Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4zg9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 28.A OD2 no hydrogen 2.686 N/A CYS 2.A N ASP 28.A OD2 no hydrogen 3.212 N/A CYS 2.A SG ARG 14.A O no hydrogen 3.862 N/A LYS 3.A N SER 1.A OG no hydrogen 3.106 N/A ARG 5.A N CYS 2.A O no hydrogen 2.582 N/A ARG 5.A NH1 CYS 13.A O no hydrogen 3.343 N/A ARG 5.A NH2 SER 1.A O no hydrogen 2.729 N/A ARG 5.A NH2 CYS 13.A O no hydrogen 3.497 N/A PHE 7.A N CYS 15.A O no hydrogen 3.010 N/A ARG 14.A N SER 24.A O no hydrogen 3.301 N/A ARG 14.A NH1 SER 24.A OG no hydrogen 2.749 N/A ASN 17.A ND2 PHE 209.A O no hydrogen 2.953 N/A CYS 19.A N ASP 16.A O no hydrogen 3.239 N/A CYS 19.A SG ARG 14.A O no hydrogen 3.840 N/A CYS 19.A SG ASP 16.A O no hydrogen 3.015 N/A LYS 20.A NZ ASP 30.A OD2 no hydrogen 2.916 N/A SER 21.A N LEU 18.A O no hydrogen 3.179 N/A SER 21.A OG SER 211.A OG no hydrogen 2.727 N/A THR 23.A OG1 TYR 22.A O no hydrogen 2.342 N/A SER 24.A N CYS 19.A O no hydrogen 3.410 N/A CYS 26.A SG ARG 14.A O no hydrogen 3.268 N/A PHE 29.A N CYS 26.A O no hydrogen 2.957 N/A GLU 31.A N ASP 28.A O no hydrogen 2.978 N/A LEU 32.A N ASP 28.A O no hydrogen 2.908 N/A CYS 33.A N PHE 29.A O no hydrogen 2.921 N/A LEU 34.A N PHE 29.A O no hydrogen 3.188 N/A THR 36.A OG1 LEU 34.A O no hydrogen 3.540 N/A GLY 39.A N THR 36.A O no hydrogen 3.444 N/A CYS 42.A N ASN 72.A OD1 no hydrogen 3.076 N/A CYS 42.A SG HIS 58.A O no hydrogen 4.020 N/A THR 43.A OG1 ASP 45.A OD1 no hydrogen 3.063 N/A ARG 46.A NE GLU 49.A OE1 no hydrogen 3.353 N/A ARG 46.A NE GLU 49.A OE2 no hydrogen 3.251 N/A ARG 46.A NH2 GLU 49.A OE2 no hydrogen 3.035 N/A ARG 46.A NH2 CYS 57.A O no hydrogen 3.075 N/A CYS 47.A N LYS 44.A O no hydrogen 3.190 N/A ASN 52.A N VAL 50.A O no hydrogen 2.420 N/A GLU 54.A N ASN 52.A OD1 no hydrogen 2.821 N/A ASN 55.A N ASN 52.A O no hydrogen 3.170 N/A ALA 56.A N ALA 37.A O no hydrogen 3.258 N/A CYS 57.A SG GLY 39.A O no hydrogen 3.753 N/A HIS 58.A ND1 ASP 68.A O no hydrogen 2.996 N/A CYS 59.A N GLU 49.A OE2 no hydrogen 3.150 N/A CYS 63.A N SER 60.A OG no hydrogen 3.112 N/A ALA 65.A N ASP 62.A O no hydrogen 3.046 N/A GLY 67.A N CYS 63.A O no hydrogen 3.106 N/A CYS 69.A SG HIS 58.A O no hydrogen 3.282 N/A CYS 70.A N HIS 58.A O no hydrogen 3.324 N/A TYR 73.A N CYS 70.A O no hydrogen 2.941 N/A GLN 74.A N GLN 279.A OE1 no hydrogen 3.311 N/A VAL 76.A N ASN 72.A O no hydrogen 3.113 N/A VAL 76.A N TYR 73.A O no hydrogen 2.825 N/A CYS 77.A N TYR 73.A O no hydrogen 2.945 N/A CYS 77.A SG TYR 73.A O no hydrogen 3.958 N/A LYS 78.A N GLN 74.A O no hydrogen 3.140 N/A SER 81.A OG ASP 86.A OD1 no hydrogen 2.622 N/A HIS 82.A ND1 ASP 275.A OD2 no hydrogen 3.230 N/A TRP 83.A N ASP 275.A OD1 no hydrogen 2.826 N/A ASP 85.A N HIS 82.A O no hydrogen 3.034 N/A GLU 95.A N ARG 284.A O no hydrogen 3.146 N/A CYS 96.A SG CYS 285.A O no hydrogen 3.677 N/A PHE 100.A N PRO 97.A O no hydrogen 3.385 N/A LEU 105.A N SER 236.A O no hydrogen 2.896 N/A ILE 106.A N ASN 287.A O no hydrogen 2.905 N/A ILE 107.A N TYR 238.A O no hydrogen 3.011 N/A PHE 108.A N ILE 289.A O no hydrogen 2.686 N/A SER 109.A N PHE 240.A O no hydrogen 3.013 N/A SER 109.A OG PHE 240.A O no hydrogen 2.697 N/A VAL 110.A N VAL 291.A O no hydrogen 2.910 N/A ASP 111.A N SER 242.A O no hydrogen 2.998 N/A GLY 112.A N ASP 293.A OD1 no hydrogen 2.957 N/A ALA 115.A N GLN 409.A O no hydrogen 3.207 N/A TYR 117.A N ARG 114.A O no hydrogen 2.980 N/A MET 118.A N ALA 115.A O no hydrogen 3.111 N/A LYS 120.A N SER 116.A O no hydrogen 3.173 N/A SER 122.A N LYS 119.A O no hydrogen 3.335 N/A VAL 124.A N GLY 121.A O no hydrogen 2.770 N/A MET 125.A N GLY 121.A O no hydrogen 2.949 N/A ASN 127.A N ASP 267.A OD2 no hydrogen 3.057 N/A ASN 127.A ND2 ASP 267.A OD2 no hydrogen 2.673 N/A ILE 128.A N ASP 267.A OD1 no hydrogen 2.620 N/A GLU 129.A N MET 125.A O no hydrogen 2.913 N/A LYS 130.A N PRO 126.A O no hydrogen 2.864 N/A LYS 130.A NZ TRP 83.A O no hydrogen 2.578 N/A LYS 130.A NZ ASP 86.A O no hydrogen 3.305 N/A LEU 131.A N ASN 127.A O no hydrogen 3.098 N/A ARG 132.A N ILE 128.A O no hydrogen 2.960 N/A ARG 132.A NH1 GLU 129.A OE1 no hydrogen 3.182 N/A SER 133.A N GLU 129.A O no hydrogen 2.880 N/A CYS 134.A N LYS 130.A O no hydrogen 3.011 N/A CYS 134.A SG LYS 130.A O no hydrogen 3.273 N/A GLY 135.A N LEU 131.A O no hydrogen 2.873 N/A THR 136.A N GLY 414.A O no hydrogen 2.738 N/A THR 136.A OG1 LYS 420.A O no hydrogen 2.979 N/A THR 136.A OG1 LEU 458.A O no hydrogen 3.545 N/A HIS 137.A N THR 423.A O no hydrogen 3.055 N/A SER 138.A OG TYR 140.A O no hydrogen 2.609 N/A MET 141.A N THR 410.A O no hydrogen 2.587 N/A ARG 142.A N PHE 428.A O no hydrogen 2.924 N/A ARG 142.A NH1 GLU 429.A OE2 no hydrogen 2.790 N/A VAL 144.A N ASN 152.A OD1 no hydrogen 2.785 N/A TYR 145.A OH HIS 379.A NE2 no hydrogen 2.817 N/A THR 147.A OG1 PHE 401.A O no hydrogen 2.726 N/A LYS 148.A N PRO 146.A O no hydrogen 2.824 N/A LYS 148.A NZ HIS 399.A O no hydrogen 3.244 N/A THR 149.A OG1 ASP 111.A OD1 no hydrogen 3.048 N/A THR 149.A OG1 ASP 111.A OD2 no hydrogen 3.384 N/A THR 149.A OG1 HIS 294.A NE2 no hydrogen 3.316 N/A ASN 152.A N LYS 148.A O no hydrogen 3.299 N/A ASN 152.A ND2 VAL 144.A O no hydrogen 3.206 N/A ASN 152.A ND2 LYS 148.A O no hydrogen 3.016 N/A LEU 153.A N THR 149.A O no hydrogen 2.754 N/A TYR 154.A N PHE 150.A O no hydrogen 3.038 N/A TYR 154.A OH GLY 190.A O no hydrogen 2.873 N/A THR 155.A N PRO 151.A O no hydrogen 3.230 N/A THR 155.A OG1 PRO 151.A O no hydrogen 2.976 N/A THR 155.A OG1 LEU 160.A O no hydrogen 2.727 N/A THR 155.A OG1 HIS 165.A NE2 no hydrogen 3.184 N/A LEU 156.A N ASN 152.A O no hydrogen 2.975 N/A ALA 157.A N LEU 153.A O no hydrogen 3.083 N/A THR 158.A N THR 155.A O no hydrogen 3.063 N/A THR 158.A OG1 TYR 154.A O no hydrogen 2.763 N/A GLY 159.A N THR 155.A O no hydrogen 2.692 N/A LEU 160.A N THR 158.A OG1 no hydrogen 3.223 N/A TYR 161.A N ASN 449.A OD1 no hydrogen 2.806 N/A SER 164.A N TYR 161.A O no hydrogen 2.975 N/A HIS 165.A N TYR 161.A O no hydrogen 3.067 N/A HIS 165.A NE2 PRO 151.A O no hydrogen 3.286 N/A HIS 165.A NE2 THR 155.A OG1 no hydrogen 3.184 N/A GLY 166.A N PRO 162.A O no hydrogen 2.994 N/A ILE 167.A N HIS 165.A ND1 no hydrogen 3.182 N/A SER 171.A OG HIS 182.A ND1 no hydrogen 3.172 N/A MET 172.A N PHE 181.A O no hydrogen 2.902 N/A TYR 173.A OH ASP 178.A OD1 no hydrogen 2.608 N/A ASP 174.A N ALA 179.A O no hydrogen 3.013 N/A VAL 176.A N ASP 174.A OD1 no hydrogen 2.848 N/A ALA 179.A N ASP 174.A O no hydrogen 3.333 N/A PHE 181.A N MET 172.A O no hydrogen 2.930 N/A LEU 183.A N ASN 170.A O no hydrogen 3.001 N/A ARG 187.A N ASN 185.A OD1 no hydrogen 2.762 N/A TRP 188.A N ASN 185.A O no hydrogen 3.450 N/A GLY 190.A N HIS 165.A O no hydrogen 2.807 N/A THR 197.A N PRO 193.A O no hydrogen 2.987 N/A THR 197.A OG1 GLN 192.A OE1 no hydrogen 2.871 N/A THR 197.A OG1 PRO 193.A O no hydrogen 2.833 N/A THR 197.A OG1 TYR 434.A OH no hydrogen 2.698 N/A ALA 198.A N LEU 194.A O no hydrogen 2.952 N/A THR 199.A N TRP 195.A O no hydrogen 3.194 N/A THR 199.A OG1 TRP 195.A O no hydrogen 3.037 N/A LYS 200.A N ILE 196.A O no hydrogen 2.945 N/A GLN 201.A N ALA 198.A O no hydrogen 3.120 N/A GLN 201.A NE2 LYS 444.A O no hydrogen 2.913 N/A GLY 202.A N THR 199.A O no hydrogen 3.073 N/A VAL 203.A N ALA 198.A O no hydrogen 2.904 N/A GLY 206.A N VAL 237.A O no hydrogen 2.841 N/A THR 207.A OG1 ASN 17.A OD1 no hydrogen 3.043 N/A TRP 210.A NE1 ALA 239.A O no hydrogen 2.732 N/A SER 211.A OG SER 21.A OG no hydrogen 2.727 N/A ILE 214.A N SER 211.A O no hydrogen 2.839 N/A GLU 217.A N GLU 217.A OE1 no hydrogen 2.515 N/A ARG 218.A NH2 LYS 35.A O no hydrogen 3.201 N/A ARG 218.A NH2 ALA 56.A O no hydrogen 3.238 N/A ARG 219.A N PRO 215.A O no hydrogen 3.194 N/A ARG 219.A NE ILE 214.A O no hydrogen 2.665 N/A ARG 219.A NH2 VAL 212.A O no hydrogen 3.455 N/A ARG 219.A NH2 ILE 214.A O no hydrogen 2.842 N/A ILE 220.A N HIS 216.A O no hydrogen 3.172 N/A ILE 220.A N GLU 217.A O no hydrogen 3.241 N/A LEU 221.A N GLU 217.A O no hydrogen 3.157 N/A THR 222.A N ARG 218.A O no hydrogen 2.995 N/A THR 222.A OG1 ARG 218.A O no hydrogen 2.886 N/A ILE 223.A N ARG 219.A O no hydrogen 3.214 N/A ILE 223.A N ILE 220.A O no hydrogen 2.901 N/A LEU 224.A N ILE 220.A O no hydrogen 2.939 N/A GLN 225.A N LEU 221.A O no hydrogen 2.674 N/A TRP 226.A N THR 222.A O no hydrogen 3.065 N/A TRP 226.A NE1 PHE 7.A O no hydrogen 2.916 N/A LEU 227.A N ILE 223.A O no hydrogen 3.005 N/A THR 228.A N LEU 224.A O no hydrogen 3.318 N/A THR 228.A N GLN 225.A O no hydrogen 3.186 N/A THR 228.A OG1 GLN 225.A O no hydrogen 2.819 N/A LEU 229.A N TRP 226.A O no hydrogen 3.030 N/A GLU 233.A N PRO 230.A O no hydrogen 2.841 N/A ARG 234.A N PRO 230.A O no hydrogen 2.981 N/A ARG 234.A NE LEU 229.A O no hydrogen 3.292 N/A SER 236.A N LYS 204.A O no hydrogen 2.786 N/A TYR 238.A N LEU 105.A O no hydrogen 2.874 N/A TYR 238.A OH PRO 235.A O no hydrogen 2.414 N/A PHE 240.A N ILE 107.A O no hydrogen 2.903 N/A TYR 241.A OH ASP 111.A OD2 no hydrogen 2.297 N/A SER 242.A N SER 109.A O no hydrogen 3.192 N/A SER 242.A OG GLN 244.A O no hydrogen 2.828 N/A GLN 244.A N SER 242.A OG no hydrogen 3.094 N/A ASP 246.A N ASP 111.A O no hydrogen 2.858 N/A PHE 247.A N GLU 243.A O no hydrogen 3.045 N/A SER 248.A OG GLN 244.A OE1 no hydrogen 2.875 N/A GLY 249.A N PRO 245.A O no hydrogen 3.027 N/A HIS 250.A N ASP 246.A O no hydrogen 3.109 N/A HIS 250.A ND1 GLY 397.A O no hydrogen 3.049 N/A LYS 251.A NZ TYR 252.A OH no hydrogen 2.842 N/A TYR 252.A N SER 248.A O no hydrogen 2.740 N/A GLY 253.A N GLY 249.A O no hydrogen 2.761 N/A GLY 256.A N GLY 253.A O no hydrogen 3.107 N/A GLU 258.A N GLU 258.A OE1 no hydrogen 2.933 N/A MET 259.A N GLY 256.A O no hydrogen 3.130 N/A THR 260.A N PRO 257.A O no hydrogen 3.178 N/A LEU 263.A N MET 259.A O no hydrogen 3.470 N/A ARG 264.A N THR 260.A O no hydrogen 3.148 N/A ARG 264.A NE VAL 124.A O no hydrogen 3.002 N/A ARG 264.A NH2 ASP 267.A OD2 no hydrogen 2.605 N/A GLU 265.A N ASN 261.A O no hydrogen 2.736 N/A ILE 266.A N PRO 262.A O no hydrogen 3.130 N/A ASP 267.A N LEU 263.A O no hydrogen 2.901 N/A LYS 268.A N ARG 264.A O no hydrogen 2.948 N/A LYS 268.A NZ GLU 265.A OE1 no hydrogen 2.997 N/A LYS 268.A NZ GLU 265.A OE2 no hydrogen 3.554 N/A ILE 269.A N GLU 265.A O no hydrogen 3.263 N/A VAL 270.A N ILE 266.A O no hydrogen 3.049 N/A GLY 271.A N ASP 267.A O no hydrogen 2.792 N/A GLN 272.A N LYS 268.A O no hydrogen 2.867 N/A LEU 273.A N ILE 269.A O no hydrogen 2.981 N/A MET 274.A N VAL 270.A O no hydrogen 3.208 N/A ASP 275.A N GLY 271.A O no hydrogen 2.767 N/A GLY 276.A N GLN 272.A O no hydrogen 2.824 N/A LEU 277.A N LEU 273.A O no hydrogen 2.978 N/A LYS 278.A N MET 274.A O no hydrogen 2.997 N/A LYS 278.A NZ SER 81.A O no hydrogen 3.069 N/A LYS 278.A NZ ASP 86.A OD2 no hydrogen 2.865 N/A GLN 279.A N ASP 275.A O no hydrogen 3.204 N/A GLN 279.A NE2 CYS 70.A O no hydrogen 3.232 N/A LEU 280.A N LEU 277.A O no hydrogen 2.750 N/A LYS 281.A N LYS 278.A O no hydrogen 3.083 N/A LEU 282.A N LEU 277.A O no hydrogen 2.966 N/A ARG 284.A NE GLU 95.A OE1 no hydrogen 3.252 N/A ARG 284.A NE GLU 95.A OE2 no hydrogen 2.767 N/A ARG 284.A NH1 GLU 90.A O no hydrogen 2.832 N/A ARG 284.A NH1 GLU 95.A OE2 no hydrogen 3.009 N/A ARG 284.A NH2 GLU 89.A O no hydrogen 3.387 N/A ARG 284.A NH2 GLU 90.A O no hydrogen 3.065 N/A CYS 285.A N LEU 282.A O no hydrogen 3.071 N/A VAL 286.A N LEU 282.A O no hydrogen 3.128 N/A ASN 287.A N PRO 104.A O no hydrogen 2.914 N/A ASN 287.A ND2 THR 418.A OG1 no hydrogen 2.899 N/A VAL 288.A N TYR 415.A O no hydrogen 2.662 N/A ILE 289.A N ILE 106.A O no hydrogen 3.052 N/A PHE 290.A N VAL 413.A O no hydrogen 2.891 N/A VAL 291.A N PHE 108.A O no hydrogen 2.971 N/A GLY 292.A N VAL 411.A O no hydrogen 3.225 N/A HIS 294.A ND1 GLY 295.A O no hydrogen 2.914 N/A HIS 294.A NE2 THR 149.A OG1 no hydrogen 3.316 N/A MET 296.A N SER 407.A O no hydrogen 3.035 N/A GLU 297.A N ASP 398.A O no hydrogen 2.715 N/A ASP 298.A N GLU 297.A OE1 no hydrogen 2.689 N/A VAL 299.A N GLN 396.A O no hydrogen 3.255 N/A THR 300.A OG1 ASP 302.A OD2 no hydrogen 2.961 N/A ARG 303.A N THR 300.A O no hydrogen 3.094 N/A ARG 303.A NE ARG 385.A O no hydrogen 3.011 N/A THR 304.A OG1 CYS 301.A O no hydrogen 2.513 N/A GLU 305.A N HIS 387.A O no hydrogen 3.175 N/A LEU 307.A N ALA 389.A O no hydrogen 2.964 N/A SER 308.A N ARG 390.A O no hydrogen 2.972 N/A SER 308.A OG ARG 390.A O no hydrogen 3.565 N/A ASN 309.A N PHE 306.A O no hydrogen 3.228 N/A TYR 310.A N LEU 307.A O no hydrogen 2.728 N/A TYR 310.A OH GLU 305.A OE1 no hydrogen 2.631 N/A LEU 311.A N LEU 307.A O no hydrogen 2.988 N/A ASP 316.A N ASN 313.A O no hydrogen 3.472 N/A THR 318.A N ARG 328.A O no hydrogen 2.810 N/A VAL 320.A N ARG 326.A O no hydrogen 3.047 N/A GLY 322.A N VAL 388.A O no hydrogen 2.991 N/A THR 323.A OG1 HIS 399.A O no hydrogen 2.935 N/A GLY 325.A N LEU 380.A O no hydrogen 2.994 N/A ARG 326.A N VAL 320.A O no hydrogen 3.298 N/A ARG 326.A NE GLU 376.A OE1 no hydrogen 2.751 N/A ARG 326.A NH2 SER 171.A O no hydrogen 2.688 N/A ILE 327.A N ILE 378.A O no hydrogen 3.074 N/A ARG 328.A N THR 318.A O no hydrogen 3.291 N/A SER 329.A OG PHE 331.A O no hydrogen 2.626 N/A LYS 330.A N ASP 316.A O no hydrogen 3.333 N/A PHE 331.A N SER 329.A OG no hydrogen 3.087 N/A ASN 334.A ND2 ASP 316.A OD2 no hydrogen 2.740 N/A LYS 336.A N ASN 334.A OD1 no hydrogen 3.151 N/A TYR 337.A N ASN 334.A O no hydrogen 3.380 N/A LYS 340.A N ASP 338.A OD1 no hydrogen 3.290 N/A ILE 342.A N ASP 338.A O no hydrogen 3.149 N/A ILE 343.A N PRO 339.A O no hydrogen 3.084 N/A ALA 344.A N LYS 340.A O no hydrogen 3.123 N/A ASN 345.A N ALA 341.A O no hydrogen 2.813 N/A LEU 346.A N ILE 342.A O no hydrogen 3.003 N/A LEU 346.A N ILE 343.A O no hydrogen 2.970 N/A THR 347.A N ALA 344.A O no hydrogen 3.078 N/A THR 347.A OG1 ILE 343.A O no hydrogen 2.468 N/A CYS 348.A SG GLU 693.A O no hydrogen 4.023 N/A LYS 349.A N GLN 353.A OE1 no hydrogen 2.919 N/A LYS 350.A NZ GLU 305.A OE2 no hydrogen 3.282 N/A GLN 353.A NE2 LEU 346.A O no hydrogen 2.607 N/A GLN 353.A NE2 PHE 355.A O no hydrogen 3.274 N/A HIS 354.A N GLU 305.A OE2 no hydrogen 3.010 N/A HIS 354.A ND1 GLU 383.A OE2 no hydrogen 3.276 N/A LYS 356.A N LEU 381.A O no hydrogen 3.017 N/A LYS 356.A NZ GLU 694.A O no hydrogen 2.664 N/A TYR 358.A N HIS 379.A O no hydrogen 2.916 N/A TYR 358.A OH GLU 694.A OE1 no hydrogen 2.717 N/A LYS 360.A N ASP 377.A O no hydrogen 2.722 N/A LYS 360.A NZ ALA 370.A O no hydrogen 2.700 N/A LYS 360.A NZ ILE 375.A O no hydrogen 2.822 N/A GLN 361.A N GLN 361.A OE1 no hydrogen 2.620 N/A HIS 362.A N LEU 359.A O no hydrogen 2.836 N/A LEU 363.A N LYS 360.A O no hydrogen 3.185 N/A LYS 365.A NZ ASP 630.A OD2 no hydrogen 2.646 N/A ARG 366.A NE MET 712.A O no hydrogen 3.014 N/A ARG 366.A NH1 ASP 402.A OD1 no hydrogen 2.701 N/A ARG 366.A NH2 ASP 402.A OD1 no hydrogen 3.350 N/A ARG 366.A NH2 ASP 402.A OD2 no hydrogen 2.953 N/A ARG 366.A NH2 MET 712.A O no hydrogen 3.170 N/A LEU 367.A N PRO 364.A O no hydrogen 3.103 N/A HIS 368.A N LYS 365.A O no hydrogen 2.889 N/A HIS 368.A NE2 ASP 719.A OD1 no hydrogen 3.006 N/A TYR 369.A OH VAL 168.A O no hydrogen 2.797 N/A ALA 370.A N GLU 163.A OE2 no hydrogen 3.318 N/A ASN 371.A N GLU 163.A OE2 no hydrogen 3.060 N/A ASN 372.A N ALA 370.A O no hydrogen 2.734 N/A ASN 372.A ND2 GLU 163.A O no hydrogen 3.309 N/A ARG 373.A NE ASP 174.A OD1 no hydrogen 2.901 N/A ARG 373.A NE ASP 174.A OD2 no hydrogen 3.111 N/A ARG 373.A NH2 ASP 174.A OD2 no hydrogen 3.080 N/A ARG 374.A N ASN 372.A OD1 no hydrogen 2.709 N/A ARG 374.A NE ASP 174.A OD2 no hydrogen 2.947 N/A ILE 375.A N ASN 372.A O no hydrogen 2.852 N/A GLU 376.A N GLU 376.A OE1 no hydrogen 2.728 N/A HIS 379.A N TYR 358.A O no hydrogen 2.819 N/A HIS 379.A NE2 TYR 145.A OH no hydrogen 2.817 N/A LEU 380.A N GLY 325.A O no hydrogen 2.850 N/A LEU 381.A N LYS 356.A O no hydrogen 2.948 N/A GLU 383.A N HIS 354.A O no hydrogen 2.931 N/A ARG 384.A NH1.A GLU 750.A OE1 no hydrogen 2.922 N/A ARG 384.A NH2.A GLU 750.A OE1 no hydrogen 3.394 N/A TRP 386.A N GLU 383.A O no hydrogen 2.993 N/A HIS 387.A N ARG 303.A O no hydrogen 2.965 N/A HIS 387.A NE2 ASP 398.A OD2 no hydrogen 3.007 N/A VAL 388.A N GLY 322.A O no hydrogen 2.995 N/A ALA 389.A N GLU 305.A O no hydrogen 2.992 N/A ARG 390.A NE VAL 314.A O no hydrogen 3.125 N/A LYS 391.A NZ ASP 315.A OD1 no hydrogen 2.698 N/A CYS 393.A SG PHE 395.A O no hydrogen 4.013 N/A GLN 396.A N HIS 250.A O no hydrogen 2.722 N/A GLY 397.A N HIS 250.A O no hydrogen 2.938 N/A ASP 398.A N GLU 297.A O no hydrogen 2.887 N/A HIS 399.A N ASP 398.A OD1 no hydrogen 2.732 N/A HIS 399.A ND1 THR 147.A O no hydrogen 2.647 N/A ASN 403.A ND2 PRO 143.A O no hydrogen 2.733 N/A LYS 404.A N ASP 402.A OD1 no hydrogen 3.155 N/A LYS 404.A NZ LYS 711.A O no hydrogen 2.955 N/A VAL 405.A N ASP 402.A O no hydrogen 3.133 N/A SER 407.A OG GLU 297.A OE2 no hydrogen 2.742 N/A GLN 409.A N ASN 406.A O no hydrogen 2.811 N/A GLN 409.A NE2 ASN 403.A O no hydrogen 2.883 N/A GLN 409.A NE2 VAL 405.A O no hydrogen 2.696 N/A THR 410.A N MET 141.A O no hydrogen 2.930 N/A THR 410.A OG1 PHE 113.A O no hydrogen 2.721 N/A VAL 413.A N PHE 290.A O no hydrogen 2.819 N/A GLY 414.A N THR 136.A O no hydrogen 2.768 N/A TYR 415.A N VAL 288.A O no hydrogen 2.805 N/A SER 417.A OG ASN 287.A OD1 no hydrogen 3.478 N/A THR 418.A N ASN 287.A OD1 no hydrogen 3.033 N/A LYS 420.A N LEU 458.A O no hydrogen 3.061 N/A LYS 420.A NZ HIS 457.A O no hydrogen 3.210 N/A TYR 421.A OH CYS 88.A O no hydrogen 3.137 N/A LYS 422.A N CYS 134.A O no hydrogen 2.746 N/A THR 423.A N GLY 135.A O no hydrogen 3.234 N/A THR 423.A OG1 TYR 421.A O no hydrogen 2.936 N/A VAL 425.A N HIS 137.A O no hydrogen 2.799 N/A ASN 430.A N ARG 142.A O no hydrogen 2.982 N/A ASN 430.A ND2 ASN 152.A OD1 no hydrogen 3.071 N/A GLU 432.A N GLU 429.A O no hydrogen 2.806 N/A LEU 433.A N ASN 430.A O no hydrogen 3.371 N/A TYR 434.A OH THR 197.A OG1 no hydrogen 2.698 N/A MET 437.A N LEU 433.A O no hydrogen 2.863 N/A CYS 438.A N TYR 434.A O no hydrogen 3.072 N/A CYS 438.A SG TYR 434.A O no hydrogen 3.390 N/A ASP 439.A N ASN 435.A O no hydrogen 3.269 N/A LEU 440.A N VAL 436.A O no hydrogen 2.911 N/A LEU 441.A N CYS 438.A O no hydrogen 2.859 N/A GLY 442.A N ASP 439.A O no hydrogen 3.210 N/A LEU 443.A N CYS 438.A O no hydrogen 2.944 N/A LYS 444.A N GLN 201.A OE1 no hydrogen 2.954 N/A ALA 446.A N TYR 434.A OH no hydrogen 2.921 N/A ASN 448.A ND2 ASN 435.A OD1 no hydrogen 3.064 N/A ASN 448.A ND2 ALA 446.A O no hydrogen 2.786 N/A ASN 449.A N GLY 159.A O no hydrogen 2.812 N/A GLY 450.A N ASN 448.A OD1 no hydrogen 2.760 N/A THR 451.A N GLU 432.A OE1 no hydrogen 2.946 N/A HIS 452.A NE2 ASP 439.A OD1 no hydrogen 2.898 N/A SER 454.A N THR 451.A O no hydrogen 3.121 N/A SER 454.A OG GLU 432.A OE1 no hydrogen 3.083 N/A SER 454.A OG THR 451.A O no hydrogen 3.041 N/A ASN 456.A N GLY 453.A O no hydrogen 2.902 N/A ASN 456.A ND2 PHE 464.A O no hydrogen 2.901 N/A LEU 458.A N LEU 455.A O no hydrogen 3.368 N/A LEU 459.A N ASN 456.A O no hydrogen 2.967 N/A ARG 460.A N THR 418.A O no hydrogen 2.918 N/A ASN 462.A ND2 ASP 439.A O no hydrogen 3.368 N/A VAL 472.A N VAL 500.A O no hydrogen 2.963 N/A THR 473.A N VAL 500.A O no hydrogen 3.374 N/A THR 473.A OG1 TYR 502.A O no hydrogen 2.628 N/A ASN 476.A N TYR 506.A O no hydrogen 2.770 N/A MET 481.A N VAL 547.A O no hydrogen 3.239 N/A LEU 483.A N ASP 486.A OD2 no hydrogen 3.245 N/A ASP 486.A N LEU 483.A O no hydrogen 2.754 N/A PHE 487.A N GLN 484.A O no hydrogen 3.312 N/A ARG 497.A NH1 GLU 471.A OE1 no hydrogen 3.233 N/A ARG 497.A NH1 PRO 498.A O no hydrogen 3.483 N/A ARG 497.A NH2 GLU 471.A OE2 no hydrogen 3.109 N/A ALA 499.A N ASP 727.A O no hydrogen 3.052 N/A VAL 500.A N GLU 471.A OE1 no hydrogen 3.192 N/A LEU 501.A N SER 725.A O no hydrogen 2.838 N/A THR 504.A N THR 473.A OG1 no hydrogen 3.134 N/A ARG 505.A NH2 GLU 520.A OE1 no hydrogen 3.080 N/A TYR 506.A OH GLU 471.A OE1 no hydrogen 3.073 N/A ASP 507.A N TYR 518.A O no hydrogen 2.860 N/A ILE 508.A N ASN 476.A O no hydrogen 2.814 N/A LEU 509.A N SER 516.A O no hydrogen 2.808 N/A HIS 511.A N PHE 514.A O no hydrogen 3.009 N/A HIS 511.A ND1 PHE 514.A O no hydrogen 2.940 N/A GLU 515.A N SER 529.A O no hydrogen 2.981 N/A SER 516.A N LEU 509.A O no hydrogen 2.857 N/A GLY 517.A N TRP 527.A O no hydrogen 3.003 N/A TYR 518.A N ASP 507.A O no hydrogen 2.711 N/A TYR 518.A OH PHE 553.A O no hydrogen 2.484 N/A SER 519.A N MET 524.A O no hydrogen 2.790 N/A GLU 520.A N ARG 505.A O no hydrogen 2.904 N/A PHE 522.A N SER 519.A OG no hydrogen 3.416 N/A LEU 526.A N GLY 517.A O no hydrogen 2.711 N/A THR 528.A N SER 625.A O no hydrogen 2.802 N/A SER 529.A N GLU 515.A O no hydrogen 2.752 N/A SER 529.A OG HIS 492.A O no hydrogen 2.632 N/A TYR 530.A N VAL 623.A O no hydrogen 2.863 N/A THR 531.A N HIS 492.A ND1 no hydrogen 3.249 N/A THR 531.A OG1 ARG 491.A O no hydrogen 2.613 N/A VAL 532.A N VAL 621.A O no hydrogen 2.876 N/A CYS 542.A N LEU 539.A O no hydrogen 3.363 N/A CYS 542.A SG LEU 539.A O no hydrogen 3.582 N/A ARG 544.A N PHE 587.A O no hydrogen 2.973 N/A ARG 548.A N ASP 546.A OD1 no hydrogen 3.020 N/A ARG 548.A NE ASP 546.A OD1 no hydrogen 2.818 N/A ARG 548.A NH1 TYR 510.A O no hydrogen 2.986 N/A ARG 548.A NH2 HIS 511.A NE2 no hydrogen 3.346 N/A ARG 548.A NH2 ASP 546.A OD1 no hydrogen 3.337 N/A ARG 548.A NH2 ASP 546.A OD2 no hydrogen 2.720 N/A VAL 549.A N ASP 546.A O no hydrogen 3.167 N/A SER 552.A N SER 550.A OG no hydrogen 3.069 N/A PHE 553.A N SER 550.A O no hydrogen 2.992 N/A SER 554.A N PRO 551.A O no hydrogen 3.411 N/A SER 554.A OG VAL 549.A O no hydrogen 3.482 N/A SER 554.A OG SER 550.A O no hydrogen 2.950 N/A GLN 555.A NE2 LEU 523.A O no hydrogen 2.635 N/A GLN 555.A NE2 MET 592.A O no hydrogen 3.193 N/A ALA 559.A N ASN 556.A OD1 no hydrogen 3.125 N/A TYR 560.A OH GLN 555.A OE1 no hydrogen 2.672 N/A LYS 561.A N CYS 557.A O no hydrogen 3.204 N/A LYS 561.A N LEU 558.A O no hydrogen 2.973 N/A ASN 562.A N LEU 558.A O no hydrogen 2.973 N/A GLN 565.A N ASP 563.A OD1 no hydrogen 2.954 N/A MET 566.A N ASP 563.A OD1 no hydrogen 3.031 N/A SER 567.A N MET 595.A O no hydrogen 2.994 N/A TYR 568.A N SER 567.A OG no hydrogen 2.743 N/A TYR 568.A OH THR 540.A O no hydrogen 3.306 N/A GLY 569.A N VAL 593.A O no hydrogen 2.971 N/A LEU 571.A N ASN 591.A O no hydrogen 3.264 N/A PHE 572.A N ASN 591.A OD1 no hydrogen 3.306 N/A LEU 576.A N PRO 573.A O no hydrogen 2.914 N/A SER 577.A N PRO 574.A O no hydrogen 3.004 N/A SER 577.A OG PRO 574.A O no hydrogen 3.544 N/A SER 578.A N ASP 513.A OD2 no hydrogen 2.821 N/A SER 578.A OG ASP 513.A OD1 no hydrogen 2.903 N/A SER 578.A OG ASP 513.A OD2 no hydrogen 3.463 N/A SER 578.A OG SER 579.A OG no hydrogen 3.365 N/A SER 579.A OG SER 578.A OG no hydrogen 3.365 N/A LYS 583.A N SER 579.A O no hydrogen 3.018 N/A LYS 583.A N PRO 580.A O no hydrogen 3.382 N/A LYS 583.A NZ PRO 574.A O no hydrogen 3.324 N/A ASP 585.A N ALA 582.A O no hydrogen 2.989 N/A ALA 586.A N LYS 583.A O no hydrogen 3.117 N/A PHE 587.A N TYR 584.A O no hydrogen 3.179 N/A LEU 588.A N ASP 585.A O no hydrogen 3.164 N/A VAL 589.A N ARG 544.A O no hydrogen 2.804 N/A THR 590.A OG1 ASP 546.A OD2 no hydrogen 2.843 N/A ASN 591.A N LEU 588.A O no hydrogen 2.910 N/A ASN 591.A ND2 PHE 572.A O no hydrogen 2.798 N/A ASN 591.A ND2 ALA 586.A O no hydrogen 3.211 N/A VAL 593.A N GLY 569.A O no hydrogen 2.749 N/A MET 595.A N SER 567.A O no hydrogen 2.958 N/A TYR 596.A N HIS 688.A NE2 no hydrogen 3.138 N/A LYS 600.A N TYR 596.A O no hydrogen 3.039 N/A LYS 600.A NZ SER 567.A OG no hydrogen 2.976 N/A LYS 600.A NZ TYR 568.A O no hydrogen 2.805 N/A ARG 601.A NE GLU 702.A OE2 no hydrogen 3.182 N/A ARG 601.A NH1 SER 698.A O no hydrogen 2.858 N/A ARG 601.A NH1 GLU 702.A OE2 no hydrogen 3.483 N/A ARG 601.A NH2 SER 698.A O no hydrogen 2.865 N/A TRP 603.A N PHE 599.A O no hydrogen 2.865 N/A TRP 603.A NE1 PHE 570.A O no hydrogen 2.977 N/A ASN 604.A N LYS 600.A O no hydrogen 2.605 N/A TYR 605.A N ARG 601.A O no hydrogen 3.390 N/A PHE 606.A N VAL 602.A O no hydrogen 2.997 N/A GLN 607.A N TRP 603.A O no hydrogen 3.004 N/A GLN 607.A NE2 PHE 570.A O no hydrogen 3.056 N/A ARG 608.A N ASN 604.A O no hydrogen 2.893 N/A VAL 609.A N TYR 605.A O no hydrogen 2.706 N/A VAL 611.A N PHE 606.A O no hydrogen 3.117 N/A LYS 613.A N VAL 609.A O no hydrogen 3.352 N/A LYS 613.A NZ GLU 707.A OE2 no hydrogen 2.865 N/A TYR 614.A N LEU 610.A O no hydrogen 2.727 N/A ALA 615.A N VAL 611.A O no hydrogen 2.775 N/A SER 616.A N LYS 612.A O no hydrogen 2.986 N/A SER 616.A OG LYS 612.A O no hydrogen 2.863 N/A GLU 617.A N LYS 613.A O no hydrogen 2.836 N/A ARG 618.A N TYR 614.A O no hydrogen 2.910 N/A ARG 618.A NH1 ILE 662.A O no hydrogen 3.102 N/A ARG 618.A NH2 ILE 662.A O no hydrogen 3.306 N/A ASN 619.A N ALA 615.A O no hydrogen 2.851 N/A ASN 619.A ND2 PHE 668.A O no hydrogen 2.869 N/A GLY 620.A N ALA 615.A O no hydrogen 2.995 N/A VAL 621.A N VAL 532.A O no hydrogen 2.893 N/A ASN 622.A N THR 663.A O no hydrogen 2.781 N/A VAL 623.A N TYR 530.A O no hydrogen 2.957 N/A ILE 624.A N ILE 661.A O no hydrogen 3.013 N/A SER 625.A N THR 528.A O no hydrogen 2.969 N/A SER 625.A OG SER 660.A OG no hydrogen 2.787 N/A GLY 626.A N TYR 659.A O no hydrogen 3.263 N/A ILE 628.A N HIS 657.A O no hydrogen 3.119 N/A ASP 630.A N THR 656.A OG1 no hydrogen 3.128 N/A TYR 631.A N ASP 638.A OD2 no hydrogen 2.608 N/A TYR 631.A OH VAL 654.A O no hydrogen 2.361 N/A TYR 633.A N ASP 630.A O no hydrogen 2.903 N/A ASP 634.A N ASP 630.A OD1 no hydrogen 3.133 N/A GLY 635.A N ASP 630.A OD2 no hydrogen 2.929 N/A LEU 636.A N ASP 634.A OD1 no hydrogen 3.236 N/A HIS 637.A N HIS 722.A O no hydrogen 3.115 N/A ASP 638.A N PHE 629.A O no hydrogen 3.005 N/A LYS 642.A N THR 639.A O no hydrogen 3.080 N/A ILE 643.A N GLU 640.A O no hydrogen 3.459 N/A GLN 645.A NE2 TYR 596.A OH no hydrogen 2.605 N/A VAL 647.A N ILE 652.A O no hydrogen 2.940 N/A GLU 648.A N ASP 563.A OD2 no hydrogen 3.028 N/A SER 650.A OG VAL 647.A O no hydrogen 2.753 N/A ILE 652.A N SER 650.A OG no hydrogen 3.181 N/A VAL 654.A N GLN 645.A O no hydrogen 3.047 N/A THR 656.A N ILE 628.A O no hydrogen 3.010 N/A THR 656.A OG1 ILE 628.A O no hydrogen 3.439 N/A THR 656.A OG1 HIS 657.A ND1 no hydrogen 2.690 N/A HIS 657.A N ILE 628.A O no hydrogen 3.360 N/A HIS 657.A ND1 THR 656.A OG1 no hydrogen 2.690 N/A TYR 658.A N LEU 686.A O no hydrogen 2.889 N/A TYR 658.A OH PRO 594.A O no hydrogen 2.469 N/A TYR 659.A N GLY 626.A O no hydrogen 2.876 N/A TYR 659.A OH LEU 526.A O no hydrogen 2.870 N/A SER 660.A N PHE 684.A O no hydrogen 3.085 N/A SER 660.A OG SER 625.A OG no hydrogen 2.787 N/A SER 660.A OG TYR 659.A O no hydrogen 2.862 N/A ILE 661.A N ILE 624.A O no hydrogen 2.886 N/A ILE 662.A N SER 682.A O no hydrogen 2.809 N/A THR 663.A N ASN 622.A O no hydrogen 2.901 N/A SER 664.A N SER 680.A O no hydrogen 2.711 N/A SER 664.A OG ARG 618.A O no hydrogen 3.308 N/A SER 664.A OG CYS 665.A O no hydrogen 3.116 N/A LEU 666.A N PRO 678.A O no hydrogen 3.138 N/A THR 669.A N ASP 667.A OD1 no hydrogen 3.252 N/A THR 669.A OG1 ASP 667.A OD1 no hydrogen 2.656 N/A THR 669.A OG1 ASP 667.A OD2 no hydrogen 3.521 N/A GLN 670.A N ASP 667.A O no hydrogen 2.959 N/A GLN 670.A NE2 ASP 667.A OD2 no hydrogen 2.922 N/A ALA 672.A N ASN 619.A O no hydrogen 2.955 N/A LYS 674.A N PRO 671.A O no hydrogen 3.102 N/A SER 680.A N SER 664.A O no hydrogen 2.757 N/A SER 682.A N ILE 662.A O no hydrogen 2.972 N/A SER 683.A OG ALA 715.A O no hydrogen 2.812 N/A PHE 684.A N SER 660.A O no hydrogen 2.952 N/A ILE 685.A N HIS 713.A O no hydrogen 2.990 N/A LEU 686.A N TYR 658.A O no hydrogen 2.949 N/A HIS 688.A N THR 656.A O no hydrogen 2.864 N/A HIS 688.A ND1 PRO 655.A O no hydrogen 2.547 N/A ASN 692.A ND2 ALA 598.A O no hydrogen 3.247 N/A GLU 693.A N ASP 691.A OD1 no hydrogen 3.433 N/A SER 695.A N ASN 692.A O no hydrogen 3.215 N/A SER 698.A N SER 695.A O no hydrogen 3.396 N/A SER 698.A OG ASN 692.A O no hydrogen 3.535 N/A SER 698.A OG SER 695.A O no hydrogen 3.403 N/A GLU 700.A N ASN 697.A O no hydrogen 3.099 N/A GLU 702.A N GLU 702.A OE1 no hydrogen 2.746 N/A SER 703.A N ASP 701.A OD2 no hydrogen 2.879 N/A SER 703.A OG ASP 701.A OD2 no hydrogen 2.387 N/A LYS 704.A N ASP 701.A O no hydrogen 2.716 N/A TRP 705.A N GLU 702.A O no hydrogen 3.242 N/A TRP 705.A NE1 GLU 700.A O no hydrogen 3.224 N/A VAL 706.A N GLU 702.A O no hydrogen 3.121 N/A LEU 709.A N TRP 705.A O no hydrogen 3.384 N/A MET 710.A N VAL 706.A O no hydrogen 3.196 N/A LYS 711.A N GLU 707.A O no hydrogen 3.159 N/A MET 712.A N LEU 709.A O no hydrogen 3.109 N/A HIS 713.A N LEU 709.A O no hydrogen 3.248 N/A HIS 713.A N MET 710.A O no hydrogen 3.081 N/A HIS 713.A NE2 GLU 694.A OE1 no hydrogen 2.916 N/A THR 714.A OG1 SER 683.A O no hydrogen 3.549 N/A THR 714.A OG1 HIS 747.A O no hydrogen 2.668 N/A ALA 715.A N SER 683.A O no hydrogen 2.925 N/A ARG 716.A N ASP 719.A OD2 no hydrogen 3.108 N/A ARG 716.A NE ASP 719.A OD1 no hydrogen 3.409 N/A ARG 716.A NE ASP 719.A OD2 no hydrogen 3.492 N/A ARG 716.A NH2 ASP 719.A OD1 no hydrogen 3.052 N/A ARG 718.A N LYS 743.A O no hydrogen 3.143 N/A ARG 718.A NE GLU 721.A OE1 no hydrogen 3.004 N/A ASP 719.A N ARG 716.A O no hydrogen 3.232 N/A ILE 720.A N VAL 717.A O no hydrogen 2.799 N/A GLU 721.A N VAL 717.A O no hydrogen 3.117 N/A HIS 722.A N ARG 718.A O no hydrogen 3.143 N/A LEU 723.A N ASP 719.A O no hydrogen 3.213 N/A THR 724.A N ILE 720.A O no hydrogen 2.839 N/A THR 724.A OG1 ILE 720.A O no hydrogen 2.440 N/A PHE 728.A N GLU 721.A OE2 no hydrogen 3.047 N/A ARG 730.A NH1 PRO 469.A O no hydrogen 2.749 N/A ARG 730.A NH2 PRO 469.A O no hydrogen 3.146 N/A ARG 730.A NH2 ASP 727.A OD2 no hydrogen 2.709 N/A LYS 731.A N TYR 495.A O no hydrogen 3.123 N/A ARG 734.A N THR 732.A OG1 no hydrogen 3.281 N/A ARG 734.A NH1 GLU 738.A OE2 no hydrogen 2.992 N/A GLU 738.A N SER 735.A OG no hydrogen 3.247 N/A ILE 739.A N SER 735.A O no hydrogen 3.062 N/A LEU 740.A N TYR 736.A O no hydrogen 2.910 N/A THR 741.A N PRO 737.A O no hydrogen 3.143 N/A THR 741.A OG1 SER 454.A O no hydrogen 2.685 N/A THR 741.A OG1 PRO 737.A O no hydrogen 3.456 N/A LEU 742.A N GLU 738.A O no hydrogen 2.989 N/A LYS 743.A N ILE 739.A O no hydrogen 2.997 N/A LYS 743.A NZ GLU 721.A OE1 no hydrogen 3.525 N/A LYS 743.A NZ GLU 721.A OE2 no hydrogen 2.566 N/A LYS 743.A NZ ASP 727.A OD1 no hydrogen 2.972 N/A LYS 743.A NZ PHE 728.A O no hydrogen 3.096 N/A THR 744.A N LEU 740.A O no hydrogen 2.992 N/A THR 744.A OG1 THR 741.A O no hydrogen 3.183 N/A TYR 745.A N THR 741.A O no hydrogen 3.184 N/A TYR 745.A N LEU 742.A O no hydrogen 3.190 N/A