Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7laf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N LEU 54.A O no hydrogen 3.017 N/A ARG 7.A N THR 82.A O no hydrogen 2.703 N/A VAL 8.A N PHE 50.A O no hydrogen 2.845 N/A ARG 9.A N GLN 80.A O no hydrogen 2.910 N/A ARG 9.A NE ASP 49.A OD1 no hydrogen 2.823 N/A ARG 9.A NE ASP 49.A OD2 no hydrogen 3.423 N/A ARG 9.A NH2 ASP 49.A OD2 no hydrogen 3.548 N/A VAL 10.A N GLU 48.A O no hydrogen 3.121 N/A SER 11.A N TRP 78.A O no hydrogen 3.097 N/A THR 12.A N ALA 46.A O no hydrogen 3.340 N/A GLY 13.A N PHE 75.A O no hydrogen 2.784 N/A ALA 18.A N ALA 15.A O no hydrogen 2.927 N/A THR 20.A N PHE 42.A O no hydrogen 3.096 N/A SER 25.A N HIS 67.A O no hydrogen 2.814 N/A VAL 26.A N LEU 38.A O no hydrogen 2.822 N/A SER 27.A N ARG 65.A O no hydrogen 2.666 N/A SER 27.A OG GLU 34.A OE1 no hydrogen 3.165 N/A SER 27.A OG SER 35.A O no hydrogen 2.802 N/A ILE 28.A N SER 35.A OG no hydrogen 3.401 N/A VAL 29.A N LEU 63.A O no hydrogen 3.027 N/A GLY 30.A N GLY 33.A O no hydrogen 3.146 N/A THR 31.A N ARG 60.A O no hydrogen 3.182 N/A ARG 32.A N VAL 58.A O no hydrogen 3.092 N/A SER 35.A N ILE 28.A O no hydrogen 2.810 N/A SER 35.A OG ILE 28.A O no hydrogen 3.419 N/A SER 35.A OG PRO 36.A O no hydrogen 3.221 N/A LEU 38.A N VAL 26.A O no hydrogen 2.492 N/A LEU 40.A N VAL 24.A O no hydrogen 3.016 N/A GLY 45.A N THR 12.A O no hydrogen 2.940 N/A ALA 46.A N THR 43.A O no hydrogen 3.345 N/A GLU 48.A N VAL 10.A O no hydrogen 3.148 N/A LEU 54.A N ALA 4.A O no hydrogen 2.345 N/A GLY 59.A N ASP 57.A OD1 no hydrogen 3.378 N/A ARG 60.A N THR 31.A OG1 no hydrogen 3.257 N/A LEU 62.A N VAL 29.A O no hydrogen 2.914 N/A LEU 63.A N VAL 29.A O no hydrogen 2.903 N/A LEU 64.A N LEU 105.A O no hydrogen 2.968 N/A ARG 65.A N SER 27.A O no hydrogen 2.573 N/A VAL 66.A N LEU 103.A O no hydrogen 2.891 N/A HIS 67.A N SER 25.A O no hydrogen 2.579 N/A LYS 68.A N GLY 101.A O no hydrogen 3.225 N/A LYS 68.A NZ ASP 72.A O no hydrogen 2.938 N/A LYS 68.A NZ LEU 97.A O no hydrogen 3.016 N/A TRP 74.A N LEU 97.A O no hydrogen 2.625 N/A TRP 74.A NE1 THR 12.A OG1 no hydrogen 2.871 N/A PHE 75.A N ALA 18.A O no hydrogen 3.164 N/A ARG 77.A N SER 11.A O no hydrogen 2.986 N/A ARG 77.A NE SER 11.A OG no hydrogen 3.208 N/A PHE 79.A N PHE 91.A O no hydrogen 3.058 N/A GLN 80.A N ARG 9.A O no hydrogen 2.751 N/A LEU 81.A N LEU 89.A O no hydrogen 2.793 N/A THR 82.A N ARG 7.A O no hydrogen 2.634 N/A PHE 91.A N PHE 79.A O no hydrogen 2.854 N/A CYS 93.A N ARG 77.A O no hydrogen 2.653 N/A CYS 93.A SG CYS 76.A O no hydrogen 3.464 N/A TYR 94.A N ARG 77.A O no hydrogen 3.018 N/A GLN 95.A N CYS 76.A O no hydrogen 3.204 N/A GLN 95.A NE2 CYS 93.A O no hydrogen 3.181 N/A TRP 96.A N ASN 160.A OD1 no hydrogen 2.532 N/A LEU 97.A N TRP 74.A O no hydrogen 2.557 N/A LEU 103.A N VAL 66.A O no hydrogen 3.049 N/A LEU 105.A N LEU 64.A O no hydrogen 2.945 N/A GLN 106.A NE2 LEU 121.A O no hydrogen 3.664 N/A GLN 106.A NE2 GLN 124.A OE1 no hydrogen 2.751 N/A GLY 108.A N LEU 90.A O no hydrogen 2.803 N/A ALA 110.A N GLU 617.A OE1 no hydrogen 2.937 N/A LYS 111.A N CYS 382.A O no hydrogen 2.996 N/A LYS 111.A NZ GLN 106.A OE1 no hydrogen 2.811 N/A LYS 111.A NZ GLU 107.A O no hydrogen 3.453 N/A LYS 111.A NZ THR 109.A O no hydrogen 3.320 N/A TRP 114.A NE1 SER 488.A O no hydrogen 3.002 N/A ALA 115.A N VAL 112.A O no hydrogen 2.798 N/A VAL 120.A N HIS 118.A ND1 no hydrogen 3.100 N/A GLN 122.A N HIS 118.A O no hydrogen 3.093 N/A GLN 122.A NE2 SER 113.A O no hydrogen 2.634 N/A GLN 122.A NE2 ASP 116.A O no hydrogen 3.038 N/A GLN 123.A N PRO 119.A O no hydrogen 3.029 N/A GLN 123.A NE2 GLU 127.A OE2 no hydrogen 2.748 N/A GLN 124.A N VAL 120.A O no hydrogen 2.943 N/A GLN 124.A NE2 GLU 128.A OE1 no hydrogen 2.935 N/A ARG 125.A N LEU 121.A O no hydrogen 3.270 N/A ARG 125.A NE GLU 494.A OE2 no hydrogen 2.741 N/A ARG 125.A NH1 LYS 111.A O no hydrogen 3.413 N/A ARG 125.A NH2 LYS 111.A O no hydrogen 3.103 N/A ARG 125.A NH2 GLU 494.A OE1 no hydrogen 2.802 N/A GLN 126.A N GLN 122.A O no hydrogen 3.354 N/A GLU 127.A N GLN 123.A O no hydrogen 3.140 N/A GLU 128.A N GLN 124.A O no hydrogen 2.900 N/A LEU 129.A N ARG 125.A O no hydrogen 2.631 N/A GLN 130.A N GLN 126.A O no hydrogen 2.760 N/A ALA 131.A N GLU 127.A O no hydrogen 3.090 N/A ARG 132.A N GLU 128.A O no hydrogen 3.024 N/A ARG 132.A NH2 LEU 376.A O no hydrogen 3.158 N/A ARG 132.A NH2 LEU 379.A O no hydrogen 3.537 N/A GLN 133.A N LEU 129.A O no hydrogen 2.939 N/A GLN 133.A NE2 ARG 377.A O no hydrogen 3.452 N/A GLU 134.A N GLN 130.A O no hydrogen 3.005 N/A MET 135.A N ALA 131.A O no hydrogen 2.845 N/A TYR 136.A N ARG 132.A O no hydrogen 2.704 N/A GLN 137.A NE2 GLU 134.A O no hydrogen 3.289 N/A TRP 138.A NE1 GLU 501.A OE2 no hydrogen 2.815 N/A LYS 139.A N CYS 148.A O no hydrogen 3.116 N/A TRP 145.A N ASN 142.A O no hydrogen 2.993 N/A TRP 145.A NE1 SER 426.A OG no hydrogen 2.739 N/A HIS 147.A N LYS 505.A O no hydrogen 2.708 N/A CYS 148.A N LYS 139.A O no hydrogen 3.297 N/A CYS 148.A SG LYS 139.A O no hydrogen 3.981 N/A CYS 148.A SG LEU 149.A O no hydrogen 3.766 N/A LEU 149.A N GLU 369.A OE2 no hydrogen 2.946 N/A ASP 150.A N GLN 137.A O no hydrogen 3.085 N/A THR 153.A N ASP 156.A OD2 no hydrogen 3.400 N/A VAL 154.A N GLU 405.A OE1 no hydrogen 3.065 N/A ASP 156.A N THR 153.A O no hydrogen 3.214 N/A LEU 157.A N VAL 154.A O no hydrogen 3.308 N/A ASN 160.A ND2 GLU 158.A OE1 no hydrogen 3.560 N/A ILE 161.A N GLU 158.A O no hydrogen 3.109 N/A LYS 162.A N LEU 159.A O no hydrogen 3.218 N/A LYS 162.A NZ VAL 154.A O no hydrogen 3.158 N/A TYR 163.A OH SER 662.A O no hydrogen 2.762 N/A LYS 167.A NZ GLU 600.A OE2 no hydrogen 3.168 N/A LYS 167.A NZ GLY 602.A O no hydrogen 3.128 N/A LYS 167.A NZ ASP 603.A O no hydrogen 3.293 N/A ASN 168.A N SER 164.A O no hydrogen 2.658 N/A ALA 169.A N THR 165.A O no hydrogen 2.892 N/A ASN 170.A N ALA 166.A O no hydrogen 3.009 N/A PHE 171.A N LYS 167.A O no hydrogen 2.890 N/A TYR 172.A N ASN 168.A O no hydrogen 3.007 N/A LEU 173.A N ALA 169.A O no hydrogen 2.904 N/A GLN 174.A N ASN 170.A O no hydrogen 3.135 N/A ALA 175.A N PHE 171.A O no hydrogen 2.752 N/A GLY 176.A N TYR 172.A O no hydrogen 2.847 N/A SER 177.A N LEU 173.A O no hydrogen 3.128 N/A SER 177.A OG LEU 173.A O no hydrogen 3.393 N/A ALA 178.A N GLN 174.A O no hydrogen 3.003 N/A PHE 179.A N ALA 175.A O no hydrogen 2.924 N/A ALA 180.A N GLY 176.A O no hydrogen 2.829 N/A GLU 181.A N SER 177.A O no hydrogen 2.778 N/A MET 182.A N ALA 178.A O no hydrogen 3.137 N/A LYS 183.A N PHE 179.A O no hydrogen 2.843 N/A LYS 183.A NZ ASP 189.A OD1 no hydrogen 2.649 N/A LYS 183.A NZ ASP 189.A OD2 no hydrogen 2.660 N/A ILE 184.A N ALA 180.A O no hydrogen 2.885 N/A LYS 185.A N GLU 181.A O no hydrogen 3.184 N/A LYS 185.A NZ GLU 181.A OE1 no hydrogen 3.227 N/A GLY 186.A N MET 182.A O no hydrogen 3.111 N/A LEU 187.A N MET 182.A O no hydrogen 3.211 N/A ASP 189.A N GLY 186.A O no hydrogen 3.046 N/A ARG 190.A NH1 GLU 199.A OE1 no hydrogen 3.385 N/A ARG 190.A NH1 GLU 199.A OE2 no hydrogen 2.720 N/A ARG 190.A NH2 GLU 199.A OE1 no hydrogen 3.563 N/A TRP 194.A NE1 THR 587.A OG1 no hydrogen 3.011 N/A ARG 195.A N GLU 199.A OE1 no hydrogen 2.634 N/A ASN 198.A N SER 196.A OG no hydrogen 3.197 N/A GLU 199.A N SER 196.A OG no hydrogen 3.182 N/A LYS 201.A N ASN 198.A O no hydrogen 2.867 N/A ARG 202.A N GLU 199.A O no hydrogen 3.072 N/A ARG 202.A NH2 GLU 199.A OE2 no hydrogen 3.009 N/A ILE 203.A N MET 200.A O no hydrogen 3.161 N/A PHE 204.A N LYS 201.A O no hydrogen 3.155 N/A ASN 205.A N ARG 202.A O no hydrogen 2.847 N/A PHE 206.A N ILE 203.A O no hydrogen 2.862 N/A ARG 207.A N ILE 203.A O no hydrogen 3.276 N/A ARG 207.A NH1 GLU 181.A OE2 no hydrogen 3.061 N/A ARG 207.A NH1 PHE 206.A O no hydrogen 2.565 N/A THR 209.A OG1 ASP 549.A OD2 no hydrogen 3.098 N/A ALA 212.A N THR 209.A OG1 no hydrogen 2.963 N/A GLU 213.A N THR 209.A O no hydrogen 3.002 N/A HIS 214.A N PRO 210.A O no hydrogen 3.102 N/A ALA 215.A N ALA 211.A O no hydrogen 3.072 N/A PHE 216.A N ALA 212.A O no hydrogen 3.290 N/A GLU 217.A N GLU 213.A O no hydrogen 2.917 N/A HIS 218.A N HIS 214.A O no hydrogen 3.035 N/A HIS 218.A ND1 GLU 221.A OE2 no hydrogen 2.482 N/A TRP 219.A N PHE 216.A O no hydrogen 3.452 N/A GLU 221.A N HIS 218.A O no hydrogen 2.906 N/A PHE 225.A N GLU 221.A O no hydrogen 2.986 N/A ALA 226.A N ASP 222.A O no hydrogen 3.012 N/A SER 227.A N ALA 223.A O no hydrogen 3.131 N/A SER 227.A OG ALA 223.A O no hydrogen 3.401 N/A SER 227.A OG PHE 224.A O no hydrogen 3.117 N/A GLN 228.A N PHE 224.A O no hydrogen 3.363 N/A GLN 228.A NE2 ASN 556.A OD1 no hydrogen 3.346 N/A PHE 229.A N ALA 226.A O no hydrogen 2.776 N/A LEU 230.A N SER 227.A O no hydrogen 3.066 N/A ASN 231.A N SER 227.A O no hydrogen 2.933 N/A ASN 231.A ND2 GLY 457.A O no hydrogen 2.916 N/A ARG 239.A N LEU 276.A O no hydrogen 3.102 N/A ARG 240.A N ARG 450.A O no hydrogen 2.679 N/A CYS 241.A N LEU 274.A O no hydrogen 2.936 N/A ASN 247.A ND2 GLN 322.A O no hydrogen 3.106 N/A ASN 247.A ND2 GLN 322.A OE1 no hydrogen 2.973 N/A PHE 248.A N PRO 245.A O no hydrogen 3.259 N/A VAL 255.A N THR 251.A O no hydrogen 3.332 N/A ALA 256.A N ALA 253.A O no hydrogen 3.382 N/A LEU 259.A N VAL 255.A O no hydrogen 3.122 N/A LEU 265.A N ASP 252.A OD1 no hydrogen 2.746 N/A ALA 267.A N SER 264.A OG no hydrogen 3.049 N/A GLU 268.A N SER 264.A O no hydrogen 3.366 N/A LEU 269.A N LEU 265.A O no hydrogen 3.239 N/A GLU 270.A N GLN 266.A O no hydrogen 3.398 N/A LYS 271.A N ALA 267.A O no hydrogen 3.140 N/A GLY 272.A N LEU 269.A O no hydrogen 3.355 N/A SER 273.A N GLU 268.A O no hydrogen 3.166 N/A SER 273.A OG GLU 268.A O no hydrogen 3.288 N/A SER 273.A OG GLU 268.A OE1 no hydrogen 2.110 N/A PHE 275.A N LEU 304.A O no hydrogen 2.793 N/A LEU 276.A N ARG 239.A O no hydrogen 2.815 N/A VAL 277.A N THR 302.A O no hydrogen 2.900 N/A HIS 279.A N PRO 300.A O no hydrogen 3.104 N/A HIS 279.A NE2 GLU 351.A OE1 no hydrogen 2.425 N/A GLY 280.A N ASP 278.A OD2 no hydrogen 2.512 N/A LEU 282.A N HIS 279.A O no hydrogen 2.960 N/A SER 283.A N GLY 280.A O no hydrogen 2.868 N/A ILE 285.A N LEU 282.A O no hydrogen 2.987 N/A GLN 286.A N GLU 427.A OE1 no hydrogen 3.096 N/A ASN 288.A N GLY 419.A O no hydrogen 2.483 N/A ASN 288.A ND2 ASP 415.A O no hydrogen 2.445 N/A ASN 288.A ND2 THR 418.A O no hydrogen 2.669 N/A ILE 290.A N LYS 293.A O no hydrogen 2.991 N/A ASN 291.A ND2 ASN 585.A OD1 no hydrogen 2.883 N/A LYS 293.A N ILE 290.A O no hydrogen 2.899 N/A LYS 293.A NZ GLN 562.A OE1 no hydrogen 2.970 N/A GLN 295.A N ASN 288.A O no hydrogen 2.869 N/A GLN 295.A NE2 LYS 293.A O no hydrogen 2.946 N/A GLN 295.A NE2 GLN 562.A OE1 no hydrogen 3.596 N/A PHE 296.A N MET 561.A O no hydrogen 2.771 N/A SER 297.A OG ALA 298.A O no hydrogen 3.005 N/A MET 301.A N GLN 319.A O no hydrogen 2.726 N/A THR 302.A N VAL 277.A O no hydrogen 2.977 N/A LEU 303.A N ALA 317.A O no hydrogen 2.891 N/A LEU 304.A N PHE 275.A O no hydrogen 2.807 N/A TYR 305.A N LEU 314.A O no hydrogen 2.786 N/A GLN 306.A N SER 273.A O no hydrogen 2.828 N/A GLN 306.A NE2 SER 307.A O no hydrogen 2.738 N/A GLN 306.A NE2 GLY 311.A O no hydrogen 2.777 N/A GLY 311.A N SER 307.A O no hydrogen 3.214 N/A LEU 314.A N TYR 305.A O no hydrogen 3.099 N/A LEU 316.A N LEU 303.A O no hydrogen 2.547 N/A ILE 318.A N PHE 331.A O no hydrogen 2.939 N/A GLN 319.A N MET 301.A O no hydrogen 3.034 N/A GLN 319.A NE2 ASN 247.A O no hydrogen 3.126 N/A GLN 319.A NE2 SER 321.A O no hydrogen 2.736 N/A SER 321.A OG THR 323.A O no hydrogen 3.525 N/A SER 321.A OG THR 323.A OG1 no hydrogen 3.024 N/A GLN 322.A NE2 ALA 299.A O no hydrogen 2.601 N/A THR 323.A N SER 321.A OG no hydrogen 3.131 N/A THR 323.A OG1 SER 321.A OG no hydrogen 3.024 N/A SER 328.A N GLY 325.A O no hydrogen 2.912 N/A SER 328.A OG THR 323.A O no hydrogen 2.623 N/A PHE 331.A N ILE 318.A O no hydrogen 2.941 N/A LEU 332.A N ASP 335.A OD2 no hydrogen 2.963 N/A ASP 335.A N LEU 332.A O no hydrogen 2.888 N/A ASP 339.A N ASP 336.A OD1 no hydrogen 3.045 N/A TRP 340.A N ASP 336.A O no hydrogen 2.824 N/A TRP 340.A NE1 ASP 222.A OD1 no hydrogen 2.855 N/A TRP 340.A NE1 ASP 222.A OD2 no hydrogen 3.265 N/A LEU 341.A N LYS 337.A O no hydrogen 2.802 N/A LEU 342.A N TRP 338.A O no hydrogen 2.798 N/A ALA 343.A N ASP 339.A O no hydrogen 2.859 N/A LYS 344.A N TRP 340.A O no hydrogen 3.018 N/A LYS 344.A NZ GLN 220.A O no hydrogen 3.084 N/A LYS 344.A NZ ASP 222.A OD1 no hydrogen 2.939 N/A THR 345.A N LEU 341.A O no hydrogen 2.905 N/A THR 345.A OG1 LEU 341.A O no hydrogen 3.089 N/A TRP 346.A N LEU 342.A O no hydrogen 3.136 N/A VAL 347.A N ALA 343.A O no hydrogen 3.288 N/A ARG 348.A N LYS 344.A O no hydrogen 2.912 N/A ARG 348.A NH1 ASN 556.A O no hydrogen 3.309 N/A ASN 349.A N THR 345.A O no hydrogen 2.725 N/A ASN 349.A ND2 PRO 558.A O no hydrogen 3.291 N/A ALA 350.A N TRP 346.A O no hydrogen 2.784 N/A GLU 351.A N VAL 347.A O no hydrogen 2.752 N/A PHE 352.A N ARG 348.A O no hydrogen 3.012 N/A SER 353.A N ASN 349.A O no hydrogen 3.220 N/A SER 353.A OG ASN 349.A O no hydrogen 3.552 N/A PHE 354.A N ALA 350.A O no hydrogen 3.054 N/A HIS 355.A N GLU 351.A O no hydrogen 3.028 N/A HIS 355.A NE2 VAL 543.A O no hydrogen 2.751 N/A GLU 356.A N PHE 352.A O no hydrogen 3.060 N/A ALA 357.A N SER 353.A O no hydrogen 3.288 N/A LEU 358.A N PHE 354.A O no hydrogen 3.088 N/A THR 359.A N PHE 354.A O no hydrogen 3.302 N/A THR 359.A OG1 ASN 234.A OD1 no hydrogen 2.638 N/A HIS 360.A N HIS 355.A O no hydrogen 2.563 N/A LEU 362.A N ALA 357.A O no hydrogen 2.956 N/A HIS 363.A N LEU 358.A O no hydrogen 2.899 N/A HIS 363.A NE2 ASN 432.A OD1 no hydrogen 2.728 N/A SER 364.A OG THR 359.A O no hydrogen 3.385 N/A HIS 365.A N LEU 361.A O no hydrogen 2.851 N/A HIS 365.A ND1 ASN 400.A OD1 no hydrogen 2.862 N/A LEU 366.A N LEU 361.A O no hydrogen 3.041 N/A LEU 367.A N LEU 362.A O no hydrogen 3.219 N/A GLU 369.A N HIS 365.A O no hydrogen 3.031 N/A VAL 370.A N LEU 366.A O no hydrogen 3.003 N/A PHE 371.A N LEU 367.A O no hydrogen 2.920 N/A THR 372.A N PRO 368.A O no hydrogen 2.838 N/A THR 372.A OG1 PRO 368.A O no hydrogen 2.917 N/A LEU 373.A N GLU 369.A O no hydrogen 2.829 N/A ALA 374.A N VAL 370.A O no hydrogen 2.923 N/A THR 375.A N PHE 371.A O no hydrogen 3.176 N/A THR 375.A OG1 PHE 371.A O no hydrogen 3.491 N/A LEU 376.A N THR 372.A O no hydrogen 3.144 N/A ARG 377.A N LEU 373.A O no hydrogen 3.304 N/A ARG 377.A NE GLU 501.A OE2 no hydrogen 2.720 N/A ARG 377.A NH1 TYR 136.A O no hydrogen 2.732 N/A ARG 377.A NH2 GLU 501.A OE2 no hydrogen 3.305 N/A GLN 378.A N ALA 374.A O no hydrogen 2.867 N/A GLN 378.A NE2 GLU 501.A OE1 no hydrogen 3.007 N/A GLN 378.A NE2 GLU 501.A OE2 no hydrogen 3.257 N/A LEU 379.A N THR 375.A O no hydrogen 3.110 N/A HIS 381.A N GLU 128.A OE2 no hydrogen 2.374 N/A CYS 382.A SG GLN 106.A OE1 no hydrogen 3.563 N/A HIS 383.A N PRO 380.A O no hydrogen 3.061 N/A HIS 383.A NE2 ASP 492.A OD2 no hydrogen 2.723 N/A LEU 385.A N HIS 383.A ND1 no hydrogen 2.804 N/A LYS 387.A N HIS 383.A O no hydrogen 3.169 N/A LYS 387.A NZ GLY 108.A O no hydrogen 3.143 N/A LEU 388.A N PRO 384.A O no hydrogen 3.042 N/A LEU 389.A N LEU 385.A O no hydrogen 2.951 N/A ILE 390.A N PHE 386.A O no hydrogen 2.835 N/A HIS 392.A N LEU 389.A O no hydrogen 2.784 N/A HIS 392.A ND1 ASN 659.A O no hydrogen 2.596 N/A HIS 392.A NE2 TYR 610.A OH no hydrogen 2.984 N/A THR 393.A N ILE 390.A O no hydrogen 3.307 N/A THR 393.A OG1 ILE 390.A O no hydrogen 2.830 N/A ARG 394.A N PRO 391.A O no hydrogen 3.445 N/A ARG 394.A NH1 ASP 603.A OD1 no hydrogen 3.185 N/A ARG 394.A NH1 ASP 603.A OD2 no hydrogen 2.675 N/A ARG 394.A NH2 ASP 603.A O no hydrogen 2.672 N/A ARG 394.A NH2 ASP 603.A OD2 no hydrogen 3.307 N/A ARG 394.A NH2 GLU 658.A OE1 no hydrogen 3.091 N/A TYR 395.A OH ASP 603.A OD1 no hydrogen 2.628 N/A THR 396.A N THR 393.A O no hydrogen 3.087 N/A THR 396.A OG1 THR 393.A O no hydrogen 3.316 N/A THR 396.A OG1 VAL 661.A O no hydrogen 2.691 N/A ILE 399.A N TYR 395.A O no hydrogen 3.078 N/A ASN 400.A N THR 396.A O no hydrogen 3.085 N/A ASN 400.A ND2 HIS 365.A O no hydrogen 2.731 N/A ASN 400.A ND2 GLU 369.A OE1 no hydrogen 2.956 N/A THR 401.A N LEU 397.A O no hydrogen 3.056 N/A THR 401.A OG1 LEU 397.A O no hydrogen 3.358 N/A THR 401.A OG1 HIS 398.A O no hydrogen 3.006 N/A LEU 402.A N HIS 398.A O no hydrogen 2.897 N/A ALA 403.A N ILE 399.A O no hydrogen 2.900 N/A ARG 404.A N ASN 400.A O no hydrogen 2.981 N/A GLU 405.A N THR 401.A O no hydrogen 2.846 N/A LEU 406.A N LEU 402.A O no hydrogen 2.684 N/A LEU 406.A N ALA 403.A O no hydrogen 3.151 N/A LEU 407.A N ALA 403.A O no hydrogen 2.646 N/A ILE 408.A N ALA 403.A O no hydrogen 3.347 N/A GLY 411.A N ASP 415.A OD2 no hydrogen 2.787 N/A ARG 416.A N GLN 412.A O no hydrogen 2.774 N/A ARG 416.A NE ASP 589.A OD2 no hydrogen 3.379 N/A ARG 416.A NH1 GLY 411.A O no hydrogen 2.552 N/A ARG 416.A NH2 ASP 589.A OD1 no hydrogen 3.114 N/A ARG 416.A NH2 ASP 589.A OD2 no hydrogen 2.866 N/A SER 417.A N VAL 413.A O no hydrogen 2.734 N/A SER 417.A OG ASP 589.A OD2 no hydrogen 2.957 N/A THR 418.A N VAL 414.A O no hydrogen 3.262 N/A THR 418.A OG1 VAL 413.A O no hydrogen 3.460 N/A GLY 419.A N PRO 559.A O no hydrogen 3.183 N/A GLY 424.A N ILE 420.A O no hydrogen 3.275 N/A PHE 425.A N GLY 421.A O no hydrogen 2.930 N/A SER 426.A N ILE 422.A O no hydrogen 2.895 N/A SER 426.A OG ASN 142.A OD1 no hydrogen 3.138 N/A GLU 427.A N GLU 423.A O no hydrogen 2.740 N/A LEU 428.A N GLY 424.A O no hydrogen 2.984 N/A ILE 429.A N PHE 425.A O no hydrogen 2.965 N/A GLN 430.A N SER 426.A O no hydrogen 2.851 N/A GLN 430.A NE2 PRO 143.A O no hydrogen 2.697 N/A ARG 431.A N GLU 427.A O no hydrogen 2.866 N/A ARG 431.A NH1 ILE 281.A O no hydrogen 3.186 N/A ARG 431.A NH1 SER 283.A O no hydrogen 2.768 N/A ASN 432.A N LEU 428.A O no hydrogen 2.735 N/A MET 433.A N ILE 429.A O no hydrogen 2.986 N/A LYS 434.A N ARG 431.A O no hydrogen 3.207 N/A LEU 436.A N MET 433.A O no hydrogen 3.353 N/A ASN 437.A ND2 GLN 435.A O no hydrogen 3.119 N/A TYR 438.A N SER 513.A O no hydrogen 2.715 N/A LEU 440.A N ASN 437.A OD1 no hydrogen 2.939 N/A LEU 441.A N TYR 438.A O no hydrogen 3.043 N/A CYS 442.A N TYR 438.A O no hydrogen 3.249 N/A CYS 442.A SG TYR 438.A O no hydrogen 3.524 N/A CYS 442.A SG GLN 527.A OE1 no hydrogen 3.227 N/A ASP 446.A N CYS 442.A O no hydrogen 2.963 N/A ILE 447.A N LEU 443.A O no hydrogen 2.983 N/A ARG 448.A N PRO 444.A O no hydrogen 3.283 N/A THR 449.A N GLU 445.A O no hydrogen 2.591 N/A THR 449.A OG1 GLU 445.A O no hydrogen 2.792 N/A ARG 450.A N ASP 446.A O no hydrogen 2.962 N/A ARG 450.A NE ILE 238.A O no hydrogen 2.660 N/A ARG 450.A NH1 ASP 446.A OD1 no hydrogen 2.849 N/A ARG 450.A NH2 PRO 235.A O no hydrogen 3.460 N/A ARG 450.A NH2 ILE 238.A O no hydrogen 2.612 N/A ARG 450.A NH2 TYR 458.A OH no hydrogen 2.634 N/A GLY 451.A N ARG 448.A O no hydrogen 3.156 N/A VAL 452.A N ILE 447.A O no hydrogen 2.932 N/A TYR 458.A OH PRO 235.A O no hydrogen 2.792 N/A TYR 459.A N ASN 231.A OD1 no hydrogen 2.846 N/A ARG 461.A NE ASP 462.A OD1 no hydrogen 3.138 N/A ARG 461.A NH1 VAL 452.A O no hydrogen 2.785 N/A ARG 461.A NH1 ILE 455.A O no hydrogen 2.453 N/A ARG 461.A NH2 ILE 455.A O no hydrogen 2.719 N/A ARG 461.A NH2 ASP 462.A OD1 no hydrogen 3.095 N/A ASP 462.A N TYR 458.A O no hydrogen 2.960 N/A ASP 463.A N TYR 459.A O no hydrogen 2.840 N/A GLY 464.A N TYR 460.A O no hydrogen 2.889 N/A MET 465.A N ARG 461.A O no hydrogen 2.864 N/A GLN 466.A N ASP 462.A O no hydrogen 3.358 N/A ILE 467.A N ASP 463.A O no hydrogen 2.912 N/A TRP 468.A N GLY 464.A O no hydrogen 2.723 N/A GLY 469.A N MET 465.A O no hydrogen 3.074 N/A ALA 470.A N GLN 466.A O no hydrogen 3.192 N/A VAL 471.A N ILE 467.A O no hydrogen 2.966 N/A GLU 472.A N TRP 468.A O no hydrogen 2.952 N/A ARG 473.A N GLY 469.A O no hydrogen 3.039 N/A PHE 474.A N ALA 470.A O no hydrogen 2.938 N/A VAL 475.A N VAL 471.A O no hydrogen 2.632 N/A SER 476.A N GLU 472.A O no hydrogen 2.676 N/A GLU 477.A N PHE 474.A O no hydrogen 3.029 N/A ILE 478.A N PHE 474.A O no hydrogen 3.147 N/A ILE 479.A N VAL 475.A O no hydrogen 2.903 N/A GLY 480.A N SER 476.A O no hydrogen 3.024 N/A ILE 481.A N ILE 478.A O no hydrogen 2.946 N/A TYR 482.A N ILE 478.A O no hydrogen 3.347 N/A TYR 482.A OH GLU 617.A OE1 no hydrogen 2.828 N/A TYR 483.A N ILE 479.A O no hydrogen 3.088 N/A TYR 483.A OH ASP 492.A OD2 no hydrogen 2.217 N/A SER 485.A OG SER 488.A OG no hydrogen 2.662 N/A SER 488.A N SER 485.A OG no hydrogen 3.181 N/A SER 488.A OG SER 485.A O no hydrogen 3.261 N/A SER 488.A OG SER 485.A OG no hydrogen 2.662 N/A VAL 489.A N ASP 486.A O no hydrogen 3.104 N/A GLN 490.A N ASP 486.A O no hydrogen 3.172 N/A GLN 490.A NE2 GLU 520.A O no hydrogen 3.154 N/A ASP 491.A N GLU 487.A O no hydrogen 2.716 N/A ASP 492.A N SER 488.A O no hydrogen 3.097 N/A ASP 492.A N VAL 489.A O no hydrogen 3.177 N/A LEU 495.A N ASP 492.A OD1 no hydrogen 2.852 N/A GLN 496.A N ASP 492.A O no hydrogen 2.996 N/A GLN 496.A NE2 VAL 489.A O no hydrogen 2.806 N/A GLN 496.A NE2 LEU 519.A O no hydrogen 2.688 N/A ALA 497.A N ARG 493.A O no hydrogen 2.853 N/A TRP 498.A N GLU 494.A O no hydrogen 2.860 N/A VAL 499.A N LEU 495.A O no hydrogen 2.993 N/A ARG 500.A N GLN 496.A O no hydrogen 2.940 N/A ARG 500.A NE SER 517.A O no hydrogen 3.113 N/A GLU 501.A N ALA 497.A O no hydrogen 3.016 N/A ILE 502.A N TRP 498.A O no hydrogen 3.368 N/A PHE 503.A N VAL 499.A O no hydrogen 3.209 N/A SER 504.A N ARG 500.A O no hydrogen 3.295 N/A SER 504.A OG ARG 500.A O no hydrogen 3.152 N/A SER 504.A OG ASN 509.A OD1 no hydrogen 3.544 N/A LYS 505.A N GLU 501.A O no hydrogen 2.848 N/A GLY 506.A N ILE 502.A O no hydrogen 2.943 N/A PHE 507.A N ILE 502.A O no hydrogen 3.312 N/A LEU 508.A N SER 504.A O no hydrogen 2.963 N/A ASN 509.A N PHE 503.A O no hydrogen 2.863 N/A ASN 509.A ND2 SER 504.A OG no hydrogen 3.243 N/A GLN 510.A NE2 MET 433.A O no hydrogen 3.488 N/A GLN 510.A NE2 PHE 507.A O no hydrogen 3.128 N/A SER 513.A N GLN 510.A O no hydrogen 3.170 N/A SER 513.A OG GLN 510.A O no hydrogen 2.504 N/A GLY 514.A N GLU 511.A O no hydrogen 3.265 N/A ILE 515.A N SER 513.A OG no hydrogen 3.258 N/A SER 518.A OG GLN 496.A OE1 no hydrogen 3.144 N/A SER 518.A OG GLU 520.A OE2 no hydrogen 2.703 N/A LEU 519.A N GLN 496.A OE1 no hydrogen 2.968 N/A ARG 522.A N ASP 486.A OD1 no hydrogen 3.333 N/A GLU 523.A N GLU 523.A OE1 no hydrogen 2.526 N/A ALA 524.A N THR 521.A OG1 no hydrogen 2.705 N/A LEU 525.A N THR 521.A O no hydrogen 3.003 N/A VAL 526.A N ARG 522.A O no hydrogen 3.049 N/A GLN 527.A N GLU 523.A O no hydrogen 3.002 N/A TYR 528.A N ALA 524.A O no hydrogen 2.870 N/A VAL 529.A N LEU 525.A O no hydrogen 2.767 N/A THR 530.A N VAL 526.A O no hydrogen 2.940 N/A THR 530.A OG1 VAL 526.A O no hydrogen 2.510 N/A MET 531.A N GLN 527.A O no hydrogen 2.984 N/A VAL 532.A N TYR 528.A O no hydrogen 2.910 N/A ILE 533.A N VAL 529.A O no hydrogen 2.820 N/A PHE 534.A N THR 530.A O no hydrogen 2.891 N/A THR 535.A N MET 531.A O no hydrogen 3.049 N/A THR 535.A OG1 MET 531.A O no hydrogen 2.933 N/A CYS 536.A N VAL 532.A O no hydrogen 3.222 N/A CYS 536.A SG VAL 532.A O no hydrogen 3.292 N/A SER 537.A N ILE 533.A O no hydrogen 3.016 N/A SER 537.A N PHE 534.A O no hydrogen 3.139 N/A SER 537.A OG ILE 533.A O no hydrogen 3.304 N/A ALA 538.A N SER 537.A OG no hydrogen 2.690 N/A LYS 539.A N PHE 534.A O no hydrogen 2.965 N/A ALA 541.A N SER 537.A O no hydrogen 3.094 N/A ALA 542.A N ALA 538.A O no hydrogen 2.916 N/A VAL 543.A N LYS 539.A O no hydrogen 3.201 N/A SER 544.A N ALA 541.A O no hydrogen 3.094 N/A SER 544.A OG LEU 597.A O no hydrogen 3.347 N/A ALA 545.A N ALA 541.A O no hydrogen 2.889 N/A GLN 547.A NE2 GLU 356.A OE2 no hydrogen 2.964 N/A PHE 548.A N SER 598.A OG no hydrogen 3.008 N/A SER 550.A N GLN 547.A O no hydrogen 3.287 N/A SER 550.A OG GLY 546.A O no hydrogen 3.143 N/A CYS 551.A N GLN 547.A O no hydrogen 3.195 N/A CYS 551.A N PHE 548.A O no hydrogen 3.208 N/A CYS 551.A SG GLN 547.A O no hydrogen 3.275 N/A CYS 551.A SG PHE 548.A O no hydrogen 3.900 N/A ALA 552.A N PHE 548.A O no hydrogen 2.893 N/A ASN 556.A N TRP 553.A O no hydrogen 3.072 N/A ASN 556.A ND2 GLN 228.A OE1 no hydrogen 3.144 N/A ASN 556.A ND2 SER 550.A O no hydrogen 2.720 N/A SER 560.A OG GLN 295.A OE1 no hydrogen 2.875 N/A GLN 562.A N THR 580.A O no hydrogen 2.707 N/A GLN 562.A NE2 LEU 581.A O no hydrogen 2.858 N/A LYS 569.A NZ ILE 330.A O no hydrogen 2.900 N/A GLY 570.A N ASP 339.A OD2 no hydrogen 2.701 N/A GLU 575.A N THR 573.A OG1 no hydrogen 3.344 N/A PHE 577.A N THR 573.A O no hydrogen 2.796 N/A PHE 577.A N CYS 574.A O no hydrogen 3.067 N/A ILE 578.A N CYS 574.A O no hydrogen 3.234 N/A ALA 579.A N GLU 575.A O no hydrogen 3.195 N/A THR 580.A N GLY 576.A O no hydrogen 3.144 N/A THR 580.A OG1 GLY 576.A O no hydrogen 2.956 N/A LEU 581.A N PHE 577.A O no hydrogen 3.223 N/A LEU 581.A N ILE 578.A O no hydrogen 3.010 N/A VAL 584.A N GLY 192.A O no hydrogen 3.226 N/A ASN 585.A N ARG 190.A O no hydrogen 2.891 N/A ASN 585.A ND2 ASN 291.A OD1 no hydrogen 3.051 N/A THR 587.A N PRO 583.A O no hydrogen 2.850 N/A THR 587.A OG1 PRO 583.A O no hydrogen 2.654 N/A CYS 588.A N VAL 584.A O no hydrogen 2.826 N/A CYS 588.A SG VAL 584.A O no hydrogen 3.485 N/A ASP 589.A N ASN 585.A O no hydrogen 3.245 N/A VAL 590.A N ALA 586.A O no hydrogen 3.390 N/A VAL 590.A N THR 587.A O no hydrogen 3.192 N/A ILE 591.A N THR 587.A O no hydrogen 3.062 N/A LEU 592.A N CYS 588.A O no hydrogen 2.913 N/A ALA 593.A N ASP 589.A O no hydrogen 3.176 N/A LEU 594.A N VAL 590.A O no hydrogen 2.741 N/A TRP 595.A N ILE 591.A O no hydrogen 2.832 N/A LEU 596.A N LEU 592.A O no hydrogen 3.262 N/A LEU 597.A N LEU 594.A O no hydrogen 3.083 N/A SER 598.A OG LEU 594.A O no hydrogen 2.363 N/A GLY 602.A N GLU 600.A O no hydrogen 3.023 N/A ARG 605.A N GLU 658.A OE1 no hydrogen 3.132 N/A ARG 605.A NH1 ASP 612.A OD2 no hydrogen 3.363 N/A LEU 607.A N ILE 657.A O no hydrogen 2.611 N/A GLY 608.A N ASN 659.A OD1 no hydrogen 3.048 N/A THR 609.A N PRO 606.A O no hydrogen 3.049 N/A THR 609.A OG1 PRO 606.A O no hydrogen 3.483 N/A TYR 610.A OH HIS 392.A NE2 no hydrogen 2.984 N/A GLU 613.A N TYR 94.A OH no hydrogen 2.880 N/A HIS 614.A N ASP 612.A O no hydrogen 3.039 N/A ARG 622.A N GLU 618.A O no hydrogen 3.011 N/A SER 623.A N ALA 619.A O no hydrogen 3.284 N/A SER 623.A OG GLU 477.A OE1 no hydrogen 2.998 N/A SER 623.A OG ALA 619.A O no hydrogen 3.167 N/A ILE 624.A N PRO 620.A O no hydrogen 3.002 N/A ALA 625.A N ARG 621.A O no hydrogen 3.084 N/A THR 626.A N ARG 622.A O no hydrogen 3.006 N/A THR 626.A OG1 ARG 622.A O no hydrogen 2.467 N/A PHE 627.A N SER 623.A O no hydrogen 2.673 N/A GLN 628.A N ILE 624.A O no hydrogen 2.742 N/A GLN 628.A NE2 GLY 608.A O no hydrogen 2.390 N/A SER 629.A N ALA 625.A O no hydrogen 3.186 N/A SER 629.A OG THR 626.A O no hydrogen 3.101 N/A ARG 630.A N THR 626.A O no hydrogen 3.010 N/A LEU 631.A N PHE 627.A O no hydrogen 3.152 N/A ALA 632.A N GLN 628.A O no hydrogen 3.063 N/A GLN 633.A N SER 629.A O no hydrogen 3.018 N/A ILE 634.A N ARG 630.A O no hydrogen 3.120 N/A SER 635.A N LEU 631.A O no hydrogen 2.787 N/A SER 635.A OG ASP 653.A OD1 no hydrogen 2.804 N/A ARG 636.A N ALA 632.A O no hydrogen 2.951 N/A ARG 636.A N GLN 633.A O no hydrogen 3.201 N/A ARG 636.A NH1 GLU 640.A OE2 no hydrogen 2.567 N/A ARG 636.A NH2 GLU 640.A OE2 no hydrogen 3.176 N/A GLY 637.A N GLN 633.A O no hydrogen 3.268 N/A ILE 638.A N ILE 634.A O no hydrogen 3.221 N/A GLN 639.A N SER 635.A O no hydrogen 3.211 N/A GLU 640.A N ARG 636.A O no hydrogen 3.051 N/A ARG 641.A N GLY 637.A O no hydrogen 2.734 N/A ARG 641.A NH1 ASN 642.A OD1 no hydrogen 2.569 N/A ARG 641.A NH1 TYR 649.A O no hydrogen 3.063 N/A ARG 641.A NH2 ASP 463.A OD2 no hydrogen 2.401 N/A ASN 642.A N ILE 638.A O no hydrogen 2.713 N/A ASN 642.A ND2 TYR 649.A O no hydrogen 2.634 N/A GLN 643.A N GLU 640.A O no hydrogen 3.195 N/A LEU 645.A N ASN 642.A O no hydrogen 3.337 N/A TYR 649.A N ASN 642.A OD1 no hydrogen 3.197 N/A ASP 653.A N THR 650.A O no hydrogen 3.165 N/A LEU 656.A N ASP 653.A O no hydrogen 2.486 N/A ILE 657.A N PRO 654.A O no hydrogen 2.907 N/A ASN 659.A N ARG 605.A O no hydrogen 3.369 N/A ASN 659.A ND2 THR 609.A O no hydrogen 2.594 N/A SER 660.A OG ARG 394.A O no hydrogen 2.472 N/A SER 662.A OG GLU 600.A OE2 no hydrogen 2.533 N/A