OE1 no hydrogen 3.094 N/A MET 525.A N PHE 493.A O no hydrogen 3.280 N/A THR 526.A OG1 ASN 492.A OD1 no hydrogen 2.674 N/A ILE 527.A N LEU 491.A O no hydrogen 3.034 N/A ARG 529.A N ARG 489.A O no hydrogen 3.082 N/A GLN 534.A NE2 THR 526.A O no hydrogen 3.243 N/A CYS 535.A SG MET 533.A O no hydrogen 3.236 N/A ALA 540.A N PHE 473.A O no hydrogen 2.957 N/A TYR 541.A N LEU 512.A O no hydrogen 2.579 N/A LEU 542.A N SER 471.A O no hydrogen 2.995 N/A ARG 543.A N ARG 510.A O no hydrogen 3.376 N/A ARG 543.A NE ARG 509.A O no hydrogen 3.050 N/A ASP 544.A N GLU 547.A OE1 no hydrogen 2.758 N/A SER 546.A OG ASP 544.A OD2 no hydrogen 3.501 N/A GLU 547.A N ASP 544.A O no hydrogen 2.810 N/A LYS 551.A NZ GLN 456.A OE1 no hydrogen 3.434 N/A THR 553.A OG1 ASP 550.A OD2 no hydrogen 2.990 N/A ILE 555.A N ALA 590.A O no hydrogen 2.488 N/A ILE 557.A N ARG 588.A O no hydrogen 2.622 N/A PHE 558.A N LEU 498.A O no hydrogen 2.719 N/A MET 559.A N ILE 586.A O no hydrogen 2.909 N/A GLU 560.A N GLU 496.A O no hydrogen 3.066 N/A TYR 561.A N ALA 584.A O no hydrogen 3.362 N/A TYR 561.A OH PRO 583.A O no hydrogen 2.892 N/A ARG 562.A N GLN 494.A O no hydrogen 3.210 N/A ASP 564.A N ASN 492.A O no hydrogen 3.256 N/A THR 567.A OG1 ARG 566.A O no hydrogen 2.305 N/A ALA 569.A N LEU 574.A O no hydrogen 3.320 N/A THR 571.A OG1 ALA 569.A O no hydrogen 3.154 N/A ILE 577.A N PRO 439.A O no hydrogen 3.130 N/A ASN 579.A N ILE 441.A O no hydrogen 2.809 N/A ILE 586.A N MET 559.A O no hydrogen 2.896 N/A ARG 588.A N ILE 557.A O no hydrogen 3.007 N/A GLN 589.A NE2 THR 556.A OG1 no hydrogen 2.973 N/A ALA 590.A N ILE 555.A O no hydrogen 2.599 N/A HIS 591.A N SER 452.A O no hydrogen 2.566 N/A HIS 591.A NE2 ASN 685.A OD1 no hydrogen 2.986 N/A LEU 593.A N LEU 454.A O no hydrogen 2.619 N/A CYS 596.A SG LEU 594.A O no hydrogen 3.652 N/A CYS 596.A SG TYR 639.A OH no hydrogen 2.989 N/A ASN 600.A N GLY 597.A O no hydrogen 3.263 N/A VAL 601.A N ASP 599.A OD1 no hydrogen 3.256 N/A CYS 602.A SG ASP 595.A O no hydrogen 3.718 N/A CYS 602.A SG TYR 639.A OH no hydrogen 3.773 N/A GLU 607.A N GLN 632.A O no hydrogen 3.047 N/A SER 609.A N LYS 630.A O no hydrogen 3.016 N/A ASP 611.A N ILE 628.A O no hydrogen 3.408 N/A SER 612.A N ASP 611.A OD1 no hydrogen 2.611 N/A SER 612.A OG HIS 732.A NE2 no hydrogen 2.650 N/A ILE 617.A N ASP 735.A O no hydrogen 3.023 N/A LEU 627.A N LEU 697.A O no hydrogen 3.149 N/A VAL 629.A N ALA 695.A O no hydrogen 3.039 N/A LYS 630.A N SER 609.A O no hydrogen 2.785 N/A LYS 630.A NZ GLN 692.A OE1 no hydrogen 3.304 N/A ALA 631.A N LEU 693.A O no hydrogen 3.054 N/A GLN 632.A N GLU 607.A O no hydrogen 3.075 N/A ASN 633.A N THR 691.A O no hydrogen 2.927 N/A ASN 633.A ND2 GLU 636.A O no hydrogen 3.162 N/A ASN 633.A ND2 MET 687.A O no hydrogen 2.662 N/A ASN 633.A ND2 LYS 688.A O no hydrogen 3.437 N/A GLN 634.A N LYS 605.A O no hydrogen 2.887 N/A GLN 634.A NE2 GLN 632.A OE1 no hydrogen 2.839 N/A GLY 635.A N ASN 633.A OD1 no hydrogen 3.247 N/A GLU 636.A N LYS 603.A O no hydrogen 3.340 N/A ALA 638.A N MET 687.A O no hydrogen 3.143 N/A TYR 639.A N ASN 721.A OD1 no hydrogen 2.776 N/A GLU 640.A N ASN 685.A OD1 no hydrogen 2.631 N/A GLU 642.A N GLN 718.A O no hydrogen 3.212 N/A LEU 643.A N CYS 681.A O no hydrogen 2.788 N/A ILE 644.A N GLN 716.A O no hydrogen 2.710 N/A VAL 645.A N VAL 679.A O no hydrogen 2.657 N/A SER 646.A N ASP 714.A O no hydrogen 2.984 N/A SER 646.A OG ASP 714.A O no hydrogen 2.880 N/A ASP 652.A N SER 700.A O no hydrogen 3.378 N/A ILE 654.A N ARG 698.A O no hydrogen 2.998 N/A VAL 657.A N GLY 696.A O no hydrogen 3.276 N/A CYS 668.A SG LEU 666.A O no hydrogen 3.528 N/A ALA 669.A N VAL 680.A O no hydrogen 2.857 N/A LYS 671.A N GLN 678.A O no hydrogen 2.934 N/A LYS 671.A NZ GLU 673.A OE2 no hydrogen 3.543 N/A THR 676.A OG1 ASN 674.A O no hydrogen 2.881 N/A ARG 677.A NE PRO 648.A O no hydrogen 3.216 N/A ARG 677.A NH2 PRO 648.A O no hydrogen 2.415 N/A ARG 677.A NH2 ALA 651.A O no hydrogen 2.310 N/A GLN 678.A N LYS 671.A O no hydrogen 3.010 N/A VAL 679.A N VAL 645.A O no hydrogen 2.508 N/A VAL 680.A N ALA 669.A O no hydrogen 2.995 N/A CYS 681.A N LEU 643.A O no hydrogen 2.981 N/A ASP 682.A N SER 667.A O no hydrogen 2.951 N/A LEU 683.A N ALA 641.A O no hydrogen 3.084 N/A ASN 685.A ND2 GLN 589.A OE1 no hydrogen 2.591 N/A MET 687.A N ALA 638.A O no hydrogen 2.879 N/A THR 691.A OG1 LYS 688.A O no hydrogen 2.397 N/A THR 691.A OG1 ALA 689.A O no hydrogen 3.519 N/A LEU 693.A N ALA 631.A O no hydrogen 2.966 N/A ALA 695.A N VAL 629.A O no hydrogen 3.335 N/A LEU 697.A N LEU 627.A O no hydrogen 3.028 N/A ARG 698.A N GLY 655.A O no hydrogen 2.987 N/A PHE 699.A N LEU 625.A O no hydrogen 2.676 N/A SER 705.A N ASP 708.A OD2 no hydrogen 2.708 N/A MET 707.A N SER 705.A OG no hydrogen 3.417 N/A VAL 711.A N VAL 734.A O no hydrogen 2.768 N/A PHE 713.A N HIS 732.A O no hydrogen 2.732 N/A LEU 715.A N VAL 730.A O no hydrogen 2.494 N/A GLN 716.A N ILE 644.A O no hydrogen 3.041 N/A GLN 716.A NE2 SER 727.A O no hydrogen 3.343 N/A ILE 717.A N SER 727.A OG no hydrogen 2.469 N/A GLN 718.A N GLU 642.A O no hydrogen 3.131 N/A SER 719.A N LYS 725.A O no hydrogen 2.735 N/A SER 719.A OG LYS 725.A O no hydrogen 2.803 N/A SER 720.A N TYR 639.A O no hydrogen 2.981 N/A SER 720.A OG TYR 639.A O no hydrogen 3.094 N/A SER 720.A OG GLU 640.A OE2 no hydrogen 2.616 N/A ASN 721.A ND2 CYS 602.A O no hydrogen 3.096 N/A ASN 721.A ND2 GLY 637.A O no hydrogen 2.812 N/A LYS 725.A NZ ASN 721.A O no hydrogen 3.261 N/A LYS 725.A NZ LEU 722.A O no hydrogen 3.449 N/A SER 727.A N ILE 717.A O no hydrogen 2.846 N/A SER 727.A OG ILE 717.A O no hydrogen 2.948 N/A VAL 730.A N LEU 715.A O no hydrogen 2.788 N/A SER 731.A OG PHE 713.A O no hydrogen 3.366 N/A SER 731.A OG ASP 714.A OD2 no hydrogen 2.392 N/A HIS 732.A NE2 SER 612.A OG no hydrogen 2.650 N/A VAL 734.A N VAL 711.A O no hydrogen 2.747 N/A ALA 737.A N ILE 617.A O no hydrogen 2.606 N/A LEU 739.A N SER 788.A OG no hydrogen 2.581 N/A GLU 743.A N ARG 783.A O no hydrogen 3.082 N/A ARG 745.A N GLU 781.A O no hydrogen 2.715 N/A VAL 747.A N ILE 779.A O no hydrogen 2.949 N/A SER 748.A OG PRO 750.A O no hydrogen 2.365 N/A SER 748.A OG THR 917.A OG1 no hydrogen 2.522 N/A SER 749.A N GLN 777.A O no hydrogen 2.690 N/A ASP 751.A N ASP 751.A OD1 no hydrogen 2.531 N/A VAL 753.A N ASN 918.A O no hydrogen 3.201 N/A LEU 755.A N THR 920.A O no hydrogen 2.948 N/A GLU 767.A N ASP 771.A OD2 no hydrogen 3.335 N/A THR 768.A OG1 ASP 771.A OD1 no hydrogen 3.401 N/A VAL 772.A N GLU 769.A O no hydrogen 2.984 N/A GLY 773.A N GLU 769.A O no hydrogen 3.003 N/A VAL 776.A N SER 869.A O no hydrogen 2.948 N/A GLN 777.A N SER 749.A O no hydrogen 3.184 N/A HIS 778.A N VAL 867.A O no hydrogen 2.984 N/A HIS 778.A NE2 THR 917.A OG1 no hydrogen 3.103 N/A ILE 779.A N VAL 747.A O no hydrogen 2.797 N/A TYR 780.A N LEU 865.A O no hydrogen 2.976 N/A TYR 780.A OH SER 890.A OG no hydrogen 2.355 N/A GLU 781.A N ARG 745.A O no hydrogen 2.606 N/A LEU 782.A N ALA 863.A O no hydrogen 2.688 N/A ARG 783.A N GLU 743.A O no hydrogen 3.041 N/A ARG 783.A NE ASN 785.A OD1 no hydrogen 3.149 N/A ARG 783.A NH1 SER 862.A OG no hydrogen 2.542 N/A ASN 784.A N LYS 861.A O no hydrogen 3.265 N/A ASN 784.A ND2 SER 788.A O no hydrogen 3.196 N/A ASN 784.A ND2 LEU 857.A O no hydrogen 3.166 N/A ASN 784.A ND2 ASP 858.A O no hydrogen 3.238 N/A ASN 785.A N ALA 741.A O no hydrogen 2.982 N/A ASN 785.A ND2 GLU 743.A OE2 no hydrogen 3.220 N/A GLY 786.A N ALA 741.A O no hydrogen 3.243 N/A SER 788.A N LEU 739.A O no hydrogen 2.811 N/A SER 788.A OG LEU 739.A O no hydrogen 2.946 N/A SER 789.A N TYR 901.A OH no hydrogen 2.513 N/A SER 789.A OG ASP 858.A OD1 no hydrogen 2.805 N/A SER 789.A OG TYR 901.A OH no hydrogen 3.130 N/A PHE 790.A N LEU 857.A O no hydrogen 3.247 N/A SER 791.A N GLU 898.A O no hydrogen 2.986 N/A LYS 792.A N GLU 898.A O no hydrogen 3.368 N/A ALA 793.A N VAL 854.A O no hydrogen 2.883 N/A MET 794.A N ASN 895.A O no hydrogen 2.875 N/A LEU 795.A N CYS 852.A O no hydrogen 2.897 N/A HIS 796.A N SER 893.A O no hydrogen 2.763 N/A LEU 797.A N ILE 850.A O no hydrogen 2.627 N/A GLN 798.A N SER 891.A O no hydrogen 3.002 N/A TRP 799.A N LEU 848.A O no hydrogen 3.026 N/A TRP 799.A NE1 LEU 809.A O no hydrogen 2.981 N/A TYR 801.A N GLN 846.A O no hydrogen 2.978 N/A LYS 802.A N GLN 846.A O no hydrogen 3.336 N/A LYS 802.A NZ THR 807.A OG1 no hydrogen 3.155 N/A TYR 803.A N ASN 806.A O no hydrogen 2.867 N/A LEU 808.A N TYR 801.A O no hydrogen 2.812 N/A TYR 810.A N LEU 870.A O no hydrogen 2.761 N/A TYR 810.A OH ASN 829.A OD1 no hydrogen 2.334 N/A LEU 812.A N LYS 868.A O no hydrogen 2.999 N/A HIS 813.A N LYS 868.A O no hydrogen 3.466 N/A TYR 814.A OH CYS 822.A O no hydrogen 2.872 N/A ASP 815.A N TYR 866.A O no hydrogen 2.873 N/A ASP 817.A N ILE 864.A O no hydrogen 2.873 N/A ASN 821.A N GLN 853.A O no hydrogen 3.059 N/A THR 823.A N VAL 851.A O no hydrogen 2.772 N/A SER 824.A OG MET 826.A O no hydrogen 2.415 N/A ASP 825.A N LYS 849.A O no hydrogen 3.008 N/A MET 826.A N SER 824.A OG no hydrogen 3.179 N/A ASN 829.A ND2 ILE 833.A O no hydrogen 3.210 N/A LEU 831.A N TYR 810.A OH no hydrogen 3.184 N/A ARG 832.A N ASN 829.A O no hydrogen 3.429 N/A ILE 833.A N ASN 829.A OD1 no hydrogen 3.087 N/A HIS 838.A N SER 885.A O no hydrogen 3.082 N/A LEU 840.A N SER 887.A O no hydrogen 2.959 N/A CYS 842.A SG GLN 798.A OE1 no hydrogen 3.705 N/A GLN 846.A N LYS 802.A O no hydrogen 2.855 N/A CYS 847.A SG TRP 799.A O no hydrogen 3.767 N/A LEU 848.A N TRP 799.A O no hydrogen 2.848 N/A LYS 849.A N ASP 825.A OD1 no hydrogen 2.832 N/A ILE 850.A N LEU 797.A O no hydrogen 2.910 N/A VAL 851.A N THR 823.A O no hydrogen 2.842 N/A CYS 852.A N LEU 795.A O no hydrogen 2.633 N/A GLN 853.A N ASN 821.A O no hydrogen 2.653 N/A VAL 854.A N ALA 793.A O no hydrogen 2.696 N/A GLY 855.A N PRO 819.A O no hydrogen 2.737 N/A ARG 856.A NE ASP 858.A OD1 no hydrogen 3.070 N/A ARG 856.A NH2 GLU 706.A OE2 no hydrogen 2.805 N/A LEU 857.A N PHE 790.A O no hydrogen 3.096 N/A LYS 861.A N ASP 858.A O no hydrogen 3.317 N/A SER 862.A OG GLU 781.A OE2 no hydrogen 3.043 N/A ALA 863.A N LEU 782.A O no hydrogen 2.768 N/A ILE 864.A N ASP 817.A O no hydrogen 2.940 N/A LEU 865.A N TYR 780.A O no hydrogen 2.811 N/A TYR 866.A N ASP 815.A O no hydrogen 2.799 N/A VAL 867.A N HIS 778.A O no hydrogen 2.879 N/A LYS 868.A N HIS 813.A O no hydrogen 3.046 N/A SER 869.A N VAL 776.A O no hydrogen 2.902 N/A SER 869.A OG VAL 776.A O no hydrogen 2.822 N/A LEU 870.A N TYR 810.A O no hydrogen 2.810 N/A LEU 871.A N PRO 774.A O no hydrogen 3.150 N/A TRP 872.A N LEU 808.A O no hydrogen 2.991 N/A TRP 872.A NE1 GLU 874.A OE1 no hydrogen 2.968 N/A THR 873.A N VAL 772.A O no hydrogen 3.143 N/A THR 873.A OG1 VAL 772.A O no hydrogen 2.652 N/A THR 873.A OG1 LEU 871.A O no hydrogen 3.318 N/A THR 875.A N TRP 872.A O no hydrogen 3.353 N/A THR 875.A OG1 THR 807.A O no hydrogen 2.866 N/A GLN 882.A N ASN 878.A O no hydrogen 3.457 N/A ASN 883.A ND2 GLN 924.A O no hydrogen 2.335 N/A HIS 884.A N ASN 881.A O no hydrogen 2.920 N/A SER 885.A OG ASP 836.A O no hydrogen 2.884 N/A TYR 886.A N VAL 919.A O no hydrogen 2.931 N/A TYR 886.A OH GLU 880.A O no hydrogen 3.100 N/A SER 887.A N HIS 838.A O no hydrogen 3.009 N/A SER 887.A OG THR 916.A OG1 no hydrogen 2.903 N/A SER 887.A OG ASN 918.A OD1 no hydrogen 2.177 N/A LEU 888.A N THR 917.A O no hydrogen 3.020 N/A LYS 889.A N LEU 840.A O no hydrogen 2.980 N/A SER 890.A N VAL 915.A O no hydrogen 2.807 N/A SER 890.A OG HIS 778.A ND1 no hydrogen 3.035 N/A SER 890.A OG TYR 780.A OH no hydrogen 2.355 N/A SER 890.A OG VAL 915.A O no hydrogen 3.349 N/A SER 891.A N GLN 798.A O no hydrogen 3.255 N/A ALA 892.A N THR 913.A O no hydrogen 2.799 N/A SER 893.A N HIS 796.A O no hydrogen 2.925 N/A PHE 894.A N ASN 911.A O no hydrogen 3.113 N/A ASN 895.A N MET 794.A O no hydrogen 3.029 N/A VAL 896.A N ILE 909.A O no hydrogen 2.927 N/A ILE 897.A N LYS 792.A O no hydrogen 3.106 N/A GLU 898.A N LYS 792.A O no hydrogen 3.172 N/A LYS 902.A NZ PHE 899.A O no hydrogen 3.389 N/A ILE 906.A N LEU 904.A O no hydrogen 2.693 N/A ASN 911.A N PHE 894.A O no hydrogen 3.421 N/A SER 912.A N ASN 911.A OD1 no hydrogen 2.793 N/A THR 913.A N ALA 892.A O no hydrogen 2.823 N/A VAL 915.A N SER 890.A O no hydrogen 2.729 N/A THR 916.A OG1 SER 887.A OG no hydrogen 2.903 N/A THR 916.A OG1 ASN 918.A OD1 no hydrogen 2.952 N/A THR 917.A N LEU 888.A O no hydrogen 2.854 N/A THR 917.A OG1 SER 748.A OG no hydrogen 2.522 N/A THR 917.A OG1 HIS 778.A NE2 no hydrogen 3.103 N/A ASN 918.A N ASP 751.A O no hydrogen 3.000 N/A THR 920.A N VAL 753.A O no hydrogen 3.094 N/A