Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vuy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N THR 2.A O no hydrogen 2.969 N/A ARG 5.A NE GLU 53.A OE1 no hydrogen 2.401 N/A ARG 5.A NH1 PRO 6.A O no hydrogen 3.124 N/A ARG 5.A NH2 GLU 53.A OE2 no hydrogen 2.720 N/A ARG 8.A N PHE 68.A O no hydrogen 2.899 N/A GLY 16.A N SER 29.A O no hydrogen 2.804 N/A SER 17.A OG TYR 78.A OH no hydrogen 3.085 N/A ASN 18.A N ASN 27.A O no hydrogen 2.814 N/A ILE 20.A N GLY 25.A O no hydrogen 2.991 N/A ASP 23.A N ILE 20.A O no hydrogen 2.763 N/A ASP 24.A N GLU 21.A O no hydrogen 3.201 N/A VAL 26.A N VAL 69.A O no hydrogen 3.122 N/A ASN 27.A N ASN 18.A O no hydrogen 2.932 N/A PHE 28.A N VAL 67.A O no hydrogen 2.800 N/A SER 29.A N GLY 16.A O no hydrogen 2.905 N/A SER 29.A OG PRO 12.A O no hydrogen 2.540 N/A LEU 30.A N TRP 65.A O no hydrogen 2.880 N/A SER 32.A N ASP 63.A O no hydrogen 3.159 N/A SER 32.A OG ILE 302.A O no hydrogen 2.798 N/A GLU 33.A N ASP 303.A OD1 no hydrogen 2.823 N/A ASN 34.A N ASP 303.A OD1 no hydrogen 3.217 N/A ASN 34.A ND2 ASP 303.A OD2 no hydrogen 2.608 N/A ALA 35.A N SER 32.A OG no hydrogen 3.059 N/A GLU 36.A N TYR 83.A O no hydrogen 2.780 N/A LYS 37.A N TYR 83.A O no hydrogen 3.481 N/A GLU 39.A N ARG 81.A O no hydrogen 2.980 N/A LEU 40.A N ILE 55.A O no hydrogen 2.635 N/A LEU 41.A N ALA 79.A O no hydrogen 2.717 N/A LEU 42.A N GLU 53.A O no hydrogen 3.230 N/A TYR 43.A N LEU 77.A O no hydrogen 2.976 N/A SER 44.A N ASN 47.A O no hydrogen 3.434 N/A SER 44.A OG ASN 47.A O no hydrogen 3.556 N/A GLN 48.A NE2 LEU 45.A O no hydrogen 2.870 N/A LYS 49.A N ASN 47.A OD1 no hydrogen 2.948 N/A TYR 50.A N ASN 47.A OD1 no hydrogen 3.364 N/A LYS 52.A N LEU 42.A O no hydrogen 2.819 N/A ILE 55.A N LEU 40.A O no hydrogen 2.983 N/A VAL 57.A N VAL 38.A O no hydrogen 2.964 N/A LYS 58.A NZ THR 2.A OG1 no hydrogen 2.428 N/A THR 61.A N ILE 64.A O no hydrogen 2.802 N/A THR 61.A OG1 HIS 66.A NE2 no hydrogen 2.755 N/A ILE 64.A N THR 61.A O no hydrogen 3.378 N/A TRP 65.A N LEU 30.A O no hydrogen 2.817 N/A TRP 65.A NE1 SER 32.A O no hydrogen 2.883 N/A HIS 66.A N ASN 59.A O no hydrogen 2.977 N/A HIS 66.A ND1 PRO 9.A O no hydrogen 2.603 N/A HIS 66.A NE2 THR 61.A OG1 no hydrogen 2.755 N/A VAL 67.A N PHE 28.A O no hydrogen 2.988 N/A PHE 68.A N ARG 8.A O no hydrogen 2.737 N/A VAL 69.A N VAL 26.A O no hydrogen 2.919 N/A GLY 71.A N ASP 24.A O no hydrogen 2.746 N/A GLY 75.A N VAL 146.A O no hydrogen 2.627 N/A GLN 76.A N ARG 73.A O no hydrogen 3.315 N/A TYR 78.A N SER 144.A O no hydrogen 2.787 N/A TYR 78.A OH SER 17.A OG no hydrogen 3.085 N/A TYR 78.A OH ASP 102.A OD2 no hydrogen 2.691 N/A ALA 79.A N LEU 41.A O no hydrogen 2.944 N/A TYR 80.A N LEU 100.A O no hydrogen 3.136 N/A ARG 81.A N GLU 39.A O no hydrogen 3.030 N/A ARG 81.A NE PRO 96.A O no hydrogen 2.647 N/A ARG 81.A NH2 ASN 97.A O no hydrogen 3.366 N/A ARG 81.A NH2 ASP 136.A OD2 no hydrogen 3.153 N/A TYR 83.A N LYS 37.A O no hydrogen 2.870 N/A TYR 83.A OH GLU 39.A OE1 no hydrogen 2.695 N/A TYR 86.A OH ASP 129.A O no hydrogen 3.062 N/A TYR 86.A OH THR 131.A O no hydrogen 2.581 N/A LYS 87.A N LEU 92.A O no hydrogen 2.658 N/A LEU 90.A N LYS 87.A O no hydrogen 2.551 N/A GLY 91.A N PRO 88.A O no hydrogen 3.082 N/A ARG 93.A NH1 ASP 129.A O no hydrogen 3.226 N/A ARG 93.A NH2 ASP 129.A OD2 no hydrogen 3.140 N/A ARG 93.A NH2 ARG 316.A O no hydrogen 2.861 N/A PHE 94.A N PRO 85.A O no hydrogen 3.400 N/A ASN 95.A ND2 GLY 120.A O no hydrogen 3.130 N/A ASN 95.A ND2 ASP 133.A O no hydrogen 3.078 N/A ASN 97.A N ASN 95.A OD1 no hydrogen 3.097 N/A LYS 98.A N ASN 95.A O no hydrogen 2.816 N/A LYS 98.A NZ ALA 117.A O no hydrogen 2.874 N/A LYS 98.A NZ ASP 133.A O no hydrogen 3.464 N/A LYS 98.A NZ ASP 133.A OD1 no hydrogen 3.003 N/A LYS 98.A NZ ARG 135.A O no hydrogen 2.695 N/A VAL 99.A N SER 137.A OG no hydrogen 2.744 N/A LEU 100.A N TYR 80.A O no hydrogen 2.750 N/A ILE 101.A N LEU 297.A O no hydrogen 3.107 N/A ASP 102.A N SER 144.A OG no hydrogen 3.120 N/A TYR 104.A N ASP 102.A OD1 no hydrogen 2.784 N/A TYR 104.A OH ASP 341.A OD1 no hydrogen 2.544 N/A ALA 105.A N ASP 102.A O no hydrogen 2.857 N/A ASN 109.A N LYS 143.A O no hydrogen 2.819 N/A VAL 112.A N SER 111.A OG no hydrogen 2.636 N/A ILE 113.A N TYR 140.A O no hydrogen 2.826 N/A TRP 114.A NE1 ASP 224.A O no hydrogen 2.804 N/A ALA 117.A N ASN 115.A OD1 no hydrogen 2.858 N/A VAL 118.A N ASN 115.A O no hydrogen 3.031 N/A TYR 121.A OH LEU 293.A O no hydrogen 2.523 N/A LYS 122.A N THR 131.A OG1 no hydrogen 2.895 N/A ASN 127.A N ASP 125.A OD1 no hydrogen 3.273 N/A GLN 128.A N ASP 125.A O no hydrogen 3.378 N/A LEU 130.A N ASN 127.A O no hydrogen 3.044 N/A THR 131.A N GLN 128.A O no hydrogen 2.700 N/A THR 131.A OG1 GLN 128.A O no hydrogen 2.878 N/A ASP 133.A N GLY 120.A O no hydrogen 3.224 N/A ARG 135.A N ASP 133.A OD1 no hydrogen 2.744 N/A ARG 135.A NE ASP 133.A OD1 no hydrogen 3.309 N/A ARG 135.A NE ASP 133.A OD2 no hydrogen 2.802 N/A ARG 135.A NH2 ASP 133.A OD2 no hydrogen 2.690 N/A SER 137.A N ASN 97.A O no hydrogen 3.435 N/A GLY 138.A N ASP 136.A OD1 no hydrogen 2.615 N/A TYR 140.A N SER 137.A O no hydrogen 2.931 N/A VAL 141.A N GLY 138.A O no hydrogen 3.438 N/A LYS 143.A NZ GLN 48.A O no hydrogen 2.807 N/A LYS 143.A NZ GLY 138.A O no hydrogen 2.508 N/A LYS 143.A NZ VAL 141.A O no hydrogen 2.876 N/A SER 144.A N TYR 78.A O no hydrogen 2.829 N/A VAL 145.A N ALA 107.A O no hydrogen 2.735 N/A VAL 146.A N GLN 76.A O no hydrogen 3.038 N/A ASP 157.A N ASP 155.A O no hydrogen 2.371 N/A GLY 161.A N PHE 158.A O no hydrogen 2.825 N/A LYS 167.A NZ ASP 168.A OD1 no hydrogen 2.794 N/A LYS 167.A NZ ASP 168.A OD2 no hydrogen 3.060 N/A THR 169.A OG1 PRO 165.A O no hydrogen 2.769 N/A THR 169.A OG1 LEU 166.A O no hydrogen 2.847 N/A VAL 170.A N THR 212.A OG1 no hydrogen 2.802 N/A ILE 171.A N PRO 533.A O no hydrogen 3.126 N/A TYR 172.A N THR 213.A O no hydrogen 2.962 N/A TYR 172.A OH GLU 540.A OE1 no hydrogen 2.921 N/A GLU 173.A N ILE 535.A O no hydrogen 2.931 N/A VAL 174.A N GLU 215.A O no hydrogen 3.139 N/A HIS 175.A NE2 TYR 236.A O no hydrogen 2.617 N/A LYS 177.A N HIS 175.A ND1 no hydrogen 3.040 N/A LYS 177.A NZ ASP 555.A OD2 no hydrogen 3.085 N/A PHE 179.A N HIS 175.A O no hydrogen 2.912 N/A THR 180.A N LYS 177.A O no hydrogen 3.156 N/A LYS 181.A N LYS 177.A O no hydrogen 3.061 N/A ARG 183.A N THR 180.A O no hydrogen 3.128 N/A ARG 183.A NH2 ASP 185.A OD2 no hydrogen 3.362 N/A LEU 186.A N ARG 183.A O no hydrogen 3.106 N/A ILE 190.A N PRO 187.A O no hydrogen 3.383 N/A ARG 191.A NE LEU 186.A O no hydrogen 2.891 N/A ARG 191.A NH2 LEU 186.A O no hydrogen 2.902 N/A GLY 192.A N THR 180.A OG1 no hydrogen 2.750 N/A THR 193.A OG1 ILE 190.A O no hydrogen 2.633 N/A TYR 194.A N TYR 251.A O no hydrogen 2.894 N/A TYR 194.A OH GLU 248.A O no hydrogen 3.028 N/A GLY 196.A N THR 193.A OG1 no hydrogen 3.218 N/A LEU 197.A N THR 193.A O no hydrogen 3.059 N/A ALA 198.A N TYR 194.A O no hydrogen 3.294 N/A SER 199.A N GLY 196.A O no hydrogen 2.933 N/A SER 199.A OG GLY 196.A O no hydrogen 2.881 N/A MET 202.A N SER 199.A OG no hydrogen 3.287 N/A ILE 203.A N SER 199.A O no hydrogen 2.930 N/A SER 204.A N GLU 200.A O no hydrogen 3.017 N/A SER 204.A OG GLU 200.A O no hydrogen 2.984 N/A TYR 205.A N GLN 201.A O no hydrogen 3.179 N/A TYR 205.A OH GLU 540.A OE1 no hydrogen 2.440 N/A LEU 206.A N MET 202.A O no hydrogen 2.958 N/A LYS 207.A N ILE 203.A O no hydrogen 2.893 N/A LYS 207.A NZ ALA 274.A O no hydrogen 2.609 N/A ASP 208.A N SER 204.A O no hydrogen 2.853 N/A LEU 209.A N TYR 205.A O no hydrogen 2.912 N/A GLY 210.A N LEU 206.A O no hydrogen 3.009 N/A GLY 210.A N LYS 207.A O no hydrogen 3.070 N/A THR 212.A OG1 VAL 170.A O no hydrogen 3.228 N/A THR 213.A N VAL 170.A O no hydrogen 3.349 N/A VAL 214.A N GLU 277.A O no hydrogen 3.058 N/A GLU 215.A N TYR 172.A O no hydrogen 2.723 N/A LEU 216.A N ILE 279.A O no hydrogen 2.956 N/A MET 217.A N VAL 174.A O no hydrogen 3.070 N/A HIS 221.A N SER 246.A O no hydrogen 2.852 N/A PHE 222.A N GLU 248.A OE2 no hydrogen 3.108 N/A ILE 223.A N ASP 240.A O no hydrogen 3.309 N/A GLN 225.A N GLN 225.A OE1 no hydrogen 2.616 N/A ARG 226.A NH1 ASP 116.A OD1 no hydrogen 2.960 N/A ARG 226.A NH2 ASP 116.A OD1 no hydrogen 2.862 N/A LEU 228.A N GLN 225.A O no hydrogen 2.925 N/A THR 229.A N GLN 225.A O no hydrogen 3.194 N/A ASP 230.A N ARG 226.A O no hydrogen 2.740 N/A LYS 231.A N LEU 228.A O no hydrogen 3.071 N/A GLY 232.A N THR 229.A O no hydrogen 3.151 N/A LEU 233.A N LEU 228.A O no hydrogen 2.734 N/A THR 234.A OG1 ASP 224.A OD1 no hydrogen 2.943 N/A ASN 235.A N ASP 224.A OD1 no hydrogen 2.800 N/A ASN 235.A ND2 GLN 225.A OE1 no hydrogen 2.683 N/A TYR 236.A N PHE 552.A O no hydrogen 2.843 N/A TRP 237.A N PHE 552.A O no hydrogen 3.300 N/A GLY 238.A N ASN 235.A OD1 no hydrogen 2.699 N/A TYR 239.A OH ASP 281.A OD2 no hydrogen 3.050 N/A ASP 240.A N GLY 238.A O no hydrogen 2.877 N/A ILE 242.A N HIS 221.A O no hydrogen 3.288 N/A ASN 243.A ND2 ALA 105.A O no hydrogen 3.430 N/A PHE 245.A N ASN 243.A OD1 no hydrogen 2.582 N/A SER 246.A N ASN 243.A OD1 no hydrogen 2.907 N/A SER 246.A OG ALA 105.A O no hydrogen 2.708 N/A SER 246.A OG ASN 243.A OD1 no hydrogen 3.186 N/A GLU 248.A N VAL 219.A O no hydrogen 2.725 N/A ARG 250.A N GLU 248.A OE1 no hydrogen 2.872 N/A ARG 250.A NE GLU 248.A OE1 no hydrogen 2.876 N/A ARG 250.A NH1 ASP 224.A OD1 no hydrogen 3.152 N/A ARG 250.A NH2 ASP 224.A OD1 no hydrogen 3.445 N/A ARG 250.A NH2 ASP 224.A OD2 no hydrogen 3.412 N/A TYR 251.A N GLU 248.A O no hydrogen 3.442 N/A SER 252.A N CYS 249.A O no hydrogen 3.326 N/A SER 252.A OG GLY 255.A O no hydrogen 2.687 N/A SER 253.A OG GLU 195.A OE2 no hydrogen 2.698 N/A THR 254.A N SER 252.A OG no hydrogen 3.218 N/A THR 254.A OG1 SER 263.A OG no hydrogen 2.913 N/A CYS 256.A SG CYS 249.A O no hydrogen 3.124 N/A GLY 258.A N GLN 260.A OE1 no hydrogen 2.724 N/A GLN 260.A N GLN 260.A OE1 no hydrogen 2.694 N/A GLN 260.A NE2 CYS 256.A O no hydrogen 2.990 N/A LEU 262.A N GLY 258.A O no hydrogen 3.140 N/A SER 263.A N GLY 259.A O no hydrogen 2.827 N/A SER 263.A OG THR 254.A OG1 no hydrogen 2.913 N/A SER 263.A OG GLY 259.A O no hydrogen 3.049 N/A PHE 264.A N GLN 260.A O no hydrogen 3.069 N/A LYS 265.A N VAL 261.A O no hydrogen 3.192 N/A LYS 266.A N LEU 262.A O no hydrogen 3.169 N/A MET 267.A N SER 263.A O no hydrogen 3.036 N/A VAL 268.A N PHE 264.A O no hydrogen 3.028 N/A ASN 269.A N LYS 265.A O no hydrogen 2.812 N/A ASN 269.A ND2 ASP 154.A O no hydrogen 3.346 N/A GLU 270.A N LYS 266.A O no hydrogen 2.711 N/A LEU 271.A N MET 267.A O no hydrogen 3.023 N/A HIS 272.A N VAL 268.A O no hydrogen 2.987 N/A HIS 272.A ND1 GLU 156.A OE1 no hydrogen 2.101 N/A HIS 272.A NE2 ASP 353.A OD2 no hydrogen 2.702 N/A ASN 273.A N ASN 269.A O no hydrogen 3.188 N/A ASN 273.A N GLU 270.A O no hydrogen 3.155 N/A ALA 274.A N LEU 271.A O no hydrogen 2.998 N/A GLY 275.A N HIS 272.A O no hydrogen 3.042 N/A ILE 276.A N LEU 271.A O no hydrogen 2.973 N/A GLU 277.A N THR 212.A O no hydrogen 3.125 N/A VAL 278.A N ASP 353.A OD2 no hydrogen 2.814 N/A ILE 279.A N VAL 214.A O no hydrogen 2.880 N/A ILE 280.A N GLY 354.A O no hydrogen 3.076 N/A ASP 281.A N LEU 216.A O no hydrogen 2.906 N/A VAL 282.A N ARG 356.A O no hydrogen 2.917 N/A TYR 284.A OH SER 342.A OG no hydrogen 2.645 N/A ASN 285.A ND2 ASP 358.A OD1 no hydrogen 3.558 N/A ASN 285.A ND2 LEU 359.A O no hydrogen 3.564 N/A THR 287.A N ASN 326.A OD1 no hydrogen 2.980 N/A ALA 288.A N PRO 241.A O no hydrogen 2.689 N/A GLY 290.A N THR 287.A O no hydrogen 3.302 N/A GLY 294.A N ASN 291.A O no hydrogen 3.156 N/A THR 296.A N VAL 118.A O no hydrogen 3.064 N/A THR 296.A OG1 PHE 119.A O no hydrogen 3.338 N/A LEU 297.A N GLU 289.A OE2 no hydrogen 2.736 N/A SER 298.A N GLU 289.A OE2 no hydrogen 2.741 N/A SER 298.A OG ILE 101.A O no hydrogen 2.895 N/A ARG 300.A N GLU 289.A OE1 no hydrogen 2.835 N/A ARG 300.A NE PRO 295.A O no hydrogen 3.294 N/A ARG 300.A NH1 GLY 290.A O no hydrogen 3.252 N/A ARG 300.A NH1 ASN 291.A O no hydrogen 2.989 N/A ARG 300.A NH1 TYR 318.A OH no hydrogen 2.914 N/A ARG 300.A NH2 GLU 289.A O no hydrogen 2.413 N/A ARG 300.A NH2 GLY 290.A O no hydrogen 3.508 N/A ARG 300.A NH2 PRO 295.A O no hydrogen 2.730 N/A ILE 302.A N SER 298.A O no hydrogen 3.186 N/A ILE 302.A N PHE 299.A O no hydrogen 2.906 N/A ASP 303.A N PHE 299.A O no hydrogen 2.977 N/A ASN 304.A ND2 GLY 91.A O no hydrogen 2.748 N/A THR 305.A OG1 ASP 303.A OD2 no hydrogen 3.488 N/A ALA 306.A N ASP 303.A O no hydrogen 3.079 N/A TYR 307.A N ASP 303.A O no hydrogen 3.131 N/A TYR 308.A N ASN 304.A O no hydrogen 3.285 N/A TYR 308.A OH GLU 289.A OE1 no hydrogen 2.394 N/A MET 309.A N THR 327.A O no hydrogen 2.977 N/A GLN 311.A N TYR 317.A O no hydrogen 3.235 N/A GLN 311.A NE2 ASP 313.A OD1 no hydrogen 2.764 N/A ASN 314.A N GLN 311.A O no hydrogen 2.983 N/A LYS 315.A N GLN 311.A O no hydrogen 2.606 N/A ARG 316.A NE ASP 129.A OD2 no hydrogen 2.814 N/A ARG 316.A NH2 ASP 129.A OD1 no hydrogen 3.038 N/A TYR 318.A OH ASN 304.A OD1 no hydrogen 2.542 N/A LEU 319.A N MET 309.A O no hydrogen 2.974 N/A PHE 321.A N THR 327.A OG1 no hydrogen 2.854 N/A THR 322.A OG1 THR 324.A OG1 no hydrogen 2.791 N/A THR 322.A OG1 ASN 326.A O no hydrogen 2.829 N/A GLY 323.A N ASP 320.A OD1 no hydrogen 2.512 N/A THR 324.A N THR 322.A OG1 no hydrogen 3.307 N/A THR 324.A OG1 THR 322.A OG1 no hydrogen 2.791 N/A GLY 325.A N ASP 320.A OD2 no hydrogen 2.393 N/A ASN 326.A ND2 THR 287.A O no hydrogen 3.314 N/A ASN 326.A ND2 GLY 290.A O no hydrogen 2.785 N/A THR 327.A OG1 LEU 319.A O no hydrogen 3.244 N/A LEU 328.A N ASN 285.A O no hydrogen 2.573 N/A ASN 329.A N TYR 307.A O no hydrogen 2.853 N/A ASN 329.A ND2 SER 331.A OG no hydrogen 2.702 N/A LEU 330.A N LEU 328.A O no hydrogen 2.972 N/A HIS 332.A N ASN 329.A O no hydrogen 3.158 N/A HIS 332.A NE2 GLU 33.A OE1 no hydrogen 3.122 N/A ARG 334.A N HIS 332.A ND1 no hydrogen 2.980 N/A ARG 334.A NE ASP 63.A OD1 no hydrogen 3.442 N/A ARG 334.A NE ASP 63.A OD2 no hydrogen 3.535 N/A ARG 334.A NH1 TYR 13.A OH no hydrogen 2.966 N/A ARG 334.A NH2 ASP 63.A OD2 no hydrogen 3.154 N/A ILE 336.A N HIS 332.A O no hydrogen 2.753 N/A GLN 337.A N PRO 333.A O no hydrogen 2.876 N/A MET 338.A N ARG 334.A O no hydrogen 2.836 N/A VAL 339.A N VAL 335.A O no hydrogen 3.130 N/A LEU 340.A N ILE 336.A O no hydrogen 3.034 N/A ASP 341.A N GLN 337.A O no hydrogen 2.574 N/A SER 342.A N MET 338.A O no hydrogen 2.765 N/A SER 342.A OG PHE 244.A O no hydrogen 2.663 N/A SER 342.A OG TYR 284.A OH no hydrogen 2.645 N/A LEU 343.A N VAL 339.A O no hydrogen 2.920 N/A ARG 344.A N LEU 340.A O no hydrogen 3.026 N/A ARG 344.A NH1 ASP 383.A OD1 no hydrogen 2.839 N/A ARG 344.A NH2 ASP 341.A OD2 no hydrogen 3.030 N/A TYR 345.A N ASP 341.A O no hydrogen 2.984 N/A TRP 346.A N SER 342.A O no hydrogen 2.921 N/A TRP 346.A NE1 PHE 244.A O no hydrogen 3.009 N/A VAL 347.A N LEU 343.A O no hydrogen 2.967 N/A VAL 347.A N ARG 344.A O no hydrogen 3.196 N/A THR 348.A N ARG 344.A O no hydrogen 2.794 N/A THR 348.A OG1 ARG 344.A O no hydrogen 3.377 N/A GLU 349.A N TYR 345.A O no hydrogen 2.693 N/A MET 350.A N TYR 345.A O no hydrogen 3.293 N/A HIS 351.A ND1 GLU 156.A OE2 no hydrogen 1.945 N/A VAL 352.A N TRP 346.A O no hydrogen 2.898 N/A ASP 353.A N VAL 278.A O no hydrogen 2.848 N/A PHE 355.A N LYS 390.A O no hydrogen 3.015 N/A ARG 356.A N ILE 280.A O no hydrogen 3.047 N/A ARG 356.A NH1 ASP 281.A OD1 no hydrogen 3.032 N/A PHE 357.A N ILE 392.A O no hydrogen 2.615 N/A ASP 358.A N VAL 282.A O no hydrogen 2.992 N/A LEU 359.A N GLU 394.A OE2 no hydrogen 2.853 N/A ALA 362.A N LEU 359.A O no hydrogen 3.029 N/A LEU 363.A N ALA 360.A O no hydrogen 2.820 N/A ALA 364.A N ALA 361.A O no hydrogen 2.751 N/A ARG 365.A NE ASP 397.A OD1 no hydrogen 2.736 N/A ARG 365.A NH1 GLN 400.A O no hydrogen 3.191 N/A ARG 365.A NH2 ASP 397.A OD1 no hydrogen 3.389 N/A ARG 365.A NH2 ASP 397.A OD2 no hydrogen 3.087 N/A ARG 365.A NH2 GLN 400.A O no hydrogen 2.925 N/A GLU 366.A N SER 369.A O no hydrogen 3.062 N/A SER 369.A OG GLU 366.A O no hydrogen 3.484 N/A ASN 371.A N ALA 364.A O no hydrogen 2.934 N/A ILE 378.A N ASN 374.A O no hydrogen 3.169 N/A ALA 379.A N THR 375.A O no hydrogen 2.997 N/A LEU 380.A N PHE 376.A O no hydrogen 2.952 N/A GLN 381.A N PHE 377.A O no hydrogen 3.033 N/A GLN 382.A N ILE 378.A O no hydrogen 3.275 N/A GLN 382.A N ALA 379.A O no hydrogen 3.327 N/A GLN 382.A NE2 ALA 379.A O no hydrogen 2.807 N/A ASP 383.A N ALA 379.A O no hydrogen 3.029 N/A ASP 383.A N LEU 380.A O no hydrogen 3.256 N/A ILE 385.A N ASP 383.A OD2 no hydrogen 3.099 N/A LEU 386.A N ASP 383.A OD2 no hydrogen 2.951 N/A SER 387.A N ASP 383.A O no hydrogen 3.111 N/A SER 387.A OG ASP 383.A O no hydrogen 2.803 N/A SER 387.A OG PRO 384.A O no hydrogen 3.468 N/A GLN 388.A N ILE 385.A O no hydrogen 3.122 N/A LYS 390.A N ASP 353.A O no hydrogen 3.233 N/A LYS 390.A NZ VAL 164.A O no hydrogen 3.090 N/A LYS 390.A NZ GLU 277.A OE1 no hydrogen 3.229 N/A LYS 390.A NZ GLU 277.A OE2 no hydrogen 2.790 N/A ILE 392.A N PHE 355.A O no hydrogen 2.763 N/A ALA 393.A N ALA 413.A O no hydrogen 2.893 N/A GLU 394.A N PHE 357.A O no hydrogen 3.104 N/A ASP 397.A N GLY 402.A O no hydrogen 3.381 N/A VAL 398.A N PHE 321.A O no hydrogen 3.141 N/A GLY 399.A N ASP 397.A OD2 no hydrogen 3.124 N/A GLY 402.A N GLY 399.A O no hydrogen 3.222 N/A GLN 404.A N PRO 395.A O no hydrogen 2.737 N/A GLN 404.A NE2 GLY 401.A O no hydrogen 2.907 N/A GLY 406.A N GLU 414.A OE1 no hydrogen 2.529 N/A ASN 407.A N GLN 404.A O no hydrogen 3.084 N/A PHE 408.A N GLU 414.A OE2 no hydrogen 3.354 N/A GLN 411.A NE2 LEU 386.A O no hydrogen 3.112 N/A GLN 411.A NE2 VAL 389.A O no hydrogen 2.684 N/A TRP 412.A N PRO 409.A O no hydrogen 3.098 N/A ALA 413.A N LEU 391.A O no hydrogen 2.859 N/A GLU 414.A N ALA 457.A O no hydrogen 2.779 N/A TRP 415.A N ALA 393.A O no hydrogen 2.877 N/A ASN 416.A N ILE 459.A O no hydrogen 2.986 N/A ASN 416.A ND2 SER 444.A OG no hydrogen 3.024 N/A ASN 416.A ND2 SER 458.A OG no hydrogen 2.895 N/A TYR 419.A N ASN 416.A O no hydrogen 3.138 N/A TYR 419.A N ASN 416.A OD1 no hydrogen 2.973 N/A TYR 419.A OH SER 529.A OG no hydrogen 2.721 N/A ARG 420.A N ASN 416.A O no hydrogen 3.270 N/A ASP 421.A N GLY 417.A O no hydrogen 2.909 N/A SER 422.A N LYS 418.A O no hydrogen 2.940 N/A SER 422.A OG LYS 418.A O no hydrogen 3.225 N/A SER 422.A OG GLU 436.A OE2 no hydrogen 2.668 N/A ILE 423.A N TYR 419.A O no hydrogen 2.853 N/A ARG 424.A N ARG 420.A O no hydrogen 2.993 N/A ARG 424.A NE ASN 495.A O no hydrogen 3.009 N/A ARG 424.A NH1 VAL 462.A O no hydrogen 2.543 N/A ARG 424.A NH2 ASN 495.A O no hydrogen 3.425 N/A ARG 425.A N ASP 421.A O no hydrogen 2.809 N/A ARG 425.A NE GLU 430.A OE1 no hydrogen 3.186 N/A ARG 425.A NE GLU 430.A OE2 no hydrogen 3.216 N/A ARG 425.A NH2 GLU 430.A OE2 no hydrogen 2.882 N/A PHE 426.A N SER 422.A O no hydrogen 2.827 N/A TRP 427.A NE1 THR 525.A OG1 no hydrogen 2.932 N/A ARG 428.A N ARG 425.A O no hydrogen 3.152 N/A ARG 428.A NE SER 497.A O no hydrogen 3.016 N/A ARG 428.A NH1 GLU 430.A OE1 no hydrogen 2.668 N/A GLY 429.A N PHE 426.A O no hydrogen 3.181 N/A TYR 434.A N SER 625.A O no hydrogen 3.323 N/A TYR 434.A OH TYR 611.A O no hydrogen 2.834 N/A SER 435.A N TRP 623.A O no hydrogen 2.818 N/A ILE 437.A N PRO 433.A O no hydrogen 3.256 N/A ALA 438.A N TYR 434.A O no hydrogen 2.881 N/A ASN 439.A N SER 435.A O no hydrogen 2.884 N/A ASN 439.A ND2 SER 435.A O no hydrogen 2.825 N/A ARG 440.A N GLU 436.A O no hydrogen 3.294 N/A ARG 440.A NE SER 444.A OG no hydrogen 3.144 N/A ARG 440.A NH1 GLU 436.A OE2 no hydrogen 2.584 N/A ARG 440.A NH2 ASP 446.A OD2 no hydrogen 2.791 N/A LEU 441.A N ILE 437.A O no hydrogen 3.041 N/A LEU 442.A N ALA 438.A O no hydrogen 2.913 N/A LEU 442.A N ASN 439.A O no hydrogen 3.166 N/A GLY 443.A N ARG 440.A O no hydrogen 3.116 N/A SER 444.A N ASN 439.A O no hydrogen 2.631 N/A ILE 447.A N SER 444.A O no hydrogen 3.090 N/A TYR 448.A N SER 444.A O no hydrogen 3.227 N/A TYR 448.A OH GLU 414.A OE1 no hydrogen 3.421 N/A LEU 449.A N PRO 445.A O no hydrogen 2.761 N/A LYS 453.A N TYR 448.A O no hydrogen 2.909 N/A LYS 453.A NZ PHE 408.A O no hydrogen 2.644 N/A ALA 457.A N THR 454.A O no hydrogen 2.951 N/A SER 458.A N PRO 455.A O no hydrogen 3.042 N/A SER 458.A OG ASN 460.A OD1 no hydrogen 2.580 N/A ILE 459.A N GLU 414.A O no hydrogen 2.973 N/A ASN 460.A N THR 532.A O no hydrogen 2.698 N/A ASN 460.A ND2 GLN 530.A O no hydrogen 2.736 N/A HIS 465.A N GLU 173.A OE1 no hydrogen 3.003 N/A HIS 465.A ND1 GLU 173.A OE2 no hydrogen 2.994 N/A ASP 466.A N SER 464.A OG no hydrogen 2.978 N/A THR 469.A OG1 ARG 543.A O no hydrogen 2.997 N/A LEU 470.A N ASP 539.A OD1 no hydrogen 2.756 N/A ASP 472.A N THR 469.A OG1 no hydrogen 3.070 N/A LEU 473.A N THR 469.A O no hydrogen 2.909 N/A VAL 474.A N GLU 471.A O no hydrogen 3.306 N/A SER 475.A N ASP 472.A O no hydrogen 3.037 N/A SER 475.A OG GLU 471.A O no hydrogen 3.010 N/A ASN 477.A N GLU 503.A OE1 no hydrogen 2.790 N/A LYS 479.A NZ ASN 488.A O no hydrogen 2.963 N/A LYS 479.A NZ ASP 490.A O no hydrogen 2.650 N/A LYS 479.A NZ GLY 491.A O no hydrogen 3.426 N/A HIS 480.A N GLY 547.A O no hydrogen 2.867 N/A HIS 480.A ND1 GLN 478.A O no hydrogen 3.030 N/A ASN 481.A ND2 ASP 490.A O no hydrogen 2.939 N/A ASN 484.A N ASN 481.A O no hydrogen 3.202 N/A ASN 484.A ND2 ASP 490.A OD2 no hydrogen 2.804 N/A GLY 485.A N GLU 482.A O no hydrogen 2.639 N/A GLN 489.A N PHE 486.A O no hydrogen 2.909 N/A ASN 495.A ND2 ASN 549.A OD1 no hydrogen 2.926 N/A TYR 496.A N GLU 494.A OE1 no hydrogen 3.339 N/A SER 497.A OG TYR 476.A O no hydrogen 2.794 N/A ASN 499.A N ASN 477.A OD1 no hydrogen 3.043 N/A ALA 502.A N ASN 499.A O no hydrogen 3.309 N/A GLY 504.A N SER 475.A O no hydrogen 2.918 N/A THR 506.A OG1 GLY 504.A O no hydrogen 3.298 N/A VAL 511.A N ASP 508.A O no hydrogen 2.467 N/A VAL 511.A N ASP 508.A OD1 no hydrogen 3.313 N/A VAL 512.A N ASP 508.A O no hydrogen 3.015 N/A ILE 513.A N GLN 509.A O no hydrogen 2.869 N/A CYS 514.A N ASN 510.A O no hydrogen 3.445 N/A CYS 514.A SG CYS 500.A O no hydrogen 3.964 N/A ARG 515.A N VAL 511.A O no hydrogen 3.054 N/A ARG 515.A NH1 VAL 474.A O no hydrogen 3.516 N/A ARG 515.A NH1 ASN 499.A O no hydrogen 2.724 N/A ARG 515.A NH1 ALA 502.A O no hydrogen 2.919 N/A ARG 515.A NH2 GLY 504.A O no hydrogen 2.658 N/A GLU 516.A N VAL 512.A O no hydrogen 2.846 N/A LYS 517.A N ILE 513.A O no hydrogen 2.921 N/A LYS 517.A NZ GLY 702.A O no hydrogen 3.460 N/A LYS 517.A NZ THR 704.A OG1 no hydrogen 2.909 N/A GLN 518.A N CYS 514.A O no hydrogen 2.952 N/A LYS 519.A N ARG 515.A O no hydrogen 3.003 N/A LYS 519.A NZ GLU 471.A OE1 no hydrogen 2.829 N/A LYS 519.A NZ GLU 516.A OE1 no hydrogen 3.090 N/A LYS 519.A NZ SER 542.A OG no hydrogen 2.973 N/A ARG 520.A N GLU 516.A O no hydrogen 3.384 N/A ARG 520.A NH1 GLU 516.A O no hydrogen 2.792 N/A ARG 520.A NH1 GLU 516.A OE2 no hydrogen 3.117 N/A ASN 521.A N LYS 517.A O no hydrogen 2.961 N/A ASN 521.A ND2 ARG 703.A O no hydrogen 3.367 N/A PHE 522.A N GLN 518.A O no hydrogen 2.915 N/A MET 523.A N LYS 519.A O no hydrogen 3.146 N/A ILE 524.A N ARG 520.A O no hydrogen 2.939 N/A THR 525.A N ASN 521.A O no hydrogen 3.143 N/A THR 525.A OG1 ASN 521.A O no hydrogen 2.786 N/A LEU 526.A N PHE 522.A O no hydrogen 2.840 N/A LEU 527.A N MET 523.A O no hydrogen 2.999 N/A VAL 528.A N THR 525.A O no hydrogen 3.295 N/A SER 529.A N LEU 526.A O no hydrogen 3.332 N/A SER 529.A OG TYR 419.A OH no hydrogen 2.721 N/A SER 529.A OG THR 525.A O no hydrogen 2.473 N/A GLN 530.A N LEU 441.A O no hydrogen 2.773 N/A THR 532.A N SER 458.A O no hydrogen 2.921 N/A MET 534.A N ASN 460.A O no hydrogen 2.823 N/A ILE 535.A N ILE 171.A O no hydrogen 2.677 N/A GLY 537.A N GLU 173.A O no hydrogen 2.717 N/A GLY 538.A N GLU 540.A OE2 no hydrogen 2.512 N/A ASP 539.A N LEU 536.A O no hydrogen 3.020 N/A LEU 541.A N GLY 538.A O no hydrogen 2.734 N/A SER 542.A N ASP 539.A O no hydrogen 2.961 N/A ARG 543.A N GLY 538.A O no hydrogen 2.943 N/A ARG 543.A NH1 THR 559.A O no hydrogen 2.729 N/A THR 544.A OG1 SER 542.A O no hydrogen 3.354 N/A GLN 545.A N ASP 472.A OD1 no hydrogen 2.769 N/A GLY 547.A N ASP 472.A OD1 no hydrogen 3.025 N/A ASN 548.A N GLN 545.A O no hydrogen 2.762 N/A ASN 548.A ND2 ASN 484.A OD1 no hydrogen 3.070 N/A ASN 549.A N ASN 481.A OD1 no hydrogen 2.898 N/A ASN 550.A N ASN 548.A OD1 no hydrogen 2.767 N/A PHE 552.A N ASN 550.A O no hydrogen 2.630 N/A CYS 553.A SG ASN 484.A OD1 no hydrogen 3.457 N/A CYS 553.A SG GLN 554.A OE1 no hydrogen 3.816 N/A GLN 554.A NE2 ASN 556.A OD1 no hydrogen 2.958 N/A THR 559.A N ASN 556.A O no hydrogen 3.002 N/A THR 559.A OG1 GLN 554.A O no hydrogen 2.647 N/A THR 559.A OG1 ASN 556.A O no hydrogen 3.263 N/A TRP 560.A N ASN 556.A O no hydrogen 2.749 N/A PHE 561.A N GLY 178.A O no hydrogen 2.883 N/A ASN 564.A N ASP 562.A OD2 no hydrogen 3.026 N/A ARG 568.A NH1 GLU 516.A OE1 no hydrogen 2.878 N/A LYS 569.A N ASP 566.A OD1 no hydrogen 2.715 N/A LYS 569.A NZ ASN 564.A O no hydrogen 3.267 N/A SER 570.A N ASP 566.A O no hydrogen 2.852 N/A LYS 571.A N GLU 567.A O no hydrogen 2.800 N/A PHE 572.A N ARG 568.A O no hydrogen 3.080 N/A PHE 572.A N LYS 569.A O no hydrogen 3.205 N/A LEU 573.A N LYS 569.A O no hydrogen 3.034 N/A GLU 574.A N SER 570.A O no hydrogen 3.219 N/A PHE 575.A N LYS 571.A O no hydrogen 3.285 N/A VAL 576.A N PHE 572.A O no hydrogen 3.003 N/A LYS 577.A N LEU 573.A O no hydrogen 3.209 N/A LYS 578.A N GLU 574.A O no hydrogen 3.166 N/A MET 579.A N PHE 575.A O no hydrogen 3.019 N/A ILE 580.A N VAL 576.A O no hydrogen 2.882 N/A GLN 581.A N LYS 577.A O no hydrogen 2.906 N/A PHE 582.A N LYS 578.A O no hydrogen 2.972 N/A TYR 583.A N MET 579.A O no hydrogen 2.977 N/A TYR 583.A OH GLY 531.A O no hydrogen 3.001 N/A TYR 583.A OH PHE 589.A O no hydrogen 3.133 N/A ARG 584.A N ILE 580.A O no hydrogen 3.071 N/A ARG 584.A NH1 GLY 210.A O no hydrogen 3.035 N/A ALA 585.A N GLN 581.A O no hydrogen 3.112 N/A ALA 585.A N PHE 582.A O no hydrogen 3.144 N/A HIS 586.A N TYR 583.A O no hydrogen 3.268 N/A HIS 586.A ND1 ASP 651.A OD2 no hydrogen 2.714 N/A ALA 588.A N ASP 651.A OD1 no hydrogen 2.843 N/A PHE 589.A N HIS 586.A O no hydrogen 3.106 N/A ARG 590.A N PRO 587.A O no hydrogen 3.031 N/A ARG 590.A NE TYR 583.A O no hydrogen 2.986 N/A ARG 590.A NH2 ARG 584.A O no hydrogen 2.815 N/A ARG 591.A NE GLU 641.A OE2 no hydrogen 3.167 N/A GLU 592.A N GLU 641.A OE2 no hydrogen 2.824 N/A ARG 593.A N GLU 641.A OE2 no hydrogen 3.304 N/A TYR 594.A OH GLY 443.A O no hydrogen 3.159 N/A GLN 596.A N ASP 607.A OD2 no hydrogen 2.752 N/A GLY 597.A N ASP 607.A OD1 no hydrogen 2.947 N/A LYS 598.A N ASP 607.A OD1 no hydrogen 3.072 N/A MET 603.A N LEU 600.A O no hydrogen 2.870 N/A LYS 606.A NZ GLU 617.A OE1 no hydrogen 3.490 N/A LYS 606.A NZ GLU 617.A OE2 no hydrogen 2.654 N/A ASP 607.A N LYS 598.A O no hydrogen 3.178 N/A THR 609.A N VAL 633.A O no hydrogen 3.075 N/A TYR 611.A N ILE 631.A O no hydrogen 2.605 N/A THR 612.A N ARG 616.A O no hydrogen 3.262 N/A THR 612.A OG1 GLU 614.A OE1 no hydrogen 3.129 N/A THR 612.A OG1 GLU 614.A OE2 no hydrogen 2.397 N/A THR 612.A OG1 ARG 616.A O no hydrogen 3.206 N/A GLY 615.A N THR 612.A O no hydrogen 2.711 N/A VAL 618.A N PHE 610.A O no hydrogen 2.695 N/A THR 622.A N ASP 619.A OD2 no hydrogen 2.895 N/A TRP 623.A N ASP 619.A O no hydrogen 2.989 N/A SER 624.A N LYS 621.A O no hydrogen 2.987 N/A SER 624.A OG LYS 621.A O no hydrogen 3.277 N/A SER 625.A OG LYS 621.A O no hydrogen 2.921 N/A THR 627.A N LEU 432.A O no hydrogen 2.964 N/A THR 627.A OG1 LEU 629.A O no hydrogen 2.670 N/A LEU 629.A N THR 627.A OG1 no hydrogen 2.782 N/A VAL 630.A N LEU 658.A O no hydrogen 2.960 N/A ILE 631.A N TYR 434.A OH no hydrogen 2.909 N/A PHE 632.A N ILE 656.A O no hydrogen 3.100 N/A VAL 633.A N THR 609.A O no hydrogen 2.799 N/A LEU 634.A N PHE 654.A O no hydrogen 2.847 N/A GLU 635.A N ASP 607.A O no hydrogen 2.871 N/A GLY 636.A N LEU 634.A O no hydrogen 3.224 N/A VAL 638.A N GLU 635.A O no hydrogen 2.917 N/A ASN 643.A N GLU 647.A O no hydrogen 2.984 N/A ASN 643.A ND2 GLU 647.A OE1 no hydrogen 2.919 N/A TYR 645.A N ASN 643.A OD1 no hydrogen 2.773 N/A GLY 646.A N ASN 643.A O no hydrogen 2.867 N/A GLU 647.A N ASN 643.A OD1 no hydrogen 2.960 N/A ARG 648.A NH1 SER 637.A O no hydrogen 2.987 N/A ILE 649.A N GLU 641.A O no hydrogen 2.727 N/A ASP 651.A N GLY 636.A O no hydrogen 2.914 N/A ASP 652.A N ASP 651.A OD2 no hydrogen 2.559 N/A SER 653.A OG GLU 635.A OE1 no hydrogen 2.355 N/A PHE 654.A N LEU 634.A O no hydrogen 3.034 N/A LEU 655.A N TYR 708.A O no hydrogen 2.774 N/A ILE 656.A N PHE 632.A O no hydrogen 2.850 N/A ILE 657.A N LEU 706.A O no hydrogen 2.898 N/A LEU 658.A N VAL 630.A O no hydrogen 2.843 N/A ASN 659.A N THR 704.A O no hydrogen 2.965 N/A ASN 659.A ND2 ASN 663.A O no hydrogen 3.541 N/A ASN 659.A ND2 GLU 701.A O no hydrogen 3.004 N/A ALA 660.A N GLN 628.A O no hydrogen 2.695 N/A ASN 661.A N GLN 628.A O no hydrogen 3.158 N/A ASN 663.A N ASN 661.A OD1 no hydrogen 2.725 N/A VAL 665.A N ILE 700.A O no hydrogen 2.975 N/A VAL 667.A N LEU 698.A O no hydrogen 3.255 N/A LYS 668.A N LEU 613.A O no hydrogen 2.997 N/A PHE 669.A N LYS 696.A O no hydrogen 3.114 N/A LYS 673.A N GLU 712.A O no hydrogen 2.753 N/A TRP 674.A N ILE 692.A O no hydrogen 2.825 N/A TRP 674.A NE1 PRO 670.A O no hydrogen 3.122 N/A GLU 675.A N ARG 709.A O no hydrogen 2.943 N/A LEU 676.A N ARG 690.A O no hydrogen 2.763 N/A VAL 677.A N VAL 707.A O no hydrogen 2.978 N/A ILE 678.A N VAL 707.A O no hydrogen 3.345 N/A SER 680.A N ALA 705.A O no hydrogen 3.125 N/A SER 680.A OG ASN 521.A OD1 no hydrogen 2.778 N/A TYR 681.A N SER 679.A OG no hydrogen 3.118 N/A ARG 683.A NE GLU 684.A O no hydrogen 3.187 N/A ARG 683.A NH1 GLU 701.A OE1 no hydrogen 3.369 N/A ARG 683.A NH1 GLU 701.A OE2 no hydrogen 2.443 N/A ARG 683.A NH2 GLU 689.A OE1 no hydrogen 3.100 N/A LYS 686.A N GLU 689.A OE1 no hydrogen 2.871 N/A GLU 688.A N GLU 688.A OE2 no hydrogen 2.543 N/A GLU 689.A N LYS 686.A O no hydrogen 2.762 N/A ILE 692.A N TRP 674.A O no hydrogen 2.914 N/A LYS 696.A N GLU 693.A O no hydrogen 3.407 N/A LEU 698.A N VAL 667.A O no hydrogen 3.094 N/A ILE 700.A N VAL 665.A O no hydrogen 2.755 N/A GLU 701.A N TYR 681.A OH no hydrogen 3.091 N/A ARG 703.A N ASN 661.A O no hydrogen 3.086 N/A THR 704.A N ASN 659.A O no hydrogen 2.972 N/A THR 704.A OG1 GLU 701.A O no hydrogen 2.629 N/A THR 704.A OG1 GLY 702.A O no hydrogen 3.324 N/A ALA 705.A N SER 680.A OG no hydrogen 2.999 N/A LEU 706.A N ILE 657.A O no hydrogen 2.909 N/A VAL 707.A N ILE 678.A O no hydrogen 2.877 N/A TYR 708.A N LEU 655.A O no hydrogen 2.803 N/A TYR 708.A OH GLU 689.A O no hydrogen 3.016 N/A ARG 709.A N GLU 675.A O no hydrogen 2.852 N/A ARG 709.A NH1 ASP 652.A OD1 no hydrogen 2.805 N/A ARG 710.A N SER 653.A O no hydrogen 3.002 N/A ARG 710.A NH2 GLU 635.A OE2 no hydrogen 2.575 N/A ILE 711.A N LYS 673.A O no hydrogen 2.868 N/A