Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wsb_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N MET 2.A O no hydrogen 2.513 N/A LYS 6.A N MET 2.A O no hydrogen 3.292 N/A GLU 7.A N GLU 3.A O no hydrogen 2.914 N/A LEU 8.A N ARG 4.A O no hydrogen 2.892 N/A MET 9.A N ILE 5.A O no hydrogen 2.948 N/A GLU 10.A N LYS 6.A O no hydrogen 2.918 N/A MET 11.A N GLU 7.A O no hydrogen 2.870 N/A VAL 12.A N LEU 8.A O no hydrogen 2.819 N/A LYS 13.A N MET 9.A O no hydrogen 2.878 N/A ASN 14.A N MET 11.A O no hydrogen 2.868 N/A ARG 16.A N ASN 14.A OD1 no hydrogen 2.950 N/A MET 17.A N ASN 14.A O no hydrogen 3.278 N/A ARG 18.A N ASN 14.A O no hydrogen 2.957 N/A GLU 19.A N SER 15.A O no hydrogen 2.922 N/A LEU 21.A N MET 17.A O no hydrogen 2.788 N/A THR 22.A N ARG 18.A O no hydrogen 3.277 N/A THR 22.A OG1 ARG 18.A O no hydrogen 2.739 N/A THR 22.A OG1 GLU 19.A O no hydrogen 2.807 N/A THR 23.A N GLU 19.A O no hydrogen 2.898 N/A THR 23.A OG1 GLU 19.A O no hydrogen 2.530 N/A THR 23.A OG1 ILE 20.A O no hydrogen 3.342 N/A THR 24.A N ILE 20.A O no hydrogen 2.948 N/A THR 24.A OG1 ILE 20.A O no hydrogen 2.549 N/A HIS 28.A N SER 25.A OG no hydrogen 3.397 N/A MET 29.A N SER 25.A O no hydrogen 2.832 N/A ALA 30.A N ASP 27.A O no hydrogen 3.035 N/A VAL 31.A N HIS 28.A O no hydrogen 3.019 N/A ILE 32.A N HIS 28.A O no hydrogen 3.122 N/A LYS 33.A N MET 29.A O no hydrogen 3.082 N/A TYR 35.A N ILE 32.A O no hydrogen 3.431 N/A GLY 38.A N THR 36.A OG1 no hydrogen 2.932 N/A ASN 43.A N GLU 41.A OE2 no hydrogen 3.044 N/A LEU 46.A N ASN 43.A OD1 no hydrogen 2.965 N/A ARG 47.A N ASN 43.A O no hydrogen 2.942 N/A ARG 47.A NE GLU 41.A OE1 no hydrogen 3.171 N/A ARG 47.A NE GLU 41.A OE2 no hydrogen 3.228 N/A ARG 47.A NH2 GLU 41.A OE2 no hydrogen 3.282 N/A MET 48.A N PRO 44.A O no hydrogen 2.913 N/A LYS 49.A N ALA 45.A O no hydrogen 3.302 N/A TRP 50.A N LEU 46.A O no hydrogen 2.900 N/A MET 51.A N ARG 47.A O no hydrogen 2.693 N/A MET 52.A N MET 48.A O no hydrogen 2.858 N/A ALA 53.A N TRP 50.A O no hydrogen 3.301 N/A MET 54.A N MET 51.A O no hydrogen 2.888 N/A ILE 58.A N VAL 92.A O no hydrogen 3.229 N/A SER 59.A OG ASP 84.A OD2 no hydrogen 3.470 N/A ALA 60.A N VAL 90.A O no hydrogen 2.877 N/A ILE 64.A N SER 61.A O no hydrogen 2.928 N/A ARG 65.A N SER 62.A O no hydrogen 2.850 N/A ARG 65.A NH1 ASN 81.A OD1 no hydrogen 2.565 N/A GLU 66.A N ARG 63.A O no hydrogen 2.901 N/A MET 67.A N ARG 63.A O no hydrogen 2.983 N/A ILE 68.A N ILE 64.A O no hydrogen 2.925 N/A ASP 72.A N ASN 76.A O no hydrogen 2.986 N/A GLU 73.A N GLU 73.A OE1 no hydrogen 2.715 N/A GLY 75.A N ASP 72.A O no hydrogen 3.015 N/A LEU 78.A N GLU 70.A O no hydrogen 2.799 N/A TRP 79.A NE1 ILE 68.A O no hydrogen 2.877 N/A THR 80.A N LEU 91.A O no hydrogen 3.023 N/A THR 80.A OG1 THR 82.A OG1 no hydrogen 2.750 N/A THR 80.A OG1 LEU 91.A O no hydrogen 2.814 N/A THR 82.A OG1 THR 80.A OG1 no hydrogen 2.750 N/A LYS 83.A NZ ASN 88.A OD1 no hydrogen 3.074 N/A ASP 84.A N ARG 89.A O no hydrogen 2.521 N/A SER 87.A N ASP 84.A O no hydrogen 2.964 N/A VAL 90.A N ALA 60.A O no hydrogen 2.973 N/A LEU 91.A N THR 82.A O no hydrogen 2.953 N/A VAL 92.A N ILE 58.A O no hydrogen 2.609 N/A SER 93.A N LEU 78.A O no hydrogen 2.794 N/A ASN 95.A N SER 93.A OG no hydrogen 3.019 N/A ALA 96.A N SER 93.A O no hydrogen 2.867 N/A THR 98.A N PRO 94.A O no hydrogen 3.274 N/A THR 98.A OG1 PRO 94.A O no hydrogen 3.435 N/A TRP 99.A N ASN 95.A O no hydrogen 2.989 N/A TRP 100.A N ALA 96.A O no hydrogen 3.038 N/A ASN 101.A N VAL 97.A O no hydrogen 3.261 N/A ARG 102.A N TRP 99.A O no hydrogen 3.204 N/A ARG 102.A NH1 GLU 73.A OE1 no hydrogen 3.569 N/A ARG 102.A NH1 GLU 73.A OE2 no hydrogen 3.115 N/A ARG 102.A NH2 GLU 73.A OE1 no hydrogen 2.801 N/A GLY 104.A N TRP 100.A O no hydrogen 2.767 N/A SER 107.A OG ASP 108.A O no hydrogen 3.482 N/A TYR 112.A N VAL 109.A O no hydrogen 2.775 N/A TYR 112.A OH LYS 198.A O no hydrogen 2.551 N/A ARG 114.A N HIS 111.A O no hydrogen 2.950 N/A ARG 114.A NE HIS 111.A ND1 no hydrogen 3.035 N/A TYR 116.A N TYR 112.A O no hydrogen 2.903 N/A LYS 117.A NZ ASP 121.A OD2 no hydrogen 2.897 N/A TYR 119.A N TYR 116.A O no hydrogen 2.892 N/A PHE 120.A N TYR 116.A O no hydrogen 3.073 N/A ASP 121.A N LYS 117.A O no hydrogen 2.805 N/A ARG 122.A N TYR 119.A O no hydrogen 2.718 N/A LEU 123.A N TYR 119.A O no hydrogen 3.428 N/A GLU 124.A N PHE 120.A O no hydrogen 2.882 N/A ARG 125.A N ASP 121.A O no hydrogen 3.065 N/A ARG 125.A NH1 GLU 231.A OE2 no hydrogen 3.511 N/A LEU 126.A N ARG 122.A O no hydrogen 3.231 N/A THR 127.A N LEU 123.A O no hydrogen 2.715 N/A THR 127.A OG1 LEU 123.A O no hydrogen 2.820 N/A HIS 128.A N GLU 124.A O no hydrogen 3.234 N/A GLY 129.A N LEU 126.A O no hydrogen 2.908 N/A THR 130.A N THR 246.A O no hydrogen 2.877 N/A THR 130.A OG1 THR 246.A OG1 no hydrogen 2.916 N/A GLY 132.A N GLN 244.A O no hydrogen 2.773 N/A LYS 135.A N GLU 242.A O no hydrogen 2.970 N/A TYR 137.A N CYS 240.A O no hydrogen 2.793 N/A TYR 137.A OH GLU 242.A OE1 no hydrogen 2.416 N/A ASN 138.A ND2 SER 664.A O no hydrogen 3.259 N/A LYS 141.A NZ GLN 139.A O no hydrogen 2.948 N/A LYS 141.A NZ GLY 238.A O no hydrogen 2.739 N/A VAL 142.A N ILE 221.A O no hydrogen 2.923 N/A LYS 144.A N LEU 219.A O no hydrogen 2.913 N/A ARG 145.A NE THR 216.A OG1 no hydrogen 2.956 N/A VAL 146.A N ARG 217.A O no hydrogen 2.886 N/A ILE 148.A N ARG 215.A O no hydrogen 2.821 N/A ASN 149.A ND2 ARG 210.A O no hydrogen 2.545 N/A ASN 149.A ND2 GLU 211.A O no hydrogen 3.291 N/A ASN 149.A ND2 VAL 213.A O no hydrogen 3.019 N/A HIS 152.A NE2 ASP 147.A OD2 no hydrogen 2.757 N/A THR 156.A N GLU 159.A OE1 no hydrogen 3.419 N/A ALA 160.A N THR 156.A O no hydrogen 2.860 N/A GLN 161.A N SER 157.A O no hydrogen 2.789 N/A GLU 162.A N ARG 158.A O no hydrogen 2.877 N/A VAL 163.A N GLU 159.A O no hydrogen 3.438 N/A ILE 164.A N ALA 160.A O no hydrogen 2.834 N/A MET 165.A N GLN 161.A O no hydrogen 2.867 N/A GLU 166.A N GLU 162.A O no hydrogen 2.974 N/A VAL 167.A N VAL 163.A O no hydrogen 3.123 N/A VAL 168.A N ILE 164.A O no hydrogen 2.994 N/A PHE 169.A N MET 165.A O no hydrogen 2.781 N/A SER 179.A N GLN 183.A OE1 no hydrogen 3.276 N/A SER 180.A OG SER 179.A O no hydrogen 2.831 N/A GLN 183.A NE2 GLU 162.A OE1 no hydrogen 2.980 N/A LEU 184.A N SER 180.A O no hydrogen 2.910 N/A THR 185.A N ASP 181.A O no hydrogen 2.817 N/A THR 185.A OG1 ASP 181.A O no hydrogen 2.466 N/A THR 185.A OG1 ALA 182.A O no hydrogen 3.551 N/A THR 187.A N GLN 183.A O no hydrogen 2.823 N/A THR 187.A OG1 GLN 183.A O no hydrogen 2.811 N/A LYS 188.A N LEU 184.A O no hydrogen 2.888 N/A GLU 189.A N THR 185.A O no hydrogen 2.799 N/A LYS 190.A N ILE 186.A O no hydrogen 2.786 N/A LYS 190.A NZ GLU 211.A OE1 no hydrogen 3.377 N/A LYS 190.A NZ GLU 211.A OE2 no hydrogen 2.658 N/A LYS 191.A N THR 187.A O no hydrogen 2.811 N/A GLU 192.A N LYS 188.A O no hydrogen 2.825 N/A GLU 193.A N GLU 189.A O no hydrogen 2.773 N/A LEU 194.A N LYS 190.A O no hydrogen 2.903 N/A LYS 195.A N GLU 192.A O no hydrogen 3.377 N/A ILE 202.A N SER 200.A OG no hydrogen 3.247 N/A MET 203.A N SER 200.A O no hydrogen 3.079 N/A VAL 204.A N SER 200.A O no hydrogen 3.286 N/A ALA 205.A N PRO 201.A O no hydrogen 2.792 N/A TYR 206.A N ILE 202.A O no hydrogen 2.914 N/A MET 207.A N MET 203.A O no hydrogen 2.766 N/A LEU 208.A N VAL 204.A O no hydrogen 2.976 N/A GLU 209.A N ALA 205.A O no hydrogen 2.847 N/A ARG 210.A N TYR 206.A O no hydrogen 2.978 N/A GLU 211.A N MET 207.A O no hydrogen 2.817 N/A GLU 211.A N LEU 208.A O no hydrogen 3.134 N/A LEU 212.A N LEU 208.A O no hydrogen 2.873 N/A ARG 214.A NH1 ASP 154.A OD2 no hydrogen 2.963 N/A ARG 215.A NH2 ARG 210.A O no hydrogen 2.855 N/A ARG 217.A N VAL 146.A O no hydrogen 2.935 N/A LEU 219.A N LYS 144.A O no hydrogen 2.922 N/A ILE 221.A N VAL 142.A O no hydrogen 3.024 N/A ALA 222.A N GLN 237.A OE1 no hydrogen 2.942 N/A THR 225.A N GLU 518.A O no hydrogen 3.194 N/A THR 225.A OG1 GLU 518.A O no hydrogen 3.193 N/A SER 226.A N LYS 519.A O no hydrogen 3.010 N/A TYR 229.A N SER 226.A O no hydrogen 2.949 N/A VAL 230.A N SER 226.A O no hydrogen 2.879 N/A GLU 231.A N SER 227.A O no hydrogen 2.897 N/A VAL 232.A N TYR 229.A O no hydrogen 3.072 N/A LEU 233.A N VAL 230.A O no hydrogen 3.313 N/A LEU 235.A N VAL 232.A O no hydrogen 3.069 N/A THR 236.A N VAL 232.A O no hydrogen 2.965 N/A THR 236.A N LEU 233.A O no hydrogen 3.120 N/A THR 236.A OG1 VAL 232.A O no hydrogen 2.921 N/A THR 236.A OG1 LEU 233.A O no hydrogen 3.457 N/A GLN 237.A N LEU 233.A O no hydrogen 2.958 N/A GLN 237.A NE2 PRO 220.A O no hydrogen 3.029 N/A GLY 238.A N TRP 241.A O no hydrogen 2.949 N/A GLU 242.A N LYS 135.A O no hydrogen 2.814 N/A GLN 243.A N THR 236.A O no hydrogen 2.752 N/A GLN 243.A NE2 GLY 132.A O no hydrogen 3.138 N/A GLN 243.A NE2 GLN 244.A O no hydrogen 3.042 N/A GLN 244.A N PRO 133.A O no hydrogen 3.312 N/A THR 246.A N THR 130.A O no hydrogen 2.994 N/A THR 246.A OG1 THR 130.A O no hydrogen 3.326 N/A THR 246.A OG1 THR 130.A OG1 no hydrogen 2.916 N/A GLY 248.A N ARG 125.A O no hydrogen 2.861 N/A LEU 256.A N GLU 252.A O no hydrogen 2.763 N/A ASP 257.A N ASN 253.A O no hydrogen 2.760 N/A GLN 258.A N ASP 254.A O no hydrogen 2.979 N/A GLN 258.A NE2 GLN 517.A O no hydrogen 3.169 N/A THR 259.A N ASP 255.A O no hydrogen 2.936 N/A THR 259.A OG1 LEU 520.A O no hydrogen 3.227 N/A LEU 260.A N LEU 256.A O no hydrogen 2.923 N/A ILE 261.A N ASP 257.A O no hydrogen 3.277 N/A ILE 262.A N GLN 258.A O no hydrogen 3.406 N/A ALA 263.A N THR 259.A O no hydrogen 2.906 N/A SER 264.A N LEU 260.A O no hydrogen 2.994 N/A SER 264.A OG LEU 260.A O no hydrogen 2.843 N/A ARG 265.A N ILE 261.A O no hydrogen 2.996 N/A ARG 265.A NE GLU 306.A OE2 no hydrogen 2.913 N/A ARG 265.A NH2 GLU 306.A OE2 no hydrogen 3.456 N/A ASN 266.A N ILE 262.A O no hydrogen 3.113 N/A ASN 266.A ND2 TYR 524.A OH no hydrogen 3.378 N/A ILE 267.A N ALA 263.A O no hydrogen 2.841 N/A VAL 268.A N SER 264.A O no hydrogen 2.806 N/A ARG 269.A N ARG 265.A O no hydrogen 2.868 N/A ARG 269.A NE ARG 265.A O no hydrogen 3.190 N/A ARG 269.A NH1 ALA 514.A O no hydrogen 3.383 N/A ARG 269.A NH2 ASN 266.A OD1 no hydrogen 2.966 N/A ARG 270.A N ASN 266.A O no hydrogen 2.875 N/A ARG 270.A NE LEU 528.A O no hydrogen 2.721 N/A ARG 270.A NH1 ARG 270.A O no hydrogen 3.290 N/A ARG 270.A NH1 GLU 571.A OE1 no hydrogen 2.725 N/A ARG 270.A NH2 LEU 528.A O no hydrogen 3.112 N/A ARG 270.A NH2 GLU 571.A OE1 no hydrogen 2.961 N/A SER 271.A N ILE 267.A O no hydrogen 2.844 N/A SER 271.A OG ILE 267.A O no hydrogen 2.830 N/A ILE 272.A N VAL 268.A O no hydrogen 2.942 N/A VAL 273.A N ARG 270.A O no hydrogen 3.052 N/A ALA 274.A N SER 271.A O no hydrogen 3.061 N/A LEU 278.A N LYS 493.A O no hydrogen 2.876 N/A ALA 279.A N ASP 276.A OD1 no hydrogen 3.136 N/A SER 280.A N ASP 276.A O no hydrogen 2.974 N/A SER 280.A OG ASP 276.A O no hydrogen 3.228 N/A LEU 281.A N PRO 277.A O no hydrogen 2.757 N/A LEU 282.A N LEU 278.A O no hydrogen 3.173 N/A SER 283.A N ALA 279.A O no hydrogen 3.289 N/A MET 284.A N SER 280.A O no hydrogen 3.178 N/A CYS 285.A N LEU 281.A O no hydrogen 2.857 N/A CYS 285.A SG LEU 281.A O no hydrogen 3.243 N/A HIS 286.A N LEU 282.A O no hydrogen 3.031 N/A THR 287.A N SER 283.A O no hydrogen 2.927 N/A THR 287.A OG1 SER 283.A O no hydrogen 3.071 N/A THR 287.A OG1 MET 284.A O no hydrogen 3.040 N/A THR 288.A N MET 284.A O no hydrogen 2.721 N/A THR 288.A OG1 MET 284.A O no hydrogen 2.531 N/A SER 289.A N ASN 523.A O no hydrogen 2.792 N/A SER 289.A OG GLU 293.A O no hydrogen 3.278 N/A ILE 290.A N GLU 293.A O no hydrogen 2.850 N/A SER 291.A N PRO 521.A O no hydrogen 2.816 N/A SER 292.A OG SER 291.A O no hydrogen 2.277 N/A GLU 293.A N ILE 290.A O no hydrogen 2.899 N/A LEU 295.A N THR 288.A O no hydrogen 3.353 N/A ILE 298.A N PRO 294.A O no hydrogen 3.045 N/A LEU 299.A N LEU 295.A O no hydrogen 2.953 N/A ARG 300.A N VAL 296.A O no hydrogen 2.856 N/A SER 301.A N ILE 298.A O no hydrogen 2.963 N/A SER 301.A OG GLU 297.A O no hydrogen 3.128 N/A SER 301.A OG ILE 298.A O no hydrogen 3.206 N/A ASN 302.A ND2 ASP 257.A OD1 no hydrogen 2.982 N/A THR 304.A N ASN 302.A OD1 no hydrogen 2.977 N/A THR 304.A OG1 ASN 302.A OD1 no hydrogen 2.406 N/A VAL 309.A N GLU 306.A OE1 no hydrogen 2.908 N/A ASN 310.A N GLU 306.A O no hydrogen 2.725 N/A ASN 310.A ND2 ASP 305.A OD1 no hydrogen 2.823 N/A ILE 311.A N GLN 307.A O no hydrogen 2.991 N/A CYS 312.A N ALA 308.A O no hydrogen 3.047 N/A CYS 312.A SG ALA 308.A O no hydrogen 3.618 N/A LYS 313.A N VAL 309.A O no hydrogen 2.817 N/A LYS 313.A NZ ASN 302.A O no hydrogen 2.740 N/A LYS 313.A NZ THR 304.A O no hydrogen 2.974 N/A ALA 314.A N ASN 310.A O no hydrogen 2.782 N/A ALA 315.A N ILE 311.A O no hydrogen 2.987 N/A LEU 316.A N CYS 312.A O no hydrogen 2.893 N/A GLY 317.A N ALA 314.A O no hydrogen 3.223 N/A ASN 321.A ND2 PRO 303.A O no hydrogen 3.068 N/A ASN 322.A N ILE 320.A O no hydrogen 2.914 N/A PHE 324.A N PHE 331.A O no hydrogen 2.867 N/A PHE 326.A N TYR 329.A O no hydrogen 2.771 N/A GLY 327.A N TYR 433.A OH no hydrogen 3.459 N/A TYR 329.A N PHE 326.A O no hydrogen 3.092 N/A ASN 330.A N SER 367.A O no hydrogen 2.775 N/A PHE 331.A N PHE 324.A O no hydrogen 2.800 N/A LYS 332.A N ASN 365.A O no hydrogen 3.089 N/A ARG 333.A N ASN 322.A O no hydrogen 3.201 N/A ARG 333.A NH1 ASP 305.A OD2 no hydrogen 2.759 N/A ARG 333.A NH2 ASP 305.A OD1 no hydrogen 3.330 N/A ARG 333.A NH2 ASP 305.A OD2 no hydrogen 3.109 N/A VAL 334.A N GLU 363.A O no hydrogen 2.833 N/A SER 338.A OG ASP 305.A OD2 no hydrogen 3.520 N/A GLN 339.A N SER 337.A O no hydrogen 3.055 N/A ARG 340.A NH2 ASP 305.A O no hydrogen 3.552 N/A THR 341.A N ILE 357.A O no hydrogen 2.687 N/A THR 341.A OG1 GLU 359.A OE1 no hydrogen 2.965 N/A THR 341.A OG1 GLU 359.A OE2 no hydrogen 3.315 N/A LYS 343.A N MET 355.A O no hydrogen 2.881 N/A VAL 345.A N LEU 353.A O no hydrogen 2.906 N/A THR 347.A N GLN 351.A O no hydrogen 2.833 N/A THR 347.A OG1 GLN 351.A O no hydrogen 3.441 N/A ASN 349.A N THR 347.A OG1 no hydrogen 3.289 N/A LEU 350.A N THR 347.A O no hydrogen 2.955 N/A GLN 351.A N THR 347.A OG1 no hydrogen 2.974 N/A LEU 353.A N VAL 345.A O no hydrogen 2.833 N/A MET 355.A N LYS 343.A O no hydrogen 2.703 N/A THR 356.A OG1 THR 356.A O no hydrogen 2.545 N/A PHE 358.A N GLN 407.A OE1 no hydrogen 3.309 N/A GLU 359.A N GLN 339.A O no hydrogen 2.700 N/A TYR 361.A OH GLU 363.A OE2 no hydrogen 2.896 N/A GLU 362.A N LYS 377.A O no hydrogen 2.765 N/A GLU 363.A N LYS 335.A O no hydrogen 2.887 N/A PHE 364.A N LEU 375.A O no hydrogen 2.727 N/A ASN 365.A N LYS 332.A O no hydrogen 2.788 N/A VAL 366.A N ALA 373.A O no hydrogen 2.685 N/A SER 367.A N ASN 330.A O no hydrogen 2.990 N/A GLY 368.A N ALA 371.A O no hydrogen 2.995 N/A ALA 371.A N GLY 368.A O no hydrogen 3.062 N/A SER 372.A N GLY 388.A O no hydrogen 2.737 N/A ALA 373.A N VAL 366.A O no hydrogen 2.584 N/A VAL 374.A N ILE 386.A O no hydrogen 2.950 N/A LEU 375.A N PHE 364.A O no hydrogen 2.822 N/A LYS 376.A N GLN 384.A O no hydrogen 2.719 N/A LYS 377.A N GLU 362.A O no hydrogen 2.762 N/A GLY 378.A N ARG 381.A O no hydrogen 2.852 N/A ARG 381.A N GLY 378.A O no hydrogen 3.055 N/A ILE 383.A N LYS 376.A O no hydrogen 2.971 N/A GLN 384.A N LYS 376.A O no hydrogen 3.188 N/A ALA 385.A N GLY 478.A O no hydrogen 2.868 N/A ILE 386.A N VAL 374.A O no hydrogen 2.973 N/A ILE 387.A N ARG 480.A O no hydrogen 2.759 N/A GLY 388.A N SER 372.A O no hydrogen 2.821 N/A GLY 389.A N GLN 483.A OE1 no hydrogen 3.355 N/A ARG 390.A N ARG 370.A O no hydrogen 2.866 N/A THR 391.A OG1 ASP 394.A OD2 no hydrogen 3.481 N/A ILE 395.A N THR 391.A O no hydrogen 2.851 N/A LEU 396.A N LEU 392.A O no hydrogen 2.816 N/A ASN 397.A N GLU 393.A O no hydrogen 2.807 N/A LEU 398.A N ASP 394.A O no hydrogen 3.290 N/A MET 399.A N ILE 395.A O no hydrogen 2.835 N/A ILE 400.A N LEU 396.A O no hydrogen 2.967 N/A THR 401.A N ASN 397.A O no hydrogen 3.006 N/A THR 401.A OG1 ASN 397.A O no hydrogen 2.884 N/A LEU 402.A N LEU 398.A O no hydrogen 2.838 N/A MET 403.A N MET 399.A O no hydrogen 2.755 N/A VAL 404.A N ILE 400.A O no hydrogen 2.928 N/A PHE 405.A N THR 401.A O no hydrogen 3.100 N/A SER 406.A N LEU 402.A O no hydrogen 2.886 N/A SER 406.A OG MET 403.A O no hydrogen 2.489 N/A GLN 407.A N VAL 404.A O no hydrogen 2.963 N/A LYS 410.A NZ GLU 408.A OE2 no hydrogen 3.150 N/A LYS 410.A NZ TRP 450.A O no hydrogen 3.244 N/A LYS 413.A N GLU 409.A O no hydrogen 2.715 N/A LYS 413.A NZ GLU 409.A OE1 no hydrogen 3.198 N/A ALA 414.A N LYS 410.A O no hydrogen 2.959 N/A VAL 415.A N LEU 412.A O no hydrogen 3.012 N/A PHE 421.A N GLN 434.A OE1 no hydrogen 3.026 N/A ASN 423.A N GLN 427.A O no hydrogen 2.392 N/A GLN 427.A N ASN 423.A O no hydrogen 3.017 N/A ARG 428.A NH1 ASN 420.A OD1 no hydrogen 2.455 N/A TYR 433.A N ASN 430.A OD1 no hydrogen 3.020 N/A GLN 434.A N ASN 430.A O no hydrogen 2.831 N/A GLN 434.A NE2 PHE 421.A O no hydrogen 2.888 N/A GLN 434.A NE2 LEU 429.A O no hydrogen 3.071 N/A LEU 435.A N PRO 431.A O no hydrogen 2.863 N/A LEU 436.A N MET 432.A O no hydrogen 3.317 N/A ARG 437.A N TYR 433.A O no hydrogen 2.863 N/A ARG 437.A NH1 GLN 440.A OE1 no hydrogen 2.753 N/A HIS 438.A N GLN 434.A O no hydrogen 3.068 N/A PHE 439.A N LEU 435.A O no hydrogen 3.211 N/A GLN 440.A N LEU 436.A O no hydrogen 2.770 N/A LYS 441.A N HIS 438.A O no hydrogen 2.865 N/A ASP 442.A N HIS 438.A O no hydrogen 2.905 N/A SER 444.A N ASP 442.A OD1 no hydrogen 3.393 N/A SER 444.A OG ASP 442.A OD1 no hydrogen 2.558 N/A SER 444.A OG ASP 442.A OD2 no hydrogen 3.179 N/A ASN 449.A N THR 445.A O no hydrogen 2.863 N/A TRP 450.A NE1 MET 477.A O no hydrogen 2.783 N/A GLU 453.A N THR 475.A O no hydrogen 2.739 N/A ILE 455.A N THR 473.A O no hydrogen 2.742 N/A ILE 461.A N ILE 458.A O no hydrogen 2.971 N/A ALA 462.A N LEU 481.A O no hydrogen 2.903 N/A GLY 463.A N ASN 471.A O no hydrogen 2.747 N/A ILE 464.A N THR 475.A OG1 no hydrogen 3.357 N/A MET 465.A N THR 469.A O no hydrogen 2.811 N/A GLY 468.A N MET 465.A O no hydrogen 2.995 N/A THR 469.A N ASP 467.A OD1 no hydrogen 2.864 N/A THR 469.A OG1 ASP 467.A OD1 no hydrogen 2.952 N/A THR 469.A OG1 ASP 467.A OD2 no hydrogen 3.131 N/A ASN 471.A N GLY 463.A O no hydrogen 2.878 N/A LYS 472.A NZ ILE 458.A O no hydrogen 3.228 N/A LYS 472.A NZ ILE 461.A O no hydrogen 3.491 N/A THR 473.A N ASN 471.A OD1 no hydrogen 2.852 N/A THR 473.A OG1 ASN 471.A OD1 no hydrogen 3.464 N/A GLN 474.A N ASN 471.A OD1 no hydrogen 3.017 N/A GLN 474.A NE2 GLU 454.A OE1 no hydrogen 3.444 N/A THR 475.A N GLU 453.A O no hydrogen 3.009 N/A THR 475.A OG1 LEU 476.A O no hydrogen 3.377 N/A THR 475.A OG1 VAL 479.A O no hydrogen 2.566 N/A LEU 476.A N ILE 464.A O no hydrogen 2.944 N/A MET 477.A N GLY 451.A O no hydrogen 2.923 N/A GLY 478.A N GLU 453.A OE2 no hydrogen 2.430 N/A VAL 479.A N LEU 476.A O no hydrogen 3.013 N/A ARG 480.A N ALA 385.A O no hydrogen 2.690 N/A ARG 480.A NH1 VAL 479.A O no hydrogen 3.085 N/A ARG 480.A NH2 GLU 453.A OE1 no hydrogen 3.113 N/A LEU 481.A N ALA 462.A O no hydrogen 2.762 N/A SER 482.A N ILE 387.A O no hydrogen 2.772 N/A SER 482.A OG GLY 460.A O no hydrogen 2.864 N/A GLN 483.A NE2 GLY 389.A O no hydrogen 3.263 N/A ASN 490.A N ARG 498.A O no hydrogen 2.796 N/A ASP 492.A N ARG 496.A O no hydrogen 3.270 N/A LYS 493.A NZ TYR 494.A OH no hydrogen 3.154 N/A LEU 495.A N ASP 492.A O no hydrogen 2.961 N/A ARG 496.A N ASP 492.A OD1 no hydrogen 2.753 N/A VAL 497.A N ILE 506.A O no hydrogen 2.952 N/A ARG 498.A N ASN 490.A O no hydrogen 2.762 N/A ARG 498.A NH2 ASP 492.A OD2 no hydrogen 3.370 N/A ASN 499.A N GLU 503.A O no hydrogen 2.929 N/A ASN 499.A ND2 GLU 503.A OE1 no hydrogen 3.010 N/A GLY 502.A N ASN 499.A O no hydrogen 2.894 N/A GLU 503.A N ASN 499.A OD1 no hydrogen 2.640 N/A LEU 505.A N VAL 497.A O no hydrogen 2.737 N/A ILE 506.A N VAL 497.A O no hydrogen 3.263 N/A GLU 509.A N SER 507.A OG no hydrogen 3.428 N/A GLU 510.A N SER 507.A O no hydrogen 2.833 N/A VAL 511.A N PRO 508.A O no hydrogen 3.337 N/A ALA 514.A N SER 512.A O no hydrogen 2.851 N/A GLN 515.A NE2 ASN 632.A O no hydrogen 3.333 N/A GLN 517.A NE2 ILE 221.A O no hydrogen 3.279 N/A GLN 517.A NE2 GLY 223.A O no hydrogen 3.308 N/A GLU 518.A N GLU 518.A OE2 no hydrogen 2.875 N/A LYS 519.A N GLN 258.A OE1 no hydrogen 3.033 N/A ASN 523.A N SER 289.A O no hydrogen 2.784 N/A LEU 528.A N SER 526.A OG no hydrogen 3.071 N/A MET 529.A N SER 526.A O no hydrogen 3.298 N/A ASN 533.A ND2 ILE 522.A O no hydrogen 3.357 N/A GLU 536.A N GLU 536.A OE1 no hydrogen 2.812 N/A SER 537.A OG VAL 532.A O no hydrogen 3.186 N/A ILE 538.A N GLY 534.A O no hydrogen 3.417 N/A LEU 539.A N PRO 535.A O no hydrogen 2.982 N/A THR 540.A N GLU 536.A O no hydrogen 2.971 N/A THR 540.A OG1 GLU 536.A O no hydrogen 3.113 N/A THR 540.A OG1 SER 537.A O no hydrogen 2.944 N/A ASN 541.A N SER 537.A O no hydrogen 2.897 N/A THR 542.A N ILE 538.A O no hydrogen 3.004 N/A THR 542.A OG1 ILE 538.A O no hydrogen 2.427 N/A TYR 543.A N LEU 539.A O no hydrogen 2.885 N/A TYR 543.A OH LYS 610.A O no hydrogen 2.771 N/A HIS 544.A N THR 540.A O no hydrogen 2.717 N/A HIS 544.A ND1 VAL 665.A O no hydrogen 3.028 N/A TRP 545.A N ASN 541.A O no hydrogen 2.806 N/A ILE 546.A N THR 542.A O no hydrogen 3.367 N/A ILE 547.A N TYR 543.A O no hydrogen 3.408 N/A LYS 548.A N HIS 544.A O no hydrogen 2.915 N/A ASN 549.A N TRP 545.A O no hydrogen 3.051 N/A ASN 549.A ND2 TRP 545.A O no hydrogen 2.880 N/A TRP 550.A N ILE 547.A O no hydrogen 3.364 N/A LEU 553.A N ASN 549.A O no hydrogen 3.229 N/A LEU 553.A N TRP 550.A O no hydrogen 2.868 N/A LYS 554.A N TRP 550.A O no hydrogen 2.800 N/A LYS 554.A NZ GLU 551.A OE1 no hydrogen 3.241 N/A THR 555.A N GLU 551.A O no hydrogen 3.448 N/A THR 555.A OG1 GLU 551.A O no hydrogen 3.533 N/A THR 555.A OG1 LEU 552.A O no hydrogen 3.150 N/A TRP 557.A N LEU 553.A O no hydrogen 2.777 N/A MET 558.A N THR 555.A O no hydrogen 2.910 N/A THR 559.A N THR 555.A O no hydrogen 2.806 N/A THR 559.A OG1 THR 555.A O no hydrogen 3.133 N/A THR 562.A OG1 ASP 560.A OD1 no hydrogen 3.189 N/A TYR 565.A N PRO 561.A O no hydrogen 2.910 N/A ASN 566.A N VAL 563.A O no hydrogen 3.058 N/A ARG 567.A N LEU 564.A O no hydrogen 3.371 N/A ARG 567.A NH2 GLN 556.A OE1 no hydrogen 3.164 N/A PHE 570.A N ARG 567.A O no hydrogen 3.026 N/A GLN 574.A N GLU 571.A O no hydrogen 3.007 N/A GLN 574.A NE2 PRO 613.A O no hydrogen 3.067 N/A THR 575.A OG1 PRO 572.A O no hydrogen 2.558 N/A LEU 576.A N PHE 573.A O no hydrogen 3.028 N/A ILE 577.A N GLN 574.A O no hydrogen 2.858 N/A ASN 581.A N PRO 578.A O no hydrogen 3.064 N/A ARG 582.A NE GLN 574.A O no hydrogen 3.086 N/A ARG 582.A NE ILE 577.A O no hydrogen 3.166 N/A ARG 582.A NH2 GLN 574.A O no hydrogen 3.019 N/A ARG 582.A NH2 ILE 577.A O no hydrogen 3.089 N/A TYR 585.A N ASN 581.A O no hydrogen 2.747 N/A TYR 585.A OH THR 630.A OG1 no hydrogen 3.004 N/A SER 586.A N ARG 582.A O no hydrogen 2.841 N/A SER 586.A OG ARG 582.A O no hydrogen 3.100 N/A SER 586.A OG ALA 583.A O no hydrogen 2.913 N/A SER 586.A OG HIS 617.A O no hydrogen 2.820 N/A GLY 587.A N ALA 583.A O no hydrogen 2.818 N/A PHE 588.A N ILE 584.A O no hydrogen 2.812 N/A THR 589.A N TYR 585.A O no hydrogen 2.767 N/A THR 589.A OG1 TYR 585.A O no hydrogen 2.627 N/A ARG 590.A N SER 586.A O no hydrogen 2.745 N/A ARG 590.A NE SER 615.A O no hydrogen 3.356 N/A ARG 590.A NH2 SER 615.A O no hydrogen 3.359 N/A THR 591.A N GLY 587.A O no hydrogen 3.046 N/A THR 591.A OG1 GLY 587.A O no hydrogen 2.822 N/A THR 591.A OG1 PHE 588.A O no hydrogen 2.872 N/A LEU 592.A N PHE 588.A O no hydrogen 3.183 N/A PHE 593.A N THR 589.A O no hydrogen 2.869 N/A GLN 594.A N ARG 590.A O no hydrogen 2.938 N/A GLN 594.A NE2 GLN 594.A O no hydrogen 3.291 N/A GLN 594.A NE2 ASP 598.A OD1 no hydrogen 2.684 N/A GLN 595.A N THR 591.A O no hydrogen 2.883 N/A GLN 595.A NE2 LEU 684.A O no hydrogen 2.853 N/A GLN 595.A NE2 PHE 687.A O no hydrogen 3.640 N/A MET 596.A N LEU 592.A O no hydrogen 3.269 N/A ARG 597.A N PHE 593.A O no hydrogen 3.163 N/A ARG 597.A N GLN 594.A O no hydrogen 3.065 N/A ARG 597.A NE TRP 557.A O no hydrogen 3.032 N/A ARG 597.A NH2 TRP 557.A O no hydrogen 3.218 N/A ARG 597.A NH2 TYR 565.A OH no hydrogen 2.741 N/A ASP 598.A N GLN 594.A O no hydrogen 2.765 N/A VAL 599.A N GLN 595.A O no hydrogen 2.885 N/A THR 602.A OG1 VAL 599.A O no hydrogen 2.770 N/A THR 602.A OG1 SER 681.A OG no hydrogen 2.860 N/A GLN 607.A N ASP 604.A OD1 no hydrogen 3.188 N/A GLN 607.A NE2 ILE 642.A O no hydrogen 2.777 N/A GLN 607.A NE2 ALA 682.A O no hydrogen 3.350 N/A ILE 608.A N ASP 604.A O no hydrogen 2.861 N/A ILE 609.A N SER 605.A O no hydrogen 2.652 N/A LYS 610.A N ILE 606.A O no hydrogen 2.825 N/A LYS 610.A NZ GLN 607.A OE1 no hydrogen 2.727 N/A LYS 610.A NZ ILE 642.A O no hydrogen 2.659 N/A LYS 610.A NZ GLY 644.A O no hydrogen 3.210 N/A LEU 611.A N GLN 607.A O no hydrogen 3.211 N/A LEU 612.A N ILE 608.A O no hydrogen 2.832 N/A PHE 614.A N LEU 611.A O no hydrogen 2.986 N/A SER 615.A N LEU 612.A O no hydrogen 2.899 N/A HIS 617.A N SER 615.A O no hydrogen 2.934 N/A SER 620.A N ALA 583.A O no hydrogen 3.294 N/A PHE 629.A N LEU 640.A O no hydrogen 2.965 N/A THR 630.A N TYR 585.A OH no hydrogen 3.098 N/A THR 630.A OG1 TYR 585.A OH no hydrogen 3.004 N/A LEU 631.A N LEU 638.A O no hydrogen 2.705 N/A ASN 632.A N LEU 576.A O no hydrogen 2.870 N/A ARG 634.A N GLN 515.A OE1 no hydrogen 2.518 N/A ARG 634.A NH1 GLN 515.A O no hydrogen 3.475 N/A ALA 636.A N ARG 634.A O no hydrogen 3.005 N/A LEU 638.A N LEU 631.A O no hydrogen 2.783 N/A LEU 640.A N PHE 629.A O no hydrogen 2.788 N/A LEU 641.A N SER 646.A OG no hydrogen 3.007 N/A ILE 642.A N SER 627.A O no hydrogen 2.939 N/A ASN 645.A ND2 TYR 651.A O no hydrogen 3.444 N/A SER 646.A N PHE 649.A O no hydrogen 2.721 N/A ASN 650.A N ILE 659.A O no hydrogen 3.011 N/A TYR 651.A N ASN 645.A OD1 no hydrogen 3.159 N/A TYR 651.A OH ASN 656.A OD1 no hydrogen 3.018 N/A ASN 652.A N VAL 657.A O no hydrogen 2.758 N/A GLU 655.A N ASN 652.A OD1 no hydrogen 2.949 N/A ASN 656.A N GLN 653.A O no hydrogen 3.188 N/A ASN 656.A ND2 PRO 668.A O no hydrogen 3.612 N/A VAL 657.A N ASN 652.A O no hydrogen 2.830 N/A ILE 658.A N GLY 666.A O no hydrogen 3.066 N/A ILE 659.A N ASN 650.A O no hydrogen 2.693 N/A VAL 660.A N LYS 663.A O no hydrogen 2.791 N/A LYS 663.A N VAL 660.A O no hydrogen 2.961 N/A LYS 663.A NZ GLN 139.A O no hydrogen 3.031 N/A VAL 665.A N ILE 658.A O no hydrogen 2.931 N/A SER 667.A OG ASN 656.A O no hydrogen 3.023 N/A SER 671.A OG THR 674.A OG1 no hydrogen 3.068 N/A THR 674.A N SER 671.A O no hydrogen 2.773 N/A THR 674.A OG1 SER 671.A O no hydrogen 2.616 N/A GLU 675.A N SER 671.A O no hydrogen 3.343 N/A SER 676.A OG LEU 673.A O no hydrogen 2.912 N/A SER 681.A OG THR 602.A OG1 no hydrogen 2.860 N/A ARG 685.A N GLN 625.A OE1 no hydrogen 2.990 N/A GLY 686.A N GLN 595.A OE1 no hydrogen 3.014 N/A LEU 688.A N MET 728.A O no hydrogen 2.704 N/A ILE 689.A N GLU 680.A O no hydrogen 2.874 N/A LEU 690.A N LEU 726.A O no hydrogen 2.776 N/A ASN 694.A N ASN 716.A OD1 no hydrogen 3.169 N/A LYS 696.A N ASN 694.A OD1 no hydrogen 3.527 N/A TYR 697.A N ASN 694.A O no hydrogen 3.117 N/A GLY 698.A N SER 695.A O no hydrogen 2.900 N/A LEU 701.A N ASN 716.A O no hydrogen 2.827 N/A GLU 705.A N THR 702.A O no hydrogen 2.868 N/A GLY 710.A N GLU 713.A OE1 no hydrogen 2.800 N/A ARG 711.A NH1 LYS 731.A O no hydrogen 2.734 N/A ARG 711.A NH2 ASP 733.A OD2 no hydrogen 3.340 N/A GLU 713.A N GLY 710.A O no hydrogen 2.806 N/A ALA 715.A N VAL 727.A O no hydrogen 2.798 N/A ASN 716.A ND2 ASN 694.A O no hydrogen 2.756 N/A ASN 716.A ND2 GLY 698.A O no hydrogen 3.156 N/A VAL 717.A N VAL 725.A O no hydrogen 2.926 N/A LEU 718.A N LEU 701.A O no hydrogen 2.807 N/A ILE 719.A N ASP 723.A O no hydrogen 2.978 N/A VAL 725.A N VAL 717.A O no hydrogen 3.012 N/A LEU 726.A N GLY 691.A O no hydrogen 2.827 N/A VAL 727.A N ALA 715.A O no hydrogen 2.700 N/A MET 728.A N LEU 688.A O no hydrogen 2.841 N/A LYS 729.A N GLU 713.A O no hydrogen 3.391 N/A LYS 729.A NZ LEU 709.A O no hydrogen 3.565 N/A ARG 730.A N GLY 686.A O no hydrogen 2.915 N/A SER 734.A OG ASP 598.A OD2 no hydrogen 3.042 N/A