Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xya_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG ARG 3.A O no hydrogen 3.037 N/A ARG 3.A NH2 ASP 11.A OD1 no hydrogen 2.855 N/A VAL 8.A N SER 4.A O no hydrogen 3.141 N/A ARG 9.A N ASN 5.A O no hydrogen 2.927 N/A LEU 10.A N SER 6.A O no hydrogen 2.939 N/A ASP 11.A N GLY 7.A O no hydrogen 3.208 N/A ASP 11.A N VAL 8.A O no hydrogen 3.119 N/A TYR 13.A N ARG 9.A O no hydrogen 3.231 N/A TYR 13.A OH GLU 414.A OE1 no hydrogen 2.903 N/A ALA 14.A N LEU 10.A O no hydrogen 2.414 N/A ARG 15.A N ASP 11.A O no hydrogen 2.684 N/A LEU 16.A N GLY 12.A O no hydrogen 2.998 N/A VAL 17.A N TYR 13.A O no hydrogen 2.828 N/A GLN 18.A N ALA 14.A O no hydrogen 2.802 N/A GLN 19.A N ARG 15.A O no hydrogen 2.780 N/A GLN 19.A NE2 ASN 363.A OD1 no hydrogen 2.974 N/A THR 20.A OG1 LEU 16.A O no hydrogen 2.356 N/A ILE 21.A N VAL 17.A O no hydrogen 2.684 N/A LEU 22.A N VAL 17.A O no hydrogen 2.875 N/A CYS 23.A N GLN 18.A O no hydrogen 2.951 N/A CYS 23.A SG GLN 18.A O no hydrogen 3.151 N/A CYS 23.A SG GLN 19.A O no hydrogen 3.275 N/A CYS 23.A SG HIS 24.A ND1 no hydrogen 3.052 N/A HIS 24.A N ILE 21.A O no hydrogen 2.976 N/A GLN 25.A NE2 GLY 30.A O no hydrogen 2.999 N/A GLN 25.A NE2 SER 79.A O no hydrogen 2.912 N/A ASN 26.A N LEU 31.A O no hydrogen 2.716 N/A THR 29.A OG1 THR 117.A O no hydrogen 2.271 N/A GLY 30.A N ASN 26.A O no hydrogen 2.867 N/A LEU 31.A N THR 29.A OG1 no hydrogen 3.288 N/A LEU 32.A N ASN 46.A OD1 no hydrogen 2.799 N/A ALA 34.A N ASP 40.A O no hydrogen 2.894 N/A SER 35.A N GLN 38.A O no hydrogen 3.064 N/A GLN 38.A N SER 35.A OG no hydrogen 3.176 N/A LYS 39.A NZ TYR 36.A O no hydrogen 2.810 N/A ALA 41.A N TYR 115.A O no hydrogen 3.207 N/A TRP 42.A NE1 GLU 184.A OE2 no hydrogen 3.145 N/A VAL 43.A N ALA 113.A O no hydrogen 2.887 N/A ARG 44.A NE ASP 135.A OD1 no hydrogen 3.405 N/A ARG 44.A NH1 GLU 184.A OE1 no hydrogen 3.516 N/A ARG 44.A NH2 GLU 184.A OE1 no hydrogen 3.125 N/A ASN 46.A N TRP 42.A O no hydrogen 2.863 N/A ASN 46.A ND2 LEU 32.A O no hydrogen 2.793 N/A VAL 47.A N VAL 43.A O no hydrogen 3.277 N/A TYR 48.A N ARG 44.A O no hydrogen 3.053 N/A SER 49.A N ASP 45.A O no hydrogen 2.622 N/A SER 49.A OG ASP 45.A O no hydrogen 2.847 N/A SER 49.A OG ASN 46.A O no hydrogen 2.942 N/A ILE 50.A N ASN 46.A O no hydrogen 3.070 N/A ILE 50.A N VAL 47.A O no hydrogen 3.357 N/A LEU 51.A N TYR 48.A O no hydrogen 3.187 N/A ALA 52.A N SER 404.A OG no hydrogen 2.756 N/A TRP 54.A N ILE 50.A O no hydrogen 2.831 N/A TRP 54.A NE1 SER 150.A OG no hydrogen 3.232 N/A GLY 55.A N LEU 51.A O no hydrogen 2.627 N/A LEU 56.A N ALA 52.A O no hydrogen 2.794 N/A GLY 57.A N VAL 53.A O no hydrogen 2.790 N/A LEU 58.A N TRP 54.A O no hydrogen 2.943 N/A ALA 59.A N GLY 55.A O no hydrogen 2.798 N/A TYR 60.A N LEU 56.A O no hydrogen 2.722 N/A TYR 60.A OH ASP 11.A OD1 no hydrogen 2.277 N/A ARG 61.A N GLY 57.A O no hydrogen 2.896 N/A ARG 61.A NE GLU 77.A OE1 no hydrogen 3.460 N/A ARG 61.A NE GLU 77.A OE2 no hydrogen 3.052 N/A ARG 61.A NH2 GLU 77.A OE1 no hydrogen 2.891 N/A LYS 62.A N ALA 59.A O no hydrogen 3.418 N/A LYS 62.A NZ PHE 416.A O no hydrogen 3.468 N/A ASN 63.A N TYR 60.A O no hydrogen 3.352 N/A ALA 64.A N ARG 61.A O no hydrogen 3.433 N/A ASP 65.A N ASN 63.A O no hydrogen 2.740 N/A ARG 66.A NH2 ARG 1.A O no hydrogen 2.885 N/A LYS 70.A N ARG 66.A O no hydrogen 3.044 N/A ALA 71.A N ASP 67.A O no hydrogen 3.009 N/A LYS 72.A N GLU 68.A O no hydrogen 2.903 N/A TYR 74.A N LYS 70.A O no hydrogen 2.799 N/A GLU 75.A N ALA 71.A O no hydrogen 2.664 N/A LEU 76.A N LYS 72.A O no hydrogen 2.962 N/A GLU 77.A N ALA 73.A O no hydrogen 2.903 N/A GLN 78.A N TYR 74.A O no hydrogen 2.774 N/A SER 79.A N GLU 75.A O no hydrogen 2.651 N/A SER 79.A OG GLU 75.A O no hydrogen 2.739 N/A VAL 80.A N LEU 76.A O no hydrogen 3.121 N/A VAL 81.A N GLU 77.A O no hydrogen 3.004 N/A LYS 82.A N GLN 78.A O no hydrogen 2.715 N/A LYS 82.A NZ PRO 27.A O no hydrogen 2.823 N/A LYS 82.A NZ VAL 28.A O no hydrogen 3.420 N/A LEU 83.A N SER 79.A O no hydrogen 2.986 N/A MET 84.A N VAL 80.A O no hydrogen 2.912 N/A ARG 85.A N VAL 81.A O no hydrogen 2.689 N/A GLY 86.A N LYS 82.A O no hydrogen 2.660 N/A LEU 87.A N LEU 83.A O no hydrogen 2.650 N/A LEU 88.A N MET 84.A O no hydrogen 2.931 N/A HIS 89.A N ARG 85.A O no hydrogen 2.939 N/A CYS 90.A N GLY 86.A O no hydrogen 3.234 N/A CYS 90.A SG GLY 86.A O no hydrogen 3.164 N/A MET 91.A N LEU 87.A O no hydrogen 3.230 N/A ILE 92.A N LEU 88.A O no hydrogen 2.653 N/A ARG 93.A N HIS 89.A O no hydrogen 2.954 N/A GLN 94.A N MET 91.A O no hydrogen 2.968 N/A LYS 97.A N GLN 94.A O no hydrogen 2.963 N/A LYS 97.A NZ LYS 108.A O no hydrogen 3.273 N/A LYS 97.A NZ ASP 109.A OD1 no hydrogen 3.525 N/A VAL 98.A N GLN 94.A O no hydrogen 3.148 N/A GLU 99.A N VAL 95.A O no hydrogen 2.863 N/A SER 100.A N ASP 96.A O no hydrogen 3.016 N/A SER 100.A OG ASP 96.A O no hydrogen 2.933 N/A PHE 101.A N LYS 97.A O no hydrogen 2.802 N/A LYS 102.A N VAL 98.A O no hydrogen 3.182 N/A LYS 102.A NZ GLU 99.A OE1 no hydrogen 3.334 N/A LYS 102.A NZ ASN 166.A OD1 no hydrogen 2.345 N/A LYS 102.A NZ GLY 495.A O no hydrogen 2.481 N/A TYR 103.A OH SER 494.A OG no hydrogen 2.368 N/A SER 104.A N SER 100.A O no hydrogen 2.995 N/A GLN 105.A NE2 LYS 102.A O no hydrogen 3.382 N/A SER 106.A N SER 104.A O no hydrogen 2.714 N/A ASP 109.A N SER 106.A O no hydrogen 3.335 N/A SER 110.A OG THR 107.A O no hydrogen 3.163 N/A LEU 111.A N TYR 170.A OH no hydrogen 2.599 N/A HIS 112.A N GLN 94.A OE1 no hydrogen 3.016 N/A HIS 112.A NE2 ASP 126.A OD1 no hydrogen 2.599 N/A ALA 113.A N HIS 131.A ND1 no hydrogen 3.010 N/A TYR 115.A N ALA 41.A O no hydrogen 2.975 N/A TYR 115.A OH GLN 94.A OE1 no hydrogen 2.634 N/A ASN 116.A N ALA 121.A O no hydrogen 2.460 N/A LYS 118.A N ASN 116.A OD1 no hydrogen 3.459 N/A CYS 120.A N ASN 116.A O no hydrogen 2.842 N/A CYS 120.A SG GLY 86.A O no hydrogen 3.357 N/A TRP 129.A NE1 GLU 184.A OE2 no hydrogen 2.719 N/A HIS 131.A NE2 GLY 125.A O no hydrogen 2.746 N/A GLN 133.A NE2 GLY 130.A O no hydrogen 2.716 N/A GLN 133.A NE2 GLU 184.A OE2 no hydrogen 2.924 N/A LEU 134.A N ASP 179.A OD2 no hydrogen 3.201 N/A ALA 136.A N GLN 133.A O no hydrogen 2.984 N/A THR 137.A OG1 LEU 134.A O no hydrogen 3.473 N/A SER 138.A N LEU 134.A O no hydrogen 3.283 N/A SER 138.A OG LEU 134.A O no hydrogen 2.749 N/A VAL 139.A N ASP 135.A O no hydrogen 3.261 N/A TYR 140.A N ALA 136.A O no hydrogen 3.286 N/A TYR 140.A OH MET 84.A O no hydrogen 2.513 N/A LEU 141.A N THR 137.A O no hydrogen 2.718 N/A LEU 142.A N SER 138.A O no hydrogen 2.650 N/A PHE 143.A N VAL 139.A O no hydrogen 3.380 N/A LEU 144.A N TYR 140.A O no hydrogen 2.737 N/A ALA 145.A N LEU 141.A O no hydrogen 3.083 N/A GLN 146.A N LEU 142.A O no hydrogen 2.921 N/A GLN 146.A NE2 ASP 423.A OD1 no hydrogen 2.884 N/A MET 147.A N PHE 143.A O no hydrogen 2.545 N/A THR 148.A N LEU 144.A O no hydrogen 3.057 N/A THR 148.A OG1 LEU 144.A O no hydrogen 2.891 N/A THR 148.A OG1 ALA 145.A O no hydrogen 2.652 N/A ALA 149.A N ALA 145.A O no hydrogen 3.001 N/A SER 150.A N GLN 146.A O no hydrogen 2.904 N/A SER 150.A OG MET 147.A O no hydrogen 3.099 N/A GLY 151.A N THR 148.A O no hydrogen 2.997 N/A LEU 152.A N MET 147.A O no hydrogen 2.779 N/A HIS 156.A N GLU 160.A OE1 no hydrogen 3.027 N/A GLU 160.A N SER 157.A OG no hydrogen 3.226 N/A VAL 161.A N SER 157.A O no hydrogen 3.077 N/A ASN 162.A N LEU 158.A O no hydrogen 2.962 N/A PHE 163.A N ASP 159.A O no hydrogen 2.838 N/A ILE 164.A N GLU 160.A O no hydrogen 2.791 N/A GLN 165.A N VAL 161.A O no hydrogen 2.832 N/A GLN 165.A NE2 GLN 165.A O no hydrogen 3.032 N/A GLN 165.A NE2 HIS 228.A O no hydrogen 3.164 N/A ASN 166.A N ASN 162.A O no hydrogen 2.757 N/A ASN 166.A ND2 ASN 162.A O no hydrogen 2.846 N/A ASN 166.A ND2 GLY 486.A O no hydrogen 2.503 N/A LEU 167.A N PHE 163.A O no hydrogen 2.763 N/A VAL 168.A N ILE 164.A O no hydrogen 3.010 N/A VAL 168.A N GLN 165.A O no hydrogen 3.107 N/A TYR 170.A N ASN 166.A O no hydrogen 3.106 N/A ILE 171.A N LEU 167.A O no hydrogen 3.068 N/A TYR 175.A OH GLU 233.A OE2 no hydrogen 3.365 N/A LYS 176.A N ALA 173.A O no hydrogen 2.863 N/A THR 177.A OG1 ALA 173.A O no hydrogen 2.785 N/A ASP 179.A N GLU 195.A O no hydrogen 2.979 N/A PHE 180.A N LEU 132.A O no hydrogen 2.922 N/A TRP 183.A NE1 ASP 255.A OD1 no hydrogen 3.109 N/A TRP 183.A NE1 ASP 255.A OD2 no hydrogen 2.675 N/A GLU 184.A N GLY 181.A O no hydrogen 3.224 N/A ARG 185.A NH2 TYR 312.A OH no hydrogen 3.068 N/A GLY 186.A N PHE 180.A O no hydrogen 3.084 N/A ASP 187.A N ILE 193.A O no hydrogen 2.962 N/A LYS 188.A N SER 251.A OG no hydrogen 3.403 N/A THR 189.A OG1 ASP 187.A OD2 no hydrogen 3.501 N/A ASN 190.A N ASP 187.A O no hydrogen 3.311 N/A ASN 190.A ND2 LEU 310.A O no hydrogen 3.189 N/A GLN 191.A NE2 TYR 312.A O no hydrogen 3.183 N/A GLU 195.A N ASP 179.A O no hydrogen 3.277 N/A ALA 198.A N ALA 248.A O no hydrogen 2.659 N/A SER 199.A OG SER 257.A OG no hydrogen 2.643 N/A SER 200.A OG ASP 135.A OD2 no hydrogen 3.172 N/A SER 200.A OG ASP 179.A OD1 no hydrogen 3.133 N/A SER 200.A OG ASP 179.A OD2 no hydrogen 2.301 N/A VAL 201.A N ASN 197.A O no hydrogen 3.146 N/A GLY 202.A N ALA 198.A O no hydrogen 2.629 N/A MET 203.A N SER 199.A O no hydrogen 2.828 N/A ALA 204.A N SER 200.A O no hydrogen 3.083 N/A LYS 205.A N VAL 201.A O no hydrogen 3.224 N/A LYS 205.A NZ GLN 238.A OE1 no hydrogen 2.544 N/A LYS 205.A NZ ALA 268.A O no hydrogen 2.483 N/A ALA 206.A N GLY 202.A O no hydrogen 3.162 N/A ALA 207.A N MET 203.A O no hydrogen 2.908 N/A LEU 208.A N ALA 204.A O no hydrogen 2.711 N/A GLU 209.A N LYS 205.A O no hydrogen 2.947 N/A ALA 210.A N ALA 206.A O no hydrogen 2.724 N/A LEU 211.A N ALA 207.A O no hydrogen 2.906 N/A ASP 212.A N GLU 209.A O no hydrogen 3.243 N/A LEU 216.A N SER 225.A O no hydrogen 2.790 N/A PHE 217.A N ASP 215.A OD1 no hydrogen 3.152 N/A GLY 218.A N ASP 215.A O no hydrogen 3.031 N/A SER 225.A N GLY 222.A O no hydrogen 2.984 N/A VAL 226.A N PRO 223.A O no hydrogen 3.448 N/A ILE 227.A N LEU 214.A O no hydrogen 2.906 N/A HIS 228.A N GLN 165.A OE1 no hydrogen 2.890 N/A HIS 228.A ND1 GLU 213.A OE2 no hydrogen 3.262 N/A GLU 233.A N LEU 230.A O no hydrogen 3.232 N/A GLN 235.A N ALA 231.A O no hydrogen 2.891 N/A HIS 236.A N ASP 232.A O no hydrogen 2.941 N/A CYS 237.A N GLU 233.A O no hydrogen 3.208 N/A CYS 237.A SG VAL 201.A O no hydrogen 3.744 N/A CYS 237.A SG GLU 233.A O no hydrogen 3.363 N/A SER 239.A N GLN 235.A O no hydrogen 3.065 N/A SER 239.A OG GLN 235.A O no hydrogen 3.450 N/A ILE 240.A N HIS 236.A O no hydrogen 3.279 N/A LEU 241.A N CYS 237.A O no hydrogen 2.841 N/A ASN 242.A N GLN 238.A O no hydrogen 2.782 N/A SER 243.A N SER 239.A O no hydrogen 3.414 N/A SER 243.A OG SER 239.A O no hydrogen 2.707 N/A LEU 244.A N ILE 240.A O no hydrogen 2.716 N/A LEU 245.A N LEU 241.A O no hydrogen 2.928 N/A ARG 247.A N LEU 244.A O no hydrogen 2.849 N/A ARG 247.A NE SER 249.A O no hydrogen 3.052 N/A ARG 247.A NH2 SER 249.A O no hydrogen 3.129 N/A SER 249.A N LYS 252.A O no hydrogen 3.474 N/A SER 249.A OG GLU 195.A OE2 no hydrogen 3.148 N/A SER 249.A OG LEU 196.A O no hydrogen 3.503 N/A SER 251.A OG GLU 195.A OE1 no hydrogen 2.497 N/A SER 251.A OG GLU 195.A OE2 no hydrogen 3.203 N/A LYS 252.A NZ GLY 186.A O no hydrogen 3.162 N/A ALA 256.A N ARG 294.A O no hydrogen 2.766 N/A SER 257.A N ASP 255.A OD1 no hydrogen 2.529 N/A SER 257.A OG SER 199.A OG no hydrogen 2.643 N/A LEU 258.A N ASP 255.A O no hydrogen 3.090 N/A LEU 259.A N ALA 256.A O no hydrogen 3.194 N/A SER 260.A N SER 257.A O no hydrogen 2.780 N/A SER 260.A OG SER 257.A O no hydrogen 2.494 N/A VAL 261.A N LEU 258.A O no hydrogen 2.863 N/A VAL 262.A N LEU 258.A O no hydrogen 2.756 N/A SER 263.A OG ASP 337.A OD1 no hydrogen 2.501 N/A PHE 264.A N LEU 259.A O no hydrogen 3.203 N/A ALA 266.A N SER 260.A O no hydrogen 3.334 N/A ALA 268.A N VAL 261.A O no hydrogen 2.896 N/A VAL 275.A N ASP 271.A O no hydrogen 3.151 N/A GLU 276.A N SER 272.A O no hydrogen 2.981 N/A LEU 277.A N GLN 273.A O no hydrogen 2.849 N/A THR 278.A N LEU 274.A O no hydrogen 2.849 N/A THR 278.A OG1 LEU 274.A O no hydrogen 2.706 N/A LYS 279.A N VAL 275.A O no hydrogen 2.892 N/A LYS 279.A NZ GLU 276.A OE1 no hydrogen 3.184 N/A LYS 279.A NZ GLU 276.A OE2 no hydrogen 3.467 N/A LYS 279.A NZ ASP 337.A OD2 no hydrogen 3.458 N/A GLN 280.A N GLU 276.A O no hydrogen 2.879 N/A GLU 281.A N LEU 277.A O no hydrogen 2.917 N/A ILE 282.A N THR 278.A O no hydrogen 2.960 N/A ILE 283.A N LYS 279.A O no hydrogen 3.007 N/A THR 284.A N GLN 280.A O no hydrogen 2.940 N/A THR 284.A OG1 GLN 280.A O no hydrogen 3.361 N/A LYS 285.A N GLU 281.A O no hydrogen 3.115 N/A LEU 286.A N ILE 282.A O no hydrogen 2.958 N/A GLN 287.A N ILE 282.A O no hydrogen 3.309 N/A GLY 288.A N GLY 291.A O no hydrogen 3.096 N/A ARG 289.A NE THR 388.A O no hydrogen 3.077 N/A ARG 289.A NH2 THR 388.A O no hydrogen 2.661 N/A ARG 289.A NH2 ASP 390.A OD1 no hydrogen 2.761 N/A TYR 290.A N GLU 326.A OE1 no hydrogen 3.150 N/A TYR 290.A OH ASP 390.A OD1 no hydrogen 2.329 N/A CYS 292.A N TRP 327.A O no hydrogen 3.194 N/A CYS 293.A N LEU 286.A O no hydrogen 3.179 N/A CYS 293.A SG GLU 324.A O no hydrogen 3.705 N/A CYS 293.A SG CYS 325.A O no hydrogen 3.595 N/A ARG 294.A NE ASP 298.A OD2 no hydrogen 2.676 N/A ARG 294.A NH2 ASP 298.A OD1 no hydrogen 2.876 N/A ARG 294.A NH2 ASP 298.A OD2 no hydrogen 3.322 N/A ARG 297.A NH1 LEU 317.A O no hydrogen 3.258 N/A ASP 298.A N GLU 324.A OE2 no hydrogen 2.960 N/A THR 302.A OG1 ILE 323.A O no hydrogen 3.054 N/A GLU 305.A N THR 302.A O no hydrogen 3.121 N/A TYR 312.A N ASN 190.A O no hydrogen 3.081 N/A TYR 312.A OH GLY 299.A O no hydrogen 2.479 N/A GLU 316.A N GLU 313.A O no hydrogen 3.085 N/A LEU 317.A N PRO 314.A O no hydrogen 3.437 N/A LYS 318.A NZ ALA 315.A O no hydrogen 2.824 N/A LEU 319.A N GLU 316.A O no hydrogen 3.009 N/A PHE 320.A N LEU 317.A O no hydrogen 3.177 N/A ILE 323.A N PHE 320.A O no hydrogen 3.400 N/A CYS 325.A SG SER 373.A OG no hydrogen 2.990 N/A GLU 326.A N TYR 372.A O no hydrogen 2.992 N/A TRP 327.A N CYS 292.A O no hydrogen 3.115 N/A TRP 331.A N PRO 328.A O no hydrogen 3.097 N/A THR 332.A N LEU 329.A O no hydrogen 3.155 N/A THR 332.A OG1 LEU 329.A O no hydrogen 2.486 N/A PHE 334.A N PHE 330.A O no hydrogen 3.256 N/A ILE 335.A N TRP 331.A O no hydrogen 3.104 N/A LEU 336.A N THR 332.A O no hydrogen 2.870 N/A ASP 337.A N TYR 333.A O no hydrogen 2.724 N/A GLY 338.A N PHE 334.A O no hydrogen 2.966 N/A VAL 339.A N ILE 335.A O no hydrogen 3.130 N/A PHE 340.A N LEU 336.A O no hydrogen 3.162 N/A SER 341.A N ASP 337.A O no hydrogen 2.731 N/A SER 341.A OG ASP 337.A O no hydrogen 2.755 N/A SER 341.A OG GLY 338.A O no hydrogen 3.295 N/A GLY 342.A N GLY 338.A O no hydrogen 2.723 N/A ASN 343.A N GLY 338.A O no hydrogen 2.883 N/A GLU 345.A N GLU 345.A OE1 no hydrogen 2.804 N/A GLN 346.A NE2 ASP 337.A OD2 no hydrogen 3.251 N/A VAL 347.A N ASN 343.A O no hydrogen 3.030 N/A GLN 348.A N GLU 345.A O no hydrogen 3.091 N/A GLU 349.A N GLU 345.A O no hydrogen 3.033 N/A TYR 350.A N GLN 346.A O no hydrogen 3.413 N/A LYS 351.A NZ GLU 414.A OE2 no hydrogen 3.252 N/A GLU 352.A N GLN 348.A O no hydrogen 3.177 N/A ALA 353.A N GLU 349.A O no hydrogen 3.333 N/A LEU 354.A N TYR 350.A O no hydrogen 3.122 N/A GLU 355.A N LYS 351.A O no hydrogen 2.866 N/A VAL 357.A N LEU 354.A O no hydrogen 3.164 N/A LEU 358.A N LEU 354.A O no hydrogen 3.080 N/A ILE 359.A N LEU 367.A O no hydrogen 2.838 N/A GLY 361.A N VAL 365.A O no hydrogen 3.188 N/A LEU 367.A N ILE 359.A O no hydrogen 2.912 N/A LEU 368.A N GLN 403.A OE1 no hydrogen 2.759 N/A GLU 370.A N LYS 396.A O no hydrogen 2.967 N/A TYR 372.A N GLU 326.A O no hydrogen 2.547 N/A TYR 372.A OH VAL 357.A O no hydrogen 2.328 N/A SER 373.A N VAL 392.A O no hydrogen 2.771 N/A SER 373.A OG LYS 301.A O no hydrogen 3.040 N/A ARG 378.A N PRO 375.A O no hydrogen 3.029 N/A TYR 383.A N VAL 379.A O no hydrogen 3.130 N/A GLN 384.A N ASP 380.A O no hydrogen 3.358 N/A GLN 384.A N GLU 381.A O no hydrogen 3.231 N/A ASN 385.A N GLU 381.A O no hydrogen 2.898 N/A THR 388.A OG1 ASN 385.A O no hydrogen 3.386 N/A THR 388.A OG1 ASN 385.A OD1 no hydrogen 2.413 N/A ARG 391.A NH1 GLU 324.A O no hydrogen 2.360 N/A ARG 391.A NH1 TYR 372.A O no hydrogen 3.188 N/A ARG 391.A NH2 GLU 324.A O no hydrogen 3.129 N/A ARG 391.A NH2 GLU 382.A OE2 no hydrogen 2.368 N/A VAL 392.A N SER 373.A O no hydrogen 2.840 N/A MET 394.A N LEU 371.A O no hydrogen 2.939 N/A HIS 399.A N LEU 368.A O no hydrogen 2.872 N/A TRP 401.A NE1 TYR 333.A OH no hydrogen 3.146 N/A GLY 402.A N HIS 399.A ND1 no hydrogen 3.020 N/A GLN 403.A N HIS 399.A O no hydrogen 2.643 N/A GLN 403.A NE2 PRO 366.A O no hydrogen 2.862 N/A SER 404.A N MET 400.A O no hydrogen 3.397 N/A SER 404.A N TRP 401.A O no hydrogen 3.184 N/A SER 404.A OG TYR 48.A O no hydrogen 2.634 N/A TYR 406.A N GLY 402.A O no hydrogen 3.088 N/A ILE 407.A N GLN 403.A O no hydrogen 3.042 N/A LEU 408.A N SER 404.A O no hydrogen 2.647 N/A GLY 409.A N LEU 405.A O no hydrogen 2.493 N/A SER 410.A N TYR 406.A O no hydrogen 2.804 N/A SER 410.A OG TYR 406.A O no hydrogen 2.813 N/A LEU 411.A N ILE 407.A O no hydrogen 2.627 N/A MET 412.A N LEU 408.A O no hydrogen 3.015 N/A ALA 413.A N GLY 409.A O no hydrogen 2.900 N/A GLU 414.A N SER 410.A O no hydrogen 3.173 N/A PHE 416.A N LEU 411.A O no hydrogen 2.991 N/A GLU 421.A N ALA 418.A O no hydrogen 3.160 N/A ILE 422.A N ALA 418.A O no hydrogen 3.384 N/A ASN 426.A N ASP 423.A O no hydrogen 3.061 N/A ARG 427.A N ASP 423.A OD1 no hydrogen 2.847 N/A ARG 427.A NE ALA 266.A O no hydrogen 2.695 N/A ARG 427.A NH2 ALA 266.A O no hydrogen 3.512 N/A ARG 427.A NH2 PHE 267.A O no hydrogen 3.235 N/A ARG 428.A NH1 ASN 426.A OD1 no hydrogen 2.826 N/A SER 430.A N ARG 427.A O no hydrogen 3.021 N/A SER 430.A OG PHE 267.A O no hydrogen 2.881 N/A SER 430.A OG VAL 269.A O no hydrogen 3.114 N/A VAL 432.A N PHE 429.A O no hydrogen 3.334 N/A LYS 434.A NZ SER 430.A O no hydrogen 2.337 N/A LYS 434.A NZ VAL 432.A O no hydrogen 3.151 N/A VAL 437.A N CYS 550.A O no hydrogen 3.203 N/A VAL 439.A N ARG 597.A O no hydrogen 2.646 N/A GLN 440.A N PRO 559.A O no hydrogen 2.809 N/A GLN 440.A NE2 PRO 559.A O no hydrogen 3.557 N/A GLN 440.A NE2 THR 609.A O no hydrogen 3.103 N/A GLN 440.A NE2 SER 610.A OG no hydrogen 3.148 N/A SER 442.A N ILE 561.A O no hydrogen 3.077 N/A LEU 444.A N PHE 563.A O no hydrogen 2.743 N/A ALA 445.A N GLU 462.A O no hydrogen 3.265 N/A GLU 446.A N ILE 565.A O no hydrogen 3.214 N/A ILE 450.A N THR 447.A O no hydrogen 3.234 N/A LYS 451.A N THR 447.A O no hydrogen 3.360 N/A LYS 451.A NZ GLU 466.A OE1 no hydrogen 2.933 N/A THR 452.A N GLU 448.A O no hydrogen 3.315 N/A THR 452.A OG1 GLU 449.A O no hydrogen 3.177 N/A LEU 454.A N ILE 450.A O no hydrogen 3.047 N/A LYS 455.A N LYS 451.A O no hydrogen 2.807 N/A ASP 456.A N THR 452.A O no hydrogen 2.703 N/A LYS 457.A N ILE 453.A O no hydrogen 3.177 N/A GLY 458.A N LYS 455.A O no hydrogen 2.776 N/A ILE 459.A N LEU 454.A O no hydrogen 2.711 N/A THR 463.A OG1 GLU 448.A OE2 no hydrogen 3.311 N/A THR 463.A OG1 GLU 466.A OE1 no hydrogen 3.414 N/A ILE 464.A N ALA 445.A O no hydrogen 3.049 N/A TYR 468.A N ALA 465.A O no hydrogen 3.234 N/A ARG 471.A NE LEU 629.A O no hydrogen 3.157 N/A GLN 473.A N THR 518.A O no hydrogen 3.160 N/A ILE 477.A N PRO 474.A O no hydrogen 3.121 N/A SER 479.A N ALA 475.A O no hydrogen 3.283 N/A SER 479.A OG ALA 475.A O no hydrogen 3.098 N/A SER 479.A OG ARG 499.A O no hydrogen 3.242 N/A HIS 480.A N ARG 476.A O no hydrogen 2.945 N/A ILE 481.A N ILE 477.A O no hydrogen 2.942 N/A TYR 482.A N LEU 478.A O no hydrogen 3.233 N/A SER 483.A N HIS 480.A O no hydrogen 3.139 N/A SER 483.A OG SER 479.A O no hydrogen 3.569 N/A SER 483.A OG ARG 496.A O no hydrogen 3.043 N/A SER 484.A N ILE 481.A O no hydrogen 3.114 N/A LEU 485.A N TYR 482.A O no hydrogen 3.143 N/A CYS 487.A SG SER 483.A O no hydrogen 3.796 N/A CYS 487.A SG LEU 493.A O no hydrogen 3.893 N/A ASN 488.A N LEU 493.A O no hydrogen 2.989 N/A ASN 488.A ND2 ASN 162.A OD1 no hydrogen 2.669 N/A MET 491.A N ASN 488.A OD1 no hydrogen 3.448 N/A LYS 492.A N ASN 489.A O no hydrogen 2.989 N/A LEU 493.A N ASN 488.A O no hydrogen 2.865 N/A SER 494.A N GLU 99.A OE1 no hydrogen 2.926 N/A SER 494.A OG GLU 99.A OE1 no hydrogen 3.015 N/A SER 494.A OG GLU 99.A OE2 no hydrogen 2.472 N/A SER 494.A OG TYR 103.A OH no hydrogen 2.368 N/A ARG 496.A NE GLU 172.A OE1 no hydrogen 3.395 N/A ARG 496.A NE GLU 172.A OE2 no hydrogen 3.264 N/A ARG 496.A NH2 GLU 233.A OE1 no hydrogen 3.125 N/A TYR 498.A OH GLU 684.A OE1 no hydrogen 3.120 N/A TYR 498.A OH GLU 684.A OE2 no hydrogen 2.467 N/A ARG 499.A NH2 PHE 169.A O no hydrogen 2.759 N/A GLY 502.A N ASP 232.A OD2 no hydrogen 2.650 N/A GLY 505.A N GLY 502.A O no hydrogen 3.322 N/A THR 506.A N GLY 502.A O no hydrogen 2.968 N/A THR 506.A OG1 GLY 502.A O no hydrogen 2.542 N/A SER 507.A N VAL 503.A O no hydrogen 2.597 N/A SER 507.A OG VAL 503.A O no hydrogen 2.874 N/A LYS 508.A NZ LEU 504.A O no hydrogen 2.295 N/A LEU 509.A N CYS 611.A O no hydrogen 2.846 N/A TYR 510.A N PHE 517.A O no hydrogen 2.619 N/A TYR 510.A OH GLY 505.A O no hydrogen 2.185 N/A ASP 511.A N THR 613.A O no hydrogen 2.887 N/A ILE 512.A N THR 515.A O no hydrogen 3.120 N/A ARG 513.A NH1 MET 618.A O no hydrogen 3.398 N/A THR 515.A N ILE 512.A O no hydrogen 3.012 N/A PHE 517.A N TYR 510.A O no hydrogen 2.378 N/A THR 520.A N GLN 473.A O no hydrogen 2.656 N/A THR 520.A OG1 GLN 473.A O no hydrogen 3.416 N/A ILE 524.A N PRO 521.A O no hydrogen 3.388 N/A ASP 525.A N GLN 522.A O no hydrogen 2.900 N/A GLN 527.A N ASP 525.A OD1 no hydrogen 2.829 N/A GLN 528.A N ASP 525.A OD1 no hydrogen 3.184 N/A TYR 530.A OH GLU 742.A OE2 no hydrogen 3.116 N/A LEU 533.A N TYR 530.A O no hydrogen 3.337 N/A MET 537.A N ASP 534.A O no hydrogen 2.860 N/A ILE 538.A N ASP 534.A O no hydrogen 3.120 N/A VAL 539.A N ASN 535.A O no hydrogen 3.500 N/A MET 541.A N MET 537.A O no hydrogen 2.773 N/A LEU 542.A N ILE 538.A O no hydrogen 2.676 N/A ARG 543.A N VAL 539.A O no hydrogen 2.610 N/A THR 544.A N GLU 540.A O no hydrogen 3.186 N/A THR 544.A OG1 GLU 540.A O no hydrogen 3.444 N/A THR 544.A OG1 MET 541.A O no hydrogen 2.918 N/A ASP 545.A N MET 541.A O no hydrogen 2.806 N/A LEU 546.A N LEU 542.A O no hydrogen 2.878 N/A SER 547.A N ARG 543.A O no hydrogen 3.295 N/A SER 547.A OG ARG 543.A O no hydrogen 2.355 N/A SER 547.A OG GLY 594.A O no hydrogen 2.520 N/A TYR 548.A N THR 544.A O no hydrogen 2.688 N/A LEU 549.A N ASP 545.A O no hydrogen 3.012 N/A CYS 550.A N LEU 546.A O no hydrogen 2.864 N/A CYS 550.A SG ASP 436.A OD2 no hydrogen 3.902 N/A CYS 550.A SG LEU 546.A O no hydrogen 3.398 N/A CYS 550.A SG SER 547.A O no hydrogen 3.242 N/A CYS 550.A SG GLY 595.A O no hydrogen 3.886 N/A SER 551.A OG SER 547.A O no hydrogen 2.738 N/A ARG 552.A N LEU 549.A O no hydrogen 3.255 N/A TRP 553.A NE1 GLY 557.A O no hydrogen 2.947 N/A ARG 554.A NE GLU 270.A OE2 no hydrogen 3.506 N/A ARG 554.A NH1 SER 551.A O no hydrogen 3.435 N/A ARG 554.A NH1 TRP 553.A O no hydrogen 2.731 N/A ARG 554.A NH2 GLU 270.A OE1 no hydrogen 3.195 N/A ARG 554.A NH2 SER 551.A O no hydrogen 3.055 N/A GLN 558.A N THR 609.A O no hydrogen 3.156 N/A GLN 558.A NE2 GLN 440.A OE1 no hydrogen 2.617 N/A THR 560.A N SER 507.A O no hydrogen 2.743 N/A THR 560.A OG1 GLN 558.A O no hydrogen 3.374 N/A THR 560.A OG1 SER 610.A OG no hydrogen 2.195 N/A ILE 561.A N GLN 440.A O no hydrogen 2.812 N/A PHE 563.A N SER 442.A O no hydrogen 3.146 N/A ILE 565.A N LEU 444.A O no hydrogen 2.604 N/A SER 566.A OG GLU 446.A OE2 no hydrogen 3.060 N/A MET 569.A N SER 566.A O no hydrogen 3.053 N/A LEU 570.A N HIS 567.A O no hydrogen 3.188 N/A ASP 571.A N SER 576.A O no hydrogen 2.729 N/A SER 576.A OG ASP 571.A OD2 no hydrogen 2.879 N/A SER 576.A OG LEU 577.A O no hydrogen 3.051 N/A ASN 578.A N MET 569.A O no hydrogen 3.441 N/A SER 580.A N ASN 578.A OD1 no hydrogen 2.513 N/A LEU 582.A N ASN 578.A O no hydrogen 2.559 N/A ALA 583.A N SER 579.A O no hydrogen 2.710 N/A ALA 584.A N SER 580.A O no hydrogen 3.128 N/A LEU 585.A N ILE 581.A O no hydrogen 2.859 N/A ARG 586.A N LEU 582.A O no hydrogen 3.443 N/A LYS 587.A N ALA 583.A O no hydrogen 3.035 N/A MET 588.A N ALA 584.A O no hydrogen 3.320 N/A MET 588.A N LEU 585.A O no hydrogen 3.089 N/A GLN 589.A N LEU 585.A O no hydrogen 3.421 N/A ASP 590.A N ARG 586.A O no hydrogen 3.305 N/A GLY 591.A N MET 588.A O no hydrogen 3.154 N/A PHE 593.A N ALA 596.A O no hydrogen 3.133 N/A ALA 596.A N PHE 593.A O no hydrogen 3.299 N/A VAL 598.A N GLY 591.A O no hydrogen 3.062 N/A GLN 599.A N VAL 439.A O no hydrogen 3.204 N/A THR 600.A OG1 MET 588.A O no hydrogen 2.787 N/A GLY 601.A N VAL 441.A O no hydrogen 3.091 N/A LYS 602.A NZ GLU 605.A OE2 no hydrogen 2.601 N/A GLU 605.A N LYS 602.A O no hydrogen 2.956 N/A LEU 607.A N SER 604.A O no hydrogen 3.370 N/A THR 609.A OG1 GLN 440.A OE1 no hydrogen 2.343 N/A SER 610.A OG GLN 558.A O no hydrogen 3.402 N/A SER 610.A OG THR 560.A OG1 no hydrogen 2.195 N/A SER 610.A OG PHE 606.A O no hydrogen 2.816 N/A THR 613.A N LEU 509.A O no hydrogen 2.927 N/A THR 613.A OG1 LEU 509.A O no hydrogen 3.486 N/A HIS 614.A ND1 ASP 511.A O no hydrogen 2.976 N/A HIS 614.A NE2 ASP 619.A OD2 no hydrogen 3.042 N/A LEU 615.A N ASP 511.A O no hydrogen 3.096 N/A MET 618.A N LEU 615.A O no hydrogen 3.163 N/A ASP 619.A N SER 616.A O no hydrogen 3.050 N/A TYR 625.A N GLU 621.A O no hydrogen 2.988 N/A TYR 625.A OH GLN 473.A OE1 no hydrogen 3.410 N/A LEU 626.A N VAL 622.A O no hydrogen 2.811 N/A ASP 627.A N ALA 623.A O no hydrogen 2.646 N/A HIS 628.A N ARG 624.A O no hydrogen 3.261 N/A LEU 629.A N TYR 625.A O no hydrogen 2.912 N/A LEU 630.A N LEU 626.A O no hydrogen 2.722 N/A ALA 631.A N ASP 627.A O no hydrogen 3.092 N/A LEU 637.A N GLN 633.A O no hydrogen 3.359 N/A LEU 637.A N ALA 634.A O no hydrogen 3.066 N/A LEU 640.A N ILE 636.A O no hydrogen 3.003 N/A TYR 641.A N LEU 637.A O no hydrogen 2.499 N/A THR 642.A N TYR 638.A O no hydrogen 2.446 N/A MET 643.A N MET 639.A O no hydrogen 3.229 N/A GLY 645.A N THR 642.A O no hydrogen 3.434 N/A TRP 648.A NE1 LYS 644.A O no hydrogen 2.678 N/A GLU 658.A N LEU 655.A O no hydrogen 3.197 N/A TYR 660.A N LEU 656.A O no hydrogen 2.261 N/A GLY 661.A N GLU 658.A O no hydrogen 2.819 N/A LYS 662.A NZ GLU 658.A O no hydrogen 2.681 N/A GLY 664.A N TYR 660.A O no hydrogen 3.272 N/A GLU 665.A N GLY 661.A O no hydrogen 3.225 N/A ILE 666.A N LYS 662.A O no hydrogen 2.773 N/A ARG 667.A N VAL 663.A O no hydrogen 2.635 N/A ARG 667.A NE GLU 572.A OE2 no hydrogen 3.374 N/A ARG 667.A NH1 LEU 533.A O no hydrogen 2.457 N/A ARG 667.A NH1 SER 568.A OG no hydrogen 3.182 N/A LEU 671.A N HIS 668.A ND1 no hydrogen 2.975 N/A ILE 672.A N HIS 668.A O no hydrogen 3.050 N/A ARG 673.A N TRP 669.A O no hydrogen 3.055 N/A ARG 673.A NE GLU 742.A OE2 no hydrogen 2.821 N/A ARG 673.A NH1 MET 793.A O no hydrogen 2.739 N/A ARG 673.A NH1 LEU 795.A O no hydrogen 2.665 N/A ARG 673.A NH2 GLU 742.A OE1 no hydrogen 2.714 N/A ARG 673.A NH2 GLU 742.A OE2 no hydrogen 2.972 N/A ARG 673.A NH2 LEU 795.A O no hydrogen 3.440 N/A TYR 674.A N GLY 670.A O no hydrogen 3.410 N/A ILE 675.A N LEU 671.A O no hydrogen 3.108 N/A SER 676.A N ILE 672.A O no hydrogen 3.108 N/A SER 676.A OG ILE 672.A O no hydrogen 3.270 N/A GLY 677.A N ARG 673.A O no hydrogen 2.891 N/A ILE 678.A N TYR 674.A O no hydrogen 2.876 N/A LEU 679.A N ILE 675.A O no hydrogen 2.661 N/A ARG 680.A N GLY 677.A O no hydrogen 3.058 N/A LYS 681.A N SER 676.A O no hydrogen 2.636 N/A LYS 681.A NZ GLN 527.A O no hydrogen 3.017 N/A GLU 688.A N ASP 687.A OD1 no hydrogen 3.015 N/A GLU 688.A N GLU 688.A OE1 no hydrogen 2.485 N/A ALA 689.A N ALA 685.A O no hydrogen 2.780 N/A CYS 690.A N LEU 686.A O no hydrogen 2.553 N/A THR 691.A N ASP 687.A O no hydrogen 3.308 N/A THR 691.A OG1 ASP 687.A O no hydrogen 2.860 N/A ASP 692.A N GLU 688.A O no hydrogen 2.849 N/A LEU 693.A N ALA 689.A O no hydrogen 3.336 N/A LEU 694.A N CYS 690.A O no hydrogen 2.744 N/A SER 695.A N THR 691.A O no hydrogen 2.615 N/A SER 695.A OG ILE 240.A O no hydrogen 3.219 N/A HIS 696.A N LEU 693.A O no hydrogen 3.447 N/A HIS 696.A ND1 ASP 692.A O no hydrogen 3.202 N/A LYS 698.A NZ PHE 758.A O no hydrogen 2.818 N/A LYS 698.A NZ MET 761.A O no hydrogen 3.001 N/A HIS 699.A N PHE 762.A O no hydrogen 3.222 N/A LEU 700.A N ILE 713.A O no hydrogen 2.986 N/A THR 701.A N LEU 764.A O no hydrogen 2.783 N/A THR 701.A OG1 LEU 764.A O no hydrogen 3.327 N/A VAL 702.A N LYS 711.A O no hydrogen 3.325 N/A GLU 710.A N PRO 706.A O no hydrogen 2.865 N/A LYS 711.A N VAL 702.A O no hydrogen 3.399 N/A ILE 713.A N LEU 700.A O no hydrogen 2.456 N/A TYR 719.A OH VAL 683.A O no hydrogen 2.448 N/A LEU 722.A N PRO 718.A O no hydrogen 2.949 N/A THR 723.A N TYR 719.A O no hydrogen 3.146 N/A THR 723.A OG1 TYR 719.A O no hydrogen 2.777 N/A THR 723.A OG1 GLU 720.A O no hydrogen 2.627 N/A GLN 724.A N GLU 720.A O no hydrogen 2.862 N/A LEU 725.A N ALA 721.A O no hydrogen 2.759 N/A ILE 726.A N LEU 722.A O no hydrogen 3.070 N/A ASP 727.A N THR 723.A O no hydrogen 2.909 N/A GLU 728.A N GLN 724.A O no hydrogen 2.838 N/A ALA 729.A N LEU 725.A O no hydrogen 2.795 N/A SER 730.A N ASP 727.A O no hydrogen 3.066 N/A SER 730.A OG ASP 727.A O no hydrogen 2.379 N/A GLU 731.A N GLU 728.A O no hydrogen 3.201 N/A ASP 733.A N SER 730.A O no hydrogen 2.679 N/A SER 737.A N ASP 733.A O no hydrogen 3.410 N/A SER 737.A OG MET 734.A O no hydrogen 2.867 N/A ILE 738.A N MET 734.A O no hydrogen 3.334 N/A LEU 739.A N SER 735.A O no hydrogen 3.219 N/A THR 740.A N ILE 736.A O no hydrogen 2.630 N/A THR 740.A OG1 ILE 736.A O no hydrogen 2.801 N/A GLN 741.A N SER 737.A O no hydrogen 3.311 N/A GLU 742.A N ILE 738.A O no hydrogen 2.571 N/A ILE 743.A N LEU 739.A O no hydrogen 2.965 N/A MET 744.A N THR 740.A O no hydrogen 3.163 N/A VAL 745.A N GLN 741.A O no hydrogen 3.184 N/A TYR 746.A N GLU 742.A O no hydrogen 3.410 N/A TYR 746.A OH GLU 742.A OE1 no hydrogen 2.632 N/A LEU 747.A N ILE 743.A O no hydrogen 2.672 N/A ALA 748.A N MET 744.A O no hydrogen 3.055 N/A MET 749.A N VAL 745.A O no hydrogen 2.652 N/A TYR 750.A N TYR 746.A O no hydrogen 2.850 N/A TYR 750.A OH LYS 801.A O no hydrogen 3.056 N/A MET 751.A N LEU 747.A O no hydrogen 2.842 N/A ARG 752.A N ALA 748.A O no hydrogen 2.989 N/A ARG 752.A NE ASP 692.A OD2 no hydrogen 2.789 N/A ARG 752.A NH2 ASP 692.A OD2 no hydrogen 3.206 N/A THR 753.A N MET 749.A O no hydrogen 3.332 N/A THR 753.A N TYR 750.A O no hydrogen 3.289 N/A GLN 754.A N TYR 750.A O no hydrogen 2.532 N/A MET 761.A N PHE 758.A O no hydrogen 3.223 N/A ARG 763.A NH1 GLU 875.A OE1 no hydrogen 2.533 N/A ARG 763.A NH2 GLU 875.A OE1 no hydrogen 3.168 N/A LEU 764.A N HIS 699.A O no hydrogen 2.802 N/A ARG 765.A NE GLU 710.A OE2 no hydrogen 2.982 N/A ARG 765.A NH1 ASN 828.A OD1 no hydrogen 2.880 N/A ARG 765.A NH2 GLU 710.A OE2 no hydrogen 2.878 N/A ILE 766.A N THR 701.A O no hydrogen 2.757 N/A ILE 769.A N ARG 765.A O no hydrogen 3.152 N/A ILE 770.A N ILE 766.A O no hydrogen 3.248 N/A VAL 772.A N LEU 768.A O no hydrogen 2.525 N/A MET 773.A N ILE 769.A O no hydrogen 2.728 N/A ALA 774.A N ILE 770.A O no hydrogen 2.762 N/A THR 775.A N GLN 771.A O no hydrogen 3.072 N/A THR 775.A OG1 VAL 772.A O no hydrogen 3.092 N/A LEU 777.A N MET 773.A O no hydrogen 3.305 N/A ALA 778.A N THR 775.A O no hydrogen 2.979 N/A HIS 779.A N THR 775.A O no hydrogen 2.730 N/A HIS 779.A ND1 GLU 776.A O no hydrogen 2.503 N/A SER 780.A N GLU 776.A O no hydrogen 2.934 N/A CYS 783.A N ALA 778.A O no hydrogen 3.290 N/A CYS 783.A SG LEU 781.A O no hydrogen 3.587 N/A CYS 783.A SG SER 784.A O no hydrogen 3.359 N/A GLU 787.A N SER 784.A OG no hydrogen 3.314 N/A ALA 788.A N SER 784.A O no hydrogen 2.868 N/A THR 789.A N ALA 785.A O no hydrogen 2.574 N/A THR 789.A OG1 ALA 785.A O no hydrogen 2.900 N/A GLU 790.A N GLU 786.A O no hydrogen 2.807 N/A GLY 791.A N GLU 787.A O no hydrogen 2.557 N/A LEU 792.A N ALA 788.A O no hydrogen 2.516 N/A ASN 794.A N GLY 791.A O no hydrogen 2.831 N/A SER 798.A N ASP 534.A OD2 no hydrogen 3.117 N/A SER 798.A OG ASP 534.A OD2 no hydrogen 2.302 N/A ALA 799.A N SER 796.A OG no hydrogen 2.882 N/A MET 800.A N SER 796.A O no hydrogen 2.522 N/A LYS 801.A N PRO 797.A O no hydrogen 2.654 N/A LYS 801.A NZ GLU 540.A OE1 no hydrogen 2.719 N/A ASN 802.A N SER 798.A O no hydrogen 2.673 N/A LEU 803.A N ALA 799.A O no hydrogen 2.730 N/A LEU 804.A N MET 800.A O no hydrogen 2.983 N/A HIS 805.A N LYS 801.A O no hydrogen 2.877 N/A HIS 805.A NE2 GLN 754.A OE1 no hydrogen 3.252 N/A HIS 806.A N ASN 802.A O no hydrogen 2.495 N/A ILE 807.A N LEU 803.A O no hydrogen 2.861 N/A LEU 808.A N LEU 804.A O no hydrogen 2.798 N/A SER 809.A N HIS 805.A O no hydrogen 2.893 N/A SER 809.A OG HIS 805.A O no hydrogen 2.625 N/A TRP 817.A N ASP 953.A OD1 no hydrogen 2.771 N/A GLN 818.A N ASP 953.A OD1 no hydrogen 3.436 N/A ARG 819.A N GLY 815.A O no hydrogen 2.932 N/A ARG 820.A NH1 GLU 812.A OE1 no hydrogen 2.372 N/A ARG 821.A NH1 TYR 952.A O no hydrogen 2.403 N/A ARG 821.A NH1 SER 954.A O no hydrogen 2.699 N/A ARG 821.A NH2 SER 954.A O no hydrogen 3.317 N/A ARG 822.A N GLN 818.A O no hydrogen 3.059 N/A ASP 824.A N ARG 821.A O no hydrogen 3.422 N/A GLY 825.A N ARG 821.A O no hydrogen 3.063 N/A ARG 829.A N ASP 824.A O no hydrogen 3.187 N/A ARG 829.A NH1 ASP 824.A OD1 no hydrogen 2.785 N/A VAL 830.A N GLU 760.A O no hydrogen 2.765 N/A PHE 834.A N PRO 831.A O no hydrogen 3.091 N/A LYS 837.A N PHE 834.A O no hydrogen 2.966 N/A VAL 838.A N PHE 834.A O no hydrogen 2.913 N/A TRP 839.A NE1 THR 860.A O no hydrogen 2.653 N/A TRP 839.A NE1 MET 863.A O no hydrogen 3.237 N/A VAL 841.A N LYS 837.A O no hydrogen 3.287 N/A LEU 842.A N VAL 838.A O no hydrogen 2.879 N/A GLN 843.A N TRP 839.A O no hydrogen 3.361 N/A LYS 844.A N VAL 841.A O no hydrogen 2.871 N/A LYS 844.A NZ GLU 904.A O no hydrogen 3.427 N/A CYS 845.A N LEU 842.A O no hydrogen 3.191 N/A CYS 845.A SG VAL 841.A O no hydrogen 3.263 N/A HIS 846.A N SER 910.A O no hydrogen 3.369 N/A LEU 848.A N LEU 855.A O no hydrogen 2.892 N/A SER 849.A N ILE 912.A O no hydrogen 2.936 N/A VAL 850.A N PHE 853.A O no hydrogen 2.923 N/A PHE 853.A N VAL 850.A O no hydrogen 2.860 N/A LEU 855.A N LEU 848.A O no hydrogen 2.744 N/A SER 857.A N HIS 846.A O no hydrogen 3.031 N/A SER 857.A OG LEU 842.A O no hydrogen 2.623 N/A SER 857.A OG CYS 845.A O no hydrogen 2.574 N/A THR 859.A N PRO 856.A O no hydrogen 3.229 N/A THR 859.A OG1 PRO 856.A O no hydrogen 2.230 N/A THR 860.A N SER 857.A O no hydrogen 3.029 N/A THR 860.A OG1 SER 857.A O no hydrogen 2.150 N/A GLU 862.A N SER 858.A O no hydrogen 3.226 N/A MET 863.A N THR 859.A O no hydrogen 3.041 N/A THR 864.A OG1 GLU 867.A OE1 no hydrogen 3.023 N/A GLU 867.A N THR 864.A O no hydrogen 3.018 N/A LYS 869.A NZ GLU 867.A OE2 no hydrogen 3.218 N/A SER 871.A N GLU 867.A O no hydrogen 3.259 N/A SER 871.A OG GLU 867.A O no hydrogen 3.325 N/A VAL 872.A N ILE 868.A O no hydrogen 2.948 N/A HIS 873.A N LYS 869.A O no hydrogen 3.149 N/A HIS 873.A ND1 LYS 869.A O no hydrogen 3.029 N/A VAL 874.A N PHE 870.A O no hydrogen 2.977 N/A GLU 875.A N SER 871.A O no hydrogen 2.853 N/A SER 876.A N VAL 872.A O no hydrogen 2.538 N/A VAL 877.A N HIS 873.A O no hydrogen 3.187 N/A LEU 878.A N VAL 874.A O no hydrogen 3.124 N/A ASN 879.A N GLU 875.A O no hydrogen 3.112 N/A ASN 879.A ND2 ASN 828.A OD1 no hydrogen 3.537 N/A ARG 880.A N VAL 877.A O no hydrogen 3.246 N/A ARG 880.A NH1 SER 876.A OG no hydrogen 3.063 N/A GLN 883.A N GLN 883.A OE1 no hydrogen 2.541 N/A GLU 885.A N GLU 885.A OE1 no hydrogen 2.728 N/A TYR 886.A OH GLU 915.A O no hydrogen 2.807 N/A ARG 887.A N PRO 884.A O no hydrogen 3.009 N/A ARG 887.A NH2 GLU 875.A OE2 no hydrogen 3.006 N/A GLN 888.A N PRO 884.A O no hydrogen 3.448 N/A GLN 888.A NE2 ARG 829.A O no hydrogen 3.019 N/A LEU 889.A N GLU 885.A O no hydrogen 3.330 N/A LEU 890.A N TYR 886.A O no hydrogen 2.930 N/A VAL 891.A N ARG 887.A O no hydrogen 2.710 N/A GLU 892.A N GLN 888.A O no hydrogen 2.946 N/A ALA 893.A N LEU 889.A O no hydrogen 2.938 N/A ILE 894.A N LEU 890.A O no hydrogen 2.803 N/A LEU 895.A N VAL 891.A O no hydrogen 3.366 N/A VAL 896.A N GLU 892.A O no hydrogen 3.053 N/A LEU 897.A N ALA 893.A O no hydrogen 3.328 N/A THR 898.A N ILE 894.A O no hydrogen 3.125 N/A THR 898.A OG1 LEU 895.A O no hydrogen 2.365 N/A MET 899.A N LEU 895.A O no hydrogen 2.829 N/A LEU 900.A N VAL 896.A O no hydrogen 3.150 N/A ALA 901.A N LEU 897.A O no hydrogen 2.559 N/A ASP 902.A N THR 898.A O no hydrogen 3.277 N/A GLU 904.A N LEU 900.A O no hydrogen 2.990 N/A ILE 905.A N ILE 982.A O no hydrogen 2.942 N/A SER 910.A OG GLY 909.A O no hydrogen 2.791 N/A VAL 914.A N SER 849.A O no hydrogen 2.987 N/A LYS 916.A N ALA 913.A O no hydrogen 3.124 N/A LYS 916.A NZ THR 972.A OG1 no hydrogen 3.360 N/A VAL 918.A N GLU 915.A O no hydrogen 3.132 N/A HIS 919.A N GLU 915.A O no hydrogen 3.355 N/A ILE 920.A N LYS 916.A O no hydrogen 3.077 N/A ALA 921.A N ILE 917.A O no hydrogen 3.231 N/A ASN 922.A N VAL 918.A O no hydrogen 2.464 N/A ASP 923.A N HIS 919.A O no hydrogen 2.623 N/A LEU 924.A N ILE 920.A O no hydrogen 2.243 N/A PHE 925.A N ALA 921.A O no hydrogen 2.736 N/A LEU 926.A N ASN 922.A O no hydrogen 2.873 N/A GLN 927.A N ASP 923.A O no hydrogen 3.147 N/A GLU 928.A N LEU 924.A O no hydrogen 3.418 N/A LYS 930.A N LEU 926.A O no hydrogen 3.044 N/A LYS 930.A NZ ALA 934.A O no hydrogen 3.050 N/A LYS 930.A NZ ASP 935.A O no hydrogen 2.828 N/A THR 931.A N GLN 927.A O no hydrogen 2.954 N/A THR 931.A OG1 GLN 927.A O no hydrogen 3.215 N/A THR 931.A OG1 GLU 928.A O no hydrogen 2.468 N/A LEU 932.A N GLU 928.A O no hydrogen 2.941 N/A GLY 933.A N GLN 929.A O no hydrogen 2.920 N/A ALA 934.A N GLN 929.A O no hydrogen 2.636 N/A THR 937.A OG1 ASP 935.A OD2 no hydrogen 2.737 N/A LEU 939.A N ASP 935.A O no hydrogen 3.409 N/A ASP 942.A N ILE 947.A O no hydrogen 2.707 N/A ALA 944.A N ASP 942.A OD2 no hydrogen 3.335 N/A SER 945.A N ASP 942.A OD2 no hydrogen 2.904 N/A SER 945.A OG ASP 942.A OD2 no hydrogen 2.832 N/A SER 945.A OG TYR 952.A OH no hydrogen 3.056 N/A GLY 946.A N ASP 942.A O no hydrogen 3.292 N/A CYS 948.A N ASN 922.A OD1 no hydrogen 2.735 N/A CYS 948.A SG ASN 922.A OD1 no hydrogen 3.135 N/A THR 949.A N ALA 940.A O no hydrogen 2.823 N/A THR 949.A OG1 ALA 940.A O no hydrogen 2.826 N/A TYR 952.A N CYS 948.A O no hydrogen 3.247 N/A TYR 952.A OH SER 945.A OG no hydrogen 3.056 N/A ASP 953.A N THR 949.A O no hydrogen 3.126 N/A SER 954.A N LEU 951.A O no hydrogen 3.298 N/A SER 954.A OG LEU 950.A O no hydrogen 2.383 N/A THR 962.A N ALA 955.A O no hydrogen 2.782 N/A THR 962.A OG1 ALA 955.A O no hydrogen 3.068 N/A MET 963.A N PRO 956.A O no hydrogen 2.981 N/A THR 964.A N GLY 961.A O no hydrogen 3.275 N/A THR 964.A OG1 GLY 958.A O no hydrogen 2.614 N/A TYR 965.A N GLY 961.A O no hydrogen 3.312 N/A TYR 965.A OH GLU 928.A OE1 no hydrogen 2.880 N/A LEU 966.A N THR 962.A O no hydrogen 2.967 N/A SER 967.A N MET 963.A O no hydrogen 3.247 N/A SER 967.A OG MET 963.A O no hydrogen 2.539 N/A LYS 968.A N TYR 965.A O no hydrogen 3.199 N/A LYS 968.A NZ GLU 928.A OE1 no hydrogen 3.459 N/A ALA 969.A N TYR 965.A O no hydrogen 2.783 N/A ALA 970.A N LEU 966.A O no hydrogen 3.186 N/A GLN 975.A N THR 972.A O no hydrogen 3.174 N/A PHE 977.A N TYR 973.A O no hydrogen 3.374 N/A LEU 978.A N VAL 974.A O no hydrogen 2.786 N/A ALA 984.A N ILE 903.A O no hydrogen 2.741 N/A