Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4r71_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N THR 2.A O no hydrogen 3.362 N/A LYS 7.A N ALA 3.A O no hydrogen 3.324 N/A GLU 8.A N SER 4.A O no hydrogen 3.488 N/A LEU 9.A N LEU 5.A O no hydrogen 2.895 N/A LEU 9.A N VAL 6.A O no hydrogen 3.005 N/A ARG 10.A NH1 ASP 366.A O no hydrogen 3.057 N/A ARG 10.A NH2 PRO 368.A O no hydrogen 3.387 N/A THR 13.A OG1 ARG 12.A O no hydrogen 2.346 N/A THR 13.A OG1 THR 13.A O no hydrogen 2.590 N/A MET 18.A N THR 365.A O no hydrogen 3.193 N/A CYS 20.A N GLY 16.A O no hydrogen 2.896 N/A CYS 20.A N MET 17.A O no hydrogen 3.281 N/A CYS 20.A SG GLY 16.A O no hydrogen 3.343 N/A LYS 21.A N MET 17.A O no hydrogen 3.341 N/A LYS 21.A NZ ASP 398.A OD2 no hydrogen 3.373 N/A LYS 22.A N MET 18.A O no hydrogen 2.834 N/A ALA 23.A N ASP 19.A O no hydrogen 2.964 N/A LEU 24.A N CYS 20.A O no hydrogen 3.019 N/A THR 25.A N LYS 21.A O no hydrogen 2.693 N/A THR 25.A OG1 LYS 21.A O no hydrogen 3.016 N/A LEU 33.A N ASP 30.A OD1 no hydrogen 3.212 N/A ALA 34.A N ASP 30.A O no hydrogen 3.066 N/A ILE 35.A N ILE 31.A O no hydrogen 3.024 N/A GLU 36.A N GLU 32.A O no hydrogen 3.318 N/A GLU 36.A N LEU 33.A O no hydrogen 3.137 N/A ASN 37.A N LEU 33.A O no hydrogen 3.327 N/A MET 38.A N ALA 34.A O no hydrogen 3.040 N/A ARG 39.A N GLU 36.A O no hydrogen 2.864 N/A ARG 39.A NE GLU 36.A OE2 no hydrogen 3.162 N/A ARG 39.A NH2 GLU 36.A OE1 no hydrogen 2.290 N/A LYS 40.A N GLU 36.A O no hydrogen 3.107 N/A SER 41.A N ASN 37.A O no hydrogen 3.216 N/A SER 41.A OG SER 41.A O no hydrogen 2.574 N/A GLY 42.A N ARG 39.A O no hydrogen 3.051 N/A ALA 43.A N LYS 40.A O no hydrogen 3.312 N/A ALA 46.A N GLY 42.A O no hydrogen 3.001 N/A ALA 46.A N ALA 43.A O no hydrogen 3.179 N/A ALA 47.A N ALA 43.A O no hydrogen 3.253 N/A LYS 48.A N ILE 44.A O no hydrogen 3.330 N/A LYS 49.A N LYS 45.A O no hydrogen 3.451 N/A ALA 50.A N ALA 47.A O no hydrogen 3.293 N/A ASN 52.A N LYS 49.A O no hydrogen 3.269 N/A ASN 52.A ND2 GLN 76.A OE1 no hydrogen 3.205 N/A ASP 56.A N CYS 75.A O no hydrogen 3.295 N/A GLY 57.A N ASP 56.A OD1 no hydrogen 2.371 N/A VAL 58.A N VAL 73.A O no hydrogen 2.922 N/A ILE 59.A N ALA 147.A O no hydrogen 2.992 N/A LYS 60.A N LEU 71.A O no hydrogen 2.898 N/A LYS 60.A NZ GLN 87.A OE1 no hydrogen 2.999 N/A LYS 60.A NZ ASP 91.A OD1 no hydrogen 2.856 N/A THR 61.A OG1 GLN 144.A OE1 no hydrogen 2.970 N/A LYS 62.A N ILE 69.A O no hydrogen 3.054 N/A ASP 64.A N TYR 67.A O no hydrogen 2.899 N/A GLY 68.A N LEU 135.A O no hydrogen 2.944 N/A ILE 69.A N LYS 62.A O no hydrogen 2.892 N/A ILE 70.A N ALA 133.A O no hydrogen 2.910 N/A LEU 71.A N LYS 60.A O no hydrogen 2.843 N/A GLU 72.A N ARG 131.A O no hydrogen 3.138 N/A VAL 73.A N VAL 58.A O no hydrogen 3.080 N/A ASN 74.A N ASN 128.A O no hydrogen 2.809 N/A ASN 74.A ND2 ASP 56.A O no hydrogen 3.123 N/A ASN 74.A ND2 GLU 72.A OE2 no hydrogen 3.342 N/A CYS 75.A N ASP 56.A O no hydrogen 2.895 N/A CYS 75.A SG THR 77.A O no hydrogen 3.204 N/A GLN 76.A N GLU 125.A OE1 no hydrogen 2.804 N/A THR 77.A N GLU 125.A OE1 no hydrogen 2.928 N/A THR 77.A OG1 GLU 125.A OE2 no hydrogen 2.727 N/A VAL 80.A N THR 77.A O no hydrogen 2.952 N/A ALA 81.A N THR 77.A O no hydrogen 3.427 N/A LYS 82.A N ASP 78.A O no hydrogen 3.184 N/A ASP 83.A N VAL 80.A O no hydrogen 2.906 N/A GLY 85.A N ASP 83.A OD2 no hydrogen 3.211 N/A PHE 86.A N ASP 83.A OD2 no hydrogen 3.506 N/A GLN 87.A N ASP 83.A O no hydrogen 2.979 N/A GLN 87.A NE2 ALA 81.A O no hydrogen 3.211 N/A ALA 88.A N ALA 84.A O no hydrogen 2.875 N/A PHE 89.A N GLY 85.A O no hydrogen 3.052 N/A ALA 90.A N PHE 86.A O no hydrogen 3.058 N/A ASP 91.A N GLN 87.A O no hydrogen 2.940 N/A LYS 92.A N ALA 88.A O no hydrogen 3.110 N/A LYS 92.A NZ GLU 115.A OE1 no hydrogen 2.756 N/A LYS 92.A NZ GLU 115.A OE2 no hydrogen 3.044 N/A VAL 93.A N PHE 89.A O no hydrogen 2.977 N/A LEU 94.A N ALA 90.A O no hydrogen 2.837 N/A ASP 95.A N ASP 91.A O no hydrogen 3.113 N/A ALA 96.A N LYS 92.A O no hydrogen 3.332 N/A ALA 97.A N VAL 93.A O no hydrogen 3.043 N/A VAL 98.A N LEU 94.A O no hydrogen 3.097 N/A ALA 99.A N ASP 95.A O no hydrogen 2.862 N/A GLY 100.A N ALA 96.A O no hydrogen 3.241 N/A LYS 101.A N VAL 98.A O no hydrogen 3.389 N/A ILE 102.A N ALA 97.A O no hydrogen 2.922 N/A THR 103.A OG1 LYS 101.A O no hydrogen 3.569 N/A GLU 106.A N ASP 104.A OD1 no hydrogen 2.868 N/A LEU 108.A N ASP 104.A O no hydrogen 3.283 N/A LYS 109.A N VAL 105.A O no hydrogen 2.750 N/A LYS 109.A NZ ILE 129.A O no hydrogen 2.294 N/A ALA 110.A N GLU 106.A O no hydrogen 2.978 N/A GLN 111.A N VAL 107.A O no hydrogen 3.171 N/A GLN 111.A N LEU 108.A O no hydrogen 3.109 N/A PHE 112.A N LEU 108.A O no hydrogen 3.271 N/A ARG 116.A N PHE 112.A O no hydrogen 3.199 N/A ARG 116.A N GLU 113.A O no hydrogen 3.150 N/A ARG 116.A NE ILE 127.A O no hydrogen 2.643 N/A ARG 116.A NH1 GLU 113.A OE1 no hydrogen 3.546 N/A ARG 116.A NH1 GLU 113.A OE2 no hydrogen 3.178 N/A ARG 116.A NH2 ILE 127.A O no hydrogen 3.018 N/A VAL 117.A N GLU 113.A O no hydrogen 3.255 N/A ALA 118.A N GLU 114.A O no hydrogen 3.304 N/A LEU 119.A N GLU 115.A O no hydrogen 3.132 N/A VAL 120.A N ARG 116.A O no hydrogen 2.392 N/A ALA 121.A N VAL 117.A O no hydrogen 2.717 N/A ILE 123.A N LEU 119.A O no hydrogen 2.984 N/A ILE 123.A N VAL 120.A O no hydrogen 3.060 N/A GLY 124.A N VAL 120.A O no hydrogen 2.582 N/A ASN 126.A N GLN 76.A OE1 no hydrogen 2.924 N/A ASN 126.A ND2 ASN 52.A O no hydrogen 2.984 N/A ASN 128.A N ASN 74.A O no hydrogen 2.961 N/A ASN 128.A ND2 ASN 126.A OD1 no hydrogen 2.870 N/A ARG 130.A N GLU 72.A O no hydrogen 2.877 N/A ARG 130.A NH1 GLU 72.A OE1 no hydrogen 2.996 N/A ARG 130.A NH1 GLU 72.A OE2 no hydrogen 3.172 N/A ARG 130.A NH1 GLU 260.A O no hydrogen 2.965 N/A ARG 130.A NH2 GLU 260.A O no hydrogen 2.427 N/A ARG 131.A NE GLU 72.A OE1 no hydrogen 2.562 N/A ARG 131.A NH2 GLU 72.A OE1 no hydrogen 3.209 N/A ARG 131.A NH2 GLU 257.A O no hydrogen 3.494 N/A ARG 131.A NH2 GLU 260.A OE1 no hydrogen 2.651 N/A ALA 133.A N ILE 70.A O no hydrogen 3.060 N/A LEU 135.A N GLY 68.A O no hydrogen 2.888 N/A VAL 139.A N ALA 155.A O no hydrogen 3.261 N/A GLY 141.A N VAL 153.A O no hydrogen 3.009 N/A TYR 143.A N VAL 151.A O no hydrogen 3.303 N/A TYR 143.A OH HIS 145.A ND1 no hydrogen 2.672 N/A HIS 145.A N ILE 149.A O no hydrogen 2.866 N/A HIS 145.A ND1 TYR 143.A OH no hydrogen 2.672 N/A HIS 145.A NE2 ASP 611.A OD2 no hydrogen 2.690 N/A ILE 149.A N HIS 145.A O no hydrogen 3.446 N/A GLY 150.A N PHE 256.A O no hydrogen 2.999 N/A VAL 151.A N TYR 143.A O no hydrogen 2.917 N/A LEU 152.A N ILE 254.A O no hydrogen 2.889 N/A VAL 153.A N GLY 141.A O no hydrogen 3.001 N/A ALA 154.A N GLY 252.A O no hydrogen 2.731 N/A ALA 155.A N VAL 139.A O no hydrogen 3.040 N/A LYS 156.A N GLU 249.A O no hydrogen 2.785 N/A VAL 163.A N ASP 159.A O no hydrogen 3.245 N/A LYS 164.A N GLU 160.A O no hydrogen 2.747 N/A LYS 164.A NZ GLU 605.A OE1 no hydrogen 3.168 N/A LYS 164.A NZ GLU 605.A OE2 no hydrogen 3.073 N/A HIS 165.A N GLU 161.A O no hydrogen 3.010 N/A ILE 166.A N LEU 162.A O no hydrogen 3.078 N/A ALA 167.A N VAL 163.A O no hydrogen 2.801 N/A MET 168.A N LYS 164.A O no hydrogen 2.950 N/A HIS 169.A N HIS 165.A O no hydrogen 2.926 N/A HIS 169.A NE2 GLN 229.A OE1 no hydrogen 3.038 N/A VAL 170.A N ILE 166.A O no hydrogen 2.723 N/A ALA 171.A N ALA 167.A O no hydrogen 3.012 N/A ALA 172.A N MET 168.A O no hydrogen 3.169 N/A ALA 172.A N HIS 169.A O no hydrogen 2.946 N/A SER 173.A N HIS 169.A O no hydrogen 2.901 N/A LYS 174.A N VAL 170.A O no hydrogen 3.022 N/A GLU 176.A N VAL 224.A O no hydrogen 2.861 N/A PHE 177.A N VAL 224.A O no hydrogen 3.277 N/A LYS 179.A N ASP 182.A OD1 no hydrogen 2.860 N/A ASP 182.A N LYS 179.A O no hydrogen 2.886 N/A VAL 183.A N PRO 180.A O no hydrogen 3.471 N/A VAL 188.A N SER 184.A O no hydrogen 3.079 N/A TYR 192.A N VAL 188.A O no hydrogen 3.048 N/A GLN 193.A N LYS 190.A O no hydrogen 2.947 N/A VAL 194.A N LYS 190.A O no hydrogen 3.089 N/A GLN 195.A N GLU 191.A O no hydrogen 3.192 N/A LEU 196.A N TYR 192.A O no hydrogen 2.897 N/A MET 200.A N LEU 196.A O no hydrogen 3.008 N/A ALA 209.A N PRO 205.A O no hydrogen 2.653 N/A GLU 210.A N LYS 206.A O no hydrogen 2.980 N/A LYS 211.A N GLU 207.A O no hydrogen 3.401 N/A LYS 211.A NZ GLU 214.A OE2 no hydrogen 3.253 N/A MET 212.A N ILE 208.A O no hydrogen 2.899 N/A VAL 213.A N ALA 209.A O no hydrogen 3.119 N/A GLU 214.A N GLU 210.A O no hydrogen 2.823 N/A GLY 215.A N LYS 211.A O no hydrogen 3.060 N/A ARG 216.A N MET 212.A O no hydrogen 2.978 N/A ARG 216.A NE GLN 195.A OE1 no hydrogen 3.141 N/A ARG 216.A NH2 GLN 195.A OE1 no hydrogen 2.320 N/A MET 217.A N VAL 213.A O no hydrogen 2.843 N/A LYS 218.A N GLU 214.A O no hydrogen 3.333 N/A LYS 219.A N GLY 215.A O no hydrogen 3.385 N/A LYS 219.A NZ GLU 223.A OE2 no hydrogen 2.973 N/A PHE 220.A N ARG 216.A O no hydrogen 2.938 N/A THR 221.A OG1 MET 217.A O no hydrogen 2.853 N/A GLY 222.A N LYS 219.A O no hydrogen 3.445 N/A GLU 223.A N LYS 219.A O no hydrogen 3.278 N/A SER 225.A OG THR 221.A O no hydrogen 3.163 N/A LEU 226.A N PHE 177.A O no hydrogen 2.644 N/A THR 227.A N ILE 178.A O no hydrogen 2.913 N/A THR 227.A OG1 ILE 178.A O no hydrogen 3.159 N/A GLY 228.A N SER 225.A O no hydrogen 3.089 N/A GLN 229.A N LEU 226.A O no hydrogen 3.302 N/A GLN 229.A NE2 SER 173.A O no hydrogen 3.400 N/A GLN 229.A NE2 GLU 223.A O no hydrogen 3.524 N/A PHE 231.A N LYS 237.A O no hydrogen 2.984 N/A VAL 232.A N HIS 169.A ND1 no hydrogen 2.963 N/A GLU 234.A N PHE 231.A O no hydrogen 2.823 N/A LYS 237.A N GLU 234.A O no hydrogen 3.104 N/A LYS 237.A NZ GLU 234.A OE1 no hydrogen 3.044 N/A LYS 237.A NZ GLU 245.A OE1 no hydrogen 3.133 N/A LYS 237.A NZ GLU 245.A OE2 no hydrogen 3.198 N/A THR 238.A N GLN 241.A OE1 no hydrogen 3.453 N/A THR 238.A OG1 THR 227.A O no hydrogen 3.192 N/A VAL 239.A N GLN 229.A O no hydrogen 3.030 N/A GLY 240.A N THR 227.A O no hydrogen 3.010 N/A GLN 241.A N THR 238.A OG1 no hydrogen 3.141 N/A LEU 242.A N THR 238.A O no hydrogen 2.840 N/A LEU 243.A N VAL 239.A O no hydrogen 2.735 N/A LYS 244.A N GLY 240.A O no hydrogen 2.795 N/A GLU 245.A N GLN 241.A O no hydrogen 3.080 N/A GLU 245.A N LEU 242.A O no hydrogen 3.324 N/A HIS 246.A N LEU 242.A O no hydrogen 3.407 N/A HIS 246.A ND1 LEU 242.A O no hydrogen 3.284 N/A ALA 248.A N LEU 243.A O no hydrogen 2.829 N/A THR 251.A N ALA 154.A O no hydrogen 2.791 N/A ILE 254.A N LEU 152.A O no hydrogen 2.805 N/A ARG 255.A NE ALA 171.A O no hydrogen 3.257 N/A ARG 255.A NH1 GLU 257.A OE1 no hydrogen 3.207 N/A ARG 255.A NH2 ALA 171.A O no hydrogen 3.198 N/A ARG 255.A NH2 GLU 257.A OE1 no hydrogen 3.348 N/A PHE 256.A N GLY 150.A O no hydrogen 2.966 N/A GLU 257.A N GLU 260.A OE1 no hydrogen 3.250 N/A VAL 258.A N ARG 148.A O no hydrogen 2.886 N/A GLY 259.A N GLU 72.A OE2 no hydrogen 2.873 N/A GLU 260.A N GLU 257.A O no hydrogen 3.152 N/A ILE 262.A N GLY 259.A O no hydrogen 2.854 N/A THR 267.A OG1 GLU 272.A OE2 no hydrogen 2.627 N/A ALA 270.A N SER 322.A OG no hydrogen 3.242 N/A ALA 271.A N ASP 268.A OD1 no hydrogen 3.336 N/A GLU 272.A N ASP 268.A O no hydrogen 2.946 N/A VAL 273.A N PHE 269.A O no hydrogen 2.938 N/A ALA 274.A N ALA 270.A O no hydrogen 2.766 N/A ALA 275.A N ALA 271.A O no hydrogen 2.744 N/A MET 276.A N GLU 272.A O no hydrogen 3.239 N/A MET 276.A N VAL 273.A O no hydrogen 3.177 N/A SER 277.A N ALA 274.A O no hydrogen 3.115 N/A SER 277.A OG VAL 273.A O no hydrogen 3.053 N/A PHE 284.A N SER 280.A O no hydrogen 2.723 N/A GLU 285.A N GLU 282.A O no hydrogen 3.242 N/A THR 287.A N PHE 284.A O no hydrogen 3.045 N/A THR 287.A OG1 LYS 283.A O no hydrogen 2.379 N/A LYS 288.A N GLU 285.A O no hydrogen 3.519 N/A LYS 288.A NZ ASP 327.A OD1 no hydrogen 3.432 N/A LYS 288.A NZ THR 328.A O no hydrogen 3.143 N/A HIS 290.A ND1 LYS 288.A O no hydrogen 3.099 N/A VAL 291.A N HIS 332.A O no hydrogen 2.925 N/A ASN 292.A N ASP 356.A OD2 no hydrogen 2.891 N/A ASN 292.A ND2 ASP 356.A OD2 no hydrogen 3.507 N/A VAL 293.A N ALA 334.A O no hydrogen 2.881 N/A THR 295.A N VAL 336.A O no hydrogen 3.143 N/A THR 295.A OG1 ASP 337.A OD1 no hydrogen 3.323 N/A ILE 296.A N ILE 359.A O no hydrogen 3.143 N/A HIS 301.A NE2 ASP 366.A OD2 no hydrogen 2.909 N/A GLY 302.A N VAL 299.A O no hydrogen 3.320 N/A LYS 303.A NZ GLY 297.A O no hydrogen 3.144 N/A LYS 303.A NZ ASP 337.A OD1 no hydrogen 3.474 N/A THR 305.A OG1 GLY 302.A O no hydrogen 3.145 N/A LEU 306.A N GLY 302.A O no hydrogen 3.185 N/A THR 307.A N LYS 303.A O no hydrogen 3.060 N/A THR 307.A OG1 HIS 335.A ND1 no hydrogen 3.043 N/A ALA 308.A N THR 304.A O no hydrogen 3.270 N/A ALA 309.A N THR 305.A O no hydrogen 2.983 N/A ILE 310.A N LEU 306.A O no hydrogen 2.851 N/A THR 311.A N THR 307.A O no hydrogen 3.298 N/A THR 311.A OG1 THR 307.A O no hydrogen 2.906 N/A THR 312.A N ALA 308.A O no hydrogen 3.413 N/A THR 312.A OG1 ALA 308.A O no hydrogen 3.474 N/A THR 312.A OG1 ALA 309.A O no hydrogen 3.281 N/A VAL 313.A N ALA 309.A O no hydrogen 2.961 N/A LEU 314.A N ILE 310.A O no hydrogen 3.379 N/A ALA 315.A N THR 311.A O no hydrogen 3.136 N/A LYS 316.A N THR 312.A O no hydrogen 2.728 N/A THR 317.A N VAL 313.A O no hydrogen 2.952 N/A THR 317.A OG1 VAL 313.A O no hydrogen 3.284 N/A TYR 318.A N LEU 314.A O no hydrogen 3.076 N/A GLY 319.A N ALA 315.A O no hydrogen 2.795 N/A THR 321.A OG1 THR 321.A O no hydrogen 2.573 N/A SER 322.A OG ASP 268.A OD1 no hydrogen 3.022 N/A HIS 323.A ND1 THR 321.A O no hydrogen 3.195 N/A HIS 323.A NE2 GLU 325.A OE1 no hydrogen 3.271 N/A VAL 324.A N HIS 335.A O no hydrogen 2.670 N/A THR 328.A N ARG 331.A O no hydrogen 3.014 N/A THR 328.A OG1 ARG 331.A O no hydrogen 3.189 N/A THR 328.A OG1 ASP 453.A OD1 no hydrogen 3.016 N/A THR 328.A OG1 ASP 453.A OD2 no hydrogen 3.144 N/A ARG 331.A N THR 328.A O no hydrogen 3.309 N/A ARG 331.A N THR 328.A OG1 no hydrogen 3.345 N/A ARG 331.A NH1 ILE 456.A O no hydrogen 2.664 N/A HIS 332.A N PRO 289.A O no hydrogen 2.879 N/A TYR 333.A N TYR 326.A O no hydrogen 2.987 N/A TYR 333.A OH ASP 453.A OD1 no hydrogen 2.493 N/A ALA 334.A N VAL 291.A O no hydrogen 2.794 N/A HIS 335.A N VAL 324.A O no hydrogen 2.373 N/A VAL 336.A N VAL 293.A O no hydrogen 3.118 N/A CYS 338.A N THR 295.A O no hydrogen 3.267 N/A HIS 341.A N ASP 78.A OD1 no hydrogen 2.925 N/A HIS 341.A N ASP 78.A OD2 no hydrogen 3.073 N/A HIS 341.A NE2 GLN 381.A OE1 no hydrogen 3.080 N/A ALA 342.A N ASP 78.A OD2 no hydrogen 3.133 N/A TYR 344.A N GLY 340.A O no hydrogen 3.419 N/A VAL 345.A N HIS 341.A O no hydrogen 3.440 N/A LYS 346.A N ALA 342.A O no hydrogen 3.032 N/A ASN 347.A N ASP 343.A O no hydrogen 3.319 N/A MET 348.A N TYR 344.A O no hydrogen 2.585 N/A ILE 349.A N VAL 345.A O no hydrogen 2.987 N/A ILE 349.A N LYS 346.A O no hydrogen 3.216 N/A THR 350.A N LYS 346.A O no hydrogen 3.034 N/A THR 350.A OG1 LYS 346.A O no hydrogen 3.477 N/A THR 350.A OG1 ASN 347.A O no hydrogen 3.308 N/A GLY 351.A N ASN 347.A O no hydrogen 3.030 N/A ALA 352.A N THR 350.A OG1 no hydrogen 3.194 N/A MET 355.A N TYR 344.A OH no hydrogen 3.114 N/A ASP 356.A N ASN 292.A O no hydrogen 2.697 N/A ALA 358.A N TYR 386.A O no hydrogen 3.026 N/A ILE 359.A N GLY 294.A O no hydrogen 2.733 N/A VAL 361.A N ILE 296.A O no hydrogen 3.306 N/A VAL 362.A N PHE 390.A O no hydrogen 3.365 N/A ALA 363.A N HIS 301.A ND1 no hydrogen 3.115 N/A ALA 364.A N ASN 392.A O no hydrogen 2.796 N/A ASP 366.A N ALA 363.A O no hydrogen 2.873 N/A GLY 367.A N ALA 363.A O no hydrogen 2.869 N/A MET 369.A N THR 372.A OG1 no hydrogen 2.796 N/A GLN 371.A N GLN 371.A OE1 no hydrogen 2.642 N/A GLN 371.A NE2 ILE 123.A O no hydrogen 3.014 N/A GLN 371.A NE2 HIS 298.A ND1 no hydrogen 2.992 N/A THR 372.A N MET 369.A O no hydrogen 3.034 N/A ARG 373.A N PRO 370.A O no hydrogen 3.441 N/A ARG 373.A NH1 GLN 416.A OE1 no hydrogen 3.303 N/A ARG 373.A NH2 GLN 416.A OE1 no hydrogen 2.533 N/A HIS 375.A N GLN 371.A O no hydrogen 3.078 N/A ILE 376.A N THR 372.A O no hydrogen 3.055 N/A LEU 377.A N ARG 373.A O no hydrogen 2.929 N/A LEU 378.A N GLU 374.A O no hydrogen 2.934 N/A GLY 379.A N HIS 375.A O no hydrogen 3.498 N/A ARG 380.A N ILE 376.A O no hydrogen 3.267 N/A ARG 380.A NE TYR 417.A O no hydrogen 3.206 N/A ARG 380.A NH2 TYR 417.A O no hydrogen 3.032 N/A GLN 381.A N LEU 377.A O no hydrogen 2.975 N/A VAL 382.A N LEU 378.A O no hydrogen 3.051 N/A GLY 383.A N ARG 380.A O no hydrogen 3.173 N/A VAL 384.A N GLY 379.A O no hydrogen 2.779 N/A ILE 388.A N ALA 358.A O no hydrogen 2.943 N/A VAL 389.A N PRO 425.A O no hydrogen 2.990 N/A PHE 390.A N LEU 360.A O no hydrogen 2.988 N/A LEU 391.A N VAL 427.A O no hydrogen 2.957 N/A ASN 392.A N VAL 362.A O no hydrogen 2.878 N/A ASN 392.A ND2 HIS 301.A O no hydrogen 2.847 N/A CYS 394.A N GLY 429.A O no hydrogen 3.123 N/A CYS 394.A SG LEU 391.A O no hydrogen 3.270 N/A CYS 394.A SG GLY 429.A O no hydrogen 3.234 N/A MET 396.A N LYS 393.A O no hydrogen 3.447 N/A VAL 397.A N CYS 394.A O no hydrogen 3.224 N/A LEU 402.A N ASP 399.A O no hydrogen 3.158 N/A GLU 404.A N GLU 400.A O no hydrogen 3.236 N/A LEU 405.A N GLU 401.A O no hydrogen 3.190 N/A VAL 406.A N LEU 402.A O no hydrogen 3.240 N/A VAL 406.A N LEU 403.A O no hydrogen 3.219 N/A GLU 407.A N LEU 403.A O no hydrogen 3.123 N/A MET 408.A N GLU 404.A O no hydrogen 3.005 N/A GLU 409.A N LEU 405.A O no hydrogen 3.406 N/A VAL 410.A N VAL 406.A O no hydrogen 2.969 N/A ARG 411.A N GLU 407.A O no hydrogen 2.712 N/A ARG 411.A NH1 GLY 421.A O no hydrogen 2.788 N/A GLU 412.A N MET 408.A O no hydrogen 2.998 N/A LEU 413.A N GLU 409.A O no hydrogen 3.026 N/A LEU 414.A N VAL 410.A O no hydrogen 2.923 N/A SER 415.A N ARG 411.A O no hydrogen 2.974 N/A SER 415.A OG ARG 411.A O no hydrogen 2.807 N/A GLN 416.A N GLU 412.A O no hydrogen 2.876 N/A TYR 417.A N LEU 414.A O no hydrogen 2.919 N/A ASP 418.A N SER 415.A O no hydrogen 3.309 N/A PHE 419.A N LEU 414.A O no hydrogen 3.056 N/A ASP 423.A N PRO 420.A O no hydrogen 2.954 N/A THR 424.A N GLY 421.A O no hydrogen 3.372 N/A THR 424.A OG1 PRO 420.A O no hydrogen 2.604 N/A VAL 427.A N VAL 389.A O no hydrogen 2.980 N/A ARG 428.A NH1 GLU 400.A OE2 no hydrogen 3.029 N/A ARG 428.A NH2 GLU 400.A OE2 no hydrogen 3.334 N/A GLY 429.A N LEU 391.A O no hydrogen 3.169 N/A SER 430.A OG ASP 395.A OD1 no hydrogen 3.259 N/A ALA 431.A N ASN 392.A OD1 no hydrogen 2.730 N/A ALA 434.A N ALA 431.A O no hydrogen 2.916 N/A GLU 436.A N GLU 436.A OE1 no hydrogen 2.328 N/A GLU 440.A N ASP 438.A OD1 no hydrogen 3.207 N/A TRP 441.A N ASP 438.A O no hydrogen 2.999 N/A GLU 442.A N ASP 438.A O no hydrogen 2.523 N/A ALA 443.A N ALA 439.A O no hydrogen 2.708 N/A LYS 444.A N TRP 441.A O no hydrogen 3.208 N/A LYS 444.A NZ GLU 447.A OE1 no hydrogen 2.608 N/A ILE 445.A N TRP 441.A O no hydrogen 3.381 N/A LEU 446.A N GLU 442.A O no hydrogen 3.383 N/A GLU 447.A N ALA 443.A O no hydrogen 2.907 N/A LEU 448.A N LYS 444.A O no hydrogen 3.043 N/A ALA 449.A N ILE 445.A O no hydrogen 3.031 N/A GLY 450.A N LEU 446.A O no hydrogen 2.839 N/A PHE 451.A N GLU 447.A O no hydrogen 3.145 N/A LEU 452.A N LEU 448.A O no hydrogen 3.027 N/A ASP 453.A N ALA 449.A O no hydrogen 3.113 N/A SER 454.A N GLY 450.A O no hydrogen 2.811 N/A SER 454.A OG GLY 450.A O no hydrogen 2.791 N/A SER 454.A OG PHE 451.A O no hydrogen 3.290 N/A TYR 455.A N PHE 451.A O no hydrogen 2.349 N/A ASP 464.A N ARG 461.A O no hydrogen 2.887 N/A LYS 465.A N ALA 462.A O no hydrogen 3.309 N/A LYS 465.A NZ GLU 460.A OE1 no hydrogen 2.815 N/A LEU 468.A N ARG 490.A O no hydrogen 2.884 N/A LEU 469.A N LEU 549.A O no hydrogen 2.917 N/A ILE 471.A N GLN 547.A O no hydrogen 3.031 N/A GLU 472.A N THR 485.A O no hydrogen 2.823 N/A VAL 474.A N ASP 473.A OD1 no hydrogen 2.821 N/A PHE 475.A N VAL 483.A O no hydrogen 2.894 N/A ILE 477.A N GLY 481.A O no hydrogen 3.126 N/A ARG 480.A N ILE 477.A O no hydrogen 2.844 N/A ARG 480.A NH1 GLU 516.A OE1 no hydrogen 3.005 N/A ARG 480.A NH1 GLU 516.A OE2 no hydrogen 2.523 N/A ARG 480.A NH2 GLU 516.A OE1 no hydrogen 2.625 N/A GLY 481.A N ILE 477.A O no hydrogen 3.086 N/A THR 482.A OG1 ILE 538.A O no hydrogen 2.883 N/A VAL 483.A N PHE 475.A O no hydrogen 3.001 N/A VAL 484.A N VAL 533.A O no hydrogen 3.152 N/A THR 485.A N ASP 473.A O no hydrogen 3.322 N/A GLY 486.A N VAL 531.A O no hydrogen 3.218 N/A VAL 488.A N GLU 529.A O no hydrogen 3.157 N/A GLU 489.A N LEU 468.A O no hydrogen 2.916 N/A ARG 490.A N LEU 468.A O no hydrogen 3.343 N/A GLY 491.A N ALA 462.A O no hydrogen 2.970 N/A ILE 493.A N GLY 525.A O no hydrogen 2.998 N/A LYS 494.A N GLU 497.A OE1 no hydrogen 2.983 N/A VAL 495.A N ASP 523.A O no hydrogen 3.133 N/A GLY 496.A N CYS 512.A O no hydrogen 2.822 N/A GLU 497.A N LYS 494.A O no hydrogen 3.050 N/A VAL 499.A N SER 510.A O no hydrogen 2.676 N/A GLU 500.A N ALA 550.A O no hydrogen 2.766 N/A ILE 501.A N GLN 508.A O no hydrogen 2.568 N/A VAL 502.A N VAL 548.A O no hydrogen 2.994 N/A ILE 504.A N PRO 622.A O no hydrogen 2.685 N/A LYS 505.A N GLY 503.A O no hydrogen 2.551 N/A GLU 506.A N GLU 506.A OE1 no hydrogen 2.414 N/A GLN 508.A N ILE 501.A O no hydrogen 3.139 N/A SER 510.A N VAL 499.A O no hydrogen 2.797 N/A SER 510.A OG ARG 536.A O no hydrogen 2.659 N/A CYS 512.A N GLU 497.A O no hydrogen 2.902 N/A CYS 512.A SG LYS 494.A O no hydrogen 3.832 N/A CYS 512.A SG LEU 534.A O no hydrogen 4.014 N/A THR 513.A N LEU 534.A O no hydrogen 2.824 N/A GLU 516.A N GLY 532.A O no hydrogen 2.945 N/A MET 517.A N LYS 520.A O no hydrogen 3.061 N/A LEU 522.A N VAL 515.A O no hydrogen 3.095 N/A GLY 525.A N ILE 493.A O no hydrogen 2.597 N/A ARG 526.A N GLU 529.A OE1 no hydrogen 2.889 N/A GLY 528.A N VAL 488.A O no hydrogen 2.765 N/A GLU 529.A N ARG 526.A O no hydrogen 3.100 N/A VAL 531.A N GLY 486.A O no hydrogen 3.079 N/A GLY 532.A N GLU 516.A O no hydrogen 2.893 N/A VAL 533.A N VAL 484.A O no hydrogen 2.796 N/A LEU 534.A N GLY 514.A O no hydrogen 2.753 N/A LEU 535.A N THR 482.A O no hydrogen 2.953 N/A ARG 536.A N THR 511.A O no hydrogen 2.916 N/A ILE 538.A N ARG 536.A O no hydrogen 2.764 N/A ARG 540.A NE VAL 474.A O no hydrogen 3.238 N/A GLU 542.A N LYS 539.A O no hydrogen 3.087 N/A ILE 543.A N ARG 540.A O no hydrogen 3.273 N/A GLU 544.A N GLN 547.A OE1 no hydrogen 2.934 N/A ARG 545.A NE GLU 472.A O no hydrogen 2.947 N/A ARG 545.A NH1 THR 591.A O no hydrogen 2.692 N/A GLN 547.A N GLU 544.A O no hydrogen 3.246 N/A GLN 547.A NE2 GLY 503.A O no hydrogen 2.984 N/A VAL 548.A N VAL 502.A O no hydrogen 3.098 N/A LEU 549.A N LEU 469.A O no hydrogen 3.017 N/A ALA 550.A N GLU 500.A O no hydrogen 2.983 N/A LYS 551.A N PHE 467.A O no hydrogen 3.324 N/A GLY 553.A N GLU 500.A OE1 no hydrogen 2.964 N/A THR 554.A N LYS 551.A O no hydrogen 3.086 N/A THR 554.A OG1 LYS 551.A O no hydrogen 3.061 N/A HIS 558.A N ILE 623.A O no hydrogen 3.218 N/A THR 559.A OG1 LEU 619.A O no hydrogen 3.187 N/A PHE 561.A N VAL 617.A O no hydrogen 2.923 N/A GLU 562.A N LYS 647.A O no hydrogen 2.629 N/A SER 563.A N MET 615.A O no hydrogen 3.132 N/A SER 563.A OG MET 615.A O no hydrogen 3.057 N/A GLU 564.A N VAL 644.A O no hydrogen 3.123 N/A VAL 565.A N ILE 613.A O no hydrogen 2.835 N/A TYR 566.A N ALA 642.A O no hydrogen 2.838 N/A TYR 566.A OH GLU 572.A OE1 no hydrogen 2.839 N/A TYR 566.A OH GLU 572.A OE2 no hydrogen 2.988 N/A ILE 567.A N ASP 611.A O no hydrogen 3.202 N/A LEU 568.A N VAL 640.A O no hydrogen 2.870 N/A SER 569.A N GLU 572.A OE1 no hydrogen 3.085 N/A GLU 572.A N SER 569.A OG no hydrogen 3.326 N/A GLY 573.A N LYS 570.A O no hydrogen 2.967 N/A GLY 574.A N SER 569.A O no hydrogen 2.972 N/A ARG 575.A NE THR 577.A O no hydrogen 2.947 N/A ARG 575.A NH1 THR 577.A O no hydrogen 3.052 N/A ARG 575.A NH2 GLU 635.A OE2 no hydrogen 2.830 N/A PHE 579.A N VAL 607.A O no hydrogen 3.075 N/A TYR 583.A N PHE 580.A O no hydrogen 3.196 N/A TYR 583.A OH GLU 635.A OE2 no hydrogen 2.795 N/A GLN 586.A N ARG 634.A O no hydrogen 2.903 N/A GLN 586.A NE2 THR 595.A OG1 no hydrogen 2.608 N/A PHE 587.A N VAL 594.A O no hydrogen 2.857 N/A TYR 588.A N ALA 632.A O no hydrogen 2.724 N/A PHE 589.A N THR 592.A O no hydrogen 2.927 N/A ARG 590.A NE GLU 489.A OE1 no hydrogen 3.178 N/A ARG 590.A NH1 ALA 624.A O no hydrogen 2.727 N/A THR 591.A N PHE 589.A O no hydrogen 2.699 N/A THR 591.A OG1 ILE 471.A O no hydrogen 3.371 N/A VAL 594.A N PHE 587.A O no hydrogen 2.756 N/A GLY 596.A N PRO 585.A O no hydrogen 3.265 N/A THR 597.A N THR 618.A O no hydrogen 3.064 N/A THR 597.A OG1 THR 618.A O no hydrogen 3.485 N/A VAL 604.A N PRO 601.A O no hydrogen 3.125 N/A VAL 607.A N PHE 579.A O no hydrogen 2.985 N/A MET 608.A N ASP 611.A OD2 no hydrogen 2.919 N/A GLY 610.A N ILE 567.A O no hydrogen 2.643 N/A ASN 612.A ND2 ALA 342.A O no hydrogen 3.484 N/A ILE 613.A N VAL 565.A O no hydrogen 3.043 N/A MET 615.A N SER 563.A O no hydrogen 3.086 N/A VAL 616.A N GLU 599.A O no hydrogen 3.256 N/A VAL 617.A N PHE 561.A O no hydrogen 2.787 N/A THR 618.A N THR 597.A O no hydrogen 2.920 N/A LEU 619.A N THR 559.A O no hydrogen 2.682 N/A ILE 620.A N THR 595.A O no hydrogen 2.729 N/A ILE 623.A N HIS 558.A O no hydrogen 2.884 N/A MET 625.A N LYS 556.A O no hydrogen 3.441 N/A GLY 628.A N VAL 645.A O no hydrogen 2.720 N/A LEU 629.A N ASP 626.A O no hydrogen 3.190 N/A ARG 630.A NE ILE 349.A O no hydrogen 3.113 N/A ARG 630.A NH2 MET 348.A O no hydrogen 2.717 N/A PHE 631.A N GLY 643.A O no hydrogen 3.164 N/A ALA 632.A N TYR 588.A O no hydrogen 3.221 N/A ILE 633.A N GLY 641.A O no hydrogen 2.580 N/A ARG 634.A N GLN 586.A O no hydrogen 2.723 N/A ARG 634.A NE ASP 593.A OD1 no hydrogen 3.441 N/A ARG 634.A NH1 GLY 637.A O no hydrogen 3.407 N/A ARG 634.A NH2 ASP 593.A OD2 no hydrogen 2.344 N/A GLU 635.A N ARG 638.A O no hydrogen 2.922 N/A ARG 638.A NH1 GLY 574.A O no hydrogen 3.026 N/A VAL 640.A N ILE 633.A O no hydrogen 2.765 N/A GLY 641.A N ILE 633.A O no hydrogen 3.191 N/A ALA 642.A N TYR 566.A O no hydrogen 2.974 N/A GLY 643.A N PHE 631.A O no hydrogen 2.831 N/A VAL 644.A N GLU 564.A O no hydrogen 2.774 N/A VAL 645.A N LEU 629.A O no hydrogen 2.794 N/A ALA 646.A N GLU 562.A O no hydrogen 2.744 N/A LYS 647.A N GLU 562.A O no hydrogen 3.159 N/A VAL 648.A N ASP 627.A OD1 no hydrogen 3.041 N/A LEU 649.A N LYS 560.A O no hydrogen 3.020 N/A