Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3req_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 21.A N ASP 17.A O no hydrogen 2.683 N/A ARG 21.A NH2 ASP 17.A OD1 no hydrogen 2.721 N/A PHE 22.A N ALA 18.A O no hydrogen 2.752 N/A GLU 23.A N ALA 19.A O no hydrogen 3.203 N/A LEU 25.A N ARG 21.A O no hydrogen 3.444 N/A ALA 26.A N PHE 22.A O no hydrogen 2.635 N/A ALA 27.A N GLU 23.A O no hydrogen 2.926 N/A LYS 28.A N GLU 24.A O no hydrogen 3.090 N/A ALA 29.A N LEU 25.A O no hydrogen 3.362 N/A ALA 29.A N ALA 26.A O no hydrogen 3.286 N/A GLY 30.A N ALA 27.A O no hydrogen 3.277 N/A THR 31.A OG1 ALA 26.A O no hydrogen 3.130 N/A TRP 35.A N VAL 43.A O no hydrogen 2.962 N/A THR 37.A OG1 ILE 41.A O no hydrogen 3.028 N/A GLN 40.A N THR 37.A O no hydrogen 2.972 N/A VAL 43.A N TRP 35.A O no hydrogen 3.077 N/A GLU 49.A N ASN 48.A OD1 no hydrogen 2.858 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 3.286 N/A MET 55.A N TYR 52.A O no hydrogen 2.686 N/A TRP 57.A NE1 GLU 407.A OE1 no hydrogen 2.753 N/A THR 60.A N TRP 57.A O no hydrogen 3.256 N/A THR 60.A OG1 TRP 57.A O no hydrogen 3.017 N/A GLY 63.A N GLY 70.A O no hydrogen 3.211 N/A ILE 64.A N TYR 61.A O no hydrogen 3.264 N/A PHE 67.A N ILE 64.A O no hydrogen 3.457 N/A HIS 69.A ND1 ASP 398.A OD2 no hydrogen 2.984 N/A TYR 76.A OH THR 357.A O no hydrogen 2.494 N/A ALA 77.A N THR 74.A O no hydrogen 3.425 N/A TRP 81.A NE1 GLN 384.A OE1 no hydrogen 2.897 N/A THR 82.A N GLN 358.A O no hydrogen 2.989 N/A ARG 84.A N LEU 360.A O no hydrogen 2.859 N/A GLN 85.A NE2 THR 362.A O no hydrogen 3.197 N/A GLN 85.A NE2 THR 362.A OG1 no hydrogen 3.285 N/A TYR 86.A N HIS 361.A ND1 no hydrogen 2.947 N/A SER 95.A OG PHE 89.A O no hydrogen 3.378 N/A ASN 96.A ND2 LEU 149.A O no hydrogen 3.473 N/A ASN 96.A ND2 ALA 151.A O no hydrogen 3.661 N/A PHE 98.A N GLU 94.A O no hydrogen 3.158 N/A TYR 99.A N SER 95.A O no hydrogen 2.864 N/A TYR 99.A OH SER 111.A O no hydrogen 3.082 N/A ARG 100.A N ASN 96.A O no hydrogen 3.129 N/A ARG 101.A N ALA 97.A O no hydrogen 3.160 N/A ASN 102.A N PHE 98.A O no hydrogen 2.821 N/A LEU 103.A N TYR 99.A O no hydrogen 2.926 N/A ALA 104.A N ARG 100.A O no hydrogen 2.876 N/A ALA 105.A N ARG 101.A O no hydrogen 2.931 N/A GLY 106.A N ASN 102.A O no hydrogen 3.049 N/A LEU 110.A N SER 159.A O no hydrogen 3.027 N/A SER 111.A OG SER 161.A O no hydrogen 3.217 N/A VAL 112.A N SER 161.A O no hydrogen 3.389 N/A ASP 115.A N VAL 138.A O no hydrogen 3.067 N/A THR 118.A N ASP 115.A OD1 no hydrogen 2.669 N/A THR 118.A OG1 ASP 115.A OD1 no hydrogen 2.691 N/A HIS 119.A N ASP 115.A O no hydrogen 3.374 N/A ARG 120.A N PRO 117.A O no hydrogen 3.280 N/A ARG 120.A NE TYR 207.A O no hydrogen 2.710 N/A ARG 120.A NH1 GLN 604.A OE1 no hydrogen 2.998 N/A ARG 120.A NH2 TYR 207.A O no hydrogen 3.257 N/A GLY 121.A N THR 118.A O no hydrogen 3.197 N/A TYR 122.A N PRO 117.A O no hydrogen 3.278 N/A SER 124.A OG ASP 141.A OD1 no hydrogen 2.832 N/A ARG 128.A NH1 GLU 636.A OE2 no hydrogen 3.131 N/A ALA 130.A N PRO 127.A O no hydrogen 3.232 N/A ASP 132.A N VAL 129.A O no hydrogen 3.175 N/A GLY 134.A N ASP 115.A OD2 no hydrogen 2.766 N/A VAL 138.A N ALA 113.A O no hydrogen 2.697 N/A ILE 140.A N THR 118.A OG1 no hydrogen 2.932 N/A ASP 141.A N ASP 145.A OD2 no hydrogen 2.853 N/A SER 142.A OG ASP 145.A OD2 no hydrogen 3.389 N/A ARG 147.A N ILE 143.A O no hydrogen 2.765 N/A ARG 147.A NE GLU 181.A OE2 no hydrogen 2.633 N/A ARG 147.A NH2 GLU 181.A OE1 no hydrogen 2.758 N/A GLU 148.A N TYR 144.A O no hydrogen 2.858 N/A LEU 149.A N ASP 145.A O no hydrogen 3.056 N/A PHE 150.A N MET 146.A O no hydrogen 3.156 N/A ALA 151.A N GLU 148.A O no hydrogen 3.270 N/A ILE 153.A N PHE 150.A O no hydrogen 3.237 N/A LEU 155.A N GLN 182.A OE1 no hydrogen 3.336 N/A GLN 157.A NE2 ASP 156.A OD2 no hydrogen 3.096 N/A SER 159.A N LYS 108.A O no hydrogen 3.128 N/A VAL 160.A N ALA 190.A O no hydrogen 3.129 N/A SER 161.A N LEU 110.A O no hydrogen 2.713 N/A MET 162.A N THR 192.A O no hydrogen 2.835 N/A ALA 173.A N LEU 169.A O no hydrogen 3.099 N/A THR 178.A OG1 LEU 174.A O no hydrogen 3.014 N/A ALA 179.A N TYR 175.A O no hydrogen 2.951 N/A GLU 180.A N VAL 176.A O no hydrogen 2.750 N/A GLU 181.A N VAL 177.A O no hydrogen 2.973 N/A GLN 182.A N ALA 179.A O no hydrogen 3.437 N/A GLN 182.A NE2 ILE 153.A O no hydrogen 3.547 N/A VAL 184.A N ALA 179.A O no hydrogen 2.994 N/A GLN 188.A N LYS 185.A O no hydrogen 2.905 N/A THR 192.A N VAL 160.A O no hydrogen 3.321 N/A THR 192.A OG1 GLY 191.A O no hydrogen 3.095 N/A ILE 193.A N ASN 233.A O no hydrogen 2.763 N/A GLN 194.A N MET 162.A O no hydrogen 3.207 N/A ASN 195.A N MET 164.A O no hydrogen 3.320 N/A ASP 196.A N ASN 165.A OD1 no hydrogen 3.071 N/A LYS 199.A N ASP 196.A OD1 no hydrogen 3.377 N/A LYS 199.A NZ ASN 165.A OD1 no hydrogen 2.680 N/A LYS 199.A NZ GLN 194.A OE1 no hydrogen 3.372 N/A LYS 199.A NZ ASP 196.A O no hydrogen 2.937 N/A LYS 199.A NZ GLU 200.A OE2 no hydrogen 2.907 N/A GLU 200.A N ILE 197.A O no hydrogen 2.785 N/A PHE 201.A N ILE 197.A O no hydrogen 3.479 N/A ARG 204.A N LYS 199.A O no hydrogen 3.230 N/A ASN 205.A N GLU 200.A O no hydrogen 2.785 N/A ASN 205.A ND2 GLY 606.A O no hydrogen 2.674 N/A ASN 205.A ND2 ASP 608.A OD2 no hydrogen 3.123 N/A THR 206.A OG1 GLU 200.A OE1 no hydrogen 2.512 N/A TYR 209.A OH SER 546.A O no hydrogen 3.055 N/A SER 214.A N PRO 210.A O no hydrogen 2.742 N/A SER 214.A N PRO 211.A O no hydrogen 2.929 N/A SER 214.A OG TYR 209.A O no hydrogen 2.593 N/A MET 215.A N PRO 211.A O no hydrogen 2.817 N/A MET 215.A N GLN 212.A O no hydrogen 3.082 N/A ARG 216.A N GLN 212.A O no hydrogen 3.249 N/A ARG 216.A NH2 ALA 516.A O no hydrogen 3.111 N/A SER 219.A N MET 215.A O no hydrogen 2.956 N/A SER 219.A OG ALA 266.A O no hydrogen 2.696 N/A SER 219.A OG SER 269.A OG no hydrogen 2.987 N/A GLU 220.A N ARG 216.A O no hydrogen 2.955 N/A THR 225.A N ILE 221.A O no hydrogen 3.043 N/A THR 225.A OG1 ILE 221.A O no hydrogen 2.949 N/A SER 226.A OG PHE 222.A O no hydrogen 2.789 N/A SER 226.A OG ALA 223.A O no hydrogen 2.656 N/A ALA 227.A N SER 226.A OG no hydrogen 2.692 N/A ASN 228.A N TYR 224.A O no hydrogen 2.999 N/A ASN 233.A N GLY 191.A O no hydrogen 2.731 N/A SER 236.A N GLN 194.A O no hydrogen 3.260 N/A SER 236.A OG SER 282.A O no hydrogen 3.428 N/A ILE 237.A N SER 282.A O no hydrogen 3.057 N/A SER 238.A N ASP 196.A OD2 no hydrogen 3.272 N/A GLY 239.A N PHE 284.A O no hydrogen 3.000 N/A TYR 240.A N PHE 284.A O no hydrogen 2.975 N/A TYR 240.A OH THR 328.A O no hydrogen 3.350 N/A MET 242.A N GLY 239.A O no hydrogen 2.991 N/A GLN 243.A NE2 GLU 294.A OE2 no hydrogen 3.028 N/A GLU 244.A N TYR 240.A O no hydrogen 3.254 N/A ALA 245.A N HIS 241.A O no hydrogen 3.202 N/A GLY 246.A N MET 242.A O no hydrogen 3.168 N/A ALA 247.A N MET 242.A O no hydrogen 3.148 N/A THR 248.A OG1 ASP 250.A OD1 no hydrogen 3.021 N/A ALA 249.A N GLU 39.A OE2 no hydrogen 2.728 N/A ILE 251.A N THR 248.A O no hydrogen 3.119 N/A GLU 252.A N THR 248.A O no hydrogen 3.111 N/A MET 253.A N ALA 249.A O no hydrogen 3.132 N/A ALA 254.A N ASP 250.A O no hydrogen 2.932 N/A TYR 255.A N ILE 251.A O no hydrogen 2.998 N/A THR 256.A N GLU 252.A O no hydrogen 3.254 N/A THR 256.A OG1 GLU 252.A O no hydrogen 2.624 N/A LEU 257.A N MET 253.A O no hydrogen 3.224 N/A ALA 258.A N ALA 254.A O no hydrogen 3.096 N/A ASP 259.A N TYR 255.A O no hydrogen 2.648 N/A GLY 260.A N THR 256.A O no hydrogen 2.937 N/A VAL 261.A N LEU 257.A O no hydrogen 2.926 N/A VAL 261.A N ALA 258.A O no hydrogen 3.105 N/A ASP 262.A N ALA 258.A O no hydrogen 3.329 N/A TYR 263.A OH ASP 196.A OD1 no hydrogen 2.783 N/A ILE 264.A N GLY 260.A O no hydrogen 3.237 N/A ILE 264.A N VAL 261.A O no hydrogen 3.121 N/A ARG 265.A N VAL 261.A O no hydrogen 3.065 N/A ALA 266.A N ASP 262.A O no hydrogen 3.203 N/A GLY 267.A N TYR 263.A O no hydrogen 3.075 N/A GLU 268.A N ILE 264.A O no hydrogen 2.886 N/A SER 269.A OG SER 219.A OG no hydrogen 2.987 N/A SER 269.A OG ALA 266.A O no hydrogen 2.911 N/A ASN 273.A N GLN 276.A OE1 no hydrogen 2.702 N/A ASN 273.A ND2 GLN 276.A OE1 no hydrogen 2.642 N/A PHE 277.A N VAL 274.A O no hydrogen 2.726 N/A ALA 278.A N VAL 274.A O no hydrogen 2.732 N/A ARG 280.A NH2 PRO 230.A O no hydrogen 3.231 N/A PHE 283.A N ARG 323.A O no hydrogen 2.896 N/A PHE 284.A N ILE 237.A O no hydrogen 3.182 N/A TRP 285.A N HIS 325.A O no hydrogen 2.978 N/A GLY 286.A N GLU 252.A OE2 no hydrogen 2.971 N/A GLY 288.A N GLU 294.A OE2 no hydrogen 2.782 N/A GLU 294.A N ASN 290.A O no hydrogen 2.841 N/A VAL 295.A N PHE 291.A O no hydrogen 2.961 N/A ALA 296.A N PHE 292.A O no hydrogen 3.423 N/A LYS 297.A N MET 293.A O no hydrogen 3.003 N/A LYS 297.A NZ GLU 252.A OE1 no hydrogen 2.648 N/A LYS 297.A NZ GLY 286.A O no hydrogen 2.618 N/A LYS 297.A NZ GLU 294.A OE1 no hydrogen 2.642 N/A LEU 298.A N VAL 295.A O no hydrogen 3.331 N/A ARG 299.A N VAL 295.A O no hydrogen 3.265 N/A ARG 299.A NE ASP 398.A OD2 no hydrogen 2.709 N/A ARG 299.A NH1 GLU 407.A OE1 no hydrogen 2.701 N/A ARG 299.A NH2 ASP 398.A OD2 no hydrogen 2.926 N/A ARG 299.A NH2 GLU 407.A OE1 no hydrogen 2.744 N/A ARG 299.A NH2 GLU 407.A OE2 no hydrogen 2.741 N/A ALA 301.A N LYS 297.A O no hydrogen 2.881 N/A ARG 302.A N LEU 298.A O no hydrogen 3.377 N/A ARG 302.A NE PHE 67.A O no hydrogen 2.843 N/A ARG 302.A NH1 GLY 355.A O no hydrogen 2.642 N/A ARG 302.A NH2 VAL 68.A O no hydrogen 2.647 N/A ARG 302.A NH2 GLY 355.A O no hydrogen 3.093 N/A MET 303.A N ARG 299.A O no hydrogen 3.411 N/A LEU 304.A N ALA 300.A O no hydrogen 3.185 N/A TRP 305.A N ALA 301.A O no hydrogen 2.749 N/A TRP 305.A N ARG 302.A O no hydrogen 2.892 N/A ALA 306.A N ARG 302.A O no hydrogen 3.098 N/A LEU 308.A N LEU 304.A O no hydrogen 3.502 N/A VAL 309.A N ALA 306.A O no hydrogen 3.137 N/A HIS 310.A N ALA 306.A O no hydrogen 2.988 N/A PHE 312.A N VAL 309.A O no hydrogen 3.426 N/A SER 319.A OG ASP 275.A OD1 no hydrogen 2.761 N/A SER 319.A OG ASN 316.A O no hydrogen 2.960 N/A SER 321.A OG LYS 318.A O no hydrogen 3.141 N/A ARG 323.A NE SER 321.A O no hydrogen 3.387 N/A ARG 323.A NE SER 321.A OG no hydrogen 2.997 N/A ARG 323.A NH2 ALA 278.A O no hydrogen 3.459 N/A ARG 323.A NH2 SER 321.A O no hydrogen 3.386 N/A THR 324.A N GLN 358.A OE1 no hydrogen 2.622 N/A THR 324.A OG1 PHE 283.A O no hydrogen 3.066 N/A THR 324.A OG1 HIS 325.A O no hydrogen 3.037 N/A HIS 325.A N PHE 283.A O no hydrogen 2.905 N/A HIS 325.A ND1 SER 359.A OG no hydrogen 2.968 N/A SER 326.A N SER 359.A O no hydrogen 2.685 N/A SER 326.A OG THR 357.A OG1 no hydrogen 2.877 N/A GLN 327.A N TRP 285.A O no hydrogen 3.040 N/A GLN 327.A NE2 TYR 86.A OH no hydrogen 3.257 N/A GLN 327.A NE2 ASN 363.A OD1 no hydrogen 2.958 N/A THR 328.A N HIS 361.A O no hydrogen 3.179 N/A SER 329.A N ILE 287.A O no hydrogen 2.759 N/A SER 329.A OG GLU 244.A OE1 no hydrogen 3.466 N/A SER 329.A OG GLU 244.A OE2 no hydrogen 2.562 N/A GLY 330.A N TYR 240.A OH no hydrogen 3.188 N/A TRP 331.A N GLU 244.A OE1 no hydrogen 2.723 N/A SER 332.A N SER 329.A OG no hydrogen 3.308 N/A SER 332.A OG SER 329.A O no hydrogen 2.887 N/A SER 332.A OG GLU 348.A OE2 no hydrogen 2.922 N/A THR 334.A N ASN 341.A OD1 no hydrogen 2.897 N/A THR 334.A OG1 GLN 336.A O no hydrogen 2.995 N/A THR 334.A OG1 ASN 341.A OD1 no hydrogen 3.354 N/A ASN 340.A N ASP 337.A O no hydrogen 3.167 N/A ASN 341.A ND2 THR 334.A O no hydrogen 3.070 N/A ASN 341.A ND2 VAL 338.A O no hydrogen 2.889 N/A ASN 341.A ND2 LEU 365.A O no hydrogen 2.978 N/A ARG 344.A N ASN 340.A O no hydrogen 3.177 N/A ARG 344.A NH1 ASN 341.A OD1 no hydrogen 2.941 N/A ARG 344.A NH2 ILE 462.A O no hydrogen 3.127 N/A THR 345.A N ASN 341.A O no hydrogen 2.769 N/A CYS 346.A N VAL 342.A O no hydrogen 3.174 N/A ILE 347.A N VAL 343.A O no hydrogen 3.046 N/A GLU 348.A N ARG 344.A O no hydrogen 3.331 N/A ALA 349.A N THR 345.A O no hydrogen 2.939 N/A MET 350.A N CYS 346.A O no hydrogen 3.209 N/A ALA 351.A N ILE 347.A O no hydrogen 2.818 N/A ALA 352.A N GLU 348.A O no hydrogen 2.854 N/A THR 353.A N ALA 349.A O no hydrogen 3.056 N/A THR 353.A OG1 ALA 349.A O no hydrogen 3.420 N/A THR 353.A OG1 MET 350.A O no hydrogen 3.331 N/A GLN 354.A N MET 350.A O no hydrogen 2.883 N/A GLY 355.A N ALA 351.A O no hydrogen 3.402 N/A GLY 355.A N ALA 352.A O no hydrogen 3.292 N/A HIS 356.A N ALA 352.A O no hydrogen 3.073 N/A HIS 356.A N THR 353.A O no hydrogen 3.116 N/A HIS 356.A ND1 HIS 69.A O no hydrogen 3.145 N/A THR 357.A N ALA 352.A O no hydrogen 3.260 N/A THR 357.A OG1 THR 324.A O no hydrogen 3.143 N/A THR 357.A OG1 SER 326.A OG no hydrogen 2.877 N/A THR 357.A OG1 SER 359.A O no hydrogen 3.127 N/A GLN 358.A N THR 324.A O no hydrogen 2.943 N/A SER 359.A N THR 324.A O no hydrogen 3.504 N/A SER 359.A OG HIS 325.A ND1 no hydrogen 2.968 N/A LEU 360.A N THR 82.A O no hydrogen 3.162 N/A HIS 361.A N SER 326.A O no hydrogen 2.961 N/A THR 362.A N GLN 85.A OE1 no hydrogen 2.792 N/A THR 362.A OG1 GLN 85.A OE1 no hydrogen 3.279 N/A THR 362.A OG1 ALA 380.A O no hydrogen 2.686 N/A ASN 363.A N THR 328.A OG1 no hydrogen 3.258 N/A SER 364.A N GLU 367.A OE2 no hydrogen 3.125 N/A GLU 367.A N SER 364.A O no hydrogen 3.284 N/A THR 373.A N SER 376.A OG no hydrogen 3.163 N/A THR 373.A OG1 ASP 366.A OD2 no hydrogen 3.039 N/A THR 373.A OG1 SER 376.A OG no hydrogen 3.021 N/A SER 376.A N THR 373.A OG1 no hydrogen 3.367 N/A SER 376.A OG ASP 366.A OD1 no hydrogen 2.580 N/A SER 376.A OG ASP 366.A OD2 no hydrogen 3.213 N/A SER 376.A OG THR 373.A O no hydrogen 3.410 N/A SER 376.A OG THR 373.A OG1 no hydrogen 3.021 N/A ALA 377.A N THR 373.A O no hydrogen 3.189 N/A ARG 378.A N ASP 374.A O no hydrogen 3.432 N/A ILE 379.A N PHE 375.A O no hydrogen 3.333 N/A ALA 380.A N SER 376.A O no hydrogen 2.847 N/A ARG 381.A N ALA 377.A O no hydrogen 3.152 N/A ASN 382.A N ARG 378.A O no hydrogen 2.885 N/A THR 383.A N ILE 379.A O no hydrogen 3.125 N/A THR 383.A OG1 ILE 379.A O no hydrogen 2.812 N/A GLN 384.A NE2 LEU 360.A O no hydrogen 2.937 N/A GLN 384.A NE2 THR 362.A OG1 no hydrogen 3.035 N/A LEU 385.A N ARG 381.A O no hydrogen 3.188 N/A PHE 386.A N ASN 382.A O no hydrogen 2.671 N/A LEU 387.A N THR 383.A O no hydrogen 3.233 N/A GLN 388.A N GLN 384.A O no hydrogen 3.133 N/A GLN 389.A N LEU 385.A O no hydrogen 3.146 N/A GLU 390.A N PHE 386.A O no hydrogen 2.743 N/A SER 391.A OG LEU 387.A O no hydrogen 2.619 N/A SER 391.A OG THR 393.A OG1 no hydrogen 3.012 N/A THR 393.A OG1 SER 391.A OG no hydrogen 3.012 N/A TRP 400.A NE1 GLN 354.A OE1 no hydrogen 2.940 N/A SER 401.A OG ASP 398.A O no hydrogen 2.778 N/A GLY 402.A N GLU 407.A OE2 no hydrogen 3.039 N/A SER 403.A N TYR 52.A OH no hydrogen 2.751 N/A SER 403.A OG GLY 402.A O no hydrogen 2.600 N/A GLU 407.A N SER 403.A O no hydrogen 3.355 N/A GLU 408.A N ALA 404.A O no hydrogen 2.716 N/A LEU 409.A N TYR 405.A O no hydrogen 3.109 N/A THR 410.A N VAL 406.A O no hydrogen 2.988 N/A THR 410.A OG1 VAL 406.A O no hydrogen 2.612 N/A TRP 411.A N GLU 407.A O no hydrogen 2.784 N/A ASP 412.A N GLU 408.A O no hydrogen 2.866 N/A LEU 413.A N LEU 409.A O no hydrogen 2.803 N/A ALA 414.A N THR 410.A O no hydrogen 2.942 N/A ARG 415.A N TRP 411.A O no hydrogen 3.096 N/A LYS 416.A N ASP 412.A O no hydrogen 3.066 N/A LYS 416.A NZ GLN 40.A O no hydrogen 2.965 N/A ALA 417.A N LEU 413.A O no hydrogen 2.926 N/A TRP 418.A N ALA 414.A O no hydrogen 2.985 N/A GLY 419.A N ARG 415.A O no hydrogen 3.287 N/A HIS 420.A NE2 ASP 250.A OD2 no hydrogen 3.156 N/A ILE 421.A N ALA 417.A O no hydrogen 3.304 N/A GLN 422.A N TRP 418.A O no hydrogen 2.791 N/A GLU 423.A N GLY 419.A O no hydrogen 2.831 N/A VAL 424.A N HIS 420.A O no hydrogen 3.145 N/A GLU 425.A N ILE 421.A O no hydrogen 2.926 N/A GLU 425.A N GLN 422.A O no hydrogen 3.265 N/A MET 430.A N ASP 262.A OD2 no hydrogen 3.084 N/A GLU 435.A N ALA 431.A O no hydrogen 3.175 N/A LYS 436.A N LYS 432.A O no hydrogen 2.893 N/A GLY 437.A N ALA 433.A O no hydrogen 2.819 N/A ILE 438.A N ALA 433.A O no hydrogen 3.069 N/A LYS 440.A NZ MET 202.A O no hydrogen 2.865 N/A LYS 440.A NZ ASP 608.A OD2 no hydrogen 3.302 N/A ARG 442.A N ILE 438.A O no hydrogen 3.354 N/A ARG 442.A NE GLU 423.A OE1 no hydrogen 3.024 N/A ARG 442.A NH2 GLU 423.A OE1 no hydrogen 3.562 N/A ARG 442.A NH2 GLU 423.A OE2 no hydrogen 2.777 N/A ILE 443.A N PRO 439.A O no hydrogen 3.341 N/A GLU 444.A N LYS 440.A O no hydrogen 3.269 N/A GLU 445.A N MET 441.A O no hydrogen 3.113 N/A ALA 446.A N ARG 442.A O no hydrogen 3.160 N/A ALA 447.A N ILE 443.A O no hydrogen 2.963 N/A ALA 448.A N GLU 444.A O no hydrogen 2.814 N/A ARG 449.A N GLU 445.A O no hydrogen 2.788 N/A ARG 449.A NH2 GLU 445.A OE1 no hydrogen 3.467 N/A THR 450.A N ALA 446.A O no hydrogen 2.769 N/A THR 450.A OG1 ALA 446.A O no hydrogen 3.085 N/A GLN 451.A N ALA 447.A O no hydrogen 2.935 N/A ALA 452.A N ALA 448.A O no hydrogen 3.131 N/A ARG 453.A N ARG 449.A O no hydrogen 3.454 N/A ARG 453.A NH2 THR 450.A OG1 no hydrogen 3.156 N/A ILE 454.A N THR 450.A O no hydrogen 3.261 N/A ASP 455.A N GLN 451.A O no hydrogen 2.691 N/A SER 456.A N ALA 452.A O no hydrogen 2.756 N/A SER 456.A OG ALA 452.A O no hydrogen 2.901 N/A SER 456.A OG VAL 571.A O no hydrogen 3.124 N/A GLY 457.A N ARG 453.A O no hydrogen 3.185 N/A GLY 457.A N ILE 454.A O no hydrogen 3.230 N/A ARG 458.A N ARG 453.A O no hydrogen 2.669 N/A ARG 458.A NH1 GLU 570.A OE2 no hydrogen 3.059 N/A LEU 461.A N ASN 465.A OD1 no hydrogen 2.654 N/A GLY 463.A N LYS 466.A O no hydrogen 3.063 N/A VAL 464.A N LEU 461.A O no hydrogen 2.944 N/A ASN 465.A N LEU 461.A O no hydrogen 3.276 N/A ASN 465.A ND2 GLN 459.A O no hydrogen 2.973 N/A ARG 468.A NH2 ASN 465.A O no hydrogen 3.513 N/A LEU 475.A N PRO 473.A O no hydrogen 3.110 N/A ASN 482.A ND2 VAL 133.A O no hydrogen 2.651 N/A VAL 485.A N ASN 482.A O no hydrogen 3.152 N/A ALA 487.A N SER 483.A O no hydrogen 3.235 N/A GLN 489.A NE2 ASP 145.A OD1 no hydrogen 2.732 N/A ALA 491.A N ALA 487.A O no hydrogen 3.386 N/A LYS 492.A N GLN 489.A O no hydrogen 3.195 N/A LYS 492.A NZ ASP 145.A OD1 no hydrogen 2.680 N/A LYS 492.A NZ GLU 148.A OE1 no hydrogen 2.889 N/A LEU 493.A N GLN 489.A O no hydrogen 3.067 N/A LEU 496.A N LYS 492.A O no hydrogen 2.914 N/A ARG 497.A NE GLU 544.A OE2 no hydrogen 3.232 N/A ARG 497.A NH2 GLU 544.A OE2 no hydrogen 2.709 N/A ALA 498.A N LYS 495.A O no hydrogen 3.247 N/A ARG 500.A NH1 MET 539.A O no hydrogen 3.033 N/A ARG 500.A NH1 GLU 544.A OE1 no hydrogen 2.732 N/A ARG 500.A NH2 GLU 544.A OE1 no hydrogen 3.208 N/A ARG 500.A NH2 GLU 544.A OE2 no hydrogen 3.047 N/A VAL 505.A N ASP 501.A O no hydrogen 3.330 N/A LYS 506.A N PRO 502.A O no hydrogen 2.764 N/A ALA 507.A N GLU 503.A O no hydrogen 3.067 N/A ALA 508.A N VAL 505.A O no hydrogen 3.290 N/A LEU 509.A N VAL 505.A O no hydrogen 3.409 N/A ASP 510.A N LYS 506.A O no hydrogen 3.344 N/A LYS 511.A N ALA 507.A O no hydrogen 3.242 N/A ILE 512.A N ALA 508.A O no hydrogen 2.698 N/A THR 513.A N LEU 509.A O no hydrogen 2.709 N/A THR 513.A OG1 LEU 509.A O no hydrogen 2.851 N/A THR 513.A OG1 ALA 548.A O no hydrogen 2.927 N/A TRP 514.A N ASP 510.A O no hydrogen 2.843 N/A ALA 515.A N LYS 511.A O no hydrogen 3.017 N/A ALA 516.A N ILE 512.A O no hydrogen 2.902 N/A GLY 517.A N THR 513.A O no hydrogen 2.666 N/A ASN 518.A N TRP 514.A O no hydrogen 2.670 N/A ARG 526.A N ASP 523.A O no hydrogen 3.093 N/A LEU 528.A N GLU 220.A OE1 no hydrogen 2.796 N/A LYS 530.A N ASN 527.A OD1 no hydrogen 2.765 N/A LEU 531.A N ASN 527.A O no hydrogen 3.066 N/A CYS 532.A N LEU 528.A O no hydrogen 3.009 N/A ILE 533.A N LEU 529.A O no hydrogen 3.253 N/A GLY 536.A N CYS 532.A O no hydrogen 2.862 N/A ARG 537.A N ILE 533.A O no hydrogen 2.733 N/A ALA 538.A N ASP 534.A O no hydrogen 2.732 N/A MET 539.A N GLY 536.A O no hydrogen 3.198 N/A ALA 540.A N ALA 535.A O no hydrogen 2.779 N/A THR 541.A N GLU 544.A OE1 no hydrogen 3.307 N/A THR 541.A OG1 ASP 123.A OD1 no hydrogen 2.922 N/A THR 541.A OG1 ASP 123.A OD2 no hydrogen 2.661 N/A VAL 542.A N ASP 141.A O no hydrogen 2.698 N/A GLY 543.A N ASP 123.A OD1 no hydrogen 2.674 N/A GLU 544.A N THR 541.A OG1 no hydrogen 2.821 N/A MET 545.A N THR 541.A O no hydrogen 2.870 N/A SER 546.A N VAL 542.A O no hydrogen 2.780 N/A SER 546.A OG TYR 209.A OH no hydrogen 3.009 N/A ASP 547.A N GLY 543.A O no hydrogen 2.775 N/A ALA 548.A N GLU 544.A O no hydrogen 3.437 N/A GLU 550.A N SER 546.A O no hydrogen 3.157 N/A PHE 553.A N LEU 549.A O no hydrogen 3.456 N/A ARG 555.A NH1 ARG 120.A O no hydrogen 3.455 N/A ARG 555.A NH2 ARG 120.A O no hydrogen 2.754 N/A TYR 556.A N ILE 208.A O no hydrogen 2.697 N/A THR 557.A OG1 ARG 555.A O no hydrogen 3.565 N/A SER 564.A OG ASP 620.A OD1 no hydrogen 3.474 N/A GLY 565.A N ASP 620.A OD1 no hydrogen 3.106 N/A TYR 567.A OH ASP 455.A OD2 no hydrogen 2.557 N/A SER 568.A N ASP 620.A OD2 no hydrogen 2.884 N/A LYS 569.A N GLY 565.A O no hydrogen 2.998 N/A GLU 570.A N VAL 566.A O no hydrogen 2.841 N/A VAL 571.A N TYR 567.A O no hydrogen 2.711 N/A LYS 572.A N SER 568.A O no hydrogen 2.989 N/A GLU 578.A N THR 574.A O no hydrogen 3.062 N/A GLU 579.A N PRO 575.A O no hydrogen 2.789 N/A ALA 580.A N GLU 576.A O no hydrogen 2.710 N/A ARG 581.A N VAL 577.A O no hydrogen 3.083 N/A ARG 581.A NH2 SER 568.A OG no hydrogen 3.137 N/A GLU 582.A N GLU 578.A O no hydrogen 2.880 N/A LEU 583.A N GLU 579.A O no hydrogen 2.930 N/A VAL 584.A N ALA 580.A O no hydrogen 3.343 N/A GLU 585.A N ARG 581.A O no hydrogen 3.080 N/A GLU 586.A N GLU 582.A O no hydrogen 3.092 N/A PHE 587.A N LEU 583.A O no hydrogen 2.695 N/A GLU 588.A N VAL 584.A O no hydrogen 3.082 N/A GLN 589.A N GLU 585.A O no hydrogen 3.031 N/A ALA 590.A N GLU 586.A O no hydrogen 3.000 N/A GLU 591.A N PHE 587.A O no hydrogen 2.847 N/A GLU 591.A N GLU 588.A O no hydrogen 3.113 N/A GLY 592.A N GLU 588.A O no hydrogen 2.634 N/A GLY 592.A N GLN 589.A O no hydrogen 3.398 N/A ARG 593.A NH1 ASP 645.A O no hydrogen 3.496 N/A ARG 593.A NH2 ASP 645.A O no hydrogen 2.670 N/A ARG 594.A NH1 GLY 622.A O no hydrogen 3.055 N/A ARG 596.A N HIS 647.A ND1 no hydrogen 3.243 N/A ARG 596.A NE ASP 626.A OD2 no hydrogen 3.382 N/A ILE 597.A N ASP 624.A O no hydrogen 2.977 N/A LEU 598.A N VAL 648.A O no hydrogen 3.403 N/A LEU 599.A N ASP 626.A O no hydrogen 2.680 N/A ALA 600.A N GLY 650.A O no hydrogen 2.723 N/A LYS 601.A NZ ASP 605.A OD2 no hydrogen 2.909 N/A LYS 601.A NZ HIS 607.A O no hydrogen 2.754 N/A LYS 601.A NZ SER 652.A O no hydrogen 2.620 N/A GLY 603.A N GLN 632.A O no hydrogen 3.074 N/A GLN 604.A N ASP 132.A OD2 no hydrogen 3.135 N/A HIS 607.A N ASP 605.A OD1 no hydrogen 2.830 N/A HIS 607.A ND1 ASP 605.A OD1 no hydrogen 2.716 N/A ARG 609.A NH1 GLU 244.A O no hydrogen 2.610 N/A GLN 611.A NE2 LEU 599.A O no hydrogen 3.504 N/A GLN 611.A NE2 GLY 628.A O no hydrogen 3.087 N/A LYS 612.A N ASP 608.A O no hydrogen 3.090 N/A LYS 612.A NZ GLU 444.A OE2 no hydrogen 2.669 N/A VAL 613.A N ARG 609.A O no hydrogen 2.921 N/A VAL 613.A N GLY 610.A O no hydrogen 2.714 N/A ILE 614.A N GLY 610.A O no hydrogen 3.013 N/A ALA 615.A N GLN 611.A O no hydrogen 2.918 N/A THR 616.A N LYS 612.A O no hydrogen 3.336 N/A THR 616.A OG1 ILE 563.A O no hydrogen 3.221 N/A TYR 618.A N ILE 614.A O no hydrogen 2.831 N/A TYR 618.A OH SER 711.A OG no hydrogen 2.746 N/A ASP 620.A N THR 616.A O no hydrogen 2.995 N/A LEU 621.A N ALA 617.A O no hydrogen 2.745 N/A ASP 624.A N PRO 595.A O no hydrogen 2.817 N/A ASP 626.A N ILE 597.A O no hydrogen 2.703 N/A GLY 628.A N LEU 599.A O no hydrogen 2.836 N/A GLN 632.A N LYS 601.A O no hydrogen 3.162 N/A THR 633.A OG1 GLU 636.A OE1 no hydrogen 2.663 N/A GLU 636.A N THR 633.A O no hydrogen 2.898 N/A THR 637.A N THR 633.A O no hydrogen 3.051 N/A THR 637.A OG1 THR 633.A O no hydrogen 3.065 N/A GLN 640.A N GLU 636.A O no hydrogen 3.313 N/A ALA 641.A N THR 637.A O no hydrogen 2.992 N/A VAL 642.A N ALA 638.A O no hydrogen 2.886 N/A GLU 643.A N ARG 639.A O no hydrogen 2.782 N/A VAL 646.A N ALA 641.A O no hydrogen 3.160 N/A HIS 647.A N ARG 596.A O no hydrogen 2.993 N/A VAL 648.A N ARG 596.A O no hydrogen 3.413 N/A VAL 649.A N LEU 678.A O no hydrogen 3.182 N/A GLY 650.A N LEU 598.A O no hydrogen 2.757 N/A VAL 651.A N THR 680.A O no hydrogen 3.118 N/A SER 652.A N ALA 600.A O no hydrogen 3.036 N/A SER 653.A N GLY 682.A O no hydrogen 2.643 N/A LEU 654.A N ASP 605.A OD2 no hydrogen 2.749 N/A ALA 655.A N ASP 605.A OD2 no hydrogen 3.149 N/A GLY 656.A N LEU 654.A O no hydrogen 3.070 N/A VAL 662.A N HIS 658.A O no hydrogen 3.371 N/A ALA 664.A N THR 660.A O no hydrogen 3.023 N/A LEU 665.A N LEU 661.A O no hydrogen 2.990 N/A ARG 666.A N VAL 662.A O no hydrogen 2.781 N/A ARG 666.A NH1 ILE 677.A O no hydrogen 2.764 N/A ARG 666.A NH2 ASP 670.A OD1 no hydrogen 3.044 N/A ARG 666.A NH2 ILE 677.A O no hydrogen 3.395 N/A LYS 667.A N PRO 663.A O no hydrogen 2.695 N/A GLU 668.A N ALA 664.A O no hydrogen 2.743 N/A LEU 669.A N LEU 665.A O no hydrogen 2.751 N/A ASP 670.A N ARG 666.A O no hydrogen 3.110 N/A LYS 671.A N LYS 667.A O no hydrogen 3.237 N/A LYS 671.A NZ GLU 668.A OE2 no hydrogen 2.703 N/A LEU 672.A N LEU 669.A O no hydrogen 3.243 N/A GLY 673.A N ASP 670.A O no hydrogen 3.011 N/A ARG 674.A N LEU 669.A O no hydrogen 3.273 N/A ARG 674.A NE ASP 676.A OD1 no hydrogen 2.733 N/A ARG 674.A NE ASP 676.A OD2 no hydrogen 3.002 N/A ARG 674.A NH1 ASP 645.A OD1 no hydrogen 2.579 N/A ARG 674.A NH2 ASP 676.A OD2 no hydrogen 3.106 N/A THR 680.A N VAL 649.A O no hydrogen 3.287 N/A THR 680.A OG1 VAL 649.A O no hydrogen 3.231 N/A VAL 681.A N GLU 700.A O no hydrogen 2.918 N/A GLY 682.A N VAL 651.A O no hydrogen 2.616 N/A GLY 683.A N TYR 702.A O no hydrogen 3.095 N/A VAL 684.A N SER 653.A O no hydrogen 3.314 N/A GLN 688.A NE2 VAL 477.A O no hydrogen 3.257 N/A ASP 689.A N PRO 686.A O no hydrogen 3.093 N/A LEU 693.A N ASP 689.A O no hydrogen 3.446 N/A ARG 694.A N PHE 690.A O no hydrogen 3.076 N/A ARG 694.A NH1 VAL 699.A O no hydrogen 2.736 N/A ARG 694.A NH1 GLU 700.A OE1 no hydrogen 3.501 N/A LYS 695.A N ASP 691.A O no hydrogen 3.345 N/A ASP 696.A N GLU 692.A O no hydrogen 2.997 N/A GLY 697.A N ARG 694.A O no hydrogen 3.181 N/A ALA 698.A N LEU 693.A O no hydrogen 2.904 N/A VAL 699.A N ILE 679.A O no hydrogen 2.746 N/A TYR 702.A N VAL 681.A O no hydrogen 2.872 N/A THR 706.A OG1 THR 703.A O no hydrogen 2.848 N/A ILE 708.A N ASP 455.A OD1 no hydrogen 2.880 N/A SER 711.A N VAL 707.A O no hydrogen 3.453 N/A SER 711.A OG TYR 618.A OH no hydrogen 2.746 N/A SER 711.A OG ILE 708.A O no hydrogen 2.981 N/A ALA 712.A N ILE 708.A O no hydrogen 3.329 N/A ILE 713.A N PRO 709.A O no hydrogen 3.257 N/A SER 714.A N GLU 710.A O no hydrogen 2.956 N/A SER 714.A OG GLU 700.A OE2 no hydrogen 2.614 N/A LEU 715.A N SER 711.A O no hydrogen 2.788 N/A VAL 716.A N ALA 712.A O no hydrogen 2.797 N/A LYS 717.A N ILE 713.A O no hydrogen 2.822 N/A LYS 718.A N SER 714.A O no hydrogen 3.080 N/A LEU 719.A N LEU 715.A O no hydrogen 2.690 N/A ARG 720.A N VAL 716.A O no hydrogen 2.958 N/A ARG 720.A N LYS 717.A O no hydrogen 3.024 N/A ALA 721.A N LYS 717.A O no hydrogen 3.316 N/A SER 722.A OG LEU 719.A O no hydrogen 2.736 N/A