Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7smo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N VAL 1.A O no hydrogen 3.147 N/A VAL 6.A N LEU 4.A O no hydrogen 2.906 N/A LYS 11.A N PRO 7.A O no hydrogen 3.235 N/A LYS 11.A NZ VAL 1.A O no hydrogen 2.863 N/A LYS 11.A NZ LEU 4.A O no hydrogen 2.842 N/A GLU 12.A N GLU 8.A O no hydrogen 2.887 N/A VAL 13.A N LYS 9.A O no hydrogen 2.947 N/A LEU 14.A N PHE 10.A O no hydrogen 2.968 N/A LYS 15.A N LYS 11.A O no hydrogen 2.889 N/A LYS 15.A NZ ASP 2.A OD1 no hydrogen 2.971 N/A SER 16.A N GLU 12.A O no hydrogen 2.944 N/A SER 16.A OG GLU 12.A O no hydrogen 3.196 N/A SER 16.A OG VAL 13.A O no hydrogen 2.767 N/A GLU 17.A N LEU 14.A O no hydrogen 2.574 N/A GLN 26.A NE2 GLY 49.A O no hydrogen 2.724 N/A SER 27.A N LEU 23.A O no hydrogen 2.578 N/A LEU 28.A N PRO 24.A O no hydrogen 2.963 N/A ALA 29.A N VAL 25.A O no hydrogen 2.960 N/A VAL 30.A N GLN 26.A O no hydrogen 2.894 N/A LYS 31.A N SER 27.A O no hydrogen 2.957 N/A ASN 32.A N LEU 28.A O no hydrogen 2.953 N/A ASN 32.A N ALA 29.A O no hydrogen 3.163 N/A GLY 33.A N VAL 30.A O no hydrogen 2.871 N/A LEU 34.A N VAL 30.A O no hydrogen 3.250 N/A GLY 37.A N LEU 34.A O no hydrogen 3.427 N/A GLU 38.A N GLY 33.A O no hydrogen 3.387 N/A LEU 40.A N PHE 179.A O no hydrogen 2.895 N/A LEU 41.A N LYS 199.A O no hydrogen 2.947 N/A VAL 42.A N GLY 181.A O no hydrogen 2.914 N/A VAL 43.A N VAL 201.A O no hydrogen 2.927 N/A SER 44.A N SER 183.A O no hydrogen 2.917 N/A SER 44.A OG SER 48.A OG no hydrogen 3.139 N/A SER 48.A OG SER 44.A OG no hydrogen 3.139 N/A SER 48.A OG ALA 45.A O no hydrogen 2.539 N/A LYS 50.A NZ GLU 150.A OE2 no hydrogen 3.145 N/A ILE 53.A N LYS 50.A O no hydrogen 2.956 N/A GLY 54.A N THR 51.A O no hydrogen 3.053 N/A LEU 56.A N ILE 53.A O no hydrogen 3.004 N/A ALA 57.A N GLY 54.A O no hydrogen 2.964 N/A GLY 58.A N GLU 55.A O no hydrogen 2.975 N/A VAL 59.A N GLU 55.A O no hydrogen 3.130 N/A ALA 62.A N GLY 58.A O no hydrogen 2.751 N/A MET 63.A N VAL 59.A O no hydrogen 2.609 N/A MET 63.A N PRO 60.A O no hydrogen 2.970 N/A GLN 64.A N LYS 61.A O no hydrogen 2.952 N/A GLY 65.A N ALA 62.A O no hydrogen 3.043 N/A LYS 66.A N LYS 61.A O no hydrogen 2.865 N/A LYS 67.A NZ ILE 118.A O no hydrogen 3.314 N/A LYS 67.A NZ ILE 140.A O no hydrogen 3.396 N/A LEU 68.A N ASP 121.A O no hydrogen 3.322 N/A LEU 69.A N THR 145.A O no hydrogen 3.043 N/A PHE 70.A N ILE 123.A O no hydrogen 2.927 N/A LEU 71.A N VAL 147.A O no hydrogen 3.063 N/A VAL 72.A N GLY 125.A O no hydrogen 2.959 N/A ASN 79.A N VAL 75.A O no hydrogen 2.904 N/A ASN 79.A ND2 VAL 75.A O no hydrogen 2.625 N/A GLN 80.A N ALA 76.A O no hydrogen 2.865 N/A LYS 81.A N LEU 77.A O no hydrogen 2.965 N/A TYR 82.A N ALA 78.A O no hydrogen 2.803 N/A GLU 83.A N ASN 79.A O no hydrogen 2.868 N/A ASP 84.A N GLN 80.A O no hydrogen 3.008 N/A PHE 85.A N LYS 81.A O no hydrogen 2.958 N/A LYS 86.A N TYR 82.A O no hydrogen 2.945 N/A LYS 86.A NZ ASP 115.A OD2 no hydrogen 3.133 N/A ARG 87.A N GLU 83.A O no hydrogen 2.984 N/A ARG 87.A NH2 ASP 84.A OD1 no hydrogen 3.516 N/A ARG 88.A N ASP 84.A O no hydrogen 2.883 N/A ARG 88.A NH1 GLU 55.A OE2 no hydrogen 3.275 N/A ARG 88.A NH1 TYR 89.A OH no hydrogen 3.508 N/A TYR 89.A N PHE 85.A O no hydrogen 2.957 N/A TYR 89.A N LYS 86.A O no hydrogen 3.220 N/A TYR 89.A OH GLU 55.A OE1 no hydrogen 2.235 N/A SER 90.A N LYS 86.A O no hydrogen 2.904 N/A SER 90.A OG LYS 86.A O no hydrogen 3.263 N/A SER 90.A OG LEU 94.A O no hydrogen 3.179 N/A LEU 92.A N TYR 89.A O no hydrogen 2.816 N/A GLY 93.A N SER 90.A O no hydrogen 3.368 N/A ALA 97.A N ILE 122.A O no hydrogen 2.939 N/A ILE 98.A N ASP 115.A O no hydrogen 2.940 N/A ARG 99.A N VAL 124.A O no hydrogen 2.877 N/A SER 103.A OG LEU 111.A O no hydrogen 3.534 N/A ARG 104.A NE GLU 605.A OE1 no hydrogen 3.365 N/A ARG 104.A NH2 GLU 605.A OE1 no hydrogen 3.091 N/A LYS 106.A N GLU 631.A O no hydrogen 3.281 N/A LYS 106.A NZ GLU 631.A OE1 no hydrogen 3.074 N/A ILE 122.A N ARG 95.A O no hydrogen 2.758 N/A ILE 123.A N LEU 68.A O no hydrogen 2.932 N/A VAL 124.A N ALA 97.A O no hydrogen 2.949 N/A THR 126.A N ARG 99.A O no hydrogen 3.103 N/A TYR 127.A OH ASP 149.A O no hydrogen 2.689 N/A TYR 127.A OH GLU 150.A O no hydrogen 3.377 N/A GLY 129.A N THR 126.A OG1 no hydrogen 2.996 N/A ILE 130.A N TYR 127.A O no hydrogen 3.418 N/A ASP 131.A N TYR 127.A O no hydrogen 2.936 N/A TYR 132.A N GLU 128.A O no hydrogen 2.851 N/A LEU 134.A N ILE 130.A O no hydrogen 3.003 N/A ARG 135.A N ASP 131.A O no hydrogen 2.890 N/A ARG 135.A NH1 ASP 394.A O no hydrogen 3.143 N/A ARG 135.A NH1 SER 453.A OG no hydrogen 2.849 N/A ALA 136.A N TYR 132.A O no hydrogen 3.239 N/A ALA 136.A N LEU 133.A O no hydrogen 3.013 N/A GLY 137.A N LEU 134.A O no hydrogen 2.788 N/A ARG 138.A N LEU 133.A O no hydrogen 3.282 N/A ILE 140.A N TYR 174.A OH no hydrogen 3.311 N/A GLY 141.A N TYR 174.A OH no hydrogen 2.927 N/A ASN 142.A ND2 GLY 65.A O no hydrogen 3.026 N/A VAL 143.A N GLY 141.A O no hydrogen 2.882 N/A GLY 144.A N LYS 67.A O no hydrogen 2.650 N/A THR 145.A OG1 ALA 57.A O no hydrogen 3.323 N/A ILE 146.A N GLN 178.A O no hydrogen 2.949 N/A VAL 147.A N LEU 69.A O no hydrogen 3.027 N/A ILE 148.A N ILE 180.A O no hydrogen 2.999 N/A ASP 149.A N LEU 71.A O no hydrogen 3.187 N/A ILE 151.A N LEU 182.A O no hydrogen 3.232 N/A HIS 152.A ND1 SER 183.A OG no hydrogen 2.848 N/A THR 153.A OG1 GLU 150.A O no hydrogen 3.028 N/A THR 153.A OG1 ILE 151.A O no hydrogen 3.142 N/A LEU 154.A N ILE 151.A O no hydrogen 2.969 N/A ASP 155.A N HIS 152.A O no hydrogen 2.966 N/A GLU 158.A N ASP 156.A OD1 no hydrogen 3.246 N/A ARG 159.A NH2 PRO 73.A O no hydrogen 2.414 N/A GLY 160.A N ASP 156.A O no hydrogen 3.091 N/A LEU 163.A N ARG 159.A O no hydrogen 3.096 N/A ASP 164.A N GLY 160.A O no hydrogen 2.926 N/A GLY 165.A N PRO 161.A O no hydrogen 3.000 N/A LEU 166.A N ARG 162.A O no hydrogen 2.880 N/A ILE 167.A N LEU 163.A O no hydrogen 2.907 N/A ALA 168.A N ASP 164.A O no hydrogen 2.994 N/A ARG 169.A N GLY 165.A O no hydrogen 3.000 N/A ARG 169.A NH1 ASN 395.A OD1 no hydrogen 3.525 N/A ARG 169.A NH2 ASN 395.A OD1 no hydrogen 2.698 N/A LEU 170.A N LEU 166.A O no hydrogen 2.911 N/A ARG 171.A N ILE 167.A O no hydrogen 2.860 N/A LYS 172.A N ALA 168.A O no hydrogen 3.027 N/A LYS 172.A NZ GLU 411.A OE2 no hydrogen 3.081 N/A LEU 173.A N ARG 169.A O no hydrogen 2.879 N/A TYR 174.A N LEU 170.A O no hydrogen 3.047 N/A GLN 178.A N GLY 144.A O no hydrogen 2.958 N/A GLN 178.A NE2 LEU 34.A O no hydrogen 2.552 N/A GLN 178.A NE2 GLU 38.A O no hydrogen 2.555 N/A PHE 179.A N ASN 39.A OD1 no hydrogen 2.812 N/A ILE 180.A N ILE 146.A O no hydrogen 2.904 N/A GLY 181.A N LEU 40.A O no hydrogen 3.035 N/A LEU 182.A N ILE 148.A O no hydrogen 2.879 N/A SER 183.A N VAL 42.A O no hydrogen 2.938 N/A SER 183.A OG HIS 152.A ND1 no hydrogen 2.848 N/A SER 183.A OG ALA 184.A O no hydrogen 2.808 N/A ALA 184.A N HIS 152.A ND1 no hydrogen 3.267 N/A LEU 192.A N ASN 188.A O no hydrogen 3.168 N/A ALA 193.A N PRO 189.A O no hydrogen 2.891 N/A LYS 194.A N ASP 190.A O no hydrogen 2.981 N/A GLU 195.A N GLU 191.A O no hydrogen 2.967 N/A LEU 196.A N ALA 193.A O no hydrogen 3.212 N/A GLY 197.A N LYS 194.A O no hydrogen 3.427 N/A LYS 199.A N ASN 39.A O no hydrogen 3.187 N/A VAL 201.A N LEU 41.A O no hydrogen 2.907 N/A TYR 203.A N VAL 43.A O no hydrogen 2.955 N/A TYR 203.A OH GLU 205.A OE1 no hydrogen 2.915 N/A ARG 206.A NH1 ALA 339.A O no hydrogen 3.283 N/A GLU 211.A N GLY 348.A O no hydrogen 2.819 N/A HIS 213.A N VAL 350.A O no hydrogen 2.859 N/A ILE 215.A N LEU 352.A O no hydrogen 3.234 N/A VAL 217.A N VAL 354.A O no hydrogen 3.009 N/A ARG 218.A N GLU 222.A OE1 no hydrogen 3.519 N/A SER 221.A N ASN 219.A OD1 no hydrogen 2.421 N/A SER 221.A OG ASN 219.A OD1 no hydrogen 3.183 N/A LYS 223.A N ASN 219.A O no hydrogen 3.314 N/A LYS 223.A NZ GLU 318.A O no hydrogen 3.293 N/A TRP 224.A N GLU 220.A O no hydrogen 2.924 N/A ARG 225.A N SER 221.A O no hydrogen 2.948 N/A HIS 226.A N GLU 222.A O no hydrogen 2.886 N/A ILE 227.A N LYS 223.A O no hydrogen 2.899 N/A ALA 228.A N TRP 224.A O no hydrogen 2.884 N/A ASN 229.A N ARG 225.A O no hydrogen 2.929 N/A LEU 230.A N HIS 226.A O no hydrogen 2.794 N/A CYS 231.A N ILE 227.A O no hydrogen 2.951 N/A CYS 231.A SG ILE 227.A O no hydrogen 3.158 N/A ARG 232.A N ALA 228.A O no hydrogen 2.931 N/A ARG 232.A NH1 ASN 229.A OD1 no hydrogen 3.013 N/A ARG 232.A NH2 ASN 229.A OD1 no hydrogen 2.687 N/A ALA 233.A N ASN 229.A O no hydrogen 2.878 N/A GLU 234.A N LEU 230.A O no hydrogen 2.847 N/A ALA 235.A N CYS 231.A O no hydrogen 2.917 N/A MET 236.A N ALA 233.A O no hydrogen 2.906 N/A LYS 238.A NZ TYR 243.A O no hydrogen 2.702 N/A SER 239.A OG GLN 241.A O no hydrogen 3.422 N/A LYS 240.A NZ GLN 241.A OE1 no hydrogen 2.893 N/A GLN 241.A N SER 239.A OG no hydrogen 3.032 N/A LYS 244.A NZ GLN 293.A O no hydrogen 2.247 N/A GLN 246.A N SER 313.A OG no hydrogen 2.891 N/A GLN 246.A NE2 PHE 290.A O no hydrogen 3.070 N/A SER 247.A N ASP 296.A O no hydrogen 2.739 N/A ILE 248.A N GLN 314.A O no hydrogen 2.956 N/A VAL 249.A N VAL 298.A O no hydrogen 2.901 N/A PHE 250.A N ILE 316.A O no hydrogen 2.865 N/A THR 251.A N THR 300.A O no hydrogen 2.879 N/A THR 251.A OG1 GLU 318.A OE1 no hydrogen 3.055 N/A PHE 252.A N THR 251.A OG1 no hydrogen 2.724 N/A ARG 254.A NH1 ASP 592.A OD1 no hydrogen 3.502 N/A LYS 255.A NZ LEU 489.A O no hydrogen 2.906 N/A LYS 255.A NZ GLN 494.A OE1 no hydrogen 2.530 N/A ARG 256.A N SER 253.A OG no hydrogen 3.221 N/A ARG 256.A NH1 GLU 259.A OE1 no hydrogen 2.622 N/A ARG 256.A NH2 GLU 220.A OE2 no hydrogen 3.138 N/A THR 257.A N SER 253.A O no hydrogen 3.183 N/A THR 257.A OG1 ARG 254.A O no hydrogen 2.677 N/A THR 257.A OG1 HIS 258.A ND1 no hydrogen 3.231 N/A HIS 258.A N ARG 254.A O no hydrogen 3.038 N/A GLU 259.A N LYS 255.A O no hydrogen 2.947 N/A LEU 260.A N ARG 256.A O no hydrogen 2.898 N/A ALA 261.A N THR 257.A O no hydrogen 2.894 N/A ALA 262.A N HIS 258.A O no hydrogen 3.000 N/A TYR 263.A N GLU 259.A O no hydrogen 2.996 N/A LEU 264.A N LEU 260.A O no hydrogen 2.929 N/A THR 265.A N ALA 261.A O no hydrogen 2.916 N/A THR 265.A OG1 ALA 261.A O no hydrogen 2.627 N/A THR 265.A OG1 ALA 271.A O no hydrogen 3.141 N/A SER 266.A N ALA 262.A O no hydrogen 2.912 N/A SER 266.A OG TYR 263.A O no hydrogen 2.282 N/A LYS 267.A N TYR 263.A O no hydrogen 3.003 N/A GLY 268.A N THR 265.A O no hydrogen 2.888 N/A LEU 269.A N LEU 264.A O no hydrogen 2.998 N/A LYS 270.A N ASP 296.A OD2 no hydrogen 3.427 N/A LYS 272.A N VAL 297.A O no hydrogen 3.038 N/A TYR 274.A N VAL 299.A O no hydrogen 2.956 N/A LEU 278.A N SER 276.A O no hydrogen 2.581 N/A ARG 283.A N PRO 279.A O no hydrogen 3.129 N/A ARG 283.A NE LEU 278.A O no hydrogen 2.983 N/A ARG 283.A NH2 LEU 278.A O no hydrogen 3.040 N/A LYS 284.A N TYR 280.A O no hydrogen 2.999 N/A LYS 284.A NZ GLU 287.A OE1 no hydrogen 3.411 N/A LYS 284.A NZ GLU 287.A OE2 no hydrogen 3.321 N/A LEU 285.A N LYS 281.A O no hydrogen 2.952 N/A THR 286.A N GLN 282.A O no hydrogen 2.811 N/A THR 286.A OG1 GLN 282.A O no hydrogen 2.810 N/A GLU 287.A N ARG 283.A O no hydrogen 2.925 N/A MET 288.A N LYS 284.A O no hydrogen 2.967 N/A GLU 289.A N LEU 285.A O no hydrogen 2.878 N/A PHE 290.A N THR 286.A O no hydrogen 2.928 N/A LEU 291.A N GLU 287.A O no hydrogen 3.016 N/A ALA 292.A N MET 288.A O no hydrogen 3.258 N/A GLN 293.A N PHE 290.A O no hydrogen 3.427 N/A ARG 294.A N GLU 289.A O no hydrogen 3.266 N/A ASP 296.A N LYS 270.A O no hydrogen 2.736 N/A VAL 297.A N LYS 270.A O no hydrogen 3.127 N/A VAL 298.A N SER 247.A O no hydrogen 2.974 N/A VAL 299.A N LYS 272.A O no hydrogen 2.929 N/A THR 300.A N VAL 249.A O no hydrogen 2.845 N/A THR 300.A OG1 TYR 274.A O no hydrogen 3.272 N/A THR 300.A OG1 THR 301.A O no hydrogen 2.778 N/A ALA 303.A N THR 301.A OG1 no hydrogen 3.223 N/A GLY 305.A N ALA 303.A O no hydrogen 2.974 N/A SER 313.A N GLN 246.A O no hydrogen 2.923 N/A SER 313.A OG GLU 234.A OE2 no hydrogen 3.232 N/A SER 313.A OG GLN 246.A O no hydrogen 2.596 N/A VAL 315.A N LYS 349.A O no hydrogen 2.957 N/A ILE 316.A N ILE 248.A O no hydrogen 2.794 N/A PHE 317.A N TYR 351.A O no hydrogen 2.906 N/A ALA 321.A N SER 319.A OG no hydrogen 3.315 N/A MET 322.A N LYS 325.A O no hydrogen 2.732 N/A GLY 323.A N PHE 252.A O no hydrogen 3.505 N/A ASN 324.A ND2 GLN 363.A OE1 no hydrogen 3.289 N/A TRP 326.A NE1 GLY 366.A O no hydrogen 2.915 N/A LEU 327.A N LEU 320.A O no hydrogen 2.764 N/A SER 328.A N GLU 331.A OE1 no hydrogen 2.654 N/A VAL 329.A N GLU 381.A OE2 no hydrogen 3.216 N/A ARG 330.A NH2 GLU 381.A O no hydrogen 3.068 N/A GLU 331.A N SER 328.A OG no hydrogen 2.989 N/A PHE 332.A N SER 328.A O no hydrogen 2.760 N/A HIS 333.A N VAL 329.A O no hydrogen 2.831 N/A GLN 334.A N ARG 330.A O no hydrogen 2.924 N/A GLN 334.A NE2 HIS 152.A NE2 no hydrogen 3.020 N/A MET 335.A N GLU 331.A O no hydrogen 2.914 N/A LEU 336.A N PHE 332.A O no hydrogen 2.919 N/A GLY 337.A N HIS 333.A O no hydrogen 2.829 N/A ARG 338.A NH2 GLY 305.A O no hydrogen 2.495 N/A ALA 339.A N LEU 336.A O no hydrogen 2.618 N/A ARG 341.A NH2 GLY 337.A O no hydrogen 2.811 N/A LEU 343.A N GLY 340.A O no hydrogen 3.264 N/A HIS 345.A NE2 TYR 243.A OH no hydrogen 2.656 N/A LYS 349.A NZ GLU 234.A OE2 no hydrogen 2.917 N/A LYS 349.A NZ SER 313.A O no hydrogen 3.396 N/A VAL 350.A N GLU 211.A O no hydrogen 3.205 N/A TYR 351.A N VAL 315.A O no hydrogen 2.897 N/A LEU 353.A N PHE 317.A O no hydrogen 3.015 N/A GLU 355.A N GLU 368.A OE1 no hydrogen 3.262 N/A GLY 357.A N ASP 369.A OD1 no hydrogen 2.958 N/A ARG 358.A N GLU 355.A O no hydrogen 3.077 N/A ARG 358.A NH1 GLU 355.A OE2 no hydrogen 3.134 N/A LYS 359.A NZ MET 364.A O no hydrogen 2.821 N/A TYR 360.A OH GLU 368.A OE1 no hydrogen 2.920 N/A TYR 360.A OH GLU 368.A OE2 no hydrogen 3.106 N/A SER 361.A OG GLN 363.A OE1 no hydrogen 2.855 N/A ALA 362.A N GLN 363.A OE1 no hydrogen 3.210 N/A GLN 363.A N GLN 363.A OE1 no hydrogen 2.530 N/A MET 364.A N SER 361.A OG no hydrogen 3.429 N/A THR 367.A OG1 ASP 369.A OD2 no hydrogen 2.755 N/A GLU 368.A N ARG 358.A O no hydrogen 3.055 N/A VAL 371.A N THR 367.A O no hydrogen 3.072 N/A ALA 372.A N GLU 368.A O no hydrogen 2.886 N/A PHE 373.A N ASP 369.A O no hydrogen 3.038 N/A LYS 374.A N GLU 370.A O no hydrogen 2.983 N/A LYS 374.A NZ LEU 327.A O no hydrogen 3.531 N/A LEU 375.A N VAL 371.A O no hydrogen 2.933 N/A LEU 376.A N ALA 372.A O no hydrogen 3.042 N/A THR 377.A N PHE 373.A O no hydrogen 3.038 N/A THR 377.A OG1 PHE 373.A O no hydrogen 2.554 N/A ALA 378.A N LYS 374.A O no hydrogen 3.189 N/A GLU 381.A N GLU 381.A OE1 no hydrogen 2.832 N/A VAL 383.A N ASN 188.A OD1 no hydrogen 3.383 N/A GLN 384.A N ASP 155.A OD1 no hydrogen 2.630 N/A SER 388.A OG ASP 389.A OD1 no hydrogen 3.046 N/A GLU 392.A N SER 388.A O no hydrogen 3.038 N/A GLN 393.A N ASP 389.A O no hydrogen 2.948 N/A ASP 394.A N GLU 390.A O no hydrogen 2.874 N/A ASN 395.A N LEU 391.A O no hydrogen 2.949 N/A ASN 395.A ND2 PRO 161.A O no hydrogen 2.597 N/A ASN 395.A ND2 LEU 391.A O no hydrogen 3.535 N/A VAL 396.A N GLU 392.A O no hydrogen 2.931 N/A LEU 397.A N GLN 393.A O no hydrogen 2.896 N/A ALA 398.A N ASP 394.A O no hydrogen 2.868 N/A HIS 399.A N ASN 395.A O no hydrogen 2.898 N/A SER 400.A N VAL 396.A O no hydrogen 2.961 N/A SER 400.A OG VAL 396.A O no hydrogen 3.246 N/A CYS 401.A N LEU 397.A O no hydrogen 2.906 N/A CYS 401.A SG LEU 397.A O no hydrogen 3.402 N/A CYS 401.A SG GLY 449.A O no hydrogen 3.887 N/A VAL 402.A N ALA 398.A O no hydrogen 2.911 N/A PHE 403.A N HIS 399.A O no hydrogen 2.540 N/A ASN 404.A N ASN 404.A OD1 no hydrogen 2.569 N/A ARG 405.A NE ASP 407.A OD1 no hydrogen 3.162 N/A ARG 405.A NH2 ASP 407.A OD2 no hydrogen 3.377 N/A LEU 406.A N PRO 441.A O no hydrogen 3.113 N/A VAL 408.A N ASP 407.A OD1 no hydrogen 2.619 N/A ILE 409.A N ARG 405.A O no hydrogen 2.955 N/A GLU 410.A N LEU 406.A O no hydrogen 2.888 N/A GLU 411.A N ASP 407.A O no hydrogen 2.949 N/A VAL 412.A N VAL 408.A O no hydrogen 2.933 N/A GLN 413.A N ILE 409.A O no hydrogen 2.912 N/A SER 414.A N GLU 410.A O no hydrogen 2.920 N/A SER 414.A OG GLU 411.A O no hydrogen 2.701 N/A MET 415.A N GLU 411.A O no hydrogen 2.975 N/A CYS 416.A N GLN 413.A O no hydrogen 2.988 N/A CYS 416.A SG VAL 412.A O no hydrogen 3.147 N/A CYS 416.A SG GLN 413.A OE1 no hydrogen 3.854 N/A LEU 417.A N ASP 164.A OD2 no hydrogen 3.283 N/A GLY 418.A N ASP 164.A OD2 no hydrogen 2.966 N/A ASN 420.A N GLU 392.A OE2 no hydrogen 2.787 N/A GLN 421.A N GLU 392.A OE2 no hydrogen 3.263 N/A ALA 423.A N GLU 410.A OE2 no hydrogen 2.471 N/A LYS 425.A N SER 422.A OG no hydrogen 3.329 N/A LEU 427.A N ALA 423.A O no hydrogen 2.864 N/A GLU 428.A N GLU 424.A O no hydrogen 2.904 N/A LYS 429.A N LYS 425.A O no hydrogen 2.942 N/A LEU 430.A N VAL 426.A O no hydrogen 2.891 N/A GLU 431.A N LEU 427.A O no hydrogen 2.859 N/A GLU 432.A N GLU 428.A O no hydrogen 2.989 N/A ASP 434.A N GLU 431.A O no hydrogen 3.305 N/A PHE 435.A N LEU 430.A O no hydrogen 3.108 N/A LYS 437.A N GLU 444.A O no hydrogen 2.930 N/A LYS 439.A N ILE 442.A O no hydrogen 2.990 N/A LYS 439.A NZ GLU 444.A OE1 no hydrogen 3.230 N/A ARG 440.A NH2 GLU 428.A OE2 no hydrogen 3.091 N/A ILE 442.A N LYS 439.A O no hydrogen 2.902 N/A VAL 443.A N ASN 404.A O no hydrogen 2.978 N/A GLU 444.A N LYS 437.A O no hydrogen 2.904 N/A THR 446.A OG1 ASP 434.A O no hydrogen 2.937 N/A THR 446.A OG1 PHE 435.A O no hydrogen 2.489 N/A GLY 449.A N THR 446.A OG1 no hydrogen 3.184 N/A ARG 450.A N THR 446.A O no hydrogen 2.796 N/A ARG 450.A NH1 CYS 401.A O no hydrogen 3.409 N/A ARG 450.A NH2 CYS 401.A O no hydrogen 3.238 N/A ALA 451.A N PRO 447.A O no hydrogen 2.902 N/A VAL 452.A N TYR 448.A O no hydrogen 3.026 N/A SER 453.A N GLY 449.A O no hydrogen 3.012 N/A MET 454.A N ARG 450.A O no hydrogen 2.944 N/A SER 455.A N ALA 451.A O no hydrogen 2.948 N/A SER 455.A N VAL 452.A O no hydrogen 3.193 N/A SER 455.A OG ALA 451.A O no hydrogen 3.238 N/A PHE 456.A N SER 453.A O no hydrogen 2.886 N/A LEU 457.A N VAL 452.A O no hydrogen 3.412 N/A LEU 458.A N GLU 461.A OE1 no hydrogen 2.903 N/A ALA 462.A N LEU 458.A O no hydrogen 2.933 N/A THR 463.A N PRO 459.A O no hydrogen 2.975 N/A THR 463.A OG1 PRO 459.A O no hydrogen 2.715 N/A THR 463.A OG1 LYS 460.A O no hydrogen 2.908 N/A PHE 464.A N LYS 460.A O no hydrogen 2.927 N/A ILE 465.A N GLU 461.A O no hydrogen 3.004 N/A ARG 466.A N ALA 462.A O no hydrogen 2.940 N/A ARG 466.A NH2 PHE 433.A O no hydrogen 3.165 N/A GLY 467.A N THR 463.A O no hydrogen 2.906 N/A ASN 468.A N PHE 464.A O no hydrogen 2.951 N/A LYS 471.A NZ GLY 467.A O no hydrogen 3.163 N/A ILE 477.A N GLU 473.A O no hydrogen 3.203 N/A ALA 478.A N ALA 474.A O no hydrogen 2.974 N/A VAL 479.A N ARG 475.A O no hydrogen 2.908 N/A LYS 480.A N TRP 476.A O no hydrogen 2.921 N/A LEU 481.A N ILE 477.A O no hydrogen 2.957 N/A LEU 482.A N ALA 478.A O no hydrogen 3.086 N/A PHE 484.A N SER 560.A OG no hydrogen 2.889 N/A TYR 488.A N ILE 587.A O no hydrogen 2.885 N/A LEU 489.A N ALA 507.A O no hydrogen 3.281 N/A SER 490.A N GLY 585.A O no hydrogen 3.271 N/A SER 490.A OG GLY 585.A O no hydrogen 3.070 N/A GLN 494.A N SER 490.A O no hydrogen 2.803 N/A ARG 495.A N GLY 491.A O no hydrogen 2.965 N/A ARG 495.A NE GLY 491.A O no hydrogen 2.770 N/A GLU 496.A N THR 492.A O no hydrogen 2.948 N/A LEU 497.A N LEU 493.A O no hydrogen 2.936 N/A GLU 498.A N GLN 494.A O no hydrogen 2.847 N/A GLY 499.A N ARG 495.A O no hydrogen 3.002 N/A SER 506.A N SER 513.A OG no hydrogen 2.943 N/A ASN 508.A N SER 506.A OG no hydrogen 3.311 N/A ASN 508.A ND2 GLU 485.A O no hydrogen 3.411 N/A VAL 509.A N ASN 508.A OD1 no hydrogen 2.358 N/A PHE 510.A N ASN 508.A OD1 no hydrogen 3.358 N/A SER 511.A OG SER 513.A OG no hydrogen 2.405 N/A SER 513.A OG SER 511.A OG no hydrogen 2.405 N/A PHE 514.A N SER 511.A O no hydrogen 2.866 N/A ALA 515.A N SER 511.A O no hydrogen 3.235 N/A SER 516.A N PRO 512.A O no hydrogen 2.927 N/A SER 516.A OG PRO 512.A O no hydrogen 3.206 N/A LEU 518.A N PHE 514.A O no hydrogen 2.947 N/A GLU 519.A N ALA 515.A O no hydrogen 2.932 N/A GLU 520.A N ILE 517.A O no hydrogen 3.013 N/A LYS 523.A N GLU 520.A O no hydrogen 3.306 N/A VAL 524.A N GLU 520.A O no hydrogen 2.665 N/A ILE 525.A N LEU 521.A O no hydrogen 2.885 N/A GLU 527.A N ILE 525.A O no hydrogen 2.408 N/A SER 529.A N GLU 496.A OE1 no hydrogen 3.415 N/A ALA 533.A N SER 529.A O no hydrogen 2.997 N/A GLU 534.A N PRO 530.A O no hydrogen 2.915 N/A ARG 535.A N ASN 531.A O no hydrogen 3.015 N/A LEU 536.A N ALA 532.A O no hydrogen 2.984 N/A PHE 537.A N ALA 533.A O no hydrogen 2.943 N/A THR 538.A N GLU 534.A O no hydrogen 2.994 N/A THR 538.A OG1 GLU 534.A O no hydrogen 2.841 N/A ILE 539.A N ARG 535.A O no hydrogen 2.947 N/A TYR 540.A N LEU 536.A O no hydrogen 2.951 N/A GLN 541.A N PHE 537.A O no hydrogen 2.862 N/A GLU 542.A N THR 538.A O no hydrogen 2.971 N/A PHE 543.A N ILE 539.A O no hydrogen 2.984 N/A PHE 544.A N TYR 540.A O no hydrogen 2.844 N/A CYS 546.A SG GLU 548.A O no hydrogen 3.280 N/A CYS 546.A SG ASP 550.A O no hydrogen 3.388 N/A CYS 551.A SG PHE 544.A O no hydrogen 3.728 N/A CYS 551.A SG GLU 548.A O no hydrogen 3.729 N/A CYS 551.A SG GLU 549.A O no hydrogen 3.605 N/A THR 552.A OG1 ASP 550.A OD1 no hydrogen 2.804 N/A THR 552.A OG1 ASP 550.A OD2 no hydrogen 3.148 N/A ALA 555.A N CYS 551.A O no hydrogen 2.982 N/A MET 556.A N THR 552.A O no hydrogen 2.990 N/A GLU 557.A N GLU 553.A O no hydrogen 2.934 N/A ARG 558.A N TYR 554.A O no hydrogen 2.944 N/A VAL 559.A N ALA 555.A O no hydrogen 2.969 N/A SER 560.A N MET 556.A O no hydrogen 3.012 N/A SER 560.A OG MET 556.A O no hydrogen 3.057 N/A ASN 561.A N GLU 557.A O no hydrogen 2.885 N/A LEU 562.A N ARG 558.A O no hydrogen 2.944 N/A ILE 563.A N VAL 559.A O no hydrogen 2.950 N/A ILE 564.A N SER 560.A O no hydrogen 2.930 N/A GLU 565.A N ASN 561.A O no hydrogen 2.882 N/A LEU 566.A N LEU 562.A O no hydrogen 2.965 N/A ARG 567.A N ILE 563.A O no hydrogen 2.969 N/A ARG 567.A NE ILE 630.A O no hydrogen 2.995 N/A ARG 567.A NH1 LYS 571.A O no hydrogen 2.964 N/A ARG 567.A NH2 LYS 106.A O no hydrogen 3.391 N/A ARG 567.A NH2 GLU 631.A O no hydrogen 3.085 N/A ARG 568.A N ILE 564.A O no hydrogen 2.942 N/A SER 569.A N GLU 565.A O no hydrogen 3.373 N/A SER 569.A OG GLU 565.A O no hydrogen 3.253 N/A SER 569.A OG LEU 566.A O no hydrogen 2.499 N/A GLY 570.A N ARG 567.A O no hydrogen 3.303 N/A LYS 571.A N LEU 566.A O no hydrogen 3.280 N/A HIS 572.A N GLN 575.A OE1 no hydrogen 2.468 N/A THR 574.A N HIS 572.A ND1 no hydrogen 3.429 N/A THR 574.A OG1 HIS 572.A ND1 no hydrogen 3.377 N/A ILE 576.A N HIS 572.A O no hydrogen 2.820 N/A ALA 577.A N PRO 573.A O no hydrogen 2.902 N/A GLU 578.A N THR 574.A O no hydrogen 2.938 N/A HIS 579.A N GLN 575.A O no hydrogen 2.894 N/A HIS 579.A ND1 ILE 576.A O no hydrogen 3.228 N/A PHE 580.A N ILE 576.A O no hydrogen 2.950 N/A ARG 581.A N ALA 577.A O no hydrogen 2.950 N/A LYS 582.A N GLU 578.A O no hydrogen 2.910 N/A VAL 583.A N HIS 579.A O no hydrogen 2.876 N/A TYR 584.A N PHE 580.A O no hydrogen 3.168 N/A GLY 585.A N ARG 581.A O no hydrogen 2.812 N/A LEU 586.A N PHE 580.A O no hydrogen 3.460 N/A ILE 587.A N TYR 488.A O no hydrogen 2.931 N/A GLY 591.A N GLY 277.A O no hydrogen 3.264 N/A VAL 593.A N TYR 589.A O no hydrogen 2.732 N/A PHE 594.A N PRO 590.A O no hydrogen 2.901 N/A THR 595.A N GLY 591.A O no hydrogen 2.951 N/A THR 595.A OG1 GLY 591.A O no hydrogen 2.310 N/A TRP 596.A N ASP 592.A O no hydrogen 2.879 N/A TRP 596.A NE1 LEU 482.A O no hydrogen 2.948 N/A LEU 597.A N VAL 593.A O no hydrogen 2.912 N/A ASP 598.A N PHE 594.A O no hydrogen 2.916 N/A GLY 599.A N THR 595.A O no hydrogen 2.886 N/A ILE 600.A N TRP 596.A O no hydrogen 2.874 N/A VAL 601.A N LEU 597.A O no hydrogen 2.892 N/A ARG 602.A N ASP 598.A O no hydrogen 2.912 N/A ARG 602.A NH2 GLY 101.A O no hydrogen 3.191 N/A LYS 603.A N GLY 599.A O no hydrogen 2.889 N/A LEU 604.A N ILE 600.A O no hydrogen 2.843 N/A GLU 605.A N VAL 601.A O no hydrogen 2.841 N/A ALA 606.A N ARG 602.A O no hydrogen 2.913 N/A ILE 607.A N LYS 603.A O no hydrogen 2.871 N/A GLU 608.A N LEU 604.A O no hydrogen 2.845 N/A ARG 609.A N GLU 605.A O no hydrogen 2.878 N/A ARG 609.A NH1 TYR 132.A OH no hydrogen 3.551 N/A ILE 610.A N ALA 606.A O no hydrogen 2.946 N/A ALA 611.A N ILE 607.A O no hydrogen 2.853 N/A ARG 612.A N GLU 608.A O no hydrogen 2.856 N/A VAL 613.A N ARG 609.A O no hydrogen 2.911 N/A PHE 614.A N ILE 610.A O no hydrogen 3.312 N/A VAL 616.A N ALA 611.A O no hydrogen 2.687 N/A LYS 618.A NZ GLY 470.A O no hydrogen 2.973 N/A LYS 618.A NZ ARG 472.A O no hydrogen 2.724 N/A GLU 620.A N VAL 616.A O no hydrogen 3.317 N/A GLU 621.A N ARG 617.A O no hydrogen 2.934 N/A GLY 622.A N LYS 618.A O no hydrogen 2.907 N/A ALA 623.A N THR 619.A O no hydrogen 2.783 N/A LYS 624.A N GLU 620.A O no hydrogen 2.953 N/A LYS 624.A NZ GLU 620.A OE2 no hydrogen 3.558 N/A ILE 625.A N GLU 621.A O no hydrogen 2.965 N/A LEU 626.A N GLY 622.A O no hydrogen 2.915 N/A LYS 627.A N ALA 623.A O no hydrogen 2.829 N/A LYS 627.A NZ GLU 608.A OE2 no hydrogen 3.549 N/A ARG 628.A N LYS 624.A O no hydrogen 3.030 N/A GLU 629.A N ILE 625.A O no hydrogen 2.866 N/A ILE 630.A N LEU 626.A O no hydrogen 2.945 N/A GLU 631.A N LYS 627.A O no hydrogen 2.900 N/A GLU 632.A N ARG 628.A O no hydrogen 2.966 N/A