Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ri6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ VAL 1.A O no hydrogen 2.667 N/A LEU 10.A N PHE 7.A O no hydrogen 3.356 N/A GLN 11.A NE2 GLY 9.A O no hydrogen 2.169 N/A LEU 19.A N ALA 14.A O no hydrogen 2.961 N/A LEU 20.A N GLY 16.A O no hydrogen 2.918 N/A SER 21.A N ALA 17.A O no hydrogen 2.998 N/A MET 22.A N ALA 18.A O no hydrogen 3.247 N/A VAL 24.A N MET 22.A O no hydrogen 2.489 N/A ARG 25.A NH1 LEU 20.A O no hydrogen 2.506 N/A ASP 34.A N ASN 31.A O no hydrogen 2.593 N/A ILE 35.A N ASN 31.A O no hydrogen 3.218 N/A SER 36.A N ASP 32.A O no hydrogen 2.924 N/A SER 36.A OG ASP 32.A O no hydrogen 3.141 N/A ASN 37.A N GLU 33.A O no hydrogen 2.913 N/A THR 38.A N ASP 34.A O no hydrogen 2.754 N/A THR 38.A OG1 ASP 34.A O no hydrogen 3.503 N/A THR 38.A OG1 ILE 35.A O no hydrogen 2.114 N/A ILE 39.A N ILE 35.A O no hydrogen 2.943 N/A ARG 40.A N SER 36.A O no hydrogen 2.822 N/A ALA 41.A N ASN 37.A O no hydrogen 2.848 N/A LEU 42.A N THR 38.A O no hydrogen 2.823 N/A PHE 43.A N ILE 39.A O no hydrogen 3.112 N/A ALA 44.A N ARG 40.A O no hydrogen 2.780 N/A THR 45.A N ALA 41.A O no hydrogen 2.950 N/A THR 45.A OG1 LEU 42.A O no hydrogen 3.303 N/A ASP 56.A N THR 59.A O no hydrogen 2.111 N/A THR 59.A N ASP 56.A O no hydrogen 2.247 N/A THR 59.A OG1 ASP 56.A O no hydrogen 2.273 N/A LEU 61.A N LEU 54.A O no hydrogen 2.396 N/A GLN 63.A N GLN 63.A OE1 no hydrogen 2.514 N/A LYS 65.A NZ ASP 50.A OD2 no hydrogen 2.374 N/A ARG 67.A NH1 GLU 49.A O no hydrogen 2.120 N/A THR 69.A OG1 ILE 70.A O no hydrogen 3.555 N/A THR 69.A OG1 GLU 99.A O no hydrogen 3.276 N/A SER 72.A OG ASP 140.A OD2 no hydrogen 2.520 N/A THR 74.A OG1 ASP 140.A OD2 no hydrogen 3.436 N/A THR 74.A OG1 LEU 141.A O no hydrogen 2.986 N/A SER 76.A N LEU 143.A O no hydrogen 2.247 N/A SER 76.A OG THR 74.A O no hydrogen 2.728 N/A ASN 78.A ND2 PHE 75.A O no hydrogen 3.173 N/A LYS 87.A N ASP 83.A O no hydrogen 2.882 N/A GLN 88.A N ASP 84.A O no hydrogen 2.814 N/A GLN 88.A NE2 MET 85.A O no hydrogen 2.877 N/A ASN 89.A N MET 85.A O no hydrogen 2.817 N/A LEU 90.A N LEU 86.A O no hydrogen 2.852 N/A GLU 91.A N LYS 87.A O no hydrogen 3.049 N/A GLU 91.A N GLU 91.A OE1 no hydrogen 2.727 N/A ALA 92.A N GLN 88.A O no hydrogen 2.921 N/A SER 93.A N LEU 90.A O no hydrogen 2.759 N/A SER 93.A OG ASN 89.A O no hydrogen 2.503 N/A GLY 94.A N GLU 91.A O no hydrogen 2.807 N/A VAL 95.A N LEU 90.A O no hydrogen 3.399 N/A ARG 96.A NH1 GLY 94.A O no hydrogen 3.212 N/A ARG 96.A NH2 GLU 91.A O no hydrogen 3.006 N/A GLU 99.A N ARG 96.A O no hydrogen 3.175 N/A SER 100.A OG ASN 47.A OD1 no hydrogen 2.875 N/A ARG 103.A NE GLU 49.A OE1 no hydrogen 2.626 N/A ARG 103.A NH2 GLU 49.A OE1 no hydrogen 3.166 N/A THR 104.A OG1 ASP 102.A O no hydrogen 3.333 N/A THR 105.A N ASP 102.A O no hydrogen 3.046 N/A THR 105.A OG1 ASP 102.A O no hydrogen 3.139 N/A ASP 108.A N THR 105.A O no hydrogen 2.962 N/A ILE 109.A N ILE 106.A O no hydrogen 2.958 N/A GLU 110.A N GLU 110.A OE1 no hydrogen 2.380 N/A LYS 111.A N ALA 107.A O no hydrogen 2.861 N/A GLY 112.A N ASP 108.A O no hydrogen 2.188 N/A LEU 113.A N ILE 109.A O no hydrogen 2.388 N/A GLU 114.A N GLU 110.A O no hydrogen 2.433 N/A ASP 115.A N LYS 111.A O no hydrogen 2.727 N/A TYR 117.A N LEU 113.A O no hydrogen 3.229 N/A TYR 117.A N GLU 114.A O no hydrogen 2.887 N/A TYR 118.A N ASP 115.A O no hydrogen 2.904 N/A SER 119.A N PHE 116.A O no hydrogen 3.001 N/A SER 119.A OG PHE 116.A O no hydrogen 2.494 N/A GLY 121.A N TYR 118.A O no hydrogen 2.344 N/A SER 124.A N GLU 147.A OE2 no hydrogen 3.323 N/A LYS 128.A N VAL 144.A O no hydrogen 2.886 N/A VAL 130.A N LYS 142.A O no hydrogen 2.985 N/A THR 132.A N ASP 140.A O no hydrogen 2.878 N/A THR 132.A OG1 THR 132.A O no hydrogen 2.555 N/A THR 132.A OG1 ASP 140.A O no hydrogen 2.594 N/A LEU 134.A N ARG 138.A O no hydrogen 2.541 N/A ASP 140.A N THR 132.A O no hydrogen 2.941 N/A LEU 141.A N SER 72.A O no hydrogen 2.179 N/A LYS 142.A N VAL 130.A O no hydrogen 2.804 N/A LYS 142.A NZ THR 74.A OG1 no hydrogen 2.498 N/A LYS 142.A NZ ASP 140.A OD1 no hydrogen 3.081 N/A LYS 142.A NZ ASP 140.A OD2 no hydrogen 2.971 N/A LEU 143.A N THR 74.A O no hydrogen 2.552 N/A VAL 144.A N LYS 128.A O no hydrogen 2.826 N/A PHE 145.A N SER 76.A O no hydrogen 2.509 N/A GLN 146.A N SER 126.A O no hydrogen 2.872 N/A SER 150.A OG GLU 152.A OE1 no hydrogen 3.031 N/A GLU 152.A N GLU 152.A OE1 no hydrogen 2.443 N/A GLN 154.A NE2 ARG 188.A O no hydrogen 2.606 N/A ASN 161.A ND2 ILE 158.A O no hydrogen 2.423 N/A THR 165.A OG1 ASP 167.A OD1 no hydrogen 2.716 N/A GLU 168.A N THR 165.A OG1 no hydrogen 3.043 N/A LEU 169.A N THR 165.A O no hydrogen 2.901 N/A ILE 170.A N THR 166.A O no hydrogen 2.758 N/A SER 171.A N ASP 167.A O no hydrogen 2.836 N/A SER 171.A OG ASP 167.A O no hydrogen 3.419 N/A SER 171.A OG GLU 168.A O no hydrogen 2.122 N/A HIS 172.A N GLU 168.A O no hydrogen 2.933 N/A HIS 172.A NE2 GLU 168.A OE1 no hydrogen 2.896 N/A PHE 173.A N ILE 170.A O no hydrogen 2.460 N/A ARG 176.A N ASP 187.A O no hydrogen 2.629 N/A ARG 176.A NH1 PHE 173.A O no hydrogen 2.236 N/A ARG 188.A N ASP 187.A OD2 no hydrogen 3.042 N/A ARG 188.A NH1 ASP 187.A O no hydrogen 2.791 N/A GLN 191.A NE2 VAL 120.A O no hydrogen 2.425 N/A LYS 192.A N GLN 191.A OE1 no hydrogen 3.115 N/A LYS 192.A NZ TYR 118.A O no hydrogen 2.129 N/A LYS 192.A NZ SER 119.A O no hydrogen 2.694 N/A LYS 192.A NZ GLN 191.A OE1 no hydrogen 2.860 N/A LEU 195.A N GLN 191.A O no hydrogen 2.773 N/A ALA 196.A N LYS 192.A O no hydrogen 3.085 N/A GLY 197.A N GLN 193.A O no hydrogen 2.787 N/A ASP 198.A N LYS 194.A O no hydrogen 2.845 N/A LEU 199.A N LEU 195.A O no hydrogen 2.813 N/A GLU 200.A N ALA 196.A O no hydrogen 2.892 N/A THR 201.A N GLY 197.A O no hydrogen 2.711 N/A THR 201.A OG1 GLY 197.A O no hydrogen 2.849 N/A LEU 202.A N ASP 198.A O no hydrogen 2.969 N/A ARG 203.A N LEU 199.A O no hydrogen 2.865 N/A ARG 203.A NH1 GLU 200.A OE2 no hydrogen 3.123 N/A SER 204.A N GLU 200.A O no hydrogen 2.689 N/A SER 204.A N GLU 200.A OE1 no hydrogen 2.349 N/A SER 204.A OG GLU 200.A O no hydrogen 2.146 N/A SER 204.A OG THR 201.A O no hydrogen 2.786 N/A TYR 205.A N THR 201.A O no hydrogen 2.829 N/A TYR 205.A OH GLU 168.A OE1 no hydrogen 1.936 N/A TYR 206.A N LEU 202.A O no hydrogen 2.834 N/A TYR 206.A OH GLU 238.A OE1 no hydrogen 3.075 N/A LEU 207.A N ARG 203.A O no hydrogen 2.796 N/A ASP 208.A N SER 204.A O no hydrogen 2.740 N/A ARG 209.A N TYR 205.A O no hydrogen 2.885 N/A GLY 210.A N LEU 207.A O no hydrogen 2.565 N/A TYR 211.A N TYR 206.A O no hydrogen 3.063 N/A TYR 211.A N LEU 207.A O no hydrogen 2.848 N/A ARG 213.A NH1 ALA 212.A O no hydrogen 2.602 N/A ASN 215.A N THR 237.A O no hydrogen 2.313 N/A ASP 217.A N ASN 235.A O no hydrogen 2.516 N/A SER 218.A OG GLN 220.A OE1 no hydrogen 2.296 N/A GLN 220.A N THR 233.A O no hydrogen 2.866 N/A LYS 227.A N THR 224.A O no hydrogen 2.696 N/A LYS 227.A NZ PRO 225.A O no hydrogen 2.293 N/A LYS 228.A NZ GLY 148.A O no hydrogen 3.147 N/A LYS 228.A NZ ASP 226.A O no hydrogen 3.461 N/A TYR 231.A N SER 222.A O no hydrogen 2.906 N/A THR 233.A N GLN 220.A O no hydrogen 2.841 N/A THR 233.A OG1 GLN 220.A O no hydrogen 3.124 N/A THR 233.A OG1 GLN 220.A OE1 no hydrogen 3.307 N/A VAL 234.A N ASN 157.A O no hydrogen 3.353 N/A VAL 234.A N ASN 157.A OD1 no hydrogen 2.818 N/A ILE 236.A N ASN 235.A OD1 no hydrogen 2.247 N/A THR 237.A N ASN 215.A O no hydrogen 2.189 N/A THR 237.A OG1 ASP 217.A OD1 no hydrogen 2.856 N/A LYS 243.A NZ LEU 244.A O no hydrogen 2.500 N/A LYS 243.A NZ SER 245.A OG no hydrogen 3.107 N/A LYS 243.A NZ GLU 270.A O no hydrogen 2.662 N/A SER 245.A OG LEU 244.A O no hydrogen 2.952 N/A GLU 248.A N LEU 313.A O no hydrogen 2.133 N/A SER 250.A N VAL 315.A O no hydrogen 2.187 N/A SER 250.A OG VAL 315.A O no hydrogen 3.261 N/A ASN 252.A N VAL 317.A O no hydrogen 2.192 N/A ASN 252.A ND2 ASP 318.A OD1 no hydrogen 2.287 N/A GLU 261.A N SER 257.A O no hydrogen 2.962 N/A GLN 262.A N ALA 258.A O no hydrogen 2.847 N/A THR 264.A N ILE 260.A O no hydrogen 2.966 N/A THR 264.A OG1 ILE 260.A O no hydrogen 3.481 N/A LYS 265.A N GLU 261.A O no hydrogen 3.194 N/A LYS 265.A NZ GLN 262.A OE1 no hydrogen 3.454 N/A LYS 265.A NZ GLU 267.A OE1 no hydrogen 2.752 N/A GLU 267.A N GLU 270.A OE2 no hydrogen 2.749 N/A GLY 269.A N GLU 267.A O no hydrogen 2.420 N/A THR 275.A OG1 ASP 208.A OD1 no hydrogen 2.418 N/A LYS 276.A N ASN 273.A O no hydrogen 3.401 N/A THR 278.A N GLY 274.A O no hydrogen 3.104 N/A THR 278.A OG1 THR 275.A O no hydrogen 2.322 N/A LYS 279.A N THR 275.A O no hydrogen 2.961 N/A LYS 279.A N LYS 276.A O no hydrogen 2.988 N/A LYS 279.A NZ THR 278.A OG1 no hydrogen 2.813 N/A MET 280.A N LYS 276.A O no hydrogen 3.013 N/A GLU 281.A N VAL 277.A O no hydrogen 2.705 N/A ASP 282.A N THR 278.A O no hydrogen 3.093 N/A ASP 283.A N LYS 279.A O no hydrogen 2.879 N/A ILE 284.A N MET 280.A O no hydrogen 3.078 N/A LYS 285.A N GLU 281.A O no hydrogen 2.781 N/A LYS 286.A N ASP 282.A O no hydrogen 2.949 N/A LEU 287.A N ASP 283.A O no hydrogen 2.909 N/A LEU 288.A N ILE 284.A O no hydrogen 2.961 N/A GLY 289.A N LYS 285.A O no hydrogen 2.932 N/A ARG 290.A N LYS 286.A O no hydrogen 2.854 N/A ARG 290.A NH1 LEU 353.A O no hydrogen 2.569 N/A TYR 291.A N LEU 287.A O no hydrogen 2.966 N/A GLY 292.A N LEU 288.A O no hydrogen 2.896 N/A TYR 293.A N LEU 288.A O no hydrogen 3.293 N/A TYR 293.A OH LEU 253.A O no hydrogen 2.233 N/A ARG 297.A N ASP 318.A OD2 no hydrogen 2.831 N/A GLN 299.A N ASN 316.A O no hydrogen 2.917 N/A GLN 299.A N ASN 316.A OD1 no hydrogen 2.150 N/A SER 300.A OG SER 300.A O no hydrogen 2.406 N/A LYS 309.A NZ ASP 240.A OD1 no hydrogen 2.990 N/A LYS 309.A NZ GLN 241.A O no hydrogen 3.365 N/A LYS 309.A NZ ASP 306.A OD1 no hydrogen 2.457 N/A THR 310.A N ASN 305.A OD1 no hydrogen 2.846 N/A THR 310.A OG1 ASN 305.A OD1 no hydrogen 2.051 N/A LEU 313.A N GLY 246.A O no hydrogen 3.011 N/A ARG 314.A N MET 301.A O no hydrogen 2.965 N/A ARG 314.A NH1 PRO 302.A O no hydrogen 2.832 N/A ARG 314.A NH2 PRO 302.A O no hydrogen 2.337 N/A ASN 316.A N GLN 299.A O no hydrogen 2.804 N/A ASP 318.A N ARG 297.A O no hydrogen 3.243 N/A ARG 322.A NH2 TYR 291.A OH no hydrogen 2.229 N/A ARG 326.A NH1 LYS 327.A O no hydrogen 2.539 N/A GLU 331.A N TYR 392.A O no hydrogen 2.285 N/A SER 336.A OG LYS 337.A O no hydrogen 3.156 N/A LEU 341.A N LYS 337.A O no hydrogen 3.450 N/A ARG 342.A N ASP 338.A O no hydrogen 2.852 N/A ARG 343.A N ALA 339.A O no hydrogen 2.775 N/A ARG 343.A NH1 GLY 429.A O no hydrogen 2.959 N/A ARG 343.A NH1 ASN 451.A OD1 no hydrogen 2.406 N/A ARG 343.A NH2 GLY 429.A O no hydrogen 2.496 N/A GLU 344.A N VAL 340.A O no hydrogen 2.957 N/A MET 345.A N LEU 341.A O no hydrogen 3.099 N/A GLN 347.A NE2 LEU 357.A O no hydrogen 2.987 N/A TRP 352.A NE1 ARG 290.A O no hydrogen 3.117 N/A ASP 359.A N SER 355.A O no hydrogen 2.933 N/A GLN 360.A N ASP 356.A O no hydrogen 2.959 N/A GLY 361.A N LEU 357.A O no hydrogen 2.978 N/A LYS 362.A N VAL 358.A O no hydrogen 2.887 N/A LYS 362.A NZ VAL 374.A O no hydrogen 2.257 N/A GLU 363.A N ASP 359.A O no hydrogen 2.942 N/A ARG 364.A N GLN 360.A O no hydrogen 2.756 N/A LEU 365.A N GLY 361.A O no hydrogen 2.944 N/A ASN 366.A N LYS 362.A O no hydrogen 2.885 N/A ARG 367.A N GLU 363.A O no hydrogen 2.844 N/A LEU 368.A N LEU 365.A O no hydrogen 2.591 N/A GLU 372.A N LYS 395.A O no hydrogen 2.042 N/A THR 373.A OG1 THR 373.A O no hydrogen 2.678 N/A THR 373.A OG1 ASP 375.A OD1 no hydrogen 3.209 N/A ASP 375.A N LYS 393.A O no hydrogen 3.364 N/A ASP 377.A N VAL 391.A O no hydrogen 2.816 N/A GLN 379.A N GLN 379.A OE1 no hydrogen 2.455 N/A ARG 380.A NE VAL 381.A O no hydrogen 2.219 N/A ARG 380.A NH2 VAL 381.A O no hydrogen 2.730 N/A SER 384.A OG ASP 386.A OD2 no hydrogen 2.511 N/A GLN 387.A NE2 VAL 325.A O no hydrogen 2.434 N/A VAL 390.A N LYS 327.A O no hydrogen 3.066 N/A VAL 391.A N ASP 377.A O no hydrogen 2.815 N/A TYR 392.A N GLU 331.A OE1 no hydrogen 2.826 N/A LYS 393.A N ASP 375.A O no hydrogen 2.932 N/A LYS 393.A NZ GLU 331.A OE2 no hydrogen 2.850 N/A LYS 393.A NZ ASP 377.A OD2 no hydrogen 2.824 N/A LYS 395.A NZ GLU 372.A OE2 no hydrogen 2.375 N/A ARG 397.A N PHE 370.A O no hydrogen 3.350 N/A SER 401.A N GLN 421.A O no hydrogen 2.899 N/A SER 401.A OG ASP 423.A OD2 no hydrogen 2.973 N/A ASN 403.A N GLY 419.A O no hydrogen 2.929 N/A SER 412.A N GLY 409.A O no hydrogen 3.067 N/A SER 412.A OG GLY 409.A O no hydrogen 2.917 N/A SER 412.A OG GLY 413.A O no hydrogen 3.268 N/A SER 412.A OG ASP 440.A OD1 no hydrogen 2.999 N/A SER 415.A OG TYR 408.A O no hydrogen 2.920 N/A PHE 416.A N LYS 438.A O no hydrogen 3.064 N/A GLY 419.A N ASN 403.A O no hydrogen 3.377 N/A VAL 420.A N ILE 434.A O no hydrogen 2.982 N/A GLN 421.A N SER 401.A O no hydrogen 2.815 N/A GLN 421.A NE2 GLY 419.A O no hydrogen 2.949 N/A THR 428.A N TRP 425.A O no hydrogen 2.520 N/A THR 428.A OG1 TRP 425.A O no hydrogen 2.896 N/A GLY 429.A N LEU 426.A O no hydrogen 2.291 N/A ALA 431.A N THR 450.A O no hydrogen 2.903 N/A GLY 433.A N SER 448.A O no hydrogen 2.813 N/A ASN 435.A N GLU 446.A OE2 no hydrogen 3.072 N/A GLY 436.A N ALA 418.A O no hydrogen 2.938 N/A ASN 439.A N GLN 442.A O no hydrogen 2.918 N/A ASN 439.A ND2 THR 437.A OG1 no hydrogen 2.421 N/A GLN 442.A N ASN 439.A O no hydrogen 2.905 N/A THR 443.A N ASP 469.A O no hydrogen 2.895 N/A THR 443.A OG1 THR 443.A O no hydrogen 2.567 N/A THR 443.A OG1 ASP 469.A O no hydrogen 2.689 N/A ALA 445.A N TYR 467.A O no hydrogen 2.903 N/A SER 448.A N GLY 433.A O no hydrogen 3.028 N/A SER 448.A OG GLY 433.A O no hydrogen 2.364 N/A VAL 449.A N GLY 463.A O no hydrogen 2.951 N/A THR 450.A N ALA 431.A O no hydrogen 2.949 N/A THR 450.A OG1 ALA 431.A O no hydrogen 3.433 N/A TYR 453.A N ASN 451.A OD1 no hydrogen 2.913 N/A GLY 458.A N THR 455.A O no hydrogen 3.250 N/A SER 460.A OG PRO 452.A O no hydrogen 2.385 N/A SER 460.A OG GLY 458.A O no hydrogen 2.926 N/A LEU 461.A N ASN 451.A O no hydrogen 2.176 N/A GLY 463.A N VAL 449.A O no hydrogen 2.824 N/A ARG 464.A NH1 LEU 447.A O no hydrogen 2.974 N/A ARG 464.A NH1 LEU 465.A O no hydrogen 2.142 N/A LEU 465.A N LEU 447.A O no hydrogen 2.866 N/A TYR 467.A N ALA 445.A O no hydrogen 3.011 N/A ASN 468.A N SER 484.A O no hydrogen 2.814 N/A ASP 469.A N THR 443.A O no hydrogen 2.989 N/A ASP 469.A N THR 443.A OG1 no hydrogen 3.075 N/A PHE 470.A N ASN 482.A O no hydrogen 2.962 N/A GLN 471.A N GLN 442.A OE1 no hydrogen 3.054 N/A GLN 471.A NE2 TYR 441.A O no hydrogen 2.981 N/A ALA 472.A N GLN 442.A OE1 no hydrogen 2.312 N/A SER 478.A OG SER 656.A O no hydrogen 2.841 N/A SER 478.A OG SER 656.A OG no hydrogen 2.934 N/A SER 478.A OG ASN 657.A O no hydrogen 2.189 N/A TYR 480.A N LEU 477.A O no hydrogen 3.163 N/A THR 481.A N SER 513.A O no hydrogen 2.880 N/A THR 481.A OG1 LEU 477.A O no hydrogen 2.979 N/A ASN 482.A N PHE 470.A O no hydrogen 2.896 N/A LYS 483.A N SER 511.A O no hydrogen 2.867 N/A SER 484.A N ASN 468.A O no hydrogen 2.919 N/A SER 484.A OG ASN 510.A OD1 no hydrogen 2.616 N/A TYR 485.A N ASN 510.A OD1 no hydrogen 2.462 N/A TYR 485.A OH SER 511.A OG no hydrogen 3.270 N/A GLY 486.A N PHE 466.A O no hydrogen 3.004 N/A ASP 488.A N ARG 464.A O no hydrogen 2.896 N/A VAL 489.A N LEU 505.A O no hydrogen 2.903 N/A THR 490.A N GLY 462.A O no hydrogen 3.013 N/A TYR 498.A N ASN 496.A OD1 no hydrogen 2.907 N/A TYR 498.A OH ASN 555.A O no hydrogen 3.381 N/A ALA 503.A N LEU 491.A O no hydrogen 2.967 N/A LEU 505.A N VAL 489.A O no hydrogen 2.813 N/A TYR 507.A N THR 487.A O no hydrogen 2.964 N/A HIS 509.A N TYR 485.A O no hydrogen 2.892 N/A ASN 510.A N THR 543.A O no hydrogen 2.854 N/A SER 511.A N LYS 483.A O no hydrogen 2.316 N/A SER 511.A OG TYR 485.A OH no hydrogen 3.270 N/A LEU 512.A N PHE 541.A O no hydrogen 2.850 N/A SER 513.A N THR 481.A O no hydrogen 2.879 N/A ASN 514.A N ASN 539.A O no hydrogen 2.380 N/A VAL 519.A N VAL 649.A O no hydrogen 2.830 N/A TRP 522.A N GLN 518.A O no hydrogen 2.868 N/A ARG 523.A N VAL 519.A O no hydrogen 2.870 N/A TYR 524.A N ALA 520.A O no hydrogen 2.826 N/A LEU 525.A N MET 521.A O no hydrogen 2.971 N/A TYR 526.A N TRP 522.A O no hydrogen 2.848 N/A SER 527.A N ARG 523.A O no hydrogen 2.695 N/A SER 527.A OG ARG 523.A O no hydrogen 2.482 N/A MET 528.A N TYR 524.A O no hydrogen 2.782 N/A GLY 529.A N TYR 526.A O no hydrogen 2.700 N/A HIS 531.A N GLY 529.A O no hydrogen 2.589 N/A SER 535.A OG ASP 536.A OD1 no hydrogen 3.443 N/A GLN 537.A NE2 HIS 653.A NE2 no hydrogen 2.921 N/A ASN 539.A ND2 SER 533.A OG no hydrogen 2.727 N/A PHE 541.A N LEU 512.A O no hydrogen 2.890 N/A LYS 542.A NZ LEU 512.A O no hydrogen 3.003 N/A LYS 542.A NZ PHE 541.A O no hydrogen 2.537 N/A THR 543.A N ASN 510.A O no hydrogen 2.911 N/A THR 543.A OG1 ASP 545.A OD2 no hydrogen 2.489 N/A THR 543.A OG1 ASP 581.A OD2 no hydrogen 3.148 N/A ASP 544.A N ASP 581.A OD2 no hydrogen 3.119 N/A ASP 545.A N VAL 508.A O no hydrogen 3.030 N/A THR 547.A OG1 GLY 506.A O no hydrogen 2.941 N/A PHE 548.A N VAL 575.A O no hydrogen 2.866 N/A TYR 550.A N GLY 573.A O no hydrogen 2.937 N/A TRP 552.A N LEU 571.A O no hydrogen 2.992 N/A TRP 552.A NE1 ASN 499.A OD1 no hydrogen 2.832 N/A THR 553.A OG1 ASN 570.A OD1 no hydrogen 3.419 N/A TYR 554.A N VAL 569.A O no hydrogen 2.961 N/A LYS 556.A N SER 567.A O no hydrogen 2.857 N/A LYS 556.A NZ TYR 554.A OH no hydrogen 2.497 N/A ASP 558.A N ASP 565.A OD1 no hydrogen 2.453 N/A ARG 559.A N ASP 558.A OD1 no hydrogen 2.432 N/A ARG 559.A NH1 PRO 563.A O no hydrogen 2.617 N/A THR 564.A N ASP 558.A OD1 no hydrogen 2.681 N/A THR 564.A N ASP 558.A OD2 no hydrogen 3.083 N/A THR 564.A OG1 ASP 558.A OD2 no hydrogen 2.042 N/A ASP 565.A N ASP 558.A OD1 no hydrogen 3.511 N/A GLY 566.A N TYR 594.A O no hydrogen 2.998 N/A SER 567.A N LYS 556.A O no hydrogen 3.048 N/A ARG 568.A N ALA 592.A O no hydrogen 2.971 N/A VAL 569.A N ASN 555.A OD1 no hydrogen 2.323 N/A ASN 570.A N ASP 590.A O no hydrogen 3.082 N/A LEU 571.A N TRP 552.A O no hydrogen 3.023 N/A THR 572.A N THR 588.A O no hydrogen 2.968 N/A THR 572.A OG1 THR 588.A O no hydrogen 3.363 N/A GLY 573.A N TYR 550.A O no hydrogen 3.011 N/A LYS 574.A N LYS 586.A O no hydrogen 2.889 N/A VAL 575.A N PHE 548.A O no hydrogen 2.925 N/A THR 576.A OG1 TYR 584.A O no hydrogen 2.270 N/A SER 580.A N ILE 577.A O no hydrogen 3.446 N/A SER 580.A OG ILE 577.A O no hydrogen 3.030 N/A SER 580.A OG ASN 582.A O no hydrogen 3.017 N/A ASN 582.A N ASP 545.A OD1 no hydrogen 2.984 N/A ASN 582.A ND2 GLY 616.A O no hydrogen 3.096 N/A LYS 586.A N LYS 574.A O no hydrogen 2.930 N/A VAL 587.A N TYR 613.A O no hydrogen 2.937 N/A THR 588.A N THR 572.A O no hydrogen 2.973 N/A LEU 589.A N TRP 611.A O no hydrogen 2.890 N/A ASP 590.A N ASN 570.A O no hydrogen 3.065 N/A THR 591.A N THR 609.A O no hydrogen 2.953 N/A THR 591.A OG1 ARG 568.A O no hydrogen 3.335 N/A ALA 592.A N ARG 568.A O no hydrogen 3.033 N/A THR 593.A N GLY 607.A O no hydrogen 2.921 N/A VAL 595.A N VAL 605.A O no hydrogen 2.886 N/A ILE 597.A N TRP 603.A O no hydrogen 2.599 N/A HIS 601.A ND1 ASP 598.A O no hydrogen 2.500 N/A VAL 604.A N ILE 695.A O no hydrogen 2.971 N/A VAL 605.A N VAL 595.A O no hydrogen 2.867 N/A LEU 606.A N GLU 693.A O no hydrogen 2.894 N/A GLY 607.A N THR 593.A O no hydrogen 3.013 N/A ARG 608.A N SER 691.A O no hydrogen 3.012 N/A ARG 608.A NH1 VAL 689.A O no hydrogen 3.159 N/A THR 609.A N THR 591.A O no hydrogen 3.022 N/A THR 609.A OG1 VAL 689.A O no hydrogen 2.840 N/A ARG 610.A N VAL 689.A O no hydrogen 2.826 N/A ARG 610.A NH2 ASP 590.A OD1 no hydrogen 3.066 N/A ARG 610.A NH2 ASP 590.A OD2 no hydrogen 3.068 N/A TRP 611.A N LEU 589.A O no hydrogen 2.886 N/A GLY 612.A N MET 687.A O no hydrogen 2.948 N/A TYR 613.A N VAL 587.A O no hydrogen 2.972 N/A ASP 615.A N TYR 585.A O no hydrogen 2.846 N/A LYS 620.A N LEU 617.A O no hydrogen 2.756 N/A GLU 626.A N PRO 623.A O no hydrogen 3.481 N/A SER 633.A OG GLY 631.A O no hydrogen 3.365 N/A SER 633.A OG ASN 642.A OD1 no hydrogen 2.943 N/A ARG 637.A N ASP 716.A OD2 no hydrogen 3.181 N/A ARG 637.A NH1 GLU 776.A O no hydrogen 2.914 N/A SER 641.A OG GLY 632.A O no hydrogen 2.970 N/A ASN 642.A N GLY 631.A O no hydrogen 2.179 N/A THR 643.A OG1 SER 641.A O no hydrogen 3.074 N/A LYS 647.A NZ GLY 645.A O no hydrogen 3.472 N/A LYS 647.A NZ TYR 736.A OH no hydrogen 2.629 N/A LYS 647.A NZ ASP 771.A O no hydrogen 3.494 N/A LYS 647.A NZ ASP 771.A OD1 no hydrogen 2.700 N/A PHE 651.A N PRO 517.A O no hydrogen 3.154 N/A HIS 653.A N ALA 667.A O no hydrogen 3.363 N/A GLN 654.A N SER 535.A O no hydrogen 2.392 N/A ALA 655.A N SER 535.A O no hydrogen 2.368 N/A SER 656.A OG ASP 476.A OD2 no hydrogen 3.378 N/A SER 656.A OG SER 478.A OG no hydrogen 2.934 N/A SER 656.A OG ASN 657.A O no hydrogen 2.960 N/A TYR 662.A N ASP 661.A OD2 no hydrogen 2.328 N/A TYR 664.A N ASP 663.A OD1 no hydrogen 2.580 N/A CYS 666.A SG SER 678.A OG no hydrogen 2.660 N/A THR 668.A N ALA 672.A O no hydrogen 2.856 N/A THR 668.A OG1 HIS 653.A O no hydrogen 3.417 N/A THR 668.A OG1 ASP 659.A OD1 no hydrogen 2.935 N/A THR 668.A OG1 ASP 663.A OD2 no hydrogen 2.734 N/A GLN 669.A N THR 668.A OG1 no hydrogen 2.512 N/A LYS 673.A NZ GLN 669.A O no hydrogen 2.618 N/A CYS 676.A SG ASP 674.A O no hydrogen 3.858 N/A CYS 676.A SG SER 678.A OG no hydrogen 2.608 N/A ASP 679.A N ASP 679.A OD1 no hydrogen 2.409 N/A VAL 682.A N PRO 646.A O no hydrogen 2.156 N/A GLY 683.A N PRO 646.A O no hydrogen 2.723 N/A ALA 686.A N TRP 721.A O no hydrogen 2.993 N/A MET 687.A N GLY 612.A O no hydrogen 2.853 N/A ALA 688.A N THR 719.A O no hydrogen 2.943 N/A VAL 689.A N ARG 610.A O no hydrogen 2.993 N/A ALA 690.A N MET 717.A O no hydrogen 2.901 N/A SER 691.A N ARG 608.A O no hydrogen 2.827 N/A SER 691.A OG GLU 693.A OE1 no hydrogen 2.756 N/A LEU 692.A N TRP 715.A O no hydrogen 2.878 N/A GLU 693.A N LEU 606.A O no hydrogen 3.018 N/A PHE 694.A N PHE 713.A O no hydrogen 2.925 N/A ILE 695.A N VAL 604.A O no hydrogen 2.890 N/A THR 696.A N THR 711.A O no hydrogen 3.056 N/A THR 698.A OG1 THR 698.A O no hydrogen 2.534 N/A ALA 706.A N SER 702.A O no hydrogen 2.900 N/A ASN 707.A N ASP 703.A O no hydrogen 2.991 N/A SER 708.A N LYS 704.A O no hydrogen 2.993 N/A SER 708.A N TYR 705.A O no hydrogen 2.812 N/A SER 708.A OG LYS 704.A O no hydrogen 3.535 N/A SER 708.A OG TYR 705.A O no hydrogen 2.738 N/A VAL 709.A N ALA 706.A O no hydrogen 3.170 N/A ARG 710.A N GLN 751.A O no hydrogen 2.836 N/A ARG 710.A NH2 GLN 751.A OE1 no hydrogen 3.436 N/A SER 712.A N ALA 749.A O no hydrogen 3.031 N/A SER 712.A OG PHE 694.A O no hydrogen 2.217 N/A PHE 713.A N PHE 694.A O no hydrogen 2.940 N/A PHE 714.A N GLY 747.A O no hydrogen 2.975 N/A TRP 715.A N LEU 692.A O no hydrogen 2.865 N/A ASP 716.A N SER 745.A O no hydrogen 3.336 N/A MET 717.A N ALA 690.A O no hydrogen 2.889 N/A THR 719.A N ALA 688.A O no hydrogen 2.971 N/A THR 723.A N ASN 685.A OD1 no hydrogen 2.217 N/A THR 723.A OG1 ASN 685.A OD1 no hydrogen 3.141 N/A ASN 724.A N ASP 722.A OD1 no hydrogen 2.923 N/A TRP 725.A NE1 ASP 735.A OD1 no hydrogen 2.207 N/A SER 728.A N ASP 726.A OD1 no hydrogen 2.248 N/A GLN 729.A N ASP 726.A OD2 no hydrogen 2.611 N/A SER 731.A OG SER 727.A O no hydrogen 3.190 N/A SER 731.A OG SER 728.A O no hydrogen 2.044 N/A ASN 741.A N THR 719.A OG1 no hydrogen 3.025 N/A ARG 743.A NE ASN 741.A O no hydrogen 2.359 N/A ARG 743.A NH1 ASP 773.A OD1 no hydrogen 2.302 N/A SER 745.A OG ASP 716.A OD1 no hydrogen 2.211 N/A SER 745.A OG ASP 716.A OD2 no hydrogen 2.777 N/A GLY 747.A N PHE 714.A O no hydrogen 2.987 N/A ILE 748.A N TYR 763.A O no hydrogen 2.931 N/A ALA 749.A N SER 712.A O no hydrogen 2.982 N/A LEU 750.A N PHE 761.A O no hydrogen 2.957 N/A GLN 751.A N ARG 710.A O no hydrogen 2.982 N/A TRP 752.A N LEU 759.A O no hydrogen 2.937 N/A MET 753.A N SER 708.A O no hydrogen 2.502 N/A SER 754.A OG GLY 757.A O no hydrogen 2.138 N/A LEU 759.A N TRP 752.A O no hydrogen 2.803 N/A PHE 761.A N LEU 750.A O no hydrogen 2.922 N/A TYR 763.A N ILE 748.A O no hydrogen 2.978 N/A GLN 765.A N ALA 746.A O no hydrogen 2.967 N/A LYS 768.A NZ ILE 742.A O no hydrogen 2.327 N/A LYS 768.A NZ LYS 769.A O no hydrogen 3.137 N/A TYR 770.A N ASP 773.A OD1 no hydrogen 2.547 N/A TYR 770.A OH SER 740.A O no hydrogen 2.897 N/A LYS 774.A NZ GLY 772.A O no hydrogen 2.845 N/A GLU 776.A N GLY 638.A O no hydrogen 2.665 N/A