Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5a1a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N MET 1.A O no hydrogen 2.222 N/A THR 3.A OG1 MET 1.A O no hydrogen 3.007 N/A SER 5.A N ILE 2.A O no hydrogen 3.230 N/A VAL 9.A N SER 5.A O no hydrogen 3.177 N/A LEU 10.A N LEU 6.A O no hydrogen 2.615 N/A GLN 11.A N ALA 7.A O no hydrogen 3.253 N/A GLY 19.A N ASN 17.A OD1 no hydrogen 3.116 N/A VAL 20.A N ASN 17.A O no hydrogen 3.188 N/A LEU 23.A N TYR 160.A O no hydrogen 2.558 N/A ARG 25.A NH1 GLN 162.A O no hydrogen 3.005 N/A ARG 25.A NH1 SER 168.A OG no hydrogen 3.110 N/A LEU 26.A N GLU 169.A O no hydrogen 2.725 N/A HIS 29.A ND1 PRO 30.A O no hydrogen 2.307 N/A SER 34.A N GLU 325.A OE2 no hydrogen 2.915 N/A SER 34.A OG HIS 215.A O no hydrogen 3.046 N/A TRP 35.A NE1 ARG 45.A O no hydrogen 2.464 N/A ARG 36.A NE SER 34.A O no hydrogen 3.413 N/A ARG 36.A NH1 HIS 215.A O no hydrogen 3.342 N/A SER 38.A OG GLU 313.A OE1 no hydrogen 3.241 N/A SER 38.A OG GLU 313.A OE2 no hydrogen 3.488 N/A ALA 41.A N ASN 37.A O no hydrogen 3.147 N/A ARG 42.A N SER 38.A O no hydrogen 2.979 N/A ARG 42.A NE GLU 39.A OE1 no hydrogen 3.162 N/A ARG 42.A NH1 GLU 39.A OE2 no hydrogen 2.307 N/A THR 43.A N GLU 39.A O no hydrogen 3.139 N/A THR 43.A OG1 GLU 39.A O no hydrogen 2.983 N/A ASP 44.A N ALA 41.A O no hydrogen 3.361 N/A ARG 45.A N GLU 40.A O no hydrogen 2.824 N/A SER 47.A OG ALA 33.A O no hydrogen 2.619 N/A GLN 49.A N SER 47.A OG no hydrogen 3.397 N/A ARG 51.A N LEU 213.A O no hydrogen 2.644 N/A ARG 51.A NH2 ASN 127.A O no hydrogen 3.412 N/A LEU 53.A N VAL 211.A O no hydrogen 2.656 N/A ASN 54.A N SER 52.A OG no hydrogen 3.155 N/A ASN 54.A ND2 ASP 210.A OD1 no hydrogen 3.199 N/A GLY 55.A N VAL 85.A O no hydrogen 3.105 N/A TRP 57.A N VAL 83.A O no hydrogen 3.100 N/A TRP 57.A NE1 LEU 53.A O no hydrogen 2.942 N/A ARG 58.A N SER 123.A O no hydrogen 3.005 N/A ARG 58.A NH1 THR 82.A OG1 no hydrogen 2.913 N/A PHE 59.A N ASP 81.A O no hydrogen 2.434 N/A ALA 60.A N CYS 121.A O no hydrogen 3.033 N/A PHE 62.A N THR 119.A O no hydrogen 2.702 N/A ALA 67.A N ALA 64.A O no hydrogen 3.086 N/A TRP 72.A N PRO 69.A O no hydrogen 3.477 N/A LEU 73.A N GLU 70.A O no hydrogen 3.461 N/A CYS 75.A N SER 71.A O no hydrogen 3.407 N/A CYS 75.A SG SER 71.A O no hydrogen 3.728 N/A CYS 75.A SG ASP 76.A O no hydrogen 4.006 N/A ALA 80.A N LEU 77.A O no hydrogen 3.279 N/A ASP 81.A N PHE 59.A O no hydrogen 2.608 N/A VAL 83.A N TRP 57.A O no hydrogen 3.161 N/A VAL 85.A N GLY 55.A O no hydrogen 2.916 N/A SER 87.A N ILE 207.A O no hydrogen 2.763 N/A SER 87.A OG VAL 84.A O no hydrogen 2.483 N/A SER 87.A OG HIS 92.A NE2 no hydrogen 3.383 N/A GLN 90.A NE2 SER 205.A OG no hydrogen 2.502 N/A MET 91.A N ASN 88.A O no hydrogen 3.227 N/A HIS 92.A N TRP 89.A O no hydrogen 3.134 N/A GLY 93.A N GLN 90.A O no hydrogen 3.215 N/A TYR 94.A N TRP 89.A O no hydrogen 3.217 N/A TYR 94.A OH ASP 81.A OD2 no hydrogen 3.304 N/A TYR 99.A N ASP 593.A OD2 no hydrogen 3.293 N/A TYR 99.A OH ASP 200.A OD1 no hydrogen 2.755 N/A THR 100.A OG1 THR 103.A O no hydrogen 3.167 N/A ASN 101.A N ASP 597.A OD1 no hydrogen 3.033 N/A TYR 104.A OH TYR 195.A O no hydrogen 2.601 N/A PHE 112.A N ASN 109.A O no hydrogen 2.806 N/A VAL 113.A N GLU 16.A OE2 no hydrogen 2.960 N/A ASN 117.A ND2 TRP 190.A O no hydrogen 3.644 N/A THR 119.A N PHE 62.A O no hydrogen 2.631 N/A THR 119.A OG1 ASN 117.A O no hydrogen 3.204 N/A GLY 120.A N VAL 187.A O no hydrogen 2.910 N/A CYS 121.A N ALA 60.A O no hydrogen 2.768 N/A TYR 122.A N VAL 185.A O no hydrogen 2.783 N/A SER 123.A N ARG 58.A O no hydrogen 2.956 N/A SER 123.A OG ARG 58.A O no hydrogen 3.052 N/A LEU 124.A N LEU 183.A O no hydrogen 3.225 N/A THR 125.A OG1 GLU 180.A OE2 no hydrogen 2.956 N/A PHE 126.A N ASN 181.A O no hydrogen 3.317 N/A TRP 132.A N ASP 129.A O no hydrogen 3.290 N/A LEU 133.A N GLU 130.A O no hydrogen 3.193 N/A GLN 137.A N LYS 216.A O no hydrogen 2.732 N/A THR 138.A N SER 173.A OG no hydrogen 2.801 N/A ARG 139.A N LEU 214.A O no hydrogen 2.954 N/A ARG 139.A NE GLN 137.A OE1 no hydrogen 3.331 N/A ARG 139.A NH1 GLU 169.A OE1 no hydrogen 3.550 N/A ARG 139.A NH2 GLN 137.A OE1 no hydrogen 2.684 N/A ILE 140.A N PHE 170.A O no hydrogen 2.827 N/A ILE 141.A N SER 212.A O no hydrogen 2.670 N/A PHE 142.A N SER 168.A O no hydrogen 2.816 N/A ASP 143.A N ASP 210.A O no hydrogen 2.956 N/A ASN 146.A N GLY 206.A O no hydrogen 3.432 N/A SER 147.A N LEU 188.A O no hydrogen 3.044 N/A SER 147.A OG LEU 188.A O no hydrogen 3.483 N/A SER 147.A OG ARG 189.A O no hydrogen 3.104 N/A PHE 149.A N GLY 161.A O no hydrogen 3.413 N/A HIS 150.A N MET 186.A O no hydrogen 3.284 N/A HIS 150.A NE2 ASP 14.A OD2 no hydrogen 2.759 N/A LEU 151.A N GLY 159.A O no hydrogen 3.078 N/A TRP 152.A N ALA 184.A O no hydrogen 2.695 N/A TRP 152.A NE1 ASP 4.A O no hydrogen 2.933 N/A CYS 153.A N ARG 156.A O no hydrogen 2.853 N/A ASN 154.A N ARG 182.A O no hydrogen 2.837 N/A ASN 154.A ND2 PHE 175.A O no hydrogen 2.740 N/A ASN 154.A ND2 ASN 181.A OD1 no hydrogen 2.590 N/A ARG 156.A N CYS 153.A O no hydrogen 3.101 N/A TRP 157.A N ASP 4.A OD1 no hydrogen 2.890 N/A VAL 158.A N LEU 151.A O no hydrogen 2.854 N/A TYR 160.A N LEU 23.A O no hydrogen 2.878 N/A GLY 161.A N PHE 149.A O no hydrogen 3.368 N/A GLN 162.A NE2 ASP 192.A OD1 no hydrogen 2.787 N/A SER 164.A OG VAL 145.A O no hydrogen 3.279 N/A ARG 165.A NH2 GLN 364.A OE1 no hydrogen 3.228 N/A SER 168.A N PHE 142.A O no hydrogen 2.683 N/A PHE 170.A N ILE 140.A O no hydrogen 2.977 N/A LEU 172.A N THR 138.A O no hydrogen 2.771 N/A SER 173.A N ASP 171.A OD1 no hydrogen 3.022 N/A SER 173.A OG ASP 171.A OD1 no hydrogen 2.877 N/A LEU 176.A N LEU 172.A O no hydrogen 3.093 N/A ARG 177.A N ASN 181.A OD1 no hydrogen 3.192 N/A ASN 181.A N PHE 126.A O no hydrogen 3.072 N/A ASN 181.A ND2 ARG 177.A O no hydrogen 2.897 N/A ARG 182.A N ASN 154.A OD1 no hydrogen 3.177 N/A ARG 182.A NE LEU 73.A O no hydrogen 3.318 N/A ARG 182.A NH2 LEU 73.A O no hydrogen 3.079 N/A LEU 183.A N LEU 124.A O no hydrogen 3.080 N/A ALA 184.A N TRP 152.A O no hydrogen 2.690 N/A VAL 185.A N TYR 122.A O no hydrogen 2.682 N/A MET 186.A N HIS 150.A O no hydrogen 3.098 N/A VAL 187.A N GLY 120.A O no hydrogen 2.818 N/A LEU 188.A N ALA 148.A O no hydrogen 2.605 N/A ARG 189.A N PRO 118.A O no hydrogen 3.254 N/A ARG 189.A NH1 ALA 96.A O no hydrogen 3.108 N/A ARG 189.A NH2 ALA 96.A O no hydrogen 3.392 N/A ARG 189.A NH2 ARG 203.A O no hydrogen 2.797 N/A SER 191.A N SER 194.A OG no hydrogen 3.219 N/A SER 191.A OG TRP 15.A O no hydrogen 3.152 N/A SER 191.A OG ASP 192.A OD1 no hydrogen 2.863 N/A ASP 192.A N TRP 15.A O no hydrogen 2.664 N/A SER 194.A N SER 191.A O no hydrogen 2.614 N/A SER 194.A OG SER 191.A O no hydrogen 2.969 N/A TYR 195.A N ASP 192.A O no hydrogen 3.323 N/A TYR 195.A OH PHE 112.A O no hydrogen 2.221 N/A LEU 196.A N GLY 193.A O no hydrogen 3.174 N/A GLU 197.A N SER 194.A O no hydrogen 3.033 N/A ASP 198.A N GLU 415.A O no hydrogen 2.911 N/A GLN 199.A NE2 HIS 390.A O no hydrogen 2.999 N/A GLN 199.A NE2 ASN 413.A OD1 no hydrogen 3.091 N/A TRP 202.A NE1 GLN 572.A O no hydrogen 2.935 N/A ARG 203.A N ILE 98.A O no hydrogen 2.622 N/A ARG 203.A NE MET 201.A O no hydrogen 3.275 N/A ARG 203.A NH1 ASP 198.A OD1 no hydrogen 2.400 N/A SER 205.A N GLN 90.A OE1 no hydrogen 2.635 N/A GLY 206.A N ASN 146.A O no hydrogen 3.066 N/A PHE 208.A N GLY 144.A O no hydrogen 3.209 N/A ARG 209.A N GLY 144.A O no hydrogen 3.314 N/A ARG 209.A NH1 PRO 392.A O no hydrogen 2.815 N/A ARG 209.A NH2 ARG 165.A O no hydrogen 2.924 N/A ARG 209.A NH2 PRO 392.A O no hydrogen 3.413 N/A VAL 211.A N ASN 54.A OD1 no hydrogen 2.916 N/A SER 212.A N ILE 141.A O no hydrogen 3.217 N/A LEU 213.A N ARG 51.A O no hydrogen 2.592 N/A LEU 214.A N ARG 139.A O no hydrogen 2.851 N/A HIS 215.A N GLN 49.A O no hydrogen 2.877 N/A HIS 215.A NE2 GLU 135.A O no hydrogen 2.532 N/A LYS 216.A N GLN 137.A O no hydrogen 2.704 N/A LYS 216.A NZ GLU 323.A OE2 no hydrogen 3.379 N/A THR 219.A OG1 GLU 248.A O no hydrogen 3.194 N/A GLN 220.A N CYS 246.A O no hydrogen 3.379 N/A ILE 221.A N GLU 323.A OE1 no hydrogen 2.871 N/A ASP 223.A N GLN 244.A O no hydrogen 3.190 N/A HIS 225.A N GLU 242.A O no hydrogen 2.648 N/A VAL 226.A N ASN 448.A OD1 no hydrogen 3.286 N/A ALA 227.A N GLU 240.A O no hydrogen 3.125 N/A THR 228.A OG1 ARG 332.A O no hydrogen 3.431 N/A ARG 229.A N VAL 238.A O no hydrogen 3.024 N/A ARG 229.A NH2 GLU 240.A OE1 no hydrogen 2.662 N/A ASN 231.A N ARG 236.A O no hydrogen 2.994 N/A ASN 231.A ND2 SER 235.A OG no hydrogen 2.819 N/A PHE 234.A N ASN 231.A O no hydrogen 2.861 N/A ARG 236.A N ASN 231.A OD1 no hydrogen 2.578 N/A ALA 237.A N VAL 294.A O no hydrogen 3.021 N/A VAL 238.A N ARG 229.A O no hydrogen 2.949 N/A LEU 239.A N LEU 292.A O no hydrogen 2.799 N/A ALA 241.A N LEU 290.A O no hydrogen 2.650 N/A VAL 243.A N VAL 288.A O no hydrogen 2.832 N/A GLN 244.A N ASP 223.A O no hydrogen 2.513 N/A GLN 244.A NE2 GLU 242.A OE2 no hydrogen 2.848 N/A CYS 246.A N GLN 220.A O no hydrogen 2.836 N/A ARG 254.A N HIS 315.A O no hydrogen 2.321 N/A ARG 254.A NH2 ASP 251.A O no hydrogen 3.313 N/A THR 256.A N GLU 313.A O no hydrogen 2.878 N/A THR 256.A OG1 THR 270.A OG1 no hydrogen 3.134 N/A THR 256.A OG1 HIS 315.A NE2 no hydrogen 2.343 N/A VAL 257.A N GLY 269.A O no hydrogen 2.834 N/A SER 258.A N VAL 311.A O no hydrogen 3.122 N/A LEU 259.A N ALA 267.A O no hydrogen 2.738 N/A TRP 260.A N ARG 309.A O no hydrogen 2.463 N/A TRP 260.A NE1 SER 258.A OG no hydrogen 2.964 N/A GLN 261.A N THR 264.A O no hydrogen 2.574 N/A THR 264.A N GLN 261.A O no hydrogen 3.346 N/A THR 264.A OG1 GLN 261.A O no hydrogen 2.731 N/A VAL 266.A N LEU 259.A O no hydrogen 2.838 N/A GLY 269.A N VAL 257.A O no hydrogen 2.674 N/A THR 270.A OG1 THR 256.A OG1 no hydrogen 3.134 N/A GLY 274.A N ARG 287.A O no hydrogen 2.614 N/A GLY 275.A N TYR 284.A O no hydrogen 2.531 N/A GLU 276.A N GLU 276.A OE1 no hydrogen 2.539 N/A ILE 278.A N GLY 282.A O no hydrogen 3.521 N/A GLU 280.A N GLU 280.A OE1 no hydrogen 2.986 N/A GLY 282.A N ASP 279.A O no hydrogen 3.106 N/A VAL 288.A N VAL 243.A O no hydrogen 3.074 N/A LEU 290.A N ALA 241.A O no hydrogen 2.788 N/A LEU 292.A N LEU 239.A O no hydrogen 2.784 N/A VAL 294.A N ALA 237.A O no hydrogen 2.788 N/A ASN 296.A N SER 235.A O no hydrogen 2.964 N/A LYS 298.A N TYR 308.A OH no hydrogen 3.138 N/A TRP 300.A N PHE 331.A O no hydrogen 2.674 N/A TRP 300.A NE1 ASP 402.A O no hydrogen 2.759 N/A SER 301.A N ILE 304.A O no hydrogen 2.899 N/A SER 301.A OG ILE 304.A O no hydrogen 2.974 N/A ILE 304.A N SER 301.A OG no hydrogen 2.932 N/A TYR 308.A N VAL 329.A O no hydrogen 2.621 N/A ARG 309.A N TRP 260.A O no hydrogen 2.781 N/A ARG 309.A NE ALA 41.A O no hydrogen 3.234 N/A ARG 309.A NH2 ALA 41.A O no hydrogen 2.713 N/A ARG 309.A NH2 ASP 44.A OD1 no hydrogen 3.094 N/A ALA 310.A N CYS 327.A O no hydrogen 2.754 N/A VAL 311.A N SER 258.A O no hydrogen 2.862 N/A VAL 312.A N GLU 325.A O no hydrogen 2.401 N/A GLU 313.A N THR 256.A O no hydrogen 3.070 N/A LEU 314.A N GLU 323.A O no hydrogen 2.799 N/A HIS 315.A N ARG 254.A O no hydrogen 2.743 N/A HIS 315.A ND1 THR 316.A O no hydrogen 3.187 N/A HIS 315.A NE2 THR 256.A OG1 no hydrogen 2.343 N/A THR 316.A N THR 320.A O no hydrogen 2.840 N/A THR 316.A OG1 THR 320.A O no hydrogen 3.323 N/A THR 316.A OG1 THR 320.A OG1 no hydrogen 3.108 N/A THR 320.A N THR 316.A OG1 no hydrogen 3.190 N/A THR 320.A OG1 THR 316.A OG1 no hydrogen 3.108 N/A ILE 322.A N LEU 314.A O no hydrogen 2.675 N/A GLU 323.A N LEU 314.A O no hydrogen 3.199 N/A ALA 324.A N TRP 35.A O no hydrogen 2.595 N/A GLU 325.A N VAL 312.A O no hydrogen 2.494 N/A CYS 327.A N ALA 310.A O no hydrogen 2.730 N/A CYS 327.A SG ASP 328.A O no hydrogen 3.485 N/A VAL 329.A N TYR 308.A O no hydrogen 2.543 N/A ARG 332.A NE PRO 450.A O no hydrogen 2.757 N/A ARG 332.A NH1 ARG 332.A O no hydrogen 3.410 N/A ARG 332.A NH2 PRO 450.A O no hydrogen 3.171 N/A ARG 332.A NH2 VAL 452.A O no hydrogen 2.699 N/A GLU 333.A N ASN 344.A OD1 no hydrogen 2.872 N/A ARG 335.A N LEU 342.A O no hydrogen 3.167 N/A GLU 337.A N LEU 340.A O no hydrogen 2.869 N/A LEU 340.A N GLU 337.A O no hydrogen 3.042 N/A LEU 341.A N GLN 562.A OE1 no hydrogen 3.039 N/A LEU 342.A N ARG 335.A O no hydrogen 2.983 N/A LEU 343.A N LYS 346.A O no hydrogen 2.784 N/A ASN 344.A N GLU 333.A O no hydrogen 3.054 N/A ASN 344.A ND2 TRP 300.A O no hydrogen 3.413 N/A LYS 346.A N LEU 343.A O no hydrogen 3.007 N/A ILE 350.A N GLN 562.A O no hydrogen 2.938 N/A ARG 351.A N ASN 384.A OD1 no hydrogen 3.120 N/A ARG 351.A NE GLN 623.A O no hydrogen 2.764 N/A GLY 352.A N GLY 564.A O no hydrogen 3.214 N/A VAL 353.A N ALA 385.A O no hydrogen 3.349 N/A ASN 354.A N VAL 566.A O no hydrogen 2.584 N/A ARG 355.A N ARG 387.A O no hydrogen 3.171 N/A ARG 355.A NE ASP 374.A OD2 no hydrogen 3.306 N/A GLU 357.A N TYR 391.A OH no hydrogen 2.913 N/A HIS 358.A NE2 SER 573.A O no hydrogen 3.007 N/A HIS 359.A N GLY 363.A O no hydrogen 2.399 N/A LEU 361.A N HIS 359.A ND1 no hydrogen 3.043 N/A HIS 362.A N HIS 359.A ND1 no hydrogen 3.098 N/A GLN 364.A NE2 TRP 202.A O no hydrogen 2.671 N/A VAL 365.A N HIS 362.A O no hydrogen 3.248 N/A VAL 372.A N GLU 368.A O no hydrogen 3.184 N/A GLN 373.A N GLN 369.A O no hydrogen 2.901 N/A ASP 374.A N THR 370.A O no hydrogen 3.161 N/A ILE 375.A N MET 371.A O no hydrogen 3.237 N/A LEU 376.A N VAL 372.A O no hydrogen 3.006 N/A LEU 377.A N GLN 373.A O no hydrogen 3.349 N/A MET 378.A N ASP 374.A O no hydrogen 2.974 N/A LYS 379.A N ILE 375.A O no hydrogen 3.054 N/A LYS 379.A NZ ALA 302.A O no hydrogen 3.159 N/A LYS 379.A NZ TYR 404.A O no hydrogen 3.479 N/A LYS 379.A NZ GLY 405.A O no hydrogen 2.976 N/A GLN 380.A N LEU 376.A O no hydrogen 2.873 N/A GLN 380.A NE2 TRP 707.A O no hydrogen 2.354 N/A ASN 381.A N MET 378.A O no hydrogen 3.039 N/A ASN 381.A ND2 LEU 377.A O no hydrogen 2.464 N/A ASN 382.A N LYS 379.A O no hydrogen 3.311 N/A ASN 382.A ND2 LYS 620.A O no hydrogen 2.383 N/A ASN 382.A ND2 SER 714.A O no hydrogen 3.189 N/A PHE 383.A N MET 378.A O no hydrogen 2.866 N/A ASN 384.A N ARG 351.A O no hydrogen 3.222 N/A ASN 384.A ND2 LEU 349.A O no hydrogen 3.469 N/A VAL 386.A N TYR 407.A O no hydrogen 2.663 N/A ARG 387.A N VAL 353.A O no hydrogen 3.148 N/A ARG 387.A NH1 GLU 536.A OE2 no hydrogen 2.861 N/A CYS 388.A SG TYR 391.A O no hydrogen 4.043 N/A CYS 388.A SG VAL 409.A O no hydrogen 3.185 N/A CYS 388.A SG ASP 410.A OD1 no hydrogen 3.432 N/A SER 389.A N ARG 355.A O no hydrogen 3.416 N/A HIS 390.A NE2 GLU 536.A OE2 no hydrogen 3.372 N/A TYR 391.A OH HIS 356.A ND1 no hydrogen 3.349 N/A ASN 393.A N TYR 398.A OH no hydrogen 2.861 N/A TRP 397.A N HIS 394.A O no hydrogen 2.960 N/A TYR 398.A OH ASP 410.A OD1 no hydrogen 2.522 N/A THR 399.A OG1 PRO 395.A O no hydrogen 3.300 N/A LEU 400.A N LEU 396.A O no hydrogen 2.976 N/A CYS 401.A N TRP 397.A O no hydrogen 3.107 N/A CYS 401.A SG TRP 397.A O no hydrogen 3.188 N/A ASP 402.A N TYR 398.A O no hydrogen 3.025 N/A ASP 402.A N THR 399.A O no hydrogen 3.199 N/A ARG 403.A N THR 399.A O no hydrogen 3.341 N/A TYR 404.A N LEU 400.A O no hydrogen 2.999 N/A GLY 405.A N CYS 401.A O no hydrogen 2.963 N/A LEU 406.A N CYS 401.A O no hydrogen 3.062 N/A TYR 407.A N ASN 384.A O no hydrogen 2.698 N/A VAL 408.A N SER 451.A O no hydrogen 2.917 N/A VAL 409.A N VAL 386.A O no hydrogen 3.273 N/A ASP 410.A N ILE 454.A O no hydrogen 2.921 N/A ALA 412.A N SER 456.A O no hydrogen 2.956 N/A ASN 413.A ND2 ASP 163.A OD1 no hydrogen 2.732 N/A ILE 414.A N ALA 412.A O no hydrogen 2.965 N/A GLU 415.A N LEU 196.A O no hydrogen 2.474 N/A THR 416.A N SER 461.A OG no hydrogen 3.293 N/A THR 416.A OG1 MET 422.A O no hydrogen 2.731 N/A ASN 423.A ND2 HIS 463.A O no hydrogen 2.901 N/A ARG 424.A N PRO 421.A O no hydrogen 3.144 N/A ARG 424.A NE VAL 420.A O no hydrogen 2.811 N/A ARG 424.A NH2 VAL 420.A O no hydrogen 2.937 N/A THR 426.A OG1 SER 461.A O no hydrogen 2.978 N/A ASP 427.A N ASN 423.A O no hydrogen 2.937 N/A ASP 428.A N LEU 425.A O no hydrogen 3.139 N/A ARG 430.A N ASP 428.A OD1 no hydrogen 3.020 N/A TRP 431.A N ASP 428.A O no hydrogen 3.051 N/A LEU 432.A N PRO 429.A O no hydrogen 3.266 N/A MET 435.A N TRP 431.A O no hydrogen 3.249 N/A SER 436.A N LEU 432.A O no hydrogen 2.998 N/A SER 436.A OG LEU 432.A O no hydrogen 3.199 N/A SER 436.A OG PRO 433.A O no hydrogen 2.846 N/A ARG 438.A N MET 435.A O no hydrogen 3.146 N/A ARG 438.A NE ASN 413.A O no hydrogen 2.886 N/A ARG 438.A NH1 GLY 193.A O no hydrogen 3.318 N/A ARG 438.A NH1 ASN 413.A O no hydrogen 3.024 N/A VAL 439.A N SER 436.A O no hydrogen 3.044 N/A THR 440.A N SER 436.A O no hydrogen 2.696 N/A THR 440.A OG1 SER 436.A O no hydrogen 2.792 N/A MET 442.A N VAL 439.A O no hydrogen 3.197 N/A VAL 443.A N VAL 439.A O no hydrogen 3.179 N/A GLN 444.A N THR 440.A O no hydrogen 3.115 N/A ARG 445.A N MET 442.A O no hydrogen 3.173 N/A ARG 445.A NE ASP 446.A OD2 no hydrogen 3.376 N/A ARG 445.A NH1 ASN 393.A O no hydrogen 2.815 N/A ARG 445.A NH1 ASP 446.A OD2 no hydrogen 3.274 N/A ASP 446.A N MET 442.A O no hydrogen 3.065 N/A ARG 447.A NH2 VAL 477.A O no hydrogen 2.957 N/A ARG 447.A NH2 ASP 478.A OD1 no hydrogen 3.253 N/A ASN 448.A ND2 PHE 224.A O no hydrogen 3.495 N/A HIS 449.A ND1 ASP 402.A OD2 no hydrogen 3.004 N/A SER 451.A N ASP 402.A OD1 no hydrogen 2.798 N/A SER 451.A OG TYR 398.A O no hydrogen 3.354 N/A SER 451.A OG ASP 402.A OD1 no hydrogen 2.844 N/A ILE 453.A N VAL 408.A O no hydrogen 2.968 N/A TRP 455.A N PRO 482.A O no hydrogen 3.172 N/A TRP 455.A NE1 ASP 478.A OD2 no hydrogen 3.367 N/A SER 456.A N ASP 410.A O no hydrogen 2.860 N/A SER 456.A OG GLY 458.A O no hydrogen 3.549 N/A LEU 457.A N GLN 484.A O no hydrogen 3.376 N/A ASN 459.A N ILE 414.A O no hydrogen 3.004 N/A ASN 459.A ND2 GLU 415.A OE1 no hydrogen 2.877 N/A SER 461.A OG ILE 414.A O no hydrogen 3.408 N/A SER 461.A OG ASN 459.A O no hydrogen 3.254 N/A ALA 465.A N ASP 427.A OD1 no hydrogen 2.873 N/A ASN 466.A N THR 426.A O no hydrogen 3.276 N/A ASN 466.A ND2 ASP 428.A O no hydrogen 3.114 N/A HIS 467.A N GLY 464.A O no hydrogen 3.318 N/A ALA 469.A N ALA 465.A O no hydrogen 3.151 N/A LEU 470.A N ASN 466.A O no hydrogen 2.869 N/A TYR 471.A N HIS 467.A O no hydrogen 2.720 N/A TYR 471.A OH ASP 496.A OD1 no hydrogen 2.236 N/A ARG 472.A N ASP 468.A O no hydrogen 3.054 N/A ARG 472.A NE ARG 472.A O no hydrogen 3.053 N/A TRP 473.A N ALA 469.A O no hydrogen 3.029 N/A ILE 474.A N LEU 470.A O no hydrogen 3.301 N/A LYS 475.A N TYR 471.A O no hydrogen 3.238 N/A LYS 475.A NZ ASP 496.A OD2 no hydrogen 3.037 N/A SER 476.A N ARG 472.A O no hydrogen 3.068 N/A VAL 477.A N TRP 473.A O no hydrogen 2.936 N/A ASP 478.A N ILE 474.A O no hydrogen 2.706 N/A ARG 481.A NE VAL 452.A O no hydrogen 2.818 N/A ARG 481.A NH1 ARG 447.A O no hydrogen 3.154 N/A ARG 481.A NH1 ASP 478.A OD2 no hydrogen 3.315 N/A ARG 481.A NH2 ARG 447.A O no hydrogen 2.867 N/A ARG 481.A NH2 HIS 449.A O no hydrogen 2.648 N/A ARG 481.A NH2 VAL 452.A O no hydrogen 3.535 N/A VAL 483.A N ASP 496.A OD2 no hydrogen 2.756 N/A GLN 484.A N TRP 455.A O no hydrogen 3.025 N/A TYR 485.A OH GLY 462.A O no hydrogen 2.280 N/A THR 492.A OG1 GLY 487.A O no hydrogen 3.558 N/A THR 495.A OG1 ILE 497.A O no hydrogen 2.244 N/A ASP 496.A N VAL 483.A O no hydrogen 2.514 N/A ILE 497.A N THR 495.A OG1 no hydrogen 3.123 N/A ILE 498.A N PRO 531.A O no hydrogen 2.865 N/A CYS 499.A SG ILE 497.A O no hydrogen 3.981 N/A TYR 502.A N GLU 536.A O no hydrogen 2.708 N/A ARG 504.A NH1 ASP 996.A OD2 no hydrogen 3.246 N/A ARG 504.A NH1 PRO 1000.A O no hydrogen 3.249 N/A ARG 504.A NH2 GLU 507.A OE2 no hydrogen 3.388 N/A ARG 504.A NH2 PRO 1000.A O no hydrogen 3.514 N/A VAL 514.A N PRO 512.A O no hydrogen 2.511 N/A LYS 516.A N GLN 509.A O no hydrogen 3.142 N/A LYS 516.A NZ MET 501.A O no hydrogen 2.999 N/A SER 518.A OG VAL 505.A O no hydrogen 2.380 N/A ILE 519.A N ARG 504.A O no hydrogen 3.025 N/A LYS 520.A N SER 518.A OG no hydrogen 3.104 N/A LYS 520.A NZ ASP 506.A OD1 no hydrogen 3.533 N/A LYS 521.A N SER 518.A OG no hydrogen 3.395 N/A LYS 521.A NZ ASP 508.A OD2 no hydrogen 3.256 N/A TRP 522.A N SER 518.A O no hydrogen 2.658 N/A SER 524.A N LYS 521.A O no hydrogen 2.987 N/A SER 524.A OG LYS 520.A O no hydrogen 3.228 N/A LEU 525.A N TRP 522.A O no hydrogen 3.489 N/A GLU 528.A N LEU 525.A O no hydrogen 3.039 N/A ARG 530.A NH1 THR 492.A O no hydrogen 2.672 N/A ARG 530.A NH1 THR 495.A O no hydrogen 2.965 N/A ARG 530.A NH2 ASP 491.A O no hydrogen 2.852 N/A LEU 532.A N ARG 560.A O no hydrogen 2.973 N/A ILE 533.A N ILE 498.A O no hydrogen 2.871 N/A LEU 534.A N GLY 563.A O no hydrogen 3.336 N/A CYS 535.A SG CYS 499.A O no hydrogen 3.460 N/A TYR 537.A N PHE 565.A O no hydrogen 3.170 N/A HIS 539.A N ASP 995.A O no hydrogen 3.213 N/A HIS 539.A ND1 SER 997.A OG no hydrogen 2.392 N/A ALA 540.A N TRP 567.A O no hydrogen 2.731 N/A ASN 543.A ND2 GLU 933.A O no hydrogen 3.124 N/A SER 544.A OG HIS 539.A O no hydrogen 3.041 N/A SER 544.A OG MET 541.A O no hydrogen 2.793 N/A GLY 546.A N GLY 993.A O no hydrogen 2.901 N/A GLY 547.A N ASP 907.A O no hydrogen 2.967 N/A LYS 550.A N GLY 547.A O no hydrogen 3.174 N/A LYS 550.A NZ SER 1003.A OG no hydrogen 2.624 N/A LYS 550.A NZ GLU 1005.A OE2 no hydrogen 3.045 N/A TYR 551.A OH ALA 503.A O no hydrogen 2.276 N/A TYR 551.A OH ASP 995.A OD2 no hydrogen 2.904 N/A GLN 553.A N ALA 549.A O no hydrogen 3.015 N/A ALA 554.A N LYS 550.A O no hydrogen 3.135 N/A PHE 555.A N TYR 551.A O no hydrogen 2.809 N/A ARG 556.A N TRP 552.A O no hydrogen 3.400 N/A ARG 556.A NE GLU 640.A OE1 no hydrogen 3.264 N/A ARG 556.A NE GLU 640.A OE2 no hydrogen 2.702 N/A ARG 556.A NH1 TRP 552.A O no hydrogen 3.419 N/A ARG 556.A NH1 GLN 622.A O no hydrogen 2.993 N/A ARG 556.A NH2 GLN 622.A O no hydrogen 2.841 N/A ARG 556.A NH2 GLN 624.A O no hydrogen 3.164 N/A ARG 556.A NH2 GLU 640.A OE1 no hydrogen 3.170 N/A GLN 557.A N GLN 553.A O no hydrogen 3.255 N/A TYR 558.A N ALA 554.A O no hydrogen 2.992 N/A ARG 560.A NH1 LEU 523.A O no hydrogen 2.356 N/A ARG 560.A NH2 ARG 530.A O no hydrogen 2.871 N/A LEU 561.A N TYR 558.A O no hydrogen 3.113 N/A GLN 562.A N LEU 532.A O no hydrogen 3.295 N/A GLN 562.A NE2 LEU 341.A O no hydrogen 2.501 N/A GLN 562.A NE2 LEU 348.A O no hydrogen 3.392 N/A GLY 564.A N ILE 350.A O no hydrogen 3.055 N/A PHE 565.A N LEU 534.A O no hydrogen 2.599 N/A VAL 566.A N GLY 352.A O no hydrogen 2.923 N/A TRP 567.A N TYR 537.A O no hydrogen 3.278 N/A TRP 567.A NE1 ASN 603.A OD1 no hydrogen 3.203 N/A ASP 568.A N ASN 603.A O no hydrogen 2.517 N/A ASP 571.A N VAL 606.A O no hydrogen 3.174 N/A GLN 572.A N CYS 601.A O no hydrogen 3.381 N/A LEU 574.A N ALA 586.A O no hydrogen 2.856 N/A ILE 575.A N PRO 360.A O no hydrogen 3.137 N/A LYS 576.A N TRP 584.A O no hydrogen 2.838 N/A ASP 578.A N ASN 582.A O no hydrogen 2.912 N/A GLU 579.A N GLU 579.A OE1 no hydrogen 2.460 N/A GLY 581.A N ASP 578.A O no hydrogen 3.039 N/A ASN 582.A N ASN 582.A OD1 no hydrogen 2.405 N/A TRP 584.A N LYS 576.A O no hydrogen 2.675 N/A ALA 586.A N LEU 574.A O no hydrogen 2.450 N/A TYR 587.A N ASP 590.A OD2 no hydrogen 2.773 N/A TYR 587.A OH SER 970.A O no hydrogen 2.291 N/A ASP 590.A N TYR 587.A O no hydrogen 3.205 N/A ARG 598.A NH1 GLY 793.A O no hydrogen 2.998 N/A ARG 598.A NH2 GLN 599.A OE1 no hydrogen 3.059 N/A GLN 599.A N GLN 599.A OE1 no hydrogen 2.727 N/A GLN 599.A NE2 ASP 789.A OD1 no hydrogen 2.673 N/A PHE 600.A N ASP 597.A O no hydrogen 3.205 N/A CYS 601.A SG GLN 572.A O no hydrogen 3.628 N/A CYS 601.A SG ARG 598.A O no hydrogen 3.762 N/A MET 602.A N GLN 599.A O no hydrogen 3.124 N/A ASN 603.A ND2 PHE 600.A O no hydrogen 2.835 N/A GLY 604.A N ASP 571.A OD1 no hydrogen 2.511 N/A VAL 606.A N TRP 569.A O no hydrogen 2.862 N/A PHE 607.A N THR 611.A O no hydrogen 2.483 N/A ASP 609.A N ASP 609.A OD1 no hydrogen 2.414 N/A ARG 610.A NE ALA 608.A O no hydrogen 3.517 N/A ARG 610.A NH1 ASP 374.A OD1 no hydrogen 2.991 N/A ARG 610.A NH2 HIS 358.A O no hydrogen 3.084 N/A THR 611.A N ASP 609.A OD1 no hydrogen 2.665 N/A THR 611.A OG1 ASP 609.A OD2 no hydrogen 2.394 N/A HIS 613.A N LEU 605.A O no hydrogen 3.013 N/A LEU 616.A N HIS 613.A O no hydrogen 3.056 N/A GLU 618.A N ALA 615.A O no hydrogen 3.199 N/A ALA 619.A N ALA 615.A O no hydrogen 3.227 N/A LYS 620.A N LEU 616.A O no hydrogen 3.178 N/A LYS 620.A NZ GLN 380.A O no hydrogen 3.477 N/A LYS 620.A NZ ILE 713.A O no hydrogen 2.829 N/A HIS 621.A N THR 617.A O no hydrogen 3.171 N/A GLN 622.A N GLU 618.A O no hydrogen 3.123 N/A GLN 622.A NE2 THR 910.A OG1 no hydrogen 2.776 N/A GLN 623.A N ALA 619.A O no hydrogen 3.001 N/A GLN 624.A NE2 PHE 626.A O no hydrogen 3.120 N/A GLN 624.A NE2 TRP 716.A O no hydrogen 3.392 N/A GLN 627.A N THR 638.A O no hydrogen 2.829 N/A GLN 627.A NE2 GLN 624.A O no hydrogen 2.916 N/A ARG 629.A N GLU 636.A O no hydrogen 3.105 N/A ARG 629.A NH2 GLU 636.A OE2 no hydrogen 2.532 N/A SER 631.A N THR 634.A O no hydrogen 2.954 N/A GLN 633.A NE2 PRO 682.A O no hydrogen 3.173 N/A ILE 635.A N ILE 679.A O no hydrogen 2.628 N/A VAL 637.A N GLN 677.A O no hydrogen 2.830 N/A THR 638.A N GLN 627.A O no hydrogen 3.152 N/A SER 639.A N GLY 675.A O no hydrogen 2.965 N/A GLU 640.A N PHE 625.A O no hydrogen 2.656 N/A TYR 641.A N SER 639.A OG no hydrogen 3.262 N/A LEU 642.A N GLU 303.A OE2 no hydrogen 2.796 N/A PHE 643.A N GLU 303.A OE1 no hydrogen 2.724 N/A ARG 644.A N GLU 303.A OE1 no hydrogen 3.153 N/A ARG 644.A NH1 GLU 649.A OE2 no hydrogen 3.001 N/A ARG 644.A NH2 ASP 647.A OD1 no hydrogen 2.710 N/A ARG 644.A NH2 GLU 649.A OE2 no hydrogen 3.186 N/A SER 646.A N VAL 671.A O no hydrogen 3.025 N/A SER 646.A OG VAL 671.A O no hydrogen 3.555 N/A ASP 647.A N HIS 645.A O no hydrogen 2.655 N/A ASN 648.A ND2 ASN 703.A O no hydrogen 2.893 N/A LEU 650.A N VAL 700.A O no hydrogen 2.667 N/A LEU 651.A N VAL 667.A O no hydrogen 2.701 N/A HIS 652.A N ARG 698.A O no hydrogen 2.817 N/A TRP 653.A N GLY 665.A O no hydrogen 3.024 N/A MET 654.A N THR 696.A O no hydrogen 2.668 N/A VAL 655.A N ALA 663.A O no hydrogen 2.761 N/A ALA 656.A N TRP 694.A O no hydrogen 3.033 N/A LEU 657.A N LYS 660.A O no hydrogen 3.029 N/A LYS 660.A N LEU 657.A O no hydrogen 2.843 N/A LEU 662.A N VAL 655.A O no hydrogen 2.624 N/A ALA 663.A N VAL 655.A O no hydrogen 3.171 N/A GLY 665.A N TRP 653.A O no hydrogen 3.080 N/A VAL 667.A N LEU 651.A O no hydrogen 2.620 N/A LEU 669.A N GLU 649.A O no hydrogen 3.205 N/A GLN 674.A NE2 TYR 641.A O no hydrogen 3.073 N/A GLY 675.A N ALA 672.A O no hydrogen 2.946 N/A GLN 677.A N VAL 637.A O no hydrogen 2.798 N/A ILE 679.A N ILE 635.A O no hydrogen 2.598 N/A LEU 681.A N GLN 633.A O no hydrogen 3.347 N/A GLU 683.A N GLU 683.A OE1 no hydrogen 2.526 N/A GLY 691.A N ASN 724.A O no hydrogen 3.037 N/A GLN 692.A NE2 LEU 693.A O no hydrogen 2.371 N/A GLN 692.A NE2 LEU 721.A O no hydrogen 2.672 N/A TRP 694.A N ALA 656.A O no hydrogen 2.728 N/A LEU 695.A N TRP 719.A O no hydrogen 3.103 N/A THR 696.A N MET 654.A O no hydrogen 2.823 N/A VAL 697.A N GLN 717.A O no hydrogen 2.771 N/A ARG 698.A N HIS 652.A O no hydrogen 2.680 N/A VAL 699.A N ALA 715.A O no hydrogen 2.543 N/A VAL 700.A N LEU 650.A O no hydrogen 2.713 N/A GLN 701.A N HIS 712.A O no hydrogen 2.710 N/A ASN 703.A N ASN 648.A OD1 no hydrogen 3.026 N/A THR 705.A N SER 708.A O no hydrogen 2.805 N/A THR 705.A OG1 GLN 701.A OE1 no hydrogen 3.557 N/A THR 705.A OG1 SER 708.A OG no hydrogen 3.284 N/A SER 708.A N THR 705.A O no hydrogen 3.358 N/A SER 708.A OG GLN 701.A OE1 no hydrogen 3.162 N/A GLY 711.A N GLN 701.A O no hydrogen 2.651 N/A SER 714.A N VAL 699.A O no hydrogen 2.954 N/A SER 714.A OG VAL 699.A O no hydrogen 3.444 N/A TRP 716.A N GLN 624.A OE1 no hydrogen 3.095 N/A TRP 716.A NE1 ALA 911.A O no hydrogen 3.181 N/A GLN 717.A N VAL 697.A O no hydrogen 2.838 N/A GLN 717.A NE2 GLN 718.A O no hydrogen 3.602 N/A GLN 718.A NE2 PHE 914.A O no hydrogen 2.668 N/A TRP 719.A N LEU 695.A O no hydrogen 2.721 N/A LEU 721.A N LEU 693.A O no hydrogen 3.310 N/A ASN 724.A N GLY 691.A O no hydrogen 2.837 N/A SER 726.A OG THR 728.A OG1 no hydrogen 2.663 N/A THR 728.A OG1 SER 726.A OG no hydrogen 2.663 N/A HIS 738.A N GLU 749.A O no hydrogen 2.834 N/A THR 740.A N CYS 747.A O no hydrogen 2.620 N/A SER 742.A N ASP 745.A O no hydrogen 3.320 N/A SER 742.A OG ASP 745.A O no hydrogen 3.077 N/A ASP 745.A N SER 742.A OG no hydrogen 3.365 N/A PHE 746.A N PHE 757.A O no hydrogen 2.563 N/A CYS 747.A N THR 740.A O no hydrogen 3.242 N/A CYS 747.A SG GLU 749.A OE2 no hydrogen 3.828 N/A ILE 748.A N TRP 755.A O no hydrogen 2.549 N/A GLU 749.A N HIS 738.A O no hydrogen 2.525 N/A LEU 750.A N LYS 753.A O no hydrogen 2.847 N/A LYS 753.A N LEU 750.A O no hydrogen 3.001 N/A ARG 754.A N TRP 768.A O no hydrogen 3.277 N/A TRP 755.A N ILE 748.A O no hydrogen 2.588 N/A GLN 756.A N GLN 766.A O no hydrogen 2.884 N/A PHE 757.A N PHE 746.A O no hydrogen 2.590 N/A ASN 758.A N PHE 763.A O no hydrogen 2.995 N/A ARG 759.A NH2 SER 742.A O no hydrogen 2.688 N/A GLN 760.A N ASN 758.A OD1 no hydrogen 2.809 N/A GLY 762.A N ASN 758.A O no hydrogen 2.891 N/A PHE 763.A N SER 761.A OG no hydrogen 3.422 N/A SER 765.A N GLN 756.A O no hydrogen 2.927 N/A GLN 766.A N GLN 756.A O no hydrogen 3.473 N/A GLN 766.A NE2 MET 767.A O no hydrogen 3.019 N/A GLN 766.A NE2 LEU 775.A O no hydrogen 3.084 N/A LEU 776.A N GLN 886.A O no hydrogen 2.772 N/A THR 777.A N GLN 886.A O no hydrogen 3.272 N/A THR 777.A OG1 GLN 886.A OE1 no hydrogen 2.782 N/A ARG 780.A N ASN 884.A O no hydrogen 3.090 N/A GLN 782.A N GLY 882.A O no hydrogen 2.846 N/A ARG 785.A NH2 ASP 791.A OD2 no hydrogen 3.551 N/A ALA 786.A N GLN 963.A OE1 no hydrogen 2.734 N/A ASN 790.A ND2 MET 541.A O no hydrogen 3.538 N/A ASN 790.A ND2 SER 544.A OG no hydrogen 3.113 N/A ILE 792.A N LEU 788.A O no hydrogen 2.891 N/A GLY 793.A N ASP 789.A O no hydrogen 3.015 N/A SER 795.A N ILE 792.A O no hydrogen 3.370 N/A SER 795.A OG GLU 807.A OE2 no hydrogen 3.276 N/A GLU 796.A N ARG 799.A O no hydrogen 2.794 N/A ASN 803.A N ASP 801.A OD1 no hydrogen 3.487 N/A ASN 803.A ND2 ASP 801.A OD1 no hydrogen 3.462 N/A VAL 806.A N ASP 791.A O no hydrogen 3.264 N/A ARG 808.A N ALA 804.A O no hydrogen 3.102 N/A TRP 809.A N TRP 805.A O no hydrogen 2.993 N/A TRP 809.A NE1 HIS 877.A O no hydrogen 2.935 N/A LYS 810.A N VAL 806.A O no hydrogen 3.103 N/A ALA 811.A N GLU 807.A O no hydrogen 3.017 N/A ALA 812.A N ARG 808.A O no hydrogen 3.065 N/A GLY 813.A N TRP 809.A O no hydrogen 3.116 N/A HIS 814.A N TRP 809.A O no hydrogen 3.093 N/A HIS 814.A NE2 THR 875.A OG1 no hydrogen 2.663 N/A TYR 815.A OH ARG 785.A O no hydrogen 2.910 N/A ALA 817.A N HIS 814.A O no hydrogen 3.341 N/A ALA 820.A N ALA 840.A O no hydrogen 2.764 N/A LEU 822.A N ALA 838.A O no hydrogen 3.397 N/A GLN 823.A N ALA 838.A O no hydrogen 3.438 N/A THR 825.A N THR 836.A O no hydrogen 2.885 N/A THR 825.A OG1 THR 836.A O no hydrogen 3.238 N/A ASP 827.A N LEU 834.A O no hydrogen 2.874 N/A VAL 833.A N ILE 857.A O no hydrogen 3.166 N/A LEU 834.A N ASP 827.A O no hydrogen 2.940 N/A ILE 835.A N TYR 855.A O no hydrogen 2.850 N/A THR 836.A N THR 825.A O no hydrogen 3.107 N/A THR 837.A N LYS 853.A O no hydrogen 2.693 N/A THR 837.A OG1 LYS 853.A O no hydrogen 3.495 N/A ALA 838.A N GLN 823.A O no hydrogen 2.997 N/A HIS 839.A N SER 851.A O no hydrogen 2.543 N/A HIS 839.A NE2 SER 761.A O no hydrogen 2.341 N/A ALA 840.A N ALA 820.A O no hydrogen 3.112 N/A TRP 841.A N PHE 849.A O no hydrogen 2.883 N/A HIS 843.A N LYS 846.A O no hydrogen 2.751 N/A LYS 846.A N HIS 843.A O no hydrogen 3.126 N/A LEU 848.A N TRP 841.A O no hydrogen 2.573 N/A ILE 850.A N GLU 870.A O no hydrogen 2.948 N/A SER 851.A N HIS 839.A O no hydrogen 2.882 N/A SER 851.A OG ASP 781.A OD2 no hydrogen 2.399 N/A ARG 852.A N ASP 868.A O no hydrogen 2.964 N/A LYS 853.A N THR 837.A O no hydrogen 2.725 N/A LYS 853.A NZ ASP 781.A OD1 no hydrogen 2.557 N/A LYS 853.A NZ TYR 855.A OH no hydrogen 3.176 N/A THR 854.A N THR 866.A O no hydrogen 3.112 N/A THR 854.A OG1 THR 854.A O no hydrogen 2.585 N/A ARG 856.A N ALA 864.A O no hydrogen 2.955 N/A ILE 857.A N VAL 833.A O no hydrogen 2.665 N/A ASP 858.A N GLN 862.A O no hydrogen 2.901 N/A GLY 861.A N ASP 858.A O no hydrogen 3.060 N/A MET 863.A N TRP 1019.A O no hydrogen 2.480 N/A ALA 864.A N ARG 856.A O no hydrogen 2.864 N/A ILE 865.A N LEU 1017.A O no hydrogen 2.781 N/A VAL 867.A N TYR 1015.A O no hydrogen 2.906 N/A ASP 868.A N ARG 852.A O no hydrogen 2.911 N/A VAL 869.A N TYR 1013.A O no hydrogen 2.606 N/A GLU 870.A N ILE 850.A O no hydrogen 2.926 N/A VAL 871.A N GLY 1011.A O no hydrogen 2.418 N/A ALA 872.A N LEU 848.A O no hydrogen 3.098 N/A THR 875.A OG1 PRO 876.A O no hydrogen 3.336 N/A ARG 880.A NH1 ASN 957.A OD1 no hydrogen 3.526 N/A ILE 881.A N PHE 988.A O no hydrogen 2.872 N/A LEU 883.A N ILE 985.A O no hydrogen 2.624 N/A ASN 884.A N ARG 780.A O no hydrogen 2.952 N/A CYS 885.A N LEU 983.A O no hydrogen 2.977 N/A GLN 886.A NE2 GLU 979.A O no hydrogen 2.326 N/A GLN 886.A NE2 GLU 979.A OE2 no hydrogen 3.448 N/A LEU 887.A N THR 981.A O no hydrogen 2.604 N/A ALA 888.A N GLN 774.A O no hydrogen 3.195 N/A ARG 893.A NE ASP 918.A OD1 no hydrogen 3.037 N/A ARG 893.A NH1 ASP 918.A OD1 no hydrogen 3.100 N/A VAL 894.A N LEU 919.A O no hydrogen 2.562 N/A ASN 895.A N ASN 944.A O no hydrogen 3.055 N/A TRP 896.A N TRP 917.A O no hydrogen 2.837 N/A LEU 897.A N GLU 942.A O no hydrogen 2.663 N/A GLY 898.A N ASP 915.A O no hydrogen 3.251 N/A LEU 899.A N CYS 938.A O no hydrogen 3.156 N/A GLY 900.A N CYS 913.A O no hydrogen 3.006 N/A ASN 904.A N LEU 936.A O no hydrogen 2.605 N/A ASN 904.A ND2 LEU 899.A O no hydrogen 3.185 N/A ASN 904.A ND2 GLN 902.A O no hydrogen 2.876 N/A TYR 905.A N ARG 908.A O no hydrogen 2.906 N/A TYR 905.A OH GLU 933.A OE2 no hydrogen 2.976 N/A ARG 908.A N TYR 905.A O no hydrogen 2.766 N/A ARG 908.A NH1 SER 544.A O no hydrogen 2.733 N/A ARG 908.A NH2 GLU 903.A OE2 no hydrogen 3.093 N/A THR 910.A OG1 GLU 618.A OE1 no hydrogen 3.077 N/A THR 910.A OG1 GLU 618.A OE2 no hydrogen 2.446 N/A ALA 911.A N GLU 618.A OE1 no hydrogen 3.193 N/A ALA 912.A N LEU 909.A O no hydrogen 3.146 N/A CYS 913.A N GLY 900.A O no hydrogen 2.945 N/A CYS 913.A SG ALA 911.A O no hydrogen 3.636 N/A PHE 914.A N GLN 718.A OE1 no hydrogen 2.643 N/A ASP 915.A N GLY 898.A O no hydrogen 3.099 N/A TRP 917.A N TRP 896.A O no hydrogen 2.732 N/A TRP 917.A NE1 CYS 913.A O no hydrogen 2.860 N/A LEU 919.A N VAL 894.A O no hydrogen 2.909 N/A LEU 921.A N GLU 892.A O no hydrogen 3.179 N/A ASP 923.A N PRO 920.A O no hydrogen 3.116 N/A MET 924.A N LEU 921.A O no hydrogen 3.197 N/A TYR 925.A N SER 922.A O no hydrogen 3.265 N/A THR 926.A OG1 GLU 903.A OE1 no hydrogen 2.587 N/A TYR 928.A N THR 926.A O no hydrogen 2.917 N/A TYR 928.A OH GLU 903.A OE2 no hydrogen 2.524 N/A GLU 933.A N ALA 786.A O no hydrogen 3.291 N/A GLY 935.A N GLU 903.A OE1 no hydrogen 2.500 N/A ARG 937.A N PHE 956.A O no hydrogen 2.713 N/A ARG 937.A NE PRO 901.A O no hydrogen 2.721 N/A ARG 937.A NH2 PRO 901.A O no hydrogen 3.021 N/A ARG 937.A NH2 ASP 923.A O no hydrogen 3.489 N/A CYS 938.A N ASN 904.A OD1 no hydrogen 2.614 N/A CYS 938.A SG ASN 904.A O no hydrogen 3.155 N/A THR 940.A N PHE 954.A O no hydrogen 3.000 N/A THR 940.A OG1 ARG 937.A O no hydrogen 3.481 N/A ARG 941.A N LEU 897.A O no hydrogen 2.642 N/A GLU 942.A N LEU 897.A O no hydrogen 3.432 N/A LEU 943.A N TRP 950.A O no hydrogen 2.817 N/A ASN 944.A N ASN 895.A O no hydrogen 2.545 N/A ASN 944.A ND2 ASN 895.A O no hydrogen 3.655 N/A ASN 944.A ND2 GLU 942.A OE1 no hydrogen 2.474 N/A TYR 945.A N HIS 948.A O no hydrogen 3.263 N/A TYR 945.A OH ALA 891.A O no hydrogen 3.036 N/A HIS 948.A N TYR 945.A O no hydrogen 3.157 N/A GLN 949.A N CYS 1020.A O no hydrogen 2.869 N/A GLN 949.A NE2 GLU 942.A OE1 no hydrogen 2.804 N/A TRP 950.A N LEU 943.A O no hydrogen 2.917 N/A ARG 951.A N VAL 1018.A O no hydrogen 3.063 N/A ARG 951.A NH1 GLN 862.A OE1 no hydrogen 2.666 N/A PHE 954.A N THR 940.A O no hydrogen 2.924 N/A GLN 955.A N ASP 986.A O no hydrogen 2.882 N/A GLN 955.A NE2 GLY 987.A O no hydrogen 3.562 N/A PHE 956.A N ARG 937.A O no hydrogen 3.079 N/A ASN 957.A ND2 ASN 934.A O no hydrogen 3.688 N/A SER 959.A N TRP 982.A O no hydrogen 2.761 N/A SER 959.A OG ASN 957.A O no hydrogen 3.518 N/A SER 959.A OG TYR 961.A O no hydrogen 3.138 N/A ARG 960.A NE GLU 978.A O no hydrogen 3.170 N/A ARG 960.A NH1 GLU 978.A O no hydrogen 2.870 N/A SER 962.A OG GLU 978.A OE1 no hydrogen 3.376 N/A SER 962.A OG GLU 978.A OE2 no hydrogen 2.627 N/A GLN 963.A NE2 ASN 984.A OD1 no hydrogen 3.554 N/A GLN 965.A N SER 962.A OG no hydrogen 3.354 N/A GLN 965.A NE2 HIS 976.A O no hydrogen 2.840 N/A LEU 966.A N SER 962.A O no hydrogen 3.293 N/A THR 969.A N GLN 965.A O no hydrogen 3.042 N/A THR 969.A OG1 GLN 965.A O no hydrogen 2.250 N/A SER 970.A OG HIS 971.A ND1 no hydrogen 2.868 N/A HIS 971.A ND1 SER 970.A OG no hydrogen 2.868 N/A HIS 971.A NE2 ASP 590.A OD2 no hydrogen 2.607 N/A ARG 972.A NH1 PRO 927.A O no hydrogen 3.143 N/A GLU 978.A N ARG 960.A O no hydrogen 3.046 N/A THR 981.A N LEU 887.A O no hydrogen 2.485 N/A THR 981.A OG1 LEU 887.A O no hydrogen 3.427 N/A THR 981.A OG1 GLN 889.A O no hydrogen 3.108 N/A TRP 982.A N SER 959.A O no hydrogen 2.675 N/A TRP 982.A NE1 GLU 978.A OE1 no hydrogen 2.312 N/A LEU 983.A N CYS 885.A O no hydrogen 2.876 N/A ILE 985.A N LEU 883.A O no hydrogen 2.748 N/A ASP 986.A N GLN 955.A O no hydrogen 2.780 N/A PHE 988.A N ILE 881.A O no hydrogen 3.154 N/A MET 990.A N ALA 879.A O no hydrogen 2.763 N/A GLY 991.A N PHE 1006.A O no hydrogen 3.341 N/A GLY 993.A N ASP 907.A OD2 no hydrogen 3.086 N/A SER 997.A OG HIS 539.A ND1 no hydrogen 2.392 N/A SER 999.A N ASP 996.A OD1 no hydrogen 2.948 N/A SER 999.A OG ASP 996.A OD1 no hydrogen 2.416 N/A SER 999.A OG ASP 996.A OD2 no hydrogen 3.062 N/A SER 1001.A OG ASP 996.A O no hydrogen 3.026 N/A SER 1001.A OG SER 999.A O no hydrogen 3.547 N/A SER 1003.A OG GLU 1005.A OE1 no hydrogen 2.848 N/A SER 1003.A OG GLU 1005.A OE2 no hydrogen 2.766 N/A GLU 1005.A N GLU 1005.A OE1 no hydrogen 2.696 N/A GLN 1007.A N ALA 1004.A O no hydrogen 3.278 N/A GLN 1007.A NE2 VAL 1002.A O no hydrogen 2.972 N/A GLN 1007.A NE2 SER 1003.A O no hydrogen 3.548 N/A ALA 1010.A N TYR 1013.A OH no hydrogen 3.190 N/A TYR 1013.A N VAL 869.A O no hydrogen 2.588 N/A TYR 1015.A N VAL 867.A O no hydrogen 2.978 N/A LEU 1017.A N ILE 865.A O no hydrogen 3.052 N/A VAL 1018.A N ARG 951.A O no hydrogen 3.192 N/A TRP 1019.A N MET 863.A O no hydrogen 2.427 N/A CYS 1020.A N GLN 949.A O no hydrogen 3.001 N/A CYS 1020.A SG GLN 1021.A O no hydrogen 3.208 N/A GLN 1021.A NE2 HIS 948.A ND1 no hydrogen 3.127 N/A LYS 1022.A N PRO 947.A O no hydrogen 2.353 N/A