Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3req_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 7.A OG ASP 11.A OD1 no hydrogen 2.974 N/A THR 16.A N GLN 19.A OE1 no hydrogen 2.684 N/A THR 16.A OG1 GLU 18.A OE1 no hydrogen 3.028 N/A THR 16.A OG1 GLN 19.A OE1 no hydrogen 2.693 N/A GLU 21.A N GLU 17.A O no hydrogen 2.965 N/A ARG 22.A N GLU 18.A O no hydrogen 2.686 N/A GLU 23.A N GLN 19.A O no hydrogen 3.122 N/A VAL 24.A N TRP 20.A O no hydrogen 3.161 N/A GLU 25.A N ARG 22.A O no hydrogen 3.270 N/A LYS 26.A N ARG 22.A O no hydrogen 3.345 N/A VAL 27.A N GLU 23.A O no hydrogen 3.259 N/A LEU 28.A N VAL 24.A O no hydrogen 3.441 N/A ASN 29.A N GLU 25.A O no hydrogen 3.043 N/A ASN 29.A ND2 LEU 38.A O no hydrogen 2.976 N/A ARG 32.A NE LYS 36.A O no hydrogen 3.478 N/A GLN 37.A NE2 ARG 32.A O no hydrogen 2.865 N/A LEU 38.A N ASN 29.A OD1 no hydrogen 3.000 N/A THR 39.A N GLU 42.A OE1 no hydrogen 2.988 N/A THR 39.A OG1 GLU 42.A OE1 no hydrogen 3.358 N/A CYS 43.A N THR 39.A O no hydrogen 2.955 N/A CYS 43.A SG VAL 24.A O no hydrogen 4.022 N/A CYS 43.A SG THR 39.A O no hydrogen 3.253 N/A LEU 44.A N PHE 40.A O no hydrogen 2.703 N/A LYS 45.A N ALA 41.A O no hydrogen 3.067 N/A ARG 46.A N GLU 42.A O no hydrogen 3.313 N/A LEU 47.A N CYS 43.A O no hydrogen 3.177 N/A LEU 47.A N LEU 44.A O no hydrogen 2.997 N/A THR 48.A OG1 LEU 44.A O no hydrogen 2.653 N/A VAL 49.A N ILE 57.A O no hydrogen 2.869 N/A HIS 50.A ND1 ASP 56.A OD1 no hydrogen 2.726 N/A THR 51.A N ILE 55.A O no hydrogen 2.804 N/A THR 51.A OG1 ASP 53.A OD1 no hydrogen 3.321 N/A THR 51.A OG1 ILE 55.A O no hydrogen 3.421 N/A ILE 57.A N VAL 49.A O no hydrogen 2.825 N/A ARG 62.A N ASP 65.A OD2 no hydrogen 2.617 N/A ASP 65.A N ARG 62.A O no hydrogen 2.938 N/A GLY 74.A N GLY 81.A O no hydrogen 3.072 N/A ARG 80.A NE ASP 382.A OD2 no hydrogen 3.229 N/A ARG 80.A NH1 GLY 71.A O no hydrogen 3.423 N/A ARG 80.A NH2 ASP 382.A O no hydrogen 3.376 N/A THR 82.A OG1 ALA 305.A O no hydrogen 2.645 N/A THR 83.A OG1 GLU 341.A OE2 no hydrogen 2.672 N/A ARG 85.A N ASN 381.A OD1 no hydrogen 3.357 N/A ARG 85.A NH1 VAL 380.A O no hydrogen 2.708 N/A ARG 85.A NH2 SER 336.A O no hydrogen 2.623 N/A ASN 86.A ND2 ASP 88.A OD2 no hydrogen 2.757 N/A ASP 88.A N ASN 86.A OD1 no hydrogen 3.276 N/A VAL 94.A N THR 119.A OG1 no hydrogen 2.777 N/A ARG 95.A N ILE 343.A O no hydrogen 3.308 N/A ARG 95.A NE SER 120.A OG no hydrogen 2.656 N/A ARG 95.A NH2 ASP 93.A OD2 no hydrogen 2.933 N/A HIS 98.A N LEU 122.A O no hydrogen 2.753 N/A ASP 102.A N ASP 100.A OD1 no hydrogen 3.183 N/A GLU 103.A N GLU 103.A OE1 no hydrogen 2.907 N/A LYS 104.A N ASP 102.A OD1 no hydrogen 2.865 N/A THR 106.A OG1 ASP 100.A O no hydrogen 2.845 N/A THR 106.A OG1 ASP 102.A O no hydrogen 2.726 N/A ARG 107.A N GLU 103.A O no hydrogen 3.240 N/A ARG 107.A NE ASP 141.A OD1 no hydrogen 3.344 N/A ARG 107.A NE ASP 141.A OD2 no hydrogen 2.709 N/A ARG 107.A NH2 ASP 141.A OD1 no hydrogen 2.640 N/A ALA 109.A N PHE 105.A O no hydrogen 2.904 N/A ILE 110.A N THR 106.A O no hydrogen 2.931 N/A LEU 111.A N ARG 107.A O no hydrogen 3.245 N/A GLU 112.A N LYS 108.A O no hydrogen 2.789 N/A GLY 113.A N ALA 109.A O no hydrogen 2.756 N/A LEU 114.A N ILE 110.A O no hydrogen 2.841 N/A GLU 115.A N LEU 111.A O no hydrogen 2.880 N/A ARG 116.A N GLY 113.A O no hydrogen 2.839 N/A VAL 118.A N GLY 113.A O no hydrogen 3.063 N/A THR 119.A N VAL 94.A O no hydrogen 2.939 N/A THR 119.A OG1 ASP 93.A OD1 no hydrogen 2.916 N/A THR 119.A OG1 VAL 94.A O no hydrogen 3.198 N/A SER 120.A N VAL 94.A O no hydrogen 3.063 N/A SER 120.A OG ASP 93.A OD1 no hydrogen 2.613 N/A SER 120.A OG ASP 93.A OD2 no hydrogen 2.975 N/A LEU 121.A N LYS 148.A O no hydrogen 3.374 N/A LEU 122.A N ALA 96.A O no hydrogen 2.629 N/A LEU 123.A N GLU 150.A O no hydrogen 2.751 N/A ARG 124.A N HIS 98.A O no hydrogen 3.185 N/A ARG 124.A NH1 ASP 126.A OD2 no hydrogen 3.101 N/A ARG 124.A NH1 ASP 128.A OD1 no hydrogen 3.034 N/A ARG 124.A NH1 ASP 128.A OD2 no hydrogen 3.298 N/A ARG 124.A NH2 ASP 128.A OD2 no hydrogen 2.769 N/A VAL 125.A N PHE 152.A O no hydrogen 2.810 N/A ALA 129.A N ASP 126.A O no hydrogen 3.442 N/A ILE 130.A N GLU 99.A O no hydrogen 3.221 N/A HIS 134.A N ALA 131.A O no hydrogen 2.930 N/A VAL 138.A N HIS 134.A O no hydrogen 3.071 N/A LEU 139.A N ASP 136.A O no hydrogen 3.345 N/A SER 140.A OG ASP 136.A O no hydrogen 2.872 N/A SER 140.A OG GLU 137.A O no hydrogen 2.674 N/A GLU 145.A N GLU 145.A OE1 no hydrogen 3.247 N/A THR 147.A N LEU 143.A O no hydrogen 3.179 N/A THR 147.A OG1 LEU 143.A O no hydrogen 3.299 N/A LYS 148.A NZ ASN 181.A OD1 no hydrogen 2.747 N/A LYS 148.A NZ ASP 215.A O no hydrogen 3.406 N/A GLU 150.A N LEU 121.A O no hydrogen 2.957 N/A VAL 151.A N ASN 181.A O no hydrogen 3.515 N/A PHE 152.A N LEU 123.A O no hydrogen 3.051 N/A SER 153.A OG VAL 125.A O no hydrogen 2.611 N/A SER 153.A OG ASP 126.A OD1 no hydrogen 2.687 N/A SER 153.A OG ASP 156.A O no hydrogen 2.624 N/A ARG 154.A N ASP 126.A OD1 no hydrogen 3.051 N/A ARG 154.A N ASP 126.A OD2 no hydrogen 2.680 N/A TYR 155.A N ASP 126.A OD1 no hydrogen 2.807 N/A TYR 155.A OH PRO 468.A O no hydrogen 2.688 N/A GLN 157.A NE2 SER 153.A O no hydrogen 3.439 N/A GLN 157.A NE2 ASP 185.A O no hydrogen 3.619 N/A GLY 158.A N ASP 156.A OD1 no hydrogen 3.228 N/A ALA 163.A N ALA 159.A O no hydrogen 3.189 N/A ALA 163.A N ALA 160.A O no hydrogen 3.346 N/A LEU 164.A N ALA 160.A O no hydrogen 3.016 N/A SER 166.A OG GLU 162.A O no hydrogen 3.015 N/A TYR 168.A N LEU 164.A O no hydrogen 3.426 N/A TYR 168.A OH ALA 179.A O no hydrogen 2.693 N/A GLU 169.A N VAL 165.A O no hydrogen 2.659 N/A ARG 170.A N SER 166.A O no hydrogen 2.780 N/A SER 171.A N TYR 168.A O no hydrogen 3.389 N/A SER 171.A OG TYR 168.A O no hydrogen 2.715 N/A ASN 181.A N VAL 149.A O no hydrogen 3.090 N/A LEU 182.A N ARG 217.A O no hydrogen 3.046 N/A GLY 183.A N ALA 218.A O no hydrogen 3.270 N/A LEU 184.A N ALA 218.A O no hydrogen 3.374 N/A ASP 185.A N GLN 157.A OE1 no hydrogen 2.858 N/A ILE 187.A N TYR 247.A OH no hydrogen 2.647 N/A GLY 188.A N ASP 185.A OD1 no hydrogen 3.429 N/A PHE 189.A N ASP 185.A O no hydrogen 2.840 N/A ALA 190.A N PRO 186.A O no hydrogen 3.206 N/A ALA 191.A N ILE 187.A O no hydrogen 3.097 N/A LEU 192.A N GLY 188.A O no hydrogen 3.028 N/A GLN 193.A N PHE 189.A O no hydrogen 3.021 N/A GLN 193.A NE2 ARG 154.A O no hydrogen 3.128 N/A GLY 194.A N ALA 190.A O no hydrogen 2.787 N/A THR 200.A OG1 ASP 198.A OD1 no hydrogen 3.314 N/A VAL 206.A N LEU 202.A O no hydrogen 3.482 N/A ARG 207.A N GLY 203.A O no hydrogen 2.931 N/A ARG 207.A NH2 GLN 254.A O no hydrogen 2.718 N/A ARG 208.A N TRP 205.A O no hydrogen 3.151 N/A ARG 208.A NE GLU 169.A OE1 no hydrogen 3.221 N/A ARG 208.A NE GLU 169.A OE2 no hydrogen 3.485 N/A ARG 208.A NH1 GLU 162.A OE1 no hydrogen 2.827 N/A ARG 208.A NH1 GLU 162.A OE2 no hydrogen 3.184 N/A ARG 208.A NH2 GLU 162.A OE2 no hydrogen 2.993 N/A ARG 208.A NH2 GLU 169.A OE1 no hydrogen 3.265 N/A LEU 209.A N TRP 205.A O no hydrogen 2.903 N/A LYS 211.A NZ GLU 169.A OE2 no hydrogen 3.006 N/A SER 213.A N LEU 178.A O no hydrogen 3.210 N/A SER 213.A OG SER 216.A OG no hydrogen 3.146 N/A SER 216.A N SER 213.A OG no hydrogen 2.834 N/A SER 216.A OG SER 213.A OG no hydrogen 3.146 N/A ARG 217.A N LEU 180.A O no hydrogen 2.981 N/A ARG 217.A NH1 ASP 263.A O no hydrogen 3.416 N/A ALA 218.A N THR 264.A OG1 no hydrogen 3.094 N/A VAL 219.A N THR 264.A O no hydrogen 2.879 N/A THR 220.A N LEU 184.A O no hydrogen 2.942 N/A ILE 221.A N ASN 266.A O no hydrogen 3.100 N/A ASP 222.A N ASP 185.A OD2 no hydrogen 2.695 N/A ALA 223.A N ARG 268.A O no hydrogen 3.029 N/A ASN 224.A ND2 THR 270.A OG1 no hydrogen 3.242 N/A HIS 227.A NE2 SER 312.A OG no hydrogen 2.739 N/A ASN 228.A N ASN 224.A O no hydrogen 3.139 N/A ASN 228.A ND2 ASN 224.A OD1 no hydrogen 3.574 N/A ALA 229.A N ILE 225.A O no hydrogen 3.209 N/A GLY 230.A N TYR 226.A O no hydrogen 3.351 N/A ALA 231.A N TYR 226.A O no hydrogen 2.871 N/A ALA 235.A N ASP 53.A OD2 no hydrogen 3.478 N/A GLU 236.A N GLY 232.A O no hydrogen 2.755 N/A LEU 237.A N ASP 233.A O no hydrogen 3.168 N/A ALA 238.A N VAL 234.A O no hydrogen 2.864 N/A LEU 241.A N LEU 237.A O no hydrogen 3.438 N/A ALA 242.A N ALA 238.A O no hydrogen 2.995 N/A THR 243.A N TRP 239.A O no hydrogen 2.712 N/A THR 243.A OG1 TRP 239.A O no hydrogen 2.718 N/A GLY 244.A N ALA 240.A O no hydrogen 2.775 N/A ALA 245.A N LEU 241.A O no hydrogen 3.169 N/A TYR 247.A N GLY 244.A O no hydrogen 3.161 N/A TYR 247.A OH ASP 185.A OD1 no hydrogen 2.644 N/A VAL 248.A N GLY 244.A O no hydrogen 3.174 N/A ARG 249.A N ALA 245.A O no hydrogen 2.863 N/A ARG 249.A NH2 GLU 409.A OE2 no hydrogen 2.628 N/A ALA 250.A N GLU 246.A O no hydrogen 2.928 N/A LEU 251.A N TYR 247.A O no hydrogen 2.722 N/A VAL 252.A N VAL 248.A O no hydrogen 3.264 N/A VAL 252.A N ARG 249.A O no hydrogen 3.097 N/A GLU 253.A N ARG 249.A O no hydrogen 3.395 N/A GLN 254.A N ALA 250.A O no hydrogen 3.246 N/A GLN 254.A NE2 LEU 199.A O no hydrogen 3.131 N/A THR 257.A N GLU 260.A OE1 no hydrogen 2.659 N/A THR 257.A OG1 GLU 260.A OE1 no hydrogen 2.650 N/A ALA 261.A N THR 257.A O no hydrogen 3.356 N/A ASP 263.A N GLU 260.A O no hydrogen 3.240 N/A THR 264.A N ALA 261.A O no hydrogen 3.428 N/A ASN 266.A N VAL 219.A O no hydrogen 2.914 N/A PHE 267.A N ARG 306.A O no hydrogen 2.988 N/A ARG 268.A N ILE 221.A O no hydrogen 2.985 N/A ARG 268.A NE ASP 222.A OD2 no hydrogen 2.660 N/A VAL 269.A N ASN 308.A O no hydrogen 3.240 N/A THR 270.A N GLU 236.A OE2 no hydrogen 3.323 N/A THR 270.A OG1 GLU 236.A OE1 no hydrogen 2.577 N/A THR 270.A OG1 GLU 236.A OE2 no hydrogen 3.377 N/A ALA 271.A N ILE 310.A O no hydrogen 2.980 N/A THR 272.A N THR 278.A OG1 no hydrogen 3.125 N/A HIS 273.A N GLU 315.A OE1 no hydrogen 3.086 N/A ASP 274.A N THR 272.A OG1 no hydrogen 2.925 N/A LEU 277.A N ASP 274.A OD1 no hydrogen 3.037 N/A THR 278.A N ASP 274.A O no hydrogen 2.876 N/A THR 278.A OG1 THR 272.A O no hydrogen 3.415 N/A THR 278.A OG1 ASP 274.A O no hydrogen 3.020 N/A ILE 279.A N GLN 275.A O no hydrogen 2.883 N/A ALA 280.A N PHE 276.A O no hydrogen 3.165 N/A ARG 281.A N LEU 277.A O no hydrogen 3.171 N/A ARG 281.A NE ASP 233.A OD1 no hydrogen 2.847 N/A ARG 281.A NH1 THR 270.A O no hydrogen 2.604 N/A ARG 281.A NH2 ASP 233.A OD1 no hydrogen 3.462 N/A ARG 281.A NH2 THR 270.A O no hydrogen 3.158 N/A LEU 282.A N THR 278.A O no hydrogen 3.142 N/A ARG 283.A N ILE 279.A O no hydrogen 3.080 N/A ARG 283.A NH1 GLU 391.A OE2 no hydrogen 3.140 N/A ARG 283.A NH2 GLU 391.A OE2 no hydrogen 3.107 N/A ALA 284.A N ALA 280.A O no hydrogen 2.788 N/A LEU 285.A N ARG 281.A O no hydrogen 3.099 N/A ARG 286.A NE PHE 78.A O no hydrogen 2.993 N/A ARG 286.A NE THR 79.A O no hydrogen 3.190 N/A ARG 286.A NH1 GLY 338.A O no hydrogen 2.646 N/A ARG 286.A NH2 THR 79.A O no hydrogen 2.601 N/A ARG 286.A NH2 GLY 338.A O no hydrogen 2.967 N/A ALA 288.A N ALA 284.A O no hydrogen 3.402 N/A TRP 289.A N ARG 286.A O no hydrogen 3.034 N/A ALA 290.A N ARG 286.A O no hydrogen 3.015 N/A ALA 290.A N GLU 287.A O no hydrogen 3.355 N/A ARG 291.A NH1 GLU 294.A OE1 no hydrogen 3.314 N/A GLY 293.A N TRP 289.A O no hydrogen 3.468 N/A GLU 294.A N ALA 290.A O no hydrogen 3.018 N/A VAL 295.A N ARG 291.A O no hydrogen 3.108 N/A PHE 296.A N ILE 292.A O no hydrogen 2.958 N/A GLY 297.A N GLY 293.A O no hydrogen 2.769 N/A LYS 302.A N ASP 299.A O no hydrogen 3.097 N/A LYS 302.A NZ ASP 263.A OD2 no hydrogen 3.440 N/A ARG 303.A NE VAL 298.A O no hydrogen 2.624 N/A ARG 303.A NH2 VAL 298.A O no hydrogen 2.882 N/A ARG 306.A NE ASN 266.A OD1 no hydrogen 2.958 N/A ARG 306.A NH2 PHE 262.A O no hydrogen 3.292 N/A GLN 307.A N GLU 341.A OE1 no hydrogen 3.177 N/A ASN 308.A N PHE 267.A O no hydrogen 2.831 N/A ALA 309.A N SER 342.A O no hydrogen 2.863 N/A ILE 310.A N VAL 269.A O no hydrogen 2.949 N/A THR 311.A N THR 344.A O no hydrogen 3.033 N/A SER 312.A N ALA 271.A O no hydrogen 3.016 N/A SER 312.A OG HIS 227.A NE2 no hydrogen 2.739 N/A ARG 314.A NE ASP 478.A OD1 no hydrogen 2.865 N/A ARG 314.A NH1 HIS 227.A O no hydrogen 3.052 N/A ARG 314.A NH1 ALA 231.A O no hydrogen 2.996 N/A LEU 316.A N TRP 313.A O no hydrogen 3.013 N/A THR 317.A N ASN 324.A OD1 no hydrogen 2.986 N/A THR 317.A OG1 GLU 319.A O no hydrogen 2.635 N/A ARG 318.A N GLU 483.A OE2 no hydrogen 2.936 N/A ARG 318.A NE GLU 319.A OE1 no hydrogen 2.872 N/A ARG 318.A NE GLU 319.A OE2 no hydrogen 2.952 N/A ARG 318.A NH1 ASP 487.A OD2 no hydrogen 3.109 N/A ARG 318.A NH2 GLU 319.A OE1 no hydrogen 2.786 N/A ARG 318.A NH2 GLU 319.A OE2 no hydrogen 3.452 N/A ARG 318.A NH2 GLU 483.A O no hydrogen 3.153 N/A ASN 324.A N PRO 321.A O no hydrogen 3.329 N/A ASN 324.A ND2 THR 317.A O no hydrogen 3.298 N/A ASN 324.A ND2 PRO 321.A O no hydrogen 2.655 N/A ASN 324.A ND2 PHE 348.A O no hydrogen 3.209 N/A ARG 327.A N VAL 323.A O no hydrogen 3.313 N/A ARG 327.A NH1 ASN 324.A OD1 no hydrogen 2.895 N/A GLY 328.A N ASN 324.A O no hydrogen 2.937 N/A SER 329.A N ILE 325.A O no hydrogen 2.747 N/A SER 329.A OG ILE 325.A O no hydrogen 2.709 N/A ILE 330.A N LEU 326.A O no hydrogen 3.021 N/A ALA 331.A N ARG 327.A O no hydrogen 3.031 N/A THR 332.A N GLY 328.A O no hydrogen 2.957 N/A THR 332.A OG1 GLY 328.A O no hydrogen 2.600 N/A THR 332.A OG1 THR 345.A OG1 no hydrogen 2.630 N/A PHE 333.A N SER 329.A O no hydrogen 3.208 N/A SER 334.A N ILE 330.A O no hydrogen 3.212 N/A SER 334.A OG ILE 330.A O no hydrogen 2.645 N/A ALA 335.A N ALA 331.A O no hydrogen 3.024 N/A SER 336.A N THR 332.A O no hydrogen 3.242 N/A SER 336.A N PHE 333.A O no hydrogen 3.035 N/A VAL 337.A N PHE 333.A O no hydrogen 3.291 N/A GLY 339.A N SER 336.A O no hydrogen 3.104 N/A ALA 340.A N ALA 335.A O no hydrogen 2.865 N/A GLU 341.A N GLN 307.A O no hydrogen 2.634 N/A SER 342.A OG ASN 308.A OD1 no hydrogen 2.618 N/A ILE 343.A N ASP 93.A O no hydrogen 3.110 N/A THR 344.A N ALA 309.A O no hydrogen 2.664 N/A THR 344.A OG1 ARG 95.A O no hydrogen 2.783 N/A THR 345.A OG1 THR 332.A OG1 no hydrogen 2.630 N/A LEU 346.A N THR 311.A OG1 no hydrogen 2.771 N/A GLY 353.A N THR 349.A O no hydrogen 2.996 N/A LEU 354.A N LYS 462.A O no hydrogen 2.909 N/A ARG 362.A N ASP 358.A O no hydrogen 2.838 N/A ARG 362.A N PHE 359.A O no hydrogen 3.094 N/A ILE 363.A N PHE 359.A O no hydrogen 3.039 N/A ALA 364.A N PRO 360.A O no hydrogen 2.766 N/A ARG 365.A N LEU 361.A O no hydrogen 3.239 N/A ARG 365.A NH1 ASP 358.A OD1 no hydrogen 3.171 N/A ARG 365.A NH1 ASP 358.A OD2 no hydrogen 3.255 N/A ARG 365.A NH2 ASP 358.A OD2 no hydrogen 3.501 N/A ASN 366.A N ARG 362.A O no hydrogen 2.923 N/A THR 367.A N ALA 364.A O no hydrogen 3.199 N/A THR 367.A OG1 ILE 363.A O no hydrogen 2.771 N/A THR 367.A OG1 ALA 364.A O no hydrogen 3.387 N/A ILE 369.A N ARG 365.A O no hydrogen 3.446 N/A VAL 370.A N ASN 366.A O no hydrogen 2.829 N/A LEU 371.A N THR 367.A O no hydrogen 3.305 N/A ALA 372.A N GLY 368.A O no hydrogen 2.768 N/A GLU 373.A N ILE 369.A O no hydrogen 3.110 N/A GLU 374.A N VAL 370.A O no hydrogen 2.737 N/A VAL 375.A N VAL 370.A O no hydrogen 3.391 N/A ASN 376.A N LEU 371.A O no hydrogen 2.836 N/A ILE 377.A N LEU 371.A O no hydrogen 3.383 N/A ASN 381.A ND2 ARG 85.A O no hydrogen 3.295 N/A GLY 386.A N GLU 391.A OE2 no hydrogen 2.653 N/A GLU 391.A N SER 387.A O no hydrogen 2.849 N/A SER 392.A N TYR 388.A O no hydrogen 2.723 N/A LEU 393.A N TYR 389.A O no hydrogen 2.800 N/A THR 394.A N VAL 390.A O no hydrogen 3.047 N/A THR 394.A OG1 VAL 390.A O no hydrogen 2.724 N/A ARG 395.A N GLU 391.A O no hydrogen 3.277 N/A ARG 395.A NH2 GLU 287.A OE1 no hydrogen 2.851 N/A SER 396.A N SER 392.A O no hydrogen 2.793 N/A SER 396.A OG SER 392.A O no hydrogen 2.955 N/A LEU 397.A N LEU 393.A O no hydrogen 2.689 N/A ALA 398.A N THR 394.A O no hydrogen 3.043 N/A ASP 399.A N ARG 395.A O no hydrogen 2.980 N/A ALA 400.A N SER 396.A O no hydrogen 3.066 N/A ALA 401.A N LEU 397.A O no hydrogen 2.896 N/A TRP 402.A N ALA 398.A O no hydrogen 2.826 N/A LYS 403.A N ASP 399.A O no hydrogen 2.964 N/A GLU 404.A N ALA 400.A O no hydrogen 3.053 N/A PHE 405.A N ALA 401.A O no hydrogen 2.813 N/A PHE 405.A N TRP 402.A O no hydrogen 2.962 N/A GLN 406.A N TRP 402.A O no hydrogen 2.836 N/A GLU 407.A N LYS 403.A O no hydrogen 3.253 N/A VAL 408.A N GLU 404.A O no hydrogen 3.333 N/A GLU 409.A N PHE 405.A O no hydrogen 2.981 N/A LYS 410.A N GLN 406.A O no hydrogen 2.948 N/A LYS 410.A N GLU 407.A O no hydrogen 3.124 N/A GLY 413.A N VAL 408.A O no hydrogen 2.819 N/A GLY 413.A N LEU 411.A O no hydrogen 3.274 N/A MET 414.A N GLU 246.A OE1 no hydrogen 2.911 N/A ALA 417.A N GLY 413.A O no hydrogen 3.197 N/A VAL 418.A N MET 414.A O no hydrogen 2.907 N/A MET 419.A N SER 415.A O no hydrogen 3.022 N/A THR 420.A N LYS 416.A O no hydrogen 2.961 N/A GLU 421.A N THR 420.A OG1 no hydrogen 2.704 N/A HIS 422.A N ALA 417.A O no hydrogen 3.416 N/A VAL 423.A N ALA 417.A O no hydrogen 3.411 N/A LYS 425.A N GLU 421.A O no hydrogen 3.454 N/A VAL 426.A N HIS 422.A O no hydrogen 3.273 N/A LEU 427.A N VAL 423.A O no hydrogen 3.040 N/A ASP 428.A N THR 424.A O no hydrogen 3.053 N/A CYS 430.A N VAL 426.A O no hydrogen 3.439 N/A CYS 430.A SG VAL 426.A O no hydrogen 3.678 N/A ASN 431.A ND2 ALA 229.A O no hydrogen 3.479 N/A ASN 431.A ND2 LEU 427.A O no hydrogen 2.785 N/A ALA 432.A N ASP 428.A O no hydrogen 3.259 N/A GLU 433.A N ALA 429.A O no hydrogen 3.267 N/A ARG 434.A N CYS 430.A O no hydrogen 2.939 N/A ARG 434.A NH1 GLY 230.A O no hydrogen 2.866 N/A ARG 434.A NH2 GLY 230.A O no hydrogen 2.749 N/A ALA 435.A N ASN 431.A O no hydrogen 3.146 N/A LYS 436.A N ALA 432.A O no hydrogen 3.386 N/A ARG 437.A N GLU 433.A O no hydrogen 3.123 N/A ARG 437.A NE GLU 433.A OE2 no hydrogen 3.211 N/A ARG 437.A NH1 HIS 50.A O no hydrogen 3.327 N/A LEU 438.A N ARG 434.A O no hydrogen 2.743 N/A ALA 439.A N ALA 435.A O no hydrogen 2.744 N/A ALA 439.A N LYS 436.A O no hydrogen 3.285 N/A ASN 440.A N LYS 436.A O no hydrogen 3.234 N/A ARG 441.A N ARG 437.A O no hydrogen 3.076 N/A ARG 441.A NH1 SER 449.A O no hydrogen 2.753 N/A LYS 442.A N ARG 437.A O no hydrogen 2.934 N/A LYS 442.A N ASN 440.A OD1 no hydrogen 3.309 N/A GLN 443.A N ARG 437.A O no hydrogen 3.394 N/A ALA 447.A N GLU 450.A O no hydrogen 2.921 N/A VAL 448.A N ILE 445.A O no hydrogen 3.426 N/A ILE 459.A N SER 458.A OG no hydrogen 2.703 N/A LYS 462.A N LEU 354.A O no hydrogen 2.900 N/A LYS 462.A NZ ASP 100.A OD2 no hydrogen 3.218 N/A ARG 470.A NH1 LEU 192.A O no hydrogen 2.975 N/A ARG 470.A NH1 LEU 473.A O no hydrogen 2.677 N/A ARG 470.A NH2 LEU 473.A O no hydrogen 3.443 N/A LYS 471.A N GLN 193.A O no hydrogen 3.045 N/A GLY 472.A N GLN 193.A O no hydrogen 2.738 N/A LEU 473.A N ALA 191.A O no hydrogen 3.284 N/A TRP 475.A NE1 ILE 225.A O no hydrogen 3.104 N/A HIS 476.A ND1 GLU 480.A OE1 no hydrogen 2.736 N/A ARG 477.A N GLU 480.A OE2 no hydrogen 3.163 N/A ARG 477.A NH1 LEU 316.A O no hydrogen 3.269 N/A ARG 477.A NH1 GLU 483.A OE2 no hydrogen 3.220 N/A ASP 478.A N ARG 314.A O no hydrogen 2.799 N/A SER 479.A OG GLU 483.A OE2 no hydrogen 2.821 N/A GLU 483.A N SER 479.A O no hydrogen 3.242 N/A GLN 484.A N GLU 480.A O no hydrogen 2.783 N/A MET 486.A N PHE 482.A O no hydrogen 3.088 N/A MET 486.A N GLU 483.A O no hydrogen 3.159 N/A ASP 487.A N GLU 483.A O no hydrogen 3.060 N/A ARG 488.A N GLN 484.A O no hydrogen 3.396 N/A ARG 488.A NH1 SER 611.A O no hydrogen 3.022 N/A ARG 488.A NH1 ASP 615.A OD1 no hydrogen 2.717 N/A ARG 488.A NH2 VAL 619.A O no hydrogen 3.146 N/A SER 489.A OG LEU 485.A O no hydrogen 3.122 N/A SER 489.A OG ALA 523.A O no hydrogen 2.703 N/A THR 490.A N ASP 487.A O no hydrogen 3.193 N/A THR 490.A OG1 MET 486.A O no hydrogen 3.125 N/A THR 490.A OG1 ASP 487.A O no hydrogen 2.920 N/A SER 491.A N ASP 487.A O no hydrogen 3.385 N/A SER 491.A OG ARG 488.A O no hydrogen 2.701 N/A VAL 498.A N ASP 526.A O no hydrogen 3.167 N/A PHE 499.A N VAL 547.A O no hydrogen 3.121 N/A LEU 500.A N PRO 528.A O no hydrogen 2.902 N/A ALA 501.A N ASP 549.A O no hydrogen 2.746 N/A LEU 503.A N CYS 551.A O no hydrogen 2.954 N/A ASP 508.A N THR 505.A O no hydrogen 3.302 N/A PHE 509.A N THR 505.A O no hydrogen 3.324 N/A GLY 510.A N ARG 506.A O no hydrogen 3.121 N/A ARG 512.A N PHE 509.A O no hydrogen 2.874 N/A ARG 512.A NH1 SER 552.A O no hydrogen 2.619 N/A ARG 512.A NH1 GLU 584.A OE1 no hydrogen 3.016 N/A ARG 512.A NH2 GLU 584.A OE1 no hydrogen 2.992 N/A GLU 513.A N PHE 509.A O no hydrogen 3.231 N/A GLY 514.A N GLY 510.A O no hydrogen 3.312 N/A PHE 515.A N ARG 512.A O no hydrogen 3.390 N/A SER 516.A N ARG 512.A O no hydrogen 3.158 N/A SER 516.A N GLU 513.A O no hydrogen 3.229 N/A SER 516.A OG ARG 512.A O no hydrogen 2.679 N/A SER 516.A OG SER 579.A OG no hydrogen 2.714 N/A SER 517.A N GLU 513.A O no hydrogen 3.132 N/A SER 517.A OG GLU 513.A O no hydrogen 3.474 N/A VAL 519.A N SER 516.A O no hydrogen 2.804 N/A TRP 520.A NE1 ASP 549.A OD2 no hydrogen 3.201 N/A HIS 521.A N SER 517.A O no hydrogen 3.091 N/A HIS 521.A NE2 THR 527.A OG1 no hydrogen 2.708 N/A ALA 523.A N TRP 520.A O no hydrogen 3.196 N/A ILE 525.A N TRP 520.A O no hydrogen 3.395 N/A ASP 526.A N PRO 496.A O no hydrogen 2.730 N/A GLN 529.A NE2 GLU 513.A OE2 no hydrogen 2.703 N/A ALA 539.A N GLU 535.A O no hydrogen 3.308 N/A PHE 540.A N VAL 537.A O no hydrogen 3.114 N/A LYS 541.A N VAL 537.A O no hydrogen 3.055 N/A SER 543.A N ALA 539.A O no hydrogen 2.912 N/A SER 543.A OG PHE 540.A O no hydrogen 3.166 N/A ALA 545.A N SER 543.A OG no hydrogen 3.118 N/A GLN 546.A NE2 LEU 617.A O no hydrogen 3.684 N/A ASP 549.A N PHE 499.A O no hydrogen 2.777 N/A LEU 550.A N TYR 577.A O no hydrogen 2.687 N/A CYS 551.A N ALA 501.A O no hydrogen 2.751 N/A CYS 551.A SG SER 516.A OG no hydrogen 3.747 N/A CYS 551.A SG ASP 549.A OD1 no hydrogen 3.200 N/A CYS 551.A SG SER 579.A OG no hydrogen 3.299 N/A SER 552.A N TYR 557.A OH no hydrogen 3.108 N/A SER 552.A OG LEU 503.A O no hydrogen 2.574 N/A SER 553.A OG ASP 508.A O no hydrogen 3.462 N/A TYR 557.A N SER 553.A O no hydrogen 3.065 N/A TYR 557.A N ALA 554.A O no hydrogen 3.184 N/A TYR 557.A OH LEU 550.A O no hydrogen 2.651 N/A TYR 557.A OH SER 579.A O no hydrogen 2.591 N/A ALA 558.A N ALA 554.A O no hydrogen 3.089 N/A GLN 560.A N VAL 556.A O no hydrogen 2.849 N/A GLY 561.A N TYR 557.A O no hydrogen 2.983 N/A ALA 565.A N GLY 561.A O no hydrogen 3.324 N/A LYS 566.A N LEU 562.A O no hydrogen 2.970 N/A ALA 567.A N GLU 563.A O no hydrogen 2.684 N/A LEU 568.A N VAL 564.A O no hydrogen 2.850 N/A LYS 569.A N ALA 565.A O no hydrogen 2.702 N/A LYS 574.A N GLN 546.A O no hydrogen 2.721 N/A LEU 576.A N ASP 597.A OD2 no hydrogen 3.113 N/A TYR 577.A N ALA 548.A O no hydrogen 2.668 N/A LEU 578.A N GLY 598.A O no hydrogen 3.129 N/A SER 579.A N LEU 550.A O no hydrogen 2.951 N/A SER 579.A OG SER 516.A OG no hydrogen 2.714 N/A SER 579.A OG ASP 549.A OD1 no hydrogen 2.608 N/A SER 579.A OG LEU 550.A O no hydrogen 3.366 N/A GLY 580.A N LEU 600.A O no hydrogen 3.082 N/A ALA 581.A N GLU 584.A OE2 no hydrogen 3.378 N/A PHE 585.A N PHE 582.A O no hydrogen 3.405 N/A ASP 587.A N PHE 585.A O no hydrogen 3.183 N/A GLU 591.A N ASP 588.A O no hydrogen 3.190 N/A ALA 592.A N ASP 588.A O no hydrogen 2.914 N/A ILE 596.A N ALA 592.A O no hydrogen 2.963 N/A ASP 597.A N LEU 576.A O no hydrogen 2.678 N/A ARG 599.A NH1 GLY 580.A O no hydrogen 2.744 N/A LEU 600.A N LEU 578.A O no hydrogen 2.861 N/A MET 604.A N PHE 601.A O no hydrogen 2.850 N/A VAL 606.A N ALA 439.A O no hydrogen 2.917 N/A ASP 608.A N ASP 605.A OD1 no hydrogen 3.072 N/A LEU 610.A N VAL 606.A O no hydrogen 2.851 N/A SER 611.A N VAL 607.A O no hydrogen 3.089 N/A SER 611.A OG VAL 607.A O no hydrogen 2.767 N/A SER 611.A OG ASP 608.A O no hydrogen 3.178 N/A SER 612.A N ASP 608.A O no hydrogen 3.288 N/A SER 612.A OG TYR 577.A OH no hydrogen 2.756 N/A THR 613.A N THR 609.A O no hydrogen 3.109 N/A THR 613.A OG1 THR 609.A O no hydrogen 3.371 N/A LEU 614.A N LEU 610.A O no hydrogen 3.133 N/A ASP 615.A N SER 611.A O no hydrogen 2.721 N/A ILE 616.A N SER 612.A O no hydrogen 2.989 N/A LEU 617.A N LEU 614.A O no hydrogen 2.852 N/A GLY 618.A N LEU 614.A O no hydrogen 3.137 N/A