Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jqz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD2 no hydrogen 2.628 N/A SER 5.A OG CYS 62.A O no hydrogen 3.113 N/A ALA 8.A N SER 5.A O no hydrogen 2.754 N/A HIS 9.A N SER 5.A O no hydrogen 3.360 N/A ARG 10.A NE GLU 6.A OE2 no hydrogen 2.840 N/A ARG 10.A NH1 ASP 255.A OD2 no hydrogen 2.572 N/A ARG 10.A NH2 ASP 1.A OD2 no hydrogen 2.822 N/A PHE 11.A N VAL 7.A O no hydrogen 3.137 N/A LYS 12.A N ALA 8.A O no hydrogen 3.082 N/A LEU 14.A N ARG 10.A O no hydrogen 2.908 N/A GLY 15.A N PHE 11.A O no hydrogen 2.869 N/A ASN 18.A ND2 LEU 14.A O no hydrogen 3.082 N/A LYS 20.A N GLU 16.A O no hydrogen 3.389 N/A LYS 20.A NZ ASN 44.A OD1 no hydrogen 2.981 N/A VAL 23.A N PHE 19.A O no hydrogen 2.735 N/A ILE 25.A N ALA 21.A O no hydrogen 2.736 N/A PHE 27.A N VAL 23.A O no hydrogen 3.192 N/A ALA 28.A N LEU 24.A O no hydrogen 2.901 N/A GLN 29.A N ILE 25.A O no hydrogen 2.601 N/A TYR 30.A N PHE 27.A O no hydrogen 3.145 N/A LEU 31.A N PHE 27.A O no hydrogen 2.790 N/A GLN 32.A N ALA 28.A O no hydrogen 3.095 N/A CYS 34.A N LEU 31.A O no hydrogen 2.731 N/A GLU 37.A N GLU 37.A OE2 no hydrogen 2.674 N/A HIS 39.A N PHE 36.A O no hydrogen 2.718 N/A VAL 40.A N PHE 36.A O no hydrogen 3.143 N/A LYS 41.A N GLU 37.A O no hydrogen 2.907 N/A LEU 42.A N ASP 38.A O no hydrogen 3.226 N/A VAL 43.A N HIS 39.A O no hydrogen 2.909 N/A ASN 44.A N VAL 40.A O no hydrogen 2.781 N/A VAL 46.A N VAL 43.A O no hydrogen 3.174 N/A THR 47.A OG1 VAL 43.A O no hydrogen 2.526 N/A ALA 50.A N VAL 46.A O no hydrogen 3.140 N/A LYS 51.A N GLU 48.A O no hydrogen 2.788 N/A THR 52.A N GLU 48.A O no hydrogen 3.134 N/A THR 52.A OG1 PHE 49.A O no hydrogen 3.292 N/A CYS 53.A SG PHE 49.A O no hydrogen 3.205 N/A VAL 54.A N LYS 51.A O no hydrogen 2.978 N/A ALA 55.A N THR 52.A O no hydrogen 3.046 N/A ASN 61.A ND2 GLU 60.A O no hydrogen 2.748 N/A CYS 62.A N ALA 59.A O no hydrogen 2.953 N/A CYS 62.A SG THR 52.A OG1 no hydrogen 3.505 N/A LYS 64.A N ASN 61.A O no hydrogen 2.718 N/A LYS 64.A NZ ASN 61.A OD1 no hydrogen 2.831 N/A SER 65.A OG THR 68.A OG1 no hydrogen 3.291 N/A THR 68.A N SER 65.A O no hydrogen 2.646 N/A THR 68.A OG1 SER 65.A O no hydrogen 2.979 N/A THR 68.A OG1 SER 65.A OG no hydrogen 3.291 N/A PHE 70.A N LEU 66.A O no hydrogen 2.624 N/A GLY 71.A N HIS 67.A O no hydrogen 3.013 N/A ASP 72.A N THR 68.A O no hydrogen 3.099 N/A LYS 73.A N LEU 69.A O no hydrogen 3.254 N/A LYS 73.A NZ GLU 45.A OE1 no hydrogen 3.478 N/A LEU 74.A N PHE 70.A O no hydrogen 2.927 N/A LEU 74.A N GLY 71.A O no hydrogen 3.032 N/A CYS 75.A N GLY 71.A O no hydrogen 3.058 N/A THR 76.A OG1 LYS 73.A O no hydrogen 2.968 N/A VAL 77.A N LEU 74.A O no hydrogen 3.409 N/A LEU 80.A N THR 79.A OG1 no hydrogen 2.645 N/A GLU 82.A N THR 79.A O no hydrogen 3.306 N/A THR 83.A N LEU 80.A O no hydrogen 2.715 N/A THR 83.A OG1 LEU 80.A O no hydrogen 2.588 N/A TYR 84.A N ARG 81.A O no hydrogen 2.827 N/A ALA 88.A N HIS 105.A NE2 no hydrogen 3.479 N/A CYS 90.A SG CYS 101.A O no hydrogen 3.192 N/A CYS 90.A SG HIS 105.A NE2 no hydrogen 3.834 N/A CYS 91.A SG GLY 71.A O no hydrogen 3.671 N/A LYS 93.A N CYS 90.A O no hydrogen 2.942 N/A LYS 93.A NZ GLU 97.A OE1 no hydrogen 3.121 N/A ARG 98.A N GLN 94.A O no hydrogen 2.988 N/A ARG 98.A NE GLU 95.A OE2 no hydrogen 2.723 N/A ARG 98.A NH1 HIS 67.A O no hydrogen 3.383 N/A ARG 98.A NH1 ASP 72.A OD1 no hydrogen 3.219 N/A ARG 98.A NH2 ASP 72.A OD1 no hydrogen 3.444 N/A ASN 99.A N PRO 96.A O no hydrogen 2.967 N/A CYS 101.A N GLU 97.A O no hydrogen 3.030 N/A LEU 103.A N ASN 99.A O no hydrogen 3.211 N/A HIS 105.A N PHE 102.A O no hydrogen 3.189 N/A LYS 106.A NZ PRO 147.A O no hydrogen 2.957 N/A ASN 109.A N ASP 107.A OD1 no hydrogen 3.072 N/A LEU 112.A N PRO 110.A O no hydrogen 3.019 N/A ARG 117.A NH1 ASP 183.A OD1 no hydrogen 2.892 N/A ARG 117.A NH2 ASP 183.A OD1 no hydrogen 3.386 N/A VAL 122.A N GLU 119.A O no hydrogen 2.964 N/A MET 123.A N GLU 119.A O no hydrogen 3.257 N/A CYS 124.A N VAL 120.A O no hydrogen 3.414 N/A CYS 124.A SG VAL 120.A O no hydrogen 3.593 N/A THR 125.A N ASP 121.A O no hydrogen 3.103 N/A THR 125.A OG1 ASP 121.A O no hydrogen 2.751 N/A ALA 126.A N VAL 122.A O no hydrogen 3.132 N/A PHE 127.A N MET 123.A O no hydrogen 2.790 N/A HIS 128.A N CYS 124.A O no hydrogen 2.971 N/A HIS 128.A N THR 125.A O no hydrogen 2.935 N/A ASP 129.A N THR 125.A O no hydrogen 2.960 N/A ASN 130.A N ALA 126.A O no hydrogen 3.335 N/A PHE 134.A N ASN 130.A O no hydrogen 3.178 N/A LYS 136.A N GLU 132.A O no hydrogen 3.014 N/A LYS 137.A N THR 133.A O no hydrogen 3.271 N/A LYS 137.A NZ TYR 161.A OH no hydrogen 3.143 N/A TYR 138.A N PHE 134.A O no hydrogen 3.423 N/A LEU 139.A N LEU 135.A O no hydrogen 3.301 N/A TYR 140.A N LYS 137.A O no hydrogen 2.966 N/A TYR 140.A OH CYS 34.A O no hydrogen 2.906 N/A GLU 141.A N LYS 137.A O no hydrogen 2.695 N/A ILE 142.A N TYR 138.A O no hydrogen 3.451 N/A ARG 144.A N TYR 140.A O no hydrogen 3.090 N/A ARG 144.A NE GLN 32.A O no hydrogen 3.039 N/A ARG 144.A NH1 GLU 141.A OE1 no hydrogen 3.465 N/A ARG 144.A NH2 GLN 32.A O no hydrogen 2.845 N/A ARG 145.A N ILE 142.A O no hydrogen 3.120 N/A ARG 145.A NE PRO 113.A O no hydrogen 3.022 N/A ARG 145.A NH1 GLU 141.A O no hydrogen 2.873 N/A ARG 145.A NH1 GLU 141.A OE1 no hydrogen 2.875 N/A ARG 145.A NH2 PRO 113.A O no hydrogen 3.127 N/A HIS 146.A ND1 SER 193.A OG no hydrogen 2.810 N/A PHE 149.A N HIS 146.A O no hydrogen 3.027 N/A LEU 154.A N TYR 150.A O no hydrogen 2.902 N/A LEU 155.A N PRO 152.A O no hydrogen 2.942 N/A PHE 156.A N PRO 152.A O no hydrogen 3.444 N/A PHE 157.A N GLU 153.A O no hydrogen 3.332 N/A LYS 159.A N LEU 155.A O no hydrogen 3.148 N/A ARG 160.A N PHE 156.A O no hydrogen 2.992 N/A ARG 160.A NH1 GLU 188.A OE2 no hydrogen 2.571 N/A ARG 160.A NH2 GLU 188.A OE1 no hydrogen 2.950 N/A TYR 161.A N PHE 157.A O no hydrogen 2.578 N/A LYS 162.A N ALA 158.A O no hydrogen 2.804 N/A ALA 163.A N LYS 159.A O no hydrogen 2.916 N/A ALA 164.A N ARG 160.A O no hydrogen 3.011 N/A PHE 165.A N TYR 161.A O no hydrogen 3.200 N/A PHE 165.A N LYS 162.A O no hydrogen 2.817 N/A THR 166.A N LYS 162.A O no hydrogen 2.745 N/A THR 166.A OG1 ALA 163.A O no hydrogen 2.886 N/A GLU 167.A N ALA 163.A O no hydrogen 2.932 N/A CYS 168.A N ALA 164.A O no hydrogen 3.244 N/A CYS 169.A N PHE 165.A O no hydrogen 2.993 N/A LYS 174.A N ALA 171.A O no hydrogen 2.907 N/A ALA 176.A N ASP 173.A O no hydrogen 3.215 N/A CYS 177.A N LYS 174.A O no hydrogen 3.002 N/A LEU 178.A N LYS 174.A O no hydrogen 2.948 N/A LEU 179.A N ALA 175.A O no hydrogen 3.355 N/A LYS 181.A N LEU 178.A O no hydrogen 2.734 N/A LYS 181.A NZ GLU 167.A OE2 no hydrogen 3.037 N/A LEU 182.A N LEU 178.A O no hydrogen 3.071 N/A LEU 182.A N LEU 179.A O no hydrogen 2.696 N/A ASP 183.A N LEU 179.A O no hydrogen 2.836 N/A LEU 185.A N LYS 181.A O no hydrogen 3.264 N/A ARG 186.A N LEU 182.A O no hydrogen 2.548 N/A ASP 187.A N ASP 183.A O no hydrogen 3.121 N/A GLU 188.A N GLU 184.A O no hydrogen 2.814 N/A GLY 189.A N LEU 185.A O no hydrogen 2.785 N/A LYS 190.A N ARG 186.A O no hydrogen 3.036 N/A ALA 191.A N ASP 187.A O no hydrogen 2.812 N/A SER 192.A N GLU 188.A O no hydrogen 3.263 N/A SER 193.A N GLY 189.A O no hydrogen 3.087 N/A SER 193.A OG HIS 146.A ND1 no hydrogen 2.810 N/A ALA 194.A N ALA 191.A O no hydrogen 3.188 N/A LYS 195.A N ALA 191.A O no hydrogen 3.184 N/A LYS 195.A NZ GLU 292.A OE2 no hydrogen 2.996 N/A GLN 196.A N SER 192.A O no hydrogen 2.915 N/A GLN 196.A NE2 HIS 242.A ND1 no hydrogen 3.219 N/A ARG 197.A N SER 193.A O no hydrogen 3.037 N/A LEU 198.A N ALA 194.A O no hydrogen 3.375 N/A LYS 199.A N LYS 195.A O no hydrogen 3.125 N/A CYS 200.A N GLN 196.A O no hydrogen 2.887 N/A CYS 200.A SG GLN 196.A O no hydrogen 3.776 N/A ALA 201.A N ARG 197.A O no hydrogen 2.741 N/A SER 202.A N LEU 198.A O no hydrogen 2.840 N/A SER 202.A N LYS 199.A O no hydrogen 3.178 N/A SER 202.A OG LEU 198.A O no hydrogen 3.567 N/A SER 202.A OG LYS 199.A O no hydrogen 2.754 N/A LEU 203.A N CYS 200.A O no hydrogen 2.946 N/A GLN 204.A N CYS 200.A O no hydrogen 2.931 N/A LYS 205.A NZ GLU 465.A OE2 no hydrogen 2.999 N/A LYS 212.A N GLU 208.A O no hydrogen 2.918 N/A TRP 214.A N PHE 211.A O no hydrogen 2.695 N/A ALA 215.A N PHE 211.A O no hydrogen 3.321 N/A VAL 216.A N LYS 212.A O no hydrogen 2.833 N/A ALA 217.A N TRP 214.A O no hydrogen 3.027 N/A ARG 218.A N TRP 214.A O no hydrogen 2.883 N/A LEU 219.A N ALA 215.A O no hydrogen 2.593 N/A SER 220.A OG VAL 216.A O no hydrogen 2.587 N/A SER 220.A OG TYR 332.A O no hydrogen 3.455 N/A GLN 221.A N ALA 217.A O no hydrogen 3.433 N/A GLN 221.A NE2 HIS 338.A O no hydrogen 2.832 N/A GLN 221.A NE2 TYR 341.A O no hydrogen 2.926 N/A PHE 223.A N LEU 219.A O no hydrogen 2.923 N/A ALA 226.A N PRO 224.A O no hydrogen 2.821 N/A GLU 230.A N GLU 227.A O no hydrogen 3.142 N/A VAL 231.A N GLU 227.A O no hydrogen 3.040 N/A SER 232.A N PHE 228.A O no hydrogen 2.828 N/A LYS 233.A NZ ASP 237.A OD2 no hydrogen 2.940 N/A LEU 234.A N GLU 230.A O no hydrogen 3.167 N/A VAL 235.A N VAL 231.A O no hydrogen 2.625 N/A THR 236.A OG1 SER 232.A O no hydrogen 3.351 N/A THR 236.A OG1 LYS 233.A O no hydrogen 2.764 N/A THR 236.A OG1 ASP 237.A OD1 no hydrogen 3.535 N/A ASP 237.A N LYS 233.A O no hydrogen 2.999 N/A LEU 238.A N LEU 234.A O no hydrogen 2.720 N/A THR 239.A N VAL 235.A O no hydrogen 3.058 N/A THR 239.A OG1 VAL 235.A O no hydrogen 3.096 N/A LYS 240.A N THR 236.A O no hydrogen 3.436 N/A LYS 240.A NZ ASP 256.A OD1 no hydrogen 2.920 N/A VAL 241.A N ASP 237.A O no hydrogen 3.500 N/A HIS 242.A N LEU 238.A O no hydrogen 3.055 N/A THR 243.A N THR 239.A O no hydrogen 2.896 N/A THR 243.A OG1 THR 239.A O no hydrogen 2.525 N/A THR 243.A OG1 LYS 240.A O no hydrogen 3.419 N/A GLU 244.A N LYS 240.A O no hydrogen 3.194 N/A GLU 244.A N VAL 241.A O no hydrogen 2.806 N/A CYS 245.A N VAL 241.A O no hydrogen 3.105 N/A CYS 246.A N HIS 242.A O no hydrogen 3.149 N/A CYS 246.A SG HIS 242.A O no hydrogen 2.993 N/A HIS 247.A N THR 243.A O no hydrogen 2.952 N/A HIS 247.A ND1 HIS 247.A O no hydrogen 2.716 N/A LEU 250.A N GLY 248.A O no hydrogen 2.762 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.616 N/A CYS 253.A N ASP 249.A O no hydrogen 2.968 N/A CYS 253.A SG VAL 241.A O no hydrogen 3.700 N/A ALA 254.A N LEU 250.A O no hydrogen 2.884 N/A ASP 255.A N LEU 251.A O no hydrogen 2.798 N/A ASP 256.A N GLU 252.A O no hydrogen 2.760 N/A ARG 257.A N CYS 253.A O no hydrogen 2.952 N/A ARG 257.A NH2 GLU 153.A OE2 no hydrogen 2.863 N/A ALA 258.A N ALA 254.A O no hydrogen 2.853 N/A ASP 259.A N ASP 255.A O no hydrogen 3.213 N/A LEU 260.A N ASP 256.A O no hydrogen 3.055 N/A LEU 260.A N ARG 257.A O no hydrogen 3.105 N/A ALA 261.A N ARG 257.A O no hydrogen 3.106 N/A LYS 262.A N ALA 258.A O no hydrogen 2.959 N/A TYR 263.A N ASP 259.A O no hydrogen 3.216 N/A TYR 263.A OH GLU 230.A OE1 no hydrogen 2.833 N/A ILE 264.A N LEU 260.A O no hydrogen 2.780 N/A CYS 265.A N ALA 261.A O no hydrogen 3.007 N/A CYS 265.A SG ALA 261.A O no hydrogen 3.304 N/A GLU 266.A N TYR 263.A O no hydrogen 2.680 N/A ASN 267.A N TYR 263.A O no hydrogen 2.975 N/A ASN 267.A ND2 GLU 230.A OE2 no hydrogen 3.206 N/A SER 272.A N GLN 268.A O no hydrogen 3.329 N/A SER 272.A OG ILE 271.A O no hydrogen 2.425 N/A SER 273.A N ASP 296.A OD2 no hydrogen 3.317 N/A LYS 276.A NZ LYS 274.A O no hydrogen 2.603 N/A CYS 278.A N LEU 275.A O no hydrogen 2.966 N/A CYS 279.A N LEU 275.A O no hydrogen 3.080 N/A CYS 279.A SG LEU 275.A O no hydrogen 3.482 N/A LYS 281.A NZ GLU 285.A O no hydrogen 3.287 N/A HIS 288.A ND1 GLU 153.A OE1 no hydrogen 3.146 N/A HIS 288.A ND1 GLU 153.A OE2 no hydrogen 2.744 N/A ILE 290.A N LYS 286.A O no hydrogen 3.376 N/A ALA 291.A N SER 287.A O no hydrogen 3.387 N/A ALA 291.A N HIS 288.A O no hydrogen 3.022 N/A GLU 292.A N HIS 288.A O no hydrogen 3.305 N/A ASN 295.A N GLU 294.A OE1 no hydrogen 2.753 N/A ASP 296.A N ARG 222.A O no hydrogen 3.007 N/A ASP 308.A N LEU 305.A O no hydrogen 3.161 N/A PHE 309.A N ALA 306.A O no hydrogen 2.795 N/A VAL 310.A N ALA 306.A O no hydrogen 2.596 N/A GLU 311.A N ALA 306.A O no hydrogen 3.189 N/A SER 312.A OG ASP 314.A OD2 no hydrogen 2.961 N/A ASN 318.A N VAL 315.A O no hydrogen 2.839 N/A TYR 319.A N CYS 316.A O no hydrogen 2.683 N/A ALA 320.A N CYS 316.A O no hydrogen 2.926 N/A ALA 322.A N TYR 319.A O no hydrogen 2.698 N/A LEU 327.A N LYS 323.A O no hydrogen 2.958 N/A MET 329.A N VAL 325.A O no hydrogen 2.867 N/A MET 329.A N PHE 326.A O no hydrogen 3.004 N/A PHE 330.A N PHE 326.A O no hydrogen 3.306 N/A LEU 331.A N LEU 327.A O no hydrogen 3.030 N/A TYR 332.A N GLY 328.A O no hydrogen 2.901 N/A TYR 332.A OH ALA 226.A O no hydrogen 2.597 N/A GLU 333.A N MET 329.A O no hydrogen 2.759 N/A TYR 334.A N PHE 330.A O no hydrogen 2.894 N/A ALA 335.A N LEU 331.A O no hydrogen 2.702 N/A ARG 336.A N TYR 332.A O no hydrogen 3.100 N/A ARG 336.A NE PRO 224.A O no hydrogen 3.030 N/A ARG 336.A NH1 GLU 333.A OE1 no hydrogen 3.260 N/A ARG 336.A NH2 PRO 224.A O no hydrogen 2.721 N/A ARG 337.A N TYR 334.A O no hydrogen 3.213 N/A HIS 338.A N ALA 335.A O no hydrogen 2.914 N/A TYR 341.A N HIS 338.A O no hydrogen 3.063 N/A LEU 345.A N SER 342.A O no hydrogen 2.994 N/A LEU 345.A N SER 342.A OG no hydrogen 3.302 N/A LEU 346.A N SER 342.A O no hydrogen 3.233 N/A ARG 348.A N VAL 344.A O no hydrogen 3.209 N/A ARG 348.A NH1 GLU 450.A OE2 no hydrogen 3.051 N/A LEU 349.A N LEU 345.A O no hydrogen 3.092 N/A ALA 350.A N LEU 346.A O no hydrogen 2.944 N/A LYS 351.A N LEU 347.A O no hydrogen 2.709 N/A LYS 351.A NZ GLU 354.A OE1 no hydrogen 3.097 N/A THR 352.A OG1 ARG 348.A O no hydrogen 2.442 N/A TYR 353.A N LEU 349.A O no hydrogen 2.748 N/A TYR 353.A OH PHE 309.A O no hydrogen 2.811 N/A GLU 354.A N ALA 350.A O no hydrogen 2.868 N/A THR 355.A N LYS 351.A O no hydrogen 3.123 N/A THR 356.A N TYR 353.A O no hydrogen 2.937 N/A THR 356.A OG1 THR 352.A O no hydrogen 3.473 N/A THR 356.A OG1 GLU 376.A OE2 no hydrogen 2.635 N/A LEU 357.A N TYR 353.A O no hydrogen 2.962 N/A GLU 358.A N GLU 354.A O no hydrogen 3.320 N/A LYS 359.A N THR 356.A O no hydrogen 2.862 N/A CYS 360.A N THR 356.A O no hydrogen 2.758 N/A CYS 360.A N LEU 357.A O no hydrogen 3.276 N/A CYS 361.A N LEU 357.A O no hydrogen 2.937 N/A CYS 369.A N PRO 366.A O no hydrogen 2.769 N/A ASP 375.A N LYS 372.A O no hydrogen 3.339 N/A GLU 376.A N VAL 373.A O no hydrogen 3.039 N/A VAL 381.A N PHE 377.A O no hydrogen 2.675 N/A GLU 382.A N PRO 379.A O no hydrogen 3.412 N/A GLU 383.A N PRO 379.A O no hydrogen 2.745 N/A ASN 386.A N GLU 382.A O no hydrogen 2.893 N/A LEU 387.A N GLU 383.A O no hydrogen 3.075 N/A LEU 387.A N PRO 384.A O no hydrogen 3.013 N/A ILE 388.A N PRO 384.A O no hydrogen 2.961 N/A LYS 389.A N GLN 385.A O no hydrogen 2.941 N/A GLN 390.A N ASN 386.A O no hydrogen 3.189 N/A ASN 391.A N LEU 387.A O no hydrogen 2.964 N/A ASN 391.A ND2 LEU 387.A O no hydrogen 3.339 N/A CYS 392.A N ILE 388.A O no hydrogen 2.865 N/A GLU 393.A N LYS 389.A O no hydrogen 2.874 N/A LEU 394.A N GLN 390.A O no hydrogen 2.807 N/A PHE 395.A N ASN 391.A O no hydrogen 2.766 N/A GLU 396.A N CYS 392.A O no hydrogen 2.924 N/A GLN 397.A N LEU 394.A O no hydrogen 2.946 N/A LEU 398.A N LEU 394.A O no hydrogen 3.022 N/A GLY 399.A N PHE 395.A O no hydrogen 3.033 N/A PHE 403.A N GLY 399.A O no hydrogen 3.070 N/A GLN 404.A N GLU 400.A O no hydrogen 3.040 N/A GLN 404.A NE2 ARG 428.A O no hydrogen 2.661 N/A ASN 405.A N TYR 401.A O no hydrogen 3.074 N/A ALA 406.A N LYS 402.A O no hydrogen 3.085 N/A LEU 407.A N PHE 403.A O no hydrogen 3.211 N/A LEU 408.A N GLN 404.A O no hydrogen 2.780 N/A VAL 409.A N ASN 405.A O no hydrogen 3.176 N/A VAL 409.A N ALA 406.A O no hydrogen 3.228 N/A ARG 410.A N ALA 406.A O no hydrogen 2.979 N/A TYR 411.A N LEU 407.A O no hydrogen 2.790 N/A THR 412.A N VAL 409.A O no hydrogen 2.923 N/A LYS 413.A N VAL 409.A O no hydrogen 2.621 N/A LYS 413.A N ARG 410.A O no hydrogen 3.132 N/A LYS 413.A NZ PRO 537.A O no hydrogen 2.565 N/A LYS 413.A NZ ALA 539.A O no hydrogen 2.826 N/A LYS 414.A N ARG 410.A O no hydrogen 3.020 N/A LYS 414.A NZ PHE 488.A O no hydrogen 3.242 N/A GLN 417.A NE2 ASP 494.A OD2 no hydrogen 3.398 N/A VAL 418.A N VAL 415.A O no hydrogen 3.164 N/A THR 420.A OG1 GLU 531.A OE2 no hydrogen 2.565 N/A LEU 423.A N SER 419.A O no hydrogen 3.220 N/A GLU 425.A N PRO 421.A O no hydrogen 3.155 N/A VAL 426.A N THR 422.A O no hydrogen 2.765 N/A SER 427.A N LEU 423.A O no hydrogen 3.009 N/A SER 427.A OG LEU 423.A O no hydrogen 3.021 N/A ARG 428.A N VAL 424.A O no hydrogen 2.753 N/A ARG 428.A NE GLN 526.A OE1 no hydrogen 3.337 N/A LEU 430.A N VAL 426.A O no hydrogen 2.856 N/A GLY 431.A N SER 427.A O no hydrogen 3.045 N/A LYS 432.A N ARG 428.A O no hydrogen 3.069 N/A LYS 432.A N ASN 429.A O no hydrogen 2.820 N/A VAL 433.A N LEU 430.A O no hydrogen 3.210 N/A LYS 436.A N VAL 433.A O no hydrogen 2.861 N/A CYS 437.A SG LYS 436.A O no hydrogen 3.046 N/A CYS 438.A N GLY 434.A O no hydrogen 3.180 N/A HIS 440.A N CYS 437.A O no hydrogen 3.191 N/A ARG 445.A NH1 HIS 440.A O no hydrogen 3.102 N/A CYS 448.A SG LYS 436.A O no hydrogen 3.052 N/A GLU 450.A N MET 446.A O no hydrogen 3.231 N/A ASP 451.A N PRO 447.A O no hydrogen 2.650 N/A TYR 452.A N CYS 448.A O no hydrogen 2.883 N/A LEU 453.A N ALA 449.A O no hydrogen 2.824 N/A SER 454.A N GLU 450.A O no hydrogen 3.238 N/A VAL 455.A N ASP 451.A O no hydrogen 3.042 N/A VAL 456.A N TYR 452.A O no hydrogen 3.114 N/A LEU 457.A N LEU 453.A O no hydrogen 2.970 N/A ASN 458.A N SER 454.A O no hydrogen 3.285 N/A ASN 458.A N VAL 455.A O no hydrogen 3.039 N/A GLN 459.A N VAL 455.A O no hydrogen 3.318 N/A LEU 460.A N VAL 456.A O no hydrogen 3.197 N/A CYS 461.A N LEU 457.A O no hydrogen 3.207 N/A CYS 461.A SG LEU 457.A O no hydrogen 3.034 N/A VAL 462.A N ASN 458.A O no hydrogen 2.666 N/A HIS 464.A N LEU 460.A O no hydrogen 2.977 N/A GLU 465.A N CYS 461.A O no hydrogen 2.867 N/A ARG 472.A NH1 VAL 493.A O no hydrogen 3.348 N/A ARG 472.A NH2 GLU 492.A O no hydrogen 3.480 N/A ARG 472.A NH2 VAL 493.A O no hydrogen 3.517 N/A VAL 473.A N SER 470.A O no hydrogen 2.759 N/A THR 474.A N SER 470.A O no hydrogen 3.347 N/A THR 474.A OG1 HIS 464.A NE2 no hydrogen 2.798 N/A LYS 475.A N ASP 471.A O no hydrogen 2.945 N/A CYS 476.A N ARG 472.A O no hydrogen 3.124 N/A CYS 476.A SG ARG 472.A O no hydrogen 4.012 N/A CYS 477.A N VAL 473.A O no hydrogen 2.760 N/A CYS 477.A SG VAL 473.A O no hydrogen 3.659 N/A THR 478.A N THR 474.A O no hydrogen 2.879 N/A THR 478.A OG1 THR 474.A O no hydrogen 2.648 N/A GLU 479.A N LYS 475.A O no hydrogen 3.028 N/A ARG 484.A N LEU 481.A O no hydrogen 3.001 N/A ARG 484.A NE CYS 477.A O no hydrogen 2.859 N/A ARG 485.A NE GLU 450.A OE2 no hydrogen 3.556 N/A ARG 485.A NH1 GLU 383.A OE1 no hydrogen 3.529 N/A ARG 485.A NH2 GLU 383.A OE2 no hydrogen 3.096 N/A CYS 487.A N ASN 483.A O no hydrogen 3.253 N/A PHE 488.A N ARG 484.A O no hydrogen 3.129 N/A SER 489.A N ARG 485.A O no hydrogen 3.263 N/A SER 489.A OG ARG 485.A O no hydrogen 3.445 N/A ALA 490.A N PRO 486.A O no hydrogen 3.279 N/A ALA 490.A N CYS 487.A O no hydrogen 3.077 N/A LEU 491.A N CYS 487.A O no hydrogen 3.094 N/A LEU 491.A N PHE 488.A O no hydrogen 2.871 N/A THR 496.A N ASP 494.A OD1 no hydrogen 3.041 N/A THR 496.A OG1 ASP 494.A OD1 no hydrogen 2.625 N/A TYR 497.A OH LYS 534.A O no hydrogen 3.419 N/A LYS 500.A N LYS 534.A O no hydrogen 3.010 N/A LYS 500.A NZ GLU 501.A O no hydrogen 3.516 N/A LYS 500.A NZ GLU 531.A OE1 no hydrogen 2.902 N/A ASN 503.A ND2 THR 506.A OG1 no hydrogen 2.779 N/A THR 506.A N ASN 503.A O no hydrogen 3.347 N/A THR 506.A OG1 ASN 503.A O no hydrogen 3.436 N/A THR 508.A OG1 ALA 504.A O no hydrogen 2.851 N/A ILE 513.A N HIS 510.A O no hydrogen 2.723 N/A CYS 514.A N ALA 511.A O no hydrogen 2.895 N/A CYS 514.A SG CYS 558.A O no hydrogen 3.501 N/A THR 515.A OG1 ASP 512.A O no hydrogen 3.277 N/A LYS 519.A N SER 517.A OG no hydrogen 3.392 N/A ARG 521.A N SER 517.A O no hydrogen 2.954 N/A ARG 521.A NH1 ILE 513.A O no hydrogen 3.146 N/A ARG 521.A NH1 CYS 514.A O no hydrogen 2.923 N/A GLN 522.A N GLU 518.A O no hydrogen 3.280 N/A ILE 523.A N LYS 519.A O no hydrogen 2.644 N/A LYS 524.A N ARG 521.A O no hydrogen 2.970 N/A LYS 525.A N ARG 521.A O no hydrogen 3.063 N/A GLN 526.A N GLN 522.A O no hydrogen 2.737 N/A GLN 526.A NE2 ASN 405.A OD1 no hydrogen 2.653 N/A THR 527.A N ILE 523.A O no hydrogen 2.943 N/A THR 527.A OG1 ILE 523.A O no hydrogen 2.474 N/A ALA 528.A N LYS 524.A O no hydrogen 2.883 N/A LEU 529.A N LYS 525.A O no hydrogen 2.951 N/A VAL 530.A N GLN 526.A O no hydrogen 3.009 N/A GLU 531.A N THR 527.A O no hydrogen 3.147 N/A LEU 532.A N ALA 528.A O no hydrogen 2.978 N/A VAL 533.A N LEU 529.A O no hydrogen 2.930 N/A LYS 534.A N VAL 530.A O no hydrogen 2.987 N/A LYS 534.A NZ VAL 418.A O no hydrogen 2.844 N/A LYS 534.A NZ THR 420.A OG1 no hydrogen 2.873 N/A HIS 535.A N LEU 532.A O no hydrogen 2.689 N/A LYS 536.A N VAL 533.A O no hydrogen 3.289 N/A LYS 536.A NZ VAL 533.A O no hydrogen 3.557 N/A LYS 536.A NZ LYS 536.A O no hydrogen 3.155 N/A LYS 538.A NZ ASP 494.A O no hydrogen 3.316 N/A ALA 539.A N PRO 537.A O no hydrogen 2.639 N/A LEU 544.A N THR 540.A O no hydrogen 3.271 N/A LYS 545.A N LYS 541.A O no hydrogen 2.424 N/A LYS 545.A NZ LYS 545.A O no hydrogen 3.434 N/A LYS 545.A NZ ASP 549.A OD2 no hydrogen 3.462 N/A ALA 546.A N GLN 543.A O no hydrogen 3.064 N/A VAL 547.A N GLN 543.A O no hydrogen 2.881 N/A MET 548.A N LEU 544.A O no hydrogen 2.779 N/A ASP 550.A N ALA 546.A O no hydrogen 2.880 N/A PHE 551.A N VAL 547.A O no hydrogen 3.093 N/A ALA 552.A N MET 548.A O no hydrogen 2.876 N/A ALA 553.A N ASP 549.A O no hydrogen 2.894 N/A PHE 554.A N PHE 551.A O no hydrogen 2.841 N/A VAL 555.A N PHE 551.A O no hydrogen 2.743 N/A GLU 556.A N ALA 552.A O no hydrogen 3.140 N/A LYS 557.A N PHE 554.A O no hydrogen 2.649 N/A CYS 558.A N PHE 554.A O no hydrogen 2.898 N/A CYS 559.A SG VAL 555.A O no hydrogen 3.031 N/A GLU 570.A N CYS 567.A O no hydrogen 2.927 N/A GLU 571.A N CYS 567.A O no hydrogen 2.490 N/A GLY 572.A N CYS 567.A O no hydrogen 3.121 N/A LYS 574.A N GLU 570.A O no hydrogen 3.234 N/A LYS 574.A NZ GLU 571.A OE1 no hydrogen 2.948 N/A LEU 575.A N GLU 571.A O no hydrogen 2.845 N/A VAL 576.A N GLY 572.A O no hydrogen 3.168 N/A ALA 577.A N LYS 573.A O no hydrogen 3.240 N/A ALA 578.A N LYS 574.A O no hydrogen 2.715 N/A ALA 578.A N LEU 575.A O no hydrogen 3.072 N/A SER 579.A N LEU 575.A O no hydrogen 2.753 N/A SER 579.A OG LEU 575.A O no hydrogen 2.868 N/A GLN 580.A N VAL 576.A O no hydrogen 3.252 N/A ALA 581.A N ALA 578.A O no hydrogen 2.815 N/A