Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ja0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ GLU 53.A O no hydrogen 2.694 N/A LYS 3.A NZ TYR 55.A O no hydrogen 3.123 N/A LYS 3.A NZ ASP 89.A OD2 no hydrogen 3.223 N/A GLU 4.A N GLU 54.A O no hydrogen 2.653 N/A LYS 10.A N SER 6.A O no hydrogen 3.207 N/A MET 11.A N PHE 7.A O no hydrogen 3.048 N/A LYS 12.A N VAL 8.A O no hydrogen 2.904 N/A LYS 12.A NZ GLU 9.A OE2 no hydrogen 3.032 N/A LYS 12.A NZ GLU 65.A OE1 no hydrogen 2.617 N/A LYS 13.A N GLU 9.A O no hydrogen 3.010 N/A THR 14.A N MET 11.A O no hydrogen 3.081 N/A THR 14.A OG1 LYS 10.A O no hydrogen 2.990 N/A ARG 16.A N MET 11.A O no hydrogen 3.002 N/A ASN 17.A N ARG 46.A O no hydrogen 3.189 N/A ASN 17.A ND2 LYS 68.A O no hydrogen 3.352 N/A ILE 19.A N LEU 70.A O no hydrogen 3.003 N/A VAL 20.A N MET 48.A O no hydrogen 2.842 N/A PHE 21.A N VAL 72.A O no hydrogen 2.817 N/A TYR 22.A N ALA 50.A O no hydrogen 3.284 N/A GLY 23.A N CYS 74.A O no hydrogen 2.837 N/A GLN 25.A NE2 GLN 25.A O no hydrogen 3.471 N/A GLY 27.A N SER 24.A OG no hydrogen 2.820 N/A GLU 31.A N GLY 27.A O no hydrogen 3.136 N/A PHE 32.A N THR 28.A O no hydrogen 2.992 N/A ALA 33.A N ALA 29.A O no hydrogen 2.970 N/A ASN 34.A N GLU 30.A O no hydrogen 3.094 N/A ASN 34.A ND2 SER 49.A OG no hydrogen 2.576 N/A ARG 35.A N GLU 31.A O no hydrogen 3.020 N/A ARG 35.A NH1 GLU 151.A OE1 no hydrogen 3.206 N/A ARG 35.A NH1 GLU 151.A OE2 no hydrogen 3.225 N/A ARG 35.A NH2 GLU 151.A OE2 no hydrogen 3.231 N/A LEU 36.A N PHE 32.A O no hydrogen 2.944 N/A SER 37.A N ALA 33.A O no hydrogen 2.773 N/A LYS 38.A N ASN 34.A O no hydrogen 3.068 N/A LYS 38.A NZ ASN 322.A OD1 no hydrogen 3.539 N/A ASP 39.A N ARG 35.A O no hydrogen 2.942 N/A ASP 39.A N LEU 36.A O no hydrogen 3.018 N/A ALA 40.A N LEU 36.A O no hydrogen 3.241 N/A ARG 42.A N ASP 39.A O no hydrogen 2.921 N/A ARG 42.A NH2 ASP 39.A OD1 no hydrogen 3.107 N/A TYR 43.A N ALA 40.A O no hydrogen 2.971 N/A GLY 44.A N HIS 41.A O no hydrogen 3.328 N/A MET 45.A N ALA 40.A O no hydrogen 2.934 N/A ARG 46.A N ASN 17.A OD1 no hydrogen 3.133 N/A GLU 53.A N ASP 51.A OD1 no hydrogen 2.705 N/A GLU 54.A N ASP 51.A O no hydrogen 2.971 N/A TYR 55.A N PRO 52.A O no hydrogen 2.800 N/A ALA 58.A N ASP 56.A OD1 no hydrogen 2.921 N/A ASP 59.A N ASP 56.A O no hydrogen 2.981 N/A LEU 60.A N LEU 57.A O no hydrogen 2.775 N/A SER 61.A N ALA 58.A O no hydrogen 3.106 N/A SER 61.A OG ALA 58.A O no hydrogen 3.459 N/A SER 62.A N ASP 59.A O no hydrogen 2.730 N/A SER 62.A OG GLU 65.A OE2 no hydrogen 3.394 N/A LEU 63.A N LEU 60.A O no hydrogen 3.001 N/A GLU 65.A N SER 62.A O no hydrogen 2.801 N/A ILE 66.A N LEU 63.A O no hydrogen 2.921 N/A SER 69.A OG LEU 63.A O no hydrogen 2.943 N/A SER 69.A OG ILE 66.A O no hydrogen 3.517 N/A LEU 70.A N ASN 17.A O no hydrogen 2.870 N/A VAL 71.A N LYS 105.A O no hydrogen 3.016 N/A VAL 72.A N ILE 19.A O no hydrogen 2.915 N/A PHE 73.A N ALA 107.A O no hydrogen 3.036 N/A CYS 74.A N PHE 21.A O no hydrogen 2.739 N/A MET 75.A N PHE 109.A O no hydrogen 3.275 N/A ALA 76.A N GLY 23.A O no hydrogen 3.092 N/A THR 77.A N LEU 111.A O no hydrogen 3.079 N/A TYR 78.A N ASP 82.A O no hydrogen 2.626 N/A GLY 81.A N GLY 79.A O no hydrogen 2.555 N/A THR 84.A OG1 ASN 86.A OD1 no hydrogen 2.637 N/A ASN 86.A ND2 TYR 22.A O no hydrogen 2.849 N/A ASN 86.A ND2 ASP 51.A OD1 no hydrogen 3.226 N/A ALA 87.A N THR 84.A O no hydrogen 2.619 N/A TYR 91.A N ALA 87.A O no hydrogen 2.840 N/A ASP 92.A N GLN 88.A O no hydrogen 2.810 N/A TRP 93.A N ASP 89.A O no hydrogen 2.655 N/A LEU 94.A N PHE 90.A O no hydrogen 2.742 N/A GLU 96.A N ASP 92.A O no hydrogen 3.463 N/A THR 97.A N TRP 93.A O no hydrogen 2.893 N/A THR 97.A OG1 TRP 93.A O no hydrogen 2.559 N/A LEU 101.A N LEU 133.A O no hydrogen 2.835 N/A THR 102.A OG1 ASP 100.A OD1 no hydrogen 2.829 N/A THR 102.A OG1 ASP 100.A OD2 no hydrogen 2.913 N/A VAL 104.A N LEU 101.A O no hydrogen 2.838 N/A LYS 105.A NZ GLN 136.A OE1 no hydrogen 3.068 N/A PHE 106.A N GLN 136.A O no hydrogen 2.805 N/A ALA 107.A N VAL 71.A O no hydrogen 3.227 N/A PHE 109.A N PHE 73.A O no hydrogen 2.930 N/A GLY 110.A N GLY 142.A O no hydrogen 2.748 N/A LEU 111.A N MET 75.A O no hydrogen 2.623 N/A GLY 112.A N GLY 144.A O no hydrogen 3.250 N/A ASN 113.A ND2 ASP 146.A OD2 no hydrogen 3.559 N/A LYS 114.A N ASP 145.A OD1 no hydrogen 2.708 N/A THR 115.A N ASN 113.A OD1 no hydrogen 2.998 N/A THR 115.A OG1 ASN 113.A OD1 no hydrogen 2.633 N/A TYR 116.A N ASN 113.A O no hydrogen 3.018 N/A TYR 116.A OH VAL 607.A O no hydrogen 3.374 N/A MET 122.A N THR 77.A OG1 no hydrogen 3.036 N/A LYS 124.A N ASN 120.A O no hydrogen 2.889 N/A TYR 125.A N ALA 121.A O no hydrogen 3.030 N/A TYR 125.A N MET 122.A O no hydrogen 3.039 N/A VAL 126.A N MET 122.A O no hydrogen 2.929 N/A ASP 127.A N GLY 123.A O no hydrogen 3.129 N/A GLN 128.A N LYS 124.A O no hydrogen 3.179 N/A ARG 129.A N TYR 125.A O no hydrogen 2.779 N/A ARG 129.A NE LEU 94.A O no hydrogen 2.815 N/A ARG 129.A NH2 LEU 94.A O no hydrogen 3.349 N/A LEU 130.A N VAL 126.A O no hydrogen 3.072 N/A GLN 132.A N GLN 128.A O no hydrogen 3.396 N/A LEU 133.A N ARG 129.A O no hydrogen 3.041 N/A GLY 134.A N GLU 131.A O no hydrogen 3.058 N/A ALA 135.A N LEU 130.A O no hydrogen 3.090 N/A GLN 136.A N VAL 104.A O no hydrogen 2.592 N/A ARG 137.A NH1 ASP 127.A OD2 no hydrogen 2.762 N/A ARG 137.A NH2 GLU 131.A OE1 no hydrogen 2.953 N/A ILE 138.A N PHE 106.A O no hydrogen 2.799 N/A GLY 142.A N VAL 108.A O no hydrogen 2.711 N/A GLY 144.A N GLY 110.A O no hydrogen 2.963 N/A ASP 145.A N ASP 153.A OD2 no hydrogen 2.825 N/A ASP 146.A N GLY 112.A O no hydrogen 3.030 N/A GLY 148.A N ASP 145.A O no hydrogen 3.275 N/A GLY 148.A N ASP 145.A OD2 no hydrogen 3.182 N/A GLU 152.A N ASN 149.A O no hydrogen 2.926 N/A ASP 153.A N ASN 149.A O no hydrogen 3.221 N/A PHE 154.A N LEU 150.A O no hydrogen 3.102 N/A ILE 155.A N GLU 151.A O no hydrogen 3.245 N/A THR 156.A N GLU 152.A O no hydrogen 3.039 N/A THR 156.A OG1 ASP 153.A O no hydrogen 3.150 N/A TRP 157.A N ASP 153.A O no hydrogen 3.141 N/A TRP 157.A NE1 GLU 140.A O no hydrogen 3.216 N/A ARG 158.A N PHE 154.A O no hydrogen 2.774 N/A GLU 159.A N ILE 155.A O no hydrogen 2.836 N/A GLN 160.A N TRP 157.A O no hydrogen 3.085 N/A PHE 161.A N TRP 157.A O no hydrogen 2.719 N/A VAL 165.A N PHE 161.A O no hydrogen 3.009 N/A CYS 166.A N TRP 162.A O no hydrogen 2.679 N/A CYS 166.A SG TRP 162.A O no hydrogen 3.312 N/A GLU 167.A N PRO 163.A O no hydrogen 2.758 N/A PHE 168.A N ALA 164.A O no hydrogen 2.819 N/A PHE 169.A N VAL 165.A O no hydrogen 2.927 N/A THR 174.A N ARG 42.A O no hydrogen 3.282 N/A THR 174.A OG1 GLU 172.A O no hydrogen 3.255 N/A THR 174.A OG1 GLU 172.A OE2 no hydrogen 2.806 N/A SER 179.A OG SER 178.A O no hydrogen 2.300 N/A ARG 181.A NE GLU 384.A OE1 no hydrogen 3.136 N/A ARG 181.A NH1 ASP 380.A OD2 no hydrogen 2.668 N/A ARG 181.A NH2 ASP 380.A OD2 no hydrogen 3.168 N/A ARG 181.A NH2 GLU 384.A OE1 no hydrogen 3.253 N/A GLN 182.A N GLU 384.A OE2 no hydrogen 3.277 N/A TYR 183.A N GLU 384.A OE1 no hydrogen 3.247 N/A GLU 184.A N ASN 287.A O no hydrogen 2.778 N/A VAL 186.A N SER 285.A O no hydrogen 3.094 N/A HIS 188.A N ILE 283.A O no hydrogen 3.291 N/A HIS 188.A NE2 SER 285.A OG no hydrogen 2.717 N/A LYS 195.A N ASP 192.A O no hydrogen 2.754 N/A TYR 197.A N PRO 302.A O no hydrogen 2.880 N/A TYR 197.A OH GLY 202.A O no hydrogen 3.324 N/A THR 198.A N GLU 200.A OE2 no hydrogen 2.658 N/A THR 198.A OG1 GLU 200.A OE2 no hydrogen 3.274 N/A GLY 199.A N GLU 200.A OE2 no hydrogen 3.101 N/A LYS 205.A N GLU 200.A OE1 no hydrogen 2.711 N/A LYS 205.A NZ GLU 208.A OE2 no hydrogen 3.533 N/A SER 206.A N ARG 203.A O no hydrogen 3.019 N/A SER 206.A OG ARG 203.A O no hydrogen 2.607 N/A ASN 209.A N LYS 205.A O no hydrogen 3.098 N/A GLN 210.A NE2 SER 206.A O no hydrogen 3.189 N/A GLN 210.A NE2 TYR 207.A O no hydrogen 3.560 N/A GLN 210.A NE2 PRO 219.A O no hydrogen 3.459 N/A ASP 215.A N ASN 218.A O no hydrogen 2.704 N/A LYS 217.A N ASP 215.A OD1 no hydrogen 3.121 N/A ASN 218.A N ASP 215.A O no hydrogen 2.690 N/A ASN 218.A N ASP 215.A OD1 no hydrogen 2.770 N/A ASN 218.A ND2 LYS 211.A O no hydrogen 3.374 N/A ASN 218.A ND2 PRO 213.A O no hydrogen 2.882 N/A PHE 220.A N MET 442.A O no hydrogen 3.042 N/A LEU 221.A N GLN 210.A OE1 no hydrogen 2.940 N/A ALA 222.A N VAL 440.A O no hydrogen 2.993 N/A VAL 224.A N ALA 438.A O no hydrogen 2.706 N/A THR 225.A N GLU 242.A O no hydrogen 2.805 N/A ASN 227.A ND2 LEU 432.A O no hydrogen 2.970 N/A ASN 227.A ND2 LYS 435.A O no hydrogen 3.089 N/A ARG 228.A N HIS 240.A O no hydrogen 2.628 N/A LYS 229.A NZ GLY 233.A O no hydrogen 3.540 N/A LEU 230.A N LEU 238.A O no hydrogen 2.744 N/A ASN 231.A ND2 GLY 233.A O no hydrogen 2.841 N/A GLN 232.A NE2 TYR 504.A O no hydrogen 2.524 N/A GLY 233.A N GLU 502.A O no hydrogen 2.767 N/A GLU 235.A N GLU 502.A OE2 no hydrogen 3.010 N/A ARG 236.A NH2 ASP 503.A OD2 no hydrogen 3.430 N/A LEU 238.A N ASN 231.A OD1 no hydrogen 2.704 N/A MET 239.A N ALA 411.A O no hydrogen 2.630 N/A HIS 240.A N ARG 228.A O no hydrogen 2.546 N/A LEU 241.A N ILE 409.A O no hydrogen 2.785 N/A GLU 242.A N ALA 226.A O no hydrogen 3.025 N/A LEU 243.A N VAL 407.A O no hydrogen 3.002 N/A ASP 244.A N ALA 223.A O no hydrogen 2.774 N/A ILE 245.A N ASN 405.A O no hydrogen 2.904 N/A SER 246.A OG ASP 244.A OD1 no hydrogen 2.758 N/A SER 248.A OG ILE 245.A O no hydrogen 2.459 N/A TYR 252.A OH SER 398.A OG no hydrogen 2.601 N/A TYR 252.A OH HIS 403.A O no hydrogen 3.026 N/A TYR 252.A OH SER 406.A O no hydrogen 2.793 N/A GLU 253.A N ASP 256.A OD2 no hydrogen 2.922 N/A SER 254.A OG GLU 477.A OE1 no hydrogen 3.364 N/A ASP 256.A N GLU 253.A O no hydrogen 3.219 N/A HIS 257.A N ARG 445.A O no hydrogen 3.123 N/A VAL 258.A N TYR 394.A O no hydrogen 2.802 N/A ALA 259.A N PHE 443.A O no hydrogen 2.737 N/A VAL 260.A N ARG 392.A O no hydrogen 2.727 N/A TYR 261.A N PRO 441.A O no hydrogen 3.116 N/A TYR 261.A OH ALA 216.A O no hydrogen 2.500 N/A ASN 264.A N THR 310.A O no hydrogen 2.860 N/A ASN 264.A ND2 LEU 309.A O no hydrogen 2.819 N/A ASN 264.A ND2 LEU 313.A O no hydrogen 2.838 N/A ALA 267.A N ASP 265.A OD1 no hydrogen 2.545 N/A LEU 268.A N ASP 265.A OD1 no hydrogen 3.192 N/A VAL 269.A N ASP 265.A O no hydrogen 2.946 N/A ASN 270.A N SER 266.A O no hydrogen 2.743 N/A GLN 271.A N ALA 267.A O no hydrogen 3.011 N/A GLN 271.A NE2 ALA 267.A O no hydrogen 2.892 N/A ILE 272.A N VAL 269.A O no hydrogen 3.060 N/A GLY 273.A N VAL 269.A O no hydrogen 3.061 N/A GLU 274.A N ASN 270.A O no hydrogen 2.696 N/A ILE 275.A N GLN 271.A O no hydrogen 2.850 N/A LEU 276.A N ILE 272.A O no hydrogen 3.124 N/A GLY 277.A N GLU 274.A O no hydrogen 3.140 N/A ALA 278.A N GLY 273.A O no hydrogen 2.875 N/A ASP 281.A N ASP 279.A OD1 no hydrogen 2.779 N/A MET 284.A N THR 303.A O no hydrogen 2.835 N/A SER 285.A OG HIS 188.A NE2 no hydrogen 2.717 N/A ASN 287.A N GLU 184.A O no hydrogen 3.124 N/A ASN 288.A N LYS 296.A O no hydrogen 2.681 N/A ASN 288.A ND2 GLN 182.A O no hydrogen 2.717 N/A LEU 289.A N GLN 182.A O no hydrogen 2.725 N/A GLU 292.A N ASP 290.A OD1 no hydrogen 2.773 N/A SER 293.A N ASP 290.A O no hydrogen 3.324 N/A LYS 295.A N SER 293.A OG no hydrogen 2.974 N/A CYS 301.A SG PHE 299.A O no hydrogen 3.343 N/A CYS 301.A SG PRO 300.A O no hydrogen 3.254 N/A THR 303.A N MET 284.A O no hydrogen 2.775 N/A THR 303.A OG1 TYR 197.A O no hydrogen 2.832 N/A THR 304.A OG1 THR 307.A OG1 no hydrogen 3.028 N/A ARG 306.A N LEU 280.A O no hydrogen 2.970 N/A ARG 306.A NE ASP 281.A OD1 no hydrogen 2.786 N/A ARG 306.A NH2 ASP 281.A OD2 no hydrogen 2.902 N/A THR 307.A N THR 304.A OG1 no hydrogen 3.401 N/A THR 307.A OG1 THR 304.A OG1 no hydrogen 3.028 N/A ALA 308.A N THR 304.A O no hydrogen 2.992 N/A LEU 309.A N TYR 305.A O no hydrogen 2.831 N/A THR 310.A N ARG 306.A O no hydrogen 2.893 N/A THR 310.A OG1 ARG 306.A O no hydrogen 2.863 N/A TYR 311.A N THR 307.A O no hydrogen 2.752 N/A TYR 312.A N ALA 308.A O no hydrogen 2.893 N/A TYR 312.A OH GLU 200.A O no hydrogen 2.503 N/A ASP 314.A N PRO 387.A O no hydrogen 2.682 N/A THR 316.A N ASP 314.A OD1 no hydrogen 3.281 N/A THR 316.A OG1 ASN 317.A OD1 no hydrogen 3.311 N/A ASN 317.A N ASP 314.A OD1 no hydrogen 2.924 N/A ARG 320.A NH1 GLU 151.A OE1 no hydrogen 2.904 N/A THR 321.A N GLU 151.A OE2 no hydrogen 3.362 N/A THR 321.A OG1 GLU 151.A OE2 no hydrogen 3.387 N/A LEU 324.A N ARG 320.A O no hydrogen 3.180 N/A TYR 325.A N THR 321.A O no hydrogen 2.996 N/A GLU 326.A N ASN 322.A O no hydrogen 3.023 N/A LEU 327.A N VAL 323.A O no hydrogen 3.085 N/A LEU 327.A N LEU 324.A O no hydrogen 3.107 N/A ALA 328.A N LEU 324.A O no hydrogen 3.016 N/A ALA 328.A N TYR 325.A O no hydrogen 3.213 N/A TYR 330.A N LEU 327.A O no hydrogen 2.677 N/A TYR 330.A OH HIS 381.A ND1 no hydrogen 2.709 N/A ALA 331.A N ALA 328.A O no hydrogen 3.024 N/A SER 332.A N SER 374.A O no hydrogen 3.105 N/A SER 335.A OG GLU 333.A OE2 no hydrogen 3.502 N/A GLN 337.A N GLU 333.A O no hydrogen 2.992 N/A GLN 337.A NE2 ALA 328.A O no hydrogen 2.594 N/A GLU 338.A N PRO 334.A O no hydrogen 2.936 N/A GLU 338.A N SER 335.A O no hydrogen 3.250 N/A HIS 339.A N SER 335.A O no hydrogen 3.282 N/A LEU 340.A N GLU 336.A O no hydrogen 3.154 N/A HIS 341.A N GLN 337.A O no hydrogen 3.243 N/A LYS 342.A N GLU 338.A O no hydrogen 2.751 N/A MET 343.A N LEU 340.A O no hydrogen 3.105 N/A ALA 344.A N HIS 341.A O no hydrogen 3.174 N/A SER 345.A OG LYS 342.A O no hydrogen 2.371 N/A SER 347.A OG SER 346.A O no hydrogen 2.604 N/A LYS 351.A NZ SER 347.A OG no hydrogen 3.327 N/A GLU 352.A N GLY 348.A O no hydrogen 3.011 N/A GLU 352.A N GLU 349.A O no hydrogen 3.338 N/A LEU 353.A N GLU 349.A O no hydrogen 2.876 N/A TYR 354.A N GLY 350.A O no hydrogen 2.970 N/A TYR 354.A OH PRO 319.A O no hydrogen 3.171 N/A SER 356.A N GLU 352.A O no hydrogen 3.212 N/A SER 356.A OG GLU 352.A O no hydrogen 3.392 N/A TRP 357.A N LEU 353.A O no hydrogen 2.817 N/A VAL 358.A N TYR 354.A O no hydrogen 3.297 N/A VAL 359.A N TYR 354.A O no hydrogen 3.193 N/A GLU 360.A N LEU 355.A O no hydrogen 2.916 N/A ALA 361.A N SER 356.A O no hydrogen 3.105 N/A ARG 362.A N VAL 359.A O no hydrogen 2.892 N/A ARG 363.A N VAL 358.A O no hydrogen 2.781 N/A ARG 363.A NE ASP 371.A OD2 no hydrogen 2.506 N/A ARG 363.A NH1 TRP 357.A O no hydrogen 2.528 N/A ARG 363.A NH2 ASP 371.A OD2 no hydrogen 2.970 N/A ALA 367.A N HIS 364.A ND1 no hydrogen 3.076 N/A ILE 368.A N HIS 364.A O no hydrogen 3.230 N/A LEU 369.A N ILE 365.A O no hydrogen 3.024 N/A GLN 370.A N ALA 367.A O no hydrogen 2.912 N/A ASP 371.A N ALA 367.A O no hydrogen 2.828 N/A TYR 372.A N ILE 368.A O no hydrogen 2.842 N/A SER 374.A N GLU 336.A OE1 no hydrogen 2.830 N/A SER 374.A OG GLU 336.A OE1 no hydrogen 2.389 N/A LEU 375.A N TYR 372.A O no hydrogen 2.922 N/A ARG 376.A NH1 LEU 369.A O no hydrogen 3.182 N/A ARG 376.A NH1 LEU 375.A O no hydrogen 2.501 N/A HIS 381.A N PRO 378.A O no hydrogen 3.305 N/A HIS 381.A ND1 TYR 330.A OH no hydrogen 2.709 N/A LEU 382.A N PRO 378.A O no hydrogen 3.205 N/A CYS 383.A N ILE 379.A O no hydrogen 3.079 N/A CYS 383.A SG ILE 379.A O no hydrogen 3.351 N/A GLU 384.A N HIS 381.A O no hydrogen 2.817 N/A LEU 385.A N HIS 381.A O no hydrogen 3.053 N/A LEU 385.A N LEU 382.A O no hydrogen 2.798 N/A LEU 386.A N LEU 382.A O no hydrogen 2.909 N/A ARG 388.A NE PRO 298.A O no hydrogen 3.025 N/A ARG 388.A NH1 TYR 312.A O no hydrogen 3.024 N/A LEU 389.A N TYR 312.A O no hydrogen 3.244 N/A ARG 392.A N VAL 260.A O no hydrogen 2.784 N/A ARG 392.A NH1 GLN 390.A O no hydrogen 2.645 N/A TYR 394.A N VAL 258.A O no hydrogen 2.824 N/A ILE 396.A N ASP 256.A O no hydrogen 3.234 N/A ALA 397.A N HIS 408.A O no hydrogen 2.826 N/A SER 398.A OG TYR 252.A OH no hydrogen 2.601 N/A SER 398.A OG SER 406.A O no hydrogen 3.240 N/A SER 399.A N GLN 476.A OE1 no hydrogen 2.841 N/A SER 399.A OG GLU 477.A OE1 no hydrogen 2.785 N/A SER 400.A OG GLU 253.A OE1 no hydrogen 2.741 N/A LYS 401.A NZ GLU 477.A OE2 no hydrogen 3.535 N/A HIS 403.A N SER 399.A O no hydrogen 2.669 N/A SER 406.A N HIS 403.A O no hydrogen 3.007 N/A SER 406.A OG LEU 243.A O no hydrogen 2.903 N/A VAL 407.A N LEU 243.A O no hydrogen 3.062 N/A ILE 409.A N LEU 241.A O no hydrogen 2.671 N/A ALA 411.A N MET 239.A O no hydrogen 2.902 N/A ALA 413.A N HIS 237.A O no hydrogen 2.766 N/A VAL 414.A N THR 429.A OG1 no hydrogen 3.062 N/A TYR 416.A N ASN 424.A O no hydrogen 3.174 N/A ALA 418.A N ARG 422.A O no hydrogen 3.107 N/A ARG 422.A N SER 420.A OG no hydrogen 3.207 N/A ARG 422.A NH1 GLN 370.A OE1 no hydrogen 2.579 N/A ARG 422.A NH2 ASP 371.A OD1 no hydrogen 3.333 N/A ARG 422.A NH2 ASP 371.A OD2 no hydrogen 3.193 N/A ARG 422.A NH2 SER 420.A O no hydrogen 3.296 N/A ASN 424.A N TYR 416.A O no hydrogen 2.816 N/A ASN 424.A ND2 ARG 362.A O no hydrogen 3.268 N/A ASN 424.A ND2 TYR 416.A OH no hydrogen 2.962 N/A GLY 426.A N VAL 414.A O no hydrogen 2.788 N/A THR 429.A OG1 GLY 426.A O no hydrogen 3.496 N/A SER 430.A N GLY 426.A O no hydrogen 2.903 N/A SER 430.A OG GLY 426.A O no hydrogen 2.785 N/A TRP 431.A N VAL 427.A O no hydrogen 3.290 N/A LEU 432.A N ALA 428.A O no hydrogen 2.813 N/A ARG 433.A N THR 429.A O no hydrogen 2.721 N/A ALA 434.A N SER 430.A O no hydrogen 3.255 N/A ALA 434.A N TRP 431.A O no hydrogen 3.210 N/A LYS 435.A N LEU 432.A O no hydrogen 2.897 N/A LYS 435.A NZ LEU 439.A O no hydrogen 3.158 N/A VAL 440.A N ALA 222.A O no hydrogen 2.606 N/A MET 442.A N PHE 220.A O no hydrogen 3.009 N/A ARG 445.A N HIS 257.A O no hydrogen 2.888 N/A ARG 445.A NH1 ASP 85.A OD2 no hydrogen 3.271 N/A SER 447.A N ASP 256.A OD1 no hydrogen 2.536 N/A SER 447.A OG GLY 255.A O no hydrogen 2.461 N/A SER 447.A OG PHE 449.A O no hydrogen 3.484 N/A ARG 450.A NE SER 447.A O no hydrogen 3.384 N/A ARG 450.A NH2 SER 447.A O no hydrogen 3.290 N/A SER 455.A OG GLU 487.A O no hydrogen 2.924 N/A THR 457.A N LYS 454.A O no hydrogen 3.101 N/A VAL 459.A N GLU 490.A O no hydrogen 3.090 N/A ILE 460.A N HIS 557.A O no hydrogen 2.804 N/A MET 461.A N LEU 492.A O no hydrogen 2.791 N/A VAL 462.A N TYR 559.A O no hydrogen 2.795 N/A GLY 463.A N TYR 494.A O no hydrogen 3.043 N/A GLY 465.A N GLY 496.A O no hydrogen 2.771 N/A GLY 467.A N PRO 464.A O no hydrogen 2.979 N/A ILE 468.A N GLY 465.A O no hydrogen 3.143 N/A ALA 469.A N THR 466.A O no hydrogen 2.982 N/A MET 472.A N ILE 468.A O no hydrogen 3.015 N/A MET 472.A N ALA 469.A O no hydrogen 3.077 N/A PHE 474.A N PRO 470.A O no hydrogen 3.003 N/A ILE 475.A N PHE 471.A O no hydrogen 2.915 N/A GLN 476.A N MET 472.A O no hydrogen 2.994 N/A GLN 476.A NE2 ALA 397.A O no hydrogen 3.569 N/A GLU 477.A N GLY 473.A O no hydrogen 2.898 N/A ARG 478.A N PHE 474.A O no hydrogen 2.900 N/A ARG 478.A NH1 THR 457.A O no hydrogen 3.300 N/A ARG 478.A NH1 THR 491.A OG1 no hydrogen 3.037 N/A ARG 478.A NH2 THR 457.A O no hydrogen 2.538 N/A ALA 479.A N ILE 475.A O no hydrogen 2.721 N/A TRP 480.A N GLN 476.A O no hydrogen 3.268 N/A LEU 481.A N GLU 477.A O no hydrogen 2.833 N/A ARG 482.A N ARG 478.A O no hydrogen 3.165 N/A ARG 482.A N ALA 479.A O no hydrogen 3.391 N/A ARG 482.A NH1 ASP 516.A O no hydrogen 3.530 N/A ARG 482.A NH2 ASP 516.A O no hydrogen 3.224 N/A GLU 483.A N ALA 479.A O no hydrogen 2.981 N/A GLN 484.A N TRP 480.A O no hydrogen 2.697 N/A GLY 485.A N ARG 482.A O no hydrogen 3.027 N/A GLY 489.A N SER 455.A O no hydrogen 3.173 N/A THR 491.A N THR 520.A OG1 no hydrogen 2.999 N/A THR 491.A OG1 GLY 489.A O no hydrogen 3.444 N/A LEU 492.A N VAL 459.A O no hydrogen 3.086 N/A LEU 493.A N GLN 521.A O no hydrogen 3.317 N/A TYR 494.A N MET 461.A O no hydrogen 2.626 N/A TYR 494.A OH ASP 543.A OD2 no hydrogen 2.472 N/A TYR 495.A N ASN 523.A O no hydrogen 3.049 N/A CYS 497.A N ALA 525.A O no hydrogen 3.242 N/A CYS 497.A SG ARG 499.A O no hydrogen 3.644 N/A ARG 498.A N ASP 503.A OD1 no hydrogen 2.943 N/A ARG 498.A NH1 GLU 235.A OE1 no hydrogen 2.860 N/A ARG 499.A NH1 ARG 528.A O no hydrogen 3.536 N/A SER 500.A N GLU 529.A OE2 no hydrogen 2.521 N/A SER 500.A OG GLU 529.A OE2 no hydrogen 2.905 N/A GLU 502.A N ARG 499.A O no hydrogen 3.099 N/A LEU 505.A N TYR 495.A OH no hydrogen 2.747 N/A LEU 510.A N TYR 506.A O no hydrogen 2.871 N/A ALA 511.A N ARG 507.A O no hydrogen 3.230 N/A ALA 511.A N GLU 508.A O no hydrogen 2.912 N/A ARG 512.A N GLU 508.A O no hydrogen 3.183 N/A ARG 512.A NE ARG 512.A O no hydrogen 3.473 N/A PHE 513.A N GLU 509.A O no hydrogen 3.095 N/A HIS 514.A N ALA 511.A O no hydrogen 3.015 N/A HIS 514.A ND1 LEU 519.A O no hydrogen 2.870 N/A LYS 515.A N ALA 511.A O no hydrogen 2.809 N/A GLY 517.A N HIS 514.A O no hydrogen 3.078 N/A LEU 519.A N PHE 513.A O no hydrogen 2.652 N/A THR 520.A N THR 491.A O no hydrogen 2.787 N/A THR 520.A OG1 THR 491.A O no hydrogen 3.395 N/A ASN 523.A N LEU 493.A O no hydrogen 3.114 N/A ALA 525.A N TYR 495.A O no hydrogen 2.757 N/A SER 527.A N CYS 497.A O no hydrogen 2.840 N/A SER 527.A OG CYS 497.A O no hydrogen 3.065 N/A ARG 528.A N ARG 498.A O no hydrogen 2.604 N/A GLN 530.A NE2 PHE 526.A O no hydrogen 2.817 N/A GLN 530.A NE2 GLN 530.A O no hydrogen 3.582 N/A GLN 530.A NE2 HIS 532.A O no hydrogen 3.018 N/A GLN 537.A N GLN 537.A OE1 no hydrogen 2.543 N/A HIS 538.A N TYR 535.A O no hydrogen 3.065 N/A LEU 540.A N VAL 536.A O no hydrogen 2.864 N/A LYS 541.A N GLN 537.A O no hydrogen 2.607 N/A ARG 542.A N HIS 538.A O no hydrogen 2.839 N/A ARG 542.A NE ASP 543.A OD1 no hydrogen 2.846 N/A ARG 542.A NH2 ASP 543.A OD2 no hydrogen 3.465 N/A ASP 543.A N LEU 539.A O no hydrogen 2.953 N/A ARG 544.A N LYS 541.A O no hydrogen 3.170 N/A ARG 544.A NH1 LYS 541.A O no hydrogen 2.928 N/A HIS 546.A NE2 GLU 490.A OE1 no hydrogen 3.111 N/A LEU 547.A N ASP 543.A O no hydrogen 3.001 N/A TRP 548.A N ARG 544.A O no hydrogen 3.216 N/A LYS 549.A N HIS 546.A O no hydrogen 2.956 N/A LEU 550.A N HIS 546.A O no hydrogen 3.280 N/A ILE 551.A N LEU 547.A O no hydrogen 2.987 N/A HIS 552.A N TRP 548.A O no hydrogen 2.835 N/A ALA 556.A N LEU 550.A O no hydrogen 2.621 N/A HIS 557.A N PRO 458.A O no hydrogen 2.659 N/A HIS 557.A ND1 TYR 559.A OH no hydrogen 3.071 N/A ILE 558.A N ARG 602.A O no hydrogen 2.561 N/A TYR 559.A N ILE 460.A O no hydrogen 2.804 N/A TYR 559.A OH ARG 450.A O no hydrogen 2.448 N/A TYR 559.A OH HIS 557.A ND1 no hydrogen 3.071 N/A VAL 560.A N SER 604.A O no hydrogen 2.871 N/A CYS 561.A N VAL 462.A O no hydrogen 3.023 N/A CYS 561.A SG GLY 467.A O no hydrogen 3.352 N/A CYS 561.A SG ASP 606.A O no hydrogen 3.312 N/A ASN 566.A N ASP 563.A OD2 no hydrogen 2.830 N/A MET 567.A N ASP 563.A OD2 no hydrogen 3.271 N/A ALA 568.A N ASP 563.A O no hydrogen 3.063 N/A ASP 570.A N ASN 566.A O no hydrogen 2.687 N/A VAL 571.A N MET 567.A O no hydrogen 2.631 N/A GLN 572.A N ALA 568.A O no hydrogen 3.080 N/A GLN 572.A N LYS 569.A O no hydrogen 3.108 N/A GLN 572.A NE2 GLU 117.A OE2 no hydrogen 3.174 N/A ASN 573.A N LYS 569.A O no hydrogen 3.093 N/A THR 574.A N ASP 570.A O no hydrogen 3.218 N/A PHE 575.A N VAL 571.A O no hydrogen 3.387 N/A TYR 576.A N GLN 572.A O no hydrogen 2.929 N/A ASP 577.A N ASN 573.A O no hydrogen 2.747 N/A ILE 578.A N THR 574.A O no hydrogen 2.772 N/A VAL 579.A N PHE 575.A O no hydrogen 2.992 N/A ALA 580.A N TYR 576.A O no hydrogen 2.731 N/A GLU 581.A N ILE 578.A O no hydrogen 2.710 N/A PHE 582.A N ILE 578.A O no hydrogen 3.116 N/A ALA 590.A N HIS 587.A O no hydrogen 2.275 N/A VAL 591.A N HIS 587.A O no hydrogen 3.244 N/A ASP 592.A N THR 588.A O no hydrogen 3.324 N/A TYR 593.A N GLN 589.A O no hydrogen 3.085 N/A VAL 594.A N ALA 590.A O no hydrogen 2.819 N/A LYS 595.A N VAL 591.A O no hydrogen 2.714 N/A LYS 596.A N TYR 593.A O no hydrogen 3.125 N/A LEU 597.A N VAL 594.A O no hydrogen 2.550 N/A MET 598.A N VAL 594.A O no hydrogen 3.315 N/A THR 599.A OG1 LYS 595.A O no hydrogen 3.022 N/A ARG 602.A N LEU 597.A O no hydrogen 2.689 N/A ARG 602.A NE ALA 556.A O no hydrogen 3.187 N/A ARG 602.A NH1 ILE 551.A O no hydrogen 3.453 N/A ARG 602.A NH2 ILE 551.A O no hydrogen 2.869 N/A ARG 602.A NH2 ALA 556.A O no hydrogen 2.623 N/A SER 604.A N ILE 558.A O no hydrogen 2.645 N/A