Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lf7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A OG1 ASP 600.A OD1 no hydrogen 2.446 N/A THR 5.A OG1 ASP 600.A OD2 no hydrogen 3.038 N/A THR 6.A N ASP 4.A OD1 no hydrogen 2.859 N/A THR 6.A OG1 ASP 4.A OD1 no hydrogen 2.415 N/A ALA 7.A N ASP 4.A O no hydrogen 3.207 N/A SER 14.A N ASN 12.A OD1 no hydrogen 3.117 N/A THR 15.A N ASN 12.A O no hydrogen 3.277 N/A THR 15.A OG1 ASN 12.A O no hydrogen 2.862 N/A LEU 16.A N LEU 13.A O no hydrogen 3.180 N/A ASN 19.A N ALA 393.A O no hydrogen 2.912 N/A THR 20.A N PRO 17.A O no hydrogen 3.255 N/A THR 20.A OG1 PRO 17.A O no hydrogen 2.641 N/A LEU 21.A N GLN 394.A O no hydrogen 2.744 N/A PHE 22.A N ASN 19.A O no hydrogen 3.119 N/A TRP 25.A NE1 SER 597.A O no hydrogen 2.972 N/A ARG 26.A NH2 PRO 33.A O no hydrogen 2.794 N/A ARG 28.A N ASP 577.A OD1 no hydrogen 2.910 N/A ARG 28.A N ASP 577.A OD2 no hydrogen 3.186 N/A ARG 28.A NH1 GLY 625.A O no hydrogen 2.743 N/A ALA 29.A N ASP 577.A OD2 no hydrogen 2.752 N/A HIS 30.A ND1 ASP 577.A OD2 no hydrogen 2.829 N/A HIS 30.A NE2 GLU 582.A OE2 no hydrogen 2.486 N/A GLY 36.A N GLY 396.A O no hydrogen 3.039 N/A GLN 37.A N ASP 60.A OD1 no hydrogen 2.854 N/A ILE 38.A N THR 398.A O no hydrogen 2.968 N/A GLY 39.A N LEU 58.A O no hydrogen 2.903 N/A CYS 42.A N GLY 56.A O no hydrogen 2.830 N/A CYS 42.A SG PRO 41.A O no hydrogen 2.300 N/A ALA 43.A N GLY 100.A O no hydrogen 2.752 N/A HIS 44.A NE2 ALA 352.A O no hydrogen 2.866 N/A TYR 45.A N HIS 54.A O no hydrogen 3.038 N/A ASP 47.A N LEU 52.A O no hydrogen 2.957 N/A SER 49.A N ASP 47.A OD2 no hydrogen 2.914 N/A GLY 51.A N ASP 47.A O no hydrogen 2.651 N/A LEU 52.A N THR 50.A OG1 no hydrogen 3.286 N/A PHE 53.A N THR 69.A O no hydrogen 3.096 N/A HIS 54.A N TYR 45.A O no hydrogen 2.709 N/A VAL 55.A N ALA 67.A O no hydrogen 2.851 N/A GLY 56.A N HIS 44.A ND1 no hydrogen 3.126 N/A PHE 57.A N ALA 65.A O no hydrogen 3.073 N/A LEU 58.A N ASP 40.A O no hydrogen 2.895 N/A HIS 59.A N GLY 63.A O no hydrogen 2.959 N/A HIS 59.A ND1 GLN 37.A O no hydrogen 2.629 N/A ASP 60.A N GLN 37.A O no hydrogen 2.922 N/A ASP 62.A N HIS 59.A O no hydrogen 3.039 N/A ILE 64.A N ILE 86.A O no hydrogen 2.962 N/A ALA 65.A N PHE 57.A O no hydrogen 2.766 N/A GLY 66.A N SER 83.A O no hydrogen 2.869 N/A ALA 67.A N VAL 55.A O no hydrogen 3.018 N/A THR 68.A N THR 76.A O no hydrogen 2.893 N/A THR 69.A N PHE 53.A O no hydrogen 3.106 N/A THR 69.A OG1 THR 74.A O no hydrogen 2.675 N/A ASN 71.A N THR 69.A OG1 no hydrogen 3.220 N/A ASN 71.A ND2 THR 74.A OG1 no hydrogen 3.257 N/A LEU 72.A N THR 69.A OG1 no hydrogen 2.766 N/A ALA 73.A N ASN 71.A OD1 no hydrogen 2.669 N/A THR 74.A N ASN 71.A OD1 no hydrogen 2.941 N/A THR 74.A OG1 ASN 71.A OD1 no hydrogen 3.563 N/A TYR 75.A N ALA 629.A O no hydrogen 2.826 N/A THR 76.A N THR 68.A O no hydrogen 2.871 N/A THR 76.A OG1 GLU 632.A OE1 no hydrogen 2.836 N/A THR 78.A N GLY 66.A O no hydrogen 3.244 N/A THR 78.A OG1 GLY 66.A O no hydrogen 3.169 N/A THR 78.A OG1 SER 83.A OG no hydrogen 2.696 N/A SER 79.A N SER 83.A OG no hydrogen 3.058 N/A SER 79.A OG ASP 80.A O no hydrogen 3.393 N/A SER 83.A N ASP 80.A O no hydrogen 3.251 N/A SER 83.A OG GLY 66.A O no hydrogen 2.888 N/A SER 83.A OG THR 78.A OG1 no hydrogen 2.696 N/A SER 83.A OG SER 79.A O no hydrogen 3.160 N/A LEU 85.A N ILE 64.A O no hydrogen 2.590 N/A ILE 86.A N ILE 64.A O no hydrogen 3.336 N/A GLN 87.A NE2 ASP 62.A O no hydrogen 3.228 N/A GLY 89.A N ASP 93.A O no hydrogen 2.837 N/A GLY 90.A N ASP 93.A OD1 no hydrogen 2.823 N/A ASN 92.A ND2 SER 137.A OG no hydrogen 3.201 N/A ASN 92.A ND2 GLN 153.A O no hydrogen 2.838 N/A VAL 95.A N VAL 118.A O no hydrogen 3.017 N/A ALA 96.A N VAL 118.A O no hydrogen 3.233 N/A PHE 98.A N THR 116.A O no hydrogen 2.878 N/A ALA 101.A N LEU 114.A O no hydrogen 2.982 N/A ILE 103.A N THR 112.A O no hydrogen 2.824 N/A GLY 106.A N THR 110.A O no hydrogen 2.834 N/A VAL 107.A N THR 112.A OG1 no hydrogen 2.726 N/A ASN 109.A N GLY 106.A O no hydrogen 3.098 N/A THR 110.A N VAL 107.A O no hydrogen 2.977 N/A THR 110.A OG1 VAL 107.A O no hydrogen 2.834 N/A THR 112.A N ILE 103.A O no hydrogen 2.768 N/A THR 112.A OG1 THR 110.A O no hydrogen 2.978 N/A LEU 113.A N ALA 139.A O no hydrogen 2.726 N/A LEU 114.A N ALA 101.A O no hydrogen 2.889 N/A TYR 115.A N SER 137.A O no hydrogen 3.041 N/A TYR 115.A OH ASP 93.A OD2 no hydrogen 2.583 N/A THR 116.A N ASP 99.A O no hydrogen 3.069 N/A SER 117.A N THR 135.A O no hydrogen 2.709 N/A SER 117.A OG THR 135.A O no hydrogen 3.047 N/A SER 117.A OG THR 135.A OG1 no hydrogen 2.603 N/A SER 117.A OG SER 137.A OG no hydrogen 2.806 N/A VAL 118.A N ALA 96.A O no hydrogen 2.946 N/A SER 119.A N SER 133.A O no hydrogen 2.970 N/A SER 119.A OG ASN 92.A O no hydrogen 3.099 N/A TRP 125.A NE1 SER 309.A OG no hydrogen 2.845 N/A SER 126.A N HIS 124.A ND1 no hydrogen 3.051 N/A SER 126.A OG HIS 124.A ND1 no hydrogen 2.624 N/A ILE 127.A N HIS 124.A O no hydrogen 3.324 N/A TYR 129.A OH GLU 134.A OE1 no hydrogen 2.705 N/A ARG 131.A NE ASP 159.A OD1 no hydrogen 3.141 N/A ARG 131.A NE ASP 159.A OD2 no hydrogen 3.352 N/A ARG 131.A NH2 ASP 159.A OD2 no hydrogen 2.867 N/A SER 133.A N THR 130.A O no hydrogen 3.011 N/A SER 133.A OG THR 130.A O no hydrogen 2.500 N/A THR 135.A N SER 117.A O no hydrogen 3.031 N/A THR 135.A OG1 SER 117.A O no hydrogen 3.298 N/A THR 135.A OG1 SER 117.A OG no hydrogen 2.603 N/A GLN 136.A N ILE 157.A O no hydrogen 3.000 N/A GLN 136.A NE2 THR 116.A OG1 no hydrogen 2.785 N/A SER 137.A N TYR 115.A O no hydrogen 2.790 N/A SER 137.A OG SER 117.A OG no hydrogen 2.806 N/A ALA 139.A N LEU 113.A O no hydrogen 2.973 N/A VAL 140.A N ASP 149.A O no hydrogen 2.715 N/A ALA 141.A N PRO 111.A O no hydrogen 2.947 N/A ARG 142.A N ARG 147.A O no hydrogen 2.837 N/A ARG 142.A NH1 ASP 149.A OD2 no hydrogen 2.714 N/A GLY 145.A N ARG 142.A O no hydrogen 2.961 N/A ARG 146.A N ASP 143.A O no hydrogen 3.144 N/A ARG 146.A NH1 ASP 143.A O no hydrogen 3.142 N/A ARG 147.A NH2 ASP 149.A OD2 no hydrogen 3.121 N/A PHE 148.A N LEU 85.A O no hydrogen 2.960 N/A ASP 149.A N VAL 140.A O no hydrogen 2.863 N/A LYS 150.A NZ GLN 87.A O no hydrogen 2.791 N/A LYS 150.A NZ ASP 93.A OD1 no hydrogen 2.928 N/A LYS 150.A NZ ASP 93.A OD2 no hydrogen 3.110 N/A LEU 151.A N LEU 138.A O no hydrogen 3.074 N/A GLN 153.A N LEU 151.A O no hydrogen 2.969 N/A VAL 156.A N GLN 136.A O no hydrogen 2.919 N/A ILE 157.A N GLN 136.A O no hydrogen 3.374 N/A HIS 160.A N ASP 159.A OD1 no hydrogen 2.808 N/A HIS 160.A ND1 PRO 161.A O no hydrogen 2.882 N/A VAL 164.A N PRO 161.A O no hydrogen 3.058 N/A VAL 166.A N VAL 164.A O no hydrogen 2.931 N/A THR 167.A N GLY 218.A O no hydrogen 2.966 N/A THR 167.A OG1 ASN 270.A OD1 no hydrogen 2.879 N/A PHE 169.A N GLU 134.A OE1 no hydrogen 2.691 N/A ARG 170.A N SER 216.A O no hydrogen 3.070 N/A ARG 170.A NH1 GLU 134.A OE2 no hydrogen 2.912 N/A ARG 170.A NH2 GLU 272.A OE2 no hydrogen 2.950 N/A ASP 171.A N THR 116.A OG1 no hydrogen 3.003 N/A PHE 173.A N ALA 214.A O no hydrogen 3.035 N/A PHE 175.A N TYR 212.A O no hydrogen 3.133 N/A ARG 176.A NE ALA 209.A O no hydrogen 3.141 N/A ARG 176.A NH2 ALA 209.A O no hydrogen 3.547 N/A ALA 178.A N PRO 286.A O no hydrogen 3.047 N/A ARG 179.A NE GLU 320.A OE1 no hydrogen 3.368 N/A ARG 179.A NE VAL 321.A O no hydrogen 2.811 N/A LEU 180.A N SER 177.A OG no hydrogen 3.143 N/A ASP 181.A N SER 177.A O no hydrogen 3.165 N/A VAL 182.A N ALA 178.A O no hydrogen 2.869 N/A LEU 183.A N ARG 179.A O no hydrogen 2.947 N/A LEU 184.A N LEU 180.A O no hydrogen 2.984 N/A SER 185.A N ASP 181.A O no hydrogen 2.999 N/A SER 185.A N VAL 182.A O no hydrogen 3.145 N/A SER 185.A OG ASP 181.A O no hydrogen 2.978 N/A SER 185.A OG VAL 182.A O no hydrogen 3.045 N/A LEU 186.A N VAL 182.A O no hydrogen 3.031 N/A ALA 191.A N ASP 187.A O no hydrogen 3.054 N/A ARG 192.A N GLU 189.A O no hydrogen 3.168 N/A ARG 192.A NH1 GLY 324.A O no hydrogen 3.553 N/A VAL 197.A N ASN 193.A O no hydrogen 3.491 N/A GLN 198.A N GLU 194.A O no hydrogen 2.903 N/A GLN 198.A NE2 ASP 202.A OD2 no hydrogen 3.231 N/A GLN 199.A N THR 195.A O no hydrogen 3.348 N/A GLN 199.A N ALA 196.A O no hydrogen 3.157 N/A ALA 200.A N VAL 197.A O no hydrogen 3.016 N/A VAL 201.A N VAL 197.A O no hydrogen 3.167 N/A ASP 202.A N GLN 198.A O no hydrogen 3.181 N/A GLY 203.A N ALA 200.A O no hydrogen 3.087 N/A TRP 204.A N VAL 201.A O no hydrogen 3.115 N/A TRP 204.A NE1 ASP 181.A OD2 no hydrogen 2.645 N/A ALA 209.A N GLU 206.A O no hydrogen 2.837 N/A TRP 211.A N GLN 231.A OE1 no hydrogen 2.894 N/A TYR 212.A N PHE 175.A O no hydrogen 2.750 N/A TYR 212.A OH ASP 181.A OD1 no hydrogen 2.656 N/A VAL 213.A N TYR 229.A O no hydrogen 2.703 N/A ALA 214.A N PHE 173.A O no hydrogen 3.014 N/A VAL 215.A N PHE 227.A O no hydrogen 2.789 N/A SER 216.A N ARG 170.A O no hydrogen 2.827 N/A GLY 217.A N ALA 225.A O no hydrogen 3.040 N/A VAL 219.A N GLY 223.A O no hydrogen 2.871 N/A HIS 220.A N ASP 165.A O no hydrogen 2.744 N/A VAL 222.A N VAL 219.A O no hydrogen 2.988 N/A GLY 223.A N VAL 219.A O no hydrogen 3.034 N/A ALA 225.A N GLY 217.A O no hydrogen 2.946 N/A GLN 226.A N TRP 249.A O no hydrogen 2.889 N/A PHE 227.A N VAL 215.A O no hydrogen 2.676 N/A LEU 228.A N GLY 246.A O no hydrogen 3.058 N/A TYR 229.A N VAL 213.A O no hydrogen 2.723 N/A ARG 230.A N GLU 243.A O no hydrogen 3.044 N/A ARG 230.A NH1 TYR 212.A OH no hydrogen 3.445 N/A GLN 231.A N TRP 211.A O no hydrogen 3.104 N/A GLN 231.A NE2 ALA 236.A O no hydrogen 2.877 N/A GLN 231.A NE2 GLU 238.A O no hydrogen 2.813 N/A ASN 232.A N TYR 241.A O no hydrogen 2.834 N/A GLY 233.A N GLU 243.A OE1 no hydrogen 2.802 N/A GLY 234.A N GLN 231.A O no hydrogen 2.809 N/A ASN 235.A N ASN 232.A O no hydrogen 3.207 N/A SER 237.A N ASN 235.A OD1 no hydrogen 2.913 N/A SER 237.A OG ASN 235.A OD1 no hydrogen 2.697 N/A GLU 238.A N ASN 235.A O no hydrogen 2.824 N/A GLN 240.A N GLU 238.A OE2 no hydrogen 2.720 N/A TYR 241.A N GLU 238.A OE2 no hydrogen 3.040 N/A TRP 242.A NE1 PHE 239.A O no hydrogen 2.817 N/A LEU 245.A N LEU 228.A O no hydrogen 2.683 N/A TRP 248.A NE1 GLN 226.A OE1 no hydrogen 3.016 N/A TRP 249.A NE1 GLU 251.A OE2 no hydrogen 2.893 N/A GLU 251.A N PRO 224.A O no hydrogen 3.199 N/A THR 253.A N VAL 222.A O no hydrogen 3.085 N/A ASN 254.A N GLY 268.A O no hydrogen 2.779 N/A SER 255.A N ALA 252.A O no hydrogen 3.029 N/A SER 255.A OG ALA 252.A O no hydrogen 2.668 N/A TRP 257.A NE1 VAL 426.A O no hydrogen 2.839 N/A ASP 259.A N GLU 424.A OE1 no hydrogen 3.342 N/A THR 262.A OG1 GLU 260.A O no hydrogen 3.360 N/A TRP 263.A NE1 GLU 423.A OE2 no hydrogen 2.953 N/A ARG 266.A N ASP 313.A OD2 no hydrogen 3.426 N/A ARG 266.A NE ASN 254.A O no hydrogen 3.128 N/A ARG 266.A NE ASN 254.A OD1 no hydrogen 3.390 N/A ARG 266.A NH2 ASN 254.A O no hydrogen 2.894 N/A TRP 267.A N SER 255.A O no hydrogen 2.737 N/A PHE 269.A N GLU 298.A O no hydrogen 2.789 N/A ASN 270.A ND2 GLU 298.A OE1 no hydrogen 2.792 N/A PHE 271.A N GLY 217.A O no hydrogen 2.908 N/A GLU 272.A N GLY 296.A O no hydrogen 2.746 N/A THR 273.A N ASP 171.A OD2 no hydrogen 3.029 N/A GLY 274.A N SER 216.A OG no hydrogen 3.110 N/A ASN 275.A N THR 294.A O no hydrogen 2.956 N/A ASN 275.A ND2 TYR 373.A OH no hydrogen 2.754 N/A LEU 277.A N PHE 292.A O no hydrogen 2.631 N/A PHE 278.A N HIS 284.A NE2 no hydrogen 3.402 N/A LEU 279.A N GLU 290.A O no hydrogen 2.818 N/A THR 280.A N GLY 283.A O no hydrogen 3.060 N/A GLU 282.A N THR 280.A OG1 no hydrogen 3.068 N/A GLY 283.A N THR 280.A OG1 no hydrogen 2.924 N/A HIS 284.A N ASP 371.A O no hydrogen 2.759 N/A ASP 285.A N PHE 278.A O no hydrogen 2.899 N/A GLN 287.A N ASP 285.A OD1 no hydrogen 2.605 N/A GLN 287.A NE2 VAL 201.A O no hydrogen 3.093 N/A THR 288.A N ASP 285.A OD1 no hydrogen 2.847 N/A GLY 289.A N ASP 285.A O no hydrogen 2.745 N/A GLU 290.A N LEU 279.A O no hydrogen 2.566 N/A PHE 292.A N LEU 277.A O no hydrogen 2.788 N/A VAL 293.A N ALA 317.A O no hydrogen 2.765 N/A THR 294.A N ASN 275.A O no hydrogen 3.047 N/A LEU 295.A N LEU 315.A O no hydrogen 2.825 N/A GLY 296.A N GLU 272.A O no hydrogen 2.979 N/A THR 297.A N ASP 313.A O no hydrogen 2.886 N/A THR 297.A OG1 ARG 266.A O no hydrogen 2.863 N/A GLU 298.A N ASN 270.A O no hydrogen 2.972 N/A GLY 299.A N ILE 311.A O no hydrogen 2.747 N/A SER 300.A OG GLY 301.A O no hydrogen 2.756 N/A GLN 307.A N SER 126.A OG no hydrogen 2.743 N/A VAL 308.A N VAL 305.A O no hydrogen 3.001 N/A SER 309.A OG HIS 124.A NE2 no hydrogen 3.231 N/A SER 309.A OG GLU 298.A OE2 no hydrogen 2.546 N/A SER 310.A OG GLY 299.A O no hydrogen 3.508 N/A ILE 311.A N GLY 299.A O no hydrogen 3.098 N/A ASP 313.A N THR 297.A O no hydrogen 3.069 N/A LEU 315.A N LEU 295.A O no hydrogen 2.784 N/A TRP 316.A N GLY 340.A O no hydrogen 3.042 N/A ALA 317.A N VAL 293.A O no hydrogen 2.814 N/A ALA 318.A N MET 338.A O no hydrogen 2.906 N/A GLY 319.A N VAL 291.A O no hydrogen 3.136 N/A GLU 320.A N SER 335.A O no hydrogen 3.237 N/A VAL 321.A N GLU 320.A OE1 no hydrogen 2.643 N/A GLY 322.A N GLU 333.A O no hydrogen 3.077 N/A GLY 324.A N LYS 331.A O no hydrogen 2.652 N/A GLN 327.A NE2 SER 325.A OG no hydrogen 2.355 N/A LYS 331.A N LEU 245.A O no hydrogen 3.006 N/A GLU 333.A N GLY 322.A O no hydrogen 2.808 N/A PHE 334.A N TRP 248.A O no hydrogen 2.739 N/A SER 335.A N GLU 320.A O no hydrogen 3.061 N/A SER 337.A N ALA 318.A O no hydrogen 2.810 N/A SER 337.A OG ALA 318.A O no hydrogen 3.353 N/A MET 338.A N ALA 318.A O no hydrogen 3.462 N/A ALA 339.A N VAL 426.A O no hydrogen 3.416 N/A GLY 340.A N TRP 316.A O no hydrogen 2.846 N/A LEU 342.A N MET 314.A O no hydrogen 2.847 N/A TRP 344.A N ALA 590.A O no hydrogen 2.868 N/A GLY 345.A N ASP 343.A OD2 no hydrogen 2.772 N/A PHE 346.A N GLU 550.A OE1 no hydrogen 2.788 N/A ALA 348.A N GLY 345.A O no hydrogen 3.089 N/A TYR 349.A N TRP 378.A O no hydrogen 2.908 N/A TYR 349.A OH GLU 272.A OE1 no hydrogen 2.456 N/A ALA 352.A N PHE 376.A O no hydrogen 3.005 N/A LYS 354.A N VAL 374.A O no hydrogen 2.996 N/A LYS 354.A NZ VAL 102.A O no hydrogen 2.629 N/A LEU 356.A N ARG 372.A O no hydrogen 2.671 N/A ALA 358.A N ASP 371.A OD1 no hydrogen 2.795 N/A SER 360.A N PRO 357.A O no hydrogen 2.867 N/A SER 360.A OG PRO 357.A O no hydrogen 2.581 N/A ALA 361.A N GLY 51.A O no hydrogen 2.732 N/A SER 363.A N SER 360.A OG no hydrogen 3.072 N/A SER 363.A OG PRO 357.A O no hydrogen 3.248 N/A SER 363.A OG SER 360.A OG no hydrogen 3.067 N/A LYS 364.A N SER 360.A O no hydrogen 2.985 N/A THR 365.A N ALA 361.A O no hydrogen 3.201 N/A THR 365.A OG1 ALA 361.A O no hydrogen 3.034 N/A SER 366.A N VAL 362.A O no hydrogen 3.091 N/A SER 366.A OG VAL 362.A O no hydrogen 3.306 N/A SER 366.A OG SER 363.A O no hydrogen 3.412 N/A SER 366.A OG GLU 450.A OE2 no hydrogen 2.646 N/A VAL 368.A N SER 363.A O no hydrogen 2.876 N/A ARG 372.A N LEU 356.A O no hydrogen 3.162 N/A ARG 372.A NH1 GLU 406.A OE2 no hydrogen 3.102 N/A ARG 372.A NH1 GLU 450.A OE1 no hydrogen 2.798 N/A ARG 372.A NH1 GLU 450.A OE2 no hydrogen 3.209 N/A ARG 372.A NH2 SER 363.A OG no hydrogen 2.938 N/A ARG 372.A NH2 GLU 450.A OE2 no hydrogen 2.832 N/A VAL 374.A N LYS 354.A O no hydrogen 2.997 N/A SER 375.A N ARG 405.A O no hydrogen 2.781 N/A PHE 376.A N ALA 352.A O no hydrogen 3.153 N/A TRP 378.A N TYR 349.A O no hydrogen 2.911 N/A TRP 378.A NE1 ILE 38.A O no hydrogen 2.916 N/A LEU 379.A N SER 400.A O no hydrogen 2.887 N/A THR 380.A N SER 347.A O no hydrogen 3.036 N/A TYR 384.A N THR 380.A OG1 no hydrogen 3.106 N/A TYR 384.A OH PHE 346.A O no hydrogen 2.695 N/A GLU 385.A N ASP 382.A OD1 no hydrogen 2.807 N/A GLN 386.A N ASP 382.A O no hydrogen 3.157 N/A GLN 386.A N GLN 383.A O no hydrogen 3.157 N/A ALA 387.A N ASP 382.A O no hydrogen 3.236 N/A GLY 389.A N ALA 387.A O no hydrogen 2.977 N/A THR 392.A N PHE 390.A O no hydrogen 2.775 N/A GLN 394.A NE2 LEU 16.A O no hydrogen 2.811 N/A GLN 395.A N PRO 391.A O no hydrogen 3.141 N/A GLY 396.A N THR 392.A O no hydrogen 2.933 N/A TRP 397.A NE1 PHE 22.A O no hydrogen 2.924 N/A THR 398.A N GLY 36.A O no hydrogen 2.916 N/A SER 400.A N LEU 379.A O no hydrogen 3.262 N/A SER 400.A OG ILE 31.A O no hydrogen 3.479 N/A SER 400.A OG LEU 401.A O no hydrogen 2.835 N/A LEU 401.A N ILE 31.A O no hydrogen 2.903 N/A LEU 402.A N VAL 377.A O no hydrogen 2.732 N/A LEU 403.A N GLU 582.A OE2 no hydrogen 3.061 N/A ARG 405.A N SER 375.A O no hydrogen 2.974 N/A ARG 405.A NE TYR 584.A OH no hydrogen 2.891 N/A ARG 405.A NH1 ASP 343.A OD1 no hydrogen 2.886 N/A ARG 405.A NH2 ASP 343.A OD1 no hydrogen 3.206 N/A ARG 405.A NH2 GLU 582.A OE1 no hydrogen 2.987 N/A ARG 405.A NH2 TYR 584.A OH no hydrogen 3.352 N/A ARG 405.A NH2 SER 592.A OG no hydrogen 3.087 N/A GLU 406.A N THR 446.A O no hydrogen 2.779 N/A LEU 407.A N TYR 373.A O no hydrogen 3.041 N/A LYS 408.A N GLY 444.A O no hydrogen 3.283 N/A VAL 409.A N THR 280.A O no hydrogen 2.760 N/A GLN 410.A N THR 442.A O no hydrogen 2.746 N/A GLN 410.A NE2 THR 411.A O no hydrogen 2.708 N/A VAL 412.A N LEU 440.A O no hydrogen 3.060 N/A VAL 415.A N ALA 438.A O no hydrogen 2.991 N/A VAL 416.A N ASP 558.A O no hydrogen 2.763 N/A ASP 417.A N GLN 436.A O no hydrogen 3.136 N/A ASN 418.A ND2 ASP 558.A OD2 no hydrogen 3.110 N/A LEU 420.A N ASN 418.A OD1 no hydrogen 2.853 N/A VAL 421.A N ASN 418.A O no hydrogen 2.935 N/A ARG 422.A N ASN 418.A O no hydrogen 2.983 N/A ARG 422.A NE ASP 417.A OD1 no hydrogen 2.848 N/A ARG 422.A NH2 ASP 417.A OD1 no hydrogen 3.492 N/A ARG 422.A NH2 ASP 417.A OD2 no hydrogen 2.655 N/A GLU 423.A N GLU 419.A O no hydrogen 3.059 N/A SER 427.A OG ALA 339.A O no hydrogen 2.750 N/A TRP 428.A NE1 VAL 421.A O no hydrogen 3.229 N/A VAL 429.A N ARG 441.A O no hydrogen 3.074 N/A GLY 431.A N THR 439.A O no hydrogen 2.530 N/A GLU 432.A N THR 439.A O no hydrogen 3.438 N/A SER 433.A OG ASP 417.A OD2 no hydrogen 2.508 N/A ASN 435.A N SER 433.A OG no hydrogen 3.002 N/A GLN 436.A NE2 THR 437.A O no hydrogen 2.881 N/A THR 437.A OG1 GLN 436.A OE1 no hydrogen 2.858 N/A ALA 438.A N VAL 415.A O no hydrogen 2.720 N/A THR 439.A N GLU 432.A O no hydrogen 2.933 N/A LEU 440.A N VAL 412.A O no hydrogen 2.945 N/A ARG 441.A N VAL 429.A O no hydrogen 2.917 N/A ARG 441.A NH1 GLU 290.A OE1 no hydrogen 3.106 N/A ARG 441.A NH2 GLU 290.A OE1 no hydrogen 3.174 N/A THR 442.A N GLN 410.A O no hydrogen 2.824 N/A THR 442.A OG1 SER 427.A O no hydrogen 2.651 N/A GLY 444.A N LYS 408.A O no hydrogen 2.652 N/A ILE 445.A N GLY 587.A O no hydrogen 2.796 N/A THR 446.A N GLU 406.A O no hydrogen 3.315 N/A ALA 448.A N PRO 404.A O no hydrogen 2.839 N/A ARG 449.A N GLU 406.A OE2 no hydrogen 2.944 N/A ARG 449.A NE GLU 406.A OE2 no hydrogen 3.051 N/A ARG 449.A NH2 GLU 406.A OE1 no hydrogen 3.006 N/A GLU 450.A N GLU 450.A OE1 no hydrogen 2.702 N/A THR 451.A OG1 LEU 72.A O no hydrogen 2.746 N/A LYS 452.A N ALA 448.A O no hydrogen 2.943 N/A ALA 453.A N ARG 449.A O no hydrogen 2.839 N/A ALA 454.A N GLU 450.A O no hydrogen 2.907 N/A LEU 455.A N THR 451.A O no hydrogen 2.913 N/A LEU 456.A N LYS 452.A O no hydrogen 3.293 N/A LEU 456.A N ALA 453.A O no hydrogen 3.210 N/A ALA 457.A N ALA 453.A O no hydrogen 2.845 N/A GLY 459.A N LEU 456.A O no hydrogen 3.242 N/A SER 460.A N GLU 624.A O no hydrogen 3.113 N/A THR 462.A N VAL 622.A O no hydrogen 2.809 N/A GLU 464.A N VAL 620.A O no hydrogen 2.953 N/A ARG 467.A N PHE 617.A O no hydrogen 3.042 N/A LEU 469.A N VAL 615.A O no hydrogen 3.024 N/A GLN 470.A NE2 GLU 614.A OE1 no hydrogen 2.821 N/A THR 471.A OG1 ALA 472.A O no hydrogen 3.430 N/A ALA 473.A N HIS 609.A O no hydrogen 2.904 N/A VAL 475.A N PHE 607.A O no hydrogen 2.887 N/A PHE 477.A N ILE 605.A O no hydrogen 2.931 N/A ALA 478.A N GLU 464.A OE1 no hydrogen 3.433 N/A ALA 478.A N GLU 464.A OE2 no hydrogen 2.917 N/A SER 482.A N GLU 624.A OE2 no hydrogen 2.904 N/A SER 483.A OG GLU 624.A OE2 no hydrogen 2.624 N/A LYS 484.A NZ SER 597.A OG no hydrogen 2.583 N/A LYS 484.A NZ TYR 599.A O no hydrogen 2.683 N/A PHE 486.A N VAL 576.A O no hydrogen 3.021 N/A VAL 487.A N SER 623.A O no hydrogen 2.800 N/A LEU 488.A N VAL 574.A O no hydrogen 2.687 N/A THR 489.A N SER 621.A O no hydrogen 3.097 N/A ALA 490.A N LEU 572.A O no hydrogen 3.150 N/A GLN 491.A N ARG 618.A O no hydrogen 3.047 N/A LEU 492.A N LEU 570.A O no hydrogen 2.826 N/A GLU 493.A N GLN 616.A O no hydrogen 2.997 N/A ALA 498.A N PRO 495.A O no hydrogen 2.719 N/A ARG 499.A N ALA 496.A O no hydrogen 3.351 N/A ARG 499.A NE ASP 558.A OD1 no hydrogen 3.456 N/A ARG 499.A NH1 LEU 556.A O no hydrogen 2.819 N/A ARG 499.A NH2 LEU 556.A O no hydrogen 2.477 N/A ARG 499.A NH2 ASP 558.A OD1 no hydrogen 3.029 N/A SER 500.A OG SER 497.A O no hydrogen 3.428 N/A SER 501.A N ALA 498.A O no hydrogen 3.011 N/A SER 501.A OG ALA 498.A O no hydrogen 2.524 N/A LEU 503.A N SER 501.A OG no hydrogen 3.422 N/A GLN 504.A N ASN 610.A OD1 no hydrogen 3.077 N/A GLN 504.A NE2 GLN 522.A OE1 no hydrogen 2.744 N/A SER 505.A N TYR 521.A O no hydrogen 3.215 N/A SER 505.A OG HIS 609.A ND1 no hydrogen 2.783 N/A GLY 506.A N PHE 608.A O no hydrogen 2.740 N/A PHE 507.A N ILE 519.A O no hydrogen 2.767 N/A GLU 508.A N ARG 606.A O no hydrogen 2.904 N/A ILE 509.A N THR 517.A O no hydrogen 2.719 N/A ALA 511.A N GLN 604.A O no hydrogen 3.191 N/A SER 512.A N GLU 515.A O no hydrogen 2.847 N/A SER 512.A OG SER 602.A OG no hydrogen 2.801 N/A ARG 516.A N GLN 534.A O no hydrogen 3.025 N/A ARG 516.A NE GLU 508.A OE2 no hydrogen 3.023 N/A ARG 516.A NH1 ASP 531.A OD1 no hydrogen 3.462 N/A THR 517.A N ILE 509.A O no hydrogen 2.920 N/A THR 517.A OG1 THR 535.A OG1 no hydrogen 2.765 N/A ALA 518.A N ASP 531.A O no hydrogen 3.139 N/A ILE 519.A N PHE 507.A O no hydrogen 2.794 N/A TYR 520.A N VAL 529.A O no hydrogen 2.994 N/A TYR 521.A N SER 505.A O no hydrogen 2.848 N/A TYR 521.A OH LEU 554.A O no hydrogen 2.554 N/A GLN 522.A N SER 527.A O no hydrogen 2.839 N/A GLN 522.A NE2 ASN 525.A OD1 no hydrogen 3.217 N/A GLU 526.A N PHE 523.A O no hydrogen 2.969 N/A SER 527.A N GLN 522.A O no hydrogen 2.844 N/A SER 527.A OG ASN 525.A O no hydrogen 2.871 N/A LEU 528.A N GLY 552.A O no hydrogen 2.817 N/A VAL 529.A N TYR 520.A O no hydrogen 2.797 N/A VAL 530.A N GLU 550.A O no hydrogen 2.838 N/A ASP 531.A N ALA 518.A O no hydrogen 2.736 N/A ARG 532.A NE TRP 594.A O no hydrogen 3.232 N/A ARG 532.A NH1 ASP 546.A OD2 no hydrogen 3.186 N/A ARG 532.A NH1 PHE 548.A O no hydrogen 2.927 N/A ARG 532.A NH2 ASP 546.A OD2 no hydrogen 2.618 N/A ARG 532.A NH2 TRP 594.A O no hydrogen 3.081 N/A SER 533.A N ASP 531.A OD1 no hydrogen 2.865 N/A SER 533.A OG ASP 531.A OD1 no hydrogen 2.684 N/A THR 535.A N ARG 532.A O no hydrogen 3.097 N/A THR 535.A OG1 THR 517.A OG1 no hydrogen 2.765 N/A SER 536.A OG ARG 596.A O no hydrogen 2.959 N/A ALA 537.A N GLU 515.A OE2 no hydrogen 2.901 N/A ALA 538.A N SER 536.A OG no hydrogen 3.129 N/A ALA 539.A N SER 536.A O no hydrogen 3.023 N/A THR 541.A OG1 THR 11.A O no hydrogen 2.641 N/A THR 541.A OG1 ASN 542.A OD1 no hydrogen 3.269 N/A ASN 542.A N ALA 539.A O no hydrogen 3.210 N/A LEU 545.A N ASN 542.A O no hydrogen 2.981 N/A GLU 550.A N VAL 530.A O no hydrogen 3.046 N/A GLY 552.A N LEU 528.A O no hydrogen 2.973 N/A LYS 553.A NZ ASN 525.A O no hydrogen 2.731 N/A LEU 554.A N GLU 526.A O no hydrogen 2.845 N/A ARG 555.A NE GLU 526.A OE1 no hydrogen 3.383 N/A ARG 555.A NE GLU 526.A OE2 no hydrogen 3.036 N/A ARG 555.A NH1 LEU 420.A O no hydrogen 2.802 N/A ARG 555.A NH1 GLU 423.A OE1 no hydrogen 2.843 N/A ARG 555.A NH2 GLU 423.A OE1 no hydrogen 2.739 N/A ARG 555.A NH2 GLU 526.A OE1 no hydrogen 2.869 N/A PHE 557.A N GLU 568.A OE1 no hydrogen 3.214 N/A VAL 559.A N GLN 566.A O no hydrogen 2.923 N/A ILE 560.A N ASN 414.A O no hydrogen 3.005 N/A GLU 561.A N GLN 564.A O no hydrogen 3.212 N/A GLN 566.A N VAL 559.A O no hydrogen 2.829 N/A GLN 566.A NE2 VAL 567.A O no hydrogen 3.164 N/A GLU 568.A N PHE 557.A O no hydrogen 2.760 N/A LEU 570.A N LEU 492.A O no hydrogen 2.956 N/A LEU 572.A N ALA 490.A O no hydrogen 2.716 N/A THR 573.A N TYR 584.A O no hydrogen 3.039 N/A VAL 574.A N LEU 488.A O no hydrogen 2.637 N/A VAL 575.A N GLU 582.A O no hydrogen 2.887 N/A VAL 576.A N PHE 486.A O no hydrogen 2.869 N/A ASP 577.A N VAL 580.A O no hydrogen 2.849 N/A ASN 578.A N LYS 484.A O no hydrogen 2.804 N/A ASN 578.A ND2 LEU 24.A O no hydrogen 3.129 N/A ASN 578.A ND2 ARG 26.A O no hydrogen 3.190 N/A VAL 580.A N ASP 577.A O no hydrogen 3.312 N/A VAL 581.A N THR 593.A O no hydrogen 3.080 N/A GLU 582.A N VAL 575.A O no hydrogen 3.019 N/A VAL 583.A N LEU 591.A O no hydrogen 2.815 N/A TYR 584.A N THR 573.A O no hydrogen 3.007 N/A TYR 584.A OH GLU 582.A OE1 no hydrogen 2.487 N/A ALA 585.A N PHE 589.A O no hydrogen 2.968 N/A ASN 586.A N ASP 571.A O no hydrogen 3.097 N/A ASN 586.A ND2 ASP 571.A O no hydrogen 3.356 N/A ARG 588.A N ALA 585.A O no hydrogen 3.062 N/A ARG 588.A NH1 GLU 568.A OE2 no hydrogen 3.128 N/A ARG 588.A NH2 ARG 555.A O no hydrogen 2.854 N/A ARG 588.A NH2 GLU 568.A OE1 no hydrogen 2.931 N/A LEU 591.A N VAL 583.A O no hydrogen 2.866 N/A SER 592.A N ASP 343.A OD2 no hydrogen 2.905 N/A SER 592.A OG ASP 343.A OD1 no hydrogen 2.649 N/A THR 593.A N VAL 581.A O no hydrogen 3.006 N/A THR 593.A OG1 GLU 550.A OE2 no hydrogen 2.647 N/A TRP 594.A NE1 THR 380.A O no hydrogen 3.008 N/A ALA 595.A N ALA 579.A O no hydrogen 3.230 N/A ARG 596.A NH2 GLY 381.A O no hydrogen 3.173 N/A SER 597.A N ALA 595.A O no hydrogen 2.971 N/A TRP 598.A N GLU 515.A OE1 no hydrogen 3.253 N/A TRP 598.A N GLU 515.A OE2 no hydrogen 2.642 N/A TRP 598.A NE1 ALA 7.A O no hydrogen 2.951 N/A TYR 599.A N GLU 515.A OE1 no hydrogen 3.076 N/A ASP 600.A N THR 5.A O no hydrogen 3.004 N/A SER 602.A N TYR 599.A O no hydrogen 3.275 N/A SER 602.A OG SER 512.A OG no hydrogen 2.801 N/A SER 602.A OG GLU 515.A OE1 no hydrogen 2.595 N/A THR 603.A N ASN 601.A O no hydrogen 2.752 N/A THR 603.A OG1 PRO 481.A O no hydrogen 2.694 N/A GLN 604.A N ALA 511.A O no hydrogen 2.898 N/A ILE 605.A N SER 480.A OG no hydrogen 2.929 N/A ARG 606.A N GLU 508.A O no hydrogen 2.896 N/A ARG 606.A NH1 SER 512.A O no hydrogen 3.193 N/A ARG 606.A NH2 GLU 508.A OE1 no hydrogen 2.827 N/A PHE 607.A N VAL 475.A O no hydrogen 2.684 N/A PHE 608.A N GLY 506.A O no hydrogen 2.893 N/A HIS 609.A N ALA 473.A O no hydrogen 3.068 N/A HIS 609.A ND1 SER 505.A OG no hydrogen 2.783 N/A HIS 609.A NE2 GLY 613.A O no hydrogen 2.748 N/A ASN 610.A N GLN 504.A O no hydrogen 3.045 N/A ASN 610.A ND2 PRO 502.A O no hydrogen 3.079 N/A ASN 610.A ND2 GLN 504.A OE1 no hydrogen 3.477 N/A GLU 612.A N ASN 610.A OD1 no hydrogen 3.063 N/A VAL 615.A N LEU 469.A O no hydrogen 3.062 N/A GLN 616.A N GLU 493.A O no hydrogen 3.086 N/A PHE 617.A N ARG 467.A O no hydrogen 2.696 N/A ARG 618.A N GLN 491.A O no hydrogen 2.998 N/A ASN 619.A N ASP 466.A OD1 no hydrogen 3.230 N/A SER 621.A N THR 489.A O no hydrogen 3.054 N/A SER 621.A OG THR 462.A O no hydrogen 3.509 N/A VAL 622.A N THR 462.A O no hydrogen 2.867 N/A SER 623.A N VAL 487.A O no hydrogen 3.034 N/A GLU 624.A N SER 460.A O no hydrogen 2.905 N/A GLY 625.A N PHE 485.A O no hydrogen 2.739 N/A TYR 627.A OH ALA 73.A O no hydrogen 2.658 N/A ALA 629.A N ARG 28.A O no hydrogen 2.777 N/A TRP 630.A N ASN 628.A OD1 no hydrogen 2.792 N/A TRP 630.A NE1 HIS 30.A O no hydrogen 3.044 N/A ARG 633.A N TRP 630.A O no hydrogen 3.131 N/A ARG 633.A NE ASP 77.A OD2 no hydrogen 2.894 N/A ARG 633.A NH1 LEU 32.A O no hydrogen 2.879 N/A ARG 633.A NH2 LEU 32.A O no hydrogen 2.888 N/A ARG 633.A NH2 ASP 77.A OD1 no hydrogen 2.872 N/A ARG 633.A NH2 ASP 77.A OD2 no hydrogen 3.436 N/A