Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4btx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N HIS 59.A NE2 no hydrogen 3.426 N/A GLN 5.A NE2 GLN 273.A O no hydrogen 3.152 N/A SER 11.A N GLU 14.A OE1 no hydrogen 2.940 N/A SER 11.A OG GLU 14.A OE1 no hydrogen 3.270 N/A ARG 12.A NH1 THR 371.A OG1 no hydrogen 2.878 N/A GLU 14.A N SER 11.A OG no hydrogen 3.082 N/A LEU 15.A N SER 11.A O no hydrogen 2.797 N/A THR 16.A N ARG 12.A O no hydrogen 2.692 N/A THR 16.A OG1 ARG 12.A O no hydrogen 2.672 N/A ALA 17.A N GLU 13.A O no hydrogen 2.792 N/A VAL 18.A N GLU 14.A O no hydrogen 3.127 N/A MET 19.A N LEU 15.A O no hydrogen 2.924 N/A ARG 20.A N THR 16.A O no hydrogen 2.776 N/A PHE 21.A N ALA 17.A O no hydrogen 2.936 N/A LEU 22.A N VAL 18.A O no hydrogen 3.010 N/A THR 23.A N MET 19.A O no hydrogen 2.827 N/A THR 23.A OG1 MET 19.A O no hydrogen 2.873 N/A GLN 24.A N ARG 20.A O no hydrogen 3.396 N/A ARG 25.A N LEU 22.A O no hydrogen 2.946 N/A ARG 25.A NH1 PHE 21.A O no hydrogen 3.438 N/A VAL 31.A N ASN 41.A O no hydrogen 2.858 N/A ALA 34.A N ASP 32.A OD1 no hydrogen 3.115 N/A GLN 35.A N ASP 32.A O no hydrogen 3.251 N/A ALA 36.A N ALA 33.A O no hydrogen 3.062 N/A ARG 37.A N ASP 40.A OD2 no hydrogen 3.107 N/A ARG 37.A NH1 GLN 121.A OE1 no hydrogen 2.705 N/A ASP 40.A N ARG 37.A O no hydrogen 2.976 N/A CYS 42.A N PHE 76.A O no hydrogen 2.884 N/A PHE 44.A N ILE 74.A O no hydrogen 2.698 N/A SER 45.A N ILE 74.A O no hydrogen 3.406 N/A VAL 46.A N LEU 363.A O no hydrogen 3.139 N/A GLU 47.A N LEU 72.A O no hydrogen 2.973 N/A GLN 49.A N GLU 70.A O no hydrogen 3.216 N/A GLN 49.A NE2 LEU 50.A O no hydrogen 2.939 N/A LYS 53.A N GLU 585.A OE2 no hydrogen 2.945 N/A LYS 53.A NZ ASP 475.A OD2 no hydrogen 3.152 N/A LYS 53.A NZ ASP 477.A OD1 no hydrogen 3.004 N/A LYS 53.A NZ ASP 477.A OD2 no hydrogen 2.869 N/A LYS 53.A NZ ASP 619.A OD2 no hydrogen 2.572 N/A ALA 56.A N PRO 52.A O no hydrogen 3.029 N/A LEU 57.A N LYS 53.A O no hydrogen 2.856 N/A ALA 58.A N ALA 54.A O no hydrogen 3.040 N/A HIS 59.A N ALA 55.A O no hydrogen 3.091 N/A HIS 59.A ND1 SER 64.A O no hydrogen 2.843 N/A LEU 60.A N ALA 56.A O no hydrogen 3.008 N/A ASP 61.A N LEU 57.A O no hydrogen 2.637 N/A SER 64.A N ALA 58.A O no hydrogen 3.204 N/A ARG 69.A NE GLU 14.A OE2 no hydrogen 2.723 N/A ARG 69.A NH1 ALA 8.A O no hydrogen 3.121 N/A ARG 69.A NH2 ALA 8.A O no hydrogen 3.149 N/A ARG 69.A NH2 ASP 9.A O no hydrogen 3.342 N/A ARG 69.A NH2 GLU 14.A OE1 no hydrogen 3.165 N/A ALA 71.A N VAL 90.A O no hydrogen 2.798 N/A LEU 72.A N GLU 47.A O no hydrogen 2.739 N/A ALA 73.A N LEU 88.A O no hydrogen 2.732 N/A ILE 74.A N SER 45.A O no hydrogen 2.918 N/A VAL 75.A N SER 86.A O no hydrogen 2.869 N/A PHE 76.A N CYS 42.A O no hydrogen 2.838 N/A PHE 77.A N ASN 84.A O no hydrogen 2.779 N/A GLY 78.A N ASP 40.A O no hydrogen 2.803 N/A ARG 79.A N ASN 41.A OD1 no hydrogen 2.981 N/A ARG 79.A NH1 ASP 40.A OD1 no hydrogen 3.112 N/A ARG 79.A NH2 GLY 29.A O no hydrogen 3.310 N/A ARG 79.A NH2 ASP 40.A OD1 no hydrogen 3.355 N/A ASN 84.A N PHE 77.A O no hydrogen 3.155 N/A VAL 85.A N LEU 111.A O no hydrogen 3.193 N/A SER 86.A N VAL 75.A O no hydrogen 2.834 N/A SER 86.A OG ASN 84.A OD1 no hydrogen 2.919 N/A SER 86.A OG VAL 85.A O no hydrogen 3.259 N/A GLU 87.A N THR 103.A OG1 no hydrogen 2.571 N/A LEU 88.A N ALA 73.A O no hydrogen 2.836 N/A VAL 89.A N ARG 100.A O no hydrogen 2.732 N/A VAL 90.A N ALA 71.A O no hydrogen 2.759 N/A GLY 91.A N TYR 98.A O no hydrogen 3.322 N/A LEU 93.A N ARG 69.A O no hydrogen 2.997 N/A SER 97.A N GLY 91.A O no hydrogen 3.119 N/A TYR 98.A N GLY 91.A O no hydrogen 2.820 N/A TYR 98.A OH GLU 70.A OE2 no hydrogen 2.989 N/A ARG 100.A N VAL 89.A O no hydrogen 2.732 N/A ARG 100.A NH1 GLU 70.A OE2 no hydrogen 3.561 N/A ARG 100.A NH2 GLU 70.A OE2 no hydrogen 3.501 N/A VAL 102.A N GLU 87.A O no hydrogen 3.128 N/A THR 103.A N ASP 101.A OD1 no hydrogen 3.308 N/A THR 103.A OG1 GLU 87.A O no hydrogen 3.317 N/A THR 103.A OG1 ASP 101.A OD1 no hydrogen 2.954 N/A ARG 106.A N VAL 102.A O no hydrogen 2.889 N/A ARG 106.A NH2 GLN 49.A OE1 no hydrogen 2.467 N/A HIS 107.A N THR 103.A O no hydrogen 2.814 N/A HIS 107.A NE2 GLU 87.A OE1 no hydrogen 2.675 N/A GLY 108.A N VAL 104.A O no hydrogen 3.023 N/A TYR 113.A OH PRO 38.A O no hydrogen 2.860 N/A HIS 114.A NE2 ASP 598.A OD2 no hydrogen 3.012 N/A ARG 115.A N PRO 112.A O no hydrogen 3.239 N/A ARG 116.A N TYR 113.A O no hydrogen 3.331 N/A ARG 116.A NH1 TYR 113.A O no hydrogen 3.382 N/A PHE 120.A N GLU 365.A OE1 no hydrogen 3.483 N/A PHE 120.A N GLU 365.A OE2 no hydrogen 2.823 N/A GLN 121.A NE2 ALA 34.A O no hydrogen 3.680 N/A TYR 123.A N LEU 119.A O no hydrogen 2.924 N/A LEU 124.A N PHE 120.A O no hydrogen 3.021 N/A ASP 125.A N GLN 121.A O no hydrogen 2.705 N/A ILE 126.A N GLU 122.A O no hydrogen 3.001 N/A ASP 127.A N TYR 123.A O no hydrogen 2.979 N/A MET 129.A N ASP 125.A O no hydrogen 3.222 N/A ILE 130.A N ILE 126.A O no hydrogen 2.853 N/A PHE 131.A N ASP 127.A O no hydrogen 3.154 N/A ASN 132.A N GLN 128.A O no hydrogen 2.699 N/A ARG 133.A N MET 129.A O no hydrogen 3.242 N/A LEU 135.A N ILE 130.A O no hydrogen 3.138 N/A GLN 137.A NE2 ARG 133.A O no hydrogen 2.948 N/A ALA 138.A N LEU 135.A O no hydrogen 2.766 N/A SER 139.A N PRO 136.A O no hydrogen 3.128 N/A SER 139.A OG PRO 136.A O no hydrogen 2.998 N/A LEU 141.A N GLU 225.A OE1 no hydrogen 2.978 N/A LEU 142.A N ALA 138.A O no hydrogen 2.968 N/A HIS 143.A N SER 139.A O no hydrogen 2.633 N/A HIS 143.A ND1 SER 139.A O no hydrogen 2.947 N/A HIS 144.A N GLY 140.A O no hydrogen 3.185 N/A CYS 145.A N LEU 141.A O no hydrogen 2.810 N/A CYS 145.A SG LEU 141.A O no hydrogen 3.488 N/A CYS 145.A SG LEU 142.A O no hydrogen 3.994 N/A CYS 146.A N LEU 142.A O no hydrogen 2.977 N/A TYR 148.A N LEU 142.A O no hydrogen 3.283 N/A TYR 148.A OH HIS 150.A O no hydrogen 3.229 N/A ARG 151.A NE ASN 132.A OD1 no hydrogen 2.991 N/A ARG 151.A NH2 ASN 132.A OD1 no hydrogen 2.952 N/A ARG 153.A N ARG 151.A O no hydrogen 3.070 N/A ASN 154.A ND2 CYS 146.A O no hydrogen 3.075 N/A THR 157.A OG1 ASP 127.A OD1 no hydrogen 2.889 N/A THR 159.A OG1 THR 160.A O no hydrogen 3.534 N/A THR 160.A OG1 TRP 173.A O no hydrogen 2.746 N/A ARG 163.A NE THR 172.A OG1 no hydrogen 2.836 N/A ARG 163.A NH1 ASN 597.A OD1 no hydrogen 3.311 N/A ARG 163.A NH2 TYR 123.A OH no hydrogen 3.396 N/A LEU 165.A N ASP 169.A OD2 no hydrogen 2.893 N/A SER 167.A OG ASP 598.A OD1 no hydrogen 3.183 N/A SER 167.A OG ASP 598.A OD2 no hydrogen 2.631 N/A ASP 169.A N GLN 166.A O no hydrogen 3.064 N/A ARG 170.A NE GLU 122.A OE2 no hydrogen 2.662 N/A ARG 170.A NH1 ARG 116.A O no hydrogen 2.983 N/A ARG 170.A NH2 ARG 116.A O no hydrogen 3.103 N/A ARG 170.A NH2 GLU 122.A OE1 no hydrogen 3.263 N/A ARG 170.A NH2 GLU 122.A OE2 no hydrogen 3.056 N/A ALA 171.A N ARG 163.A O no hydrogen 3.307 N/A THR 172.A N VAL 196.A O no hydrogen 2.855 N/A THR 172.A OG1 HIS 198.A NE2 no hydrogen 2.892 N/A PHE 174.A N LEU 194.A O no hydrogen 2.724 N/A LEU 176.A N LEU 192.A O no hydrogen 3.011 N/A TYR 177.A N VAL 156.A O no hydrogen 3.003 N/A TYR 178.A N HIS 188.A O no hydrogen 3.169 N/A TYR 178.A OH ILE 238.A O no hydrogen 2.898 N/A ASN 179.A N ASN 154.A O no hydrogen 2.878 N/A GLY 184.A N TYR 440.A OH no hydrogen 3.178 N/A HIS 188.A N PHE 185.A O no hydrogen 3.147 N/A HIS 188.A NE2 SER 246.A O no hydrogen 2.429 N/A VAL 190.A N LEU 176.A O no hydrogen 3.099 N/A GLY 191.A N HIS 189.A ND1 no hydrogen 2.829 N/A GLU 193.A N PHE 212.A O no hydrogen 2.927 N/A LEU 194.A N PHE 174.A O no hydrogen 2.933 N/A LEU 195.A N LYS 210.A O no hydrogen 3.039 N/A VAL 196.A N THR 172.A O no hydrogen 2.942 N/A ASN 197.A N THR 207.A O no hydrogen 3.068 N/A HIS 198.A N ARG 170.A O no hydrogen 2.790 N/A HIS 198.A NE2 THR 172.A OG1 no hydrogen 2.892 N/A LYS 199.A N ASN 197.A OD1 no hydrogen 3.107 N/A LYS 199.A NZ GLY 168.A O no hydrogen 2.832 N/A ALA 204.A N ASP 202.A OD1 no hydrogen 3.288 N/A ARG 205.A N ASP 202.A O no hydrogen 2.780 N/A TRP 206.A N PRO 203.A O no hydrogen 3.130 N/A TRP 206.A NE1 ALA 200.A O no hydrogen 2.859 N/A GLN 209.A N LEU 195.A O no hydrogen 2.932 N/A LYS 210.A NZ ASP 219.A OD1 no hydrogen 3.391 N/A VAL 211.A N TYR 218.A O no hydrogen 2.993 N/A TYR 213.A N ARG 216.A O no hydrogen 2.785 N/A GLN 214.A N GLY 191.A O no hydrogen 2.824 N/A GLN 214.A NE2 VAL 236.A O no hydrogen 2.806 N/A ARG 216.A N TYR 213.A O no hydrogen 2.583 N/A ARG 216.A NH1 GLN 227.A OE1 no hydrogen 3.399 N/A ARG 216.A NH2 GLN 227.A OE1 no hydrogen 3.434 N/A TYR 218.A N VAL 211.A O no hydrogen 3.146 N/A ASP 219.A N GLN 223.A OE1 no hydrogen 3.267 N/A GLN 223.A N SER 220.A OG no hydrogen 3.255 N/A LEU 224.A N SER 220.A O no hydrogen 3.449 N/A GLU 225.A N LEU 221.A O no hydrogen 3.161 N/A ALA 226.A N ALA 222.A O no hydrogen 2.875 N/A GLN 227.A N GLN 223.A O no hydrogen 3.037 N/A PHE 228.A N LEU 224.A O no hydrogen 3.047 N/A GLU 229.A N GLU 225.A O no hydrogen 2.724 N/A ALA 230.A N ALA 226.A O no hydrogen 2.754 N/A LEU 232.A N GLN 227.A O no hydrogen 2.817 N/A VAL 236.A N GLN 214.A OE1 no hydrogen 2.685 N/A SER 246.A OG SER 458.A OG no hydrogen 3.131 N/A TRP 247.A N GLY 244.A O no hydrogen 2.701 N/A SER 248.A N GLY 244.A O no hydrogen 2.690 N/A SER 248.A OG LYS 250.A O no hydrogen 3.290 N/A LYS 250.A N SER 248.A OG no hydrogen 3.009 N/A VAL 253.A N SER 251.A OG no hydrogen 3.209 N/A GLN 262.A NE2 GLN 381.A OE1 no hydrogen 2.793 N/A TYR 264.A OH GLU 380.A O no hydrogen 3.309 N/A GLY 267.A N TYR 264.A O no hydrogen 3.113 N/A ARG 269.A NE GLU 380.A OE1 no hydrogen 3.209 N/A ARG 269.A NE GLU 380.A OE2 no hydrogen 3.107 N/A ARG 269.A NH1 ASP 667.A OD1 no hydrogen 3.219 N/A ARG 269.A NH1 ASP 667.A OD2 no hydrogen 3.125 N/A ARG 269.A NH2 GLU 380.A OE2 no hydrogen 2.810 N/A ARG 269.A NH2 ASP 667.A OD2 no hydrogen 3.048 N/A SER 271.A N ALA 278.A O no hydrogen 2.896 N/A GLN 273.A N ARG 276.A O no hydrogen 2.855 N/A SER 275.A N GLN 5.A OE1 no hydrogen 3.122 N/A SER 275.A OG GLN 5.A OE1 no hydrogen 3.399 N/A ARG 276.A N GLN 273.A O no hydrogen 3.240 N/A ARG 276.A NH1 ASP 298.A OD2 no hydrogen 3.362 N/A ARG 276.A NH2 ASP 298.A OD2 no hydrogen 2.905 N/A VAL 277.A N PHE 284.A O no hydrogen 2.764 N/A ALA 278.A N SER 271.A O no hydrogen 3.033 N/A SER 279.A N TRP 282.A O no hydrogen 2.737 N/A SER 279.A OG TRP 282.A O no hydrogen 2.892 N/A TRP 282.A N SER 279.A OG no hydrogen 2.758 N/A PHE 284.A N VAL 277.A O no hydrogen 2.955 N/A SER 285.A N PHE 297.A O no hydrogen 2.916 N/A PHE 286.A N SER 275.A O no hydrogen 2.861 N/A GLY 287.A N ARG 295.A O no hydrogen 2.748 N/A GLY 289.A N GLY 293.A O no hydrogen 3.216 N/A ALA 290.A N GLU 47.A OE1 no hydrogen 3.053 N/A SER 292.A OG GLY 293.A O no hydrogen 2.873 N/A SER 292.A OG LEU 312.A O no hydrogen 2.980 N/A GLY 293.A N GLY 289.A O no hydrogen 3.163 N/A ARG 295.A NH2 ASP 9.A OD1 no hydrogen 2.981 N/A ILE 296.A N ILE 310.A O no hydrogen 2.884 N/A PHE 297.A N SER 285.A O no hydrogen 2.784 N/A ASP 298.A N TYR 308.A O no hydrogen 2.832 N/A VAL 299.A N VAL 307.A O no hydrogen 3.051 N/A ARG 300.A N THR 283.A O no hydrogen 2.820 N/A ARG 300.A NE ASP 298.A OD1 no hydrogen 2.697 N/A ARG 300.A NH2 ASP 298.A OD1 no hydrogen 3.074 N/A PHE 301.A N GLU 304.A O no hydrogen 2.799 N/A GLN 302.A N LEU 281.A O no hydrogen 2.950 N/A GLU 304.A N PHE 301.A O no hydrogen 2.722 N/A ARG 305.A NE ASP 298.A OD1 no hydrogen 2.921 N/A ARG 305.A NH1 ASP 61.A OD1 no hydrogen 3.326 N/A ARG 305.A NH1 ASP 61.A OD2 no hydrogen 3.066 N/A ARG 305.A NH2 ASP 61.A OD1 no hydrogen 3.178 N/A ARG 305.A NH2 ASP 298.A OD1 no hydrogen 3.089 N/A LEU 306.A N VAL 299.A O no hydrogen 3.065 N/A TYR 308.A N ASP 475.A O no hydrogen 3.004 N/A ILE 310.A N ILE 296.A O no hydrogen 2.932 N/A SER 311.A N LYS 473.A O no hydrogen 3.026 N/A SER 311.A OG GLU 309.A OE2 no hydrogen 2.738 N/A LEU 312.A N PRO 294.A O no hydrogen 3.107 N/A GLN 313.A N HIS 471.A O no hydrogen 2.861 N/A GLN 313.A NE2 SER 311.A O no hydrogen 3.255 N/A ALA 315.A N GLU 314.A OE1 no hydrogen 2.809 N/A LEU 316.A N SER 469.A O no hydrogen 2.795 N/A ALA 317.A N TYR 331.A O no hydrogen 3.003 N/A ILE 318.A N THR 467.A O no hydrogen 3.017 N/A TYR 319.A N THR 329.A O no hydrogen 3.094 N/A GLY 320.A N VAL 465.A O no hydrogen 2.822 N/A ALA 325.A N GLU 193.A OE1 no hydrogen 2.855 N/A MET 327.A N SER 323.A O no hydrogen 3.182 N/A THR 328.A N ALA 325.A O no hydrogen 3.082 N/A THR 329.A N ALA 326.A O no hydrogen 3.256 N/A THR 329.A OG1 ALA 325.A O no hydrogen 2.687 N/A ARG 330.A NH2 TYR 319.A O no hydrogen 2.646 N/A TYR 331.A N ALA 317.A O no hydrogen 2.879 N/A TYR 331.A OH THR 159.A O no hydrogen 2.557 N/A VAL 332.A N GLN 596.A OE1 no hydrogen 3.101 N/A ASP 333.A N ALA 315.A O no hydrogen 3.033 N/A GLY 334.A N GLU 314.A OE1 no hydrogen 2.706 N/A GLY 335.A N VAL 332.A O no hydrogen 2.885 N/A PHE 336.A N ASP 333.A O no hydrogen 3.135 N/A GLY 337.A N ASP 333.A O no hydrogen 2.962 N/A MET 338.A N PHE 291.A O no hydrogen 3.195 N/A GLY 339.A N ALA 290.A O no hydrogen 2.803 N/A LYS 340.A N ALA 290.A O no hydrogen 2.827 N/A LYS 340.A NZ GLU 365.A OE1 no hydrogen 3.101 N/A TYR 341.A N GLY 337.A O no hydrogen 3.103 N/A THR 342.A N GLY 339.A O no hydrogen 2.774 N/A THR 342.A OG1 MET 338.A O no hydrogen 2.849 N/A THR 342.A OG1 GLY 339.A O no hydrogen 2.604 N/A THR 343.A N MET 412.A O no hydrogen 3.020 N/A THR 343.A OG1 PRO 344.A O no hydrogen 3.548 N/A THR 343.A OG1 MET 412.A O no hydrogen 3.561 N/A LEU 345.A N ASP 374.A O no hydrogen 3.134 N/A THR 346.A N ASP 350.A OD2 no hydrogen 2.703 N/A ARG 347.A NH1 TYR 353.A O no hydrogen 2.811 N/A GLY 348.A N CYS 351.A O no hydrogen 3.070 N/A VAL 349.A N THR 346.A O no hydrogen 3.065 N/A ASP 350.A N THR 346.A O no hydrogen 3.051 N/A TYR 353.A OH PRO 699.A O no hydrogen 2.873 N/A ALA 355.A N PRO 352.A O no hydrogen 3.078 N/A THR 356.A N VAL 378.A O no hydrogen 2.978 N/A TYR 357.A OH PRO 352.A O no hydrogen 2.506 N/A TRP 360.A N ILE 372.A O no hydrogen 3.060 N/A HIS 361.A ND1 THR 371.A OG1 no hydrogen 2.748 N/A PHE 362.A N LYS 370.A O no hydrogen 2.816 N/A GLU 365.A N PHE 44.A O no hydrogen 2.849 N/A SER 366.A OG ALA 368.A O no hydrogen 2.956 N/A ALA 368.A N SER 366.A OG no hydrogen 3.016 N/A LYS 370.A N PHE 362.A O no hydrogen 2.812 N/A THR 371.A OG1 HIS 361.A ND1 no hydrogen 2.748 N/A ILE 372.A N TRP 360.A O no hydrogen 2.813 N/A ASP 374.A N ASP 359.A OD1 no hydrogen 2.842 N/A PHE 376.A N VAL 358.A O no hydrogen 3.123 N/A CYS 377.A N ARG 410.A O no hydrogen 3.088 N/A VAL 378.A N THR 356.A O no hydrogen 2.916 N/A PHE 379.A N VAL 408.A O no hydrogen 3.068 N/A GLU 380.A N TYR 264.A OH no hydrogen 3.166 N/A GLN 381.A N VAL 406.A O no hydrogen 2.859 N/A ASN 382.A N GLN 262.A OE1 no hydrogen 3.270 N/A GLN 383.A N GLU 404.A O no hydrogen 2.900 N/A GLY 384.A N ASN 382.A OD1 no hydrogen 3.005 N/A LEU 387.A N LEU 402.A O no hydrogen 2.787 N/A ARG 388.A NE SER 662.A OG no hydrogen 2.696 N/A ARG 388.A NH2 SER 662.A O no hydrogen 2.998 N/A HIS 390.A N GLY 400.A O no hydrogen 3.120 N/A SER 392.A N TYR 398.A O no hydrogen 2.971 N/A SER 392.A OG SER 396.A O no hydrogen 2.598 N/A HIS 397.A N SER 392.A O no hydrogen 2.862 N/A PHE 399.A N PHE 671.A O no hydrogen 2.894 N/A GLY 400.A N HIS 390.A O no hydrogen 3.113 N/A GLY 401.A N ILE 669.A O no hydrogen 2.968 N/A LEU 402.A N ARG 388.A O no hydrogen 3.007 N/A GLU 404.A N LEU 385.A O no hydrogen 2.961 N/A VAL 406.A N GLN 381.A O no hydrogen 2.819 N/A LEU 407.A N PHE 425.A O no hydrogen 3.152 N/A VAL 408.A N PHE 379.A O no hydrogen 2.712 N/A VAL 409.A N THR 423.A O no hydrogen 3.032 N/A ARG 410.A N CYS 377.A O no hydrogen 2.996 N/A ARG 410.A NE ASP 422.A OD1 no hydrogen 2.530 N/A ARG 410.A NE ASP 422.A OD2 no hydrogen 3.452 N/A ARG 410.A NH1 ASP 350.A O no hydrogen 2.846 N/A ARG 410.A NH2 ASP 422.A OD2 no hydrogen 2.875 N/A SER 411.A N TRP 421.A O no hydrogen 3.222 N/A SER 413.A OG MET 338.A O no hydrogen 2.486 N/A THR 414.A N TYR 341.A O no hydrogen 3.022 N/A THR 414.A OG1 ASP 418.A OD2 no hydrogen 2.602 N/A TYR 419.A N SER 413.A O no hydrogen 2.974 N/A TYR 419.A OH ASP 333.A OD2 no hydrogen 2.561 N/A VAL 420.A N TYR 436.A O no hydrogen 2.944 N/A TRP 421.A N SER 411.A O no hydrogen 2.899 N/A TRP 421.A NE1 SER 413.A OG no hydrogen 3.219 N/A ASP 422.A N ARG 434.A O no hydrogen 3.012 N/A THR 423.A N VAL 409.A O no hydrogen 3.052 N/A VAL 424.A N GLU 432.A O no hydrogen 2.745 N/A PHE 425.A N LEU 407.A O no hydrogen 2.868 N/A HIS 426.A N ALA 430.A O no hydrogen 2.788 N/A HIS 426.A ND1 GLU 404.A OE2 no hydrogen 2.359 N/A HIS 426.A NE2 GLU 432.A OE1 no hydrogen 2.666 N/A GLY 429.A N HIS 426.A O no hydrogen 2.820 N/A ILE 431.A N LEU 651.A O no hydrogen 2.984 N/A GLU 432.A N VAL 424.A O no hydrogen 2.871 N/A ILE 433.A N PHE 649.A O no hydrogen 2.954 N/A ARG 434.A N ASP 422.A O no hydrogen 3.231 N/A ARG 434.A NE GLU 432.A OE2 no hydrogen 3.194 N/A TYR 436.A N VAL 420.A O no hydrogen 3.023 N/A THR 438.A N ASP 418.A O no hydrogen 2.937 N/A THR 438.A OG1 ASP 418.A O no hydrogen 3.444 N/A TYR 440.A N ASN 417.A O no hydrogen 2.934 N/A SER 443.A OG PHE 186.A O no hydrogen 2.469 N/A ALA 444.A N LEU 462.A O no hydrogen 3.103 N/A LEU 446.A N HIS 460.A O no hydrogen 2.405 N/A LYS 452.A N ALA 449.A O no hydrogen 3.327 N/A TYR 453.A N THR 450.A O no hydrogen 2.583 N/A ASN 455.A N GLY 463.A O no hydrogen 3.281 N/A GLN 456.A NE2 SER 458.A O no hydrogen 3.331 N/A VAL 457.A N THR 461.A O no hydrogen 3.026 N/A SER 458.A OG SER 246.A OG no hydrogen 3.131 N/A SER 458.A OG GLU 459.A OE2 no hydrogen 3.363 N/A THR 461.A N SER 458.A O no hydrogen 3.121 N/A THR 461.A OG1 LEU 187.A O no hydrogen 3.129 N/A THR 461.A OG1 GLU 459.A O no hydrogen 2.932 N/A LEU 462.A N ALA 444.A O no hydrogen 2.906 N/A GLY 463.A N ASN 455.A O no hydrogen 2.682 N/A THR 464.A OG1 SER 442.A O no hydrogen 3.107 N/A VAL 465.A N TYR 453.A O no hydrogen 3.242 N/A HIS 466.A N HIS 630.A O no hydrogen 3.010 N/A HIS 466.A ND1 THR 464.A O no hydrogen 3.129 N/A HIS 466.A NE2 HIS 468.A NE2 no hydrogen 3.090 N/A THR 467.A N ILE 318.A O no hydrogen 2.820 N/A HIS 468.A N PHE 628.A O no hydrogen 3.002 N/A SER 469.A N LEU 316.A O no hydrogen 3.123 N/A ALA 470.A N ALA 626.A O no hydrogen 2.774 N/A HIS 471.A N GLU 314.A O no hydrogen 3.029 N/A HIS 471.A ND1 SER 590.A OG no hydrogen 2.387 N/A PHE 472.A N VAL 624.A O no hydrogen 2.880 N/A LYS 473.A N SER 311.A O no hydrogen 2.954 N/A LYS 473.A NZ GLU 309.A OE1 no hydrogen 2.858 N/A LYS 473.A NZ GLU 309.A OE2 no hydrogen 3.473 N/A LYS 473.A NZ PRO 588.A O no hydrogen 2.797 N/A VAL 474.A N ALA 622.A O no hydrogen 2.757 N/A ASP 475.A N GLU 309.A O no hydrogen 2.895 N/A ASP 477.A N LEU 306.A O no hydrogen 2.861 N/A VAL 478.A N ASN 483.A OD1 no hydrogen 3.143 N/A ASN 483.A N LYS 618.A O no hydrogen 2.694 N/A TRP 486.A N TYR 534.A O no hydrogen 2.847 N/A ALA 487.A N LYS 513.A O no hydrogen 2.793 N/A GLU 488.A N TYR 532.A O no hydrogen 2.725 N/A ASP 489.A N THR 511.A O no hydrogen 2.986 N/A MET 490.A N ASP 489.A OD1 no hydrogen 3.009 N/A VAL 491.A N GLN 509.A O no hydrogen 2.834 N/A VAL 493.A N ARG 507.A O no hydrogen 2.941 N/A MET 495.A N LEU 505.A O no hydrogen 2.928 N/A VAL 497.A N HIS 503.A O no hydrogen 3.074 N/A SER 500.A N VAL 497.A O no hydrogen 3.087 N/A SER 500.A OG HIS 503.A ND1 no hydrogen 3.116 N/A HIS 503.A N SER 500.A O no hydrogen 2.887 N/A HIS 503.A ND1 SER 500.A OG no hydrogen 3.116 N/A LEU 505.A N MET 495.A O no hydrogen 2.722 N/A ARG 507.A N VAL 493.A O no hydrogen 2.827 N/A GLN 509.A N VAL 491.A O no hydrogen 2.775 N/A THR 511.A N ASP 489.A O no hydrogen 2.809 N/A THR 511.A OG1 ASP 489.A O no hydrogen 3.555 N/A ARG 512.A NH1 GLU 488.A OE2 no hydrogen 3.103 N/A LYS 513.A N ALA 487.A O no hydrogen 2.889 N/A LEU 515.A N VAL 485.A O no hydrogen 2.960 N/A GLU 518.A N GLU 613.A O no hydrogen 2.949 N/A ALA 521.A N GLU 518.A O no hydrogen 3.066 N/A ALA 522.A N GLU 519.A O no hydrogen 3.047 N/A PHE 523.A N LEU 578.A O no hydrogen 2.775 N/A VAL 525.A N ARG 575.A O no hydrogen 2.877 N/A ARG 531.A N ASP 489.A OD2 no hydrogen 3.285 N/A ARG 531.A NE ASP 489.A OD1 no hydrogen 2.787 N/A TYR 532.A N GLU 488.A O no hydrogen 2.927 N/A TYR 534.A N TRP 486.A O no hydrogen 3.121 N/A TYR 534.A OH GLU 488.A OE2 no hydrogen 2.713 N/A LEU 535.A N TYR 549.A O no hydrogen 3.140 N/A ALA 536.A N TRP 484.A O no hydrogen 2.781 N/A SER 537.A N ARG 547.A O no hydrogen 2.805 N/A HIS 539.A N SER 537.A OG no hydrogen 2.824 N/A SER 540.A OG ASN 541.A O no hydrogen 2.880 N/A ASN 541.A N HIS 545.A O no hydrogen 2.900 N/A ASN 541.A ND2 PHE 657.A O no hydrogen 3.099 N/A LYS 542.A N ASP 658.A OD1 no hydrogen 2.946 N/A GLY 544.A N ASN 541.A O no hydrogen 3.008 N/A HIS 545.A N ASN 541.A OD1 no hydrogen 3.036 N/A ARG 547.A N HIS 539.A O no hydrogen 3.309 N/A ARG 547.A NE PHE 656.A O no hydrogen 2.860 N/A ARG 547.A NH1 GLU 304.A OE2 no hydrogen 3.559 N/A ARG 547.A NH2 GLU 304.A OE1 no hydrogen 3.506 N/A ARG 547.A NH2 PHE 656.A O no hydrogen 3.185 N/A GLY 548.A N TYR 654.A O no hydrogen 3.028 N/A TYR 549.A N LEU 535.A O no hydrogen 2.915 N/A TYR 549.A OH GLY 429.A O no hydrogen 2.600 N/A ARG 550.A N ARG 652.A O no hydrogen 2.466 N/A ARG 550.A NE ARG 531.A O no hydrogen 3.446 N/A ILE 551.A N LEU 533.A O no hydrogen 2.934 N/A GLN 552.A N PHE 650.A O no hydrogen 3.050 N/A LEU 554.A N GLY 648.A O no hydrogen 3.025 N/A PHE 556.A N GLY 627.A O no hydrogen 3.088 N/A ALA 557.A N SER 555.A OG no hydrogen 3.255 N/A LEU 561.A N GLU 574.A OE1 no hydrogen 3.121 N/A SER 565.A N PRO 562.A O no hydrogen 2.916 N/A ALA 568.A N SER 565.A O no hydrogen 2.988 N/A GLY 570.A N MET 567.A O no hydrogen 3.322 N/A PHE 571.A N ALA 568.A O no hydrogen 2.990 N/A SER 572.A OG ARG 569.A O no hydrogen 3.529 N/A SER 572.A OG ASP 605.A OD1 no hydrogen 2.921 N/A GLU 574.A N PHE 571.A O no hydrogen 2.856 N/A ARG 575.A N SER 572.A O no hydrogen 3.278 N/A TYR 576.A N TRP 573.A O no hydrogen 3.275 N/A GLN 577.A N PHE 523.A O no hydrogen 2.686 N/A GLN 577.A NE2 LEU 524.A O no hydrogen 2.968 N/A GLN 577.A NE2 SER 527.A O no hydrogen 3.188 N/A ALA 579.A N TRP 623.A O no hydrogen 3.061 N/A THR 581.A N VAL 621.A O no hydrogen 2.884 N/A THR 581.A OG1 GLU 518.A OE2 no hydrogen 3.244 N/A THR 581.A OG1 PHE 609.A O no hydrogen 3.176 N/A GLN 582.A N GLU 518.A OE2 no hydrogen 3.042 N/A GLN 582.A NE2 THR 614.A O no hydrogen 3.006 N/A ARG 583.A N ASP 619.A O no hydrogen 2.909 N/A LYS 584.A NZ GLU 613.A OE1 no hydrogen 3.456 N/A LYS 584.A NZ GLU 613.A OE2 no hydrogen 2.956 N/A GLU 587.A N LYS 584.A O no hydrogen 3.246 N/A SER 590.A N GLN 313.A OE1 no hydrogen 3.142 N/A SER 590.A OG HIS 471.A ND1 no hydrogen 2.387 N/A SER 591.A OG GLU 314.A OE2 no hydrogen 2.319 N/A PHE 594.A N SER 592.A OG no hydrogen 3.288 N/A ASN 595.A N SER 592.A O no hydrogen 2.787 N/A ASN 595.A ND2 GLY 570.A O no hydrogen 3.290 N/A ASN 595.A ND2 VAL 604.A O no hydrogen 2.931 N/A ASN 597.A ND2 ARG 116.A O no hydrogen 2.971 N/A ASP 598.A N ASN 595.A O no hydrogen 3.168 N/A ALA 601.A N ASP 598.A O no hydrogen 3.353 N/A THR 603.A N ASN 595.A OD1 no hydrogen 2.831 N/A VAL 604.A N ASN 595.A OD1 no hydrogen 3.131 N/A SER 607.A N ASP 605.A OD1 no hydrogen 3.421 N/A SER 607.A OG ASP 605.A OD1 no hydrogen 3.030 N/A ASP 608.A N ASP 605.A O no hydrogen 2.822 N/A PHE 609.A N PHE 606.A O no hydrogen 3.177 N/A ILE 610.A N SER 607.A O no hydrogen 3.266 N/A ASN 611.A N GLU 518.A OE1 no hydrogen 3.286 N/A ASN 612.A N GLU 519.A OE1 no hydrogen 3.283 N/A ASN 612.A ND2 ASN 612.A O no hydrogen 2.150 N/A THR 614.A OG1 GLU 516.A O no hydrogen 3.488 N/A ILE 615.A N GLU 516.A O no hydrogen 3.066 N/A ALA 616.A N THR 614.A OG1 no hydrogen 2.854 N/A VAL 621.A N THR 581.A O no hydrogen 2.729 N/A ALA 622.A N VAL 474.A O no hydrogen 2.901 N/A TRP 623.A N ALA 579.A O no hydrogen 2.909 N/A VAL 624.A N PHE 472.A O no hydrogen 3.023 N/A THR 625.A N GLN 577.A O no hydrogen 2.944 N/A THR 625.A OG1 TRP 573.A O no hydrogen 2.864 N/A THR 625.A OG1 TYR 576.A O no hydrogen 2.961 N/A ALA 626.A N ALA 470.A O no hydrogen 3.052 N/A PHE 628.A N HIS 468.A O no hydrogen 2.851 N/A HIS 630.A N HIS 466.A O no hydrogen 2.733 N/A HIS 630.A NE2 ASP 636.A OD2 no hydrogen 2.571 N/A HIS 633.A N ASP 636.A OD2 no hydrogen 3.281 N/A HIS 633.A ND1 GLU 635.A OE1 no hydrogen 2.864 N/A GLU 635.A N GLU 635.A OE1 no hydrogen 2.671 N/A ASP 636.A N HIS 633.A O no hydrogen 2.889 N/A ILE 637.A N ALA 634.A O no hydrogen 3.140 N/A THR 640.A N GLY 439.A O no hydrogen 2.953 N/A ASN 645.A N THR 642.A O no hydrogen 2.821 N/A VAL 647.A N PHE 435.A O no hydrogen 3.228 N/A GLY 648.A N LEU 554.A O no hydrogen 2.867 N/A PHE 649.A N ILE 433.A O no hydrogen 3.082 N/A PHE 650.A N GLN 552.A O no hydrogen 2.784 N/A LEU 651.A N ILE 431.A O no hydrogen 2.793 N/A ARG 652.A N ARG 550.A O no hydrogen 2.646 N/A ARG 652.A NE GLN 552.A OE1 no hydrogen 2.769 N/A ARG 652.A NH2 GLN 552.A OE1 no hydrogen 3.000 N/A TYR 654.A N GLY 548.A O no hydrogen 2.706 N/A TYR 654.A OH GLU 488.A OE1 no hydrogen 2.480 N/A SER 662.A N ASP 660.A OD1 no hydrogen 2.948 N/A SER 662.A OG ASP 660.A OD2 no hydrogen 2.463 N/A PHE 663.A N ASP 660.A O no hydrogen 2.867 N/A TYR 664.A N PRO 661.A O no hydrogen 2.974 N/A TYR 664.A OH GLU 659.A OE2 no hydrogen 2.702 N/A SER 665.A N SER 662.A O no hydrogen 3.154 N/A ASP 667.A N SER 665.A OG no hydrogen 3.382 N/A ILE 669.A N GLY 401.A O no hydrogen 2.695 N/A PHE 671.A N PHE 399.A O no hydrogen 3.057 N/A ARG 672.A N GLN 675.A OE1 no hydrogen 3.048 N/A ARG 672.A NE ASP 674.A OD2 no hydrogen 3.230 N/A ARG 672.A NH2 ASP 674.A OD1 no hydrogen 2.581 N/A ARG 672.A NH2 ASP 674.A OD2 no hydrogen 3.503 N/A GLY 673.A N HIS 397.A O no hydrogen 2.505 N/A GLN 675.A N ARG 672.A O no hydrogen 3.214 N/A GLY 678.A N ASP 676.A OD1 no hydrogen 2.806 N/A GLU 681.A N GLU 681.A OE1 no hydrogen 2.764 N/A VAL 682.A N ALA 679.A O no hydrogen 3.149 N/A ASN 683.A N ALA 679.A O no hydrogen 2.961 N/A ASN 683.A N CYS 680.A O no hydrogen 3.359 N/A ASN 683.A ND2 ALA 677.A O no hydrogen 2.733 N/A LEU 685.A N ASN 683.A OD1 no hydrogen 3.302 N/A ALA 686.A N ASN 683.A O no hydrogen 2.967 N/A CYS 687.A N PRO 684.A O no hydrogen 2.926 N/A CYS 687.A SG CYS 680.A O no hydrogen 3.911 N/A CYS 687.A SG PRO 684.A O no hydrogen 3.232 N/A LEU 688.A N LEU 685.A O no hydrogen 3.287 N/A GLN 690.A N GLN 690.A OE1 no hydrogen 2.689 N/A ALA 692.A N LEU 688.A O no hydrogen 3.075 N/A GLY 705.A N HIS 703.A ND1 no hydrogen 2.987 N/A