Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i2q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N ARG 213.A O no hydrogen 3.067 N/A VAL 12.A N ASP 123.A OD2 no hydrogen 3.389 N/A LYS 13.A N GLN 87.A OE1 no hydrogen 2.888 N/A LYS 15.A N ARG 85.A O no hydrogen 2.879 N/A GLY 20.A N ASP 19.A OD1 no hydrogen 2.497 N/A VAL 23.A N ASN 59.A O no hydrogen 3.055 N/A GLN 25.A NE2 THR 133.A O no hydrogen 2.333 N/A LYS 32.A N THR 29.A OG1 no hydrogen 3.116 N/A ILE 33.A N THR 29.A O no hydrogen 3.050 N/A LYS 34.A N GLU 30.A O no hydrogen 2.958 N/A ALA 35.A N GLU 31.A O no hydrogen 3.122 N/A LEU 36.A N LYS 32.A O no hydrogen 2.933 N/A VAL 37.A N ILE 33.A O no hydrogen 3.056 N/A GLU 38.A N LYS 34.A O no hydrogen 3.298 N/A ILE 39.A N ALA 35.A O no hydrogen 3.251 N/A CYS 40.A N LEU 36.A O no hydrogen 2.841 N/A CYS 40.A SG LEU 36.A O no hydrogen 3.335 N/A THR 41.A N VAL 37.A O no hydrogen 3.033 N/A THR 41.A OG1 VAL 37.A O no hydrogen 2.557 N/A GLU 42.A N GLU 38.A O no hydrogen 3.082 N/A MET 43.A N ILE 39.A O no hydrogen 3.049 N/A GLU 44.A N CYS 40.A O no hydrogen 2.795 N/A LYS 45.A N THR 41.A O no hydrogen 2.979 N/A GLU 46.A N GLU 42.A O no hydrogen 3.035 N/A GLY 47.A N GLU 44.A O no hydrogen 2.975 N/A LYS 48.A N MET 43.A O no hydrogen 3.146 N/A SER 50.A N GLN 147.A O no hydrogen 2.879 N/A ILE 52.A N ARG 145.A O no hydrogen 3.076 N/A ASN 56.A ND2 LYS 128.A O no hydrogen 2.872 N/A TYR 58.A N ASN 56.A OD1 no hydrogen 2.970 N/A TYR 58.A OH ASP 19.A OD1 no hydrogen 2.829 N/A ASN 59.A N PRO 21.A O no hydrogen 3.001 N/A ASN 59.A ND2 VAL 23.A O no hydrogen 2.952 N/A THR 60.A N ALA 131.A O no hydrogen 2.913 N/A THR 60.A OG1 ALA 131.A O no hydrogen 3.561 N/A PHE 63.A N LEU 76.A O no hydrogen 2.702 N/A ILE 65.A N ARG 74.A O no hydrogen 3.035 N/A LYS 66.A NZ THR 71.A O no hydrogen 2.641 N/A SER 70.A N LYS 67.A O no hydrogen 2.994 N/A ARG 74.A N ILE 65.A O no hydrogen 2.765 N/A LEU 76.A N PHE 63.A O no hydrogen 2.980 N/A ASP 78.A N PRO 61.A O no hydrogen 3.111 N/A ARG 80.A N ASP 78.A OD1 no hydrogen 3.355 N/A ARG 80.A NE ASP 78.A OD1 no hydrogen 2.967 N/A ARG 80.A NE ASP 78.A OD2 no hydrogen 3.338 N/A ARG 80.A NH2 ASP 78.A OD2 no hydrogen 3.095 N/A ASN 83.A N PHE 79.A O no hydrogen 2.730 N/A ASN 83.A ND2 GLY 154.A O no hydrogen 3.229 N/A LYS 84.A N ARG 80.A O no hydrogen 3.133 N/A ARG 85.A N LEU 82.A O no hydrogen 3.095 N/A ARG 85.A NH2 GLU 81.A OE2 no hydrogen 2.554 N/A THR 86.A N LEU 82.A O no hydrogen 2.927 N/A THR 86.A OG1 LEU 82.A O no hydrogen 2.636 N/A GLN 87.A N LYS 13.A O no hydrogen 3.463 N/A GLN 87.A NE2 ASP 88.A O no hydrogen 2.920 N/A HIS 98.A NE2 GLN 271.A OE1 no hydrogen 2.690 N/A ALA 100.A N HIS 98.A ND1 no hydrogen 3.201 N/A GLY 101.A N HIS 98.A O no hydrogen 2.614 N/A LEU 102.A N PRO 99.A O no hydrogen 3.050 N/A LYS 106.A N ASP 194.A OD1 no hydrogen 2.807 N/A LYS 106.A NZ ASP 194.A O no hydrogen 3.373 N/A SER 107.A N SER 193.A O no hydrogen 3.407 N/A THR 109.A N VAL 191.A O no hydrogen 2.513 N/A THR 109.A OG1 VAL 191.A O no hydrogen 3.564 N/A LEU 111.A N LEU 189.A O no hydrogen 2.642 N/A VAL 113.A N ASP 187.A O no hydrogen 2.719 N/A TYR 117.A OH LEU 151.A O no hydrogen 3.312 N/A SER 119.A N ALA 116.A O no hydrogen 2.842 N/A VAL 120.A N TYR 117.A O no hydrogen 3.225 N/A LEU 122.A N ASN 149.A O no hydrogen 2.991 N/A PHE 126.A N ASP 123.A O no hydrogen 3.019 N/A ARG 127.A N GLU 124.A O no hydrogen 3.429 N/A ARG 127.A NE LEU 122.A O no hydrogen 2.787 N/A ARG 127.A NH1 ASN 149.A OD1 no hydrogen 3.025 N/A ARG 127.A NH2 LEU 122.A O no hydrogen 3.088 N/A TYR 129.A N PHE 126.A O no hydrogen 3.021 N/A THR 130.A N ARG 127.A O no hydrogen 2.728 N/A THR 130.A OG1 ARG 127.A O no hydrogen 2.430 N/A ALA 131.A N LYS 128.A O no hydrogen 3.381 N/A PHE 132.A N TYR 146.A O no hydrogen 3.007 N/A THR 133.A OG1 ASN 59.A OD1 no hydrogen 2.950 N/A ILE 134.A N ILE 144.A O no hydrogen 3.162 N/A SER 136.A OG THR 141.A O no hydrogen 2.630 N/A SER 136.A OG THR 141.A OG1 no hydrogen 2.998 N/A ASN 139.A N SER 136.A O no hydrogen 3.004 N/A THR 141.A N SER 136.A OG no hydrogen 3.058 N/A THR 141.A OG1 SER 136.A OG no hydrogen 2.998 N/A ARG 145.A NH1 TYR 58.A O no hydrogen 2.987 N/A ARG 145.A NH1 THR 133.A OG1 no hydrogen 2.793 N/A ARG 145.A NH2 ASN 56.A O no hydrogen 2.627 N/A ARG 145.A NH2 TYR 58.A O no hydrogen 2.769 N/A TYR 146.A N PHE 132.A O no hydrogen 3.102 N/A TYR 146.A OH GLU 44.A OE1 no hydrogen 3.203 N/A GLN 147.A N SER 50.A O no hydrogen 2.829 N/A TYR 148.A N THR 130.A OG1 no hydrogen 3.016 N/A ASN 149.A N LYS 48.A O no hydrogen 2.903 N/A ASN 149.A ND2 GLY 47.A O no hydrogen 2.917 N/A ASN 149.A ND2 SER 50.A OG no hydrogen 3.000 N/A LEU 151.A N VAL 120.A O no hydrogen 3.312 N/A TRP 155.A N PRO 152.A O no hydrogen 3.282 N/A TRP 155.A NE1 THR 86.A OG1 no hydrogen 3.228 N/A LYS 156.A N ASN 83.A OD1 no hydrogen 2.685 N/A LYS 156.A NZ THR 86.A O no hydrogen 2.899 N/A LYS 156.A NZ GLN 87.A O no hydrogen 3.116 N/A SER 158.A OG TYR 117.A OH no hydrogen 3.193 N/A SER 158.A OG PRO 152.A O no hydrogen 2.512 N/A ILE 161.A N GLY 157.A O no hydrogen 2.744 N/A PHE 162.A N SER 158.A O no hydrogen 2.690 N/A GLN 163.A N PRO 159.A O no hydrogen 2.789 N/A SER 164.A N ALA 160.A O no hydrogen 3.111 N/A SER 164.A OG ALA 160.A O no hydrogen 2.547 N/A SER 164.A OG ILE 161.A O no hydrogen 3.038 N/A SER 165.A N ILE 161.A O no hydrogen 3.140 N/A SER 165.A OG ILE 161.A O no hydrogen 2.811 N/A MET 166.A N PHE 162.A O no hydrogen 3.111 N/A THR 167.A N GLN 163.A O no hydrogen 3.039 N/A THR 167.A OG1 GLN 163.A O no hydrogen 3.445 N/A LYS 168.A N SER 164.A O no hydrogen 3.074 N/A ILE 169.A N SER 165.A O no hydrogen 3.204 N/A LEU 170.A N MET 166.A O no hydrogen 2.755 N/A GLU 171.A N THR 167.A O no hydrogen 2.740 N/A ALA 174.A N LEU 170.A O no hydrogen 3.001 N/A ALA 175.A N GLU 171.A O no hydrogen 2.975 N/A GLN 176.A N PRO 172.A O no hydrogen 3.003 N/A GLN 176.A NE2 PRO 172.A O no hydrogen 3.412 N/A ASN 177.A ND2 PHE 173.A O no hydrogen 3.062 N/A VAL 181.A N GLY 192.A O no hydrogen 2.833 N/A CYS 183.A N TYR 190.A O no hydrogen 2.879 N/A TYR 185.A N ASP 188.A O no hydrogen 3.042 N/A ASP 188.A N TYR 185.A O no hydrogen 3.203 N/A LEU 189.A N LEU 111.A O no hydrogen 2.798 N/A TYR 190.A N CYS 183.A O no hydrogen 2.956 N/A VAL 191.A N THR 109.A O no hydrogen 2.785 N/A GLY 192.A N VAL 181.A O no hydrogen 2.978 N/A SER 193.A N SER 107.A O no hydrogen 2.944 N/A SER 193.A OG HIS 200.A ND1 no hydrogen 2.849 N/A LEU 195.A N SER 193.A OG no hydrogen 3.377 N/A GLN 199.A N GLU 196.A OE2 no hydrogen 2.801 N/A HIS 200.A N GLU 196.A O no hydrogen 3.258 N/A HIS 200.A ND1 SER 193.A OG no hydrogen 2.849 N/A HIS 200.A NE2 THR 109.A OG1 no hydrogen 2.252 N/A ARG 201.A N ILE 197.A O no hydrogen 3.485 N/A THR 202.A N GLY 198.A O no hydrogen 3.314 N/A THR 202.A OG1 GLY 198.A O no hydrogen 2.920 N/A LYS 203.A NZ ASN 177.A OD1 no hydrogen 3.339 N/A LYS 203.A NZ ASP 179.A OD1 no hydrogen 2.766 N/A LYS 203.A NZ ASP 179.A OD2 no hydrogen 2.960 N/A ILE 204.A N HIS 200.A O no hydrogen 3.050 N/A GLU 205.A N ARG 201.A O no hydrogen 2.980 N/A GLU 206.A N THR 202.A O no hydrogen 2.807 N/A LEU 207.A N LYS 203.A O no hydrogen 2.842 N/A ARG 208.A N ILE 204.A O no hydrogen 2.784 N/A ARG 208.A NH1 GLU 205.A OE1 no hydrogen 2.882 N/A GLN 209.A N GLU 205.A O no hydrogen 3.060 N/A HIS 210.A N GLU 206.A O no hydrogen 2.925 N/A HIS 210.A NE2 ILE 169.A O no hydrogen 3.083 N/A LEU 211.A N LEU 207.A O no hydrogen 2.781 N/A LEU 212.A N ARG 208.A O no hydrogen 3.142 N/A ARG 213.A N HIS 210.A O no hydrogen 3.285 N/A TRP 214.A N LEU 211.A O no hydrogen 2.910 N/A GLY 215.A N LEU 212.A O no hydrogen 2.541 N/A LEU 216.A N LEU 211.A O no hydrogen 3.090 N/A THR 218.A OG1 THR 218.A O no hydrogen 2.355 N/A LYS 222.A NZ VAL 110.A O no hydrogen 2.389 N/A PHE 229.A N LEU 236.A O no hydrogen 2.752 N/A TYR 234.A N TRP 231.A O no hydrogen 3.069 N/A TYR 234.A OH GLN 271.A OE1 no hydrogen 3.094 N/A GLU 235.A N THR 242.A O no hydrogen 2.709 N/A LEU 236.A N PHE 229.A O no hydrogen 3.061 N/A HIS 237.A N LYS 240.A O no hydrogen 2.878 N/A LYS 240.A NZ ASP 239.A OD1 no hydrogen 2.606 N/A LYS 240.A NZ ASP 239.A OD2 no hydrogen 3.044 N/A TRP 241.A N GLY 318.A O no hydrogen 3.107 N/A TRP 241.A NE1 LEU 351.A O no hydrogen 2.933 N/A THR 242.A N GLU 235.A O no hydrogen 3.242 N/A THR 242.A OG1 VAL 316.A O no hydrogen 2.714 N/A GLN 244.A N GLY 233.A O no hydrogen 2.858 N/A LYS 251.A NZ ASP 258.A OD1 no hydrogen 3.342 N/A VAL 256.A N GLU 293.A O no hydrogen 2.895 N/A ASN 257.A N LEU 291.A O no hydrogen 3.070 N/A ASN 257.A ND2 GLN 260.A OE1 no hydrogen 3.641 N/A ILE 259.A N THR 255.A O no hydrogen 2.850 N/A GLN 260.A N VAL 256.A O no hydrogen 3.138 N/A LYS 261.A N ASN 257.A O no hydrogen 3.084 N/A LYS 261.A NZ ASN 257.A OD1 no hydrogen 2.771 N/A LEU 262.A N ILE 259.A O no hydrogen 2.928 N/A VAL 263.A N ILE 259.A O no hydrogen 2.899 N/A GLY 264.A N GLN 260.A O no hydrogen 3.175 N/A LYS 265.A N LYS 261.A O no hydrogen 3.455 N/A LEU 266.A N LEU 262.A O no hydrogen 3.192 N/A ASN 267.A N VAL 263.A O no hydrogen 2.479 N/A TRP 268.A N GLY 264.A O no hydrogen 2.713 N/A ALA 269.A N LYS 265.A O no hydrogen 2.851 N/A SER 270.A N LEU 266.A O no hydrogen 2.797 N/A SER 270.A OG ASN 267.A O no hydrogen 2.335 N/A GLN 271.A NE2 TRP 268.A O no hydrogen 2.612 N/A ILE 272.A N ALA 269.A O no hydrogen 2.931 N/A TYR 273.A N ALA 269.A O no hydrogen 2.947 N/A LYS 277.A NZ GLU 307.A OE2 no hydrogen 3.487 N/A ARG 279.A N SER 282.A OG no hydrogen 2.984 N/A ARG 279.A NE GLN 336.A O no hydrogen 2.882 N/A SER 282.A OG ARG 279.A O no hydrogen 3.137 N/A LYS 283.A N ARG 279.A O no hydrogen 2.401 N/A ARG 286.A N LYS 283.A O no hydrogen 2.932 N/A THR 288.A N ARG 286.A O no hydrogen 2.756 N/A GLU 293.A N ALA 290.A O no hydrogen 3.129 N/A ILE 295.A N GLU 293.A O no hydrogen 2.817 N/A GLU 302.A N THR 298.A O no hydrogen 3.231 N/A GLU 304.A N GLU 300.A O no hydrogen 3.024 N/A LEU 305.A N ALA 301.A O no hydrogen 2.992 N/A ALA 306.A N GLU 302.A O no hydrogen 2.845 N/A GLU 307.A N LEU 303.A O no hydrogen 2.967 N/A ASN 308.A N GLU 304.A O no hydrogen 3.014 N/A ASN 308.A ND2 LYS 277.A O no hydrogen 3.508 N/A ARG 309.A N LEU 305.A O no hydrogen 2.995 N/A ARG 309.A NH1 LEU 248.A O no hydrogen 2.877 N/A ARG 309.A NH2 PRO 249.A O no hydrogen 2.352 N/A LEU 312.A N ASN 308.A O no hydrogen 2.835 N/A LYS 313.A NZ GLU 310.A OE2 no hydrogen 2.753 N/A GLY 318.A N TRP 241.A O no hydrogen 2.818 N/A VAL 319.A N ASN 350.A O no hydrogen 2.991 N/A TYR 320.A OH HIS 237.A O no hydrogen 2.873 N/A TYR 321.A N LEU 102.A O no hydrogen 2.480 N/A ASP 322.A N GLN 345.A OE1 no hydrogen 2.838 N/A SER 324.A N ASP 322.A OD1 no hydrogen 3.147 N/A SER 324.A OG ASP 322.A OD1 no hydrogen 2.252 N/A LYS 325.A N ASP 322.A O no hydrogen 2.989 N/A ILE 328.A N TYR 344.A O no hydrogen 2.844 N/A ALA 329.A N LYS 390.A O no hydrogen 2.743 N/A GLU 330.A N GLN 342.A O no hydrogen 2.781 N/A ILE 331.A N LYS 392.A O no hydrogen 3.360 N/A GLN 332.A N THR 340.A O no hydrogen 2.686 N/A GLN 332.A NE2 GLU 330.A OE2 no hydrogen 3.252 N/A GLN 332.A NE2 GLN 342.A OE1 no hydrogen 3.411 N/A LYS 333.A NZ ASP 366.A OD2 no hydrogen 3.406 N/A GLN 334.A N GLN 338.A O no hydrogen 2.643 N/A GLN 334.A NE2 GLY 275.A O no hydrogen 3.314 N/A TRP 339.A N TYR 356.A O no hydrogen 2.980 N/A TRP 339.A NE1 GLN 369.A OE1 no hydrogen 2.810 N/A THR 340.A N GLN 332.A O no hydrogen 2.986 N/A THR 340.A OG1 GLY 354.A O no hydrogen 3.247 N/A TYR 341.A N GLY 354.A O no hydrogen 2.415 N/A TYR 341.A OH GLU 380.A OE2 no hydrogen 2.610 N/A GLN 342.A N GLU 330.A O no hydrogen 2.898 N/A GLN 342.A NE2 GLN 332.A OE1 no hydrogen 3.422 N/A ILE 343.A N LYS 352.A O no hydrogen 2.989 N/A TYR 344.A N ILE 328.A O no hydrogen 2.928 N/A GLN 345.A NE2 ASP 322.A O no hydrogen 3.210 N/A GLN 345.A NE2 ASP 326.A O no hydrogen 2.649 N/A LYS 349.A N GLU 346.A O no hydrogen 3.048 N/A LEU 351.A N ILE 343.A O no hydrogen 2.668 N/A LYS 352.A N ILE 343.A O no hydrogen 3.339 N/A LYS 352.A NZ GLU 380.A OE1 no hydrogen 3.423 N/A LYS 352.A NZ GLU 380.A OE2 no hydrogen 3.400 N/A THR 353.A N GLN 271.A O no hydrogen 2.626 N/A THR 353.A OG1 SER 270.A O no hydrogen 2.756 N/A GLY 354.A N TYR 341.A O no hydrogen 2.650 N/A LYS 355.A NZ ASN 267.A OD1 no hydrogen 3.084 N/A TYR 356.A N TRP 339.A O no hydrogen 2.858 N/A TYR 356.A OH GLU 372.A OE1 no hydrogen 2.762 N/A ARG 358.A N GLY 337.A O no hydrogen 2.991 N/A HIS 363.A ND1 SER 515.A OG no hydrogen 2.730 N/A THR 364.A N LYS 514.A O no hydrogen 3.206 N/A ASN 365.A ND2 GLN 511.A O no hydrogen 2.329 N/A ASP 366.A N ASP 513.A OD2 no hydrogen 3.204 N/A LYS 368.A N ASN 365.A OD1 no hydrogen 3.000 N/A LYS 368.A NZ TYR 407.A OH no hydrogen 2.893 N/A LYS 368.A NZ ALA 510.A O no hydrogen 2.878 N/A GLN 369.A N ASN 365.A O no hydrogen 3.127 N/A GLN 369.A N ASP 366.A O no hydrogen 3.089 N/A GLN 369.A NE2 THR 364.A OG1 no hydrogen 3.053 N/A LEU 370.A N ASP 366.A O no hydrogen 2.946 N/A THR 371.A N VAL 367.A O no hydrogen 3.183 N/A THR 371.A OG1 VAL 367.A O no hydrogen 2.813 N/A GLU 372.A N LYS 368.A O no hydrogen 3.089 N/A ALA 373.A N GLN 369.A O no hydrogen 2.919 N/A VAL 374.A N LEU 370.A O no hydrogen 2.698 N/A GLN 375.A N THR 371.A O no hydrogen 2.951 N/A GLN 375.A NE2.B TRP 412.A O no hydrogen 2.697 N/A LYS 376.A N GLU 372.A O no hydrogen 2.858 N/A LYS 376.A NZ LYS 355.A O no hydrogen 2.799 N/A ILE 377.A N ALA 373.A O no hydrogen 2.791 N/A THR 378.A N VAL 374.A O no hydrogen 2.769 N/A THR 378.A OG1 VAL 374.A O no hydrogen 2.967 N/A THR 379.A N GLN 375.A O no hydrogen 2.938 N/A GLU 380.A N LYS 376.A O no hydrogen 2.991 N/A SER 381.A N ILE 377.A O no hydrogen 2.832 N/A SER 381.A OG ILE 377.A O no hydrogen 3.176 N/A ILE 382.A N THR 378.A O no hydrogen 2.957 N/A VAL 383.A N THR 379.A O no hydrogen 2.979 N/A ILE 384.A N GLU 380.A O no hydrogen 3.044 N/A TRP 385.A N SER 381.A O no hydrogen 2.940 N/A TRP 385.A NE1 ALA 100.A O no hydrogen 2.822 N/A GLY 386.A N SER 381.A O no hydrogen 3.281 N/A GLY 386.A N ILE 382.A O no hydrogen 3.072 N/A LYS 390.A N LEU 327.A O no hydrogen 2.812 N/A LYS 390.A NZ ASP 326.A OD2 no hydrogen 3.223 N/A PHE 391.A N GLU 415.A O no hydrogen 3.121 N/A LYS 392.A N ALA 329.A O no hydrogen 2.812 N/A LYS 392.A NZ GLU 330.A OE1 no hydrogen 3.180 N/A LYS 392.A NZ TYR 344.A OH no hydrogen 2.621 N/A LEU 393.A N GLU 417.A O no hydrogen 2.969 N/A LYS 397.A NZ TRP 416.A O no hydrogen 2.726 N/A TRP 400.A N GLN 396.A O no hydrogen 3.236 N/A GLU 401.A N LYS 397.A O no hydrogen 3.071 N/A THR 402.A N GLU 398.A O no hydrogen 3.056 N/A THR 402.A OG1 GLU 398.A O no hydrogen 3.429 N/A TRP 403.A N THR 399.A O no hydrogen 2.941 N/A TRP 404.A N TRP 400.A O no hydrogen 2.857 N/A THR 405.A N GLU 401.A O no hydrogen 2.889 N/A THR 405.A OG1 GLU 401.A O no hydrogen 2.360 N/A THR 405.A OG1 THR 402.A O no hydrogen 3.073 N/A GLU 406.A N TRP 403.A O no hydrogen 3.123 N/A GLU 417.A N PHE 391.A O no hydrogen 2.746 N/A VAL 419.A N LEU 393.A O no hydrogen 2.873 N/A THR 421.A N VAL 419.A O no hydrogen 2.842 N/A VAL 425.A N PRO 394.A O no hydrogen 2.878 N/A TYR 429.A OH PRO 512.A O no hydrogen 2.690 N/A GLU 432.A N VAL 533.A O no hydrogen 2.822 N/A LYS 433.A NZ GLU 406.A OE1 no hydrogen 2.424 N/A ILE 436.A N ASN 496.A OD1 no hydrogen 2.807 N/A THR 441.A N ASN 462.A OD1 no hydrogen 2.964 N/A PHE 442.A N ASN 496.A O no hydrogen 2.659 N/A TYR 443.A N VAL 460.A O no hydrogen 2.828 N/A VAL 444.A N VAL 498.A O no hydrogen 2.960 N/A ASP 445.A N GLY 458.A O no hydrogen 3.107 N/A GLY 446.A N ASP 445.A OD1 no hydrogen 2.410 N/A ALA 447.A N LYS 456.A O no hydrogen 3.125 N/A ALA 448.A N ASN 476.A OD1 no hydrogen 3.347 N/A ASN 449.A N LEU 454.A O no hydrogen 2.521 N/A THR 452.A N ASN 449.A OD1 no hydrogen 2.877 N/A THR 452.A OG1 ASN 449.A O no hydrogen 3.437 N/A THR 452.A OG1 ASN 449.A OD1 no hydrogen 2.708 N/A LYS 453.A N ASN 449.A O no hydrogen 2.847 N/A LYS 453.A NZ ARG 450.A O no hydrogen 2.452 N/A LEU 454.A N THR 452.A OG1 no hydrogen 3.063 N/A GLY 455.A N LEU 471.A O no hydrogen 2.970 N/A LYS 456.A N ALA 447.A O no hydrogen 2.881 N/A ALA 457.A N VAL 469.A O no hydrogen 3.041 N/A GLY 458.A N ASP 445.A O no hydrogen 3.130 N/A TYR 459.A N LYS 467.A O no hydrogen 2.863 N/A TYR 459.A OH ASP 490.A OD2 no hydrogen 2.555 N/A VAL 460.A N TYR 443.A O no hydrogen 2.845 N/A THR 461.A N ARG 465.A O no hydrogen 2.990 N/A THR 461.A OG1 GLU 440.A OE2 no hydrogen 2.540 N/A ASN 462.A N THR 441.A O no hydrogen 3.377 N/A LYS 463.A N THR 461.A OG1 no hydrogen 2.711 N/A GLY 464.A N THR 461.A O no hydrogen 3.128 N/A ARG 465.A N THR 461.A OG1 no hydrogen 3.419 N/A ARG 465.A NE GLU 440.A OE2 no hydrogen 3.372 N/A ARG 465.A NH2 GLU 440.A OE1 no hydrogen 2.840 N/A ARG 465.A NH2 GLU 440.A OE2 no hydrogen 3.564 N/A LYS 467.A N TYR 459.A O no hydrogen 3.153 N/A LYS 467.A NZ ASP 490.A OD2 no hydrogen 3.072 N/A VAL 469.A N ALA 457.A O no hydrogen 2.829 N/A LEU 471.A N GLY 455.A O no hydrogen 2.707 N/A THR 474.A N LYS 453.A O no hydrogen 2.898 N/A THR 474.A OG1 THR 475.A O no hydrogen 3.517 N/A LYS 478.A N THR 475.A OG1 no hydrogen 3.026 N/A THR 479.A N THR 475.A O no hydrogen 3.028 N/A THR 479.A OG1 THR 475.A O no hydrogen 3.518 N/A THR 479.A OG1 ASN 476.A O no hydrogen 3.039 N/A GLU 480.A N ASN 476.A O no hydrogen 2.972 N/A LEU 481.A N GLN 477.A O no hydrogen 3.383 N/A LEU 481.A N LYS 478.A O no hydrogen 3.235 N/A GLN 482.A N LYS 478.A O no hydrogen 2.997 N/A ALA 483.A N THR 479.A O no hydrogen 3.028 N/A TYR 485.A N LEU 481.A O no hydrogen 2.941 N/A LEU 486.A N GLN 482.A O no hydrogen 2.887 N/A ALA 487.A N ALA 483.A O no hydrogen 3.204 N/A LEU 488.A N ILE 484.A O no hydrogen 3.000 N/A GLN 489.A N TYR 485.A O no hydrogen 2.827 N/A ASP 490.A N LEU 486.A O no hydrogen 2.844 N/A SER 491.A N LEU 488.A O no hydrogen 3.394 N/A SER 491.A OG ALA 487.A O no hydrogen 2.687 N/A SER 491.A OG LEU 488.A O no hydrogen 3.086 N/A VAL 495.A N LYS 532.A O no hydrogen 3.063 N/A ASN 496.A N GLU 440.A O no hydrogen 2.966 N/A ASN 496.A ND2 ILE 436.A O no hydrogen 3.062 N/A ASN 496.A ND2 ALA 439.A O no hydrogen 3.168 N/A ILE 497.A N TYR 534.A O no hydrogen 2.902 N/A VAL 498.A N PHE 442.A O no hydrogen 2.965 N/A THR 499.A N ALA 536.A O no hydrogen 3.127 N/A SER 501.A N THR 499.A OG1 no hydrogen 2.904 N/A ALA 504.A N SER 501.A OG no hydrogen 2.978 N/A LEU 505.A N SER 501.A O no hydrogen 3.220 N/A GLY 506.A N GLN 502.A O no hydrogen 2.974 N/A ILE 507.A N TYR 503.A O no hydrogen 3.288 N/A ILE 507.A N ALA 504.A O no hydrogen 2.973 N/A ILE 508.A N ALA 504.A O no hydrogen 3.131 N/A GLN 509.A N LEU 505.A O no hydrogen 2.705 N/A ALA 510.A N ILE 507.A O no hydrogen 3.309 N/A GLN 511.A N ILE 508.A O no hydrogen 3.165 N/A ASP 513.A N THR 364.A O no hydrogen 2.672 N/A LYS 514.A N THR 364.A O no hydrogen 3.238 N/A LYS 514.A NZ ASP 513.A O no hydrogen 3.212 N/A SER 515.A N ASN 521.A OD1 no hydrogen 2.819 N/A SER 515.A OG ALA 362.A O no hydrogen 3.137 N/A SER 515.A OG HIS 363.A ND1 no hydrogen 2.730 N/A GLU 516.A N ALA 362.A O no hydrogen 2.949 N/A SER 517.A N SER 515.A OG no hydrogen 3.256 N/A ASN 521.A N SER 517.A O no hydrogen 3.071 N/A ASN 521.A ND2 SER 515.A O no hydrogen 2.924 N/A GLN 522.A N GLU 518.A O no hydrogen 2.970 N/A ILE 523.A N LEU 519.A O no hydrogen 3.196 N/A ILE 524.A N VAL 520.A O no hydrogen 2.852 N/A GLU 525.A N ASN 521.A O no hydrogen 2.821 N/A GLN 526.A N GLN 522.A O no hydrogen 2.875 N/A LEU 527.A N ILE 523.A O no hydrogen 2.817 N/A ILE 528.A N ILE 524.A O no hydrogen 2.930 N/A LYS 529.A N GLN 526.A O no hydrogen 2.958 N/A LYS 530.A N LEU 527.A O no hydrogen 2.883 N/A LYS 530.A NZ LEU 488.A O no hydrogen 2.919 N/A LYS 530.A NZ SER 491.A OG no hydrogen 3.043 N/A LYS 530.A NZ GLY 492.A O no hydrogen 2.727 N/A GLU 531.A N LEU 493.A O no hydrogen 2.677 N/A LYS 532.A N LEU 493.A O no hydrogen 3.064 N/A TYR 534.A N VAL 495.A O no hydrogen 3.170 N/A ALA 536.A N ILE 497.A O no hydrogen 2.889 N/A VAL 538.A N THR 499.A O no hydrogen 3.066 N/A GLY 546.A N GLN 549.A OE1 no hydrogen 2.973 N/A ASN 547.A ND2 ASP 500.A OD2 no hydrogen 3.331 N/A GLU 548.A N ILE 544.A O no hydrogen 2.680 N/A VAL 550.A N GLY 546.A O no hydrogen 3.236 N/A ASP 551.A N ASN 547.A O no hydrogen 2.858 N/A LYS 552.A N GLU 548.A O no hydrogen 2.976 N/A VAL 554.A N ASP 551.A O no hydrogen 3.230 N/A SER 555.A N ASP 551.A O no hydrogen 3.004 N/A SER 555.A OG ASP 551.A O no hydrogen 2.956 N/A