Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mmz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N ASN 2.A OD1 no hydrogen 3.296 N/A PHE 1.A N SER 388.A OG no hydrogen 3.394 N/A PHE 1.A N GLN 389.A OE1 no hydrogen 3.260 N/A ASN 2.A N ASN 2.A OD1 no hydrogen 2.429 N/A ASN 2.A ND2 LEU 350.A O no hydrogen 2.491 N/A ASN 2.A ND2 ARG 438.A O no hydrogen 3.657 N/A LEU 3.A N GLN 389.A OE1 no hydrogen 3.152 N/A ASP 4.A N ARG 436.A O no hydrogen 3.022 N/A ASP 6.A N ASP 4.A OD1 no hydrogen 2.983 N/A SER 7.A N ASP 4.A OD2 no hydrogen 3.431 N/A SER 7.A OG ASP 4.A OD2 no hydrogen 3.125 N/A ALA 9.A N LEU 434.A O no hydrogen 2.855 N/A TYR 11.A N ALA 432.A O no hydrogen 2.760 N/A TYR 11.A OH ASP 60.A O no hydrogen 2.595 N/A SER 12.A OG GLU 10.A OE2 no hydrogen 3.224 N/A GLY 13.A N ASP 430.A O no hydrogen 3.266 N/A SER 17.A N ASP 430.A OD2 no hydrogen 2.649 N/A SER 17.A OG PRO 14.A O no hydrogen 2.245 N/A SER 17.A OG ASP 430.A OD2 no hydrogen 3.355 N/A GLY 20.A N GLY 39.A O no hydrogen 3.178 N/A PHE 21.A N TYR 18.A O no hydrogen 3.018 N/A ASP 24.A N LEU 37.A O no hydrogen 3.022 N/A PHE 26.A N PHE 35.A O no hydrogen 2.995 N/A ALA 30.A N ASP 103.A OD2 no hydrogen 3.181 N/A ARG 33.A N SER 31.A OG no hydrogen 3.295 N/A PHE 35.A N PHE 26.A O no hydrogen 3.024 N/A LEU 36.A N CYS 59.A O no hydrogen 2.493 N/A LEU 37.A N ASP 24.A O no hydrogen 2.834 N/A VAL 38.A N LEU 57.A O no hydrogen 3.144 N/A GLY 39.A N ALA 22.A O no hydrogen 2.802 N/A ALA 40.A N GLN 55.A O no hydrogen 3.010 N/A THR 45.A OG1 GLN 47.A OE1 no hydrogen 2.975 N/A GLN 47.A N THR 45.A OG1 no hydrogen 3.365 N/A GLN 47.A NE2 THR 75.A O no hydrogen 3.035 N/A ILE 50.A N GLN 47.A O no hydrogen 3.155 N/A VAL 51.A N SER 90.A OG no hydrogen 3.416 N/A GLU 52.A N ASN 44.A OD1 no hydrogen 2.838 N/A GLY 54.A N ALA 43.A O no hydrogen 2.819 N/A GLN 55.A N ALA 40.A O no hydrogen 2.940 N/A LEU 57.A N VAL 38.A O no hydrogen 2.979 N/A LYS 58.A N GLN 68.A O no hydrogen 2.532 N/A CYS 59.A N LEU 36.A O no hydrogen 2.776 N/A ASP 60.A N ARG 66.A O no hydrogen 3.444 N/A ARG 66.A NE GLN 68.A OE1 no hydrogen 2.606 N/A ARG 66.A NH2 GLN 68.A OE1 no hydrogen 2.807 N/A GLN 68.A N LYS 58.A O no hydrogen 2.896 N/A ILE 70.A N VAL 56.A O no hydrogen 2.793 N/A GLU 71.A N GLU 71.A OE1 no hydrogen 2.540 N/A THR 75.A OG1 ASP 73.A OD1 no hydrogen 2.615 N/A THR 75.A OG1 ASP 73.A OD2 no hydrogen 3.559 N/A ASN 77.A ND2 PHE 88.A O no hydrogen 2.955 N/A ARG 78.A N GLU 87.A OE2 no hydrogen 3.091 N/A ARG 78.A NE GLU 87.A OE2 no hydrogen 2.708 N/A ARG 78.A NH2 GLU 87.A OE1 no hydrogen 2.811 N/A ARG 78.A NH2 GLU 138.A OE1 no hydrogen 3.192 N/A TYR 80.A N ASP 84.A O no hydrogen 2.812 N/A ALA 81.A N ASP 84.A O no hydrogen 3.243 N/A ASP 84.A N ALA 81.A O no hydrogen 3.020 N/A LEU 86.A N ARG 78.A O no hydrogen 2.680 N/A GLU 87.A N ARG 78.A O no hydrogen 3.472 N/A LYS 89.A NZ ASP 73.A OD2 no hydrogen 2.681 N/A LYS 89.A NZ THR 75.A O no hydrogen 3.377 N/A LYS 89.A NZ GLY 76.A O no hydrogen 2.706 N/A LYS 89.A NZ GLU 87.A OE2 no hydrogen 3.366 N/A SER 90.A N PHE 88.A O no hydrogen 2.640 N/A HIS 91.A N VAL 51.A O no hydrogen 2.955 N/A GLN 92.A NE2 GLY 53.A O no hydrogen 3.308 N/A PHE 94.A N GLY 53.A O no hydrogen 3.104 N/A GLY 95.A N CYS 108.A O no hydrogen 2.913 N/A ALA 96.A N TRP 93.A O no hydrogen 3.350 N/A SER 97.A OG GLY 158.A O no hydrogen 2.676 N/A SER 97.A OG PHE 159.A O no hydrogen 2.916 N/A ARG 99.A N LEU 106.A O no hydrogen 3.017 N/A ARG 99.A NE ILE 161.A O no hydrogen 2.938 N/A SER 100.A N ASP 24.A OD2 no hydrogen 3.112 N/A SER 100.A OG LYS 104.A O no hydrogen 3.173 N/A LYS 101.A N LYS 104.A O no hydrogen 3.049 N/A LYS 104.A N LYS 101.A O no hydrogen 3.074 N/A LYS 104.A NZ ASP 167.A OD2 no hydrogen 3.415 N/A ILE 105.A N GLN 131.A O no hydrogen 2.908 N/A LEU 106.A N ARG 99.A O no hydrogen 2.936 N/A ALA 107.A N PHE 129.A O no hydrogen 3.240 N/A CYS 108.A N SER 97.A O no hydrogen 3.071 N/A ALA 109.A N THR 127.A O no hydrogen 2.686 N/A LEU 111.A N GLN 92.A O no hydrogen 2.926 N/A TYR 112.A N ALA 109.A O no hydrogen 3.076 N/A TYR 112.A OH GLU 87.A OE1 no hydrogen 2.731 N/A TRP 114.A N GLU 123.A O no hydrogen 3.000 N/A ARG 115.A N LEU 86.A O no hydrogen 2.962 N/A ARG 115.A NE ASP 84.A OD1 no hydrogen 3.424 N/A ARG 115.A NH2 ASP 84.A OD2 no hydrogen 3.449 N/A THR 116.A OG1 ARG 115.A O no hydrogen 2.348 N/A LYS 119.A NZ ASP 148.A OD1 no hydrogen 3.196 N/A LYS 119.A NZ ASP 148.A OD2 no hydrogen 3.299 N/A GLU 123.A N TRP 114.A O no hydrogen 2.926 N/A VAL 125.A N GLU 123.A O no hydrogen 2.592 N/A GLY 126.A N TYR 112.A O no hydrogen 3.243 N/A THR 127.A N ALA 109.A O no hydrogen 3.298 N/A THR 127.A OG1 GLU 138.A OE2 no hydrogen 2.948 N/A CYS 128.A N TYR 139.A O no hydrogen 2.770 N/A PHE 129.A N ALA 107.A O no hydrogen 2.764 N/A LEU 130.A N VAL 137.A O no hydrogen 2.859 N/A GLN 131.A N ILE 105.A O no hydrogen 2.858 N/A ASP 132.A N LYS 135.A O no hydrogen 3.099 N/A THR 136.A OG1 GLN 131.A OE1 no hydrogen 2.830 N/A VAL 137.A N LEU 130.A O no hydrogen 2.983 N/A TYR 139.A N CYS 128.A O no hydrogen 2.734 N/A TYR 139.A OH ASP 186.A OD2 no hydrogen 2.257 N/A CYS 142.A SG GLN 152.A O no hydrogen 3.927 N/A CYS 142.A SG SER 176.A OG no hydrogen 3.728 N/A CYS 142.A SG GLN 182.A OE1 no hydrogen 3.901 N/A ARG 143.A N ALA 140.A O no hydrogen 2.898 N/A ARG 143.A NE TYR 200.A O no hydrogen 3.098 N/A ARG 143.A NH1 GLU 138.A OE2 no hydrogen 3.158 N/A SER 144.A OG GLN 152.A OE1 no hydrogen 2.939 N/A ASP 150.A N ASP 150.A OD1 no hydrogen 2.347 N/A GLY 151.A N ASP 148.A O no hydrogen 2.529 N/A GLN 152.A N ASP 146.A O no hydrogen 3.363 N/A GLN 152.A NE2 GLN 182.A OE1 no hydrogen 2.914 N/A CYS 155.A N GLN 152.A O no hydrogen 3.088 N/A GLN 156.A N PRO 124.A O no hydrogen 2.928 N/A GLY 157.A N VAL 125.A O no hydrogen 2.866 N/A GLY 158.A N GLY 172.A O no hydrogen 3.146 N/A SER 160.A OG GLY 223.A O no hydrogen 2.847 N/A ASP 162.A N LEU 170.A O no hydrogen 2.991 N/A PHE 163.A N ASP 162.A OD1 no hydrogen 2.813 N/A THR 164.A OG1 ALA 166.A O no hydrogen 3.479 N/A THR 164.A OG1 ARG 168.A O no hydrogen 3.283 N/A ARG 168.A NH1 SER 185.A OG no hydrogen 3.114 N/A ARG 168.A NH2 ASN 206.A O no hydrogen 2.960 N/A VAL 169.A N ASP 186.A O no hydrogen 2.928 N/A LEU 170.A N ASP 162.A O no hydrogen 2.659 N/A LEU 171.A N ILE 184.A O no hydrogen 2.771 N/A GLY 172.A N SER 160.A O no hydrogen 3.169 N/A GLY 173.A N GLN 182.A O no hydrogen 2.926 N/A GLY 175.A N CYS 155.A O no hydrogen 2.968 N/A SER 176.A OG GLN 182.A OE1 no hydrogen 2.852 N/A PHE 177.A N GLY 151.A O no hydrogen 2.986 N/A TYR 178.A N ALA 149.A O no hydrogen 2.692 N/A TRP 179.A N GLY 175.A O no hydrogen 3.230 N/A GLN 180.A N PHE 177.A O no hydrogen 3.199 N/A GLN 180.A NE2 ALA 213.A O no hydrogen 3.116 N/A GLN 180.A NE2 ASP 218.A OD1 no hydrogen 3.082 N/A GLY 181.A N SER 176.A O no hydrogen 3.006 N/A GLN 182.A N GLY 173.A O no hydrogen 2.794 N/A GLN 182.A NE2 THR 210.A O no hydrogen 3.100 N/A LEU 183.A N THR 210.A OG1 no hydrogen 3.067 N/A ILE 184.A N LEU 171.A O no hydrogen 2.664 N/A SER 185.A N LEU 208.A O no hydrogen 2.495 N/A SER 185.A OG VAL 169.A O no hydrogen 2.825 N/A ASP 186.A N VAL 169.A O no hydrogen 3.209 N/A GLN 187.A NE2 ASN 206.A OD1 no hydrogen 3.240 N/A VAL 188.A N ASP 167.A O no hydrogen 2.970 N/A ILE 191.A N GLN 187.A O no hydrogen 2.965 N/A VAL 192.A N VAL 188.A O no hydrogen 3.086 N/A SER 193.A N ALA 189.A O no hydrogen 2.733 N/A SER 193.A OG ALA 189.A O no hydrogen 2.867 N/A SER 193.A OG GLU 190.A O no hydrogen 3.312 N/A LYS 194.A N GLU 190.A O no hydrogen 2.930 N/A LYS 194.A NZ GLU 190.A OE2 no hydrogen 3.153 N/A ASN 198.A N ASP 196.A OD1 no hydrogen 3.305 N/A VAL 199.A N ASP 196.A O no hydrogen 2.609 N/A SER 201.A OG ARG 143.A O no hydrogen 3.406 N/A ASN 205.A N GLU 190.A OE1 no hydrogen 2.879 N/A GLN 207.A NE2 ASP 186.A OD2 no hydrogen 3.063 N/A LEU 208.A N SER 185.A O no hydrogen 2.803 N/A THR 210.A N LEU 183.A O no hydrogen 2.967 N/A ALA 213.A N GLN 180.A OE1 no hydrogen 2.865 N/A GLN 214.A N GLN 214.A OE1 no hydrogen 2.654 N/A PHE 217.A N GLN 214.A O no hydrogen 3.018 N/A ASP 218.A N ALA 215.A O no hydrogen 3.096 N/A ASP 219.A N TYR 178.A O no hydrogen 3.042 N/A SER 220.A OG PHE 217.A O no hydrogen 2.488 N/A TYR 221.A N TRP 179.A O no hydrogen 2.956 N/A LEU 222.A N GLN 180.A O no hydrogen 3.077 N/A GLY 223.A N SER 241.A OG no hydrogen 3.038 N/A SER 225.A OG GLY 277.A O no hydrogen 2.895 N/A ALA 227.A N VAL 240.A O no hydrogen 2.796 N/A GLY 229.A N ASP 238.A O no hydrogen 3.261 N/A PHE 231.A N ASP 238.A OD1 no hydrogen 3.261 N/A ILE 236.A N ASP 234.A OD1 no hydrogen 2.900 N/A ASP 238.A N GLY 229.A O no hydrogen 2.362 N/A PHE 239.A N TYR 256.A O no hydrogen 2.855 N/A VAL 240.A N ALA 227.A O no hydrogen 2.918 N/A SER 241.A N TYR 254.A O no hydrogen 3.072 N/A SER 241.A OG SER 225.A O no hydrogen 2.970 N/A SER 241.A OG GLY 242.A O no hydrogen 3.422 N/A GLY 242.A N SER 225.A O no hydrogen 3.163 N/A VAL 243.A N MET 252.A O no hydrogen 2.496 N/A ARG 245.A N SER 220.A O no hydrogen 3.177 N/A ARG 245.A NE ASP 219.A O no hydrogen 3.066 N/A ALA 246.A N VAL 243.A O no hydrogen 3.052 N/A THR 249.A N ARG 245.A O no hydrogen 3.032 N/A THR 249.A OG1 ARG 248.A O no hydrogen 2.423 N/A LEU 250.A N ALA 247.A O no hydrogen 2.944 N/A GLY 251.A N ALA 246.A O no hydrogen 2.926 N/A MET 252.A N VAL 243.A O no hydrogen 2.824 N/A VAL 253.A N PHE 267.A O no hydrogen 2.963 N/A TYR 254.A N SER 241.A O no hydrogen 2.997 N/A ILE 255.A N TYR 265.A O no hydrogen 3.042 N/A TYR 256.A N PHE 239.A O no hydrogen 2.762 N/A ASP 257.A N SER 262.A O no hydrogen 2.660 N/A GLY 258.A N ASP 238.A OD2 no hydrogen 3.103 N/A LYS 259.A N ASP 257.A OD1 no hydrogen 3.007 N/A MET 261.A N ASP 257.A O no hydrogen 3.071 N/A SER 262.A N ASN 260.A OD1 no hydrogen 3.287 N/A SER 262.A OG ASN 260.A OD1 no hydrogen 3.006 N/A LEU 264.A N ILE 255.A O no hydrogen 2.645 N/A PHE 267.A N VAL 253.A O no hydrogen 2.970 N/A GLY 269.A N GLY 251.A O no hydrogen 3.086 N/A GLN 271.A NE2 MET 301.A O no hydrogen 2.804 N/A ALA 273.A N THR 249.A O no hydrogen 2.974 N/A GLY 277.A N GLY 296.A O no hydrogen 3.023 N/A PHE 278.A N TYR 275.A O no hydrogen 3.377 N/A ALA 281.A N PHE 294.A O no hydrogen 2.974 N/A THR 283.A N ASP 292.A O no hydrogen 3.177 N/A ILE 285.A N ASP 292.A OD2 no hydrogen 2.917 N/A ASN 286.A N ASN 286.A OD1 no hydrogen 2.552 N/A ASN 286.A ND2 ASP 288.A OD2 no hydrogen 2.391 N/A ASP 289.A N ASP 284.A OD1 no hydrogen 3.175 N/A ASP 289.A N ASP 284.A OD2 no hydrogen 3.017 N/A ASP 292.A N THR 283.A O no hydrogen 2.622 N/A VAL 293.A N SER 318.A O no hydrogen 2.732 N/A PHE 294.A N ALA 281.A O no hydrogen 2.913 N/A ILE 295.A N SER 316.A O no hydrogen 2.897 N/A GLY 296.A N SER 279.A O no hydrogen 2.803 N/A ALA 297.A N GLN 314.A O no hydrogen 2.761 N/A LEU 299.A N ALA 274.A O no hydrogen 3.201 N/A PHE 300.A N ALA 297.A O no hydrogen 3.072 N/A MET 301.A N GLN 271.A OE1 no hydrogen 2.913 N/A ARG 303.A NH1 GLY 307.A O no hydrogen 3.503 N/A GLY 304.A N LYS 308.A O no hydrogen 3.315 N/A GLY 307.A N GLY 304.A O no hydrogen 3.016 N/A GLN 310.A N ASP 302.A O no hydrogen 3.133 N/A GLN 310.A NE2 ASP 302.A OD1 no hydrogen 3.553 N/A GLY 313.A N PHE 300.A O no hydrogen 2.891 N/A GLN 314.A N ALA 297.A O no hydrogen 3.001 N/A VAL 315.A N LEU 331.A O no hydrogen 2.858 N/A SER 316.A N ILE 295.A O no hydrogen 2.652 N/A VAL 317.A N THR 329.A O no hydrogen 2.768 N/A SER 318.A N VAL 293.A O no hydrogen 2.792 N/A SER 318.A OG THR 328.A OG1 no hydrogen 2.743 N/A LEU 319.A N GLN 327.A O no hydrogen 2.793 N/A GLN 320.A N ASP 292.A OD1 no hydrogen 3.124 N/A GLN 320.A NE2 ASP 230.A O no hydrogen 3.368 N/A GLN 320.A NE2 ALA 291.A O no hydrogen 2.723 N/A ARG 321.A NH2 GLN 327.A OE1 no hydrogen 3.372 N/A GLY 324.A N ARG 321.A O no hydrogen 3.374 N/A GLN 327.A N LEU 319.A O no hydrogen 2.938 N/A THR 328.A OG1 SER 318.A OG no hydrogen 2.743 N/A THR 329.A N VAL 317.A O no hydrogen 2.730 N/A THR 329.A OG1 VAL 317.A O no hydrogen 3.503 N/A LEU 331.A N VAL 315.A O no hydrogen 2.969 N/A ASN 332.A ND2 ASP 302.A OD2 no hydrogen 3.452 N/A GLY 333.A N GLY 313.A O no hydrogen 2.888 N/A PHE 337.A N GLU 311.A O no hydrogen 2.890 N/A SER 342.A N ARG 339.A O no hydrogen 3.356 N/A SER 342.A OG ARG 339.A O no hydrogen 2.702 N/A ILE 344.A N SER 279.A OG no hydrogen 3.176 N/A ALA 345.A N ALA 359.A O no hydrogen 2.870 N/A LEU 347.A N ASP 357.A O no hydrogen 3.244 N/A LEU 350.A N ASP 357.A OD2 no hydrogen 2.514 N/A ASP 351.A N ASP 351.A OD1 no hydrogen 2.526 N/A GLN 352.A N ASP 349.A O no hydrogen 3.357 N/A GLY 354.A N ASP 349.A OD2 no hydrogen 2.570 N/A ASN 356.A ND2 ASP 284.A O no hydrogen 3.133 N/A ASP 357.A N GLY 348.A O no hydrogen 3.221 N/A ILE 358.A N PHE 376.A O no hydrogen 2.999 N/A ALA 359.A N ALA 345.A O no hydrogen 2.817 N/A ILE 360.A N TYR 374.A O no hydrogen 2.870 N/A ALA 361.A N ALA 343.A O no hydrogen 3.012 N/A ALA 362.A N ILE 372.A O no hydrogen 2.847 N/A GLY 365.A N ALA 362.A O no hydrogen 3.080 N/A GLY 366.A N GLU 335.A OE2 no hydrogen 2.393 N/A LYS 369.A N GLY 366.A O no hydrogen 3.119 N/A LYS 370.A N GLU 367.A O no hydrogen 3.313 N/A LYS 370.A NZ ASP 368.A OD2 no hydrogen 3.419 N/A GLY 371.A N GLY 365.A O no hydrogen 2.703 N/A ILE 372.A N ALA 362.A O no hydrogen 3.106 N/A VAL 373.A N LEU 391.A O no hydrogen 2.845 N/A TYR 374.A N ILE 360.A O no hydrogen 2.780 N/A ILE 375.A N GLN 389.A O no hydrogen 3.071 N/A PHE 376.A N ILE 358.A O no hydrogen 2.761 N/A ASN 377.A ND2 GLN 580.A OE1 no hydrogen 3.430 N/A GLY 378.A N ASP 357.A OD1 no hydrogen 2.912 N/A ARG 379.A N GLY 382.A O no hydrogen 3.030 N/A GLY 382.A N ARG 379.A O no hydrogen 3.265 N/A ASN 384.A N ASN 377.A O no hydrogen 3.000 N/A VAL 386.A N ASN 384.A OD1 no hydrogen 3.222 N/A SER 388.A N ILE 375.A O no hydrogen 2.890 N/A SER 388.A OG ILE 375.A O no hydrogen 3.549 N/A GLN 389.A NE2 LEU 3.A O no hydrogen 2.779 N/A LEU 391.A N VAL 373.A O no hydrogen 2.765 N/A GLY 393.A N GLY 371.A O no hydrogen 2.967 N/A SER 403.A OG PRO 401.A O no hydrogen 3.015 N/A GLY 405.A N GLY 425.A O no hydrogen 2.956 N/A TYR 406.A N SER 403.A O no hydrogen 2.986 N/A SER 407.A OG GLY 20.A O no hydrogen 2.611 N/A LYS 409.A N ILE 423.A O no hydrogen 3.093 N/A THR 412.A OG1 GLY 410.A O no hydrogen 3.556 N/A ILE 414.A N ASP 421.A OD2 no hydrogen 2.962 N/A ASN 417.A ND2 ASP 421.A OD1 no hydrogen 3.485 N/A GLY 418.A N ASP 413.A OD2 no hydrogen 3.035 N/A TYR 419.A N ASN 417.A OD1 no hydrogen 2.965 N/A TYR 419.A OH LYS 484.A O no hydrogen 2.884 N/A ASP 421.A N THR 412.A O no hydrogen 2.897 N/A LEU 422.A N TYR 435.A O no hydrogen 2.987 N/A ILE 423.A N LYS 409.A O no hydrogen 2.896 N/A VAL 424.A N ILE 433.A O no hydrogen 2.857 N/A GLY 425.A N SER 407.A O no hydrogen 2.695 N/A ALA 426.A N ARG 431.A O no hydrogen 2.959 N/A GLY 428.A N PRO 402.A O no hydrogen 3.101 N/A ALA 432.A N TYR 11.A O no hydrogen 2.636 N/A ILE 433.A N VAL 424.A O no hydrogen 2.869 N/A LEU 434.A N ALA 9.A O no hydrogen 2.912 N/A TYR 435.A N LEU 422.A O no hydrogen 2.851 N/A ARG 436.A NH1 THR 571.A O no hydrogen 2.812 N/A ARG 436.A NH2 THR 571.A O no hydrogen 3.436 N/A ALA 437.A N ASP 421.A OD1 no hydrogen 2.812 N/A ARG 438.A N ASN 2.A O no hydrogen 2.608 N/A VAL 440.A N TYR 419.A OH no hydrogen 3.009 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 2.809 N/A THR 442.A OG1 ASP 482.A O no hydrogen 3.331 N/A ASN 444.A N LYS 480.A O no hydrogen 2.929 N/A GLU 448.A N ARG 476.A O no hydrogen 2.916 N/A TYR 450.A N ASN 474.A O no hydrogen 2.639 N/A LEU 454.A N HIS 591.A O no hydrogen 2.753 N/A ASP 457.A N ASN 455.A OD1 no hydrogen 2.877 N/A ASN 458.A N ASN 455.A O no hydrogen 3.105 N/A LYS 459.A NZ GLU 545.A OE2 no hydrogen 3.331 N/A THR 460.A N VAL 470.A O no hydrogen 2.904 N/A THR 460.A OG1 ASN 458.A O no hydrogen 2.879 N/A CYS 461.A SG SER 462.A O no hydrogen 3.592 N/A LEU 463.A N LEU 468.A O no hydrogen 3.148 N/A VAL 470.A N CYS 461.A O no hydrogen 2.709 N/A SER 471.A OG ASN 455.A O no hydrogen 2.799 N/A PHE 473.A N ALA 540.A O no hydrogen 2.882 N/A ASN 474.A N TYR 450.A O no hydrogen 2.383 N/A ARG 476.A N GLU 448.A O no hydrogen 2.936 N/A CYS 478.A N GLY 446.A O no hydrogen 2.713 N/A LEU 479.A N GLN 534.A O no hydrogen 3.122 N/A LYS 480.A N ASN 444.A O no hydrogen 3.165 N/A ASP 482.A N THR 442.A O no hydrogen 3.272 N/A VAL 486.A N ASN 417.A O no hydrogen 2.716 N/A LEU 491.A N ILE 527.A O no hydrogen 2.856 N/A PHE 493.A N MET 525.A O no hydrogen 2.988 N/A GLN 494.A N ARG 562.A O no hydrogen 3.189 N/A GLN 494.A NE2 ASN 524.A OD1 no hydrogen 2.573 N/A GLN 494.A NE2 ASP 564.A OD2 no hydrogen 2.947 N/A VAL 495.A N LYS 523.A O no hydrogen 3.230 N/A GLU 496.A N GLU 560.A O no hydrogen 2.666 N/A LEU 497.A N HIS 521.A O no hydrogen 2.988 N/A LEU 498.A N PHE 558.A O no hydrogen 2.638 N/A LEU 499.A N PRO 519.A O no hydrogen 3.214 N/A LYS 501.A N THR 556.A O no hydrogen 2.860 N/A ARG 510.A NH2 THR 553.A O no hydrogen 2.498 N/A LEU 512.A N TYR 541.A O no hydrogen 3.004 N/A PHE 513.A N SER 518.A O no hydrogen 2.922 N/A LEU 514.A N ILE 539.A O no hydrogen 3.178 N/A SER 518.A OG SER 520.A O no hydrogen 2.540 N/A HIS 521.A N LEU 497.A O no hydrogen 3.158 N/A SER 522.A OG GLU 496.A OE2 no hydrogen 2.601 N/A LYS 523.A N VAL 495.A O no hydrogen 3.144 N/A LYS 523.A NZ GLU 536.A OE1 no hydrogen 3.238 N/A MET 525.A N PHE 493.A O no hydrogen 3.017 N/A THR 526.A OG1 ASN 492.A OD1 no hydrogen 3.244 N/A ILE 527.A N LEU 491.A O no hydrogen 3.354 N/A ARG 529.A N ARG 489.A O no hydrogen 3.217 N/A GLN 534.A N LEU 479.A O no hydrogen 3.241 N/A CYS 535.A SG GLN 534.A O no hydrogen 3.040 N/A TYR 541.A N LEU 512.A O no hydrogen 2.531 N/A LEU 542.A N SER 471.A O no hydrogen 2.706 N/A GLU 547.A N ASP 544.A O no hydrogen 3.047 N/A THR 553.A OG1 ASP 550.A OD1 no hydrogen 3.345 N/A ILE 555.A N ALA 590.A O no hydrogen 2.773 N/A ILE 557.A N ARG 588.A O no hydrogen 2.608 N/A PHE 558.A N LEU 498.A O no hydrogen 2.629 N/A MET 559.A N ILE 586.A O no hydrogen 2.997 N/A GLU 560.A N GLU 496.A O no hydrogen 3.028 N/A TYR 561.A N ALA 584.A O no hydrogen 3.104 N/A ARG 562.A N GLN 494.A O no hydrogen 2.879 N/A THR 572.A OG1 ASP 570.A O no hydrogen 3.115 N/A ILE 577.A N PRO 439.A O no hydrogen 2.772 N/A ASN 579.A N ILE 441.A O no hydrogen 2.847 N/A ASN 579.A ND2 PHE 581.A O no hydrogen 3.000 N/A ILE 586.A N MET 559.A O no hydrogen 2.865 N/A ARG 588.A N ILE 557.A O no hydrogen 2.895 N/A ARG 588.A NE SER 587.A O no hydrogen 3.094 N/A ARG 588.A NH1 LEU 447.A O no hydrogen 2.656 N/A ALA 590.A N ILE 555.A O no hydrogen 2.839 N/A HIS 591.A N SER 452.A O no hydrogen 2.869 N/A HIS 591.A NE2 ASN 685.A OD1 no hydrogen 2.999 N/A LEU 593.A N LEU 454.A O no hydrogen 2.734 N/A CYS 596.A SG LEU 594.A O no hydrogen 3.711 N/A CYS 596.A SG TYR 639.A OH no hydrogen 3.592 N/A GLU 598.A N GLU 598.A OE1 no hydrogen 2.649 N/A ASN 600.A N GLY 597.A O no hydrogen 3.320 N/A VAL 601.A N ASP 599.A OD1 no hydrogen 2.974 N/A CYS 602.A SG TYR 639.A OH no hydrogen 3.733 N/A GLU 607.A N GLN 632.A O no hydrogen 3.019 N/A SER 609.A N LYS 630.A O no hydrogen 2.867 N/A SER 612.A N ASP 611.A OD1 no hydrogen 2.424 N/A SER 612.A OG HIS 732.A NE2 no hydrogen 2.490 N/A ILE 617.A N ASP 735.A O no hydrogen 3.225 N/A ILE 619.A N ALA 737.A O no hydrogen 3.070 N/A ASN 623.A ND2 TYR 618.A O no hydrogen 3.493 N/A LEU 625.A N PHE 699.A O no hydrogen 2.847 N/A LEU 627.A N LEU 697.A O no hydrogen 3.235 N/A VAL 629.A N ALA 695.A O no hydrogen 2.888 N/A LYS 630.A N SER 609.A O no hydrogen 2.681 N/A LYS 630.A NZ GLN 632.A OE1 no hydrogen 2.370 N/A ALA 631.A N LEU 693.A O no hydrogen 3.067 N/A GLN 632.A N GLU 607.A O no hydrogen 3.083 N/A GLN 632.A NE2 GLN 634.A OE1 no hydrogen 3.017 N/A ASN 633.A ND2 GLU 636.A O no hydrogen 3.532 N/A ASN 633.A ND2 MET 687.A O no hydrogen 3.068 N/A ASN 633.A ND2 LYS 688.A O no hydrogen 3.192 N/A GLN 634.A N LYS 605.A O no hydrogen 3.033 N/A GLN 634.A NE2 GLY 690.A O no hydrogen 3.584 N/A ALA 638.A N MET 687.A O no hydrogen 2.836 N/A TYR 639.A N ASN 721.A OD1 no hydrogen 2.803 N/A GLU 640.A N ASN 685.A OD1 no hydrogen 2.813 N/A ALA 641.A N GLY 684.A O no hydrogen 3.334 N/A GLU 642.A N GLN 718.A O no hydrogen 3.012 N/A LEU 643.A N CYS 681.A O no hydrogen 2.586 N/A ILE 644.A N GLN 716.A O no hydrogen 2.871 N/A VAL 645.A N VAL 679.A O no hydrogen 2.776 N/A SER 646.A N ASP 714.A O no hydrogen 3.000 N/A SER 646.A OG ASP 714.A O no hydrogen 3.017 N/A ALA 651.A N PRO 648.A O no hydrogen 3.431 N/A ILE 654.A N ARG 698.A O no hydrogen 3.004 N/A VAL 657.A N GLY 696.A O no hydrogen 3.370 N/A ALA 669.A N VAL 680.A O no hydrogen 3.146 N/A LYS 671.A N GLN 678.A O no hydrogen 3.349 N/A THR 672.A OG1 THR 676.A O no hydrogen 3.394 N/A THR 676.A OG1 ASN 674.A O no hydrogen 2.980 N/A VAL 679.A N VAL 645.A O no hydrogen 2.736 N/A VAL 680.A N ALA 669.A O no hydrogen 3.342 N/A CYS 681.A N LEU 643.A O no hydrogen 2.834 N/A ASP 682.A N SER 667.A O no hydrogen 2.934 N/A LEU 683.A N ALA 641.A O no hydrogen 3.010 N/A GLY 684.A N ASP 682.A OD1 no hydrogen 3.054 N/A ASN 685.A ND2 GLN 589.A OE1 no hydrogen 2.704 N/A MET 687.A N ALA 638.A O no hydrogen 2.885 N/A THR 691.A OG1 LYS 688.A O no hydrogen 2.719 N/A THR 691.A OG1 ALA 689.A O no hydrogen 2.469 N/A LEU 693.A N ALA 631.A O no hydrogen 3.136 N/A LEU 697.A N LEU 627.A O no hydrogen 3.139 N/A PHE 699.A N LEU 625.A O no hydrogen 2.695 N/A SER 700.A N ASP 652.A O no hydrogen 3.378 N/A SER 705.A OG ASP 708.A OD2 no hydrogen 2.506 N/A SER 710.A OG ASP 735.A OD1 no hydrogen 3.250 N/A VAL 711.A N VAL 734.A O no hydrogen 3.405 N/A PHE 713.A N HIS 732.A O no hydrogen 3.314 N/A ASP 714.A N SER 646.A O no hydrogen 3.224 N/A LEU 715.A N VAL 730.A O no hydrogen 2.619 N/A GLN 716.A N ILE 644.A O no hydrogen 3.372 N/A GLN 716.A NE2 GLN 718.A OE1 no hydrogen 3.209 N/A ILE 717.A N SER 727.A OG no hydrogen 2.628 N/A GLN 718.A N GLU 642.A O no hydrogen 2.991 N/A SER 719.A OG LYS 725.A O no hydrogen 2.402 N/A SER 720.A N TYR 639.A O no hydrogen 2.866 N/A ASN 721.A ND2 CYS 602.A O no hydrogen 2.832 N/A ASN 721.A ND2 GLY 637.A O no hydrogen 2.984 N/A SER 727.A N ILE 717.A O no hydrogen 3.036 N/A VAL 730.A N LEU 715.A O no hydrogen 2.670 N/A SER 731.A OG ASP 714.A OD1 no hydrogen 2.946 N/A HIS 732.A N PHE 713.A O no hydrogen 3.012 N/A LEU 736.A N THR 709.A O no hydrogen 2.916 N/A ALA 737.A N ILE 617.A O no hydrogen 2.668 N/A LEU 739.A N SER 788.A OG no hydrogen 2.986 N/A GLU 743.A N ARG 783.A O no hydrogen 2.991 N/A ARG 745.A N GLU 781.A O no hydrogen 2.965 N/A VAL 747.A N ILE 779.A O no hydrogen 3.052 N/A SER 748.A OG PRO 750.A O no hydrogen 2.598 N/A SER 748.A OG THR 915.A OG1 no hydrogen 2.495 N/A SER 749.A N GLN 777.A O no hydrogen 2.661 N/A VAL 753.A N ASN 916.A O no hydrogen 3.173 N/A LEU 755.A N THR 918.A O no hydrogen 2.825 N/A TRP 760.A NE1 ASP 771.A O no hydrogen 3.005 N/A VAL 776.A N SER 867.A O no hydrogen 2.840 N/A GLN 777.A N SER 749.A O no hydrogen 3.077 N/A HIS 778.A N VAL 865.A O no hydrogen 3.111 N/A HIS 778.A ND1 SER 888.A OG no hydrogen 2.849 N/A HIS 778.A NE2 THR 915.A OG1 no hydrogen 2.758 N/A ILE 779.A N VAL 747.A O no hydrogen 2.999 N/A TYR 780.A N LEU 863.A O no hydrogen 2.999 N/A TYR 780.A OH SER 888.A O no hydrogen 3.022 N/A TYR 780.A OH SER 888.A OG no hydrogen 2.279 N/A GLU 781.A N ARG 745.A O no hydrogen 2.813 N/A LEU 782.A N ALA 861.A O no hydrogen 2.755 N/A ARG 783.A N GLU 743.A O no hydrogen 2.968 N/A ARG 783.A NH1 GLY 858.A O no hydrogen 3.392 N/A ARG 783.A NH1 SER 860.A OG no hydrogen 3.244 N/A ARG 783.A NH2 GLY 858.A O no hydrogen 2.961 N/A ASN 784.A ND2 SER 788.A O no hydrogen 3.114 N/A ASN 784.A ND2 LEU 855.A O no hydrogen 2.754 N/A ASN 785.A N ALA 741.A O no hydrogen 2.682 N/A GLY 786.A N ALA 741.A O no hydrogen 3.224 N/A SER 788.A N LEU 739.A O no hydrogen 3.068 N/A SER 788.A OG ILE 619.A O no hydrogen 3.085 N/A SER 788.A OG LEU 739.A O no hydrogen 3.288 N/A SER 789.A N TYR 899.A OH no hydrogen 3.350 N/A SER 789.A OG ASP 856.A OD1 no hydrogen 3.437 N/A SER 789.A OG TYR 899.A OH no hydrogen 3.166 N/A PHE 790.A N LEU 855.A O no hydrogen 3.273 N/A SER 791.A N GLU 896.A O no hydrogen 3.221 N/A ALA 793.A N VAL 852.A O no hydrogen 3.030 N/A MET 794.A N ASN 893.A O no hydrogen 2.767 N/A LEU 795.A N CYS 850.A O no hydrogen 2.829 N/A HIS 796.A N SER 891.A O no hydrogen 2.879 N/A LEU 797.A N ILE 848.A O no hydrogen 2.761 N/A GLN 798.A N SER 889.A O no hydrogen 2.784 N/A TRP 799.A N LEU 846.A O no hydrogen 2.981 N/A TRP 799.A NE1 LEU 809.A O no hydrogen 3.113 N/A TYR 801.A N GLN 844.A O no hydrogen 3.062 N/A LYS 802.A N GLN 844.A O no hydrogen 3.477 N/A TYR 803.A N ASN 806.A O no hydrogen 3.004 N/A LEU 808.A N TYR 801.A O no hydrogen 2.768 N/A TYR 810.A N LEU 868.A O no hydrogen 2.808 N/A TYR 810.A OH ASN 829.A OD1 no hydrogen 2.586 N/A LEU 812.A N LYS 866.A O no hydrogen 3.009 N/A HIS 813.A N LYS 866.A O no hydrogen 3.360 N/A TYR 814.A OH CYS 822.A O no hydrogen 3.151 N/A ASP 815.A N TYR 864.A O no hydrogen 2.818 N/A ASP 817.A N ILE 862.A O no hydrogen 2.903 N/A MET 820.A N GLY 818.A O no hydrogen 2.778 N/A ASN 821.A N GLN 851.A O no hydrogen 3.075 N/A THR 823.A N VAL 849.A O no hydrogen 2.860 N/A SER 824.A OG MET 826.A O no hydrogen 2.386 N/A ASP 825.A N LYS 847.A O no hydrogen 3.086 N/A MET 826.A N SER 824.A OG no hydrogen 3.285 N/A ASN 829.A N ILE 811.A O no hydrogen 3.181 N/A ASN 829.A ND2 ILE 833.A O no hydrogen 3.002 N/A LEU 831.A N TYR 810.A OH no hydrogen 2.907 N/A ARG 832.A N ASN 829.A O no hydrogen 3.280 N/A ILE 833.A N ASN 829.A OD1 no hydrogen 2.945 N/A LEU 838.A N SER 885.A O no hydrogen 2.729 N/A CYS 840.A SG TRP 799.A O no hydrogen 3.560 N/A GLN 844.A N LYS 802.A O no hydrogen 2.820 N/A CYS 845.A SG TRP 799.A O no hydrogen 4.023 N/A LEU 846.A N TRP 799.A O no hydrogen 2.846 N/A LYS 847.A N ASP 825.A OD1 no hydrogen 2.937 N/A LYS 847.A N ASP 825.A OD2 no hydrogen 3.217 N/A ILE 848.A N LEU 797.A O no hydrogen 2.887 N/A VAL 849.A N THR 823.A O no hydrogen 2.972 N/A CYS 850.A N LEU 795.A O no hydrogen 2.687 N/A GLN 851.A N ASN 821.A O no hydrogen 3.024 N/A VAL 852.A N ALA 793.A O no hydrogen 2.596 N/A GLY 853.A N PRO 819.A O no hydrogen 2.753 N/A ARG 854.A NE ASP 856.A OD1 no hydrogen 3.107 N/A ARG 854.A NH2 GLU 706.A OE1 no hydrogen 3.324 N/A LEU 855.A N PHE 790.A O no hydrogen 3.063 N/A SER 860.A OG GLU 781.A OE1 no hydrogen 3.046 N/A ALA 861.A N LEU 782.A O no hydrogen 2.777 N/A ILE 862.A N ASP 817.A O no hydrogen 2.877 N/A LEU 863.A N TYR 780.A O no hydrogen 2.858 N/A TYR 864.A N ASP 815.A O no hydrogen 2.792 N/A VAL 865.A N HIS 778.A O no hydrogen 2.926 N/A LYS 866.A N HIS 813.A O no hydrogen 3.015 N/A SER 867.A N VAL 776.A O no hydrogen 2.903 N/A SER 867.A OG VAL 776.A O no hydrogen 2.954 N/A LEU 868.A N TYR 810.A O no hydrogen 2.572 N/A LEU 869.A N PRO 774.A O no hydrogen 3.057 N/A TRP 870.A N LEU 808.A O no hydrogen 3.177 N/A TRP 870.A NE1 GLU 872.A OE2 no hydrogen 2.835 N/A THR 871.A N VAL 772.A O no hydrogen 3.104 N/A THR 871.A OG1 VAL 772.A O no hydrogen 2.782 N/A THR 873.A OG1 THR 807.A O no hydrogen 2.683 N/A THR 873.A OG1 TRP 870.A O no hydrogen 2.815 N/A ASN 876.A ND2 GLU 872.A O no hydrogen 2.767 N/A LYS 877.A N ASN 876.A OD1 no hydrogen 2.428 N/A ASN 879.A N ASN 876.A OD1 no hydrogen 3.436 N/A GLN 880.A NE2 ASN 876.A O no hydrogen 3.634 N/A SER 883.A OG HIS 836.A NE2 no hydrogen 2.703 N/A TYR 884.A N VAL 917.A O no hydrogen 3.354 N/A SER 885.A N HIS 836.A O no hydrogen 2.814 N/A SER 885.A OG THR 914.A OG1 no hydrogen 3.049 N/A SER 885.A OG ASN 916.A OD1 no hydrogen 2.882 N/A LEU 886.A N THR 915.A O no hydrogen 2.816 N/A LYS 887.A N LEU 838.A O no hydrogen 2.735 N/A SER 888.A N VAL 913.A O no hydrogen 2.884 N/A SER 888.A OG HIS 778.A ND1 no hydrogen 2.849 N/A SER 888.A OG TYR 780.A OH no hydrogen 2.279 N/A SER 888.A OG VAL 913.A O no hydrogen 3.427 N/A SER 889.A N GLN 798.A O no hydrogen 3.262 N/A ALA 890.A N THR 911.A O no hydrogen 3.034 N/A SER 891.A N HIS 796.A O no hydrogen 3.006 N/A PHE 892.A N ASN 909.A O no hydrogen 3.084 N/A ASN 893.A N MET 794.A O no hydrogen 2.923 N/A VAL 894.A N ILE 907.A O no hydrogen 3.002 N/A ILE 895.A N LYS 792.A O no hydrogen 3.092 N/A GLU 896.A N LYS 792.A O no hydrogen 3.335 N/A TYR 899.A OH SER 789.A OG no hydrogen 3.166 N/A THR 908.A OG1 ASN 893.A OD1 no hydrogen 3.302 N/A ASN 909.A N PHE 892.A O no hydrogen 3.475 N/A SER 910.A N ASN 909.A OD1 no hydrogen 2.947 N/A THR 911.A N ALA 890.A O no hydrogen 3.188 N/A VAL 913.A N SER 888.A O no hydrogen 2.646 N/A THR 914.A OG1 SER 885.A OG no hydrogen 3.049 N/A THR 914.A OG1 LEU 886.A O no hydrogen 3.554 N/A THR 914.A OG1 ASN 916.A OD1 no hydrogen 2.668 N/A THR 915.A N LEU 886.A O no hydrogen 2.718 N/A THR 915.A OG1 SER 748.A OG no hydrogen 2.495 N/A THR 915.A OG1 HIS 778.A NE2 no hydrogen 2.758 N/A ASN 916.A N ASP 751.A O no hydrogen 3.048 N/A VAL 917.A N TYR 884.A O no hydrogen 3.070 N/A THR 918.A N VAL 753.A O no hydrogen 3.271 N/A