Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6k33_aA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N ASN 305.A OD1 no hydrogen 3.295 N/A ASP 7.A N ALA 174.A O no hydrogen 2.500 N/A ASP 9.A N LYS 172.A O no hydrogen 2.548 N/A SER 14.A OG THR 13.A O no hydrogen 2.734 N/A ALA 19.A N PHE 15.A O no hydrogen 3.121 N/A LYS 20.A N LYS 17.A O no hydrogen 3.150 N/A ARG 26.A NH1 THR 50.A O no hydrogen 2.538 N/A GLY 31.A N LEU 28.A O no hydrogen 3.355 N/A THR 35.A N GLN 705.A O no hydrogen 3.060 N/A TRP 37.A NE1 LEU 28.A O no hydrogen 3.181 N/A ILE 38.A N THR 35.A O no hydrogen 3.424 N/A ASN 40.A N THR 36.A O no hydrogen 2.983 N/A LEU 41.A N TRP 37.A O no hydrogen 2.855 N/A HIS 42.A N ILE 38.A O no hydrogen 3.247 N/A HIS 42.A ND1 ILE 38.A O no hydrogen 2.934 N/A ALA 43.A N TRP 39.A O no hydrogen 2.983 N/A LEU 44.A N ASN 40.A O no hydrogen 2.963 N/A THR 50.A N ASP 47.A O no hydrogen 3.363 N/A HIS 51.A N PHE 48.A O no hydrogen 3.155 N/A HIS 51.A NE2 ALA 45.A O no hydrogen 2.731 N/A ASP 54.A N THR 52.A OG1 no hydrogen 3.224 N/A ASP 57.A N ASP 54.A OD2 no hydrogen 2.669 N/A ILE 58.A N ASP 54.A O no hydrogen 3.102 N/A SER 59.A N LEU 55.A O no hydrogen 2.839 N/A SER 59.A OG LEU 55.A O no hydrogen 2.356 N/A ARG 60.A N GLU 56.A O no hydrogen 2.990 N/A ARG 60.A NE PRO 175.A O no hydrogen 2.703 N/A LYS 61.A N ASP 57.A O no hydrogen 3.095 N/A ILE 62.A N ILE 58.A O no hydrogen 2.846 N/A PHE 63.A N SER 59.A O no hydrogen 2.918 N/A SER 64.A N ARG 60.A O no hydrogen 3.139 N/A SER 64.A OG ARG 60.A O no hydrogen 2.391 N/A ALA 65.A N LYS 61.A O no hydrogen 3.029 N/A HIS 66.A N ILE 62.A O no hydrogen 2.882 N/A PHE 67.A N PHE 63.A O no hydrogen 3.195 N/A GLY 68.A N SER 64.A O no hydrogen 2.997 N/A HIS 69.A N ALA 65.A O no hydrogen 2.996 N/A LEU 70.A N HIS 66.A O no hydrogen 3.053 N/A ALA 71.A N PHE 67.A O no hydrogen 2.943 N/A VAL 72.A N GLY 68.A O no hydrogen 3.006 N/A VAL 73.A N HIS 69.A O no hydrogen 2.956 N/A PHE 74.A N LEU 70.A O no hydrogen 2.934 N/A ILE 75.A N ALA 71.A O no hydrogen 2.890 N/A TRP 76.A N VAL 72.A O no hydrogen 2.906 N/A LEU 77.A N VAL 73.A O no hydrogen 2.761 N/A SER 78.A N PHE 74.A O no hydrogen 2.853 N/A SER 78.A OG PHE 74.A O no hydrogen 3.356 N/A SER 78.A OG ILE 75.A O no hydrogen 2.948 N/A GLY 79.A N ILE 75.A O no hydrogen 2.870 N/A MET 80.A N TRP 76.A O no hydrogen 2.856 N/A TYR 81.A N LEU 77.A O no hydrogen 3.011 N/A PHE 82.A N SER 78.A O no hydrogen 2.674 N/A HIS 83.A N GLY 79.A O no hydrogen 2.848 N/A GLY 84.A N MET 80.A O no hydrogen 3.173 N/A ALA 85.A N TYR 81.A O no hydrogen 2.850 N/A ALA 85.A N PHE 82.A O no hydrogen 3.031 N/A LYS 86.A N PHE 82.A O no hydrogen 2.802 N/A PHE 87.A N HIS 83.A O no hydrogen 2.876 N/A SER 88.A OG GLY 84.A O no hydrogen 2.899 N/A ASN 89.A ND2 LYS 101.A O no hydrogen 3.145 N/A TYR 90.A N SER 88.A OG no hydrogen 2.816 N/A TYR 90.A OH ILE 142.A O no hydrogen 2.876 N/A TRP 93.A N ASN 89.A O no hydrogen 2.762 N/A LEU 94.A N TYR 90.A O no hydrogen 2.970 N/A ALA 95.A N GLU 91.A O no hydrogen 3.377 N/A ASP 96.A N ALA 92.A O no hydrogen 3.151 N/A GLY 99.A N ASP 96.A OD2 no hydrogen 2.937 N/A LYS 101.A N VAL 120.A O no hydrogen 3.122 N/A LYS 101.A NZ GLN 128.A OE1 no hydrogen 2.886 N/A SER 103.A N ASN 89.A OD1 no hydrogen 3.077 N/A SER 103.A OG ALA 104.A O no hydrogen 3.489 N/A SER 103.A OG ILE 127.A O no hydrogen 3.265 N/A ALA 104.A N ILE 127.A O no hydrogen 3.267 N/A GLN 105.A NE2 GLN 105.A O no hydrogen 2.542 N/A VAL 107.A N ASN 117.A OD1 no hydrogen 3.032 N/A GLN 113.A NE2 TRP 108.A O no hydrogen 2.952 N/A ILE 115.A N GLY 112.A O no hydrogen 3.193 N/A LEU 116.A N GLN 113.A O no hydrogen 3.151 N/A ASN 117.A ND2 VAL 107.A O no hydrogen 3.025 N/A VAL 120.A N PHE 124.A O no hydrogen 3.318 N/A GLY 121.A N ASP 119.A OD1 no hydrogen 3.329 N/A GLY 126.A N GLY 118.A O no hydrogen 3.253 N/A ILE 129.A N PRO 102.A O no hydrogen 2.590 N/A GLN 135.A N GLN 135.A OE1 no hydrogen 2.789 N/A LEU 136.A N GLY 132.A O no hydrogen 2.996 N/A TRP 137.A N LEU 133.A O no hydrogen 2.862 N/A ARG 138.A N PHE 134.A O no hydrogen 3.081 N/A ALA 139.A N GLN 135.A O no hydrogen 3.178 N/A SER 140.A N LEU 136.A O no hydrogen 3.066 N/A SER 140.A OG LEU 136.A O no hydrogen 3.449 N/A SER 140.A OG TRP 137.A O no hydrogen 2.720 N/A GLY 141.A N TRP 137.A O no hydrogen 3.069 N/A GLY 141.A N ARG 138.A O no hydrogen 3.092 N/A ILE 142.A N TRP 137.A O no hydrogen 2.925 N/A GLN 147.A NE2 THR 143.A OG1 no hydrogen 3.333 N/A GLN 147.A NE2 ASN 144.A OD1 no hydrogen 2.317 N/A CYS 150.A N PHE 146.A O no hydrogen 3.090 N/A CYS 150.A SG PHE 146.A O no hydrogen 3.240 N/A CYS 150.A SG GLN 147.A O no hydrogen 3.352 N/A THR 151.A N GLN 147.A O no hydrogen 3.129 N/A THR 151.A OG1 GLN 147.A O no hydrogen 2.311 N/A ALA 152.A N LEU 148.A O no hydrogen 2.883 N/A ILE 153.A N TYR 149.A O no hydrogen 2.925 N/A GLY 154.A N CYS 150.A O no hydrogen 2.801 N/A GLY 155.A N THR 151.A O no hydrogen 2.875 N/A LEU 156.A N ALA 152.A O no hydrogen 3.024 N/A VAL 157.A N ILE 153.A O no hydrogen 3.000 N/A MET 158.A N GLY 154.A O no hydrogen 3.000 N/A ALA 159.A N GLY 155.A O no hydrogen 2.800 N/A GLY 160.A N LEU 156.A O no hydrogen 3.000 N/A LEU 161.A N VAL 157.A O no hydrogen 2.914 N/A MET 162.A N MET 158.A O no hydrogen 2.985 N/A LEU 163.A N ALA 159.A O no hydrogen 2.880 N/A PHE 164.A N GLY 160.A O no hydrogen 2.941 N/A ALA 165.A N LEU 161.A O no hydrogen 2.691 N/A GLY 166.A N MET 162.A O no hydrogen 3.058 N/A TRP 167.A NE1 THR 13.A OG1 no hydrogen 2.759 N/A PHE 168.A N PHE 164.A O no hydrogen 2.925 N/A HIS 169.A N ALA 165.A O no hydrogen 2.902 N/A HIS 171.A N TRP 167.A O no hydrogen 2.751 N/A HIS 171.A ND1 VAL 11.A O no hydrogen 3.200 N/A LYS 172.A NZ ASP 9.A OD1 no hydrogen 2.696 N/A ARG 173.A N PHE 168.A O no hydrogen 2.672 N/A ARG 173.A NH1 LYS 172.A O no hydrogen 3.382 N/A ALA 174.A N ASP 7.A O no hydrogen 2.769 N/A LYS 176.A N VAL 5.A O no hydrogen 2.981 N/A LYS 176.A NZ ASP 7.A OD1 no hydrogen 2.533 N/A LEU 177.A N GLU 56.A OE2 no hydrogen 3.028 N/A PHE 180.A N LEU 177.A O no hydrogen 2.916 N/A GLN 181.A N LEU 177.A O no hydrogen 2.945 N/A GLN 181.A NE2 THR 336.A O no hydrogen 3.518 N/A ASN 182.A ND2 VAL 2.A O no hydrogen 3.246 N/A SER 185.A OG HIS 189.A ND1 no hydrogen 3.338 N/A MET 186.A N ASN 182.A O no hydrogen 3.070 N/A LEU 187.A N VAL 183.A O no hydrogen 2.650 N/A ASN 188.A N GLU 184.A O no hydrogen 2.832 N/A ASN 188.A ND2 TYR 302.A O no hydrogen 2.626 N/A HIS 189.A N SER 185.A O no hydrogen 2.926 N/A HIS 189.A ND1 SER 185.A O no hydrogen 2.886 N/A HIS 190.A N MET 186.A O no hydrogen 2.981 N/A LEU 191.A N LEU 187.A O no hydrogen 2.885 N/A ALA 192.A N ASN 188.A O no hydrogen 2.964 N/A GLY 193.A N HIS 189.A O no hydrogen 2.617 N/A LEU 194.A N HIS 189.A O no hydrogen 3.028 N/A LEU 195.A N HIS 190.A O no hydrogen 3.028 N/A GLY 196.A N LEU 191.A O no hydrogen 3.117 N/A LEU 197.A N ALA 192.A O no hydrogen 2.911 N/A SER 199.A N LEU 195.A O no hydrogen 2.842 N/A SER 199.A OG HIS 288.A O no hydrogen 2.398 N/A LEU 200.A N GLY 196.A O no hydrogen 2.712 N/A SER 201.A N LEU 197.A O no hydrogen 2.813 N/A SER 201.A OG LEU 197.A O no hydrogen 2.467 N/A SER 201.A OG GLY 198.A O no hydrogen 3.175 N/A TRP 202.A N GLY 198.A O no hydrogen 3.004 N/A ALA 203.A N SER 199.A O no hydrogen 2.844 N/A GLY 204.A N LEU 200.A O no hydrogen 2.748 N/A HIS 205.A N SER 201.A O no hydrogen 2.772 N/A GLN 206.A N TRP 202.A O no hydrogen 2.701 N/A ILE 207.A N ALA 203.A O no hydrogen 2.947 N/A HIS 208.A N GLY 204.A O no hydrogen 3.003 N/A VAL 209.A N HIS 205.A O no hydrogen 3.004 N/A SER 210.A N HIS 205.A O no hydrogen 3.032 N/A SER 210.A OG SER 140.A O no hydrogen 2.814 N/A SER 210.A OG HIS 205.A O no hydrogen 3.234 N/A LEU 211.A N GLN 206.A O no hydrogen 2.514 N/A ILE 213.A N VAL 209.A O no hydrogen 3.224 N/A ASN 214.A N SER 210.A O no hydrogen 2.967 N/A ASN 214.A ND2 ARG 138.A O no hydrogen 2.731 N/A LYS 215.A N LEU 211.A O no hydrogen 3.038 N/A LEU 216.A N PRO 212.A O no hydrogen 2.972 N/A LEU 217.A N ILE 213.A O no hydrogen 2.872 N/A ASP 218.A N ASN 214.A O no hydrogen 2.791 N/A ALA 219.A N LYS 215.A O no hydrogen 2.961 N/A GLY 220.A N LEU 216.A O no hydrogen 3.028 N/A GLY 220.A N LEU 217.A O no hydrogen 2.946 N/A VAL 221.A N LEU 216.A O no hydrogen 3.288 N/A LYS 224.A NZ THR 143.A O no hydrogen 2.678 N/A ASP 225.A N ALA 222.A O no hydrogen 2.418 N/A ILE 226.A N ALA 222.A O no hydrogen 3.323 N/A GLU 231.A N LEU 228.A O no hydrogen 3.168 N/A ILE 233.A N HIS 230.A O no hydrogen 3.080 N/A LEU 234.A N HIS 230.A O no hydrogen 2.906 N/A ASN 235.A N GLU 231.A O no hydrogen 3.070 N/A SER 237.A N ASN 235.A OD1 no hydrogen 3.410 N/A SER 237.A OG ASN 235.A OD1 no hydrogen 2.329 N/A ALA 240.A N SER 237.A O no hydrogen 3.146 N/A LYS 245.A N ASP 264.A OD2 no hydrogen 3.012 N/A LYS 245.A NZ ALA 260.A O no hydrogen 2.370 N/A TRP 248.A NE1 TYR 243.A O no hydrogen 2.803 N/A SER 252.A OG ASP 247.A OD2 no hydrogen 2.645 N/A THR 256.A OG1 PRO 253.A O no hydrogen 3.280 N/A ASN 258.A N PRO 253.A O no hydrogen 2.753 N/A TRP 259.A NE1 PHE 254.A O no hydrogen 2.990 N/A ALA 261.A N ASN 258.A O no hydrogen 3.238 N/A TYR 262.A N TRP 259.A O no hydrogen 2.923 N/A SER 263.A N ALA 260.A O no hydrogen 3.469 N/A PHE 265.A N TYR 262.A O no hydrogen 3.139 N/A PHE 265.A N ASP 264.A OD1 no hydrogen 2.904 N/A LEU 266.A N TYR 262.A O no hydrogen 2.969 N/A THR 267.A OG1 SER 282.A OG no hydrogen 2.500 N/A THR 267.A OG1 ASP 283.A OD1 no hydrogen 2.348 N/A ASN 269.A N ASP 283.A OD1 no hydrogen 3.008 N/A GLY 270.A N ASP 283.A OD2 no hydrogen 2.654 N/A ASN 273.A N GLY 278.A O no hydrogen 2.663 N/A THR 276.A N ASN 273.A O no hydrogen 3.166 N/A GLY 277.A N ASN 273.A O no hydrogen 2.647 N/A GLY 278.A N THR 276.A OG1 no hydrogen 3.279 N/A LEU 279.A N PRO 365.A O no hydrogen 2.845 N/A SER 282.A OG THR 267.A OG1 no hydrogen 2.500 N/A THR 284.A N TRP 280.A O no hydrogen 3.004 N/A THR 284.A OG1 LEU 281.A O no hydrogen 2.683 N/A ALA 285.A N LEU 281.A O no hydrogen 2.963 N/A HIS 286.A N SER 282.A O no hydrogen 2.998 N/A HIS 287.A N ASP 283.A O no hydrogen 2.798 N/A HIS 288.A N THR 284.A O no hydrogen 2.831 N/A HIS 288.A ND1 THR 284.A O no hydrogen 2.957 N/A LEU 289.A N ALA 285.A O no hydrogen 2.999 N/A ALA 290.A N HIS 286.A O no hydrogen 2.916 N/A ILE 291.A N HIS 287.A O no hydrogen 2.708 N/A ALA 292.A N HIS 288.A O no hydrogen 3.048 N/A VAL 293.A N LEU 289.A O no hydrogen 2.882 N/A LEU 294.A N ALA 290.A O no hydrogen 3.173 N/A PHE 295.A N ILE 291.A O no hydrogen 2.923 N/A ILE 296.A N ALA 292.A O no hydrogen 2.895 N/A ILE 297.A N VAL 293.A O no hydrogen 2.778 N/A ALA 298.A N LEU 294.A O no hydrogen 2.799 N/A GLY 299.A N PHE 295.A O no hydrogen 2.841 N/A HIS 300.A N ILE 297.A O no hydrogen 3.127 N/A HIS 300.A ND1 ILE 296.A O no hydrogen 3.036 N/A MET 301.A N ASN 188.A OD1 no hydrogen 3.388 N/A TYR 302.A N ASN 188.A OD1 no hydrogen 3.355 N/A ARG 303.A N HIS 310.A O no hydrogen 3.116 N/A ARG 303.A NE GLY 309.A O no hydrogen 3.030 N/A ARG 303.A NH2 GLY 309.A O no hydrogen 3.042 N/A ILE 308.A N TRP 306.A O no hydrogen 2.484 N/A HIS 310.A N MET 301.A O no hydrogen 2.694 N/A LEU 312.A N GLU 184.A OE2 no hydrogen 3.493 N/A LYS 313.A NZ GLU 317.A OE2 no hydrogen 2.418 N/A GLU 314.A N SER 311.A O no hydrogen 3.056 N/A ILE 315.A N SER 311.A O no hydrogen 3.056 N/A LEU 316.A N LEU 312.A O no hydrogen 2.986 N/A GLU 317.A N LYS 313.A O no hydrogen 3.097 N/A ALA 318.A N GLU 314.A O no hydrogen 3.174 N/A HIS 319.A ND1 ILE 315.A O no hydrogen 2.693 N/A ALA 326.A N ASN 414.A O no hydrogen 3.227 N/A GLY 327.A N THR 324.A O no hydrogen 2.640 N/A HIS 328.A N HIS 319.A O no hydrogen 3.453 N/A HIS 328.A ND1 HIS 319.A O no hydrogen 3.175 N/A LYS 329.A N ALA 326.A O no hydrogen 3.407 N/A LEU 331.A N HIS 328.A O no hydrogen 3.477 N/A TYR 332.A OH GLU 184.A OE1 no hydrogen 3.197 N/A GLU 333.A N GLU 333.A OE1 no hydrogen 2.628 N/A VAL 334.A N GLY 330.A O no hydrogen 3.135 N/A LEU 335.A N LEU 331.A O no hydrogen 2.931 N/A THR 336.A OG1 TYR 332.A O no hydrogen 2.634 N/A THR 337.A N GLU 333.A O no hydrogen 3.155 N/A THR 337.A N VAL 334.A O no hydrogen 3.405 N/A THR 337.A OG1 GLU 333.A O no hydrogen 2.421 N/A THR 337.A OG1 VAL 334.A O no hydrogen 3.503 N/A SER 338.A N VAL 334.A O no hydrogen 3.132 N/A SER 338.A OG ASP 406.A OD2 no hydrogen 2.680 N/A TRP 339.A NE1 SER 59.A OG no hydrogen 2.979 N/A ALA 341.A N SER 338.A OG no hydrogen 2.959 N/A GLN 342.A NE2 LEU 335.A O no hydrogen 2.948 N/A LEU 343.A N TRP 339.A O no hydrogen 2.880 N/A ALA 344.A N HIS 340.A O no hydrogen 2.742 N/A ILE 345.A N ALA 341.A O no hydrogen 3.179 N/A ASN 346.A N GLN 342.A O no hydrogen 2.991 N/A LEU 347.A N LEU 343.A O no hydrogen 2.926 N/A ALA 348.A N ALA 344.A O no hydrogen 3.236 N/A MET 349.A N ILE 345.A O no hydrogen 2.872 N/A MET 350.A N ASN 346.A O no hydrogen 2.758 N/A GLY 351.A N LEU 347.A O no hydrogen 2.829 N/A SER 352.A N ALA 348.A O no hydrogen 2.997 N/A SER 352.A OG ALA 348.A O no hydrogen 2.268 N/A LEU 353.A N MET 349.A O no hydrogen 2.844 N/A SER 354.A N MET 350.A O no hydrogen 2.896 N/A SER 354.A OG HIS 384.A O no hydrogen 2.725 N/A ILE 355.A N GLY 351.A O no hydrogen 3.120 N/A ILE 356.A N SER 352.A O no hydrogen 3.051 N/A VAL 357.A N LEU 353.A O no hydrogen 2.810 N/A ALA 358.A N SER 354.A O no hydrogen 3.013 N/A GLN 359.A N ILE 355.A O no hydrogen 2.841 N/A HIS 360.A N ILE 356.A O no hydrogen 2.810 N/A MET 361.A N VAL 357.A O no hydrogen 2.898 N/A MET 364.A N HIS 360.A O no hydrogen 3.112 N/A TYR 369.A N THR 276.A O no hydrogen 3.049 N/A ASP 373.A N LEU 370.A O no hydrogen 3.264 N/A TYR 374.A OH VAL 511.A O no hydrogen 3.128 N/A TYR 374.A OH GLY 610.A O no hydrogen 3.069 N/A THR 376.A N ASP 373.A OD1 no hydrogen 2.922 N/A THR 376.A OG1 ASP 373.A OD1 no hydrogen 2.801 N/A GLN 377.A N ASP 373.A O no hydrogen 2.820 N/A LEU 378.A N TYR 374.A O no hydrogen 2.974 N/A SER 379.A N PRO 375.A O no hydrogen 3.016 N/A SER 379.A OG THR 130.A O no hydrogen 3.049 N/A SER 379.A OG PRO 375.A O no hydrogen 2.224 N/A SER 379.A OG THR 376.A O no hydrogen 3.321 N/A LEU 380.A N THR 376.A O no hydrogen 2.910 N/A PHE 381.A N GLN 377.A O no hydrogen 3.481 N/A THR 382.A N LEU 378.A O no hydrogen 3.017 N/A THR 382.A OG1 LEU 378.A O no hydrogen 2.405 N/A HIS 383.A N SER 379.A O no hydrogen 2.903 N/A HIS 384.A N LEU 380.A O no hydrogen 3.301 N/A MET 385.A N PHE 381.A O no hydrogen 2.967 N/A TRP 386.A N THR 382.A O no hydrogen 3.131 N/A ILE 387.A N HIS 383.A O no hydrogen 3.009 N/A GLY 388.A N HIS 384.A O no hydrogen 2.897 N/A GLY 389.A N MET 385.A O no hydrogen 2.900 N/A PHE 390.A N TRP 386.A O no hydrogen 3.032 N/A LEU 391.A N ILE 387.A O no hydrogen 3.127 N/A VAL 392.A N GLY 388.A O no hydrogen 3.136 N/A VAL 393.A N GLY 389.A O no hydrogen 3.324 N/A GLY 394.A N PHE 390.A O no hydrogen 3.040 N/A GLY 395.A N LEU 391.A O no hydrogen 2.911 N/A ALA 396.A N VAL 392.A O no hydrogen 3.186 N/A ALA 397.A N VAL 393.A O no hydrogen 2.849 N/A HIS 398.A N GLY 394.A O no hydrogen 3.051 N/A GLY 399.A N GLY 395.A O no hydrogen 2.849 N/A ALA 400.A N ALA 396.A O no hydrogen 3.163 N/A ILE 401.A N ALA 397.A O no hydrogen 2.953 N/A PHE 402.A N HIS 398.A O no hydrogen 3.003 N/A MET 403.A N GLY 399.A O no hydrogen 3.205 N/A VAL 404.A N ALA 400.A O no hydrogen 3.147 N/A ARG 405.A N ILE 401.A O no hydrogen 2.957 N/A ARG 405.A NH1 ASP 47.A OD2 no hydrogen 3.208 N/A ASP 406.A N PHE 402.A O no hydrogen 2.971 N/A TYR 407.A N PHE 402.A O no hydrogen 2.829 N/A ASN 412.A ND2 ASP 408.A O no hydrogen 3.448 N/A GLN 413.A NE2 ALA 410.A O no hydrogen 3.092 N/A ASN 415.A ND2 LYS 329.A O no hydrogen 3.455 N/A ASN 415.A ND2 ASN 412.A OD1 no hydrogen 2.399 N/A VAL 416.A N GLY 327.A O no hydrogen 2.924 N/A ASP 418.A N ASN 415.A OD1 no hydrogen 3.187 N/A ARG 419.A N VAL 416.A O no hydrogen 3.343 N/A ARG 419.A NH1 ASN 414.A O no hydrogen 3.394 N/A VAL 420.A N VAL 416.A O no hydrogen 3.211 N/A LEU 421.A N LEU 417.A O no hydrogen 3.318 N/A ARG 422.A N ASP 418.A O no hydrogen 3.107 N/A ARG 422.A NE ASP 418.A OD2 no hydrogen 2.988 N/A ARG 422.A NH2 ASP 418.A OD2 no hydrogen 3.552 N/A HIS 423.A N ARG 419.A O no hydrogen 3.273 N/A HIS 423.A ND1 ARG 419.A O no hydrogen 2.413 N/A ARG 424.A NH1 LEU 545.A O no hydrogen 2.790 N/A ILE 427.A N HIS 423.A O no hydrogen 3.002 N/A ILE 428.A N ARG 424.A O no hydrogen 2.940 N/A SER 429.A N ASP 425.A O no hydrogen 2.982 N/A SER 429.A OG ASP 425.A O no hydrogen 2.611 N/A SER 429.A OG ALA 426.A O no hydrogen 3.475 N/A HIS 430.A N ALA 426.A O no hydrogen 3.204 N/A HIS 430.A ND1 ALA 426.A O no hydrogen 3.017 N/A LEU 431.A N ILE 427.A O no hydrogen 3.002 N/A ASN 432.A N ILE 428.A O no hydrogen 2.581 N/A TRP 433.A N SER 429.A O no hydrogen 3.093 N/A VAL 434.A N HIS 430.A O no hydrogen 3.179 N/A CYS 435.A N LEU 431.A O no hydrogen 3.071 N/A CYS 435.A SG LEU 431.A O no hydrogen 3.179 N/A ILE 436.A N ASN 432.A O no hydrogen 3.111 N/A PHE 437.A N TRP 433.A O no hydrogen 2.839 N/A LEU 438.A N VAL 434.A O no hydrogen 2.723 N/A GLY 439.A N CYS 435.A O no hydrogen 2.804 N/A PHE 440.A N ILE 436.A O no hydrogen 3.051 N/A HIS 441.A N PHE 437.A O no hydrogen 2.979 N/A HIS 441.A ND1 PHE 437.A O no hydrogen 3.004 N/A SER 442.A OG LEU 438.A O no hydrogen 2.272 N/A PHE 443.A N GLY 439.A O no hydrogen 2.919 N/A TYR 446.A N PHE 443.A O no hydrogen 2.757 N/A TYR 446.A OH ALA 630.A O no hydrogen 3.344 N/A VAL 447.A N PHE 443.A O no hydrogen 3.156 N/A HIS 448.A N GLY 444.A O no hydrogen 2.884 N/A HIS 448.A NE2 ASP 460.A O no hydrogen 2.943 N/A ASN 449.A N LEU 445.A O no hydrogen 3.091 N/A ASN 449.A ND2 LEU 445.A O no hydrogen 2.270 N/A ASP 450.A N TYR 446.A O no hydrogen 2.886 N/A THR 451.A N VAL 447.A O no hydrogen 3.113 N/A THR 451.A OG1 VAL 447.A O no hydrogen 2.581 N/A MET 452.A N HIS 448.A O no hydrogen 2.965 N/A ARG 453.A N ASN 449.A O no hydrogen 3.035 N/A ARG 453.A NH2 GLN 628.A O no hydrogen 2.490 N/A ALA 454.A N ASP 450.A O no hydrogen 2.960 N/A PHE 455.A N THR 451.A O no hydrogen 2.925 N/A GLY 456.A N ARG 453.A O no hydrogen 3.390 N/A ARG 457.A N MET 452.A O no hydrogen 2.919 N/A ARG 457.A NE ASP 460.A OD2 no hydrogen 2.754 N/A ARG 457.A NH2 ASP 460.A OD2 no hydrogen 2.728 N/A GLN 459.A NE2 ASP 460.A OD1 no hydrogen 2.896 N/A ASP 460.A N ARG 457.A O no hydrogen 3.244 N/A MET 461.A N PRO 458.A O no hydrogen 3.296 N/A SER 463.A N MET 461.A O no hydrogen 2.840 N/A ILE 467.A N MET 461.A O no hydrogen 2.909 N/A GLN 470.A NE2 GLN 468.A OE1 no hydrogen 2.772 N/A ALA 474.A N PRO 471.A O no hydrogen 3.265 N/A GLN 475.A N PRO 471.A O no hydrogen 2.986 N/A GLN 475.A NE2 GLN 470.A OE1 no hydrogen 3.366 N/A GLN 475.A NE2 LEU 518.A O no hydrogen 3.514 N/A TRP 476.A N VAL 472.A O no hydrogen 2.963 N/A GLN 478.A N ALA 474.A O no hydrogen 3.089 N/A ASN 479.A N GLN 475.A O no hydrogen 3.177 N/A ASN 479.A N TRP 476.A O no hydrogen 2.908 N/A LEU 480.A N TRP 476.A O no hydrogen 2.938 N/A HIS 481.A N VAL 477.A O no hydrogen 2.946 N/A THR 482.A N ASN 479.A O no hydrogen 3.236 N/A LEU 483.A N ASN 479.A O no hydrogen 2.993 N/A LEU 483.A N LEU 480.A O no hydrogen 3.303 N/A GLY 487.A N ALA 484.A O no hydrogen 3.029 N/A ALA 489.A N ALA 484.A O no hydrogen 2.974 N/A ALA 494.A N ASN 269.A O no hydrogen 3.047 N/A THR 495.A OG1 HIS 481.A O no hydrogen 2.727 N/A SER 497.A OG ALA 363.A O no hydrogen 2.385 N/A ALA 499.A N SER 497.A OG no hydrogen 3.163 N/A PHE 500.A N SER 497.A O no hydrogen 3.429 N/A GLY 501.A N VAL 498.A O no hydrogen 2.914 N/A VAL 504.A N ASP 503.A OD1 no hydrogen 2.582 N/A VAL 505.A N MET 513.A O no hydrogen 3.025 N/A VAL 507.A N LYS 510.A O no hydrogen 3.120 N/A LYS 510.A NZ GLY 742.A O no hydrogen 2.926 N/A VAL 511.A N TYR 374.A OH no hydrogen 2.899 N/A VAL 511.A N GLY 610.A O no hydrogen 3.153 N/A ALA 512.A N VAL 505.A O no hydrogen 2.700 N/A ILE 516.A N ALA 499.A O no hydrogen 3.447 N/A THR 520.A N ASP 464.A OD1 no hydrogen 3.230 N/A THR 520.A OG1 ASP 464.A OD1 no hydrogen 2.274 N/A PHE 523.A N GLY 519.A O no hydrogen 2.841 N/A MET 524.A N THR 520.A O no hydrogen 2.969 N/A VAL 525.A N ALA 521.A O no hydrogen 2.989 N/A HIS 526.A N ASP 522.A O no hydrogen 3.212 N/A HIS 526.A ND1 ASP 522.A O no hydrogen 2.908 N/A HIS 527.A N PHE 523.A O no hydrogen 3.254 N/A HIS 527.A ND1 PHE 523.A O no hydrogen 2.956 N/A ILE 528.A N MET 524.A O no hydrogen 2.941 N/A HIS 529.A N VAL 525.A O no hydrogen 2.877 N/A ALA 530.A N HIS 526.A O no hydrogen 2.976 N/A PHE 531.A N HIS 527.A O no hydrogen 3.074 N/A THR 532.A N ILE 528.A O no hydrogen 2.864 N/A THR 532.A OG1 ILE 528.A O no hydrogen 2.790 N/A THR 532.A OG1 HIS 529.A O no hydrogen 2.988 N/A ILE 533.A N HIS 529.A O no hydrogen 2.973 N/A HIS 534.A N ALA 530.A O no hydrogen 3.077 N/A HIS 534.A ND1 ALA 530.A O no hydrogen 2.846 N/A VAL 535.A N PHE 531.A O no hydrogen 3.035 N/A THR 536.A N THR 532.A O no hydrogen 3.124 N/A THR 536.A OG1 THR 532.A O no hydrogen 2.252 N/A VAL 537.A N ILE 533.A O no hydrogen 2.773 N/A LEU 538.A N HIS 534.A O no hydrogen 2.887 N/A ILE 539.A N VAL 535.A O no hydrogen 3.003 N/A LEU 540.A N THR 536.A O no hydrogen 3.259 N/A LEU 541.A N VAL 537.A O no hydrogen 2.677 N/A LYS 542.A N LEU 538.A O no hydrogen 3.006 N/A LYS 542.A NZ HIS 581.A NE2 no hydrogen 2.990 N/A GLY 543.A N ILE 539.A O no hydrogen 3.034 N/A VAL 544.A N LEU 540.A O no hydrogen 3.065 N/A LEU 545.A N LEU 541.A O no hydrogen 2.811 N/A PHE 546.A N LYS 542.A O no hydrogen 2.934 N/A ALA 547.A N VAL 544.A O no hydrogen 3.438 N/A ARG 548.A NH1 MET 403.A O no hydrogen 2.383 N/A ARG 548.A NH1 VAL 404.A O no hydrogen 3.324 N/A SER 549.A OG ARG 548.A O no hydrogen 2.703 N/A SER 549.A OG PRO 554.A O no hydrogen 3.553 N/A SER 550.A N ILE 553.A O no hydrogen 2.781 N/A SER 550.A OG SER 549.A O no hydrogen 2.900 N/A LYS 556.A NZ PHE 546.A O no hydrogen 2.922 N/A LYS 556.A NZ VAL 576.A O no hydrogen 2.711 N/A ALA 557.A N ARG 548.A O no hydrogen 2.978 N/A ASN 558.A N ASP 555.A O no hydrogen 3.249 N/A GLY 560.A N LYS 556.A O no hydrogen 3.485 N/A ASP 566.A N THR 573.A OG1 no hydrogen 2.717 N/A ARG 570.A NH2 ASP 566.A OD2 no hydrogen 3.243 N/A GLY 572.A N GLY 569.A O no hydrogen 2.657 N/A THR 573.A N GLY 567.A O no hydrogen 3.242 N/A THR 573.A OG1 GLY 567.A O no hydrogen 3.401 N/A GLN 575.A N PRO 564.A O no hydrogen 3.052 N/A SER 577.A OG PHE 563.A O no hydrogen 2.673 N/A SER 577.A OG ASP 580.A OD2 no hydrogen 2.278 N/A TRP 579.A N PHE 561.A O no hydrogen 3.025 N/A ASP 580.A N SER 577.A O no hydrogen 3.000 N/A HIS 581.A N SER 577.A O no hydrogen 3.283 N/A HIS 581.A ND1 SER 577.A O no hydrogen 3.008 N/A VAL 582.A N GLY 578.A O no hydrogen 3.108 N/A PHE 583.A N TRP 579.A O no hydrogen 2.883 N/A LEU 584.A N ASP 580.A O no hydrogen 2.874 N/A GLY 585.A N HIS 581.A O no hydrogen 2.860 N/A LEU 586.A N VAL 582.A O no hydrogen 2.910 N/A PHE 587.A N LEU 584.A O no hydrogen 3.224 N/A TRP 588.A N LEU 584.A O no hydrogen 3.329 N/A MET 589.A N GLY 585.A O no hydrogen 2.694 N/A TYR 590.A N LEU 586.A O no hydrogen 2.848 N/A ASN 591.A N PHE 587.A O no hydrogen 2.903 N/A CYS 592.A N TRP 588.A O no hydrogen 2.845 N/A ILE 593.A N MET 589.A O no hydrogen 2.926 N/A SER 594.A N TYR 590.A O no hydrogen 3.040 N/A SER 594.A OG TYR 590.A O no hydrogen 2.237 N/A VAL 595.A N ASN 591.A O no hydrogen 3.372 N/A VAL 596.A N CYS 592.A O no hydrogen 3.162 N/A ILE 597.A N ILE 593.A O no hydrogen 2.920 N/A PHE 598.A N SER 594.A O no hydrogen 2.969 N/A HIS 599.A N VAL 595.A O no hydrogen 2.894 N/A PHE 600.A N VAL 596.A O no hydrogen 2.849 N/A SER 601.A N ILE 597.A O no hydrogen 2.836 N/A TRP 602.A N PHE 598.A O no hydrogen 3.017 N/A TRP 602.A NE1 ASN 625.A OD1 no hydrogen 2.894 N/A LYS 603.A N HIS 599.A O no hydrogen 2.821 N/A LYS 603.A NZ VAL 517.A O no hydrogen 3.019 N/A LYS 603.A NZ ASP 522.A OD1 no hydrogen 2.873 N/A LYS 603.A NZ ASP 607.A OD2 no hydrogen 2.479 N/A MET 604.A N PHE 600.A O no hydrogen 2.919 N/A GLN 605.A N SER 601.A O no hydrogen 3.141 N/A GLN 605.A NE2 SER 601.A O no hydrogen 2.905 N/A GLN 605.A NE2 GLN 644.A OE1 no hydrogen 3.449 N/A SER 606.A N TRP 602.A O no hydrogen 2.890 N/A SER 606.A OG TRP 602.A O no hydrogen 2.249 N/A SER 606.A OG LYS 603.A O no hydrogen 3.432 N/A ASP 607.A N LYS 603.A O no hydrogen 2.824 N/A VAL 608.A N MET 604.A O no hydrogen 3.077 N/A TRP 609.A N MET 604.A O no hydrogen 2.643 N/A THR 611.A N SER 619.A O no hydrogen 3.181 N/A THR 611.A OG1 SER 619.A O no hydrogen 3.540 N/A THR 611.A OG1 SER 619.A OG no hydrogen 2.872 N/A VAL 612.A N GLY 509.A O no hydrogen 2.381 N/A ALA 613.A N THR 617.A O no hydrogen 3.161 N/A GLY 616.A N ALA 613.A O no hydrogen 3.154 N/A THR 617.A N ASP 615.A OD1 no hydrogen 3.373 N/A THR 617.A OG1 ASP 615.A OD1 no hydrogen 3.146 N/A SER 619.A N THR 611.A O no hydrogen 2.986 N/A SER 619.A OG THR 611.A OG1 no hydrogen 2.872 N/A ILE 621.A N GLN 605.A O no hydrogen 3.062 N/A THR 622.A N GLN 605.A O no hydrogen 3.314 N/A THR 622.A OG1 ASN 625.A OD1 no hydrogen 2.480 N/A SER 629.A OG ASN 625.A O no hydrogen 3.267 N/A THR 632.A N SER 629.A O no hydrogen 3.490 N/A THR 632.A OG1 SER 629.A O no hydrogen 3.283 N/A GLY 635.A N THR 632.A O no hydrogen 3.124 N/A TRP 636.A N THR 632.A O no hydrogen 3.085 N/A TRP 636.A NE1 ALA 630.A O no hydrogen 3.009 N/A LEU 637.A N ILE 633.A O no hydrogen 2.945 N/A ARG 638.A N ASN 634.A O no hydrogen 2.924 N/A ASP 639.A N GLY 635.A O no hydrogen 2.962 N/A TRP 642.A N LEU 637.A O no hydrogen 2.953 N/A GLN 644.A N PHE 640.A O no hydrogen 3.305 N/A ALA 645.A N LEU 641.A O no hydrogen 3.324 N/A ILE 649.A N ALA 645.A O no hydrogen 3.115 N/A SER 651.A OG VAL 648.A O no hydrogen 2.995 N/A SER 651.A OG LEU 656.A O no hydrogen 3.462 N/A SER 654.A N SER 657.A OG no hydrogen 2.856 N/A SER 654.A OG GLY 653.A O no hydrogen 2.809 N/A SER 657.A N SER 654.A O no hydrogen 3.418 N/A SER 657.A OG SER 651.A O no hydrogen 2.947 N/A SER 657.A OG SER 654.A O no hydrogen 2.295 N/A GLY 660.A N LEU 656.A O no hydrogen 3.130 N/A LEU 661.A N SER 657.A O no hydrogen 2.970 N/A LEU 662.A N ALA 658.A O no hydrogen 2.920 N/A PHE 663.A N TYR 659.A O no hydrogen 2.845 N/A GLY 665.A N LEU 661.A O no hydrogen 2.901 N/A ALA 666.A N LEU 662.A O no hydrogen 2.879 N/A HIS 667.A N PHE 663.A O no hydrogen 3.042 N/A HIS 667.A ND1 PHE 663.A O no hydrogen 3.057 N/A PHE 668.A N LEU 664.A O no hydrogen 2.881 N/A ILE 669.A N GLY 665.A O no hydrogen 3.056 N/A TRP 670.A N ALA 666.A O no hydrogen 2.971 N/A ALA 671.A N HIS 667.A O no hydrogen 3.232 N/A PHE 672.A N PHE 668.A O no hydrogen 2.773 N/A SER 673.A N ILE 669.A O no hydrogen 2.878 N/A SER 673.A N TRP 670.A O no hydrogen 3.308 N/A SER 673.A OG TRP 670.A O no hydrogen 2.223 N/A LEU 674.A N ALA 671.A O no hydrogen 3.167 N/A MET 675.A N PHE 672.A O no hydrogen 3.411 N/A PHE 676.A N SER 673.A O no hydrogen 2.851 N/A LEU 677.A N SER 673.A O no hydrogen 3.036 N/A PHE 678.A N LEU 674.A O no hydrogen 3.000 N/A SER 679.A N MET 675.A O no hydrogen 3.394 N/A SER 679.A OG MET 675.A O no hydrogen 2.221 N/A ARG 681.A NE LEU 709.A O no hydrogen 2.686 N/A ARG 681.A NH2 GLN 685.A OE1 no hydrogen 3.290 N/A ARG 681.A NH2 ALA 708.A O no hydrogen 3.127 N/A GLN 685.A N ARG 681.A O no hydrogen 3.047 N/A GLU 686.A N GLY 682.A O no hydrogen 3.261 N/A LEU 687.A N TYR 683.A O no hydrogen 2.882 N/A ILE 688.A N TRP 684.A O no hydrogen 2.985 N/A GLU 689.A N GLN 685.A O no hydrogen 3.145 N/A SER 690.A OG LEU 687.A O no hydrogen 2.852 N/A VAL 692.A N ILE 688.A O no hydrogen 2.838 N/A TRP 693.A N GLU 689.A O no hydrogen 3.093 N/A ALA 694.A N SER 690.A O no hydrogen 3.057 N/A HIS 695.A N ILE 691.A O no hydrogen 2.939 N/A HIS 695.A ND1 ILE 691.A O no hydrogen 2.765 N/A ASN 696.A N VAL 692.A O no hydrogen 2.997 N/A LYS 697.A N TRP 693.A O no hydrogen 2.783 N/A LYS 699.A N ASN 696.A O no hydrogen 3.439 N/A VAL 700.A N HIS 695.A O no hydrogen 2.596 N/A GLN 705.A N GLN 33.A O no hydrogen 3.375 N/A ARG 707.A NH1 PRO 706.A O no hydrogen 3.243 N/A ALA 708.A N GLN 685.A OE1 no hydrogen 2.890 N/A GLY 714.A N SER 710.A O no hydrogen 2.749 N/A ARG 715.A N ILE 711.A O no hydrogen 3.176 N/A ARG 715.A NH1 PRO 564.A O no hydrogen 3.065 N/A ARG 715.A NH2 PRO 564.A O no hydrogen 3.416 N/A ALA 716.A N ILE 712.A O no hydrogen 2.821 N/A VAL 717.A N GLN 713.A O no hydrogen 2.737 N/A GLY 718.A N GLY 714.A O no hydrogen 3.038 N/A VAL 719.A N ARG 715.A O no hydrogen 2.990 N/A ALA 720.A N ALA 716.A O no hydrogen 3.001 N/A HIS 721.A N VAL 717.A O no hydrogen 3.004 N/A HIS 721.A ND1 VAL 717.A O no hydrogen 2.950 N/A TYR 722.A N GLY 718.A O no hydrogen 2.923 N/A LEU 723.A N VAL 719.A O no hydrogen 2.872 N/A LEU 724.A N ALA 720.A O no hydrogen 2.873 N/A GLY 725.A N HIS 721.A O no hydrogen 2.813 N/A GLY 726.A N TYR 722.A O no hydrogen 2.809 N/A ILE 727.A N LEU 723.A O no hydrogen 2.936 N/A ALA 728.A N LEU 724.A O no hydrogen 3.144 N/A THR 729.A N GLY 725.A O no hydrogen 3.110 N/A THR 729.A OG1 GLY 725.A O no hydrogen 2.244 N/A THR 730.A N GLY 726.A O no hydrogen 3.262 N/A THR 730.A OG1 GLY 726.A O no hydrogen 2.953 N/A TRP 731.A N ILE 727.A O no hydrogen 2.751 N/A ALA 732.A N ALA 728.A O no hydrogen 2.874 N/A PHE 733.A N THR 729.A O no hydrogen 2.936 N/A PHE 734.A N THR 730.A O no hydrogen 2.728 N/A LEU 735.A N TRP 731.A O no hydrogen 3.089 N/A ALA 736.A N ALA 732.A O no hydrogen 3.115 N/A ARG 737.A N PHE 733.A O no hydrogen 3.026 N/A ARG 737.A NE GLN 605.A OE1 no hydrogen 3.014 N/A ARG 737.A NH1 GLN 647.A OE1 no hydrogen 3.037 N/A ARG 737.A NH2 GLN 605.A OE1 no hydrogen 3.341 N/A ILE 738.A N PHE 734.A O no hydrogen 2.832 N/A ILE 739.A N LEU 735.A O no hydrogen 2.936 N/A SER 740.A OG ARG 737.A O no hydrogen 3.328 N/A VAL 741.A N ARG 737.A O no hydrogen 3.039 N/A GLY 742.A N ILE 738.A O no hydrogen 2.817 N/A