Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6j6g_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A ND1 PRO 3.A O no hydrogen 3.311 N/A LYS 6.A NZ HIS 2.A NE2 no hydrogen 3.368 N/A GLU 7.A N GLY 5.A O no hydrogen 2.771 N/A SER 19.A OG THR 22.A OG1 no hydrogen 2.297 N/A GLN 21.A N GLN 21.A OE1 no hydrogen 2.731 N/A THR 22.A N SER 19.A O no hydrogen 3.272 N/A THR 22.A OG1 SER 19.A O no hydrogen 3.359 N/A THR 22.A OG1 SER 19.A OG no hydrogen 2.297 N/A THR 29.A OG1 THR 29.A O no hydrogen 2.625 N/A HIS 37.A N LEU 34.A O no hydrogen 3.100 N/A HIS 37.A ND1 SER 584.A OG no hydrogen 3.077 N/A THR 38.A N LEU 34.A O no hydrogen 3.028 N/A ILE 39.A N ASN 114.A O no hydrogen 2.810 N/A THR 41.A N ARG 470.A O no hydrogen 2.952 N/A THR 41.A OG1 LEU 43.A O no hydrogen 3.462 N/A GLN 42.A NE2 THR 32.A O no hydrogen 3.405 N/A ILE 47.A N LYS 44.A O no hydrogen 3.368 N/A THR 50.A OG1 TYR 52.A O no hydrogen 2.367 N/A ARG 51.A N SER 91.A O no hydrogen 2.831 N/A TYR 52.A OH SER 91.A OG no hydrogen 3.208 N/A ARG 54.A NH2 PRO 48.A O no hydrogen 2.836 N/A TYR 56.A OH SER 141.A OG no hydrogen 3.324 N/A LEU 58.A N ARG 54.A O no hydrogen 3.438 N/A SER 59.A N ASP 55.A O no hydrogen 2.918 N/A MET 60.A N MET 57.A O no hydrogen 3.093 N/A ALA 61.A N LEU 58.A O no hydrogen 3.268 N/A ILE 68.A N MET 143.A O no hydrogen 3.272 N/A ASN 69.A N ASP 167.A OD2 no hydrogen 3.215 N/A ASN 69.A ND2 GLY 481.A O no hydrogen 2.790 N/A VAL 70.A N ASN 145.A O no hydrogen 3.256 N/A GLY 71.A N LEU 168.A O no hydrogen 3.195 N/A VAL 72.A N LEU 147.A O no hydrogen 2.742 N/A ILE 73.A N LEU 170.A O no hydrogen 3.402 N/A SER 78.A OG VAL 172.A O no hydrogen 2.501 N/A LYS 80.A NZ PRO 75.A O no hydrogen 2.401 N/A THR 81.A OG1 SER 124.A OG no hydrogen 2.991 N/A THR 81.A OG1 ASP 148.A OD2 no hydrogen 3.553 N/A LEU 83.A N GLY 79.A O no hydrogen 3.124 N/A MET 84.A N LYS 80.A O no hydrogen 3.174 N/A ASP 85.A N THR 81.A O no hydrogen 3.032 N/A LEU 86.A N SER 82.A O no hydrogen 3.402 N/A VAL 88.A N MET 84.A O no hydrogen 2.972 N/A ILE 89.A N ASP 85.A O no hydrogen 3.226 N/A SER 91.A N VAL 88.A O no hydrogen 3.024 N/A SER 91.A OG TYR 52.A OH no hydrogen 3.208 N/A HIS 92.A N VAL 88.A O no hydrogen 2.945 N/A HIS 92.A ND1 VAL 88.A O no hydrogen 2.630 N/A HIS 92.A NE2 TYR 471.A OH no hydrogen 2.927 N/A LYS 93.A N LYS 49.A O no hydrogen 2.971 N/A MET 98.A N ILE 95.A O no hydrogen 3.331 N/A VAL 102.A N SER 99.A O no hydrogen 3.225 N/A GLU 103.A N SER 99.A O no hydrogen 2.844 N/A LEU 104.A N LYS 100.A O no hydrogen 3.192 N/A TRP 106.A N ASN 101.A O no hydrogen 3.276 N/A LYS 107.A N ASN 101.A O no hydrogen 3.351 N/A LEU 109.A N ASP 85.A OD2 no hydrogen 3.163 N/A ARG 110.A NH1 GLU 118.A O no hydrogen 3.264 N/A ARG 110.A NH1 ILE 119.A O no hydrogen 3.235 N/A ARG 110.A NH2 ASP 113.A OD2 no hydrogen 2.903 N/A ARG 110.A NH2 GLU 118.A O no hydrogen 2.963 N/A ASP 113.A N ARG 110.A O no hydrogen 3.151 N/A LEU 115.A N GLU 118.A OE1 no hydrogen 3.449 N/A LYS 116.A N HIS 37.A O no hydrogen 2.728 N/A ILE 119.A N LEU 115.A O no hydrogen 3.067 N/A ASP 120.A N LYS 116.A O no hydrogen 3.189 N/A ARG 121.A N GLN 117.A O no hydrogen 2.773 N/A GLY 122.A N GLU 118.A O no hydrogen 3.087 N/A LEU 123.A N GLU 118.A O no hydrogen 3.290 N/A SER 124.A OG THR 81.A OG1 no hydrogen 2.991 N/A SER 124.A OG ASP 113.A OD1 no hydrogen 2.662 N/A SER 124.A OG ASP 113.A OD2 no hydrogen 3.249 N/A ILE 125.A N GLU 118.A OE2 no hydrogen 2.806 N/A LYS 126.A N GLU 118.A OE2 no hydrogen 2.733 N/A LYS 126.A NZ TYR 550.A O no hydrogen 2.785 N/A LEU 127.A N GLU 158.A OE1 no hydrogen 3.135 N/A ASN 128.A ND2 LEU 112.A O no hydrogen 2.759 N/A ASN 128.A ND2 GLY 469.A O no hydrogen 3.639 N/A GLY 129.A N ASN 128.A OD1 no hydrogen 2.606 N/A SER 130.A N PHE 146.A O no hydrogen 3.371 N/A THR 131.A N LEU 467.A O no hydrogen 3.165 N/A LEU 132.A N ILE 144.A O no hydrogen 2.933 N/A LEU 133.A N TYR 52.A OH no hydrogen 3.282 N/A CYS 134.A N ARG 142.A O no hydrogen 2.924 N/A SER 139.A N ASP 136.A O no hydrogen 3.063 N/A SER 139.A OG SER 139.A O no hydrogen 2.510 N/A LYS 140.A N ASP 136.A OD1 no hydrogen 2.863 N/A ARG 142.A N CYS 134.A O no hydrogen 2.932 N/A ILE 144.A N LEU 132.A O no hydrogen 2.806 N/A ASN 145.A N ILE 68.A O no hydrogen 3.122 N/A ASN 145.A ND2 ASN 69.A OD1 no hydrogen 2.708 N/A PHE 146.A N SER 130.A O no hydrogen 3.253 N/A ASP 148.A N ASN 128.A O no hydrogen 3.102 N/A ALA 149.A N VAL 72.A O no hydrogen 2.740 N/A PHE 155.A N HIS 152.A O no hydrogen 3.074 N/A GLU 158.A N PHE 155.A O no hydrogen 3.177 N/A ALA 162.A N GLU 158.A O no hydrogen 3.295 N/A LEU 163.A N THR 159.A O no hydrogen 2.709 N/A ALA 164.A N ALA 160.A O no hydrogen 3.193 N/A ALA 165.A N VAL 161.A O no hydrogen 2.898 N/A SER 166.A N ALA 162.A O no hydrogen 3.321 N/A SER 166.A OG ALA 162.A O no hydrogen 2.755 N/A ASP 167.A N ASN 69.A O no hydrogen 2.429 N/A LEU 168.A N ASN 69.A O no hydrogen 3.239 N/A VAL 169.A N ALA 196.A O no hydrogen 2.814 N/A LEU 170.A N GLY 71.A O no hydrogen 2.916 N/A ILE 171.A N CYS 198.A O no hydrogen 2.883 N/A VAL 172.A N ILE 73.A O no hydrogen 2.847 N/A ILE 173.A N VAL 200.A O no hydrogen 2.552 N/A VAL 175.A N ASN 202.A O no hydrogen 2.983 N/A GLY 178.A N ASP 174.A O no hydrogen 3.107 N/A THR 180.A OG1 ASP 777.A OD2 no hydrogen 2.838 N/A THR 180.A OG1 GLU 813.A OE2 no hydrogen 2.769 N/A PHE 181.A N THR 180.A OG1 no hydrogen 2.674 N/A PHE 181.A N GLU 813.A OE2 no hydrogen 3.094 N/A VAL 183.A N THR 180.A O no hydrogen 3.105 N/A GLU 184.A N THR 180.A O no hydrogen 3.322 N/A LEU 186.A N VAL 182.A O no hydrogen 3.408 N/A ILE 187.A N VAL 183.A O no hydrogen 3.036 N/A LYS 188.A N GLU 184.A O no hydrogen 2.958 N/A GLN 189.A N GLN 185.A O no hydrogen 2.628 N/A SER 190.A OG LEU 186.A O no hydrogen 2.782 N/A ILE 191.A N ILE 187.A O no hydrogen 3.240 N/A LYS 192.A N LYS 188.A O no hydrogen 3.232 N/A ASN 193.A N GLN 189.A O no hydrogen 2.876 N/A ASN 194.A N ILE 191.A O no hydrogen 3.351 N/A ASN 194.A ND2 ASN 385.A O no hydrogen 3.098 N/A VAL 195.A N SER 190.A O no hydrogen 3.076 N/A ALA 196.A N ASP 167.A O no hydrogen 3.391 N/A CYS 198.A N VAL 169.A O no hydrogen 2.931 N/A CYS 198.A SG ASN 244.A O no hydrogen 3.262 N/A PHE 199.A N ASN 244.A O no hydrogen 3.003 N/A VAL 200.A N ILE 171.A O no hydrogen 2.785 N/A ILE 201.A N ILE 246.A O no hydrogen 2.875 N/A ASN 202.A N ILE 173.A O no hydrogen 2.511 N/A ASN 202.A ND2 SER 78.A O no hydrogen 2.809 N/A LYS 203.A N ASN 202.A OD1 no hydrogen 2.638 N/A LYS 203.A NZ HIS 77.A O no hydrogen 2.865 N/A LEU 204.A N ALA 248.A O no hydrogen 3.362 N/A ASP 205.A N SER 249.A OG no hydrogen 3.126 N/A ARG 206.A N LYS 203.A O no hydrogen 3.106 N/A ARG 206.A NE ASP 210.A OD2 no hydrogen 3.230 N/A ILE 208.A N ASP 205.A O no hydrogen 3.088 N/A LEU 209.A N ASP 205.A O no hydrogen 2.443 N/A LEU 211.A N ARG 206.A O no hydrogen 2.827 N/A LYS 212.A NZ LEU 209.A O no hydrogen 2.892 N/A ALA 218.A N PRO 214.A O no hydrogen 2.926 N/A TYR 219.A N PRO 215.A O no hydrogen 3.161 N/A LEU 220.A N MET 216.A O no hydrogen 3.047 N/A LYS 221.A NZ VAL 175.A O no hydrogen 2.529 N/A LEU 222.A N ALA 218.A O no hydrogen 3.055 N/A ASN 223.A N TYR 219.A O no hydrogen 2.916 N/A ASN 223.A ND2 ASN 223.A O no hydrogen 2.798 N/A HIS 224.A N LEU 220.A O no hydrogen 3.133 N/A HIS 224.A N LYS 221.A O no hydrogen 3.271 N/A ILE 225.A N LYS 221.A O no hydrogen 3.289 N/A ILE 226.A N LEU 222.A O no hydrogen 3.210 N/A ALA 227.A N ASN 223.A O no hydrogen 3.210 N/A ASN 228.A N ILE 225.A O no hydrogen 2.902 N/A ASN 228.A ND2 ASN 228.A O no hydrogen 2.764 N/A ILE 229.A N ILE 225.A O no hydrogen 2.855 N/A ASN 230.A N ILE 226.A O no hydrogen 3.202 N/A ASN 230.A ND2 PHE 238.A O no hydrogen 3.125 N/A SER 231.A OG ASN 228.A O no hydrogen 3.257 N/A THR 233.A N ILE 229.A O no hydrogen 3.195 N/A THR 233.A OG1 ILE 229.A O no hydrogen 3.267 N/A PHE 238.A N ASN 230.A OD1 no hydrogen 2.655 N/A ILE 246.A N PHE 199.A O no hydrogen 2.983 N/A PHE 247.A N PHE 256.A O no hydrogen 2.747 N/A ALA 248.A N ILE 201.A O no hydrogen 2.858 N/A SER 249.A N PHE 254.A O no hydrogen 3.226 N/A THR 250.A N ASN 202.A OD1 no hydrogen 3.207 N/A THR 250.A OG1 ASN 202.A OD1 no hydrogen 2.607 N/A GLY 253.A N THR 250.A O no hydrogen 3.001 N/A THR 255.A OG1 PHE 247.A O no hydrogen 3.070 N/A PHE 256.A N PHE 247.A O no hydrogen 2.752 N/A LYS 259.A NZ ASP 371.A OD2 no hydrogen 3.391 N/A GLU 260.A N THR 257.A OG1 no hydrogen 3.062 N/A PHE 261.A N THR 257.A O no hydrogen 3.356 N/A VAL 262.A N ILE 258.A O no hydrogen 3.206 N/A SER 263.A N LYS 259.A O no hydrogen 3.166 N/A SER 263.A OG LYS 259.A O no hydrogen 3.052 N/A SER 263.A OG GLU 260.A O no hydrogen 2.876 N/A TYR 264.A N GLU 260.A O no hydrogen 3.139 N/A TYR 264.A OH GLU 260.A OE2 no hydrogen 2.915 N/A TYR 265.A N PHE 261.A O no hydrogen 3.370 N/A TYR 266.A N VAL 262.A O no hydrogen 2.969 N/A TYR 266.A OH PHE 310.A O no hydrogen 2.765 N/A LYS 274.A N PRO 271.A O no hydrogen 2.892 N/A PHE 278.A N LYS 274.A O no hydrogen 2.794 N/A THR 280.A OG1 ASP 277.A O no hydrogen 2.720 N/A ARG 281.A N ASP 277.A O no hydrogen 3.379 N/A TYR 287.A N ARG 294.A O no hydrogen 2.557 N/A HIS 289.A N ASN 292.A O no hydrogen 3.432 N/A ARG 294.A N TYR 287.A O no hydrogen 2.874 N/A ARG 294.A NH2 GLU 299.A OE1 no hydrogen 3.141 N/A GLU 299.A N GLU 299.A OE1 no hydrogen 2.695 N/A LYS 303.A NZ GLU 309.A OE2 no hydrogen 3.083 N/A THR 306.A N VAL 286.A O no hydrogen 3.015 N/A THR 306.A OG1 VAL 286.A O no hydrogen 2.312 N/A GLU 309.A N PRO 305.A O no hydrogen 2.982 N/A PHE 310.A N THR 306.A O no hydrogen 3.110 N/A ILE 311.A N PHE 307.A O no hydrogen 3.123 N/A LEU 312.A N PHE 307.A O no hydrogen 3.171 N/A ILE 313.A N VAL 308.A O no hydrogen 2.718 N/A LEU 315.A N ILE 311.A O no hydrogen 2.835 N/A TYR 316.A N LEU 312.A O no hydrogen 2.799 N/A LYS 317.A N ILE 313.A O no hydrogen 3.167 N/A LYS 317.A NZ TYR 321.A OH no hydrogen 3.205 N/A ILE 318.A N PRO 314.A O no hydrogen 3.292 N/A PHE 319.A N LEU 315.A O no hydrogen 3.056 N/A SER 320.A N TYR 316.A O no hydrogen 2.811 N/A TYR 321.A N LYS 317.A O no hydrogen 2.847 N/A ALA 322.A N ILE 318.A O no hydrogen 3.168 N/A SER 324.A N SER 320.A O no hydrogen 3.039 N/A SER 324.A OG SER 320.A O no hydrogen 3.561 N/A MET 325.A N TYR 321.A O no hydrogen 3.024 N/A GLU 326.A N GLU 326.A OE1 no hydrogen 2.803 N/A LYS 327.A NZ LEU 347.A O no hydrogen 3.228 N/A LEU 330.A N GLU 326.A O no hydrogen 2.784 N/A LYS 331.A N LYS 327.A O no hydrogen 3.346 N/A LEU 334.A N LEU 330.A O no hydrogen 3.183 N/A SER 336.A N ASN 332.A O no hydrogen 3.120 N/A SER 336.A OG ASN 332.A O no hydrogen 2.749 N/A ASN 337.A N LEU 333.A O no hydrogen 3.258 N/A ASN 337.A ND2 LEU 333.A O no hydrogen 3.673 N/A PHE 338.A N LEU 334.A O no hydrogen 3.143 N/A VAL 340.A N LEU 334.A O no hydrogen 2.705 N/A GLU 345.A N SER 343.A OG no hydrogen 3.181 N/A PHE 354.A N ASP 350.A O no hydrogen 2.911 N/A LEU 355.A N PRO 351.A O no hydrogen 3.185 N/A LYS 356.A N GLN 352.A O no hydrogen 3.052 N/A HIS 357.A N PRO 353.A O no hydrogen 2.855 N/A VAL 358.A N PHE 354.A O no hydrogen 3.115 N/A LEU 359.A N LEU 355.A O no hydrogen 3.265 N/A GLN 360.A N LYS 356.A O no hydrogen 2.898 N/A LEU 361.A N HIS 357.A O no hydrogen 3.098 N/A LEU 361.A N VAL 358.A O no hydrogen 3.077 N/A ILE 362.A N VAL 358.A O no hydrogen 2.814 N/A GLN 366.A NE2 ASP 90.A OD2 no hydrogen 3.197 N/A THR 367.A OG1 GLU 260.A OE2 no hydrogen 3.249 N/A THR 367.A OG1 TYR 264.A OH no hydrogen 2.582 N/A VAL 370.A N GLN 366.A O no hydrogen 3.260 N/A ASP 371.A N THR 367.A O no hydrogen 3.074 N/A ALA 372.A N GLY 368.A O no hydrogen 3.306 N/A ILE 373.A N LEU 369.A O no hydrogen 3.041 N/A THR 374.A N VAL 370.A O no hydrogen 2.735 N/A THR 374.A OG1 VAL 370.A O no hydrogen 2.974 N/A ARG 375.A N ASP 371.A O no hydrogen 2.907 N/A CYS 376.A N ALA 372.A O no hydrogen 3.112 N/A CYS 376.A SG ASN 244.A OD1 no hydrogen 3.235 N/A CYS 376.A SG ALA 372.A O no hydrogen 3.181 N/A GLU 381.A N GLN 378.A O no hydrogen 3.286 N/A LEU 382.A N GLN 378.A O no hydrogen 3.219 N/A PHE 383.A N PRO 379.A O no hydrogen 3.382 N/A ASN 385.A ND2 GLU 381.A O no hydrogen 3.104 N/A LYS 386.A N LEU 382.A O no hydrogen 2.759 N/A LYS 386.A NZ LEU 163.A O no hydrogen 3.045 N/A LYS 386.A NZ ALA 164.A O no hydrogen 2.983 N/A LYS 386.A NZ SER 166.A O no hydrogen 3.227 N/A THR 387.A N PHE 383.A O no hydrogen 3.244 N/A THR 387.A OG1 PHE 383.A O no hydrogen 2.814 N/A ALA 388.A N ASP 384.A O no hydrogen 3.120 N/A HIS 389.A N LYS 386.A O no hydrogen 3.296 N/A LEU 390.A N LYS 386.A O no hydrogen 3.195 N/A SER 391.A N THR 387.A O no hydrogen 3.070 N/A SER 391.A OG THR 387.A O no hydrogen 2.765 N/A THR 397.A OG1 THR 401.A OG1 no hydrogen 2.650 N/A THR 401.A N PRO 398.A O no hydrogen 3.210 N/A THR 401.A OG1 THR 397.A OG1 no hydrogen 2.650 N/A THR 401.A OG1 PRO 398.A O no hydrogen 2.573 N/A LEU 402.A N SER 501.A O no hydrogen 3.277 N/A TRP 403.A N SER 424.A O no hydrogen 3.021 N/A ALA 404.A N LEU 499.A O no hydrogen 2.684 N/A HIS 405.A N ARG 421.A O no hydrogen 2.631 N/A VAL 406.A N ALA 497.A O no hydrogen 3.069 N/A LEU 407.A N LEU 419.A O no hydrogen 2.501 N/A LYS 408.A NZ THR 409.A O no hydrogen 3.247 N/A THR 409.A OG1 TYR 493.A OH no hydrogen 2.914 N/A VAL 410.A N TRP 417.A O no hydrogen 2.844 N/A TYR 412.A OH ASN 128.A OD1 no hydrogen 3.210 N/A TRP 417.A N VAL 410.A O no hydrogen 2.826 N/A SER 418.A N ILE 486.A O no hydrogen 2.973 N/A SER 418.A OG TYR 493.A OH no hydrogen 2.853 N/A LEU 419.A N LYS 408.A O no hydrogen 2.754 N/A VAL 420.A N VAL 484.A O no hydrogen 3.203 N/A ARG 421.A N HIS 405.A O no hydrogen 2.729 N/A ARG 421.A NH2 ASP 167.A OD1 no hydrogen 2.484 N/A TYR 423.A N TRP 403.A O no hydrogen 2.769 N/A SER 424.A N TRP 403.A O no hydrogen 3.004 N/A SER 424.A OG TYR 423.A O no hydrogen 2.697 N/A LEU 427.A N ALA 478.A O no hydrogen 3.319 N/A LYS 428.A N ASP 431.A OD2 no hydrogen 2.839 N/A LYS 428.A NZ GLU 477.A OE1 no hydrogen 2.496 N/A ARG 429.A N HIS 476.A O no hydrogen 2.958 N/A ARG 429.A NH1 HIS 476.A ND1 no hydrogen 3.062 N/A ARG 429.A NH2 HIS 476.A ND1 no hydrogen 3.106 N/A GLY 430.A N VAL 461.A O no hydrogen 2.724 N/A ASP 431.A N LYS 428.A O no hydrogen 3.484 N/A VAL 433.A N CYS 459.A O no hydrogen 3.293 N/A ARG 434.A N TYR 500.A O no hydrogen 2.817 N/A ILE 435.A N PRO 457.A O no hydrogen 3.245 N/A LEU 436.A N THR 498.A O no hydrogen 2.881 N/A THR 438.A OG1 SER 496.A OG no hydrogen 2.830 N/A GLN 440.A N ASP 437.A O no hydrogen 3.034 N/A SER 441.A N THR 438.A O no hydrogen 3.051 N/A SER 441.A OG THR 438.A O no hydrogen 2.544 N/A SER 441.A OG PHE 514.A O no hydrogen 2.602 N/A SER 443.A OG GLN 440.A O no hydrogen 3.110 N/A ARG 444.A N GLN 440.A O no hydrogen 3.198 N/A ARG 444.A NH1 THR 456.A OG1 no hydrogen 3.052 N/A ARG 444.A NH2 TYR 500.A OH no hydrogen 3.528 N/A GLN 445.A N SER 441.A O no hydrogen 3.329 N/A LYS 446.A N GLU 442.A O no hydrogen 3.309 N/A ARG 447.A N SER 443.A O no hydrogen 2.674 N/A GLN 448.A N GLN 445.A O no hydrogen 3.343 N/A GLN 448.A NE2 MET 508.A O no hydrogen 3.311 N/A GLN 448.A NE2 LYS 509.A O no hydrogen 2.500 N/A GLN 448.A NE2 LEU 511.A O no hydrogen 2.492 N/A GLU 452.A N GLU 455.A OE2 no hydrogen 2.981 N/A THR 456.A OG1 TYR 500.A OH no hydrogen 2.695 N/A CYS 459.A N VAL 433.A O no hydrogen 3.377 N/A VAL 461.A N ASP 431.A O no hydrogen 2.910 N/A GLU 462.A N LYS 487.A O no hydrogen 2.983 N/A GLY 465.A N LEU 485.A O no hydrogen 2.822 N/A LEU 466.A N TYR 473.A O no hydrogen 2.865 N/A GLY 468.A N TYR 471.A O no hydrogen 3.042 N/A ARG 470.A NE TYR 111.A O no hydrogen 2.922 N/A ARG 470.A NH1 ASP 97.A OD2 no hydrogen 2.814 N/A ARG 470.A NH2 ARG 110.A O no hydrogen 3.179 N/A TYR 471.A OH HIS 92.A NE2 no hydrogen 2.927 N/A TYR 473.A N LEU 466.A O no hydrogen 3.079 N/A VAL 475.A N ILE 464.A O no hydrogen 3.057 N/A ALA 478.A N LEU 427.A O no hydrogen 2.839 N/A GLY 481.A N ILE 422.A O no hydrogen 2.835 N/A VAL 484.A N VAL 420.A O no hydrogen 3.164 N/A LEU 485.A N GLY 465.A O no hydrogen 2.848 N/A ILE 486.A N SER 418.A O no hydrogen 3.047 N/A LYS 487.A N GLU 463.A O no hydrogen 2.966 N/A LYS 487.A NZ GLU 463.A OE1 no hydrogen 3.504 N/A ALA 492.A N ILE 489.A O no hydrogen 3.068 N/A TYR 493.A OH THR 409.A OG1 no hydrogen 2.914 N/A TYR 493.A OH SER 418.A OG no hydrogen 2.853 N/A ILE 494.A N ASP 437.A OD2 no hydrogen 3.163 N/A LYS 495.A NZ SER 548.A O no hydrogen 2.486 N/A SER 496.A N ILE 494.A O no hydrogen 2.867 N/A SER 496.A OG THR 438.A OG1 no hydrogen 2.830 N/A ALA 497.A N VAL 406.A O no hydrogen 3.226 N/A THR 498.A N LEU 436.A O no hydrogen 2.773 N/A LEU 499.A N ALA 404.A O no hydrogen 2.972 N/A TYR 500.A N ARG 434.A O no hydrogen 2.895 N/A TYR 500.A OH THR 456.A OG1 no hydrogen 2.695 N/A SER 501.A N LEU 402.A O no hydrogen 2.994 N/A LYS 503.A NZ GLY 400.A O no hydrogen 2.415 N/A LYS 505.A NZ GLU 452.A OE1 no hydrogen 3.016 N/A LYS 505.A NZ GLU 452.A OE2 no hydrogen 2.977 N/A ASP 507.A N SER 504.A OG no hydrogen 3.345 N/A MET 508.A N SER 504.A O no hydrogen 3.266 N/A MET 508.A N LYS 505.A O no hydrogen 3.255 N/A LYS 509.A N GLU 506.A O no hydrogen 3.321 N/A LYS 512.A NZ LYS 395.A O no hydrogen 3.188 N/A PHE 513.A N GLN 445.A OE1 no hydrogen 2.941 N/A LYS 515.A N LEU 390.A O no hydrogen 2.626 N/A LYS 515.A NZ ASP 650.A OD2 no hydrogen 3.526 N/A TYR 519.A N LEU 517.A O no hydrogen 2.937 N/A VAL 524.A N GLY 568.A O no hydrogen 2.898 N/A PHE 525.A N GLY 568.A O no hydrogen 2.826 N/A LYS 526.A N LEU 596.A O no hydrogen 2.814 N/A ILE 527.A N ILE 566.A O no hydrogen 2.949 N/A VAL 528.A N SER 593.A OG no hydrogen 3.232 N/A LEU 529.A N HIS 564.A O no hydrogen 2.818 N/A GLN 530.A N LYS 591.A O no hydrogen 3.132 N/A LEU 532.A N GLU 589.A O no hydrogen 3.000 N/A GLU 536.A N LEU 533.A O no hydrogen 3.338 N/A LEU 540.A N GLU 536.A O no hydrogen 3.228 N/A LEU 541.A N LEU 537.A O no hydrogen 3.021 N/A ASP 542.A N PRO 538.A O no hydrogen 3.093 N/A ALA 543.A N LYS 539.A O no hydrogen 3.363 N/A LEU 544.A N LEU 540.A O no hydrogen 2.831 N/A ASN 545.A N LEU 541.A O no hydrogen 3.406 N/A ILE 547.A N ALA 543.A O no hydrogen 3.117 N/A SER 548.A N LEU 544.A O no hydrogen 3.109 N/A LYS 549.A NZ SER 490.A O no hydrogen 3.068 N/A TYR 550.A N LYS 546.A O no hydrogen 2.839 N/A TYR 551.A N ILE 547.A O no hydrogen 2.835 N/A TYR 551.A OH CYS 576.A O no hydrogen 3.151 N/A TYR 551.A OH ASP 580.A OD2 no hydrogen 2.432 N/A ILE 555.A N LEU 567.A O no hydrogen 3.421 N/A LYS 557.A N VAL 565.A O no hydrogen 2.951 N/A GLU 559.A N GLU 563.A O no hydrogen 3.030 N/A GLY 562.A N GLU 559.A O no hydrogen 3.235 N/A HIS 564.A N LEU 529.A O no hydrogen 3.017 N/A VAL 565.A N LYS 557.A O no hydrogen 2.884 N/A ILE 566.A N ILE 527.A O no hydrogen 2.849 N/A LEU 567.A N ILE 555.A O no hydrogen 3.001 N/A GLY 568.A N PHE 525.A O no hydrogen 2.460 N/A TYR 573.A OH ASP 157.A OD2 no hydrogen 2.642 N/A MET 574.A N GLY 570.A O no hydrogen 3.120 N/A ASP 575.A N GLU 571.A O no hydrogen 3.093 N/A CYS 576.A N LEU 572.A O no hydrogen 2.972 N/A CYS 576.A SG LEU 572.A O no hydrogen 3.246 N/A LEU 577.A N TYR 573.A O no hydrogen 3.167 N/A LEU 578.A N MET 574.A O no hydrogen 2.885 N/A TYR 579.A N ASP 575.A O no hydrogen 3.252 N/A LEU 581.A N LEU 577.A O no hydrogen 3.018 N/A ARG 582.A N LEU 578.A O no hydrogen 3.277 N/A ALA 583.A N TYR 579.A O no hydrogen 2.745 N/A SER 584.A N ASP 580.A O no hydrogen 3.116 N/A SER 584.A OG HIS 37.A ND1 no hydrogen 3.077 N/A SER 584.A OG ASP 580.A OD1 no hydrogen 3.088 N/A TYR 585.A N ASP 580.A O no hydrogen 2.667 N/A TYR 585.A OH ASP 411.A OD2 no hydrogen 2.783 N/A LYS 587.A NZ ALA 583.A O no hydrogen 3.311 N/A LYS 587.A NZ SER 584.A O no hydrogen 3.493 N/A LYS 591.A N GLN 530.A O no hydrogen 2.732 N/A SER 593.A N VAL 528.A O no hydrogen 3.063 N/A SER 593.A OG VAL 528.A O no hydrogen 3.149 N/A SER 593.A OG ASP 594.A O no hydrogen 3.186 N/A LEU 596.A N LYS 526.A O no hydrogen 2.657 N/A THR 597.A OG1 VAL 524.A O no hydrogen 3.457 N/A THR 597.A OG1 VAL 598.A O no hydrogen 2.947 N/A PHE 599.A N GLU 723.A OE1 no hydrogen 3.178 N/A SER 600.A N LEU 770.A O no hydrogen 3.194 N/A GLU 601.A N PRO 724.A O no hydrogen 2.993 N/A SER 602.A N ILE 768.A O no hydrogen 3.303 N/A SER 602.A OG CYS 603.A O no hydrogen 3.466 N/A CYS 603.A N SER 602.A OG no hydrogen 2.617 N/A CYS 603.A SG ASN 605.A O no hydrogen 3.969 N/A SER 604.A N ILE 766.A O no hydrogen 3.023 N/A ASN 605.A N ALA 765.A O no hydrogen 3.432 N/A GLU 606.A N GLU 606.A OE1 no hydrogen 2.696 N/A SER 607.A N ALA 624.A O no hydrogen 3.326 N/A SER 607.A OG THR 764.A O no hydrogen 3.466 N/A ARG 609.A NE SER 607.A OG no hydrogen 2.797 N/A ARG 609.A NH2 SER 607.A OG no hydrogen 2.651 N/A SER 619.A OG GLY 611.A O no hydrogen 3.352 N/A SER 619.A OG GLU 612.A OE1 no hydrogen 3.327 N/A SER 621.A N SER 734.A O no hydrogen 3.068 N/A SER 621.A OG ARG 609.A O no hydrogen 2.359 N/A ALA 623.A N LYS 731.A O no hydrogen 2.917 N/A MET 627.A N GLY 727.A O no hydrogen 3.382 N/A ILE 632.A N ASP 628.A O no hydrogen 2.815 N/A GLN 633.A N SER 629.A O no hydrogen 2.987 N/A ASP 634.A N LYS 630.A O no hydrogen 3.051 N/A LEU 635.A N MET 631.A O no hydrogen 3.369 N/A SER 636.A N ILE 632.A O no hydrogen 3.115 N/A SER 636.A OG GLN 633.A O no hydrogen 2.569 N/A ASN 638.A N LEU 635.A O no hydrogen 3.261 N/A THR 639.A OG1 ASP 648.A OD1 no hydrogen 3.085 N/A LEU 640.A N LEU 647.A O no hydrogen 2.939 N/A LYS 642.A N ASN 645.A O no hydrogen 3.075 N/A LEU 647.A N LEU 640.A O no hydrogen 2.748 N/A GLY 651.A N ASP 650.A OD1 no hydrogen 2.659 N/A LEU 659.A N ASN 655.A O no hydrogen 2.769 N/A SER 660.A N PRO 656.A O no hydrogen 3.261 N/A SER 660.A OG PRO 656.A O no hydrogen 3.193 N/A SER 660.A OG SER 674.A O no hydrogen 2.920 N/A LYS 661.A N ARG 657.A O no hydrogen 3.312 N/A ILE 662.A N LYS 658.A O no hydrogen 3.015 N/A LEU 663.A N LEU 659.A O no hydrogen 2.972 N/A ARG 664.A N SER 660.A O no hydrogen 3.382 N/A THR 665.A N LYS 661.A O no hydrogen 3.147 N/A THR 665.A OG1 LYS 661.A O no hydrogen 2.949 N/A GLU 666.A N ILE 662.A O no hydrogen 3.084 N/A TYR 667.A OH ASP 634.A OD2 no hydrogen 2.339 N/A TRP 669.A N LEU 663.A O no hydrogen 3.294 N/A SER 674.A N ASP 670.A O no hydrogen 3.124 N/A SER 674.A OG ASP 670.A O no hydrogen 2.714 N/A TRP 678.A N LEU 686.A O no hydrogen 3.001 N/A ASN 684.A N TYR 681.A O no hydrogen 2.812 N/A ASN 684.A ND2 ILE 725.A O no hydrogen 2.749 N/A ILE 687.A N TYR 730.A O no hydrogen 2.926 N/A ASN 688.A N ASN 676.A O no hydrogen 3.082 N/A ASP 689.A N LEU 732.A O no hydrogen 3.153 N/A THR 690.A OG1 LEU 733.A O no hydrogen 3.058 N/A ILE 695.A N PRO 692.A O no hydrogen 2.972 N/A SER 696.A N PRO 692.A O no hydrogen 2.419 N/A SER 696.A OG SER 696.A O no hydrogen 2.498 N/A GLU 698.A N GLU 698.A OE1 no hydrogen 2.827 N/A SER 701.A N PRO 697.A O no hydrogen 2.870 N/A SER 701.A OG GLU 698.A O no hydrogen 2.823 N/A TYR 703.A N LEU 700.A O no hydrogen 3.042 N/A ILE 707.A N TYR 703.A O no hydrogen 3.380 N/A ILE 708.A N LYS 704.A O no hydrogen 3.148 N/A GLN 709.A N GLU 705.A O no hydrogen 3.080 N/A GLY 710.A N GLN 706.A O no hydrogen 2.825 N/A PHE 711.A N ILE 707.A O no hydrogen 2.547 N/A TYR 712.A N ILE 708.A O no hydrogen 2.724 N/A TRP 713.A N GLN 709.A O no hydrogen 3.029 N/A ALA 714.A N PHE 711.A O no hydrogen 3.336 N/A VAL 715.A N PHE 711.A O no hydrogen 3.157 N/A GLY 718.A N GLU 723.A O no hydrogen 2.710 N/A ALA 721.A N GLU 601.A OE2 no hydrogen 3.100 N/A ILE 725.A N VAL 715.A O no hydrogen 3.099 N/A TYR 726.A N GLU 601.A O no hydrogen 2.861 N/A GLY 727.A N GLY 683.A O no hydrogen 2.805 N/A VAL 728.A N ASN 684.A OD1 no hydrogen 2.721 N/A GLN 729.A N GLU 625.A O no hydrogen 2.535 N/A TYR 730.A N VAL 685.A O no hydrogen 2.942 N/A LYS 731.A N ALA 623.A O no hydrogen 3.075 N/A LYS 731.A NZ GLU 625.A OE1 no hydrogen 3.123 N/A LEU 732.A N ILE 687.A O no hydrogen 2.834 N/A LEU 733.A N SER 621.A O no hydrogen 2.698 N/A SER 734.A N SER 621.A O no hydrogen 3.211 N/A MET 746.A N ASN 742.A O no hydrogen 2.842 N/A LYS 747.A N ILE 743.A O no hydrogen 3.217 N/A SER 748.A OG ASP 744.A O no hydrogen 3.229 N/A SER 748.A OG VAL 745.A O no hydrogen 3.056 N/A GLN 749.A N VAL 745.A O no hydrogen 2.970 N/A ILE 750.A N MET 746.A O no hydrogen 3.296 N/A MET 754.A N ILE 750.A O no hydrogen 2.915 N/A LYS 756.A N PRO 752.A O no hydrogen 3.158 N/A LYS 756.A NZ GLU 613.A OE1 no hydrogen 3.452 N/A ALA 757.A N LEU 753.A O no hydrogen 2.670 N/A CYS 758.A N MET 754.A O no hydrogen 2.863 N/A CYS 758.A SG MET 754.A O no hydrogen 3.268 N/A TYR 759.A OH GLU 717.A O no hydrogen 2.274 N/A VAL 760.A N LYS 756.A O no hydrogen 3.431 N/A GLY 761.A N ALA 757.A O no hydrogen 3.363 N/A LEU 762.A N CYS 758.A O no hydrogen 3.174 N/A LEU 763.A N TYR 759.A O no hydrogen 3.005 N/A THR 764.A N VAL 760.A O no hydrogen 3.315 N/A THR 764.A OG1 VAL 760.A O no hydrogen 2.311 N/A ALA 765.A N LEU 762.A O no hydrogen 3.141 N/A ILE 768.A N SER 602.A O no hydrogen 3.026 N/A LEU 770.A N SER 600.A O no hydrogen 2.600 N/A GLU 771.A N ARG 850.A O no hydrogen 2.747 N/A ILE 773.A N ILE 848.A O no hydrogen 2.937 N/A TYR 774.A OH ASN 569.A O no hydrogen 2.334 N/A GLU 775.A N TYR 843.A O no hydrogen 2.939 N/A VAL 776.A N GLY 816.A O no hydrogen 2.687 N/A ASP 777.A N GLN 841.A O no hydrogen 3.220 N/A ILE 778.A N VAL 814.A O no hydrogen 2.633 N/A THR 779.A N MET 839.A O no hydrogen 2.773 N/A VAL 780.A N LEU 812.A O no hydrogen 3.253 N/A ALA 782.A N PRO 810.A O no hydrogen 2.982 N/A LEU 784.A N HIS 781.A O no hydrogen 3.120 N/A GLU 789.A N LEU 785.A O no hydrogen 3.012 N/A GLU 790.A N PRO 786.A O no hydrogen 3.278 N/A LEU 791.A N ILE 787.A O no hydrogen 2.964 N/A MET 792.A N VAL 788.A O no hydrogen 2.923 N/A LYS 793.A N GLU 790.A O no hydrogen 3.195 N/A LYS 794.A N GLU 790.A O no hydrogen 3.315 N/A LYS 794.A NZ GLU 790.A O no hydrogen 3.497 N/A ARG 795.A NE GLU 822.A O no hydrogen 2.818 N/A ARG 795.A NH1 ASP 829.A OD2 no hydrogen 3.383 N/A ARG 795.A NH2 ASP 829.A OD2 no hydrogen 2.901 N/A TYR 801.A N ARG 815.A O no hydrogen 3.032 N/A LYS 802.A N ARG 815.A O no hydrogen 3.134 N/A ILE 804.A N GLU 813.A O no hydrogen 2.742 N/A THR 809.A OG1 VAL 806.A O no hydrogen 2.814 N/A THR 809.A OG1 LEU 811.A O no hydrogen 3.051 N/A LEU 812.A N VAL 780.A O no hydrogen 2.716 N/A GLU 813.A N ILE 804.A O no hydrogen 2.831 N/A VAL 814.A N ILE 778.A O no hydrogen 2.658 N/A ARG 815.A N LYS 802.A O no hydrogen 2.861 N/A ARG 815.A NE GLU 813.A OE2 no hydrogen 2.985 N/A ARG 815.A NH2 GLU 184.A OE2 no hydrogen 3.013 N/A ARG 815.A NH2 GLU 813.A OE2 no hydrogen 3.300 N/A GLY 816.A N VAL 776.A O no hydrogen 2.987 N/A GLN 817.A N ARG 799.A O no hydrogen 3.017 N/A VAL 818.A N TYR 774.A O no hydrogen 2.849 N/A VAL 820.A N PRO 772.A O no hydrogen 3.193 N/A GLU 822.A N PRO 819.A O no hydrogen 3.140 N/A SER 823.A N VAL 820.A O no hydrogen 3.342 N/A SER 823.A OG VAL 820.A O no hydrogen 3.033 N/A GLY 825.A N GLU 571.A OE2 no hydrogen 2.385 N/A ASP 829.A N GLY 825.A O no hydrogen 2.978 N/A LEU 830.A N PHE 826.A O no hydrogen 3.268 N/A ARG 831.A NH1 GLU 827.A OE2 no hydrogen 3.294 N/A LEU 832.A N THR 828.A O no hydrogen 3.173 N/A SER 833.A N ASP 829.A O no hydrogen 3.354 N/A SER 833.A OG ASP 829.A O no hydrogen 3.040 N/A SER 833.A OG LEU 830.A O no hydrogen 3.035 N/A THR 834.A N LEU 830.A O no hydrogen 3.196 N/A THR 834.A OG1 LEU 830.A O no hydrogen 2.827 N/A THR 834.A OG1 ARG 831.A O no hydrogen 3.568 N/A GLY 836.A N ARG 831.A O no hydrogen 3.031 N/A LEU 837.A N THR 834.A O no hydrogen 3.378 N/A MET 839.A N THR 779.A O no hydrogen 3.089 N/A GLN 841.A N ASP 777.A O no hydrogen 3.232 N/A TYR 843.A N GLU 775.A O no hydrogen 3.212 N/A HIS 846.A ND1 GLU 775.A OE2 no hydrogen 2.741 N/A LYS 847.A NZ ILE 520.A O no hydrogen 2.999 N/A LYS 847.A NZ TRP 845.A O no hydrogen 3.388 N/A ARG 850.A N GLU 771.A O no hydrogen 2.834 N/A ARG 850.A NH2 GLN 817.A OE1 no hydrogen 2.394 N/A LYS 851.A NZ PRO 853.A O no hydrogen 3.492 N/A LYS 851.A NZ GLY 854.A O no hydrogen 3.014 N/A VAL 852.A N LEU 769.A O no hydrogen 2.872 N/A SER 873.A N PRO 870.A O no hydrogen 3.128 N/A SER 873.A OG PHE 862.A O no hydrogen 3.001 N/A ARG 876.A NH1 VAL 856.A O no hydrogen 3.404 N/A ASP 877.A N SER 873.A O no hydrogen 3.051 N/A PHE 878.A N LEU 874.A O no hydrogen 3.053 N/A MET 880.A N ARG 876.A O no hydrogen 3.149 N/A LYS 881.A N ASP 877.A O no hydrogen 3.048 N/A LYS 881.A NZ ASP 877.A OD1 no hydrogen 3.072 N/A THR 882.A N PHE 878.A O no hydrogen 3.415 N/A THR 882.A OG1 PHE 878.A O no hydrogen 2.542 N/A ARG 883.A N VAL 879.A O no hydrogen 2.858 N/A ARG 883.A NH1 LEU 720.A O no hydrogen 2.643 N/A ARG 884.A N LYS 881.A O no hydrogen 3.264 N/A ARG 884.A NH2 SER 895.A O no hydrogen 2.921 N/A ARG 885.A N LYS 881.A O no hydrogen 3.012 N/A LYS 886.A N THR 882.A O no hydrogen 3.028 N/A LYS 886.A NZ ALA 721.A O no hydrogen 3.239 N/A LYS 886.A NZ GLU 723.A OE2 no hydrogen 3.389 N/A SER 889.A N ARG 883.A O no hydrogen 2.987 N/A SER 889.A OG ASP 897.A OD1 no hydrogen 2.328 N/A THR 900.A OG1 TYR 910.A OH no hydrogen 3.357 N/A LEU 909.A N SER 906.A O no hydrogen 3.201 N/A TYR 910.A N SER 906.A O no hydrogen 3.144 N/A ALA 911.A N ALA 907.A O no hydrogen 3.284 N/A LEU 913.A N LEU 909.A O no hydrogen 3.050 N/A LEU 913.A N TYR 910.A O no hydrogen 3.223 N/A ARG 914.A N TYR 910.A O no hydrogen 3.304 N/A GLY 917.A N ARG 914.A O no hydrogen 3.367 N/A