Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wad_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ILE 223.A O no hydrogen 2.999 N/A VAL 5.A N LYS 221.A O no hydrogen 2.953 N/A THR 7.A N PRO 219.A O no hydrogen 3.052 N/A THR 7.A OG1 SER 8.A O no hydrogen 3.464 N/A SER 9.A OG LYS 217.A O no hydrogen 2.736 N/A ARG 11.A NE GLU 207.A OE1 no hydrogen 2.718 N/A ARG 11.A NH1 GLU 211.A OE1 no hydrogen 2.879 N/A ARG 11.A NH2 GLU 207.A OE1 no hydrogen 3.363 N/A ARG 11.A NH2 GLU 211.A OE1 no hydrogen 2.863 N/A GLY 12.A N LEU 214.A O no hydrogen 2.762 N/A TYR 15.A N ILE 246.A O no hydrogen 3.042 N/A ASP 16.A N LYS 20.A O no hydrogen 2.875 N/A ALA 17.A N ILE 250.A O no hydrogen 2.996 N/A SER 18.A N ASP 16.A OD2 no hydrogen 2.935 N/A SER 18.A OG ASP 16.A OD2 no hydrogen 3.176 N/A GLY 19.A N ASP 16.A O no hydrogen 2.940 N/A GLY 19.A N ASP 16.A OD2 no hydrogen 2.969 N/A LYS 20.A N ASP 16.A OD2 no hydrogen 2.981 N/A LEU 22.A N ILE 14.A O no hydrogen 2.764 N/A ASN 25.A N GLU 13.A OE1 no hydrogen 3.315 N/A ASN 25.A ND2 ARG 11.A O no hydrogen 2.794 N/A THR 26.A N ASP 160.A O no hydrogen 2.893 N/A LYS 28.A N SER 158.A O no hydrogen 3.421 N/A LYS 28.A NZ TRP 159.A O no hydrogen 3.290 N/A LYS 28.A NZ ASP 160.A OD1 no hydrogen 2.815 N/A VAL 30.A N SER 156.A O no hydrogen 2.659 N/A SER 32.A N SER 154.A O no hydrogen 2.846 N/A SER 32.A OG SER 156.A OG no hydrogen 3.034 N/A PHE 33.A N GLY 128.A O no hydrogen 2.853 N/A THR 34.A N GLY 152.A O no hydrogen 3.000 N/A THR 34.A OG1 THR 127.A OG1 no hydrogen 2.523 N/A ARG 35.A N ALA 126.A O no hydrogen 3.165 N/A ARG 35.A NH1 ASN 120.A O no hydrogen 2.722 N/A ARG 35.A NH1 VAL 122.A O no hydrogen 3.067 N/A ARG 35.A NH2 ASN 120.A OD1 no hydrogen 3.404 N/A SER 36.A OG ASN 37.A OD1 no hydrogen 3.507 N/A ASN 37.A ND2 GLY 229.A O no hydrogen 2.738 N/A LYS 38.A N SER 36.A OG no hydrogen 3.145 N/A LYS 38.A NZ ASP 230.A OD1 no hydrogen 2.812 N/A MET 39.A N SER 36.A O no hydrogen 3.324 N/A THR 40.A N ASP 43.A OD2 no hydrogen 3.111 N/A THR 42.A OG1 ALA 73.A O no hydrogen 3.429 N/A ASP 43.A N THR 40.A OG1 no hydrogen 2.993 N/A LEU 44.A N THR 40.A O no hydrogen 3.142 N/A LYS 45.A N ALA 41.A O no hydrogen 3.022 N/A GLU 46.A N THR 42.A O no hydrogen 3.019 N/A ILE 47.A N ASP 43.A O no hydrogen 3.186 N/A ALA 48.A N LEU 44.A O no hydrogen 2.884 N/A LYS 49.A N LYS 45.A O no hydrogen 3.163 N/A LYS 49.A NZ GLU 46.A OE1 no hydrogen 3.363 N/A LYS 50.A N GLU 46.A O no hydrogen 3.257 N/A LYS 50.A NZ GLU 149.A OE1 no hydrogen 3.118 N/A LEU 51.A N ILE 47.A O no hydrogen 3.119 N/A LEU 52.A N ALA 48.A O no hydrogen 3.009 N/A THR 53.A OG1 LYS 50.A O no hydrogen 2.503 N/A TYR 54.A N LEU 51.A O no hydrogen 2.868 N/A VAL 55.A N LEU 51.A O no hydrogen 3.286 N/A SER 58.A OG ASP 133.A OD1 no hydrogen 3.543 N/A SER 58.A OG ASP 133.A OD2 no hydrogen 2.789 N/A THR 63.A N GLN 66.A OE1 no hydrogen 3.127 N/A GLU 64.A N GLU 64.A OE1 no hydrogen 2.858 N/A ARG 65.A NE ASP 69.A OD2 no hydrogen 3.418 N/A GLN 66.A N THR 63.A OG1 no hydrogen 3.314 N/A LEU 67.A N THR 63.A O no hydrogen 2.942 N/A ALA 68.A N GLU 64.A O no hydrogen 2.901 N/A ASP 69.A N ARG 65.A O no hydrogen 2.878 N/A TYR 70.A N GLN 66.A O no hydrogen 3.083 N/A TYR 70.A OH GLU 112.A OE2 no hydrogen 2.588 N/A TYR 71.A N LEU 67.A O no hydrogen 3.206 N/A LEU 72.A N ALA 68.A O no hydrogen 2.931 N/A ALA 73.A N TYR 70.A O no hydrogen 3.194 N/A GLU 76.A N ASP 74.A OD1 no hydrogen 3.238 N/A TYR 78.A N ASP 74.A O no hydrogen 2.806 N/A LYS 79.A N PRO 75.A O no hydrogen 3.040 N/A LYS 80.A N GLU 76.A O no hydrogen 2.773 N/A THR 81.A N ILE 77.A O no hydrogen 3.016 N/A VAL 82.A N TYR 78.A O no hydrogen 3.263 N/A VAL 82.A N LYS 79.A O no hydrogen 2.929 N/A GLU 83.A N LYS 79.A O no hydrogen 2.810 N/A LEU 85.A N VAL 82.A O no hydrogen 3.053 N/A LEU 90.A N GLU 87.A O no hydrogen 2.719 N/A TYR 91.A N GLU 87.A O no hydrogen 3.035 N/A ASN 92.A N SER 88.A O no hydrogen 2.934 N/A ASN 93.A N GLU 89.A O no hydrogen 3.464 N/A ALA 94.A N LEU 90.A O no hydrogen 2.989 N/A VAL 95.A N TYR 91.A O no hydrogen 2.732 N/A ASP 96.A N ASN 92.A O no hydrogen 2.812 N/A SER 97.A N ASN 93.A O no hydrogen 3.418 N/A SER 97.A OG ASN 93.A O no hydrogen 3.449 N/A VAL 98.A N VAL 95.A O no hydrogen 2.919 N/A SER 101.A OG GLU 64.A O no hydrogen 3.337 N/A THR 106.A OG1 GLU 109.A OE1 no hydrogen 3.280 N/A GLU 109.A N THR 106.A OG1 no hydrogen 3.251 N/A LYS 110.A N THR 106.A O no hydrogen 3.051 N/A LYS 111.A N ASP 108.A O no hydrogen 2.927 N/A GLU 112.A N ASP 108.A O no hydrogen 3.359 N/A ILE 113.A N GLU 109.A O no hydrogen 2.947 N/A TYR 114.A N LYS 110.A O no hydrogen 2.967 N/A LEU 115.A N LYS 111.A O no hydrogen 3.116 N/A PHE 116.A N GLU 112.A O no hydrogen 2.866 N/A SER 117.A N ILE 113.A O no hydrogen 3.104 N/A SER 117.A OG ILE 113.A O no hydrogen 2.651 N/A GLN 118.A N TYR 114.A O no hydrogen 3.311 N/A LEU 119.A N LEU 115.A O no hydrogen 3.064 N/A ASN 120.A N PHE 116.A O no hydrogen 2.740 N/A ALA 121.A N SER 117.A O no hydrogen 3.038 N/A VAL 122.A N LEU 119.A O no hydrogen 3.140 N/A PHE 125.A N ARG 35.A O no hydrogen 2.807 N/A ALA 126.A N GLY 123.A O no hydrogen 3.079 N/A THR 127.A OG1 THR 34.A OG1 no hydrogen 2.523 N/A GLY 128.A N PHE 33.A O no hydrogen 3.039 N/A THR 129.A OG1 GLU 178.A OE2 no hydrogen 2.769 N/A ILE 130.A N VAL 31.A O no hydrogen 2.810 N/A ALA 131.A N GLN 118.A OE1 no hydrogen 3.062 N/A THR 132.A OG1 SER 56.A O no hydrogen 3.003 N/A ASP 133.A N SER 56.A O no hydrogen 3.108 N/A SER 138.A N ASN 136.A OD1 no hydrogen 2.754 N/A GLN 139.A N ASN 136.A OD1 no hydrogen 2.589 N/A GLN 139.A NE2 TYR 54.A O no hydrogen 3.457 N/A VAL 140.A N ASN 136.A O no hydrogen 3.116 N/A ALA 141.A N ASP 137.A O no hydrogen 3.239 N/A VAL 142.A N SER 138.A O no hydrogen 3.007 N/A ILE 143.A N GLN 139.A O no hydrogen 3.350 N/A ALA 144.A N VAL 140.A O no hydrogen 2.990 N/A SER 145.A N VAL 142.A O no hydrogen 3.064 N/A SER 145.A OG VAL 142.A O no hydrogen 2.628 N/A ILE 146.A N VAL 142.A O no hydrogen 3.221 N/A ILE 146.A N ILE 143.A O no hydrogen 3.153 N/A SER 147.A OG ALA 144.A O no hydrogen 3.520 N/A GLU 149.A N ILE 146.A O no hydrogen 2.792 N/A MET 150.A N SER 147.A O no hydrogen 2.968 N/A ILE 153.A N MET 150.A O no hydrogen 3.061 N/A SER 154.A N SER 32.A O no hydrogen 3.115 N/A SER 156.A N VAL 30.A O no hydrogen 2.985 N/A SER 156.A OG SER 32.A OG no hydrogen 3.034 N/A SER 158.A N LYS 28.A O no hydrogen 3.067 N/A SER 158.A OG GLU 178.A OE2 no hydrogen 3.491 N/A TRP 159.A N SER 158.A OG no hydrogen 2.717 N/A ASP 160.A N THR 26.A O no hydrogen 3.038 N/A ARG 161.A NE GLU 207.A OE2 no hydrogen 2.760 N/A ARG 161.A NH1 GLY 12.A O no hydrogen 2.849 N/A ARG 161.A NH1 ASN 25.A OD1 no hydrogen 3.213 N/A ARG 161.A NH2 GLY 12.A O no hydrogen 3.053 N/A ARG 161.A NH2 GLU 207.A OE1 no hydrogen 2.804 N/A ARG 161.A NH2 GLU 207.A OE2 no hydrogen 2.835 N/A LYS 162.A N GLU 24.A O no hydrogen 2.786 N/A LYS 162.A NZ GLU 24.A OE2 no hydrogen 3.435 N/A LEU 164.A N LEU 22.A O no hydrogen 3.054 N/A SER 167.A OG ASP 256.A OD1 no hydrogen 2.898 N/A LEU 168.A N THR 166.A OG1 no hydrogen 3.317 N/A SER 169.A N THR 166.A O no hydrogen 3.198 N/A SER 169.A OG THR 166.A O no hydrogen 3.162 N/A ILE 171.A N LEU 168.A O no hydrogen 3.313 N/A VAL 172.A N SER 169.A O no hydrogen 3.207 N/A SER 174.A N SER 204.A OG no hydrogen 2.841 N/A SER 174.A OG THR 203.A OG1 no hydrogen 3.060 N/A SER 174.A OG SER 204.A OG no hydrogen 3.217 N/A SER 176.A N VAL 201.A O no hydrogen 2.691 N/A SER 176.A OG GLY 181.A O no hydrogen 2.875 N/A SER 176.A OG ASP 199.A O no hydrogen 3.393 N/A LYS 179.A NZ TYR 114.A OH no hydrogen 2.668 N/A ALA 180.A N SER 177.A OG no hydrogen 2.867 N/A LEU 182.A N LEU 197.A O no hydrogen 3.194 N/A GLU 185.A N GLU 185.A OE2 no hydrogen 2.770 N/A GLU 186.A N PRO 183.A O no hydrogen 3.349 N/A ALA 187.A N ALA 184.A O no hydrogen 3.252 N/A SER 189.A OG GLU 186.A OE1 no hydrogen 3.437 N/A TYR 190.A N GLU 186.A O no hydrogen 3.375 N/A LEU 191.A N ALA 187.A O no hydrogen 3.325 N/A LYS 192.A N GLU 188.A O no hydrogen 3.259 N/A LYS 193.A N SER 189.A O no hydrogen 2.873 N/A GLY 194.A N TYR 190.A O no hydrogen 3.172 N/A TYR 195.A N TYR 190.A O no hydrogen 2.657 N/A TYR 195.A OH GLU 211.A OE2 no hydrogen 2.710 N/A SER 196.A N ASP 199.A OD2 no hydrogen 2.854 N/A SER 196.A OG ASN 198.A OD1 no hydrogen 2.615 N/A ARG 200.A NH1 TRP 159.A O no hydrogen 2.447 N/A ARG 200.A NH2 TRP 159.A O no hydrogen 2.616 N/A VAL 201.A N SER 176.A OG no hydrogen 3.020 N/A GLY 202.A N GLU 211.A OE1 no hydrogen 2.901 N/A THR 203.A N SER 174.A O no hydrogen 2.911 N/A THR 203.A OG1 SER 174.A O no hydrogen 3.145 N/A THR 203.A OG1 SER 174.A OG no hydrogen 3.060 N/A SER 204.A OG SER 174.A OG no hydrogen 3.217 N/A LEU 206.A N ILE 171.A O no hydrogen 3.328 N/A GLU 207.A N VAL 172.A O no hydrogen 2.914 N/A LYS 208.A N SER 204.A O no hydrogen 3.258 N/A GLN 209.A N TYR 205.A O no hydrogen 2.800 N/A TYR 210.A N LEU 206.A O no hydrogen 2.990 N/A TYR 210.A OH ASP 432.A OD2 no hydrogen 2.594 N/A GLU 211.A N LYS 208.A O no hydrogen 3.213 N/A VAL 213.A N TYR 210.A O no hydrogen 2.878 N/A LEU 214.A N TYR 210.A O no hydrogen 2.864 N/A GLN 215.A N GLU 211.A O no hydrogen 2.991 N/A LYS 217.A N SER 241.A O no hydrogen 2.901 N/A LYS 217.A NZ GLU 239.A O no hydrogen 2.533 N/A VAL 220.A N GLU 238.A O no hydrogen 2.736 N/A LYS 221.A N VAL 5.A O no hydrogen 3.031 N/A GLU 222.A N GLU 235.A O no hydrogen 2.466 N/A ILE 223.A N THR 3.A O no hydrogen 2.955 N/A HIS 224.A N SER 233.A O no hydrogen 2.835 N/A LEU 225.A N SER 1.A O no hydrogen 3.145 N/A ASP 226.A N ASP 230.A O no hydrogen 2.881 N/A HIS 228.A N ASP 226.A OD1 no hydrogen 3.069 N/A GLY 229.A N ASP 226.A O no hydrogen 2.909 N/A ASP 230.A N ASP 226.A OD1 no hydrogen 2.696 N/A GLU 232.A N HIS 224.A O no hydrogen 2.681 N/A GLU 235.A N GLU 222.A O no hydrogen 2.718 N/A ILE 237.A N VAL 220.A O no hydrogen 2.836 N/A GLU 238.A N VAL 220.A O no hydrogen 3.145 N/A SER 241.A N LYS 217.A O no hydrogen 2.994 N/A LYS 242.A NZ GLU 13.A OE2 no hydrogen 3.167 N/A LYS 242.A NZ GLY 495.A O no hydrogen 3.089 N/A GLY 243.A N ALA 10.A O no hydrogen 2.721 N/A LYS 244.A N VAL 213.A O no hydrogen 3.288 N/A LYS 244.A NZ ASP 490.A OD1 no hydrogen 3.099 N/A ASN 245.A N TYR 489.A O no hydrogen 2.889 N/A ASN 245.A ND2 GLU 13.A O no hydrogen 3.598 N/A ILE 246.A N GLU 13.A O no hydrogen 3.182 N/A LYS 247.A N GLY 487.A O no hydrogen 3.120 N/A LEU 248.A N TYR 15.A O no hydrogen 2.766 N/A THR 249.A N ILE 484.A O no hydrogen 2.711 N/A THR 249.A OG1 VAL 293.A O no hydrogen 2.644 N/A THR 249.A OG1 HIS 483.A O no hydrogen 3.374 N/A THR 249.A OG1 ILE 484.A O no hydrogen 3.062 N/A LEU 252.A N ASP 16.A OD1 no hydrogen 2.865 N/A ALA 253.A N ASP 251.A OD1 no hydrogen 3.040 N/A GLN 255.A N ASP 251.A O no hydrogen 2.913 N/A GLN 255.A NE2 MET 296.A O no hydrogen 2.895 N/A ASP 256.A N LEU 252.A O no hydrogen 2.742 N/A SER 257.A N ALA 253.A O no hydrogen 3.011 N/A SER 257.A OG PHE 254.A O no hydrogen 3.190 N/A VAL 258.A N PHE 254.A O no hydrogen 2.948 N/A ASP 259.A N GLN 255.A O no hydrogen 3.047 N/A ALA 260.A N ASP 256.A O no hydrogen 3.057 N/A LEU 261.A N SER 257.A O no hydrogen 3.047 N/A LEU 262.A N VAL 258.A O no hydrogen 2.972 N/A LYS 263.A N ASP 259.A O no hydrogen 2.992 N/A SER 264.A N ALA 260.A O no hydrogen 2.694 N/A TYR 265.A N LEU 261.A O no hydrogen 2.840 N/A TYR 265.A OH ASP 594.A OD1 no hydrogen 2.673 N/A PHE 266.A N LEU 262.A O no hydrogen 2.842 N/A ASN 267.A N LYS 263.A O no hydrogen 3.107 N/A ASN 267.A ND2 LYS 263.A O no hydrogen 3.283 N/A SER 268.A N SER 264.A O no hydrogen 3.155 N/A GLU 269.A N TYR 265.A O no hydrogen 2.976 N/A LEU 270.A N PHE 266.A O no hydrogen 2.897 N/A GLY 271.A N ASN 267.A O no hydrogen 2.789 N/A ASN 272.A N SER 268.A O no hydrogen 3.026 N/A ASN 272.A ND2 GLU 269.A OE2 no hydrogen 3.186 N/A GLY 273.A N LEU 270.A O no hydrogen 3.265 N/A GLY 274.A N ASN 272.A OD1 no hydrogen 2.874 N/A ALA 275.A N GLU 269.A O no hydrogen 2.948 N/A LYS 276.A N GLY 273.A O no hydrogen 3.316 N/A SER 278.A N ALA 275.A O no hydrogen 3.031 N/A SER 278.A OG GLY 280.A O no hydrogen 3.306 N/A SER 278.A OG PRO 578.A O no hydrogen 2.633 N/A GLU 279.A N GLU 279.A OE1 no hydrogen 2.769 N/A VAL 281.A N LEU 299.A O no hydrogen 2.969 N/A TYR 282.A N VAL 576.A O no hydrogen 2.957 N/A TYR 282.A OH ASP 311.A OD2 no hydrogen 2.587 N/A ALA 283.A N SER 297.A O no hydrogen 2.959 N/A VAL 284.A N ALA 574.A O no hydrogen 3.145 N/A ALA 285.A N SER 295.A O no hydrogen 2.861 N/A LEU 286.A N ALA 572.A O no hydrogen 2.845 N/A ASN 287.A N ALA 292.A O no hydrogen 2.899 N/A GLN 289.A N ASN 287.A OD1 no hydrogen 2.881 N/A THR 290.A N ASN 287.A O no hydrogen 3.371 N/A GLY 291.A N ASN 287.A O no hydrogen 2.812 N/A ALA 292.A N THR 290.A OG1 no hydrogen 3.067 N/A VAL 293.A N HIS 483.A O no hydrogen 2.961 N/A LEU 294.A N ALA 285.A O no hydrogen 2.860 N/A SER 295.A N ALA 285.A O no hydrogen 3.345 N/A MET 296.A N GLN 255.A OE1 no hydrogen 3.212 N/A SER 297.A N ALA 283.A O no hydrogen 2.843 N/A SER 297.A OG ASP 259.A OD2 no hydrogen 2.652 N/A LEU 299.A N VAL 281.A O no hydrogen 2.867 N/A LYS 300.A N THR 309.A O no hydrogen 2.727 N/A HIS 301.A N GLU 279.A O no hydrogen 2.804 N/A HIS 301.A ND1 SER 278.A O no hydrogen 2.727 N/A ASP 302.A N GLU 307.A O no hydrogen 3.001 N/A LYS 304.A N ASP 302.A OD1 no hydrogen 2.879 N/A THR 305.A N ASP 302.A OD1 no hydrogen 3.199 N/A GLY 306.A N ASP 302.A O no hydrogen 2.781 N/A GLU 307.A N THR 305.A OG1 no hydrogen 3.275 N/A THR 309.A N LYS 300.A O no hydrogen 2.949 N/A ASP 311.A N GLY 298.A O no hydrogen 2.726 N/A GLY 314.A N ASP 311.A O no hydrogen 2.766 N/A THR 315.A N SER 312.A O no hydrogen 3.176 N/A THR 315.A OG1 SER 312.A O no hydrogen 2.666 N/A VAL 316.A N LEU 313.A O no hydrogen 3.045 N/A THR 317.A N LEU 313.A O no hydrogen 3.016 N/A THR 317.A N GLY 314.A O no hydrogen 3.376 N/A THR 317.A OG1 LEU 313.A O no hydrogen 3.143 N/A ASN 318.A N GLY 314.A O no hydrogen 3.119 N/A PHE 320.A N TYR 461.A O no hydrogen 2.889 N/A GLY 323.A N GLY 456.A O no hydrogen 2.853 N/A SER 324.A OG SER 381.A OG no hydrogen 3.091 N/A VAL 326.A N GLY 323.A O no hydrogen 3.411 N/A LYS 327.A N SER 324.A O no hydrogen 3.311 N/A LYS 327.A NZ SER 324.A OG no hydrogen 2.834 N/A LYS 327.A NZ SER 381.A O no hydrogen 2.936 N/A LYS 327.A NZ SER 381.A OG no hydrogen 3.121 N/A LYS 327.A NZ ASN 383.A OD1 no hydrogen 2.609 N/A ALA 329.A N VAL 326.A O no hydrogen 2.957 N/A THR 330.A OG1 ALA 454.A O no hydrogen 2.791 N/A ILE 331.A N LYS 327.A O no hydrogen 3.180 N/A SER 332.A N ALA 328.A O no hydrogen 3.122 N/A SER 332.A OG ALA 328.A O no hydrogen 2.837 N/A SER 332.A OG TYR 423.A OH no hydrogen 2.839 N/A SER 333.A N ALA 329.A O no hydrogen 3.041 N/A SER 333.A OG LYS 415.A O no hydrogen 3.441 N/A SER 333.A OG THR 419.A OG1 no hydrogen 2.861 N/A GLY 334.A N THR 330.A O no hydrogen 3.104 N/A TRP 335.A N ILE 331.A O no hydrogen 3.055 N/A TRP 335.A NE1 GLY 342.A O no hydrogen 2.932 N/A GLU 336.A N SER 332.A O no hydrogen 2.959 N/A ASN 337.A N SER 333.A O no hydrogen 3.113 N/A ASN 337.A ND2 SER 333.A O no hydrogen 2.852 N/A GLY 338.A N TRP 335.A O no hydrogen 3.385 N/A VAL 339.A N GLY 334.A O no hydrogen 2.903 N/A LEU 340.A N GLY 334.A O no hydrogen 3.164 N/A SER 341.A N GLN 344.A OE1 no hydrogen 2.746 N/A LEU 346.A N ILE 372.A O no hydrogen 2.918 N/A ASP 348.A N PHE 370.A O no hydrogen 2.802 N/A GLN 349.A NE2 THR 347.A O no hydrogen 3.627 N/A GLN 349.A NE2 GLN 388.A OE1 no hydrogen 3.470 N/A ILE 351.A N ILE 359.A O no hydrogen 2.986 N/A VAL 352.A N TYR 398.A OH no hydrogen 2.874 N/A GLN 354.A N MET 402.A O no hydrogen 2.979 N/A GLN 354.A NE2 ASN 401.A O no hydrogen 2.658 N/A SER 356.A N PHE 353.A O no hydrogen 3.354 N/A ILE 359.A N ILE 351.A O no hydrogen 2.895 N/A TRP 362.A NE1 TYR 380.A O no hydrogen 2.811 N/A TYR 363.A OH ASP 348.A OD2 no hydrogen 2.590 N/A LYS 364.A N SER 361.A O no hydrogen 3.098 N/A ALA 366.A N TYR 363.A O no hydrogen 3.095 N/A GLY 368.A N LEU 365.A O no hydrogen 2.874 N/A PHE 370.A N ASP 348.A O no hydrogen 3.108 N/A ILE 372.A N LEU 346.A O no hydrogen 2.915 N/A THR 373.A N GLU 376.A OE1 no hydrogen 3.088 N/A ALA 374.A N ASN 343.A OD1 no hydrogen 2.734 N/A VAL 375.A N ASN 343.A OD1 no hydrogen 3.092 N/A GLU 376.A N THR 373.A OG1 no hydrogen 3.291 N/A ALA 377.A N THR 373.A O no hydrogen 2.816 N/A LEU 378.A N ALA 374.A O no hydrogen 3.131 N/A GLU 379.A N VAL 375.A O no hydrogen 2.961 N/A TYR 380.A N GLU 376.A O no hydrogen 2.805 N/A SER 381.A N LEU 378.A O no hydrogen 3.279 N/A SER 381.A OG SER 324.A OG no hydrogen 3.091 N/A SER 382.A N ALA 377.A O no hydrogen 2.984 N/A SER 382.A OG ASP 348.A OD2 no hydrogen 2.818 N/A ASN 383.A N SER 361.A OG no hydrogen 2.792 N/A ASN 383.A ND2 TYR 360.A O no hydrogen 3.068 N/A TYR 385.A N SER 382.A OG no hydrogen 3.060 N/A TYR 385.A OH GLN 344.A O no hydrogen 2.736 N/A VAL 387.A N ASN 383.A O no hydrogen 3.024 N/A GLN 388.A N ALA 384.A O no hydrogen 3.133 N/A GLN 388.A NE2 THR 347.A O no hydrogen 2.852 N/A GLN 388.A NE2 ALA 384.A O no hydrogen 3.063 N/A THR 389.A N TYR 385.A O no hydrogen 3.020 N/A THR 389.A OG1 TYR 385.A O no hydrogen 2.836 N/A ALA 390.A N VAL 386.A O no hydrogen 2.950 N/A LEU 391.A N VAL 387.A O no hydrogen 2.984 N/A GLY 392.A N GLN 388.A O no hydrogen 3.136 N/A ILE 393.A N THR 389.A O no hydrogen 3.139 N/A MET 394.A N ALA 390.A O no hydrogen 3.248 N/A MET 394.A N LEU 391.A O no hydrogen 2.982 N/A GLY 395.A N GLY 392.A O no hydrogen 3.142 N/A GLN 396.A N LEU 391.A O no hydrogen 3.203 N/A GLN 396.A NE2 GLY 405.A O no hydrogen 3.565 N/A ASN 401.A N VAL 352.A O no hydrogen 2.841 N/A MET 402.A N GLN 399.A O no hydrogen 3.185 N/A ASN 408.A ND2 MET 394.A O no hydrogen 3.635 N/A LEU 409.A N THR 406.A O no hydrogen 3.163 N/A ALA 412.A N ASN 408.A O no hydrogen 2.933 N/A MET 413.A N LEU 409.A O no hydrogen 2.898 N/A GLY 414.A N GLU 410.A O no hydrogen 3.002 N/A LYS 415.A N SER 411.A O no hydrogen 3.040 N/A LEU 416.A N ALA 412.A O no hydrogen 3.024 N/A ARG 417.A N MET 413.A O no hydrogen 3.021 N/A ARG 417.A NE ASP 459.A OD2 no hydrogen 2.901 N/A ARG 417.A NH1 PRO 442.A O no hydrogen 2.980 N/A ARG 417.A NH2 PRO 442.A O no hydrogen 2.807 N/A ARG 417.A NH2 ASP 459.A OD1 no hydrogen 2.824 N/A SER 418.A N GLY 414.A O no hydrogen 2.943 N/A THR 419.A N LYS 415.A O no hydrogen 3.141 N/A THR 419.A OG1 SER 333.A OG no hydrogen 2.861 N/A THR 419.A OG1 GLU 336.A OE2 no hydrogen 2.683 N/A THR 419.A OG1 LYS 415.A O no hydrogen 3.171 N/A PHE 420.A N LEU 416.A O no hydrogen 2.954 N/A GLY 421.A N ARG 417.A O no hydrogen 2.856 N/A GLU 422.A N SER 418.A O no hydrogen 3.049 N/A TYR 423.A N PHE 420.A O no hydrogen 2.912 N/A TYR 423.A OH SER 332.A OG no hydrogen 2.839 N/A GLY 424.A N GLY 421.A O no hydrogen 2.960 N/A LEU 425.A N PHE 420.A O no hydrogen 2.948 N/A SER 427.A OG GLY 421.A O no hydrogen 2.896 N/A THR 429.A N GLU 436.A OE1 no hydrogen 3.108 N/A THR 429.A N GLU 436.A OE2 no hydrogen 3.271 N/A THR 429.A OG1 GLU 436.A OE1 no hydrogen 3.470 N/A THR 429.A OG1 GLU 436.A OE2 no hydrogen 2.652 N/A GLY 430.A N GLU 436.A OE1 no hydrogen 3.387 N/A ILE 431.A N THR 429.A OG1 no hydrogen 3.260 N/A LEU 433.A N ILE 431.A O no hydrogen 2.906 N/A SER 437.A N VAL 316.A O no hydrogen 2.910 N/A GLY 439.A N SER 437.A OG no hydrogen 3.180 N/A LEU 440.A N ASN 460.A O no hydrogen 2.881 N/A ASN 449.A N ASN 446.A OD1 no hydrogen 2.906 N/A PHE 450.A N ASN 446.A O no hydrogen 3.180 N/A ILE 451.A N PHE 447.A O no hydrogen 3.139 N/A THR 452.A N ALA 448.A O no hydrogen 2.966 N/A THR 452.A OG1 ALA 448.A O no hydrogen 3.214 N/A THR 452.A OG1 ASN 449.A O no hydrogen 2.977 N/A THR 452.A OG1 GLN 457.A O no hydrogen 3.468 N/A ASN 453.A N ASN 449.A O no hydrogen 2.820 N/A ASN 453.A ND2 ASP 459.A OD2 no hydrogen 3.119 N/A ALA 454.A N PHE 450.A O no hydrogen 3.304 N/A ALA 454.A N ILE 451.A O no hydrogen 3.070 N/A PHE 455.A N THR 452.A O no hydrogen 3.159 N/A GLY 456.A N ASN 453.A O no hydrogen 3.047 N/A GLN 457.A N THR 452.A O no hydrogen 2.869 N/A ASP 459.A N ASN 453.A OD1 no hydrogen 2.910 N/A ASN 460.A N LEU 440.A O no hydrogen 3.032 N/A ASN 460.A ND2 PHE 458.A O no hydrogen 3.087 N/A TYR 461.A N PHE 320.A O no hydrogen 2.953 N/A THR 462.A N GLN 465.A OE1 no hydrogen 2.919 N/A THR 462.A OG1 GLN 465.A OE1 no hydrogen 3.484 N/A MET 464.A N THR 315.A O no hydrogen 2.960 N/A GLN 465.A N THR 462.A OG1 no hydrogen 3.059 N/A GLN 465.A NE2 SER 427.A O no hydrogen 2.932 N/A GLN 465.A NE2 THR 438.A O no hydrogen 3.011 N/A LEU 466.A N THR 462.A O no hydrogen 3.149 N/A ALA 467.A N PRO 463.A O no hydrogen 2.941 N/A GLN 468.A N MET 464.A O no hydrogen 2.964 N/A GLN 468.A NE2 THR 429.A O no hydrogen 2.865 N/A GLN 468.A NE2 LEU 480.A O no hydrogen 2.934 N/A TYR 469.A N GLN 465.A O no hydrogen 2.973 N/A TYR 469.A OH VAL 325.A O no hydrogen 2.844 N/A VAL 470.A N LEU 466.A O no hydrogen 3.320 N/A ALA 471.A N ALA 467.A O no hydrogen 2.911 N/A THR 472.A N GLN 468.A O no hydrogen 2.869 N/A THR 472.A OG1 GLN 468.A O no hydrogen 2.704 N/A ILE 473.A N TYR 469.A O no hydrogen 3.223 N/A ALA 474.A N VAL 470.A O no hydrogen 2.942 N/A ASN 475.A N THR 472.A O no hydrogen 3.166 N/A ASN 475.A ND2 VAL 478.A O no hydrogen 2.816 N/A ASN 476.A N ILE 473.A O no hydrogen 3.086 N/A GLY 477.A N THR 472.A O no hydrogen 2.823 N/A VAL 478.A N ASN 475.A O no hydrogen 3.380 N/A ARG 479.A N ASN 510.A O no hydrogen 3.109 N/A ARG 479.A NH1 ASN 510.A OD1 no hydrogen 2.966 N/A ARG 479.A NH2 ALA 428.A O no hydrogen 2.559 N/A ARG 479.A NH2 GLN 468.A OE1 no hydrogen 3.076 N/A ALA 481.A N LYS 507.A O no hydrogen 3.143 N/A HIS 483.A N GLY 291.A O no hydrogen 2.868 N/A HIS 483.A ND1 VAL 485.A O no hydrogen 2.771 N/A ILE 484.A N ASP 432.A OD1 no hydrogen 2.878 N/A ILE 484.A N ASP 432.A OD2 no hydrogen 3.112 N/A VAL 485.A N ASP 432.A OD2 no hydrogen 3.146 N/A GLU 486.A N LYS 247.A O no hydrogen 2.648 N/A GLY 487.A N LYS 247.A O no hydrogen 3.359 N/A ILE 488.A N GLN 502.A O no hydrogen 2.824 N/A TYR 489.A N ASN 245.A O no hydrogen 2.666 N/A TYR 489.A OH GLU 486.A OE2 no hydrogen 2.619 N/A ASP 490.A N GLU 499.A O no hydrogen 2.798 N/A ASN 491.A N ASP 490.A OD1 no hydrogen 2.802 N/A ASN 492.A N GLY 496.A O no hydrogen 3.080 N/A GLY 495.A N ASN 492.A O no hydrogen 3.051 N/A GLY 496.A N ASN 492.A OD1 no hydrogen 2.796 N/A GLY 498.A N ASP 490.A O no hydrogen 2.721 N/A ILE 501.A N ILE 488.A O no hydrogen 2.810 N/A GLN 502.A N ILE 488.A O no hydrogen 3.162 N/A ILE 504.A N GLU 486.A O no hydrogen 3.026 N/A THR 506.A OG1 THR 290.A O no hydrogen 3.547 N/A GLU 508.A N GLU 508.A OE1 no hydrogen 2.870 N/A ILE 509.A N ARG 479.A O no hydrogen 2.991 N/A ASN 510.A ND2 GLU 422.A O no hydrogen 3.094 N/A VAL 512.A N GLY 477.A O no hydrogen 2.772 N/A ASN 513.A N GLU 422.A OE2 no hydrogen 3.087 N/A ILE 514.A N VAL 512.A O no hydrogen 2.940 N/A ASP 518.A N SER 515.A OG no hydrogen 3.117 N/A MET 519.A N SER 515.A O no hydrogen 3.109 N/A ALA 520.A N GLU 516.A O.A no hydrogen 3.110 N/A ILE 521.A N SER 517.A O no hydrogen 3.126 N/A LEU 522.A N ASP 518.A O no hydrogen 3.139 N/A HIS 523.A N MET 519.A O no hydrogen 3.035 N/A HIS 523.A NE2 ILE 473.A O no hydrogen 2.742 N/A GLN 524.A N ALA 520.A O no hydrogen 3.045 N/A GLY 525.A N ILE 521.A O no hydrogen 3.013 N/A PHE 526.A N LEU 522.A O no hydrogen 3.005 N/A TYR 527.A N HIS 523.A O no hydrogen 3.112 N/A GLN 528.A N GLN 524.A O no hydrogen 2.970 N/A VAL 529.A N GLY 525.A O no hydrogen 3.002 N/A SER 530.A N TYR 527.A O no hydrogen 3.230 N/A SER 530.A OG TYR 527.A O no hydrogen 3.048 N/A SER 530.A OG HIS 531.A ND1 no hydrogen 2.896 N/A SER 530.A OG ILE 550.A O no hydrogen 2.583 N/A HIS 531.A ND1 TYR 527.A O no hydrogen 2.883 N/A GLY 532.A N GLN 528.A O no hydrogen 2.879 N/A SER 534.A N THR 537.A OG1 no hydrogen 3.163 N/A LEU 536.A N SER 534.A OG no hydrogen 2.937 N/A THR 537.A N SER 534.A O no hydrogen 3.113 N/A THR 537.A OG1 GLU 379.A OE2 no hydrogen 2.566 N/A THR 537.A OG1 SER 534.A O no hydrogen 3.520 N/A THR 538.A N GLU 379.A O no hydrogen 3.274 N/A THR 538.A OG1 GLU 379.A O no hydrogen 2.963 N/A ARG 540.A NH1 GLY 532.A O no hydrogen 3.212 N/A ARG 540.A NH1 SER 534.A O no hydrogen 2.975 N/A ARG 540.A NH2 SER 534.A O no hydrogen 3.522 N/A PHE 542.A N GLY 539.A O no hydrogen 2.962 N/A SER 543.A N ARG 540.A O no hydrogen 3.028 N/A SER 543.A OG SER 530.A O no hydrogen 2.416 N/A ALA 546.A N SER 543.A O no hydrogen 3.007 N/A THR 547.A N ASN 597.A OD1 no hydrogen 3.039 N/A THR 547.A OG1 ASN 597.A OD1 no hydrogen 3.144 N/A SER 549.A OG THR 566.A OG1 no hydrogen 2.745 N/A SER 551.A N TYR 563.A O no hydrogen 3.060 N/A SER 551.A OG THR 566.A OG1 no hydrogen 2.773 N/A GLY 552.A N PHE 526.A O no hydrogen 3.020 N/A LYS 553.A N VAL 561.A O no hydrogen 2.890 N/A LYS 553.A NZ SER 324.A O no hydrogen 3.353 N/A LYS 553.A NZ SER 381.A OG no hydrogen 2.925 N/A LYS 553.A NZ THR 554.A O no hydrogen 2.960 N/A ASN 557.A ND2 VAL 321.A O no hydrogen 2.768 N/A THR 558.A N PHE 577.A O no hydrogen 3.184 N/A ASN 559.A ND2 VAL 321.A O no hydrogen 3.137 N/A ASN 559.A ND2 PRO 322.A O no hydrogen 2.870 N/A ALA 560.A N VAL 575.A O no hydrogen 2.959 N/A VAL 561.A N LYS 553.A O no hydrogen 3.061 N/A ALA 562.A N VAL 573.A O no hydrogen 2.999 N/A TYR 563.A N SER 551.A O no hydrogen 2.844 N/A ALA 564.A N ILE 571.A O no hydrogen 3.061 N/A THR 566.A N SER 549.A O no hydrogen 2.846 N/A THR 566.A OG1 SER 549.A OG no hydrogen 2.745 N/A THR 566.A OG1 SER 551.A OG no hydrogen 2.773 N/A ASN 568.A N PRO 565.A O no hydrogen 3.020 N/A GLN 570.A N ALA 564.A O no hydrogen 2.762 N/A GLN 570.A NE2 ASN 568.A O no hydrogen 3.071 N/A ILE 571.A N ALA 564.A O no hydrogen 3.057 N/A ALA 572.A N LEU 286.A O no hydrogen 2.858 N/A VAL 573.A N ALA 562.A O no hydrogen 2.786 N/A ALA 574.A N VAL 284.A O no hydrogen 3.007 N/A VAL 575.A N ALA 560.A O no hydrogen 2.811 N/A VAL 576.A N TYR 282.A O no hydrogen 2.830 N/A PHE 577.A N ASN 559.A OD1 no hydrogen 2.927 N/A HIS 579.A N ASN 557.A OD1 no hydrogen 3.058 N/A ASN 580.A ND2 GLU 269.A OE1 no hydrogen 2.630 N/A THR 581.A N GLY 274.A O no hydrogen 3.026 N/A ASN 582.A N ASN 580.A OD1 no hydrogen 2.873 N/A ASN 582.A ND2 ASN 272.A OD1 no hydrogen 3.404 N/A LYS 585.A NZ GLU 269.A OE2 no hydrogen 2.988 N/A GLY 588.A N ASN 586.A OD1 no hydrogen 2.981 N/A ILE 591.A N VAL 587.A O no hydrogen 2.847 N/A ALA 592.A N GLY 588.A O no hydrogen 3.065 N/A ARG 593.A N PRO 589.A O no hydrogen 2.870 N/A ARG 593.A NE ASP 594.A OD2 no hydrogen 2.941 N/A ARG 593.A NH1 ALA 541.A O no hydrogen 2.886 N/A ARG 593.A NH2 ASP 594.A OD2 no hydrogen 3.081 N/A ASP 594.A N ALA 590.A O no hydrogen 2.918 N/A ILE 595.A N ILE 591.A O no hydrogen 2.873 N/A ILE 596.A N ALA 592.A O no hydrogen 2.990 N/A ASN 597.A N ARG 593.A O no hydrogen 2.818 N/A ASN 597.A ND2 GLY 545.A O no hydrogen 3.051 N/A LEU 598.A N ASP 594.A O no hydrogen 2.945 N/A TYR 599.A N ILE 595.A O no hydrogen 3.014 N/A ASN 600.A N ILE 596.A O no hydrogen 2.950 N/A ASN 600.A ND2 THR 547.A OG1 no hydrogen 3.071 N/A GLN 601.A N ASN 597.A O no hydrogen 3.046 N/A HIS 602.A N LEU 598.A O no hydrogen 3.142 N/A HIS 603.A N TYR 599.A O no hydrogen 2.716 N/A MET 605.A N ASN 600.A OD1 no hydrogen 2.626 N/A