Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2fgh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N HIS 3.A ND1 no hydrogen 3.506 N/A PHE 6.A N HIS 3.A O no hydrogen 2.724 N/A LYS 8.A NZ GLU 5.A OE2 no hydrogen 3.278 N/A ALA 9.A N PHE 6.A O no hydrogen 3.119 N/A GLY 10.A N GLN 16.A OE1 no hydrogen 3.070 N/A LYS 11.A NZ PHE 6.A O no hydrogen 3.565 N/A LYS 11.A NZ LEU 7.A O no hydrogen 3.196 N/A LYS 11.A NZ ALA 9.A O no hydrogen 3.246 N/A LYS 11.A NZ TYR 85.A OH no hydrogen 2.777 N/A GLY 14.A N THR 47.A O no hydrogen 3.055 N/A GLN 16.A N LEU 45.A O no hydrogen 2.781 N/A GLN 16.A NE2 LYS 8.A O no hydrogen 2.786 N/A ILE 17.A N TYR 33.A OH no hydrogen 3.179 N/A TRP 18.A N VAL 43.A O no hydrogen 2.950 N/A TRP 18.A NE1 GLU 5.A OE1 no hydrogen 2.877 N/A ARG 19.A N VAL 26.A O no hydrogen 2.760 N/A ARG 19.A NE ASP 40.A OD1 no hydrogen 2.723 N/A ARG 19.A NH1 GLU 21.A OE2 no hydrogen 3.052 N/A ARG 19.A NH1 PHE 123.A O no hydrogen 3.565 N/A ARG 19.A NH2 ASP 40.A OD1 no hydrogen 2.719 N/A ARG 19.A NH2 PHE 123.A O no hydrogen 2.546 N/A VAL 20.A N ALA 41.A O no hydrogen 2.820 N/A GLU 21.A N ASP 24.A O no hydrogen 2.980 N/A LYS 22.A N GLU 71.A OE2 no hydrogen 3.409 N/A LEU 25.A N ASP 24.A OD1 no hydrogen 2.801 N/A VAL 26.A N ARG 19.A O no hydrogen 3.112 N/A VAL 28.A N ILE 17.A O no hydrogen 2.935 N/A ASN 31.A ND2 ASN 197.A O no hydrogen 2.980 N/A LEU 32.A N PRO 29.A O no hydrogen 3.058 N/A TYR 33.A N PRO 30.A O no hydrogen 3.262 N/A ASP 35.A N LEU 32.A O no hydrogen 2.800 N/A PHE 36.A N LYS 113.A O no hydrogen 2.868 N/A PHE 37.A N TYR 42.A OH no hydrogen 2.947 N/A THR 38.A N LYS 115.A O no hydrogen 2.884 N/A THR 38.A OG1 GLN 97.A OE1 no hydrogen 3.021 N/A THR 38.A OG1 LYS 115.A O no hydrogen 3.278 N/A GLY 39.A N GLY 117.A O no hydrogen 2.996 N/A ASP 40.A N PHE 37.A O no hydrogen 3.301 N/A TYR 42.A N TRP 62.A O no hydrogen 2.880 N/A VAL 43.A N TRP 18.A O no hydrogen 2.854 N/A ILE 44.A N HIS 60.A O no hydrogen 2.699 N/A LEU 45.A N GLN 16.A O no hydrogen 2.851 N/A LYS 46.A N ASP 58.A O no hydrogen 3.043 N/A THR 47.A N GLY 14.A O no hydrogen 2.817 N/A VAL 48.A N GLN 56.A O no hydrogen 2.838 N/A GLN 49.A NE2 GLY 53.A O no hydrogen 3.137 N/A LEU 50.A N ILE 54.A O no hydrogen 3.072 N/A ARG 51.A NH1 ASP 598.A OD2 no hydrogen 3.140 N/A ARG 51.A NH2 ASP 598.A OD2 no hydrogen 3.360 N/A GLY 53.A N LEU 50.A O no hydrogen 3.016 N/A ILE 54.A N ASN 52.A OD1 no hydrogen 2.933 N/A GLN 56.A N VAL 48.A O no hydrogen 2.841 N/A GLN 56.A NE2 LEU 349.A O no hydrogen 2.890 N/A TYR 57.A OH GLY 10.A O no hydrogen 2.688 N/A ASP 58.A N LYS 46.A O no hydrogen 2.986 N/A LEU 59.A N VAL 91.A O no hydrogen 2.746 N/A HIS 60.A N ILE 44.A O no hydrogen 2.828 N/A TYR 61.A N HIS 93.A O no hydrogen 2.910 N/A TRP 62.A N TYR 42.A O no hydrogen 3.006 N/A TRP 62.A NE1 GLU 100.A OE1 no hydrogen 2.812 N/A LEU 63.A N GLU 95.A O no hydrogen 2.923 N/A GLY 64.A N ASP 40.A O no hydrogen 3.009 N/A ASN 65.A N GLN 97.A OE1 no hydrogen 3.095 N/A GLU 66.A N THR 38.A O no hydrogen 2.906 N/A CYS 67.A N GLY 64.A O no hydrogen 3.143 N/A CYS 67.A SG SER 68.A O no hydrogen 3.601 N/A SER 72.A OG SER 68.A O no hydrogen 2.814 N/A SER 72.A OG GLN 69.A O no hydrogen 3.253 N/A GLY 73.A N GLN 69.A O no hydrogen 3.355 N/A ALA 74.A N ASP 70.A O no hydrogen 3.019 N/A ALA 75.A N GLU 71.A O no hydrogen 3.169 N/A ALA 76.A N SER 72.A O no hydrogen 3.245 N/A ILE 77.A N GLY 73.A O no hydrogen 2.869 N/A PHE 78.A N ALA 74.A O no hydrogen 2.862 N/A THR 79.A N ALA 75.A O no hydrogen 2.912 N/A THR 79.A OG1 ALA 75.A O no hydrogen 2.751 N/A VAL 80.A N ALA 76.A O no hydrogen 3.017 N/A GLN 81.A N ILE 77.A O no hydrogen 2.974 N/A LEU 82.A N PHE 78.A O no hydrogen 2.714 N/A ASP 83.A N THR 79.A O no hydrogen 2.847 N/A ASP 84.A N VAL 80.A O no hydrogen 2.975 N/A TYR 85.A N GLN 81.A O no hydrogen 3.097 N/A LEU 86.A N LEU 82.A O no hydrogen 2.979 N/A ASN 87.A N ASP 84.A O no hydrogen 3.045 N/A GLY 88.A N ASP 83.A O no hydrogen 2.871 N/A ARG 89.A N LEU 86.A O no hydrogen 3.508 N/A ARG 89.A NH1 LEU 55.A O no hydrogen 3.201 N/A VAL 91.A N TYR 57.A O no hydrogen 3.046 N/A GLN 92.A N VAL 318.A O no hydrogen 2.995 N/A HIS 93.A N LEU 59.A O no hydrogen 2.625 N/A ARG 94.A N VAL 316.A O no hydrogen 2.970 N/A ARG 94.A NH1 LYS 312.A O no hydrogen 3.001 N/A ARG 94.A NH2 LYS 312.A O no hydrogen 3.346 N/A GLU 95.A N TYR 61.A O no hydrogen 2.786 N/A GLN 97.A N LEU 63.A O no hydrogen 3.038 N/A GLY 98.A N TYR 114.A OH no hydrogen 3.298 N/A PHE 99.A N VAL 96.A O no hydrogen 2.780 N/A GLU 100.A N GLU 100.A OE2 no hydrogen 2.910 N/A SER 101.A N GLU 95.A OE2 no hydrogen 2.745 N/A SER 101.A OG GLU 95.A OE1 no hydrogen 2.721 N/A SER 101.A OG GLU 95.A OE2 no hydrogen 3.307 N/A PHE 104.A N SER 101.A OG no hydrogen 3.279 N/A LEU 105.A N SER 101.A O no hydrogen 3.128 N/A GLY 106.A N ALA 102.A O no hydrogen 3.105 N/A TYR 107.A N PHE 104.A O no hydrogen 3.060 N/A TYR 107.A OH HIS 60.A NE2 no hydrogen 3.026 N/A PHE 108.A N LEU 105.A O no hydrogen 2.958 N/A LYS 109.A NZ PRO 624.A O no hydrogen 3.004 N/A LYS 109.A NZ ASP 631.A OD2 no hydrogen 2.703 N/A GLY 111.A N PHE 108.A O no hydrogen 3.206 N/A LEU 112.A N VAL 145.A O no hydrogen 3.128 N/A LYS 113.A N GLY 34.A O no hydrogen 2.863 N/A LYS 113.A NZ ASP 35.A OD1 no hydrogen 3.002 N/A LYS 113.A NZ ASP 35.A OD2 no hydrogen 3.493 N/A LYS 113.A NZ GLU 198.A OE1 no hydrogen 2.591 N/A TYR 114.A N ALA 147.A O no hydrogen 3.061 N/A TYR 114.A OH GLU 100.A OE1 no hydrogen 2.864 N/A LYS 115.A N PHE 36.A O no hydrogen 2.850 N/A LYS 115.A NZ GLU 149.A OE1 no hydrogen 2.815 N/A LYS 116.A N GLU 149.A OE2 no hydrogen 3.021 N/A VAL 119.A N ASP 40.A OD2 no hydrogen 2.875 N/A SER 121.A OG GLY 118.A O no hydrogen 3.488 N/A GLY 122.A N VAL 119.A O no hydrogen 3.124 N/A PHE 123.A N GLY 118.A O no hydrogen 2.889 N/A ARG 135.A N ASP 166.A O no hydrogen 3.009 N/A ARG 135.A NE ASP 166.A OD2 no hydrogen 2.947 N/A ARG 135.A NH1 GLU 149.A OE1 no hydrogen 2.949 N/A ARG 135.A NH2 ASP 166.A OD2 no hydrogen 2.998 N/A ARG 135.A NH2 GLU 198.A OE1 no hydrogen 2.830 N/A LEU 137.A N ILE 164.A O no hydrogen 2.899 N/A GLN 138.A N THR 148.A O no hydrogen 2.895 N/A VAL 139.A N CYS 162.A O no hydrogen 2.865 N/A LYS 140.A N ARG 146.A O no hydrogen 3.099 N/A ARG 142.A NE ASP 636.A OD2 no hydrogen 3.276 N/A ARG 142.A NH1 ASN 180.A OD1 no hydrogen 2.944 N/A ARG 142.A NH1 GLU 183.A OE1 no hydrogen 2.977 N/A ARG 142.A NH2 ASP 636.A OD2 no hydrogen 3.274 N/A ARG 143.A NH1 ASP 636.A OD2 no hydrogen 3.555 N/A ARG 143.A NH2 ASP 636.A OD2 no hydrogen 3.301 N/A ARG 146.A N LYS 140.A O no hydrogen 2.948 N/A ARG 146.A NE TYR 114.A OH no hydrogen 2.999 N/A ARG 146.A NH2 GLU 100.A OE2 no hydrogen 2.952 N/A ALA 147.A N LEU 112.A O no hydrogen 2.928 N/A THR 148.A N GLN 138.A O no hydrogen 2.887 N/A GLU 149.A N TYR 114.A O no hydrogen 2.918 N/A VAL 150.A N LEU 136.A O no hydrogen 2.853 N/A TRP 154.A NE1 GLY 222.A O no hydrogen 3.080 N/A GLU 155.A N SER 153.A OG no hydrogen 2.998 N/A SER 156.A N SER 153.A O no hydrogen 3.091 N/A SER 156.A OG PRO 151.A O no hydrogen 2.527 N/A PHE 157.A N TRP 154.A O no hydrogen 3.152 N/A ASN 158.A ND2 ASP 161.A OD1 no hydrogen 2.913 N/A ASN 159.A N PRO 228.A O no hydrogen 2.885 N/A ASN 159.A ND2 GLU 229.A OE2 no hydrogen 3.007 N/A GLY 160.A N ASN 158.A OD1 no hydrogen 2.935 N/A ASP 161.A N ASN 158.A OD1 no hydrogen 2.760 N/A PHE 163.A N TRP 174.A O no hydrogen 2.790 N/A ILE 164.A N LEU 137.A O no hydrogen 2.862 N/A LEU 165.A N TYR 172.A O no hydrogen 2.772 N/A ASP 166.A N ARG 135.A O no hydrogen 2.880 N/A LEU 167.A N ASN 170.A O no hydrogen 2.973 N/A GLY 168.A N ASP 166.A OD1 no hydrogen 3.057 N/A ILE 171.A N GLN 204.A O no hydrogen 3.065 N/A TYR 172.A N LEU 165.A O no hydrogen 2.960 N/A GLN 173.A N SER 206.A O no hydrogen 3.110 N/A GLN 173.A NE2 ARG 184.A O no hydrogen 3.645 N/A TRP 174.A N PHE 163.A O no hydrogen 2.694 N/A TRP 174.A NE1 GLU 213.A OE1 no hydrogen 2.824 N/A CYS 175.A N PHE 208.A O no hydrogen 3.169 N/A GLY 176.A N ASP 161.A O no hydrogen 3.043 N/A SER 177.A N GLU 210.A OE1 no hydrogen 3.013 N/A SER 177.A OG GLU 210.A OE1 no hydrogen 2.985 N/A LYS 178.A N ASN 159.A O no hydrogen 2.895 N/A LYS 178.A NZ GLU 229.A OE1 no hydrogen 3.504 N/A SER 179.A N GLY 176.A O no hydrogen 3.149 N/A SER 179.A OG GLY 176.A O no hydrogen 2.897 N/A ARG 181.A NH2 ASP 710.A OD2 no hydrogen 3.086 N/A ARG 181.A NH2 ASP 713.A OD1 no hydrogen 3.462 N/A GLU 183.A N ASN 180.A OD1 no hydrogen 2.915 N/A ARG 184.A N ASN 180.A O no hydrogen 3.310 N/A ARG 184.A NE SER 179.A OG no hydrogen 2.918 N/A ARG 184.A NH2 SER 179.A OG no hydrogen 3.375 N/A LEU 185.A N ARG 181.A O no hydrogen 3.179 N/A LYS 186.A N PHE 182.A O no hydrogen 3.206 N/A LYS 186.A NZ ASP 631.A OD1 no hydrogen 3.265 N/A ALA 187.A N GLU 183.A O no hydrogen 2.957 N/A THR 188.A N ARG 184.A O no hydrogen 2.892 N/A THR 188.A OG1 GLN 173.A OE1 no hydrogen 3.417 N/A THR 188.A OG1 ARG 184.A O no hydrogen 2.859 N/A GLN 189.A N LEU 185.A O no hydrogen 3.142 N/A VAL 190.A N LYS 186.A O no hydrogen 3.169 N/A SER 191.A N ALA 187.A O no hydrogen 2.994 N/A SER 191.A OG GLN 173.A OE1 no hydrogen 3.036 N/A SER 191.A OG ALA 187.A O no hydrogen 3.405 N/A LYS 192.A N THR 188.A O no hydrogen 2.861 N/A LYS 192.A NZ ALA 715.A O no hydrogen 3.488 N/A GLY 193.A N GLN 189.A O no hydrogen 2.918 N/A ILE 194.A N VAL 190.A O no hydrogen 3.011 N/A ARG 195.A N SER 191.A O no hydrogen 3.148 N/A ARG 195.A NE ASP 196.A OD2 no hydrogen 3.071 N/A ARG 195.A NH2 ASP 196.A OD2 no hydrogen 3.108 N/A ASP 196.A N LYS 192.A O no hydrogen 2.832 N/A ASN 197.A N GLY 193.A O no hydrogen 2.922 N/A ARG 199.A NH1 ASP 166.A OD1 no hydrogen 2.785 N/A ARG 199.A NH1 ASP 166.A OD2 no hydrogen 3.360 N/A ARG 199.A NH1 GLY 168.A O no hydrogen 2.962 N/A ARG 199.A NH2 ASP 166.A OD2 no hydrogen 2.894 N/A SER 200.A N GLU 198.A O no hydrogen 2.723 N/A GLY 201.A N ARG 195.A O no hydrogen 2.756 N/A ARG 202.A N ARG 199.A O no hydrogen 3.084 N/A GLN 204.A N ASN 169.A O no hydrogen 3.076 N/A GLN 204.A NE2 LEU 719.A O no hydrogen 3.664 N/A SER 206.A N ILE 171.A O no hydrogen 3.061 N/A PHE 208.A N GLN 173.A O no hydrogen 2.766 N/A GLU 210.A N CYS 175.A O no hydrogen 2.969 N/A ALA 212.A N GLU 209.A O no hydrogen 2.900 N/A LEU 218.A N PRO 214.A O no hydrogen 3.074 N/A GLN 219.A N GLU 215.A O no hydrogen 2.857 N/A VAL 220.A N ALA 216.A O no hydrogen 3.328 N/A LEU 221.A N MET 217.A O no hydrogen 2.992 N/A GLY 222.A N LEU 218.A O no hydrogen 2.929 N/A LYS 224.A NZ GLU 210.A OE2 no hydrogen 3.360 N/A LYS 224.A NZ PRO 225.A O no hydrogen 3.152 N/A ASN 233.A ND2 ASN 233.A O no hydrogen 2.108 N/A LYS 235.A NZ ASP 671.A O no hydrogen 2.683 N/A LYS 238.A N ASP 274.A O no hydrogen 3.117 N/A LYS 238.A NZ TYR 240.A OH no hydrogen 2.642 N/A LYS 238.A NZ ASP 274.A OD1 no hydrogen 3.001 N/A LEU 239.A N ALA 255.A O no hydrogen 3.122 N/A TYR 240.A N ILE 272.A O no hydrogen 2.999 N/A LYS 241.A N SER 252.A O no hydrogen 2.821 N/A LYS 241.A NZ ASP 269.A OD1 no hydrogen 3.483 N/A SER 243.A N VAL 250.A O no hydrogen 3.167 N/A SER 252.A N LYS 241.A O no hydrogen 3.295 N/A VAL 254.A N LEU 239.A O no hydrogen 3.056 N/A ALA 255.A N LEU 239.A O no hydrogen 3.218 N/A ASN 258.A ND2 LYS 235.A O no hydrogen 3.509 N/A ASN 258.A ND2 ALA 237.A O no hydrogen 3.452 N/A PHE 260.A N PHE 331.A O no hydrogen 2.965 N/A GLN 262.A NE2 ARG 336.A O no hydrogen 2.688 N/A ALA 264.A N ALA 261.A O no hydrogen 3.221 N/A LEU 265.A N GLN 262.A O no hydrogen 3.185 N/A SER 267.A OG GLU 321.A OE1 no hydrogen 3.487 N/A SER 267.A OG GLU 321.A OE2 no hydrogen 2.817 N/A ASP 269.A N ARG 266.A O no hydrogen 3.121 N/A PHE 271.A N TRP 284.A O no hydrogen 3.113 N/A ILE 272.A N TYR 240.A O no hydrogen 2.912 N/A LEU 273.A N PHE 282.A O no hydrogen 2.901 N/A ASP 274.A N LYS 238.A O no hydrogen 2.772 N/A GLY 276.A N ASP 274.A OD2 no hydrogen 2.954 N/A ASP 278.A N HIS 275.A O no hydrogen 2.946 N/A GLY 279.A N GLY 276.A O no hydrogen 3.251 N/A LYS 280.A N HIS 275.A O no hydrogen 3.420 N/A LYS 280.A NZ GLN 315.A OE1 no hydrogen 2.915 N/A ILE 281.A N GLN 315.A O no hydrogen 3.119 N/A PHE 282.A N LEU 273.A O no hydrogen 3.167 N/A VAL 283.A N SER 317.A O no hydrogen 2.670 N/A TRP 284.A N PHE 271.A O no hydrogen 2.850 N/A TRP 284.A NE1 GLU 324.A OE1 no hydrogen 2.965 N/A LYS 285.A N LEU 319.A O no hydrogen 2.915 N/A GLY 286.A N ASP 269.A O no hydrogen 3.191 N/A LYS 287.A N GLU 321.A OE2 no hydrogen 3.251 N/A GLN 288.A N SER 267.A O no hydrogen 3.151 N/A ALA 289.A N SER 267.A O no hydrogen 3.020 N/A GLU 293.A N ASN 290.A O no hydrogen 3.008 N/A ARG 294.A N ASN 290.A O no hydrogen 3.027 N/A LYS 295.A N MET 291.A O no hydrogen 3.111 N/A LYS 295.A NZ ASP 84.A OD2 no hydrogen 2.669 N/A ALA 297.A N ARG 294.A O no hydrogen 3.308 N/A THR 300.A N ALA 296.A O no hydrogen 2.914 N/A THR 300.A OG1 ALA 296.A O no hydrogen 2.573 N/A ALA 301.A N ALA 297.A O no hydrogen 2.995 N/A SER 302.A N LEU 298.A O no hydrogen 2.873 N/A ASP 303.A N LYS 299.A O no hydrogen 2.992 N/A PHE 304.A N THR 300.A O no hydrogen 3.028 N/A ILE 305.A N ALA 301.A O no hydrogen 3.133 N/A SER 306.A N SER 302.A O no hydrogen 3.041 N/A SER 306.A OG SER 302.A O no hydrogen 3.206 N/A LYS 307.A N ASP 303.A O no hydrogen 3.031 N/A ASP 309.A N SER 306.A O no hydrogen 3.188 N/A TYR 310.A N ILE 305.A O no hydrogen 3.112 N/A TYR 310.A OH ASP 274.A OD1 no hydrogen 2.747 N/A TYR 310.A OH ASP 274.A OD2 no hydrogen 2.872 N/A THR 314.A N PRO 311.A O no hydrogen 3.295 N/A THR 314.A OG1 PRO 311.A O no hydrogen 2.848 N/A GLN 315.A N GLY 279.A O no hydrogen 3.017 N/A GLN 315.A NE2 PHE 99.A O no hydrogen 3.266 N/A SER 317.A N ILE 281.A O no hydrogen 3.168 N/A VAL 318.A N GLN 92.A O no hydrogen 3.012 N/A LEU 319.A N VAL 283.A O no hydrogen 2.929 N/A GLU 321.A N LYS 285.A O no hydrogen 3.052 N/A GLY 322.A N GLU 324.A OE1 no hydrogen 3.395 N/A GLY 323.A N PRO 320.A O no hydrogen 2.786 N/A GLU 324.A N GLU 324.A OE2 no hydrogen 2.973 N/A ARG 329.A N THR 325.A O no hydrogen 2.842 N/A ARG 329.A NH1 ALA 603.A O no hydrogen 3.478 N/A GLN 330.A N PRO 326.A O no hydrogen 2.901 N/A PHE 331.A N PHE 328.A O no hydrogen 3.369 N/A PHE 332.A N ARG 329.A O no hydrogen 3.329 N/A LYS 333.A N PHE 260.A O no hydrogen 2.943 N/A ARG 336.A N GLN 262.A OE1 no hydrogen 3.096 N/A GLN 340.A N ASP 337.A O no hydrogen 2.848 N/A THR 341.A N PRO 338.A O no hydrogen 3.474 N/A THR 341.A OG1 PRO 338.A O no hydrogen 2.905 N/A TYR 348.A OH ASP 58.A OD1 no hydrogen 2.820 N/A TYR 348.A OH ASP 58.A OD2 no hydrogen 3.009 N/A LEU 349.A N GLN 56.A OE1 no hydrogen 2.910 N/A ILE 353.A N SER 350.A O no hydrogen 3.133 N/A ALA 354.A N SER 351.A O no hydrogen 3.148 N/A VAL 356.A N ILE 353.A O no hydrogen 3.370 N/A ARG 358.A NH2 ASP 602.A OD1 no hydrogen 3.029 N/A VAL 359.A N GLN 375.A OE1 no hydrogen 3.225 N/A THR 365.A N ASP 362.A O no hydrogen 2.980 N/A THR 365.A OG1 ASP 362.A O no hydrogen 3.551 N/A THR 365.A OG1 ASP 362.A OD1 no hydrogen 2.873 N/A LEU 366.A N ALA 363.A O no hydrogen 3.372 N/A THR 368.A N THR 365.A O no hydrogen 3.069 N/A SER 369.A N LEU 366.A O no hydrogen 3.143 N/A MET 372.A N SER 369.A OG no hydrogen 3.068 N/A ALA 373.A N SER 369.A O no hydrogen 3.354 N/A ALA 374.A N THR 370.A O no hydrogen 2.955 N/A GLN 375.A N ALA 371.A O no hydrogen 3.043 N/A GLN 375.A NE2 GLU 357.A O no hydrogen 2.908 N/A HIS 376.A N MET 372.A O no hydrogen 3.082 N/A HIS 376.A NE2 VAL 359.A O no hydrogen 2.916 N/A MET 378.A N ALA 373.A O no hydrogen 2.844 N/A GLY 382.A N ASP 380.A OD2 no hydrogen 2.886 N/A THR 383.A N ASP 381.A OD1 no hydrogen 3.394 N/A THR 383.A OG1 ASP 381.A OD1 no hydrogen 2.957 N/A GLY 384.A N TYR 417.A OH no hydrogen 2.933 N/A LYS 386.A NZ LEU 477.A O no hydrogen 2.639 N/A GLN 387.A N LEU 416.A O no hydrogen 3.037 N/A GLN 387.A NE2 ILE 388.A O no hydrogen 2.762 N/A ILE 388.A N TYR 404.A OH no hydrogen 3.045 N/A TRP 389.A N ILE 414.A O no hydrogen 2.814 N/A ARG 390.A N VAL 397.A O no hydrogen 2.937 N/A ARG 390.A NE GLU 392.A OE1 no hydrogen 3.115 N/A ARG 390.A NH2 GLU 392.A OE1 no hydrogen 3.148 N/A VAL 391.A N SER 412.A O no hydrogen 2.934 N/A GLU 392.A N ASN 395.A O no hydrogen 3.199 N/A GLY 393.A N GLU 441.A OE1 no hydrogen 3.289 N/A ASN 395.A N GLU 392.A O no hydrogen 3.123 N/A VAL 397.A N ARG 390.A O no hydrogen 2.801 N/A VAL 399.A N ILE 388.A O no hydrogen 3.140 N/A ALA 402.A N ASP 400.A OD1 no hydrogen 3.333 N/A THR 403.A N ASP 400.A O no hydrogen 2.877 N/A THR 403.A OG1 ASP 400.A O no hydrogen 2.754 N/A TYR 404.A N PRO 401.A O no hydrogen 3.479 N/A GLN 406.A N THR 403.A O no hydrogen 2.767 N/A PHE 407.A N ILE 484.A O no hydrogen 2.778 N/A TYR 408.A N TYR 413.A OH no hydrogen 2.776 N/A GLY 409.A N TYR 486.A O no hydrogen 2.912 N/A GLY 410.A N GLY 489.A O no hydrogen 3.107 N/A ASP 411.A N TYR 408.A O no hydrogen 2.988 N/A SER 412.A OG SER 437.A OG no hydrogen 2.992 N/A TYR 413.A N TRP 432.A O no hydrogen 2.832 N/A ILE 414.A N TRP 389.A O no hydrogen 2.994 N/A ILE 415.A N TYR 430.A O no hydrogen 2.772 N/A LEU 416.A N GLN 387.A O no hydrogen 2.829 N/A TYR 417.A N ILE 428.A O no hydrogen 2.802 N/A TYR 417.A OH ASP 380.A OD1 no hydrogen 2.923 N/A TYR 417.A OH ASP 380.A OD2 no hydrogen 2.668 N/A ASN 418.A N GLN 385.A O no hydrogen 3.195 N/A TYR 419.A N GLY 426.A O no hydrogen 2.933 N/A ARG 420.A N ASP 380.A OD1 no hydrogen 2.910 N/A HIS 421.A N ARG 424.A O no hydrogen 2.867 N/A SER 423.A OG HIS 421.A O no hydrogen 3.393 N/A ARG 424.A N HIS 421.A O no hydrogen 3.465 N/A GLY 426.A N TYR 419.A O no hydrogen 3.218 N/A GLN 427.A NE2 ASN 418.A OD1 no hydrogen 2.866 N/A ILE 428.A N TYR 417.A O no hydrogen 2.814 N/A ILE 429.A N VAL 461.A O no hydrogen 2.896 N/A TYR 430.A N ILE 415.A O no hydrogen 2.958 N/A ASN 431.A N SER 463.A O no hydrogen 2.815 N/A ASN 431.A ND2 TYR 413.A O no hydrogen 3.022 N/A ASN 431.A ND2 SER 445.A OG no hydrogen 3.065 N/A TRP 432.A NE1 GLU 470.A OE2 no hydrogen 3.008 N/A GLN 433.A N VAL 465.A O no hydrogen 2.981 N/A GLN 433.A NE2 ASN 431.A OD1 no hydrogen 2.759 N/A GLY 434.A N ASP 411.A O no hydrogen 3.006 N/A ALA 435.A N GLN 467.A OE1 no hydrogen 2.813 N/A GLN 436.A N GLY 409.A O no hydrogen 2.800 N/A SER 437.A N GLY 434.A O no hydrogen 3.211 N/A SER 437.A OG SER 412.A OG no hydrogen 2.992 N/A SER 437.A OG THR 438.A O no hydrogen 3.490 N/A THR 438.A OG1 ASP 440.A OD1 no hydrogen 3.089 N/A VAL 442.A N THR 438.A O no hydrogen 2.979 N/A ALA 443.A N GLN 439.A O no hydrogen 3.013 N/A ALA 444.A N ASP 440.A O no hydrogen 2.924 N/A SER 445.A N GLU 441.A O no hydrogen 2.868 N/A SER 445.A OG ASN 431.A OD1 no hydrogen 3.452 N/A SER 445.A OG GLU 441.A O no hydrogen 3.550 N/A SER 445.A OG VAL 442.A O no hydrogen 2.381 N/A ALA 446.A N VAL 442.A O no hydrogen 3.129 N/A ILE 447.A N ALA 443.A O no hydrogen 3.104 N/A LEU 448.A N ALA 444.A O no hydrogen 2.852 N/A THR 449.A N SER 445.A O no hydrogen 2.853 N/A THR 449.A OG1 SER 445.A O no hydrogen 2.504 N/A ALA 450.A N ALA 446.A O no hydrogen 2.959 N/A GLN 451.A N ILE 447.A O no hydrogen 2.857 N/A LEU 452.A N LEU 448.A O no hydrogen 2.886 N/A ASP 453.A N THR 449.A O no hydrogen 3.034 N/A GLU 454.A N ALA 450.A O no hydrogen 3.199 N/A GLU 455.A N GLN 451.A O no hydrogen 2.890 N/A LEU 456.A N ASP 453.A O no hydrogen 3.099 N/A GLY 457.A N GLU 454.A O no hydrogen 3.177 N/A GLY 458.A N ASP 453.A O no hydrogen 3.065 N/A VAL 461.A N GLN 427.A O no hydrogen 2.790 N/A GLN 462.A N VAL 685.A O no hydrogen 2.928 N/A SER 463.A N ILE 429.A O no hydrogen 2.834 N/A SER 463.A OG THR 684.A OG1 no hydrogen 3.233 N/A ARG 464.A N ILE 683.A O no hydrogen 2.848 N/A ARG 464.A NH1 THR 681.A O no hydrogen 3.444 N/A ARG 464.A NH2 THR 681.A O no hydrogen 3.328 N/A VAL 465.A N ASN 431.A O no hydrogen 2.963 N/A GLN 467.A N GLN 433.A O no hydrogen 3.248 N/A GLY 468.A N GLU 470.A OE2 no hydrogen 3.016 N/A LYS 469.A N VAL 466.A O no hydrogen 3.094 N/A MET 475.A N PRO 471.A O no hydrogen 3.442 N/A SER 476.A N HIS 473.A O no hydrogen 3.287 N/A SER 476.A OG HIS 473.A O no hydrogen 3.183 N/A LEU 477.A N LEU 474.A O no hydrogen 3.463 N/A LYS 481.A N PHE 478.A O no hydrogen 3.185 N/A MET 483.A N THR 515.A O no hydrogen 3.005 N/A ILE 484.A N GLY 405.A O no hydrogen 2.629 N/A VAL 485.A N ALA 517.A O no hydrogen 2.801 N/A TYR 486.A N PHE 407.A O no hydrogen 2.934 N/A LYS 487.A N GLU 519.A OE2 no hydrogen 3.466 N/A THR 490.A OG1 ASP 411.A OD1 no hydrogen 2.638 N/A THR 490.A OG1 ASP 411.A OD2 no hydrogen 3.232 N/A SER 491.A N ASP 411.A OD2 no hydrogen 3.269 N/A SER 491.A OG ASP 411.A OD2 no hydrogen 3.391 N/A ARG 492.A N THR 490.A OG1 no hydrogen 3.321 N/A ARG 492.A NE THR 490.A OG1 no hydrogen 2.952 N/A ARG 492.A NH1 GLU 441.A OE1 no hydrogen 3.153 N/A ARG 492.A NH2 ASP 411.A OD1 no hydrogen 3.013 N/A ARG 492.A NH2 GLU 441.A OE2 no hydrogen 3.011 N/A GLY 495.A N ARG 492.A O no hydrogen 3.310 N/A THR 497.A OG1 GLY 495.A O no hydrogen 3.436 N/A ARG 503.A N LYS 536.A O no hydrogen 3.057 N/A ARG 503.A NE GLU 519.A OE1 no hydrogen 3.438 N/A ARG 503.A NH2 GLU 519.A OE2 no hydrogen 3.194 N/A PHE 505.A N VAL 534.A O no hydrogen 2.849 N/A GLN 506.A N VAL 518.A O no hydrogen 2.933 N/A GLN 506.A NE2 ASP 531.A OD1 no hydrogen 2.511 N/A VAL 507.A N ALA 532.A O no hydrogen 2.772 N/A ARG 508.A N ARG 516.A O no hydrogen 3.078 N/A SER 510.A N ALA 514.A O no hydrogen 2.858 N/A SER 510.A OG SER 512.A OG no hydrogen 2.717 N/A SER 510.A OG ALA 514.A O no hydrogen 3.512 N/A SER 511.A OG HIS 376.A ND1 no hydrogen 3.070 N/A SER 512.A OG SER 510.A OG no hydrogen 2.717 N/A GLY 513.A N SER 510.A O no hydrogen 3.084 N/A ARG 516.A N ARG 508.A O no hydrogen 3.040 N/A ALA 517.A N MET 483.A O no hydrogen 2.684 N/A VAL 518.A N GLN 506.A O no hydrogen 2.837 N/A GLU 519.A N VAL 485.A O no hydrogen 2.932 N/A ILE 520.A N LEU 504.A O no hydrogen 3.135 N/A LEU 527.A N ALA 524.A O no hydrogen 3.046 N/A SER 529.A N ARG 591.A O no hydrogen 3.069 N/A SER 529.A OG GLU 573.A OE1 no hydrogen 2.528 N/A SER 529.A OG GLU 573.A OE2 no hydrogen 3.185 N/A ASN 530.A N ASN 528.A OD1 no hydrogen 3.213 N/A ASP 531.A N ASN 528.A O no hydrogen 3.303 N/A ALA 532.A N VAL 507.A O no hydrogen 3.361 N/A PHE 533.A N TRP 544.A O no hydrogen 2.730 N/A VAL 534.A N PHE 505.A O no hydrogen 2.962 N/A LEU 535.A N TYR 542.A O no hydrogen 3.099 N/A LYS 536.A N ARG 503.A O no hydrogen 2.989 N/A THR 537.A N ALA 540.A O no hydrogen 3.219 N/A TYR 542.A N LEU 535.A O no hydrogen 3.156 N/A TYR 542.A OH SER 579.A OG no hydrogen 2.841 N/A LEU 543.A N VAL 569.A O no hydrogen 3.322 N/A TRP 544.A NE1 GLU 576.A OE2 no hydrogen 3.259 N/A VAL 545.A N VAL 571.A O no hydrogen 3.160 N/A GLY 546.A N ASP 531.A O no hydrogen 3.422 N/A ALA 547.A N GLU 573.A OE1 no hydrogen 3.254 N/A GLY 548.A N SER 529.A O no hydrogen 2.990 N/A ALA 549.A N GLY 546.A O no hydrogen 3.172 N/A SER 550.A N GLU 553.A OE2 no hydrogen 3.238 N/A SER 550.A OG GLU 553.A OE2 no hydrogen 2.659 N/A ALA 552.A N SER 550.A OG no hydrogen 3.194 N/A LYS 554.A N SER 550.A O no hydrogen 3.335 N/A THR 555.A N GLU 551.A O no hydrogen 2.934 N/A GLY 556.A N ALA 552.A O no hydrogen 3.037 N/A ALA 557.A N GLU 553.A O no hydrogen 2.851 N/A GLN 558.A N LYS 554.A O no hydrogen 3.175 N/A GLU 559.A N THR 555.A O no hydrogen 3.160 N/A LEU 560.A N GLY 556.A O no hydrogen 3.233 N/A LEU 561.A N ALA 557.A O no hydrogen 3.337 N/A ARG 562.A N GLN 558.A O no hydrogen 3.342 N/A LEU 564.A N LEU 560.A O no hydrogen 2.953 N/A ARG 565.A N ARG 562.A O no hydrogen 3.203 N/A ALA 566.A N LEU 561.A O no hydrogen 3.216 N/A GLY 574.A N GLU 576.A OE2 no hydrogen 3.000 N/A SER 575.A OG GLU 573.A O no hydrogen 3.443 N/A SER 579.A OG TYR 542.A OH no hydrogen 2.841 N/A PHE 580.A N PRO 577.A O no hydrogen 3.259 N/A TRP 581.A NE1 GLU 576.A OE1 no hydrogen 2.879 N/A ALA 583.A N SER 579.A O no hydrogen 3.171 N/A ALA 583.A N PHE 580.A O no hydrogen 3.316 N/A LEU 584.A N TRP 581.A O no hydrogen 3.238 N/A GLY 586.A N TRP 581.A O no hydrogen 3.234 N/A SER 593.A OG SER 593.A O no hydrogen 2.600 N/A ARG 595.A NH1 ASP 531.A OD2 no hydrogen 2.744 N/A ARG 595.A NH2 ASP 531.A OD1 no hydrogen 3.146 N/A ARG 595.A NH2 ASP 531.A OD2 no hydrogen 3.480 N/A LYS 599.A NZ GLN 340.A O no hydrogen 2.936 N/A ALA 603.A N LYS 599.A O no hydrogen 3.234 N/A HIS 604.A N LYS 600.A O no hydrogen 3.100 N/A ARG 607.A N ASP 641.A O no hydrogen 2.979 N/A ARG 607.A NH2 GLU 622.A OE1 no hydrogen 3.496 N/A PHE 609.A N LEU 639.A O no hydrogen 2.770 N/A ALA 610.A N GLU 621.A O no hydrogen 2.872 N/A CYS 611.A N VAL 637.A O no hydrogen 2.844 N/A SER 612.A N VAL 619.A O no hydrogen 3.178 N/A VAL 619.A N SER 612.A O no hydrogen 3.267 N/A GLU 621.A N ALA 610.A O no hydrogen 3.233 N/A VAL 623.A N LEU 608.A O no hydrogen 2.908 N/A GLN 629.A NE2 ASP 703.A O no hydrogen 2.899 N/A ASP 631.A N MET 628.A O no hydrogen 3.043 N/A LEU 632.A N GLN 629.A O no hydrogen 3.038 N/A ASP 636.A N ALA 633.A O no hydrogen 3.031 N/A MET 638.A N TRP 649.A O no hydrogen 2.856 N/A LEU 639.A N PHE 609.A O no hydrogen 2.699 N/A LEU 640.A N PHE 647.A O no hydrogen 3.030 N/A ASP 641.A N ARG 607.A O no hydrogen 2.820 N/A GLN 645.A NE2 THR 684.A OG1 no hydrogen 2.555 N/A VAL 646.A N PRO 682.A O no hydrogen 2.984 N/A PHE 647.A N LEU 640.A O no hydrogen 2.915 N/A VAL 648.A N THR 684.A O no hydrogen 2.932 N/A TRP 649.A N MET 638.A O no hydrogen 3.007 N/A TRP 649.A NE1 GLU 691.A OE1 no hydrogen 2.808 N/A VAL 650.A N VAL 686.A O no hydrogen 2.986 N/A GLY 651.A N ASP 636.A O no hydrogen 2.918 N/A LYS 652.A N GLN 688.A OE1 no hydrogen 3.139 N/A ASP 653.A N THR 634.A O no hydrogen 2.940 N/A SER 654.A N GLY 651.A O no hydrogen 3.062 N/A SER 654.A OG GLY 651.A O no hydrogen 2.483 N/A LYS 659.A N GLN 655.A O no hydrogen 3.284 N/A LYS 659.A NZ LYS 652.A O no hydrogen 2.793 N/A THR 660.A N ASP 656.A O no hydrogen 3.256 N/A THR 660.A OG1 ASP 656.A O no hydrogen 3.037 N/A GLU 661.A N GLU 657.A O no hydrogen 3.089 N/A SER 665.A N GLU 661.A O no hydrogen 2.741 N/A SER 665.A OG GLU 661.A O no hydrogen 2.765 N/A ALA 666.A N ALA 662.A O no hydrogen 3.047 N/A LYS 667.A N LEU 663.A O no hydrogen 3.068 N/A ARG 668.A N THR 664.A O no hydrogen 2.964 N/A TYR 669.A N SER 665.A O no hydrogen 3.014 N/A TYR 669.A OH ASP 641.A OD2 no hydrogen 2.462 N/A ILE 670.A N ALA 666.A O no hydrogen 2.968 N/A ASP 671.A N LYS 667.A O no hydrogen 2.764 N/A THR 672.A N ARG 668.A O no hydrogen 2.887 N/A THR 672.A OG1 ARG 668.A O no hydrogen 3.086 N/A ASP 673.A N ILE 670.A O no hydrogen 3.456 N/A ALA 675.A N ASP 673.A OD1 no hydrogen 3.338 N/A HIS 676.A N ASP 673.A O no hydrogen 3.015 N/A ARG 677.A NH1 ASP 641.A OD1 no hydrogen 3.293 N/A ARG 677.A NH1 ASP 641.A OD2 no hydrogen 2.650 N/A ARG 677.A NH1 ASP 673.A OD2 no hydrogen 3.545 N/A ARG 677.A NH2 ASP 641.A OD1 no hydrogen 3.394 N/A ARG 680.A N ASP 678.A OD1 no hydrogen 3.144 N/A ARG 680.A NE ASP 678.A OD1 no hydrogen 3.128 N/A ARG 680.A NH1 GLN 467.A O no hydrogen 3.243 N/A ARG 680.A NH2 ASP 678.A OD2 no hydrogen 3.192 N/A THR 681.A N ASP 678.A O no hydrogen 3.205 N/A THR 681.A OG1 ASP 678.A O no hydrogen 2.599 N/A ILE 683.A N ARG 464.A O no hydrogen 3.204 N/A THR 684.A N VAL 646.A O no hydrogen 2.903 N/A THR 684.A OG1 SER 463.A OG no hydrogen 3.233 N/A VAL 685.A N GLN 462.A O no hydrogen 2.577 N/A VAL 686.A N VAL 648.A O no hydrogen 2.891 N/A LYS 687.A NZ ASP 453.A OD1 no hydrogen 2.924 N/A LYS 687.A NZ GLY 458.A O no hydrogen 2.774 N/A GLN 688.A N VAL 650.A O no hydrogen 3.133 N/A GLY 689.A N GLU 691.A OE1 no hydrogen 3.044 N/A PHE 690.A N LYS 687.A O no hydrogen 2.877 N/A GLU 691.A N GLU 691.A OE2 no hydrogen 2.863 N/A SER 694.A N ASP 379.A OD2 no hydrogen 2.878 N/A SER 694.A OG ASP 379.A OD2 no hydrogen 2.676 N/A PHE 695.A N PRO 692.A O no hydrogen 3.148 N/A VAL 696.A N PRO 692.A O no hydrogen 3.119 N/A GLY 697.A N PRO 693.A O no hydrogen 2.825 N/A TRP 698.A N PHE 695.A O no hydrogen 3.279 N/A PHE 699.A N VAL 696.A O no hydrogen 2.970 N/A TRP 702.A N PHE 699.A O no hydrogen 3.228 N/A ASP 703.A N GLN 629.A OE1 no hydrogen 2.942 N/A SER 705.A N ASP 703.A OD1 no hydrogen 3.407 N/A SER 705.A OG ASP 703.A OD1 no hydrogen 3.479 N/A TYR 706.A N ASP 703.A O no hydrogen 3.166 N/A SER 708.A N SER 705.A O no hydrogen 2.830 N/A SER 708.A OG SER 705.A O no hydrogen 2.604 N/A ASP 713.A N ASP 710.A OD2 no hydrogen 3.097 N/A ARG 714.A N ASP 710.A O no hydrogen 3.336 N/A ARG 714.A NH2 TYR 706.A O no hydrogen 2.806 N/A ALA 715.A N PRO 711.A O no hydrogen 3.092 N/A LEU 716.A N LEU 712.A O no hydrogen 3.005 N/A ALA 717.A N ASP 713.A O no hydrogen 3.108 N/A GLU 718.A N ALA 715.A O no hydrogen 3.173 N/A ALA 720.A N LEU 716.A O no hydrogen 3.396 N/A