Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7dr2_aA.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASN 180.A OD1 no hydrogen 3.479 N/A ASP 7.A N LYS 170.A O no hydrogen 2.554 N/A TRP 16.A N PHE 13.A O no hydrogen 3.139 N/A ARG 24.A NH1 SER 23.A O no hydrogen 2.716 N/A THR 32.A OG1 THR 34.A OG1 no hydrogen 2.905 N/A THR 33.A OG1 GLN 702.A O no hydrogen 2.286 N/A THR 34.A OG1 THR 32.A OG1 no hydrogen 2.905 N/A ILE 36.A N THR 33.A O no hydrogen 3.294 N/A ASN 38.A N THR 34.A O no hydrogen 2.609 N/A LEU 39.A N TRP 35.A O no hydrogen 2.962 N/A HIS 40.A N ILE 36.A O no hydrogen 3.504 N/A HIS 40.A ND1 ILE 36.A O no hydrogen 3.007 N/A ALA 41.A N TRP 37.A O no hydrogen 2.775 N/A SER 48.A N ASP 45.A O no hydrogen 3.067 N/A SER 48.A OG ASP 45.A O no hydrogen 2.877 N/A SER 48.A OG ASP 45.A OD1 no hydrogen 2.777 N/A TYR 49.A OH VAL 43.A O no hydrogen 2.225 N/A THR 50.A N PHE 46.A O no hydrogen 3.148 N/A THR 50.A OG1 PHE 46.A O no hydrogen 2.488 N/A SER 51.A OG TYR 49.A O no hydrogen 3.422 N/A VAL 56.A N ASP 52.A O no hydrogen 2.920 N/A SER 57.A N LEU 53.A O no hydrogen 3.437 N/A SER 57.A OG LEU 53.A O no hydrogen 2.577 N/A SER 57.A OG GLU 54.A O no hydrogen 2.705 N/A ARG 58.A NE PRO 173.A O no hydrogen 2.483 N/A ARG 58.A NH2 ASP 5.A OD1 no hydrogen 2.815 N/A ARG 58.A NH2 PRO 173.A O no hydrogen 2.797 N/A LYS 59.A N GLU 55.A O no hydrogen 3.321 N/A LYS 59.A NZ TYR 168.A OH no hydrogen 2.359 N/A ILE 60.A N VAL 56.A O no hydrogen 2.903 N/A SER 62.A N ARG 58.A O no hydrogen 3.041 N/A SER 62.A OG GLY 164.A O no hydrogen 2.497 N/A ALA 63.A N LYS 59.A O no hydrogen 3.259 N/A HIS 64.A N ILE 60.A O no hydrogen 3.218 N/A PHE 65.A N SER 62.A O no hydrogen 3.039 N/A GLY 66.A N SER 62.A O no hydrogen 3.268 N/A HIS 67.A N ALA 63.A O no hydrogen 2.987 N/A LEU 68.A N HIS 64.A O no hydrogen 2.778 N/A ALA 69.A N PHE 65.A O no hydrogen 2.806 N/A ALA 69.A N GLY 66.A O no hydrogen 3.115 N/A VAL 70.A N GLY 66.A O no hydrogen 3.148 N/A PHE 72.A N LEU 68.A O no hydrogen 3.438 N/A ILE 73.A N ALA 69.A O no hydrogen 2.793 N/A TRP 74.A N VAL 70.A O no hydrogen 3.150 N/A LEU 75.A N VAL 71.A O no hydrogen 2.425 N/A SER 76.A N PHE 72.A O no hydrogen 3.122 N/A SER 76.A OG ALA 150.A O no hydrogen 2.722 N/A GLY 77.A N ILE 73.A O no hydrogen 3.144 N/A ALA 78.A N TRP 74.A O no hydrogen 3.120 N/A TYR 79.A N SER 76.A O no hydrogen 2.849 N/A PHE 80.A N SER 76.A O no hydrogen 2.559 N/A ALA 83.A N TYR 79.A O no hydrogen 3.260 N/A ARG 84.A N PHE 80.A O no hydrogen 2.996 N/A SER 86.A OG GLY 82.A O no hydrogen 2.446 N/A ASN 87.A N SER 101.A O no hydrogen 3.220 N/A ASN 87.A ND2 LYS 99.A O no hydrogen 3.005 N/A TYR 88.A N SER 86.A OG no hydrogen 3.368 N/A TYR 88.A OH ILE 140.A O no hydrogen 2.928 N/A TRP 91.A N ASN 87.A O no hydrogen 2.434 N/A LEU 92.A N TYR 88.A O no hydrogen 2.626 N/A SER 93.A N GLU 89.A O no hydrogen 3.080 N/A SER 93.A OG ALA 90.A O no hydrogen 2.779 N/A SER 101.A N ASN 87.A OD1 no hydrogen 2.749 N/A SER 101.A OG PRO 100.A O no hydrogen 2.918 N/A SER 101.A OG GLY 124.A O no hydrogen 3.324 N/A VAL 105.A N ASN 115.A OD1 no hydrogen 2.895 N/A ILE 108.A N TRP 106.A O no hydrogen 2.997 N/A ILE 113.A N GLY 110.A O no hydrogen 3.040 N/A LEU 114.A N GLN 111.A O no hydrogen 3.310 N/A ASN 115.A N GLU 112.A O no hydrogen 3.315 N/A ASN 115.A ND2 VAL 105.A O no hydrogen 2.880 N/A GLY 116.A N LEU 114.A O no hydrogen 2.842 N/A GLY 124.A N GLY 116.A O no hydrogen 3.305 N/A ILE 127.A N PRO 100.A O no hydrogen 3.395 N/A THR 128.A OG1 HIS 732.A NE2 no hydrogen 2.528 N/A GLN 133.A N GLN 133.A OE1 no hydrogen 2.643 N/A GLN 133.A NE2 TYR 366.A O no hydrogen 3.425 N/A MET 134.A N GLY 130.A O no hydrogen 2.898 N/A TRP 135.A N LEU 131.A O no hydrogen 2.839 N/A ARG 136.A N PHE 132.A O no hydrogen 3.204 N/A ARG 136.A NH2 ASP 216.A OD1 no hydrogen 3.270 N/A SER 138.A N MET 134.A O no hydrogen 3.323 N/A GLY 139.A N TRP 135.A O no hydrogen 3.058 N/A GLY 139.A N ARG 136.A O no hydrogen 3.258 N/A ILE 140.A N TRP 135.A O no hydrogen 3.066 N/A THR 141.A N GLN 145.A OE1 no hydrogen 2.766 N/A THR 141.A OG1 GLN 145.A OE1 no hydrogen 2.897 N/A THR 142.A N GLN 145.A OE1 no hydrogen 3.196 N/A TYR 147.A N GLU 143.A O no hydrogen 3.213 N/A TYR 147.A N LEU 144.A O no hydrogen 2.911 N/A THR 149.A OG1 GLN 145.A O no hydrogen 3.318 N/A THR 149.A OG1 LEU 146.A O no hydrogen 2.109 N/A ALA 150.A N LEU 146.A O no hydrogen 3.374 N/A GLY 152.A N VAL 148.A O no hydrogen 2.634 N/A ALA 153.A N THR 149.A O no hydrogen 2.432 N/A LEU 154.A N ALA 150.A O no hydrogen 2.737 N/A VAL 155.A N ILE 151.A O no hydrogen 2.745 N/A MET 156.A N GLY 152.A O no hydrogen 3.325 N/A ALA 157.A N ALA 153.A O no hydrogen 3.278 N/A ALA 158.A N LEU 154.A O no hydrogen 2.969 N/A LEU 159.A N VAL 155.A O no hydrogen 2.822 N/A MET 160.A N MET 156.A O no hydrogen 2.920 N/A LEU 161.A N ALA 157.A O no hydrogen 3.072 N/A PHE 162.A N ALA 158.A O no hydrogen 2.906 N/A ALA 163.A N LEU 159.A O no hydrogen 2.864 N/A GLY 164.A N MET 160.A O no hydrogen 2.715 N/A TRP 165.A N LEU 161.A O no hydrogen 3.135 N/A PHE 166.A N PHE 162.A O no hydrogen 2.537 N/A HIS 167.A N ALA 163.A O no hydrogen 2.917 N/A TYR 168.A N TRP 165.A O no hydrogen 3.116 N/A TYR 168.A OH GLU 55.A OE1 no hydrogen 2.435 N/A HIS 169.A N TRP 165.A O no hydrogen 2.487 N/A LYS 170.A N PHE 166.A O no hydrogen 3.286 N/A ALA 171.A N PHE 166.A O no hydrogen 2.679 N/A LYS 174.A N VAL 3.A O no hydrogen 2.854 N/A LYS 174.A NZ ASP 5.A OD1 no hydrogen 3.014 N/A LYS 174.A NZ ASP 5.A OD2 no hydrogen 2.709 N/A LEU 175.A N GLU 54.A OE2 no hydrogen 3.224 N/A TRP 177.A N LYS 174.A O no hydrogen 3.175 N/A PHE 178.A N LEU 175.A O no hydrogen 2.996 N/A GLN 179.A N LEU 175.A O no hydrogen 3.170 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 3.058 N/A SER 183.A OG ASN 180.A O no hydrogen 3.023 N/A MET 184.A N ASN 180.A O no hydrogen 3.194 N/A MET 185.A N ALA 181.A O no hydrogen 2.709 N/A ASN 186.A N GLU 182.A O no hydrogen 3.021 N/A ASN 186.A ND2 TYR 299.A O no hydrogen 2.753 N/A ASN 186.A ND2 THR 301.A OG1 no hydrogen 3.417 N/A HIS 187.A N SER 183.A O no hydrogen 3.368 N/A HIS 187.A ND1 SER 183.A O no hydrogen 2.745 N/A HIS 188.A N MET 184.A O no hydrogen 2.979 N/A LEU 189.A N MET 185.A O no hydrogen 3.145 N/A GLY 190.A N ASN 186.A O no hydrogen 2.982 N/A GLY 191.A N HIS 187.A O no hydrogen 2.530 N/A LEU 192.A N HIS 187.A O no hydrogen 3.321 N/A PHE 193.A N HIS 188.A O no hydrogen 2.987 N/A GLY 194.A N LEU 189.A O no hydrogen 2.957 N/A LEU 195.A N GLY 190.A O no hydrogen 3.007 N/A GLY 196.A N GLY 191.A O no hydrogen 3.255 N/A GLY 196.A N LEU 192.A O no hydrogen 3.242 N/A SER 197.A N PHE 193.A O no hydrogen 3.312 N/A SER 197.A N GLY 194.A O no hydrogen 3.272 N/A SER 197.A OG PHE 193.A O no hydrogen 2.814 N/A SER 197.A OG GLY 194.A O no hydrogen 2.912 N/A LEU 198.A N GLY 194.A O no hydrogen 2.799 N/A SER 199.A N LEU 195.A O no hydrogen 2.593 N/A SER 199.A OG LEU 195.A O no hydrogen 3.132 N/A SER 199.A OG GLY 196.A O no hydrogen 3.395 N/A ALA 201.A N SER 197.A O no hydrogen 2.723 N/A GLY 202.A N LEU 198.A O no hydrogen 2.850 N/A HIS 203.A N SER 199.A O no hydrogen 2.874 N/A GLN 204.A N TRP 200.A O no hydrogen 2.879 N/A GLN 204.A NE2 SER 281.A OG no hydrogen 2.367 N/A ILE 205.A N GLY 202.A O no hydrogen 3.262 N/A HIS 206.A N GLY 202.A O no hydrogen 2.905 N/A VAL 207.A N HIS 203.A O no hydrogen 3.123 N/A SER 208.A N HIS 203.A O no hydrogen 3.036 N/A SER 208.A OG SER 138.A O no hydrogen 3.238 N/A SER 208.A OG HIS 203.A O no hydrogen 2.947 N/A LEU 209.A N GLN 204.A O no hydrogen 2.522 N/A LYS 213.A N LEU 209.A O no hydrogen 3.119 N/A LYS 213.A N PRO 210.A O no hydrogen 3.239 N/A LEU 214.A N VAL 211.A O no hydrogen 2.942 N/A LEU 215.A N VAL 211.A O no hydrogen 2.665 N/A SER 217.A N LEU 214.A O no hydrogen 2.933 N/A SER 217.A OG LYS 213.A O no hydrogen 3.427 N/A GLY 218.A N LEU 215.A O no hydrogen 3.237 N/A GLN 222.A N SER 220.A OG no hydrogen 2.772 N/A GLU 223.A N SER 220.A OG no hydrogen 2.541 N/A GLU 229.A N LEU 226.A O no hydrogen 3.244 N/A PHE 230.A N PRO 227.A O no hydrogen 3.234 N/A ASN 233.A N GLU 229.A O no hydrogen 2.794 N/A ASP 235.A N ASN 233.A OD1 no hydrogen 3.269 N/A LEU 236.A N ASN 233.A O no hydrogen 3.216 N/A LEU 236.A N ASN 233.A OD1 no hydrogen 2.705 N/A ILE 237.A N ASN 233.A O no hydrogen 3.377 N/A SER 243.A N TYR 241.A O no hydrogen 2.535 N/A SER 243.A OG TYR 241.A O no hydrogen 3.212 N/A PHE 252.A N THR 249.A O no hydrogen 2.985 N/A THR 253.A N THR 249.A O no hydrogen 2.929 N/A THR 253.A OG1 THR 253.A O no hydrogen 2.494 N/A GLU 258.A N ASN 255.A O no hydrogen 3.308 N/A TYR 259.A N TRP 256.A O no hydrogen 3.136 N/A TYR 259.A OH GLY 247.A O no hydrogen 2.673 N/A SER 260.A OG SER 260.A O no hydrogen 2.414 N/A LEU 263.A N TYR 259.A O no hydrogen 3.163 N/A THR 264.A N SER 279.A O no hydrogen 3.483 N/A THR 264.A OG1 SER 279.A OG no hydrogen 2.309 N/A THR 264.A OG1 ASP 280.A OD1 no hydrogen 3.386 N/A GLY 267.A N ASP 280.A OD2 no hydrogen 2.488 N/A ASN 270.A N GLY 275.A O no hydrogen 2.469 N/A THR 273.A N ASN 270.A O no hydrogen 2.865 N/A THR 273.A OG1 ASN 270.A O no hydrogen 3.338 N/A GLY 274.A N ASN 270.A O no hydrogen 2.440 N/A GLY 275.A N THR 273.A OG1 no hydrogen 3.336 N/A SER 279.A OG THR 264.A OG1 no hydrogen 2.309 N/A ASP 280.A N TRP 277.A O no hydrogen 3.017 N/A SER 281.A N TRP 277.A O no hydrogen 3.060 N/A SER 281.A OG LEU 278.A O no hydrogen 3.080 N/A ALA 282.A N LEU 278.A O no hydrogen 2.797 N/A HIS 283.A N SER 279.A O no hydrogen 3.483 N/A HIS 283.A ND1 THR 264.A O no hydrogen 2.917 N/A HIS 284.A N ASP 280.A O no hydrogen 2.712 N/A HIS 285.A N SER 281.A O no hydrogen 3.055 N/A HIS 285.A ND1 SER 281.A O no hydrogen 2.570 N/A LEU 286.A N ALA 282.A O no hydrogen 2.926 N/A ALA 287.A N HIS 283.A O no hydrogen 3.168 N/A ILE 288.A N HIS 284.A O no hydrogen 2.851 N/A ALA 289.A N HIS 285.A O no hydrogen 3.238 N/A VAL 290.A N LEU 286.A O no hydrogen 3.122 N/A LEU 291.A N ALA 287.A O no hydrogen 3.128 N/A PHE 292.A N ILE 288.A O no hydrogen 2.952 N/A ILE 293.A N ALA 289.A O no hydrogen 2.752 N/A VAL 294.A N VAL 290.A O no hydrogen 3.254 N/A ALA 295.A N LEU 291.A O no hydrogen 2.975 N/A GLY 296.A N ILE 293.A O no hydrogen 2.885 N/A HIS 297.A N VAL 294.A O no hydrogen 3.229 N/A HIS 297.A ND1 ILE 293.A O no hydrogen 2.626 N/A TYR 299.A N ASN 186.A OD1 no hydrogen 3.126 N/A ARG 300.A N HIS 307.A O no hydrogen 3.064 N/A ARG 300.A NH2 GLU 311.A OE1 no hydrogen 2.822 N/A ILE 305.A N TRP 303.A O no hydrogen 2.637 N/A HIS 307.A N MET 298.A O no hydrogen 2.534 N/A MET 312.A N MET 309.A O no hydrogen 2.988 N/A SER 315.A OG ASP 314.A O no hydrogen 2.521 N/A HIS 316.A N TYR 313.A O no hydrogen 2.712 N/A HIS 316.A ND1 MET 312.A O no hydrogen 2.468 N/A GLY 318.A N THR 321.A OG1 no hydrogen 2.857 N/A THR 321.A N GLY 318.A O no hydrogen 3.183 N/A GLY 322.A N GLY 318.A O no hydrogen 2.925 N/A GLU 323.A N ASN 411.A O no hydrogen 3.138 N/A GLY 324.A N THR 321.A O no hydrogen 3.438 N/A HIS 325.A N HIS 316.A O no hydrogen 3.439 N/A HIS 325.A ND1 HIS 316.A O no hydrogen 3.256 N/A VAL 328.A N HIS 325.A O no hydrogen 3.184 N/A ILE 331.A N GLY 327.A O no hydrogen 2.963 N/A ILE 331.A N VAL 328.A O no hydrogen 3.180 N/A PHE 332.A N VAL 328.A O no hydrogen 3.450 N/A THR 333.A OG1 TYR 329.A O no hydrogen 2.897 N/A ASN 334.A N ILE 331.A O no hydrogen 3.364 N/A SER 335.A N ILE 331.A O no hydrogen 2.980 N/A SER 335.A OG ASP 403.A OD2 no hydrogen 3.317 N/A HIS 337.A ND1 ASP 403.A OD2 no hydrogen 3.314 N/A ALA 338.A N SER 335.A OG no hydrogen 3.104 N/A GLN 339.A NE2 PHE 332.A O no hydrogen 2.611 N/A LEU 340.A N HIS 337.A O no hydrogen 2.969 N/A SER 341.A N HIS 337.A O no hydrogen 3.066 N/A SER 341.A OG ALA 392.A O no hydrogen 2.327 N/A LEU 342.A N ALA 338.A O no hydrogen 3.283 N/A ASN 343.A N GLN 339.A O no hydrogen 3.242 N/A ASN 343.A ND2 GLN 339.A OE1 no hydrogen 3.458 N/A LEU 344.A N LEU 340.A O no hydrogen 2.712 N/A ALA 345.A N SER 341.A O no hydrogen 2.950 N/A PHE 347.A N LEU 344.A O no hydrogen 2.961 N/A GLY 348.A N LEU 344.A O no hydrogen 2.797 N/A SER 349.A N ALA 345.A O no hydrogen 3.028 N/A SER 349.A OG ALA 345.A O no hydrogen 3.055 N/A SER 351.A N PHE 347.A O no hydrogen 3.045 N/A SER 351.A OG HIS 381.A O no hydrogen 2.496 N/A ILE 352.A N GLY 348.A O no hydrogen 3.163 N/A ILE 353.A N SER 349.A O no hydrogen 3.250 N/A VAL 354.A N LEU 350.A O no hydrogen 2.942 N/A HIS 356.A N ILE 352.A O no hydrogen 3.225 N/A HIS 356.A ND1 ILE 352.A O no hydrogen 3.086 N/A HIS 357.A N ILE 353.A O no hydrogen 3.002 N/A HIS 357.A N VAL 354.A O no hydrogen 3.096 N/A SER 360.A OG HIS 356.A O no hydrogen 3.356 N/A TYR 366.A N THR 273.A O no hydrogen 2.960 N/A TYR 366.A OH VAL 272.A O no hydrogen 2.853 N/A TYR 371.A OH VAL 508.A O no hydrogen 2.670 N/A THR 373.A N ASP 370.A O no hydrogen 3.079 N/A SER 374.A N ASP 370.A O no hydrogen 2.995 N/A SER 374.A OG LEU 367.A O no hydrogen 3.287 N/A SER 374.A OG ASP 370.A O no hydrogen 2.792 N/A CYS 376.A SG ALA 372.A O no hydrogen 3.628 N/A LEU 377.A N THR 373.A O no hydrogen 2.675 N/A THR 379.A N LEU 375.A O no hydrogen 3.306 N/A THR 379.A OG1 LEU 375.A O no hydrogen 3.192 N/A THR 379.A OG1 CYS 376.A O no hydrogen 3.098 N/A HIS 380.A N CYS 376.A O no hydrogen 3.078 N/A HIS 381.A ND1 LEU 377.A O no hydrogen 3.042 N/A VAL 382.A N PHE 378.A O no hydrogen 3.132 N/A TRP 383.A N THR 379.A O no hydrogen 3.452 N/A ILE 384.A N HIS 380.A O no hydrogen 2.806 N/A GLY 385.A N HIS 381.A O no hydrogen 2.630 N/A GLY 386.A N VAL 382.A O no hydrogen 2.903 N/A PHE 387.A N TRP 383.A O no hydrogen 2.967 N/A LEU 388.A N ILE 384.A O no hydrogen 3.244 N/A ILE 389.A N GLY 385.A O no hydrogen 3.324 N/A GLY 391.A N PHE 387.A O no hydrogen 3.217 N/A ALA 392.A N LEU 388.A O no hydrogen 2.864 N/A GLY 393.A N ILE 389.A O no hydrogen 3.014 N/A ALA 394.A N VAL 390.A O no hydrogen 2.893 N/A ALA 394.A N GLY 391.A O no hydrogen 3.134 N/A HIS 395.A N GLY 391.A O no hydrogen 3.017 N/A ALA 396.A N ALA 392.A O no hydrogen 3.311 N/A ALA 397.A N ALA 394.A O no hydrogen 2.916 N/A ILE 398.A N ALA 394.A O no hydrogen 3.248 N/A PHE 399.A N HIS 395.A O no hydrogen 3.324 N/A MET 400.A N ALA 396.A O no hydrogen 3.156 N/A VAL 401.A N ALA 397.A O no hydrogen 2.930 N/A ALA 407.A N ASP 405.A OD1 no hydrogen 3.046 N/A ASN 409.A ND2 ASP 405.A O no hydrogen 2.999 N/A ASN 411.A N ASP 415.A OD1 no hydrogen 3.102 N/A ASN 412.A ND2 LYS 326.A O no hydrogen 2.961 N/A ASN 412.A ND2 ASN 409.A OD1 no hydrogen 2.403 N/A LEU 413.A N GLY 324.A O no hydrogen 3.186 N/A ARG 416.A N ASN 412.A O no hydrogen 3.215 N/A ARG 416.A NH1 ASN 411.A OD1 no hydrogen 2.439 N/A ARG 416.A NH2 PHE 320.A O no hydrogen 2.444 N/A ARG 419.A N ARG 416.A O no hydrogen 3.062 N/A ARG 419.A NE ASP 415.A OD1 no hydrogen 3.157 N/A ARG 419.A NH2 ASP 415.A OD1 no hydrogen 3.288 N/A HIS 420.A N VAL 417.A O no hydrogen 3.453 N/A HIS 420.A ND1 ARG 416.A O no hydrogen 2.590 N/A ARG 421.A NH1 ASN 546.A OD1 no hydrogen 3.449 N/A ARG 421.A NH2 LEU 542.A O no hydrogen 2.777 N/A ARG 421.A NH2 ASN 546.A OD1 no hydrogen 2.934 N/A ILE 424.A N HIS 420.A O no hydrogen 3.032 N/A ILE 425.A N ARG 421.A O no hydrogen 3.128 N/A SER 426.A N ASP 422.A O no hydrogen 2.675 N/A SER 426.A OG ASP 422.A O no hydrogen 2.318 N/A HIS 427.A ND1 ALA 423.A O no hydrogen 2.893 N/A LEU 428.A N ILE 424.A O no hydrogen 3.076 N/A ASN 429.A N ILE 425.A O no hydrogen 2.431 N/A TRP 430.A N SER 426.A O no hydrogen 3.237 N/A VAL 431.A N HIS 427.A O no hydrogen 3.347 N/A CYS 432.A SG LEU 428.A O no hydrogen 3.285 N/A CYS 432.A SG HIS 531.A O no hydrogen 3.229 N/A ILE 433.A N ASN 429.A O no hydrogen 3.447 N/A PHE 434.A N TRP 430.A O no hydrogen 2.673 N/A LEU 435.A N VAL 431.A O no hydrogen 2.927 N/A PHE 437.A N ILE 433.A O no hydrogen 3.468 N/A HIS 438.A N PHE 434.A O no hydrogen 2.945 N/A HIS 438.A ND1 PHE 434.A O no hydrogen 3.186 N/A SER 439.A OG LEU 435.A O no hydrogen 2.622 N/A SER 439.A OG HIS 524.A O no hydrogen 3.360 N/A PHE 440.A N GLY 436.A O no hydrogen 2.994 N/A GLY 441.A N GLY 436.A O no hydrogen 3.105 N/A TYR 443.A N PHE 440.A O no hydrogen 2.906 N/A TYR 443.A OH ALA 627.A O no hydrogen 3.303 N/A ILE 444.A N PHE 440.A O no hydrogen 3.335 N/A HIS 445.A N GLY 441.A O no hydrogen 2.827 N/A HIS 445.A NE2 ASP 457.A O no hydrogen 2.834 N/A ASN 446.A N LEU 442.A O no hydrogen 2.875 N/A ASN 446.A ND2 PHE 459.A O no hydrogen 3.335 N/A ASN 446.A ND2 ILE 628.A O no hydrogen 2.770 N/A ASP 447.A N ILE 444.A O no hydrogen 3.107 N/A THR 448.A N ILE 444.A O no hydrogen 2.913 N/A THR 448.A OG1 ILE 444.A O no hydrogen 2.962 N/A MET 449.A N HIS 445.A O no hydrogen 3.034 N/A ALA 451.A N ASP 447.A O no hydrogen 2.772 N/A GLY 453.A N ARG 450.A O no hydrogen 3.085 N/A ARG 454.A N MET 449.A O no hydrogen 2.863 N/A ARG 454.A NE ASP 457.A OD2 no hydrogen 3.186 N/A ASP 457.A N ARG 454.A O no hydrogen 3.225 N/A PHE 459.A N ASN 446.A OD1 no hydrogen 2.893 N/A SER 460.A N ILE 464.A O no hydrogen 3.077 N/A GLN 467.A NE2 GLN 465.A OE1 no hydrogen 3.011 N/A GLN 472.A N PRO 468.A O no hydrogen 3.075 N/A GLN 472.A NE2 GLN 467.A OE1 no hydrogen 3.159 N/A TRP 473.A N PHE 470.A O no hydrogen 2.857 N/A VAL 474.A N PHE 470.A O no hydrogen 2.903 N/A GLN 475.A N ALA 471.A O no hydrogen 3.269 N/A GLN 475.A NE2 ILE 513.A O no hydrogen 3.234 N/A VAL 477.A N VAL 474.A O no hydrogen 3.354 N/A ASN 478.A N VAL 474.A O no hydrogen 2.938 N/A ASN 478.A ND2 VAL 474.A O no hydrogen 3.143 N/A SER 479.A OG GLN 475.A O no hydrogen 2.314 N/A GLY 483.A N ALA 486.A O no hydrogen 2.767 N/A ASN 484.A N ALA 481.A O no hydrogen 3.334 N/A THR 485.A N ALA 481.A O no hydrogen 2.864 N/A THR 485.A OG1 ALA 481.A O no hydrogen 2.535 N/A ALA 486.A N ALA 481.A O no hydrogen 2.606 N/A ALA 489.A N ALA 486.A O no hydrogen 3.416 N/A LEU 490.A N LYS 266.A O no hydrogen 2.769 N/A ALA 491.A N LYS 266.A O no hydrogen 3.308 N/A SER 494.A OG SER 360.A O no hydrogen 2.361 N/A ALA 496.A N SER 494.A OG no hydrogen 3.264 N/A GLY 498.A N TYR 495.A O no hydrogen 3.145 N/A VAL 502.A N MET 510.A O no hydrogen 3.312 N/A SER 503.A OG GLY 505.A O no hydrogen 3.143 N/A SER 503.A OG LYS 507.A O no hydrogen 2.543 N/A VAL 504.A N LYS 507.A O no hydrogen 3.109 N/A LYS 507.A NZ THR 369.A O no hydrogen 3.009 N/A LYS 507.A NZ GLY 739.A O no hydrogen 3.077 N/A ALA 509.A N VAL 502.A O no hydrogen 2.832 N/A MET 510.A N VAL 502.A O no hydrogen 3.438 N/A GLY 516.A N ASP 519.A OD2 no hydrogen 3.153 N/A THR 517.A OG1 ASP 461.A OD2 no hydrogen 3.301 N/A LEU 521.A N ALA 518.A O no hydrogen 3.186 N/A VAL 522.A N ALA 518.A O no hydrogen 3.190 N/A HIS 523.A N ASP 519.A O no hydrogen 3.265 N/A HIS 523.A ND1 ASP 519.A O no hydrogen 2.979 N/A HIS 524.A N PHE 520.A O no hydrogen 3.271 N/A ILE 525.A N LEU 521.A O no hydrogen 2.838 N/A HIS 526.A N VAL 522.A O no hydrogen 3.100 N/A HIS 526.A NE2 HIS 596.A ND1 no hydrogen 3.172 N/A ALA 527.A N HIS 523.A O no hydrogen 2.903 N/A PHE 528.A N HIS 524.A O no hydrogen 3.064 N/A THR 529.A N ILE 525.A O no hydrogen 2.829 N/A ILE 530.A N HIS 526.A O no hydrogen 3.073 N/A HIS 531.A ND1 ALA 527.A O no hydrogen 2.609 N/A VAL 532.A N PHE 528.A O no hydrogen 3.100 N/A THR 533.A N THR 529.A O no hydrogen 3.045 N/A THR 533.A OG1 THR 529.A O no hydrogen 2.368 N/A VAL 534.A N ILE 530.A O no hydrogen 2.766 N/A LEU 535.A N HIS 531.A O no hydrogen 3.256 N/A ILE 536.A N VAL 532.A O no hydrogen 2.982 N/A LEU 538.A N VAL 534.A O no hydrogen 2.670 N/A LYS 539.A N LEU 535.A O no hydrogen 2.861 N/A LYS 539.A NZ HIS 578.A NE2 no hydrogen 3.104 N/A GLY 540.A N ILE 536.A O no hydrogen 3.156 N/A VAL 541.A N LEU 537.A O no hydrogen 3.144 N/A VAL 541.A N LEU 538.A O no hydrogen 3.275 N/A LEU 542.A N LEU 538.A O no hydrogen 2.884 N/A PHE 543.A N LYS 539.A O no hydrogen 3.259 N/A ALA 544.A N VAL 541.A O no hydrogen 3.263 N/A ARG 545.A NH1 MET 400.A O no hydrogen 3.521 N/A SER 547.A N ILE 550.A O no hydrogen 2.955 N/A ARG 548.A NH1 ASP 422.A OD2 no hydrogen 2.462 N/A LEU 549.A N SER 547.A OG no hydrogen 3.312 N/A LYS 553.A NZ PHE 543.A O no hydrogen 2.843 N/A ALA 554.A N ARG 545.A O no hydrogen 3.314 N/A LEU 556.A N ASP 552.A O no hydrogen 3.084 N/A ASP 563.A N THR 570.A O no hydrogen 3.098 N/A GLY 569.A N GLY 566.A O no hydrogen 2.722 N/A THR 570.A N GLY 564.A O no hydrogen 2.760 N/A THR 570.A OG1 GLY 564.A O no hydrogen 3.133 N/A THR 570.A OG1 GLY 566.A O no hydrogen 3.412 N/A SER 574.A N ASP 577.A OD2 no hydrogen 3.154 N/A SER 574.A OG ASP 577.A OD2 no hydrogen 2.766 N/A TRP 576.A N SER 574.A OG no hydrogen 2.836 N/A ASP 577.A N SER 574.A OG no hydrogen 3.048 N/A HIS 578.A ND1 SER 574.A O no hydrogen 2.493 N/A PHE 580.A N TRP 576.A O no hydrogen 2.915 N/A LEU 581.A N ASP 577.A O no hydrogen 2.615 N/A GLY 582.A N HIS 578.A O no hydrogen 2.780 N/A MET 586.A N GLY 582.A O no hydrogen 3.171 N/A TYR 587.A N LEU 583.A O no hydrogen 2.929 N/A ASN 588.A N PHE 584.A O no hydrogen 2.635 N/A SER 589.A N TRP 585.A O no hydrogen 2.552 N/A LEU 590.A N MET 586.A O no hydrogen 3.057 N/A SER 591.A N TYR 587.A O no hydrogen 3.318 N/A SER 591.A OG TYR 587.A O no hydrogen 2.429 N/A SER 591.A OG ASN 588.A O no hydrogen 3.066 N/A VAL 593.A N SER 589.A O no hydrogen 3.327 N/A LEU 594.A N LEU 590.A O no hydrogen 2.632 N/A PHE 595.A N SER 591.A O no hydrogen 2.965 N/A HIS 596.A N VAL 592.A O no hydrogen 2.752 N/A HIS 596.A ND1 HIS 526.A NE2 no hydrogen 3.172 N/A HIS 596.A NE2 ASP 519.A OD1 no hydrogen 3.320 N/A PHE 597.A N VAL 593.A O no hydrogen 3.137 N/A SER 598.A N LEU 594.A O no hydrogen 2.859 N/A SER 598.A OG LEU 594.A O no hydrogen 2.762 N/A SER 598.A OG PHE 595.A O no hydrogen 3.445 N/A TRP 599.A N PHE 595.A O no hydrogen 3.237 N/A TRP 599.A NE1 ASN 622.A OD1 no hydrogen 2.905 N/A LYS 600.A N HIS 596.A O no hydrogen 3.442 N/A LYS 600.A NZ SER 514.A O no hydrogen 3.117 N/A LYS 600.A NZ ASP 519.A OD1 no hydrogen 3.343 N/A LYS 600.A NZ ASP 519.A OD2 no hydrogen 2.429 N/A LYS 600.A NZ ASP 604.A OD2 no hydrogen 3.079 N/A MET 601.A N PHE 597.A O no hydrogen 2.731 N/A GLN 602.A NE2 SER 598.A O no hydrogen 2.965 N/A GLN 602.A NE2 GLN 641.A OE1 no hydrogen 3.002 N/A SER 603.A N TRP 599.A O no hydrogen 2.511 N/A SER 603.A OG TRP 599.A O no hydrogen 2.731 N/A SER 603.A OG ASP 604.A OD1 no hydrogen 3.263 N/A ASP 604.A N LYS 600.A O no hydrogen 2.842 N/A TRP 606.A N MET 601.A O no hydrogen 2.826 N/A ASN 608.A N SER 616.A O no hydrogen 2.752 N/A VAL 609.A N GLY 506.A O no hydrogen 2.542 N/A ALA 611.A N THR 610.A OG1 no hydrogen 2.700 N/A ALA 614.A N ASP 612.A OD2 no hydrogen 3.115 N/A SER 616.A N ASN 608.A O no hydrogen 2.967 N/A SER 616.A OG ASN 608.A O no hydrogen 2.844 N/A ILE 618.A N GLN 602.A O no hydrogen 3.442 N/A ILE 618.A N TRP 606.A O no hydrogen 3.201 N/A THR 619.A OG1 ASN 622.A OD1 no hydrogen 2.613 N/A ASN 621.A N SER 603.A O no hydrogen 3.296 N/A GLY 626.A N ASN 622.A O no hydrogen 3.241 N/A ALA 627.A N PHE 623.A O no hydrogen 3.310 N/A THR 629.A N GLY 626.A O no hydrogen 3.381 N/A THR 629.A OG1 GLY 626.A O no hydrogen 3.112 N/A ILE 630.A N ASP 447.A OD2 no hydrogen 3.328 N/A GLY 632.A N THR 629.A OG1 no hydrogen 2.889 N/A TRP 633.A N THR 629.A O no hydrogen 3.276 N/A LEU 634.A N ILE 630.A O no hydrogen 3.104 N/A LEU 634.A N ASN 631.A O no hydrogen 2.830 N/A ARG 635.A N ASN 631.A O no hydrogen 2.448 N/A ARG 635.A NE ASP 636.A OD1 no hydrogen 2.739 N/A ARG 635.A NE ASP 636.A OD2 no hydrogen 3.385 N/A ARG 635.A NH2 ASP 636.A OD2 no hydrogen 3.101 N/A ASP 636.A N GLY 632.A O no hydrogen 3.216 N/A TRP 639.A N LEU 634.A O no hydrogen 2.620 N/A GLN 641.A N PHE 637.A O no hydrogen 3.144 N/A ALA 642.A N LEU 638.A O no hydrogen 3.322 N/A GLN 644.A N GLN 644.A OE1 no hydrogen 2.785 N/A ILE 646.A N SER 643.A O no hydrogen 3.214 N/A GLN 647.A N SER 643.A O no hydrogen 3.164 N/A SER 648.A OG SER 648.A O no hydrogen 2.324 N/A SER 648.A OG LEU 653.A O no hydrogen 2.525 N/A LEU 653.A N SER 651.A OG no hydrogen 3.044 N/A SER 654.A OG SER 648.A O no hydrogen 3.116 N/A LEU 658.A N SER 654.A O no hydrogen 2.988 N/A MET 659.A N ALA 655.A O no hydrogen 2.701 N/A PHE 660.A N TYR 656.A O no hydrogen 2.956 N/A LEU 661.A N GLY 657.A O no hydrogen 3.273 N/A GLY 662.A N LEU 658.A O no hydrogen 2.445 N/A ALA 663.A N MET 659.A O no hydrogen 2.857 N/A HIS 664.A ND1 PHE 660.A O no hydrogen 2.765 N/A TRP 667.A N ALA 663.A O no hydrogen 3.306 N/A PHE 669.A N PHE 665.A O no hydrogen 2.944 N/A SER 670.A N ILE 666.A O no hydrogen 3.060 N/A SER 670.A N TRP 667.A O no hydrogen 3.227 N/A SER 670.A OG GLY 715.A O no hydrogen 2.486 N/A LEU 671.A N ALA 668.A O no hydrogen 3.147 N/A PHE 673.A N SER 670.A O no hydrogen 2.728 N/A LEU 674.A N SER 670.A O no hydrogen 2.784 N/A PHE 675.A N LEU 671.A O no hydrogen 3.099 N/A SER 676.A OG MET 672.A O no hydrogen 2.264 N/A SER 676.A OG PHE 673.A O no hydrogen 3.348 N/A ARG 678.A NE LEU 706.A O no hydrogen 3.080 N/A TRP 681.A N ARG 678.A O no hydrogen 2.526 N/A GLN 682.A N ARG 678.A O no hydrogen 3.247 N/A ILE 685.A N TRP 681.A O no hydrogen 2.912 N/A SER 687.A N LEU 684.A O no hydrogen 3.180 N/A ILE 688.A N LEU 684.A O no hydrogen 3.215 N/A VAL 689.A N ILE 685.A O no hydrogen 2.447 N/A HIS 692.A N VAL 689.A O no hydrogen 3.295 N/A HIS 692.A ND1 ILE 688.A O no hydrogen 2.726 N/A ASN 693.A N VAL 689.A O no hydrogen 2.897 N/A ASN 693.A N TRP 690.A O no hydrogen 3.231 N/A LYS 694.A N TRP 690.A O no hydrogen 2.673 N/A PHE 697.A N HIS 692.A O no hydrogen 2.536 N/A ARG 704.A N THR 33.A OG1 no hydrogen 2.861 N/A ALA 705.A N GLN 682.A OE1 no hydrogen 2.464 N/A SER 707.A N GLN 710.A OE1 no hydrogen 3.320 N/A GLN 710.A N SER 707.A OG no hydrogen 3.399 N/A GLY 711.A N SER 707.A O no hydrogen 2.754 N/A ARG 712.A N ILE 708.A O no hydrogen 3.057 N/A ARG 712.A NH1 PRO 561.A O no hydrogen 3.097 N/A ARG 712.A NH1 ASP 577.A OD1 no hydrogen 2.780 N/A ALA 713.A N THR 709.A O no hydrogen 2.747 N/A VAL 714.A N GLN 710.A O no hydrogen 2.649 N/A GLY 715.A N GLY 711.A O no hydrogen 3.213 N/A VAL 716.A N ARG 712.A O no hydrogen 2.933 N/A ALA 717.A N ALA 713.A O no hydrogen 2.983 N/A HIS 718.A N VAL 714.A O no hydrogen 2.934 N/A HIS 718.A ND1 VAL 714.A O no hydrogen 3.130 N/A TYR 719.A N GLY 715.A O no hydrogen 3.120 N/A LEU 720.A N VAL 716.A O no hydrogen 2.897 N/A GLY 722.A N HIS 718.A O no hydrogen 3.175 N/A GLY 722.A N TYR 719.A O no hydrogen 3.136 N/A GLY 723.A N TYR 719.A O no hydrogen 3.203 N/A THR 726.A N GLY 722.A O no hydrogen 2.556 N/A THR 726.A OG1 GLY 722.A O no hydrogen 2.439 N/A THR 727.A OG1 GLY 723.A O no hydrogen 2.737 N/A TRP 728.A N ILE 724.A O no hydrogen 2.720 N/A SER 729.A N ALA 725.A O no hydrogen 3.438 N/A SER 729.A OG TYR 656.A O no hydrogen 3.226 N/A SER 729.A OG THR 726.A O no hydrogen 3.361 N/A PHE 730.A N THR 726.A O no hydrogen 3.202 N/A PHE 731.A N THR 727.A O no hydrogen 2.619 N/A HIS 732.A N TRP 728.A O no hydrogen 3.300 N/A HIS 732.A ND1 TRP 728.A O no hydrogen 2.413 N/A HIS 732.A NE2 THR 128.A OG1 no hydrogen 2.528 N/A ALA 733.A N SER 729.A O no hydrogen 2.898 N/A ARG 734.A NE GLN 602.A OE1 no hydrogen 2.855 N/A ARG 734.A NH2 GLN 602.A OE1 no hydrogen 3.083 N/A ILE 735.A N PHE 731.A O no hydrogen 3.418 N/A ILE 736.A N HIS 732.A O no hydrogen 3.306 N/A SER 737.A OG ARG 734.A O no hydrogen 3.153 N/A VAL 738.A N ARG 734.A O no hydrogen 3.365 N/A