Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3abt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N GLY 2.A O no hydrogen 3.015 N/A ALA 7.A N VAL 3.A O no hydrogen 3.473 N/A PHE 8.A N GLU 4.A O no hydrogen 3.424 N/A GLN 9.A N GLY 5.A O no hydrogen 2.884 N/A GLN 9.A NE2 LEU 166.A O no hydrogen 3.610 N/A SER 10.A N ALA 7.A O no hydrogen 3.251 N/A SER 10.A OG ALA 6.A O no hydrogen 2.979 N/A ARG 11.A N PHE 8.A O no hydrogen 2.802 N/A ARG 11.A NH1 GLN 9.A O no hydrogen 3.502 N/A LEU 12.A N ALA 7.A O no hydrogen 2.798 N/A ARG 16.A N PRO 13.A O no hydrogen 3.242 N/A THR 18.A N GLU 21.A OE1 no hydrogen 3.235 N/A GLU 21.A N THR 18.A OG1 no hydrogen 3.166 N/A ALA 22.A N THR 18.A O no hydrogen 2.953 N/A ALA 23.A N GLN 20.A O no hydrogen 2.686 N/A CYS 24.A N GLN 20.A O no hydrogen 3.060 N/A CYS 24.A SG GLN 20.A O no hydrogen 3.833 N/A PHE 25.A N GLU 21.A O no hydrogen 3.007 N/A ILE 28.A N PHE 25.A O no hydrogen 3.032 N/A ILE 29.A N PHE 25.A O no hydrogen 3.088 N/A SER 30.A N PRO 26.A O no hydrogen 2.783 N/A SER 30.A OG PRO 26.A O no hydrogen 2.567 N/A THR 35.A N PRO 32.A O no hydrogen 2.908 N/A GLN 36.A N PRO 32.A O no hydrogen 3.319 N/A GLN 36.A NE2 GLY 31.A O no hydrogen 3.064 N/A LYS 37.A N GLN 33.A O no hydrogen 2.769 N/A VAL 38.A N GLN 34.A O no hydrogen 3.302 N/A VAL 38.A N THR 35.A O no hydrogen 2.749 N/A PHE 39.A N THR 35.A O no hydrogen 2.849 N/A LEU 40.A N GLN 36.A O no hydrogen 3.185 N/A ILE 42.A N VAL 38.A O no hydrogen 3.071 N/A ARG 43.A N PHE 39.A O no hydrogen 2.912 N/A ARG 43.A NH1 PRO 13.A O no hydrogen 3.349 N/A ARG 43.A NH2 PRO 13.A O no hydrogen 3.332 N/A ARG 43.A NH2 ARG 16.A O no hydrogen 3.045 N/A ASN 44.A N LEU 40.A O no hydrogen 2.647 N/A ASN 44.A ND2 HIS 14.A O no hydrogen 3.288 N/A ARG 45.A N PHE 41.A O no hydrogen 2.592 N/A ARG 45.A NH1 GLN 66.A O no hydrogen 3.046 N/A THR 46.A N ILE 42.A O no hydrogen 2.809 N/A THR 46.A OG1 ILE 42.A O no hydrogen 2.692 N/A LEU 47.A N ARG 43.A O no hydrogen 3.087 N/A GLN 48.A N ASN 44.A O no hydrogen 3.050 N/A LEU 49.A N ARG 45.A O no hydrogen 3.028 N/A TRP 50.A N THR 46.A O no hydrogen 3.024 N/A LEU 51.A N LEU 47.A O no hydrogen 2.791 N/A ASP 52.A N GLN 48.A O no hydrogen 2.827 N/A ASN 53.A N TRP 50.A O no hydrogen 3.323 N/A ILE 56.A N ASN 53.A OD1 no hydrogen 3.301 N/A GLN 57.A N LYS 97.A O no hydrogen 2.926 N/A LEU 58.A N ASN 92.A OD1 no hydrogen 2.591 N/A THR 63.A N THR 59.A O no hydrogen 3.050 N/A THR 63.A N PHE 60.A O no hydrogen 3.148 N/A THR 63.A OG1 THR 59.A O no hydrogen 3.027 N/A LEU 64.A N PHE 60.A O no hydrogen 2.927 N/A GLN 65.A N GLU 61.A O no hydrogen 3.116 N/A GLN 66.A N THR 63.A O no hydrogen 3.012 N/A ASN 72.A N GLU 68.A O no hydrogen 3.280 N/A SER 73.A N PRO 70.A O no hydrogen 2.991 N/A SER 73.A OG PRO 70.A O no hydrogen 3.262 N/A ASP 74.A N TYR 71.A O no hydrogen 3.097 N/A THR 75.A N SER 73.A O no hydrogen 2.738 N/A THR 75.A OG1 SER 73.A O no hydrogen 3.566 N/A LEU 77.A N ASP 74.A OD1 no hydrogen 2.935 N/A VAL 78.A N ASP 74.A O no hydrogen 3.091 N/A HIS 79.A N THR 75.A O no hydrogen 2.880 N/A ARG 80.A N VAL 76.A O no hydrogen 3.010 N/A ARG 80.A NH1 ASP 27.A OD2 no hydrogen 2.802 N/A ARG 80.A NH2 ASP 27.A OD1 no hydrogen 2.766 N/A ARG 80.A NH2 ASP 27.A OD2 no hydrogen 3.415 N/A VAL 81.A N LEU 77.A O no hydrogen 3.014 N/A HIS 82.A N VAL 78.A O no hydrogen 2.785 N/A HIS 82.A NE2 LEU 58.A O no hydrogen 2.702 N/A SER 83.A N HIS 79.A O no hydrogen 2.742 N/A SER 83.A OG HIS 79.A O no hydrogen 2.866 N/A TYR 84.A N ARG 80.A O no hydrogen 3.126 N/A LEU 85.A N VAL 81.A O no hydrogen 2.948 N/A GLU 86.A N HIS 82.A O no hydrogen 3.065 N/A ARG 87.A N SER 83.A O no hydrogen 2.854 N/A ARG 87.A NH1 ASP 639.A OD1 no hydrogen 2.569 N/A ARG 87.A NH2 GLY 643.A O no hydrogen 3.407 N/A HIS 88.A N TYR 84.A O no hydrogen 3.131 N/A GLY 89.A N GLU 86.A O no hydrogen 3.299 N/A LEU 90.A N LEU 85.A O no hydrogen 2.764 N/A ILE 91.A N LEU 85.A O no hydrogen 3.164 N/A ASN 92.A ND2 LEU 58.A O no hydrogen 3.001 N/A ASN 92.A ND2 GLU 86.A OE1 no hydrogen 3.327 N/A TYR 96.A OH ASN 92.A O no hydrogen 2.806 N/A LYS 97.A N LYS 55.A O no hydrogen 2.872 N/A THR 107.A N GLY 130.A O no hydrogen 3.320 N/A LYS 109.A N ASP 440.A OD1 no hydrogen 2.994 N/A LYS 109.A NZ THR 134.A OG1 no hydrogen 3.030 N/A VAL 110.A N ASP 132.A O no hydrogen 3.192 N/A ILE 111.A N ALA 441.A O no hydrogen 3.179 N/A ILE 112.A N THR 134.A O no hydrogen 2.793 N/A ILE 113.A N LEU 443.A O no hydrogen 2.831 N/A GLY 114.A N LEU 136.A O no hydrogen 2.961 N/A SER 115.A N GLU 137.A OE2 no hydrogen 2.850 N/A SER 115.A OG SER 115.A O no hydrogen 2.594 N/A LEU 120.A N GLY 116.A O no hydrogen 2.781 N/A ALA 121.A N VAL 117.A O no hydrogen 2.985 N/A ALA 122.A N SER 118.A O no hydrogen 3.232 N/A ALA 123.A N GLY 119.A O no hydrogen 2.935 N/A ARG 124.A N LEU 120.A O no hydrogen 2.986 N/A ARG 124.A NE GLY 94.A O no hydrogen 2.672 N/A ARG 124.A NH1 LEU 399.A O no hydrogen 3.072 N/A ARG 124.A NH1 GLU 401.A O no hydrogen 2.970 N/A ARG 124.A NH2 GLY 94.A O no hydrogen 3.567 N/A GLN 125.A N ALA 121.A O no hydrogen 3.236 N/A GLN 125.A NE2 ASN 92.A O no hydrogen 3.648 N/A LEU 126.A N ALA 122.A O no hydrogen 2.957 N/A GLN 127.A N ALA 123.A O no hydrogen 3.062 N/A GLN 127.A NE2 GLY 402.A O no hydrogen 3.330 N/A SER 128.A N ARG 124.A O no hydrogen 3.088 N/A SER 128.A OG ARG 124.A O no hydrogen 3.110 N/A SER 128.A OG GLN 125.A O no hydrogen 2.642 N/A PHE 129.A N GLN 125.A O no hydrogen 2.780 N/A PHE 129.A N LEU 126.A O no hydrogen 3.213 N/A GLY 130.A N GLN 127.A O no hydrogen 2.794 N/A THR 134.A N VAL 110.A O no hydrogen 3.273 N/A THR 134.A OG1 ASP 404.A OD2 no hydrogen 3.129 N/A LEU 135.A N ASP 404.A O no hydrogen 2.994 N/A LEU 136.A N ILE 112.A O no hydrogen 2.970 N/A GLU 137.A N LYS 406.A O no hydrogen 3.356 N/A ARG 139.A NH1 ASP 575.A OD2 no hydrogen 3.098 N/A ARG 139.A NH2 ASP 575.A OD2 no hydrogen 2.920 N/A ARG 141.A NH1 VAL 142.A O no hydrogen 2.838 N/A ARG 141.A NH1 GLY 144.A O no hydrogen 3.304 N/A ARG 141.A NH2 GLY 144.A O no hydrogen 2.825 N/A GLY 143.A N SER 115.A O no hydrogen 3.242 N/A ARG 145.A NH1 SER 581.A O no hydrogen 3.308 N/A VAL 146.A N GLY 143.A O no hydrogen 2.958 N/A THR 148.A OG1 ASP 157.A OD1 no hydrogen 2.560 N/A PHE 149.A N ALA 156.A O no hydrogen 2.558 N/A ARG 150.A NE SER 393.A OG no hydrogen 2.987 N/A ARG 150.A NH1 ASN 390.A O no hydrogen 3.446 N/A ARG 150.A NH2 ASN 390.A O no hydrogen 2.749 N/A ARG 150.A NH2 SER 393.A OG no hydrogen 2.971 N/A LYS 151.A N TYR 154.A O no hydrogen 3.151 N/A LYS 151.A NZ GLU 566.A OE1 no hydrogen 3.292 N/A TYR 154.A N LYS 151.A O no hydrogen 2.959 N/A TYR 154.A OH PHE 487.A O no hydrogen 2.718 N/A ALA 156.A N PHE 149.A O no hydrogen 3.033 N/A ASP 157.A N TYR 519.A OH no hydrogen 2.873 N/A LEU 158.A N ALA 147.A O no hydrogen 3.144 N/A ALA 160.A N ARG 145.A O no hydrogen 3.314 N/A VAL 163.A N LEU 386.A O no hydrogen 2.870 N/A GLY 167.A N THR 382.A O no hydrogen 2.905 N/A ASN 169.A N LEU 166.A O no hydrogen 3.021 N/A ASN 169.A ND2 THR 164.A O no hydrogen 3.466 N/A ASN 169.A ND2 GLY 165.A O no hydrogen 3.441 N/A MET 171.A N ASN 169.A OD1 no hydrogen 2.591 N/A ALA 172.A N ASN 169.A O no hydrogen 3.034 N/A VAL 173.A N PRO 170.A O no hydrogen 2.970 N/A VAL 174.A N PRO 170.A O no hydrogen 3.439 N/A SER 175.A N MET 171.A O no hydrogen 2.638 N/A SER 175.A OG MET 180.A O no hydrogen 3.167 N/A LYS 176.A N ALA 172.A O no hydrogen 3.281 N/A LYS 176.A NZ LEU 51.A O no hydrogen 2.929 N/A GLN 177.A N VAL 173.A O no hydrogen 3.061 N/A GLN 177.A N VAL 174.A O no hydrogen 2.861 N/A GLN 177.A NE2 PRO 54.A O no hydrogen 2.996 N/A GLN 177.A NE2 PHE 93.A O no hydrogen 3.033 N/A VAL 178.A N VAL 174.A O no hydrogen 2.878 N/A ASN 179.A ND2 LYS 176.A O no hydrogen 3.584 N/A MET 180.A N SER 175.A O no hydrogen 2.990 N/A GLU 181.A N ASN 390.A OD1 no hydrogen 2.760 N/A ALA 183.A N THR 387.A O no hydrogen 3.050 N/A LYS 186.A N ASN 497.A OD1 no hydrogen 3.046 N/A LYS 186.A NZ SER 495.A O no hydrogen 2.961 N/A CYS 189.A SG LEU 498.A O no hydrogen 3.633 N/A TYR 192.A N GLY 500.A O no hydrogen 3.036 N/A GLU 193.A N GLN 197.A O no hydrogen 3.178 N/A ASN 195.A ND2 GLN 197.A OE1 no hydrogen 3.467 N/A GLN 197.A N ASN 195.A OD1 no hydrogen 2.879 N/A VAL 199.A N LEU 191.A O no hydrogen 2.886 N/A LYS 203.A NZ ASP 346.A OD1 no hydrogen 2.642 N/A ASP 204.A N PRO 200.A O no hydrogen 3.032 N/A GLU 205.A N LYS 201.A O no hydrogen 3.149 N/A GLU 205.A N GLU 202.A O no hydrogen 3.132 N/A MET 206.A N GLU 202.A O no hydrogen 2.755 N/A VAL 207.A N LYS 203.A O no hydrogen 2.753 N/A GLN 209.A N GLU 205.A O no hydrogen 2.852 N/A GLU 210.A N MET 206.A O no hydrogen 3.388 N/A PHE 211.A N VAL 207.A O no hydrogen 2.864 N/A ASN 212.A N GLU 208.A O no hydrogen 3.220 N/A ARG 213.A N GLN 209.A O no hydrogen 3.050 N/A LEU 214.A N GLU 210.A O no hydrogen 2.752 N/A LEU 215.A N PHE 211.A O no hydrogen 3.172 N/A GLU 216.A N ASN 212.A O no hydrogen 2.889 N/A ALA 217.A N ARG 213.A O no hydrogen 2.825 N/A THR 218.A N LEU 214.A O no hydrogen 2.966 N/A THR 218.A OG1 LEU 215.A O no hydrogen 2.469 N/A SER 219.A N LEU 215.A O no hydrogen 2.880 N/A TYR 220.A N GLU 216.A O no hydrogen 2.817 N/A LEU 221.A N ALA 217.A O no hydrogen 2.975 N/A SER 222.A N THR 218.A O no hydrogen 2.973 N/A SER 222.A OG ASN 228.A OD1 no hydrogen 2.515 N/A HIS 223.A N SER 219.A O no hydrogen 2.834 N/A GLN 224.A NE2 HIS 223.A O no hydrogen 3.507 N/A LEU 225.A N TYR 220.A O no hydrogen 3.299 N/A PHE 227.A N LEU 221.A O no hydrogen 2.764 N/A ASN 228.A ND2 SER 222.A O no hydrogen 3.161 N/A ASN 228.A ND2 ASP 226.A OD1 no hydrogen 2.952 N/A LEU 230.A N LYS 233.A O no hydrogen 3.052 N/A LYS 233.A N LEU 230.A O no hydrogen 2.967 N/A VAL 235.A N ASN 228.A O no hydrogen 3.041 N/A SER 236.A OG SER 366.A O no hydrogen 3.128 N/A LEU 237.A N LEU 368.A O no hydrogen 3.061 N/A GLY 238.A N LEU 365.A O no hydrogen 3.035 N/A GLN 239.A N SER 236.A OG no hydrogen 3.268 N/A ALA 240.A N SER 236.A O no hydrogen 2.892 N/A LEU 241.A N LEU 237.A O no hydrogen 2.888 N/A GLU 242.A N GLY 238.A O no hydrogen 2.919 N/A VAL 243.A N GLN 239.A O no hydrogen 3.275 N/A VAL 244.A N ALA 240.A O no hydrogen 2.865 N/A ILE 245.A N LEU 241.A O no hydrogen 2.912 N/A GLN 246.A N GLU 242.A O no hydrogen 3.007 N/A LEU 247.A N VAL 244.A O no hydrogen 3.161 N/A GLN 248.A N VAL 244.A O no hydrogen 3.176 N/A GLU 249.A N ILE 245.A O no hydrogen 3.072 N/A LYS 250.A NZ ASP 254.A OD1 no hydrogen 2.676 N/A LYS 250.A NZ ASP 254.A OD2 no hydrogen 2.688 N/A HIS 251.A N LEU 247.A O no hydrogen 2.858 N/A VAL 252.A N GLN 248.A O no hydrogen 2.975 N/A LYS 253.A N GLU 249.A O no hydrogen 3.141 N/A ASP 254.A N LYS 250.A O no hydrogen 2.852 N/A GLU 255.A N HIS 251.A O no hydrogen 3.080 N/A GLN 256.A N VAL 252.A O no hydrogen 3.058 N/A GLN 256.A NE2 ASP 339.A OD1 no hydrogen 3.037 N/A ILE 257.A N LYS 253.A O no hydrogen 2.915 N/A GLU 258.A N ASP 254.A O no hydrogen 3.171 N/A HIS 259.A N GLU 255.A O no hydrogen 3.005 N/A TRP 260.A N GLN 256.A O no hydrogen 3.112 N/A LYS 261.A N ILE 257.A O no hydrogen 2.758 N/A LYS 262.A N GLU 258.A O no hydrogen 2.971 N/A ILE 263.A N HIS 259.A O no hydrogen 3.032 N/A VAL 264.A N TRP 260.A O no hydrogen 3.038 N/A LYS 265.A N LYS 261.A O no hydrogen 2.876 N/A THR 266.A N LYS 262.A O no hydrogen 2.914 N/A THR 266.A OG1 LYS 262.A O no hydrogen 3.251 N/A GLN 267.A N ILE 263.A O no hydrogen 2.882 N/A GLU 268.A N VAL 264.A O no hydrogen 2.948 N/A GLU 269.A N LYS 265.A O no hydrogen 2.945 N/A LEU 270.A N THR 266.A O no hydrogen 3.065 N/A LYS 271.A N GLN 267.A O no hydrogen 3.111 N/A LYS 271.A NZ LYS 271.A O no hydrogen 3.367 N/A GLU 272.A N GLU 268.A O no hydrogen 3.141 N/A LEU 273.A N GLU 269.A O no hydrogen 3.004 N/A LEU 274.A N LEU 270.A O no hydrogen 2.742 N/A ASN 275.A N LYS 271.A O no hydrogen 3.209 N/A LYS 276.A N GLU 272.A O no hydrogen 3.442 N/A MET 277.A N LEU 273.A O no hydrogen 3.165 N/A VAL 278.A N LEU 274.A O no hydrogen 3.032 N/A ASN 279.A N ASN 275.A O no hydrogen 3.085 N/A ASN 279.A N LYS 276.A O no hydrogen 2.809 N/A LEU 280.A N LYS 276.A O no hydrogen 2.639 N/A LYS 281.A N MET 277.A O no hydrogen 2.667 N/A LYS 283.A N ASN 279.A O no hydrogen 2.950 N/A LEU 287.A N ILE 284.A O no hydrogen 2.803 N/A HIS 288.A N ILE 284.A O no hydrogen 2.577 N/A ALA 297.A N ASP 294.A O no hydrogen 2.950 N/A PHE 299.A N THR 296.A O no hydrogen 2.732 N/A LEU 300.A N THR 296.A O no hydrogen 3.038 N/A VAL 301.A N ALA 297.A O no hydrogen 3.249 N/A SER 303.A N PHE 299.A O no hydrogen 3.082 N/A SER 303.A OG PHE 299.A O no hydrogen 2.904 N/A LYS 304.A N LEU 300.A O no hydrogen 2.876 N/A HIS 305.A N VAL 301.A O no hydrogen 3.018 N/A ASP 307.A N LYS 304.A O no hydrogen 2.808 N/A LEU 308.A N LYS 304.A O no hydrogen 2.801 N/A THR 309.A N HIS 305.A O no hydrogen 2.887 N/A THR 309.A OG1 HIS 305.A O no hydrogen 3.025 N/A LEU 311.A N ASP 307.A O no hydrogen 3.333 N/A CYS 312.A N THR 309.A O no hydrogen 2.870 N/A CYS 312.A SG LEU 308.A O no hydrogen 3.126 N/A TYR 315.A N LEU 311.A O no hydrogen 3.350 N/A LEU 318.A N GLU 314.A O no hydrogen 2.586 N/A ALA 319.A N TYR 315.A O no hydrogen 3.210 N/A GLU 320.A N GLU 317.A O no hydrogen 2.854 N/A THR 321.A OG1 LEU 318.A O no hydrogen 3.204 N/A GLY 323.A N GLU 320.A O no hydrogen 2.837 N/A LYS 324.A N GLU 320.A O no hydrogen 3.185 N/A LEU 325.A N GLN 322.A O no hydrogen 3.151 N/A GLU 327.A N GLY 323.A O no hydrogen 3.419 N/A LEU 329.A N LEU 325.A O no hydrogen 2.639 N/A GLN 330.A N GLU 326.A O no hydrogen 2.861 N/A GLU 331.A N GLU 327.A O no hydrogen 2.641 N/A LEU 332.A N LYS 328.A O no hydrogen 2.941 N/A GLU 333.A N LEU 329.A O no hydrogen 3.118 N/A ASN 335.A N LEU 332.A O no hydrogen 2.891 N/A TYR 341.A OH GLU 210.A OE1 no hydrogen 2.676 N/A SER 343.A N ASP 346.A OD2 no hydrogen 2.570 N/A SER 343.A OG ASP 346.A OD2 no hydrogen 2.544 N/A ASP 346.A N SER 343.A OG no hydrogen 2.938 N/A ARG 347.A N SER 343.A O no hydrogen 2.921 N/A GLN 348.A NE2 SER 504.A O no hydrogen 3.137 N/A ILE 349.A N ARG 345.A O no hydrogen 3.118 N/A LEU 350.A N ASP 346.A O no hydrogen 3.033 N/A ASP 351.A N ARG 347.A O no hydrogen 2.861 N/A TRP 352.A N ILE 349.A O no hydrogen 3.004 N/A TRP 352.A NE1 PHE 513.A O no hydrogen 2.796 N/A HIS 353.A N LEU 350.A O no hydrogen 3.000 N/A PHE 354.A N LEU 350.A O no hydrogen 3.152 N/A ALA 355.A N ASP 351.A O no hydrogen 2.785 N/A ASN 356.A N TRP 352.A O no hydrogen 2.805 N/A ASN 356.A ND2 ASN 356.A O no hydrogen 2.779 N/A LEU 357.A N HIS 353.A O no hydrogen 3.138 N/A LEU 357.A N PHE 354.A O no hydrogen 2.815 N/A GLU 358.A N PHE 354.A O no hydrogen 2.708 N/A ALA 360.A N ASN 356.A O no hydrogen 3.276 N/A ASN 361.A N LEU 357.A O no hydrogen 2.930 N/A ASN 361.A ND2 LEU 357.A O no hydrogen 3.304 N/A ALA 362.A N PHE 359.A O no hydrogen 3.076 N/A THR 363.A N GLU 358.A O no hydrogen 2.945 N/A THR 363.A OG1 THR 367.A OG1 no hydrogen 2.621 N/A LEU 365.A N GLU 358.A OE2 no hydrogen 3.382 N/A THR 367.A N PRO 364.A O no hydrogen 2.884 N/A THR 367.A OG1 THR 363.A OG1 no hydrogen 2.621 N/A THR 367.A OG1 PRO 364.A O no hydrogen 2.558 N/A LEU 368.A N LEU 365.A O no hydrogen 3.057 N/A SER 369.A N VAL 585.A O no hydrogen 3.020 N/A LEU 370.A N VAL 235.A O no hydrogen 3.149 N/A HIS 372.A N SER 369.A OG no hydrogen 3.172 N/A TRP 373.A N SER 369.A O no hydrogen 2.636 N/A GLN 375.A N HIS 372.A O no hydrogen 2.819 N/A GLN 375.A NE2 ARG 617.A O no hydrogen 3.572 N/A ASP 377.A N ASP 374.A O no hydrogen 3.112 N/A PHE 379.A N ASP 376.A O no hydrogen 2.977 N/A GLU 380.A N ASP 377.A O no hydrogen 3.348 N/A LEU 386.A N VAL 163.A O no hydrogen 2.904 N/A THR 387.A N ALA 183.A O no hydrogen 2.789 N/A VAL 388.A N MET 161.A O no hydrogen 3.351 N/A ARG 389.A NH1 LEU 518.A O no hydrogen 2.560 N/A GLY 391.A N VAL 388.A O no hydrogen 3.003 N/A TYR 392.A N ASP 157.A OD1 no hydrogen 3.056 N/A TYR 392.A N ASP 157.A OD2 no hydrogen 3.108 N/A SER 393.A N THR 148.A OG1 no hydrogen 2.989 N/A CYS 394.A N GLY 391.A O no hydrogen 3.308 N/A CYS 394.A SG GLY 391.A O no hydrogen 3.120 N/A VAL 395.A N TYR 392.A O no hydrogen 3.406 N/A VAL 397.A N SER 393.A O no hydrogen 3.249 N/A LEU 399.A N VAL 395.A O no hydrogen 3.012 N/A ALA 400.A N PRO 396.A O no hydrogen 3.009 N/A ALA 400.A N VAL 397.A O no hydrogen 3.056 N/A GLU 401.A N ALA 398.A O no hydrogen 3.432 N/A LEU 403.A N ALA 400.A O no hydrogen 3.292 N/A LYS 406.A N LEU 135.A O no hydrogen 2.832 N/A ASN 408.A N ARG 139.A O no hydrogen 3.118 N/A THR 409.A N GLU 137.A O no hydrogen 2.590 N/A THR 409.A OG1 LYS 406.A O no hydrogen 2.771 N/A THR 409.A OG1 LEU 407.A O no hydrogen 3.178 N/A ALA 410.A N VAL 426.A O no hydrogen 2.812 N/A ARG 412.A N ILE 424.A O no hydrogen 2.952 N/A ARG 412.A NH1 VAL 411.A O no hydrogen 3.493 N/A GLN 413.A N ILE 424.A O no hydrogen 3.150 N/A VAL 414.A N GLN 459.A O no hydrogen 2.664 N/A ARG 415.A N GLU 422.A O no hydrogen 2.619 N/A ARG 415.A NE GLU 422.A OE2 no hydrogen 3.345 N/A TYR 416.A N VAL 461.A O no hydrogen 2.978 N/A TYR 416.A OH PRO 462.A O no hydrogen 2.723 N/A THR 417.A N GLY 420.A O no hydrogen 3.068 N/A THR 417.A OG1 GLY 420.A O no hydrogen 3.086 N/A CYS 421.A N CYS 439.A O no hydrogen 2.625 N/A CYS 421.A SG ASP 440.A O no hydrogen 3.458 N/A GLU 422.A N ARG 415.A O no hydrogen 2.665 N/A VAL 423.A N TYR 437.A O no hydrogen 2.790 N/A ILE 424.A N GLN 413.A O no hydrogen 2.854 N/A ALA 425.A N PHE 435.A O no hydrogen 2.992 N/A VAL 426.A N ALA 410.A O no hydrogen 2.825 N/A ASN 427.A N GLN 433.A O no hydrogen 3.313 N/A THR 428.A N ASN 408.A O no hydrogen 3.145 N/A ARG 429.A NH1 ASP 140.A OD1 no hydrogen 3.329 N/A ARG 429.A NH2 THR 428.A OG1 no hydrogen 3.339 N/A SER 430.A N ASN 427.A O no hydrogen 3.235 N/A SER 430.A N ASN 427.A OD1 no hydrogen 3.029 N/A SER 430.A OG SER 432.A OG no hydrogen 2.791 N/A SER 432.A OG SER 430.A OG no hydrogen 2.791 N/A GLN 433.A N SER 430.A O no hydrogen 3.171 N/A PHE 435.A N ALA 425.A O no hydrogen 2.643 N/A TYR 437.A N VAL 423.A O no hydrogen 3.189 N/A CYS 439.A N CYS 421.A O no hydrogen 2.918 N/A CYS 439.A SG ALA 441.A O no hydrogen 3.300 N/A ASP 440.A N LYS 109.A O no hydrogen 2.704 N/A VAL 442.A N ARG 607.A O no hydrogen 3.081 N/A LEU 443.A N ILE 111.A O no hydrogen 2.888 N/A CYS 444.A N PHE 609.A O no hydrogen 2.791 N/A THR 445.A N ILE 113.A O no hydrogen 3.137 N/A THR 445.A OG1 ILE 113.A O no hydrogen 2.474 N/A THR 445.A OG1 GLY 114.A O no hydrogen 3.401 N/A VAL 450.A N PRO 447.A O no hydrogen 2.838 N/A LEU 451.A N PRO 447.A O no hydrogen 3.182 N/A LYS 452.A N LEU 448.A O no hydrogen 2.956 N/A LYS 452.A NZ VAL 472.A O no hydrogen 2.719 N/A LYS 452.A NZ GLN 473.A O no hydrogen 3.370 N/A LYS 452.A NZ MET 475.A O no hydrogen 3.034 N/A GLN 453.A N GLY 449.A O no hydrogen 3.198 N/A GLN 453.A N VAL 450.A O no hydrogen 3.105 N/A GLN 459.A N ARG 412.A O no hydrogen 2.886 N/A VAL 461.A N VAL 414.A O no hydrogen 2.954 N/A LYS 468.A N PRO 465.A O no hydrogen 3.167 N/A LYS 468.A NZ LEU 596.A O no hydrogen 2.645 N/A LYS 468.A NZ GLN 599.A O no hydrogen 2.931 N/A THR 469.A N PRO 465.A O no hydrogen 3.112 N/A THR 469.A OG1 GLU 466.A O no hydrogen 3.158 N/A SER 470.A N GLU 466.A O no hydrogen 3.078 N/A SER 470.A OG GLU 466.A O no hydrogen 2.829 N/A VAL 472.A N LYS 468.A O no hydrogen 2.893 N/A GLN 473.A N THR 469.A O no hydrogen 2.901 N/A ARG 474.A N SER 470.A O no hydrogen 2.849 N/A MET 475.A N ALA 471.A O no hydrogen 3.000 N/A GLY 476.A N TYR 584.A O no hydrogen 3.257 N/A GLY 478.A N TYR 582.A O no hydrogen 2.780 N/A ASN 479.A N ALA 362.A O no hydrogen 2.738 N/A ASN 481.A ND2 ALA 533.A O no hydrogen 3.035 N/A ASN 481.A ND2 GLU 537.A OE2 no hydrogen 2.696 N/A LYS 482.A N SER 570.A OG no hydrogen 2.808 N/A LYS 482.A NZ ASP 157.A O no hydrogen 3.469 N/A LYS 482.A NZ GLY 159.A O no hydrogen 2.491 N/A VAL 483.A N ALA 526.A O no hydrogen 2.895 N/A VAL 484.A N VAL 568.A O no hydrogen 2.619 N/A LEU 485.A N LEU 524.A O no hydrogen 2.920 N/A CYS 486.A N GLU 566.A O no hydrogen 2.769 N/A PHE 487.A N PRO 522.A O no hydrogen 2.810 N/A SER 495.A N ASP 493.A OD1 no hydrogen 2.641 N/A SER 495.A OG ASP 493.A OD1 no hydrogen 2.424 N/A VAL 496.A N ASP 493.A OD1 no hydrogen 3.140 N/A PHE 499.A N PHE 515.A O no hydrogen 3.162 N/A GLY 500.A N PRO 190.A O no hydrogen 2.904 N/A HIS 501.A N PHE 513.A O no hydrogen 2.648 N/A VAL 502.A N TYR 192.A O no hydrogen 2.959 N/A THR 506.A OG1 ASP 351.A OD1 no hydrogen 3.446 N/A THR 506.A OG1 ASP 351.A OD2 no hydrogen 3.295 N/A ARG 509.A N THR 506.A O no hydrogen 3.200 N/A ARG 509.A NE GLU 358.A OE1 no hydrogen 3.193 N/A ARG 509.A NH1 ASP 351.A OD1 no hydrogen 3.153 N/A ARG 509.A NH2 GLU 358.A OE2 no hydrogen 3.037 N/A GLU 511.A N SER 508.A O no hydrogen 3.169 N/A PHE 515.A N PHE 499.A O no hydrogen 2.907 N/A TRP 516.A N LEU 525.A O no hydrogen 2.820 N/A ASN 517.A N ASN 497.A O no hydrogen 2.567 N/A TYR 519.A OH ASP 157.A OD2 no hydrogen 3.289 N/A LEU 524.A N LEU 485.A O no hydrogen 3.082 N/A LEU 525.A N TRP 516.A O no hydrogen 3.086 N/A ALA 526.A N VAL 483.A O no hydrogen 3.075 N/A LEU 527.A N LEU 514.A O no hydrogen 3.040 N/A VAL 528.A N ASN 481.A O no hydrogen 3.045 N/A ALA 529.A N GLY 510.A O no hydrogen 2.849 N/A ALA 533.A N ALA 529.A O no hydrogen 3.439 N/A ALA 533.A N GLY 530.A O no hydrogen 2.967 N/A MET 536.A N ALA 532.A O no hydrogen 2.730 N/A GLU 537.A N GLY 534.A O no hydrogen 3.077 N/A ASN 538.A N ILE 535.A O no hydrogen 2.829 N/A ILE 539.A N MET 536.A O no hydrogen 3.331 N/A ILE 544.A N SER 540.A O no hydrogen 3.017 N/A VAL 545.A N ASP 541.A O no hydrogen 2.668 N/A GLY 546.A N ASP 542.A O no hydrogen 2.798 N/A ARG 547.A N VAL 543.A O no hydrogen 2.797 N/A ARG 547.A NE GLU 511.A OE2 no hydrogen 2.974 N/A ARG 547.A NH2 GLU 511.A OE2 no hydrogen 3.388 N/A CYS 548.A N ILE 544.A O no hydrogen 3.072 N/A CYS 548.A SG ILE 544.A O no hydrogen 3.785 N/A LEU 549.A N VAL 545.A O no hydrogen 3.051 N/A ALA 550.A N GLY 546.A O no hydrogen 3.052 N/A ILE 551.A N ARG 547.A O no hydrogen 3.058 N/A LEU 552.A N CYS 548.A O no hydrogen 2.795 N/A LYS 553.A N LEU 549.A O no hydrogen 2.571 N/A GLY 554.A N ILE 551.A O no hydrogen 3.047 N/A ILE 555.A N ILE 551.A O no hydrogen 3.101 N/A ILE 555.A N LEU 552.A O no hydrogen 2.877 N/A PHE 556.A N LEU 552.A O no hydrogen 2.706 N/A SER 559.A OG SER 558.A O no hydrogen 2.363 N/A LYS 565.A N CYS 486.A O no hydrogen 2.976 N/A VAL 568.A N VAL 484.A O no hydrogen 2.920 N/A SER 570.A N LYS 482.A O no hydrogen 3.149 N/A SER 570.A OG ASN 481.A OD1 no hydrogen 3.274 N/A SER 570.A OG LYS 482.A O no hydrogen 3.520 N/A ARG 571.A NE GLU 537.A O no hydrogen 3.091 N/A ARG 571.A NH2 ILE 539.A O no hydrogen 3.303 N/A ARG 571.A NH2 ASP 541.A OD1 no hydrogen 2.754 N/A TRP 572.A N ASN 481.A OD1 no hydrogen 2.864 N/A TRP 572.A NE1 LEU 158.A O no hydrogen 3.065 N/A ARG 573.A N GLU 537.A OE2 no hydrogen 3.409 N/A ARG 573.A NH2 PHE 477.A O no hydrogen 2.777 N/A ALA 574.A N GLU 537.A OE1 no hydrogen 2.960 N/A ASP 575.A N ARG 571.A O no hydrogen 2.809 N/A TRP 577.A N ASP 575.A OD1 no hydrogen 2.678 N/A ALA 578.A N ASP 575.A O no hydrogen 3.063 N/A ARG 579.A N ASP 575.A O no hydrogen 2.764 N/A ARG 579.A NE GLN 453.A OE1 no hydrogen 2.658 N/A ARG 579.A NH2 GLN 453.A OE1 no hydrogen 3.481 N/A GLY 580.A N TRP 572.A O no hydrogen 2.784 N/A SER 581.A N GLY 478.A O no hydrogen 2.835 N/A TYR 582.A OH ALA 360.A O no hydrogen 3.161 N/A SER 583.A N GLU 613.A OE1 no hydrogen 2.974 N/A SER 583.A OG GLU 613.A O no hydrogen 3.501 N/A SER 583.A OG GLU 613.A OE1 no hydrogen 2.758 N/A TYR 584.A N GLY 476.A O no hydrogen 2.775 N/A ALA 587.A N THR 367.A O no hydrogen 2.923 N/A ASN 592.A N SER 590.A OG no hydrogen 3.399 N/A ASP 593.A N SER 590.A O no hydrogen 3.001 N/A TYR 594.A N GLY 591.A O no hydrogen 2.922 N/A ASP 595.A N ASN 592.A O no hydrogen 3.202 N/A LEU 596.A N ASN 592.A O no hydrogen 3.321 N/A MET 597.A N ASP 593.A O no hydrogen 3.202 N/A GLN 599.A N ASP 595.A O no hydrogen 2.943 N/A ILE 601.A N LEU 608.A O no hydrogen 2.778 N/A ARG 607.A N ILE 601.A O no hydrogen 3.156 N/A ARG 607.A NE ASP 440.A O no hydrogen 2.984 N/A LEU 608.A N ILE 601.A O no hydrogen 3.226 N/A PHE 609.A N VAL 442.A O no hydrogen 2.787 N/A ALA 611.A N CYS 444.A O no hydrogen 3.355 N/A GLY 612.A N SER 629.A OG no hydrogen 3.124 N/A THR 615.A N GLY 612.A O no hydrogen 2.768 N/A THR 615.A OG1 GLY 612.A O no hydrogen 2.745 N/A ARG 617.A NH1 ASP 595.A OD2 no hydrogen 2.897 N/A ALA 621.A N GLU 613.A O no hydrogen 3.048 N/A THR 622.A OG1 TYR 619.A O no hydrogen 2.955 N/A GLY 625.A N THR 622.A OG1 no hydrogen 2.824 N/A ALA 626.A N THR 622.A O no hydrogen 2.787 N/A LEU 627.A N VAL 623.A O no hydrogen 2.914 N/A LEU 628.A N HIS 624.A O no hydrogen 2.775 N/A SER 629.A N GLY 625.A O no hydrogen 3.017 N/A SER 629.A OG GLY 625.A O no hydrogen 3.431 N/A SER 629.A OG ALA 626.A O no hydrogen 2.539 N/A GLY 630.A N ALA 626.A O no hydrogen 3.020 N/A GLY 630.A N LEU 627.A O no hydrogen 2.885 N/A LEU 631.A N LEU 627.A O no hydrogen 3.075 N/A ARG 632.A N LEU 628.A O no hydrogen 2.797 N/A ARG 632.A NH1 THR 615.A O no hydrogen 2.747 N/A ARG 632.A NH2 PHE 610.A O no hydrogen 3.326 N/A ARG 632.A NH2 THR 615.A OG1 no hydrogen 2.697 N/A GLU 633.A N SER 629.A O no hydrogen 3.207 N/A ALA 634.A N GLY 630.A O no hydrogen 2.984 N/A GLY 635.A N LEU 631.A O no hydrogen 3.221 N/A ARG 636.A N ARG 632.A O no hydrogen 3.033 N/A ARG 636.A NH1 ALA 598.A O no hydrogen 2.769 N/A ILE 637.A N GLU 633.A O no hydrogen 2.833 N/A ALA 638.A N ALA 634.A O no hydrogen 2.979 N/A ASP 639.A N GLY 635.A O no hydrogen 2.919 N/A GLN 640.A N ARG 636.A O no hydrogen 3.269 N/A PHE 641.A N ILE 637.A O no hydrogen 2.939 N/A LEU 642.A N ALA 638.A O no hydrogen 2.647 N/A GLY 643.A N ALA 638.A O no hydrogen 2.998 N/A