Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vr6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N SER 67.A O no hydrogen 3.038 N/A GLN 3.A NE2 ASN 19.A O no hydrogen 2.869 N/A GLY 5.A N VAL 65.A O no hydrogen 2.714 N/A LYS 6.A N GLU 18.A O no hydrogen 3.076 N/A ILE 7.A N GLU 63.A O no hydrogen 2.874 N/A ILE 8.A N MET 16.A O no hydrogen 2.636 N/A LYS 9.A N MET 16.A O no hydrogen 3.240 N/A SER 11.A N LEU 14.A O no hydrogen 2.879 N/A LEU 14.A N SER 11.A O no hydrogen 2.865 N/A VAL 15.A N ILE 50.A O no hydrogen 3.005 N/A MET 16.A N LYS 9.A O no hydrogen 3.021 N/A ALA 17.A N ALA 48.A O no hydrogen 3.219 N/A GLU 18.A N LYS 6.A O no hydrogen 2.785 N/A ASN 19.A N ASP 46.A OD2 no hydrogen 2.844 N/A MET 20.A N ASP 46.A O no hydrogen 3.310 N/A ALA 23.A N MET 20.A O no hydrogen 2.835 N/A GLN 26.A N ILE 40.A O no hydrogen 2.840 N/A MET 28.A N GLU 70.A O no hydrogen 3.059 N/A CYS 29.A N GLY 38.A O no hydrogen 2.895 N/A LEU 30.A N ARG 66.A O no hydrogen 2.772 N/A VAL 31.A N VAL 36.A O no hydrogen 2.744 N/A GLY 32.A N PRO 64.A O no hydrogen 2.966 N/A ASP 33.A N GLU 63.A OE1 no hydrogen 2.774 N/A GLY 35.A N VAL 31.A O no hydrogen 3.033 N/A VAL 36.A N VAL 31.A O no hydrogen 3.213 N/A ILE 37.A N GLU 54.A OE1 no hydrogen 2.919 N/A GLY 38.A N CYS 29.A O no hydrogen 2.823 N/A GLU 39.A N GLN 51.A O no hydrogen 3.096 N/A ILE 40.A N ASP 27.A O no hydrogen 2.978 N/A ILE 41.A N SER 49.A O no hydrogen 2.928 N/A GLU 42.A N SER 49.A O no hydrogen 3.298 N/A ARG 44.A N VAL 47.A O no hydrogen 2.571 N/A ARG 44.A NH1 GLU 42.A OE2 no hydrogen 2.749 N/A VAL 47.A N ARG 44.A O no hydrogen 2.591 N/A ALA 48.A N ALA 17.A O no hydrogen 2.893 N/A SER 49.A N GLU 42.A O no hydrogen 2.889 N/A ILE 50.A N VAL 15.A O no hydrogen 2.802 N/A GLN 51.A N GLU 39.A O no hydrogen 3.025 N/A VAL 52.A N PRO 13.A O no hydrogen 2.714 N/A TYR 53.A N ILE 37.A O no hydrogen 3.009 N/A TYR 53.A OH GLU 39.A OE1 no hydrogen 3.079 N/A THR 56.A OG1 GLY 12.A O no hydrogen 2.533 N/A ILE 59.A N THR 56.A O no hydrogen 2.918 N/A GLY 60.A N GLU 63.A OE2 no hydrogen 3.251 N/A GLY 62.A N ILE 7.A O no hydrogen 2.795 N/A VAL 65.A N GLY 5.A O no hydrogen 2.833 N/A ARG 66.A N LEU 30.A O no hydrogen 2.940 N/A SER 67.A N GLN 3.A O no hydrogen 2.573 N/A THR 68.A N MET 28.A O no hydrogen 3.110 N/A THR 68.A OG1 MET 28.A O no hydrogen 3.079 N/A GLY 69.A N SER 67.A OG no hydrogen 3.359 N/A GLU 70.A N THR 68.A OG1 no hydrogen 3.338 N/A SER 73.A OG ALA 71.A O no hydrogen 2.559 N/A VAL 74.A N TRP 192.A O no hydrogen 2.959 N/A GLU 75.A N GLN 89.A OE1 no hydrogen 2.935 N/A LEU 76.A N GLN 190.A O no hydrogen 2.880 N/A GLY 79.A N GLU 142.A OE2 no hydrogen 2.644 N/A ILE 80.A N GLY 77.A O no hydrogen 3.127 N/A ILE 81.A N GLU 142.A OE2 no hydrogen 3.277 N/A SER 82.A N THR 290.A O no hydrogen 2.816 N/A SER 82.A OG MET 287.A O no hydrogen 2.490 N/A GLN 83.A N ILE 80.A O no hydrogen 3.355 N/A GLN 83.A NE2 GLY 79.A O no hydrogen 3.645 N/A PHE 85.A N LEU 292.A O no hydrogen 2.760 N/A ASP 86.A N ARG 90.A O no hydrogen 3.095 N/A GLY 87.A N ASN 295.A OD1 no hydrogen 2.560 N/A GLN 89.A N ASP 86.A O no hydrogen 2.964 N/A GLN 89.A NE2 GLU 75.A O no hydrogen 3.147 N/A ARG 90.A N ASP 86.A OD1 no hydrogen 2.663 N/A ARG 90.A NE ASP 86.A OD2 no hydrogen 2.701 N/A ARG 90.A NH2 ASP 86.A OD2 no hydrogen 2.943 N/A LEU 92.A N MET 84.A O no hydrogen 3.086 N/A PHE 95.A N PRO 91.A O no hydrogen 2.884 N/A MET 96.A N LEU 92.A O no hydrogen 3.404 N/A MET 96.A N ASP 93.A O no hydrogen 3.138 N/A GLU 97.A N ASP 93.A O no hydrogen 3.294 N/A VAL 98.A N THR 94.A O no hydrogen 2.943 N/A THR 99.A N PHE 95.A O no hydrogen 3.046 N/A GLN 100.A N MET 96.A O no hydrogen 2.920 N/A GLN 100.A NE2 GLU 97.A O no hydrogen 3.039 N/A PHE 103.A N SER 101.A OG no hydrogen 3.018 N/A VAL 108.A N GLY 105.A O no hydrogen 3.402 N/A LEU 113.A N GLU 75.A OE1 no hydrogen 3.150 N/A HIS 115.A ND1 ASP 171.A OD1 no hydrogen 3.214 N/A HIS 115.A ND1 ASP 171.A OD2 no hydrogen 3.219 N/A HIS 115.A NE2 GLU 75.A OE1 no hydrogen 2.922 N/A GLU 116.A N ASP 114.A OD1 no hydrogen 3.041 N/A TRP 119.A N PHE 168.A O no hydrogen 2.602 N/A TRP 120.A NE1 GLU 122.A OE1 no hydrogen 2.984 N/A PHE 121.A N GLY 166.A O no hydrogen 2.758 N/A GLU 122.A N TYR 139.A O no hydrogen 2.864 N/A ALA 123.A N SER 165.A OG no hydrogen 2.852 N/A THR 124.A N ILE 137.A O no hydrogen 3.160 N/A ILE 125.A N ILE 137.A O no hydrogen 3.428 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.815 N/A GLY 128.A N VAL 160.A O no hydrogen 2.762 N/A THR 129.A N GLU 126.A O no hydrogen 3.279 N/A THR 129.A OG1 GLU 126.A O no hydrogen 2.284 N/A VAL 131.A N GLY 158.A O no hydrogen 2.693 N/A SER 132.A N ASP 135.A OD2 no hydrogen 3.071 N/A SER 132.A OG ASP 135.A OD2 no hydrogen 3.405 N/A GLY 134.A N VAL 152.A O no hydrogen 2.940 N/A ASP 135.A N SER 132.A O no hydrogen 3.195 N/A ILE 137.A N ILE 150.A O no hydrogen 2.941 N/A TYR 139.A N GLU 122.A O no hydrogen 3.007 N/A VAL 140.A N HIS 148.A O no hydrogen 2.902 N/A THR 143.A N ILE 146.A O no hydrogen 3.465 N/A THR 143.A OG1 GLU 288.A O no hydrogen 3.007 N/A LYS 144.A N GLU 288.A OE1 no hydrogen 2.561 N/A ILE 145.A N THR 143.A OG1 no hydrogen 3.123 N/A ILE 146.A N THR 143.A OG1 no hydrogen 2.819 N/A GLN 147.A NE2 ASP 141.A OD1 no hydrogen 3.165 N/A HIS 148.A N VAL 140.A O no hydrogen 2.707 N/A HIS 148.A ND1 GLU 142.A OE1 no hydrogen 2.553 N/A HIS 148.A NE2 TYR 317.A OH no hydrogen 2.896 N/A LYS 149.A NZ MET 321.A O no hydrogen 2.825 N/A ILE 150.A N GLY 138.A O no hydrogen 2.813 N/A VAL 152.A N ASP 135.A O no hydrogen 2.918 N/A GLY 158.A N VAL 131.A O no hydrogen 2.946 N/A THR 159.A N GLU 178.A O no hydrogen 3.380 N/A VAL 160.A N THR 129.A O no hydrogen 3.098 N/A GLN 161.A N VAL 176.A O no hydrogen 2.780 N/A SER 165.A OG GLU 122.A OE2 no hydrogen 3.374 N/A GLY 166.A N PHE 121.A O no hydrogen 3.221 N/A SER 167.A OG GLN 118.A OE1 no hydrogen 2.456 N/A PHE 168.A N TRP 119.A O no hydrogen 2.752 N/A THR 169.A N ASP 172.A OD2 no hydrogen 2.982 N/A THR 169.A OG1 ASP 172.A OD2 no hydrogen 2.900 N/A ASP 171.A N THR 169.A OG1 no hydrogen 3.389 N/A ASP 172.A N THR 169.A O no hydrogen 3.179 N/A ASP 172.A N THR 169.A OG1 no hydrogen 3.197 N/A ILE 174.A N LEU 186.A O no hydrogen 2.732 N/A CYS 175.A SG LYS 162.A O no hydrogen 3.729 N/A VAL 176.A N LYS 162.A O no hydrogen 2.846 N/A ILE 177.A N LYS 184.A O no hydrogen 2.832 N/A GLU 178.A N THR 159.A O no hydrogen 2.782 N/A THR 179.A N GLY 182.A O no hydrogen 2.965 N/A THR 179.A OG1 GLY 182.A O no hydrogen 2.386 N/A GLN 181.A N THR 179.A OG1 no hydrogen 3.014 N/A LYS 184.A N ILE 177.A O no hydrogen 2.830 N/A LEU 186.A N CYS 175.A O no hydrogen 2.979 N/A THR 187.A OG1 ILE 170.A O no hydrogen 3.364 N/A THR 187.A OG1 MET 189.A O no hydrogen 3.410 N/A MET 189.A N THR 187.A OG1 no hydrogen 3.309 N/A GLN 190.A N LEU 76.A O no hydrogen 2.887 N/A TRP 192.A N VAL 74.A O no hydrogen 3.291 N/A TRP 192.A NE1 ARG 196.A O no hydrogen 2.663 N/A VAL 194.A N LEU 72.A O no hydrogen 2.977 N/A ARG 196.A N PRO 193.A O no hydrogen 3.189 N/A ARG 198.A N GLU 316.A OE1 no hydrogen 3.058 N/A ARG 198.A NE ASP 320.A OD2 no hydrogen 2.786 N/A ARG 198.A NH1 GLN 190.A OE1 no hydrogen 2.723 N/A ARG 198.A NH2 GLN 190.A OE1 no hydrogen 2.925 N/A ARG 198.A NH2 ASP 320.A OD2 no hydrogen 3.225 N/A LYS 201.A N ILE 374.A O no hydrogen 3.031 N/A GLN 202.A N ILE 374.A O no hydrogen 3.483 N/A LYS 203.A NZ GLU 368.A O no hydrogen 3.463 N/A LYS 203.A NZ SER 370.A O no hydrogen 3.301 N/A LEU 204.A N ARG 372.A O no hydrogen 2.908 N/A MET 210.A N VAL 223.A O no hydrogen 2.942 N/A ILE 211.A N ASP 251.A OD2 no hydrogen 2.990 N/A THR 212.A N ASP 218.A OD1 no hydrogen 3.096 N/A THR 212.A N ASP 218.A OD2 no hydrogen 3.214 N/A THR 212.A OG1 ASP 218.A OD1 no hydrogen 3.027 N/A GLY 213.A N ASP 218.A OD2 no hydrogen 2.775 N/A GLN 214.A N THR 212.A OG1 no hydrogen 3.123 N/A GLN 214.A NE2 THR 212.A O no hydrogen 3.621 N/A GLN 214.A NE2 THR 512.A O no hydrogen 3.216 N/A ARG 215.A N GLN 504.A OE1 no hydrogen 2.901 N/A ARG 215.A NE TYR 501.A O no hydrogen 2.659 N/A ARG 215.A NH1 ASP 511.A OD1 no hydrogen 3.201 N/A ARG 215.A NH1 THR 514.A OG1 no hydrogen 2.452 N/A ARG 215.A NH2 GLN 503.A O no hydrogen 3.000 N/A ARG 215.A NH2 ASP 511.A OD1 no hydrogen 2.762 N/A ASP 218.A N GLN 214.A O no hydrogen 3.041 N/A THR 219.A N ARG 215.A O no hydrogen 3.263 N/A THR 219.A OG1 ARG 215.A O no hydrogen 2.805 N/A THR 219.A OG1 TYR 501.A OH no hydrogen 2.500 N/A THR 219.A OG1 GLN 519.A OE1 no hydrogen 2.573 N/A PHE 220.A N VAL 216.A O no hydrogen 3.106 N/A PHE 221.A N ILE 217.A O no hydrogen 3.081 N/A THR 224.A OG1 PRO 206.A O no hydrogen 2.880 N/A LYS 225.A N VAL 208.A O no hydrogen 2.838 N/A LYS 225.A NZ ASP 251.A O no hydrogen 3.516 N/A LYS 225.A NZ ASP 251.A OD1 no hydrogen 3.376 N/A LYS 225.A NZ ASP 324.A OD2 no hydrogen 3.437 N/A GLY 226.A N THR 386.A OG1 no hydrogen 2.978 N/A GLY 227.A N THR 224.A O no hydrogen 2.818 N/A ALA 229.A N ALA 387.A O no hydrogen 2.851 N/A ALA 230.A N VAL 412.A O no hydrogen 2.790 N/A VAL 231.A N SER 389.A O no hydrogen 2.782 N/A GLY 233.A N VAL 391.A O no hydrogen 2.868 N/A LYS 239.A NZ ASP 330.A OD2 no hydrogen 2.814 N/A VAL 242.A N GLY 238.A O no hydrogen 3.227 N/A GLN 243.A N LYS 239.A O no hydrogen 2.987 N/A GLN 243.A NE2 ASP 330.A OD2 no hydrogen 2.866 N/A HIS 244.A N THR 240.A O no hydrogen 2.803 N/A GLN 245.A N VAL 241.A O no hydrogen 2.770 N/A GLN 245.A NE2 GLN 214.A OE1 no hydrogen 3.547 N/A GLN 245.A NE2 THR 512.A O no hydrogen 2.949 N/A GLN 245.A NE2 THR 512.A OG1 no hydrogen 3.036 N/A ILE 246.A N VAL 242.A O no hydrogen 3.072 N/A ALA 247.A N GLN 243.A O no hydrogen 2.799 N/A LYS 248.A N HIS 244.A O no hydrogen 2.967 N/A TRP 249.A N GLN 245.A O no hydrogen 2.810 N/A SER 250.A N ILE 246.A O no hydrogen 3.350 N/A SER 250.A OG ILE 246.A O no hydrogen 2.856 N/A ASP 251.A N ILE 211.A O no hydrogen 3.429 N/A VAL 252.A N SER 250.A O no hydrogen 2.794 N/A ASP 253.A N ASP 324.A O no hydrogen 2.623 N/A LEU 254.A N ASP 324.A O no hydrogen 3.370 N/A VAL 255.A N ARG 289.A O no hydrogen 2.860 N/A VAL 256.A N ALA 326.A O no hydrogen 2.852 N/A TYR 257.A N VAL 291.A O no hydrogen 2.970 N/A VAL 258.A N MET 328.A O no hydrogen 2.756 N/A GLY 259.A N ILE 293.A O no hydrogen 2.591 N/A CYS 260.A N ASP 330.A O no hydrogen 3.142 N/A CYS 260.A SG SER 331.A O no hydrogen 3.496 N/A GLY 261.A N GLU 262.A OE1 no hydrogen 2.965 N/A GLU 262.A N ASN 295.A O no hydrogen 2.855 N/A ARG 263.A NH1 GLU 266.A OE1 no hydrogen 2.879 N/A MET 267.A N ARG 263.A O no hydrogen 2.782 N/A THR 268.A N GLY 264.A O no hydrogen 3.103 N/A THR 268.A OG1 GLY 264.A O no hydrogen 3.201 N/A VAL 271.A N MET 267.A O no hydrogen 3.329 N/A ASN 272.A N THR 268.A O no hydrogen 3.118 N/A GLU 273.A N ASP 269.A O no hydrogen 2.653 N/A PHE 274.A N VAL 270.A O no hydrogen 2.836 N/A LEU 277.A N PHE 274.A O no hydrogen 2.894 N/A ASP 279.A N GLU 284.A O no hydrogen 2.771 N/A THR 282.A N ASP 279.A OD2 no hydrogen 3.220 N/A THR 282.A OG1 ASP 279.A OD2 no hydrogen 2.974 N/A GLY 283.A N ASP 279.A O no hydrogen 2.695 N/A GLU 284.A N THR 282.A OG1 no hydrogen 3.062 N/A SER 285.A OG PRO 275.A O no hydrogen 2.897 N/A LEU 286.A N LEU 277.A O no hydrogen 2.755 N/A MET 287.A N SER 285.A OG no hydrogen 3.220 N/A GLU 288.A N SER 285.A O no hydrogen 2.836 N/A ARG 289.A N LEU 286.A O no hydrogen 3.027 N/A ARG 289.A NE ASP 279.A OD1 no hydrogen 3.369 N/A ARG 289.A NH1 ASP 253.A O no hydrogen 3.434 N/A ARG 289.A NH2 ASP 279.A OD1 no hydrogen 3.467 N/A THR 290.A N MET 287.A O no hydrogen 3.222 N/A THR 290.A OG1 LEU 286.A O no hydrogen 2.858 N/A VAL 291.A N VAL 255.A O no hydrogen 3.023 N/A LEU 292.A N GLN 83.A O no hydrogen 3.122 N/A ILE 293.A N TYR 257.A O no hydrogen 2.725 N/A ALA 294.A N PHE 85.A O no hydrogen 2.689 N/A ASN 295.A N GLY 259.A O no hydrogen 3.028 N/A ASN 295.A ND2 GLY 259.A O no hydrogen 2.985 N/A THR 296.A OG1 ASN 298.A OD1 no hydrogen 2.667 N/A MET 299.A N THR 296.A O no hydrogen 3.049 N/A ARG 304.A N PRO 300.A O no hydrogen 3.035 N/A ARG 304.A N VAL 301.A O no hydrogen 3.103 N/A ARG 304.A NE MET 299.A O no hydrogen 3.013 N/A ARG 304.A NH2 GLU 341.A OE1 no hydrogen 3.374 N/A GLU 305.A N VAL 301.A O no hydrogen 2.915 N/A ALA 306.A N ALA 302.A O no hydrogen 2.884 N/A SER 307.A OG ARG 304.A O no hydrogen 3.006 N/A TYR 309.A OH ARG 362.A O no hydrogen 3.036 N/A THR 310.A N ALA 306.A O no hydrogen 2.669 N/A THR 310.A OG1 GLY 87.A O no hydrogen 2.633 N/A THR 310.A OG1 ALA 306.A O no hydrogen 3.077 N/A GLY 311.A N SER 307.A O no hydrogen 2.911 N/A ILE 312.A N ILE 308.A O no hydrogen 2.787 N/A THR 313.A N TYR 309.A O no hydrogen 3.096 N/A THR 313.A OG1 VAL 194.A O no hydrogen 3.299 N/A THR 313.A OG1 TYR 309.A O no hydrogen 2.331 N/A ILE 314.A N THR 310.A O no hydrogen 3.180 N/A ALA 315.A N GLY 311.A O no hydrogen 2.961 N/A GLU 316.A N ILE 312.A O no hydrogen 2.911 N/A TYR 317.A N THR 313.A O no hydrogen 3.111 N/A TYR 317.A OH HIS 148.A NE2 no hydrogen 2.896 N/A PHE 318.A N ILE 314.A O no hydrogen 3.310 N/A ARG 319.A N ALA 315.A O no hydrogen 2.923 N/A ARG 319.A NE ASP 320.A OD1 no hydrogen 2.978 N/A ARG 319.A NH2 ARG 198.A O no hydrogen 3.027 N/A ARG 319.A NH2 ASP 320.A OD1 no hydrogen 2.639 N/A ASP 320.A N GLU 316.A O no hydrogen 2.711 N/A MET 321.A N PHE 318.A O no hydrogen 2.907 N/A GLY 322.A N ARG 319.A O no hydrogen 2.820 N/A TYR 323.A N PHE 318.A O no hydrogen 3.387 N/A TYR 323.A OH GLN 147.A O no hydrogen 2.563 N/A ASP 324.A N ASP 253.A OD2 no hydrogen 2.814 N/A VAL 325.A N SER 384.A O no hydrogen 2.797 N/A ALA 326.A N LEU 254.A O no hydrogen 2.931 N/A ILE 327.A N THR 386.A O no hydrogen 2.835 N/A MET 328.A N VAL 256.A O no hydrogen 2.832 N/A ALA 329.A N ILE 388.A O no hydrogen 2.916 N/A ASP 330.A N VAL 258.A O no hydrogen 2.925 N/A SER 331.A N GLU 262.A OE1 no hydrogen 3.008 N/A SER 331.A OG SER 392.A OG no hydrogen 2.507 N/A THR 332.A N ALA 390.A O no hydrogen 2.961 N/A THR 332.A OG1 ALA 390.A O no hydrogen 2.826 N/A SER 333.A N SER 331.A OG no hydrogen 3.328 N/A ARG 334.A N SER 331.A O no hydrogen 2.947 N/A TRP 335.A N SER 331.A O no hydrogen 3.202 N/A TRP 335.A NE1 GLU 305.A O no hydrogen 2.656 N/A ALA 336.A N THR 332.A O no hydrogen 2.912 N/A GLU 337.A N SER 333.A O no hydrogen 3.102 N/A ALA 338.A N ARG 334.A O no hydrogen 3.128 N/A LEU 339.A N TRP 335.A O no hydrogen 3.239 N/A ARG 340.A N ALA 336.A O no hydrogen 2.842 N/A ARG 340.A NE GLU 353.A O no hydrogen 3.522 N/A ARG 340.A NH1 GLU 337.A OE2 no hydrogen 3.048 N/A ARG 340.A NH2 GLU 353.A O no hydrogen 3.351 N/A GLU 341.A N GLU 337.A O no hydrogen 2.982 N/A MET 342.A N ALA 338.A O no hydrogen 2.945 N/A SER 343.A N LEU 339.A O no hydrogen 2.963 N/A SER 343.A OG GLU 348.A OE1 no hydrogen 2.668 N/A GLY 344.A N ARG 340.A O no hydrogen 3.179 N/A ARG 345.A N GLU 341.A O no hydrogen 2.915 N/A ARG 345.A NE GLN 51.A OE1 no hydrogen 3.298 N/A ARG 345.A NH1 GLU 341.A OE2 no hydrogen 3.160 N/A ARG 345.A NH2 GLN 51.A OE1 no hydrogen 3.342 N/A ARG 345.A NH2 VAL 52.A O no hydrogen 2.790 N/A LEU 346.A N MET 342.A O no hydrogen 2.897 N/A GLU 347.A N GLY 344.A O no hydrogen 3.188 N/A GLU 348.A N SER 343.A O no hydrogen 3.067 N/A GLY 351.A N TYR 355.A O no hydrogen 2.698 N/A TYR 355.A N ASP 352.A O no hydrogen 3.136 N/A TYR 358.A OH GLU 348.A OE1 no hydrogen 3.086 N/A TYR 358.A OH GLU 348.A OE2 no hydrogen 2.918 N/A ARG 362.A N TYR 358.A O no hydrogen 2.758 N/A LEU 363.A N LEU 359.A O no hydrogen 2.936 N/A ALA 364.A N GLY 360.A O no hydrogen 2.797 N/A GLU 365.A N SER 361.A O no hydrogen 2.850 N/A TYR 366.A N ARG 362.A O no hydrogen 3.238 N/A TYR 367.A N LEU 363.A O no hydrogen 3.131 N/A TYR 367.A OH SER 389.A OG no hydrogen 2.739 N/A GLU 368.A N ALA 364.A O no hydrogen 2.929 N/A ARG 369.A N TYR 366.A O no hydrogen 3.098 N/A ARG 369.A NE GLU 316.A OE2 no hydrogen 2.967 N/A ARG 369.A NH1 VAL 194.A O no hydrogen 2.889 N/A ARG 369.A NH2 VAL 194.A O no hydrogen 3.202 N/A ARG 369.A NH2 THR 313.A OG1 no hydrogen 3.245 N/A ARG 369.A NH2 GLU 316.A OE1 no hydrogen 3.136 N/A SER 370.A N TYR 367.A O no hydrogen 2.889 N/A SER 370.A OG TYR 367.A O no hydrogen 2.764 N/A GLY 371.A N ILE 385.A O no hydrogen 3.025 N/A ARG 372.A NE ASN 205.A O no hydrogen 2.893 N/A ARG 372.A NH1 GLU 382.A OE2 no hydrogen 2.810 N/A ARG 372.A NH2 ASN 205.A O no hydrogen 3.496 N/A VAL 373.A N GLY 383.A O no hydrogen 2.977 N/A ILE 374.A N GLN 202.A O no hydrogen 2.862 N/A ALA 375.A N ARG 381.A O no hydrogen 2.941 N/A SER 378.A N ASP 135.A OD1 no hydrogen 2.578 N/A SER 378.A OG ASP 135.A OD1 no hydrogen 3.003 N/A SER 378.A OG ASP 135.A OD2 no hydrogen 3.278 N/A GLN 380.A N GLY 377.A O no hydrogen 3.379 N/A ARG 381.A NE ASP 320.A O no hydrogen 3.374 N/A GLY 383.A N VAL 373.A O no hydrogen 3.207 N/A SER 384.A N TYR 323.A O no hydrogen 3.225 N/A SER 384.A OG ASP 324.A OD1 no hydrogen 3.069 N/A ILE 385.A N GLY 371.A O no hydrogen 3.164 N/A THR 386.A N VAL 325.A O no hydrogen 2.894 N/A ALA 387.A N GLY 227.A O no hydrogen 3.018 N/A ILE 388.A N ILE 327.A O no hydrogen 2.734 N/A SER 389.A N ALA 229.A O no hydrogen 3.013 N/A SER 389.A OG TYR 367.A OH no hydrogen 2.739 N/A ALA 390.A N ALA 329.A O no hydrogen 2.824 N/A VAL 391.A N VAL 231.A O no hydrogen 3.053 N/A SER 392.A N SER 333.A OG no hydrogen 2.762 N/A SER 392.A OG SER 331.A OG no hydrogen 2.507 N/A GLY 396.A N PRO 393.A O no hydrogen 3.106 N/A VAL 402.A N GLU 400.A OE1 no hydrogen 2.907 N/A THR 403.A N GLU 400.A OE2 no hydrogen 3.137 N/A THR 403.A OG1 GLU 400.A OE2 no hydrogen 2.362 N/A GLN 404.A N GLU 400.A O no hydrogen 3.045 N/A GLN 404.A NE2 ILE 398.A O no hydrogen 2.509 N/A ASN 405.A N PRO 401.A O no hydrogen 2.830 N/A ASN 405.A ND2 PRO 401.A O no hydrogen 2.733 N/A THR 406.A N VAL 402.A O no hydrogen 2.970 N/A THR 406.A OG1 VAL 402.A O no hydrogen 2.693 N/A LEU 407.A N THR 403.A O no hydrogen 2.969 N/A ARG 408.A NH1 ASN 405.A OD1 no hydrogen 2.536 N/A VAL 409.A N THR 406.A O no hydrogen 2.800 N/A VAL 410.A N THR 406.A O no hydrogen 2.969 N/A VAL 412.A N ALA 228.A O no hydrogen 3.197 N/A PHE 413.A N TYR 435.A O no hydrogen 2.924 N/A TRP 414.A N ALA 230.A O no hydrogen 2.837 N/A TRP 414.A NE1 PHE 221.A O no hydrogen 2.872 N/A GLY 415.A N SER 434.A OG no hydrogen 2.917 N/A ASP 417.A N SER 428.A O no hydrogen 2.804 N/A SER 419.A N ASP 417.A OD1 no hydrogen 2.673 N/A SER 419.A OG ASP 417.A OD1 no hydrogen 2.699 N/A SER 419.A OG ASP 417.A OD2 no hydrogen 2.996 N/A ALA 421.A N ASP 417.A O no hydrogen 3.253 N/A GLN 422.A N SER 418.A O no hydrogen 2.859 N/A LYS 423.A N SER 419.A O no hydrogen 3.340 N/A LYS 423.A N LEU 420.A O no hydrogen 3.037 N/A ARG 424.A N ALA 421.A O no hydrogen 2.963 N/A HIS 425.A N LEU 420.A O no hydrogen 3.090 N/A SER 428.A OG HIS 425.A O no hydrogen 2.725 N/A ASN 430.A N GLY 415.A O no hydrogen 2.706 N/A ASN 430.A ND2 ASP 417.A OD2 no hydrogen 2.908 N/A ILE 432.A N ASN 430.A OD1 no hydrogen 3.286 N/A GLN 433.A N ASN 430.A OD1 no hydrogen 3.004 N/A SER 434.A N ASN 430.A O no hydrogen 3.015 N/A SER 434.A OG ASN 430.A O no hydrogen 2.442 N/A TYR 435.A N PHE 413.A O no hydrogen 2.989 N/A SER 436.A OG PRO 222.A O no hydrogen 2.253 N/A LEU 437.A N LYS 411.A O no hydrogen 2.858 N/A TYR 438.A N SER 436.A OG no hydrogen 3.294 N/A SER 439.A N SER 436.A O no hydrogen 3.398 N/A SER 439.A OG SER 436.A O no hydrogen 3.338 N/A VAL 442.A N TYR 438.A O no hydrogen 2.821 N/A GLY 443.A N SER 439.A O no hydrogen 3.007 N/A ARG 444.A N THR 440.A O no hydrogen 3.053 N/A ARG 444.A NE GLU 441.A OE1 no hydrogen 3.165 N/A ARG 444.A NH2 GLU 441.A OE1 no hydrogen 3.456 N/A TYR 445.A N GLU 441.A O no hydrogen 2.954 N/A MET 446.A N VAL 442.A O no hydrogen 2.736 N/A ASP 447.A N GLY 443.A O no hydrogen 2.784 N/A GLN 448.A N ARG 444.A O no hydrogen 3.203 N/A ILE 449.A N TYR 445.A O no hydrogen 3.080 N/A LEU 450.A N MET 446.A O no hydrogen 2.932 N/A GLN 451.A NE2 GLN 448.A O no hydrogen 3.234 N/A TRP 454.A N GLN 452.A O no hydrogen 2.863 N/A SER 455.A N ASP 447.A OD1 no hydrogen 2.983 N/A SER 455.A OG ASP 447.A OD1 no hydrogen 3.457 N/A SER 455.A OG ASP 447.A OD2 no hydrogen 2.634 N/A MET 457.A N ASP 453.A O no hydrogen 3.409 N/A VAL 458.A N TRP 454.A O no hydrogen 3.154 N/A THR 459.A N SER 455.A O no hydrogen 3.235 N/A THR 459.A OG1 SER 455.A O no hydrogen 3.082 N/A GLU 460.A N ASP 456.A O no hydrogen 3.040 N/A GLY 461.A N MET 457.A O no hydrogen 2.948 N/A MET 462.A N VAL 458.A O no hydrogen 2.922 N/A ARG 463.A N THR 459.A O no hydrogen 2.887 N/A ARG 463.A NE GLU 460.A OE1 no hydrogen 3.169 N/A ILE 464.A N GLU 460.A O no hydrogen 3.119 N/A LEU 465.A N GLY 461.A O no hydrogen 3.234 N/A GLN 466.A N MET 462.A O no hydrogen 3.074 N/A GLU 467.A N ARG 463.A O no hydrogen 2.868 N/A GLU 468.A N ILE 464.A O no hydrogen 2.957 N/A LEU 471.A N GLU 467.A O no hydrogen 2.995 N/A ASN 472.A N GLU 468.A O no hydrogen 2.935 N/A VAL 475.A N LEU 471.A O no hydrogen 3.031 N/A ARG 476.A N ASN 472.A O no hydrogen 3.104 N/A LEU 477.A N GLU 473.A O no hydrogen 3.288 N/A VAL 478.A N ILE 474.A O no hydrogen 2.870 N/A SER 482.A N GLY 479.A O no hydrogen 3.349 N/A ASN 486.A N SER 484.A OG no hydrogen 3.113 N/A ASP 487.A N SER 484.A OG no hydrogen 3.141 N/A ARG 488.A N SER 484.A O no hydrogen 3.128 N/A LEU 489.A N ASP 485.A O no hydrogen 3.379 N/A THR 490.A N ASN 486.A O no hydrogen 3.272 N/A THR 490.A OG1 ASN 486.A O no hydrogen 3.210 N/A LEU 491.A N ASP 487.A O no hydrogen 3.071 N/A VAL 493.A N LEU 489.A O no hydrogen 3.040 N/A ALA 494.A N THR 490.A O no hydrogen 2.923 N/A LYS 495.A N LEU 491.A O no hydrogen 2.944 N/A SER 496.A N GLU 492.A O no hydrogen 2.871 N/A SER 496.A OG ASP 500.A OD2 no hydrogen 2.234 N/A ILE 497.A N VAL 493.A O no hydrogen 2.711 N/A ARG 498.A N ALA 494.A O no hydrogen 2.829 N/A ARG 498.A NE GLU 468.A OE1 no hydrogen 3.196 N/A ARG 498.A NE GLU 468.A OE2 no hydrogen 2.753 N/A ARG 498.A NH2 GLU 468.A OE2 no hydrogen 2.903 N/A GLU 499.A N LYS 495.A O no hydrogen 2.908 N/A ASP 500.A N SER 496.A O no hydrogen 2.595 N/A TYR 501.A N ILE 497.A O no hydrogen 3.139 N/A TYR 501.A OH THR 219.A OG1 no hydrogen 2.500 N/A LEU 502.A N ILE 497.A O no hydrogen 2.830 N/A GLN 503.A NE2 HIS 425.A ND1 no hydrogen 3.287 N/A GLN 504.A N PHE 426.A O no hydrogen 2.741 N/A GLN 504.A NE2 GLY 213.A O no hydrogen 3.181 N/A GLN 504.A NE2 ASP 511.A O no hydrogen 3.051 N/A ASN 505.A N ASP 511.A OD2 no hydrogen 2.839 N/A PHE 507.A N ASN 505.A OD1 no hydrogen 2.934 N/A VAL 510.A N ASP 508.A OD2 no hydrogen 2.924 N/A ASP 511.A N ASP 508.A OD2 no hydrogen 3.173 N/A THR 512.A OG1 ALA 506.A O no hydrogen 2.686 N/A THR 514.A N GLY 213.A O no hydrogen 2.889 N/A SER 515.A N GLU 565.A OE2 no hydrogen 2.786 N/A SER 515.A OG GLU 517.A OE2 no hydrogen 3.370 N/A SER 515.A OG GLU 565.A OE1 no hydrogen 3.018 N/A SER 515.A OG GLU 565.A OE2 no hydrogen 3.171 N/A GLU 517.A N GLU 517.A OE2 no hydrogen 2.555 N/A LYS 518.A N SER 515.A OG no hydrogen 2.924 N/A LYS 518.A NZ LYS 561.A O no hydrogen 3.072 N/A LYS 518.A NZ ILE 563.A O no hydrogen 3.101 N/A GLN 519.A N SER 515.A O no hydrogen 2.893 N/A GLN 519.A NE2 ASP 218.A OD2 no hydrogen 3.264 N/A GLN 519.A NE2 THR 514.A O no hydrogen 3.427 N/A PHE 520.A N ARG 516.A O no hydrogen 3.067 N/A ASN 521.A N GLU 517.A O no hydrogen 3.115 N/A MET 522.A N LYS 518.A O no hydrogen 2.791 N/A LEU 523.A N GLN 519.A O no hydrogen 3.015 N/A LYS 524.A N PHE 520.A O no hydrogen 2.948 N/A VAL 525.A N ASN 521.A O no hydrogen 3.148 N/A LEU 527.A N LEU 523.A O no hydrogen 3.115 N/A THR 528.A N LYS 524.A O no hydrogen 2.835 N/A THR 528.A OG1 LYS 524.A O no hydrogen 2.363 N/A THR 528.A OG1 ASN 575.A OD1 no hydrogen 2.855 N/A PHE 529.A N VAL 525.A O no hydrogen 2.849 N/A GLY 530.A N ILE 526.A O no hydrogen 3.051 N/A LYS 531.A N LEU 527.A O no hydrogen 2.703 N/A GLU 532.A N THR 528.A O no hydrogen 2.706 N/A ALA 533.A N PHE 529.A O no hydrogen 3.030 N/A ARG 534.A N GLY 530.A O no hydrogen 3.055 N/A ARG 534.A N LYS 531.A O no hydrogen 3.101 N/A ARG 534.A NE ASN 486.A OD1 no hydrogen 2.690 N/A ARG 534.A NH2 ASN 486.A O no hydrogen 2.470 N/A ARG 534.A NH2 ASN 486.A OD1 no hydrogen 2.878 N/A LYS 535.A N LYS 531.A O no hydrogen 3.162 N/A ALA 536.A N GLU 532.A O no hydrogen 3.259 N/A LEU 537.A N ALA 533.A O no hydrogen 3.421 N/A SER 538.A N ARG 534.A O no hydrogen 3.124 N/A LEU 539.A N LYS 535.A O no hydrogen 3.127 N/A LEU 539.A N ALA 536.A O no hydrogen 3.308 N/A GLY 540.A N LEU 537.A O no hydrogen 3.163 N/A ALA 541.A N ALA 536.A O no hydrogen 3.103 N/A PHE 543.A N ASP 485.A OD2 no hydrogen 3.125 N/A ASN 544.A N ASN 544.A OD1 no hydrogen 2.310 N/A ILE 546.A N TYR 542.A O no hydrogen 3.166 N/A MET 547.A N PHE 543.A O no hydrogen 3.002 N/A GLU 548.A N ASN 544.A O no hydrogen 2.998 N/A GLY 549.A N GLU 545.A O no hydrogen 2.975 N/A THR 550.A N ILE 546.A O no hydrogen 3.077 N/A THR 550.A N MET 547.A O no hydrogen 3.275 N/A THR 550.A OG1 ILE 546.A O no hydrogen 2.266 N/A THR 550.A OG1 MET 547.A O no hydrogen 3.360 N/A ARG 554.A N THR 550.A O no hydrogen 2.978 N/A GLU 555.A N VAL 551.A O no hydrogen 3.145 N/A ARG 556.A N ALA 552.A O no hydrogen 3.157 N/A ARG 556.A NH1 GLU 577.A OE1 no hydrogen 2.740 N/A ILE 557.A N VAL 553.A O no hydrogen 2.998 N/A SER 558.A N ARG 554.A O no hydrogen 3.170 N/A SER 558.A OG ASP 500.A OD1 no hydrogen 2.618 N/A SER 558.A OG ASP 500.A OD2 no hydrogen 3.520 N/A SER 558.A OG ARG 554.A O no hydrogen 3.016 N/A SER 560.A N ILE 557.A O no hydrogen 3.314 N/A SER 560.A OG ARG 556.A O no hydrogen 3.369 N/A SER 560.A OG ILE 557.A O no hydrogen 2.901 N/A LYS 561.A NZ GLU 499.A O no hydrogen 2.419 N/A LYS 561.A NZ GLN 503.A O no hydrogen 3.360 N/A TYR 562.A N ARG 559.A O no hydrogen 2.638 N/A ILE 563.A N ARG 559.A O no hydrogen 3.332 N/A ILE 563.A N SER 560.A O no hydrogen 3.191 N/A GLU 567.A N PRO 564.A O no hydrogen 2.793 N/A LYS 570.A N GLU 567.A O no hydrogen 3.301 N/A ILE 571.A N LEU 568.A O no hydrogen 2.909 N/A SER 572.A N LEU 568.A O no hydrogen 3.346 N/A SER 572.A OG ALA 569.A O no hydrogen 3.085 N/A SER 573.A N ALA 569.A O no hydrogen 3.127 N/A SER 573.A OG ALA 569.A O no hydrogen 2.462 N/A ILE 574.A N ILE 571.A O no hydrogen 3.260 N/A ASN 575.A N SER 572.A O no hydrogen 3.276 N/A ASN 575.A ND2 SER 572.A O no hydrogen 3.299 N/A GLU 577.A N SER 573.A O no hydrogen 3.458 N/A ILE 578.A N ILE 574.A O no hydrogen 2.977 N/A LYS 579.A N ASN 575.A O no hydrogen 3.314 N/A GLU 580.A N GLU 576.A O no hydrogen 2.948 N/A THR 581.A N GLU 577.A O no hydrogen 2.816 N/A THR 581.A OG1 GLU 577.A O no hydrogen 2.884 N/A ILE 582.A N ILE 578.A O no hydrogen 2.905 N/A GLN 583.A N LYS 579.A O no hydrogen 3.109 N/A LEU 584.A N GLU 580.A O no hydrogen 3.309 N/A ILE 585.A N THR 581.A O no hydrogen 2.921 N/A VAL 586.A N ILE 582.A O no hydrogen 2.899 N/A SER 587.A N GLN 583.A O no hydrogen 3.228 N/A