Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ols_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ALA 43.A O no hydrogen 2.855 N/A PHE 6.A N GLY 41.A O no hydrogen 3.229 N/A ASN 8.A N TRP 5.A O no hydrogen 2.791 N/A LEU 9.A N PHE 6.A O no hydrogen 2.760 N/A ARG 10.A N ASP 13.A OD2 no hydrogen 3.013 N/A ARG 10.A NE GLU 26.A OE1 no hydrogen 3.053 N/A ARG 10.A NH2 GLU 26.A OE1 no hydrogen 3.371 N/A ARG 10.A NH2 GLU 26.A OE2 no hydrogen 3.057 N/A MET 11.A N GLU 26.A OE1 no hydrogen 2.855 N/A ASP 13.A N ARG 10.A O no hydrogen 3.085 N/A ARG 16.A N ASP 13.A O no hydrogen 2.980 N/A VAL 17.A N ASP 13.A O no hydrogen 3.022 N/A GLY 18.A N VAL 14.A O no hydrogen 2.980 N/A ASN 21.A N SER 124.A OG no hydrogen 3.092 N/A ASN 21.A ND2 VAL 17.A O no hydrogen 3.425 N/A ASN 21.A ND2 SER 175.A OG no hydrogen 2.730 N/A ALA 22.A N GLY 18.A O no hydrogen 3.135 N/A SER 23.A N GLY 19.A O no hydrogen 3.004 N/A SER 23.A OG TYR 299.A OH no hydrogen 2.886 N/A SER 23.A OG ALA 321.A O no hydrogen 2.698 N/A LEU 24.A N LYS 20.A O no hydrogen 3.144 N/A GLY 25.A N ASN 21.A O no hydrogen 3.032 N/A GLU 26.A N ALA 22.A O no hydrogen 2.892 N/A MET 27.A N SER 23.A O no hydrogen 2.977 N/A ILE 28.A N LEU 24.A O no hydrogen 2.971 N/A SER 29.A N GLY 25.A O no hydrogen 2.826 N/A SER 29.A OG GLY 25.A O no hydrogen 2.827 N/A SER 29.A OG GLU 26.A O no hydrogen 3.525 N/A SER 29.A OG GLN 30.A OE1 no hydrogen 3.019 N/A GLN 30.A N GLU 26.A O no hydrogen 3.152 N/A LEU 31.A N MET 27.A O no hydrogen 2.879 N/A GLY 35.A N THR 32.A O no hydrogen 2.961 N/A VAL 36.A N LEU 31.A O no hydrogen 3.328 N/A ARG 37.A NE LEU 316.A O no hydrogen 3.408 N/A PHE 42.A N VAL 178.A O no hydrogen 3.054 N/A ALA 43.A N ILE 4.A O no hydrogen 2.752 N/A THR 44.A N ALA 176.A O no hydrogen 2.989 N/A THR 45.A N TYR 2.A O no hydrogen 3.043 N/A THR 45.A OG1 ASN 1.A O no hydrogen 2.693 N/A THR 45.A OG1 TYR 2.A O no hydrogen 3.531 N/A ALA 46.A N ARG 16.A O no hydrogen 2.791 N/A ALA 48.A N THR 45.A OG1 no hydrogen 3.251 N/A TYR 49.A N THR 45.A O no hydrogen 3.170 N/A TYR 49.A OH PHE 152.A O no hydrogen 3.022 N/A ARG 50.A N ALA 46.A O no hydrogen 3.046 N/A ARG 50.A NH1 VAL 172.A O no hydrogen 3.139 N/A ALA 51.A N GLU 47.A O no hydrogen 3.001 N/A PHE 52.A N ALA 48.A O no hydrogen 2.971 N/A LEU 53.A N TYR 49.A O no hydrogen 2.955 N/A ALA 54.A N ARG 50.A O no hydrogen 2.998 N/A ALA 54.A N ALA 51.A O no hydrogen 3.269 N/A HIS 55.A N PHE 52.A O no hydrogen 3.477 N/A LEU 58.A N HIS 55.A O no hydrogen 2.775 N/A SER 59.A N LEU 53.A O no hydrogen 2.796 N/A GLU 60.A N GLY 57.A O no hydrogen 3.112 N/A ARG 61.A N GLY 57.A O no hydrogen 3.412 N/A ILE 62.A N LEU 58.A O no hydrogen 2.923 N/A SER 63.A N SER 59.A O no hydrogen 3.067 N/A ALA 64.A N GLU 60.A O no hydrogen 2.867 N/A ALA 65.A N ARG 61.A O no hydrogen 3.128 N/A LEU 66.A N ILE 62.A O no hydrogen 2.940 N/A ALA 67.A N SER 63.A O no hydrogen 3.142 N/A LYS 68.A N ALA 64.A O no hydrogen 3.497 N/A LEU 69.A N ALA 67.A O no hydrogen 3.037 N/A GLU 72.A N ASP 70.A OD1 no hydrogen 2.942 N/A ASP 73.A N ASP 70.A O no hydrogen 2.937 N/A GLU 76.A N ASP 73.A OD2 no hydrogen 3.121 N/A LEU 77.A N ASP 73.A O no hydrogen 3.199 N/A ALA 78.A N VAL 74.A O no hydrogen 3.247 N/A ARG 79.A N ALA 75.A O no hydrogen 2.861 N/A ARG 79.A NE GLU 76.A OE1 no hydrogen 2.793 N/A ARG 79.A NH2 GLU 76.A OE1 no hydrogen 2.489 N/A VAL 80.A N GLU 76.A O no hydrogen 2.783 N/A GLY 81.A N LEU 77.A O no hydrogen 2.936 N/A LYS 82.A N ALA 78.A O no hydrogen 3.194 N/A GLU 83.A N ARG 79.A O no hydrogen 3.210 N/A ILE 84.A N VAL 80.A O no hydrogen 2.933 N/A ARG 85.A N GLY 81.A O no hydrogen 2.943 N/A ARG 85.A NE TYR 156.A O no hydrogen 3.332 N/A GLN 86.A N LYS 82.A O no hydrogen 3.062 N/A GLN 86.A N GLU 83.A O no hydrogen 3.199 N/A TRP 87.A N GLU 83.A O no hydrogen 3.186 N/A ILE 88.A N ILE 84.A O no hydrogen 3.130 N/A LEU 89.A N ARG 85.A O no hydrogen 3.095 N/A ASP 90.A N GLN 86.A O no hydrogen 2.856 N/A THR 91.A N ILE 88.A O no hydrogen 3.127 N/A THR 91.A OG1 TRP 87.A O no hydrogen 2.534 N/A ASP 98.A N PRO 94.A O no hydrogen 3.015 N/A ALA 99.A N GLU 95.A O no hydrogen 3.086 N/A GLU 100.A N GLN 96.A O no hydrogen 3.084 N/A ILE 101.A N LEU 97.A O no hydrogen 2.979 N/A GLU 102.A N ASP 98.A O no hydrogen 2.925 N/A ALA 103.A N ALA 99.A O no hydrogen 2.977 N/A ALA 104.A N GLU 100.A O no hydrogen 3.123 N/A TRP 105.A N ILE 101.A O no hydrogen 2.803 N/A ASN 106.A N GLU 102.A O no hydrogen 2.892 N/A LYS 107.A N ALA 103.A O no hydrogen 3.226 N/A LYS 107.A N ALA 104.A O no hydrogen 3.234 N/A MET 108.A N ALA 104.A O no hydrogen 3.154 N/A VAL 109.A N TRP 105.A O no hydrogen 3.156 N/A ALA 110.A N ASN 106.A O no hydrogen 3.209 N/A ASP 111.A N LYS 107.A O no hydrogen 2.782 N/A ALA 112.A N MET 108.A O no hydrogen 2.962 N/A SER 118.A OG ASN 137.A OD1 no hydrogen 2.993 N/A VAL 119.A N ILE 138.A O no hydrogen 3.135 N/A ALA 120.A N GLN 179.A O no hydrogen 2.610 N/A VAL 121.A N PHE 135.A O no hydrogen 2.890 N/A ARG 122.A N GLY 177.A O no hydrogen 2.855 N/A ARG 122.A NH2 GLN 179.A OE1 no hydrogen 2.590 N/A SER 124.A N SER 175.A O no hydrogen 2.799 N/A SER 124.A OG VAL 17.A O no hydrogen 2.716 N/A GLU 133.A N GLN 132.A OE1 no hydrogen 3.426 N/A PHE 135.A N VAL 121.A O no hydrogen 3.010 N/A ASN 137.A ND2 SER 264.A O no hydrogen 2.908 N/A ILE 138.A N VAL 119.A O no hydrogen 3.065 N/A VAL 144.A N GLY 140.A O no hydrogen 2.874 N/A LYS 145.A N LEU 141.A O no hydrogen 3.011 N/A GLU 146.A N ASP 142.A O no hydrogen 3.049 N/A ALA 147.A N ASN 143.A O no hydrogen 2.820 N/A MET 148.A N VAL 144.A O no hydrogen 2.822 N/A HIS 149.A N LYS 145.A O no hydrogen 3.070 N/A HIS 149.A ND1 LYS 145.A O no hydrogen 3.201 N/A HIS 149.A NE2 THR 91.A O no hydrogen 2.645 N/A HIS 150.A N GLU 146.A O no hydrogen 3.250 N/A VAL 151.A N ALA 147.A O no hydrogen 3.128 N/A PHE 152.A N MET 148.A O no hydrogen 2.925 N/A ALA 153.A N HIS 149.A O no hydrogen 3.058 N/A SER 154.A N HIS 150.A O no hydrogen 2.964 N/A SER 154.A N VAL 151.A O no hydrogen 3.089 N/A SER 154.A OG VAL 151.A O no hydrogen 2.712 N/A LEU 155.A N PHE 152.A O no hydrogen 3.452 N/A TYR 156.A N ALA 153.A O no hydrogen 3.000 N/A TYR 156.A OH VAL 172.A O no hydrogen 3.421 N/A ASN 157.A N SER 154.A O no hydrogen 3.034 N/A ARG 159.A NE THR 370.A OG1 no hydrogen 3.011 N/A ARG 159.A NH2 THR 370.A OG1 no hydrogen 2.525 N/A ILE 161.A N ASN 157.A O no hydrogen 3.048 N/A SER 162.A N ASP 158.A O no hydrogen 3.031 N/A TYR 163.A N ARG 159.A O no hydrogen 2.632 N/A ARG 164.A N ALA 160.A O no hydrogen 3.079 N/A ARG 164.A NH2 LEU 155.A O no hydrogen 2.430 N/A VAL 165.A N ILE 161.A O no hydrogen 3.057 N/A HIS 166.A N SER 162.A O no hydrogen 2.678 N/A HIS 166.A NE2 GLU 72.A OE2 no hydrogen 2.835 N/A LYS 167.A N TYR 163.A O no hydrogen 3.046 N/A GLY 168.A N VAL 165.A O no hydrogen 3.144 N/A SER 175.A N SER 124.A O no hydrogen 3.348 N/A SER 175.A OG VAL 17.A O no hydrogen 3.211 N/A SER 175.A OG THR 44.A O no hydrogen 2.544 N/A ALA 176.A N THR 44.A OG1 no hydrogen 3.002 N/A GLY 177.A N ARG 122.A O no hydrogen 2.878 N/A VAL 178.A N PHE 42.A O no hydrogen 2.771 N/A GLN 179.A N ALA 120.A O no hydrogen 2.871 N/A GLN 179.A NE2 PRO 39.A O no hydrogen 3.296 N/A GLN 179.A NE2 LEU 319.A O no hydrogen 3.233 N/A ARG 180.A N GLY 40.A O no hydrogen 2.975 N/A MET 181.A N SER 118.A O no hydrogen 3.088 N/A ARG 183.A N ASP 310.A OD2 no hydrogen 3.008 N/A ARG 183.A NE ASP 185.A OD1 no hydrogen 3.014 N/A ARG 183.A NH2 ASP 185.A OD2 no hydrogen 3.014 N/A SER 186.A OG ARG 183.A O no hydrogen 3.540 N/A GLY 187.A N SER 184.A O no hydrogen 3.031 N/A ALA 188.A N ARG 309.A O no hydrogen 3.440 N/A SER 189.A N SER 210.A O no hydrogen 2.720 N/A SER 189.A OG GLY 212.A O no hydrogen 2.562 N/A GLY 190.A N TRP 307.A O no hydrogen 3.135 N/A MET 192.A N ILE 305.A O no hydrogen 2.748 N/A PHE 193.A N PHE 206.A O no hydrogen 2.903 N/A THR 194.A N MET 303.A O no hydrogen 3.123 N/A THR 194.A OG1 GLU 296.A OE2 no hydrogen 2.539 N/A ASP 196.A N TYR 201.A O no hydrogen 2.800 N/A SER 199.A N ASP 196.A OD2 no hydrogen 3.008 N/A SER 199.A OG ASP 196.A OD2 no hydrogen 2.479 N/A GLY 200.A N ASP 196.A O no hydrogen 2.577 N/A TYR 201.A N SER 199.A OG no hydrogen 2.996 N/A TYR 201.A OH ALA 502.A O no hydrogen 2.752 N/A GLN 203.A NE2 ASP 202.A OD1 no hydrogen 3.100 N/A VAL 205.A N VAL 229.A O no hydrogen 2.843 N/A PHE 206.A N PHE 193.A O no hydrogen 2.814 N/A VAL 207.A N PHE 227.A O no hydrogen 2.814 N/A THR 208.A N VAL 191.A O no hydrogen 3.053 N/A THR 208.A OG1 VAL 191.A O no hydrogen 3.064 N/A SER 209.A N ASP 225.A O no hydrogen 2.936 N/A SER 209.A OG SER 279.A OG no hydrogen 2.738 N/A SER 210.A N SER 189.A O no hydrogen 2.889 N/A TYR 211.A OH ASP 274.A O no hydrogen 2.566 N/A GLY 212.A N GLY 187.A O no hydrogen 3.370 N/A LEU 213.A N MET 253.A O no hydrogen 3.031 N/A VAL 218.A N GLY 214.A O no hydrogen 3.041 N/A GLN 219.A N GLU 215.A O no hydrogen 2.930 N/A GLN 219.A NE2 GLY 130.A O no hydrogen 3.127 N/A GLY 220.A N VAL 217.A O no hydrogen 3.188 N/A ALA 221.A N ASN 216.A O no hydrogen 2.826 N/A ASP 225.A N SER 209.A O no hydrogen 2.812 N/A GLU 226.A N THR 245.A O no hydrogen 2.873 N/A PHE 227.A N VAL 207.A O no hydrogen 2.830 N/A TYR 228.A N ARG 243.A O no hydrogen 3.161 N/A TYR 228.A OH ASP 196.A OD1 no hydrogen 2.924 N/A VAL 229.A N VAL 205.A O no hydrogen 2.891 N/A PHE 230.A N ALA 240.A O no hydrogen 2.761 N/A LYS 231.A N GLN 203.A O no hydrogen 2.896 N/A LYS 231.A NZ THR 194.A O no hydrogen 2.657 N/A LYS 231.A NZ ASP 202.A O no hydrogen 2.911 N/A LYS 231.A NZ GLU 296.A OE1 no hydrogen 2.723 N/A LYS 231.A NZ GLU 296.A OE2 no hydrogen 3.166 N/A THR 233.A OG1 PHE 230.A O no hydrogen 3.528 N/A LEU 234.A N PHE 230.A O no hydrogen 3.046 N/A LYS 235.A N LYS 231.A O no hydrogen 2.945 N/A ALA 236.A N PRO 232.A O no hydrogen 3.185 N/A GLY 237.A N LEU 234.A O no hydrogen 3.100 N/A LYS 238.A N THR 233.A O no hydrogen 2.990 N/A LEU 242.A N TYR 228.A O no hydrogen 2.872 N/A LYS 244.A N GLU 495.A OE1 no hydrogen 3.129 N/A LYS 244.A NZ ASP 282.A OD1 no hydrogen 3.080 N/A THR 245.A N GLU 226.A O no hydrogen 2.779 N/A GLY 247.A N ASP 225.A OD1 no hydrogen 2.901 N/A SER 248.A N ASN 223.A OD1 no hydrogen 3.174 N/A LYS 249.A N ASN 223.A O no hydrogen 3.057 N/A LYS 249.A NZ ASP 225.A OD1 no hydrogen 2.672 N/A LYS 249.A NZ GLY 247.A O no hydrogen 2.771 N/A LYS 249.A NZ ARG 275.A O no hydrogen 2.992 N/A LYS 249.A NZ ARG 277.A O no hydrogen 2.862 N/A LYS 252.A N VAL 268.A O no hydrogen 2.836 N/A ILE 254.A N THR 266.A O no hydrogen 2.906 N/A THR 256.A N SER 264.A O no hydrogen 2.989 N/A THR 256.A OG1 LYS 263.A O no hydrogen 2.620 N/A LYS 258.A N THR 256.A OG1 no hydrogen 3.302 N/A SER 264.A OG LEU 136.A O no hydrogen 2.936 N/A SER 264.A OG ALA 261.A O no hydrogen 3.293 N/A THR 266.A N ILE 254.A O no hydrogen 3.141 N/A ASN 267.A ND2 ASN 216.A OD1 no hydrogen 2.578 N/A VAL 268.A N LYS 252.A O no hydrogen 3.007 N/A VAL 270.A N HIS 250.A O no hydrogen 2.945 N/A ARG 275.A N PRO 271.A O no hydrogen 3.090 N/A ARG 275.A NE VAL 270.A O no hydrogen 3.178 N/A ARG 275.A NH2 HIS 250.A O no hydrogen 3.063 N/A ASN 276.A N GLU 272.A O no hydrogen 3.502 N/A ARG 277.A N ASP 274.A O no hydrogen 3.090 N/A SER 279.A N ASP 225.A OD2 no hydrogen 2.720 N/A SER 279.A OG SER 209.A OG no hydrogen 2.738 N/A SER 279.A OG ASP 225.A OD2 no hydrogen 2.553 N/A THR 281.A N GLU 284.A OE1 no hydrogen 3.027 N/A THR 281.A OG1 GLU 283.A OE1 no hydrogen 3.392 N/A GLU 284.A N THR 281.A OG1 no hydrogen 3.219 N/A ILE 285.A N THR 281.A O no hydrogen 2.927 N/A THR 286.A N ASP 282.A O no hydrogen 2.993 N/A THR 286.A OG1 ASP 282.A O no hydrogen 2.894 N/A GLU 287.A N GLU 283.A O no hydrogen 2.913 N/A LEU 288.A N GLU 284.A O no hydrogen 2.899 N/A ALA 289.A N ILE 285.A O no hydrogen 3.002 N/A HIS 290.A N THR 286.A O no hydrogen 3.099 N/A TYR 291.A N GLU 287.A O no hydrogen 3.269 N/A TYR 291.A OH GLU 287.A OE1 no hydrogen 2.676 N/A ALA 292.A N LEU 288.A O no hydrogen 2.961 N/A LEU 293.A N ALA 289.A O no hydrogen 3.081 N/A THR 294.A N HIS 290.A O no hydrogen 3.101 N/A ILE 295.A N TYR 291.A O no hydrogen 2.930 N/A GLU 296.A N ALA 292.A O no hydrogen 2.902 N/A LYS 297.A N LEU 293.A O no hydrogen 2.766 N/A HIS 298.A N THR 294.A O no hydrogen 3.154 N/A TYR 299.A N ILE 295.A O no hydrogen 3.031 N/A GLY 300.A N GLU 296.A O no hydrogen 2.811 N/A MET 303.A N THR 194.A OG1 no hydrogen 3.089 N/A ASP 304.A N ARG 322.A O no hydrogen 2.646 N/A ILE 305.A N MET 192.A O no hydrogen 2.894 N/A GLU 306.A N GLN 320.A O no hydrogen 2.858 N/A TRP 307.A N GLY 190.A O no hydrogen 3.113 N/A GLY 308.A N TYR 317.A O no hydrogen 2.896 N/A ARG 309.A N ALA 188.A O no hydrogen 2.763 N/A ARG 309.A NH1 SER 279.A O no hydrogen 3.164 N/A ARG 309.A NH1 GLU 284.A OE1 no hydrogen 3.236 N/A ASP 310.A N LYS 315.A O no hydrogen 2.967 N/A GLY 311.A N ARG 183.A O no hydrogen 2.732 N/A ASP 313.A N ASP 310.A OD1 no hydrogen 2.741 N/A GLY 314.A N ASP 310.A O no hydrogen 2.711 N/A TYR 317.A N GLY 308.A O no hydrogen 2.891 N/A TYR 317.A OH ASP 313.A OD1 no hydrogen 2.736 N/A ILE 318.A N ARG 37.A O no hydrogen 2.856 N/A LEU 319.A N GLU 306.A O no hydrogen 2.766 N/A GLN 320.A N GLU 306.A O no hydrogen 3.493 N/A GLN 320.A NE2 GLN 179.A OE1 no hydrogen 3.415 N/A ARG 322.A N ASP 304.A O no hydrogen 2.852 N/A ARG 322.A NH2 ALA 129.A O no hydrogen 3.513 N/A GLU 324.A N PRO 302.A O no hydrogen 2.867 N/A GLY 329.A N GLY 406.A O no hydrogen 3.244 N/A ARG 330.A N VAL 383.A O no hydrogen 2.481 N/A ALA 331.A N ASP 404.A O no hydrogen 2.985 N/A ARG 340.A N VAL 342.A O no hydrogen 2.942 N/A VAL 342.A N LYS 338.A O no hydrogen 2.822 N/A LEU 343.A N ALA 361.A O no hydrogen 2.696 N/A VAL 344.A N ARG 340.A O no hydrogen 3.201 N/A THR 345.A N VAL 363.A O no hydrogen 3.239 N/A THR 348.A OG1 HIS 372.A ND1 no hydrogen 3.412 N/A TRP 352.A N ASP 349.A O no hydrogen 3.425 N/A GLU 353.A N PRO 350.A O no hydrogen 2.862 N/A ARG 358.A N PRO 354.A O no hydrogen 3.267 N/A SER 360.A N ASP 341.A O no hydrogen 2.682 N/A SER 360.A OG GLN 336.A O no hydrogen 3.562 N/A VAL 363.A N LEU 343.A O no hydrogen 2.752 N/A THR 364.A N VAL 382.A O no hydrogen 2.893 N/A THR 364.A OG1 ARG 366.A O no hydrogen 3.307 N/A ASN 365.A N THR 345.A O no hydrogen 3.122 N/A ASN 365.A ND2 ASP 346.A OD2 no hydrogen 3.364 N/A ARG 366.A N ASP 346.A O no hydrogen 3.217 N/A CYS 371.A N GLY 368.A O no hydrogen 3.167 N/A ILE 375.A N HIS 372.A O no hydrogen 2.978 N/A ILE 376.A N HIS 372.A O no hydrogen 3.442 N/A ALA 377.A N ALA 373.A O no hydrogen 3.286 N/A ARG 378.A N ILE 375.A O no hydrogen 3.201 N/A GLU 379.A N ILE 375.A O no hydrogen 3.047 N/A VAL 382.A N ILE 362.A O no hydrogen 3.006 N/A VAL 383.A N ARG 330.A O no hydrogen 3.106 N/A CYS 385.A N THR 364.A O no hydrogen 3.234 N/A CYS 385.A SG GLU 328.A O no hydrogen 3.049 N/A CYS 385.A SG THR 364.A O no hydrogen 3.769 N/A CYS 385.A SG VAL 382.A O no hydrogen 4.038 N/A ALA 388.A N ASN 365.A OD1 no hydrogen 3.035 N/A THR 389.A N ASN 365.A OD1 no hydrogen 3.456 N/A LEU 391.A N ASN 387.A O no hydrogen 3.132 N/A LEU 392.A N ALA 388.A O no hydrogen 2.700 N/A ASN 394.A ND2 VAL 339.A O no hydrogen 3.668 N/A VAL 398.A N GLY 337.A O no hydrogen 3.128 N/A THR 399.A N TYR 409.A O no hydrogen 2.590 N/A VAL 400.A N GLY 335.A O no hydrogen 3.119 N/A TYR 409.A N THR 399.A O no hydrogen 3.304 N/A LYS 419.A N GLU 705.A O no hydrogen 3.166 N/A LYS 419.A NZ GLU 705.A OE2 no hydrogen 3.348 N/A MET 421.A N VAL 707.A O no hydrogen 2.846 N/A MET 422.A N GLY 440.A O no hydrogen 2.859 N/A ASN 423.A N LEU 709.A O no hydrogen 2.661 N/A VAL 424.A N LEU 443.A O no hydrogen 2.935 N/A GLU 428.A N ASN 426.A OD1 no hydrogen 2.843 N/A LEU 429.A N ASN 426.A O no hydrogen 2.891 N/A ALA 430.A N PRO 427.A O no hydrogen 3.429 N/A SER 432.A OG LEU 429.A O no hydrogen 2.706 N/A PHE 433.A N ALA 430.A O no hydrogen 3.107 N/A ALA 434.A N ALA 430.A O no hydrogen 3.119 N/A GLU 439.A N VAL 420.A O no hydrogen 3.006 N/A ILE 441.A N LYS 508.A O no hydrogen 2.872 N/A GLY 442.A N MET 422.A O no hydrogen 2.959 N/A ALA 444.A N ILE 510.A O no hydrogen 2.929 N/A ARG 445.A N VAL 424.A O no hydrogen 2.991 N/A ARG 445.A NH1 ASN 423.A OD1 no hydrogen 2.456 N/A ILE 450.A N MET 446.A O no hydrogen 3.187 N/A ASN 451.A N GLU 447.A O no hydrogen 2.960 N/A ARG 452.A N PHE 448.A O no hydrogen 2.818 N/A GLN 453.A N ILE 449.A O no hydrogen 2.968 N/A GLN 453.A NE2 LYS 492.A O no hydrogen 3.116 N/A GLY 455.A N ILE 450.A O no hydrogen 2.681 N/A HIS 457.A N VAL 525.A O no hydrogen 3.023 N/A HIS 457.A NE2 GLU 531.A OE2 no hydrogen 2.708 N/A LYS 459.A N HIS 457.A ND1 no hydrogen 3.100 N/A LYS 459.A NZ ASN 551.A O no hydrogen 2.592 N/A LEU 461.A N HIS 457.A O no hydrogen 3.321 N/A LEU 462.A N PRO 458.A O no hydrogen 2.843 N/A GLU 463.A N LYS 459.A O no hydrogen 2.798 N/A PHE 464.A N LEU 461.A O no hydrogen 3.307 N/A LYS 466.A N GLU 463.A O no hydrogen 2.883 N/A GLN 467.A N PHE 464.A O no hydrogen 3.066 N/A GLN 467.A NE2 GLU 463.A O no hydrogen 2.222 N/A GLN 467.A NE2 PHE 464.A O no hydrogen 2.996 N/A LEU 471.A N ASP 468.A O no hydrogen 2.534 N/A LEU 471.A N ASP 468.A OD1 no hydrogen 2.870 N/A LYS 472.A N ASP 468.A O no hydrogen 2.620 N/A ALA 473.A N ASP 469.A O no hydrogen 3.131 N/A GLU 474.A N GLU 470.A O no hydrogen 3.395 N/A ILE 475.A N LEU 471.A O no hydrogen 3.030 N/A THR 476.A N LYS 472.A O no hydrogen 3.183 N/A ARG 477.A N ALA 473.A O no hydrogen 3.183 N/A ARG 477.A NH1 GLU 474.A OE1 no hydrogen 3.340 N/A ARG 478.A N GLU 474.A O no hydrogen 3.089 N/A ARG 478.A NE GLU 474.A OE2 no hydrogen 2.696 N/A ILE 479.A N ILE 475.A O no hydrogen 2.842 N/A ALA 480.A N ARG 477.A O no hydrogen 3.346 N/A TYR 482.A N ILE 479.A O no hydrogen 2.943 N/A TYR 482.A OH GLU 495.A OE2 no hydrogen 2.856 N/A ASP 487.A N SER 484.A OG no hydrogen 3.407 N/A PHE 488.A N SER 484.A O no hydrogen 2.964 N/A VAL 490.A N VAL 486.A O no hydrogen 3.088 N/A ASP 491.A N ASP 487.A O no hydrogen 2.860 N/A LYS 492.A N PHE 488.A O no hydrogen 2.982 N/A LYS 492.A NZ LYS 244.A O no hydrogen 3.158 N/A LYS 492.A NZ TYR 482.A OH no hydrogen 3.131 N/A LYS 492.A NZ GLU 495.A OE1 no hydrogen 3.345 N/A ILE 493.A N TYR 489.A O no hydrogen 3.207 N/A ALA 494.A N VAL 490.A O no hydrogen 2.913 N/A GLU 495.A N ASP 491.A O no hydrogen 2.811 N/A GLY 496.A N LYS 492.A O no hydrogen 2.909 N/A VAL 497.A N ILE 493.A O no hydrogen 2.826 N/A ALA 498.A N ALA 494.A O no hydrogen 2.754 N/A THR 499.A N GLU 495.A O no hydrogen 2.969 N/A THR 499.A OG1 LEU 242.A O no hydrogen 3.002 N/A THR 499.A OG1 GLU 495.A O no hydrogen 2.722 N/A LEU 500.A N GLY 496.A O no hydrogen 3.137 N/A ALA 501.A N VAL 497.A O no hydrogen 2.918 N/A ALA 502.A N ALA 498.A O no hydrogen 2.708 N/A SER 503.A N THR 499.A O no hydrogen 3.047 N/A SER 503.A N LEU 500.A O no hydrogen 3.250 N/A SER 503.A OG LEU 500.A O no hydrogen 2.634 N/A ARG 507.A N VAL 504.A O no hydrogen 2.697 N/A ARG 507.A NE VAL 504.A O no hydrogen 3.115 N/A ARG 507.A NH1 SER 438.A O no hydrogen 3.042 N/A ARG 507.A NH2 ALA 434.A O no hydrogen 3.456 N/A THR 509.A N ASN 574.A O no hydrogen 2.876 N/A THR 509.A OG1 ARG 507.A O no hydrogen 3.423 N/A ILE 510.A N ILE 441.A O no hydrogen 2.896 N/A VAL 511.A N GLU 576.A O no hydrogen 2.716 N/A ARG 512.A N ALA 444.A O no hydrogen 3.050 N/A ARG 512.A NH2 GLU 447.A OE1 no hydrogen 2.967 N/A MET 513.A N MET 578.A O no hydrogen 3.089 N/A SER 514.A N GLU 559.A OE2 no hydrogen 2.770 N/A SER 514.A OG GLU 559.A OE1 no hydrogen 2.656 N/A SER 514.A OG GLU 559.A OE2 no hydrogen 3.158 N/A ASP 515.A N GLU 447.A OE2 no hydrogen 2.798 N/A LYS 517.A N GLU 520.A OE1 no hydrogen 2.900 N/A GLU 520.A N LYS 517.A O no hydrogen 2.971 N/A TYR 521.A N LYS 517.A O no hydrogen 3.297 N/A ALA 522.A N SER 518.A O no hydrogen 2.870 N/A LEU 524.A N TYR 521.A O no hydrogen 3.337 N/A VAL 525.A N GLY 455.A O no hydrogen 3.003 N/A GLY 527.A N LEU 524.A O no hydrogen 3.147 N/A TYR 530.A N GLY 527.A O no hydrogen 2.927 N/A TYR 530.A OH GLU 463.A OE1 no hydrogen 2.990 N/A TYR 530.A OH GLN 467.A OE1 no hydrogen 3.271 N/A GLU 531.A N ASN 528.A O no hydrogen 3.109 N/A LEU 539.A N ASN 536.A O no hydrogen 3.035 N/A GLY 540.A N PRO 537.A O no hydrogen 3.192 N/A PHE 541.A N GLU 534.A OE2 no hydrogen 2.882 N/A ARG 542.A NH1 MET 538.A O no hydrogen 2.925 N/A ARG 542.A NH2 ASP 515.A OD1 no hydrogen 3.415 N/A ALA 544.A N PHE 581.A O no hydrogen 3.313 N/A ARG 546.A NE PHE 541.A O no hydrogen 3.340 N/A ARG 546.A NH1 GLU 531.A OE2 no hydrogen 3.241 N/A ARG 546.A NH2 GLU 531.A OE1 no hydrogen 2.895 N/A ARG 546.A NH2 GLU 531.A OE2 no hydrogen 3.412 N/A ARG 546.A NH2 PHE 541.A O no hydrogen 3.320 N/A TYR 547.A N GLY 543.A O no hydrogen 2.987 N/A TYR 547.A OH SER 514.A O no hydrogen 2.615 N/A VAL 548.A N ALA 544.A O no hydrogen 3.074 N/A PHE 552.A N ALA 549.A O no hydrogen 2.822 N/A LYS 553.A NZ ASP 554.A OD1 no hydrogen 3.289 N/A CYS 555.A N PHE 552.A O no hydrogen 3.197 N/A PHE 556.A N PHE 552.A O no hydrogen 3.318 N/A ALA 557.A N LYS 553.A O no hydrogen 2.992 N/A LEU 558.A N CYS 555.A O no hydrogen 3.159 N/A GLU 559.A N CYS 555.A O no hydrogen 3.322 N/A CYS 560.A N PHE 556.A O no hydrogen 2.935 N/A CYS 560.A SG PHE 556.A O no hydrogen 3.517 N/A CYS 560.A SG ASN 598.A OD1 no hydrogen 3.859 N/A LYS 561.A N ALA 557.A O no hydrogen 2.969 N/A ALA 562.A N LEU 558.A O no hydrogen 3.310 N/A LEU 563.A N GLU 559.A O no hydrogen 3.185 N/A LYS 564.A N CYS 560.A O no hydrogen 2.997 N/A LYS 564.A NZ ASP 568.A OD2 no hydrogen 2.789 N/A ARG 565.A N LYS 561.A O no hydrogen 3.128 N/A ARG 565.A NH1 ASP 491.A OD1 no hydrogen 3.015 N/A VAL 566.A N ALA 562.A O no hydrogen 3.121 N/A ARG 567.A N LEU 563.A O no hydrogen 3.138 N/A ARG 567.A NE VAL 575.A O no hydrogen 2.873 N/A ARG 567.A NH1 ASN 605.A O no hydrogen 2.902 N/A ARG 567.A NH2 THR 573.A O no hydrogen 3.064 N/A ARG 567.A NH2 ASN 605.A O no hydrogen 3.074 N/A ASP 568.A N LYS 564.A O no hydrogen 2.725 N/A GLU 569.A N ARG 565.A O no hydrogen 2.943 N/A MET 570.A N ARG 565.A O no hydrogen 2.953 N/A LEU 572.A N VAL 566.A O no hydrogen 2.917 N/A ASN 574.A ND2 ALA 501.A O no hydrogen 3.037 N/A ASN 574.A ND2 ARG 507.A O no hydrogen 2.624 N/A VAL 575.A N LEU 572.A O no hydrogen 3.388 N/A GLU 576.A N THR 509.A O no hydrogen 2.851 N/A ILE 577.A N ARG 608.A O no hydrogen 3.141 N/A MET 578.A N VAL 511.A O no hydrogen 2.769 N/A ILE 579.A N ILE 610.A O no hydrogen 2.858 N/A PHE 581.A N GLU 614.A OE2 no hydrogen 2.759 N/A ARG 583.A N GLU 587.A OE2 no hydrogen 2.699 N/A ARG 583.A NH1 GLY 540.A O no hydrogen 3.229 N/A ARG 583.A NH2 GLY 540.A O no hydrogen 2.959 N/A GLU 587.A N THR 584.A OG1 no hydrogen 3.038 N/A ALA 588.A N THR 584.A O no hydrogen 3.110 N/A GLU 589.A N LEU 585.A O no hydrogen 3.026 N/A ALA 590.A N GLY 586.A O no hydrogen 2.919 N/A VAL 591.A N GLU 587.A O no hydrogen 2.877 N/A VAL 592.A N ALA 588.A O no hydrogen 3.102 N/A LYS 593.A N GLU 589.A O no hydrogen 3.140 N/A ALA 594.A N ALA 590.A O no hydrogen 2.870 N/A LEU 595.A N VAL 591.A O no hydrogen 2.849 N/A LYS 596.A N VAL 592.A O no hydrogen 3.055 N/A GLU 597.A N LYS 593.A O no hydrogen 3.056 N/A ASN 598.A N ALA 594.A O no hydrogen 3.184 N/A GLY 599.A N LYS 596.A O no hydrogen 3.053 N/A LEU 600.A N LEU 595.A O no hydrogen 2.961 N/A ARG 602.A NH1 ASP 630.A OD1 no hydrogen 2.865 N/A GLY 603.A N LEU 607.A O no hydrogen 3.290 N/A LYS 604.A N GLU 601.A O no hydrogen 2.958 N/A LYS 604.A NZ GLY 599.A O no hydrogen 3.138 N/A LEU 607.A N LYS 604.A O no hydrogen 3.000 N/A ARG 608.A NE GLU 576.A OE2 no hydrogen 2.709 N/A LEU 609.A N ASP 630.A OD2 no hydrogen 3.026 N/A ILE 610.A N ILE 577.A O no hydrogen 2.871 N/A MET 611.A N GLY 631.A O no hydrogen 3.094 N/A MET 612.A N ILE 579.A O no hydrogen 2.882 N/A CYS 613.A N SER 633.A O no hydrogen 2.847 N/A SER 617.A OG ARG 583.A O no hydrogen 2.914 N/A ASN 618.A N LEU 615.A O no hydrogen 2.960 N/A ALA 619.A N PRO 616.A O no hydrogen 3.156 N/A VAL 620.A N PRO 616.A O no hydrogen 3.141 N/A LEU 621.A N SER 617.A O no hydrogen 2.997 N/A ALA 622.A N ALA 619.A O no hydrogen 3.269 N/A GLN 624.A N GLN 624.A OE1 no hydrogen 2.792 N/A PHE 625.A N LEU 621.A O no hydrogen 2.927 N/A LEU 626.A N ALA 622.A O no hydrogen 2.888 N/A TYR 628.A N PHE 625.A O no hydrogen 3.138 N/A TYR 628.A OH GLU 589.A OE1 no hydrogen 2.882 N/A PHE 629.A N LEU 626.A O no hydrogen 3.182 N/A ASP 630.A N LEU 609.A O no hydrogen 2.787 N/A PHE 632.A N TYR 681.A O no hydrogen 2.898 N/A SER 633.A N MET 611.A O no hydrogen 2.896 N/A ILE 634.A N GLY 683.A O no hydrogen 2.724 N/A GLY 635.A N CYS 613.A O no hydrogen 3.096 N/A SER 636.A OG GLU 659.A OE2 no hydrogen 3.444 N/A SER 636.A OG CYS 685.A O no hydrogen 2.910 N/A MET 639.A N GLY 635.A O no hydrogen 3.042 N/A THR 640.A N SER 636.A O no hydrogen 2.848 N/A THR 640.A OG1 SER 636.A O no hydrogen 2.507 N/A GLN 641.A N ASN 637.A O no hydrogen 3.051 N/A GLN 641.A NE2 LEU 646.A O no hydrogen 3.469 N/A LEU 642.A N ASP 638.A O no hydrogen 3.035 N/A THR 643.A N MET 639.A O no hydrogen 2.949 N/A THR 643.A OG1 MET 639.A O no hydrogen 2.731 N/A LEU 644.A N THR 640.A O no hydrogen 3.058 N/A LEU 646.A N GLN 641.A O no hydrogen 2.830 N/A ARG 648.A NH1 ASN 637.A OD1 no hydrogen 3.543 N/A ASP 649.A N ASP 647.A OD1 no hydrogen 3.034 N/A SER 650.A N ASP 647.A O no hydrogen 3.127 N/A LEU 652.A N SER 650.A OG no hydrogen 3.250 N/A VAL 653.A N SER 650.A O no hydrogen 3.379 N/A SER 654.A N SER 650.A O no hydrogen 3.150 N/A SER 654.A OG SER 650.A O no hydrogen 3.014 N/A SER 656.A N VAL 653.A O no hydrogen 3.218 N/A PHE 657.A N SER 654.A O no hydrogen 3.266 N/A ARG 660.A N ASP 658.A OD1 no hydrogen 3.134 N/A ARG 660.A NH1 ASP 658.A OD1 no hydrogen 2.996 N/A ASN 661.A N ASP 658.A O no hydrogen 3.076 N/A ALA 663.A N ASN 661.A OD1 no hydrogen 2.897 N/A VAL 664.A N ASN 661.A O no hydrogen 2.896 N/A LYS 665.A N ASN 661.A O no hydrogen 2.980 N/A VAL 666.A N PRO 662.A O no hydrogen 2.990 N/A MET 667.A N ALA 663.A O no hydrogen 3.419 N/A LEU 668.A N VAL 664.A O no hydrogen 2.954 N/A HIS 669.A N LYS 665.A O no hydrogen 2.904 N/A LEU 670.A N VAL 666.A O no hydrogen 2.995 N/A ALA 671.A N MET 667.A O no hydrogen 3.128 N/A ILE 672.A N LEU 668.A O no hydrogen 2.829 N/A SER 673.A N HIS 669.A O no hydrogen 2.970 N/A SER 673.A OG HIS 669.A O no hydrogen 3.210 N/A ALA 674.A N LEU 670.A O no hydrogen 3.180 N/A CYS 675.A N ALA 671.A O no hydrogen 3.172 N/A CYS 675.A SG ALA 671.A O no hydrogen 3.433 N/A CYS 675.A SG TYR 681.A O no hydrogen 3.702 N/A ARG 676.A N ILE 672.A O no hydrogen 2.950 N/A ARG 676.A NE GLY 703.A O no hydrogen 2.958 N/A ARG 676.A NH2 GLY 703.A O no hydrogen 3.452 N/A LYS 677.A N SER 673.A O no hydrogen 3.006 N/A LYS 677.A NZ GLU 623.A OE1 no hydrogen 2.939 N/A GLN 678.A N CYS 675.A O no hydrogen 3.099 N/A ASN 679.A N ARG 676.A O no hydrogen 3.088 N/A LYS 680.A N CYS 675.A O no hydrogen 2.923 N/A LYS 680.A NZ LEU 626.A O no hydrogen 3.000 N/A LYS 680.A NZ PHE 629.A O no hydrogen 2.886 N/A TYR 681.A OH SER 706.A OG no hydrogen 2.851 N/A GLY 683.A N PHE 632.A O no hydrogen 2.956 N/A ILE 684.A N SER 706.A O no hydrogen 3.250 N/A CYS 685.A N ILE 634.A O no hydrogen 2.937 N/A GLN 687.A NE2 THR 713.A OG1 no hydrogen 2.989 N/A ASP 691.A N GLN 687.A O no hydrogen 2.743 N/A HIS 692.A N GLY 688.A O no hydrogen 2.788 N/A PHE 695.A N HIS 692.A O no hydrogen 2.768 N/A ALA 696.A N HIS 692.A O no hydrogen 3.379 N/A LYS 697.A N PRO 693.A O no hydrogen 3.045 N/A LYS 697.A NZ ASP 694.A OD1 no hydrogen 2.839 N/A TRP 698.A N ASP 694.A O no hydrogen 2.887 N/A LEU 699.A N PHE 695.A O no hydrogen 2.821 N/A VAL 700.A N ALA 696.A O no hydrogen 2.968 N/A GLU 701.A N LYS 697.A O no hydrogen 3.018 N/A GLU 702.A N TRP 698.A O no hydrogen 2.932 N/A GLY 703.A N VAL 700.A O no hydrogen 2.955 N/A ILE 704.A N LEU 699.A O no hydrogen 3.099 N/A GLU 705.A N VAL 682.A O no hydrogen 2.847 N/A SER 706.A OG TYR 681.A OH no hydrogen 2.851 N/A VAL 707.A N LYS 419.A O no hydrogen 3.000 N/A SER 708.A N ILE 684.A O no hydrogen 2.908 N/A LEU 709.A N MET 421.A O no hydrogen 3.045 N/A ASN 710.A N GLN 687.A OE1 no hydrogen 2.882 N/A THR 713.A N ASN 710.A O no hydrogen 2.782 N/A THR 713.A OG1 ASN 710.A O no hydrogen 2.658 N/A VAL 714.A N PRO 711.A O no hydrogen 3.187 N/A THR 717.A N THR 713.A O no hydrogen 3.341 N/A THR 717.A OG1 THR 713.A O no hydrogen 3.062 N/A TRP 718.A N VAL 714.A O no hydrogen 2.999 N/A TRP 718.A NE1 PRO 414.A O no hydrogen 2.908 N/A LEU 719.A N ILE 715.A O no hydrogen 2.934 N/A TYR 720.A N GLU 716.A O no hydrogen 2.931 N/A LEU 721.A N THR 717.A O no hydrogen 2.879 N/A ALA 722.A N TRP 718.A O no hydrogen 2.843 N/A ASN 723.A N LEU 719.A O no hydrogen 2.860 N/A GLU 724.A N TYR 720.A O no hydrogen 3.163 N/A LEU 725.A N ALA 722.A O no hydrogen 3.237 N/A