Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jw0_b.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 TYR 1.A O no hydrogen 3.187 N/A CYS 4.A SG ALA 5.A O no hydrogen 3.976 N/A THR 6.A N THR 583.A O no hydrogen 2.806 N/A THR 6.A OG1 THR 583.A O no hydrogen 3.434 N/A THR 6.A OG1 VAL 585.A O no hydrogen 3.082 N/A ARG 8.A N ALA 5.A O no hydrogen 2.981 N/A TYR 9.A N THR 6.A O no hydrogen 3.236 N/A GLN 11.A N GLN 7.A O no hydrogen 2.884 N/A VAL 12.A N ARG 8.A O no hydrogen 2.941 N/A LEU 13.A N TYR 9.A O no hydrogen 2.768 N/A ASN 15.A N VAL 12.A O no hydrogen 2.840 N/A ASP 18.A N ASN 15.A O no hydrogen 2.919 N/A LEU 21.A N ASP 18.A O no hydrogen 2.812 N/A ASN 22.A N ILE 19.A O no hydrogen 2.794 N/A SER 24.A N ASN 22.A OD1 no hydrogen 3.215 N/A SER 24.A OG ASN 22.A OD1 no hydrogen 2.269 N/A LEU 25.A N SER 24.A OG no hydrogen 2.769 N/A ALA 30.A N SER 27.A O no hydrogen 3.033 N/A GLN 32.A N PRO 28.A O no hydrogen 2.938 N/A GLN 32.A NE2 LEU 138.A O no hydrogen 2.376 N/A ALA 33.A N GLN 29.A O no hydrogen 2.899 N/A LEU 34.A N ALA 30.A O no hydrogen 2.871 N/A SER 35.A N ILE 31.A O no hydrogen 2.947 N/A SER 35.A OG ILE 31.A O no hydrogen 3.285 N/A PHE 36.A N GLN 32.A O no hydrogen 2.888 N/A GLY 37.A N ALA 33.A O no hydrogen 2.902 N/A GLN 38.A N LEU 34.A O no hydrogen 2.894 N/A LEU 39.A N SER 35.A O no hydrogen 2.907 N/A SER 40.A N PHE 36.A O no hydrogen 2.898 N/A SER 40.A OG GLY 37.A O no hydrogen 2.343 N/A VAL 41.A N GLY 37.A O no hydrogen 2.940 N/A ILE 42.A N GLN 38.A O no hydrogen 2.910 N/A LEU 43.A N LEU 39.A O no hydrogen 2.876 N/A LEU 44.A N SER 40.A O no hydrogen 2.908 N/A TRP 45.A N VAL 41.A O no hydrogen 2.898 N/A LEU 46.A N ILE 42.A O no hydrogen 2.938 N/A ALA 47.A N LEU 43.A O no hydrogen 2.847 N/A ALA 48.A N LEU 44.A O no hydrogen 2.828 N/A TYR 49.A N TRP 45.A O no hydrogen 3.052 N/A THR 50.A N LEU 46.A O no hydrogen 2.917 N/A THR 50.A OG1 LEU 46.A O no hydrogen 2.856 N/A THR 50.A OG1 ALA 47.A O no hydrogen 2.999 N/A PHE 51.A N ALA 47.A O no hydrogen 2.805 N/A HIS 52.A N ALA 48.A O no hydrogen 2.971 N/A ILE 53.A N TYR 49.A O no hydrogen 2.925 N/A GLY 54.A N THR 50.A O no hydrogen 2.897 N/A TRP 55.A N PHE 51.A O no hydrogen 2.856 N/A SER 56.A N HIS 52.A O no hydrogen 3.351 N/A ASN 58.A N TYR 99.A OH no hydrogen 3.349 N/A ASN 58.A ND2 GLN 70.A O no hydrogen 2.855 N/A PHE 62.A N PHE 59.A O no hydrogen 2.939 N/A ILE 63.A N PHE 59.A O no hydrogen 2.912 N/A GLY 68.A N ASN 65.A O no hydrogen 3.217 N/A GLY 68.A N ASN 65.A OD1 no hydrogen 3.161 N/A VAL 69.A N ASN 65.A O no hydrogen 3.277 N/A ILE 72.A N ASN 58.A OD1 no hydrogen 3.231 N/A ASN 73.A N ALA 92.A O no hydrogen 2.595 N/A HIS 74.A N ALA 92.A O no hydrogen 3.196 N/A HIS 74.A ND1 ASN 73.A OD1 no hydrogen 2.425 N/A HIS 80.A N ASP 78.A OD1 no hydrogen 3.297 N/A HIS 80.A ND1 ASP 78.A OD1 no hydrogen 2.507 N/A TYR 81.A N ASP 78.A O no hydrogen 3.288 N/A GLN 83.A NE2 ASP 87.A OD1 no hydrogen 2.852 N/A TYR 84.A OH SER 525.A O no hydrogen 2.449 N/A TYR 84.A OH SER 525.A OG no hydrogen 2.665 N/A LYS 85.A N SER 82.A OG no hydrogen 3.177 N/A LYS 85.A NZ ASN 526.A O no hydrogen 3.115 N/A VAL 86.A N SER 82.A O no hydrogen 2.648 N/A ASP 87.A N GLN 83.A O no hydrogen 2.658 N/A THR 88.A N TYR 84.A O no hydrogen 2.472 N/A THR 88.A OG1 TYR 84.A O no hydrogen 3.201 N/A THR 89.A N LYS 85.A O no hydrogen 2.873 N/A ALA 92.A N HIS 74.A O no hydrogen 2.639 N/A TYR 99.A OH ILE 72.A O no hydrogen 2.220 N/A TRP 101.A N PRO 97.A O no hydrogen 2.935 N/A LEU 102.A N ILE 98.A O no hydrogen 2.865 N/A MET 103.A N TYR 99.A O no hydrogen 2.910 N/A THR 104.A N HIS 100.A O no hydrogen 2.899 N/A THR 104.A OG1 HIS 100.A O no hydrogen 2.524 N/A VAL 105.A N TRP 101.A O no hydrogen 2.928 N/A GLY 106.A N MET 103.A O no hydrogen 3.460 N/A PHE 107.A N LEU 102.A O no hydrogen 2.814 N/A THR 108.A N GLN 112.A OE1 no hydrogen 3.279 N/A THR 108.A OG1 GLN 112.A OE1 no hydrogen 2.897 N/A ASN 110.A N GLU 60.A OE2 no hydrogen 3.236 N/A ALA 111.A N SER 109.A OG no hydrogen 3.153 N/A ILE 113.A N SER 109.A O no hydrogen 3.423 N/A TYR 114.A N ASN 110.A O no hydrogen 2.884 N/A ARG 115.A N ALA 111.A O no hydrogen 2.931 N/A PHE 116.A N GLN 112.A O no hydrogen 2.880 N/A THR 117.A N ILE 113.A O no hydrogen 2.895 N/A THR 117.A OG1 TYR 114.A O no hydrogen 2.499 N/A LEU 118.A N TYR 114.A O no hydrogen 2.957 N/A GLY 119.A N ARG 115.A O no hydrogen 2.875 N/A LEU 120.A N PHE 116.A O no hydrogen 2.857 N/A GLU 121.A N THR 117.A O no hydrogen 2.936 N/A ILE 122.A N LEU 118.A O no hydrogen 2.904 N/A THR 123.A N GLY 119.A O no hydrogen 2.851 N/A THR 123.A OG1 GLY 119.A O no hydrogen 2.519 N/A ALA 124.A N LEU 120.A O no hydrogen 2.893 N/A ALA 125.A N GLU 121.A O no hydrogen 2.920 N/A VAL 126.A N ILE 122.A O no hydrogen 2.885 N/A MET 127.A N THR 123.A O no hydrogen 2.884 N/A LEU 128.A N ALA 124.A O no hydrogen 2.911 N/A VAL 129.A N ALA 125.A O no hydrogen 2.885 N/A LEU 130.A N VAL 126.A O no hydrogen 2.896 N/A SER 131.A N MET 127.A O no hydrogen 2.896 N/A SER 131.A OG ALA 33.A O no hydrogen 2.952 N/A LEU 132.A N LEU 128.A O no hydrogen 2.895 N/A LEU 132.A N VAL 129.A O no hydrogen 3.040 N/A ALA 133.A N LEU 130.A O no hydrogen 3.303 N/A LEU 138.A N SER 135.A OG no hydrogen 3.111 N/A LEU 139.A N SER 135.A O no hydrogen 3.248 N/A LEU 139.A N VAL 136.A O no hydrogen 3.139 N/A SER 140.A N GLY 137.A O no hydrogen 3.081 N/A SER 140.A OG GLY 137.A O no hydrogen 2.409 N/A MET 141.A N LEU 138.A O no hydrogen 3.054 N/A VAL 147.A N GLY 143.A O no hydrogen 3.107 N/A SER 148.A N LEU 144.A O no hydrogen 2.920 N/A SER 148.A OG LEU 144.A O no hydrogen 2.892 N/A SER 148.A OG GLU 145.A O no hydrogen 2.625 N/A TRP 149.A N GLU 145.A O no hydrogen 2.885 N/A ILE 150.A N VAL 146.A O no hydrogen 2.899 N/A SER 151.A N VAL 147.A O no hydrogen 2.920 N/A SER 151.A OG HIS 208.A O no hydrogen 2.746 N/A ILE 152.A N SER 148.A O no hydrogen 2.898 N/A CYS 153.A N TRP 149.A O no hydrogen 2.895 N/A CYS 153.A SG TRP 149.A O no hydrogen 3.165 N/A TRP 154.A N ILE 150.A O no hydrogen 2.902 N/A ALA 155.A N SER 151.A O no hydrogen 2.897 N/A GLY 156.A N ILE 152.A O no hydrogen 2.927 N/A HIS 157.A N CYS 153.A O no hydrogen 2.927 N/A LEU 158.A N TRP 154.A O no hydrogen 2.923 N/A VAL 159.A N ALA 155.A O no hydrogen 2.889 N/A ASN 160.A N GLY 156.A O no hydrogen 2.936 N/A PHE 161.A N HIS 157.A O no hydrogen 3.038 N/A PHE 161.A N LEU 158.A O no hydrogen 3.273 N/A ALA 162.A N VAL 159.A O no hydrogen 3.464 N/A ALA 165.A N ALA 162.A O no hydrogen 3.001 N/A LEU 168.A N ALA 165.A O no hydrogen 3.157 N/A THR 169.A N ASN 181.A OD1 no hydrogen 2.617 N/A GLU 174.A N ASN 170.A O no hydrogen 2.891 N/A ASN 181.A N SER 178.A O no hydrogen 3.159 N/A ASN 181.A ND2 THR 169.A O no hydrogen 3.301 N/A ASN 181.A ND2 PRO 176.A O no hydrogen 3.028 N/A MET 183.A N LEU 179.A O no hydrogen 2.875 N/A ASN 184.A N GLY 180.A O no hydrogen 2.940 N/A ASN 184.A N ASN 181.A O no hydrogen 3.279 N/A VAL 185.A N LEU 182.A O no hydrogen 2.997 N/A LEU 186.A N LEU 182.A O no hydrogen 2.701 N/A THR 187.A OG1 ASN 189.A OD1 no hydrogen 3.267 N/A THR 187.A OG1 ASP 203.A OD1 no hydrogen 2.340 N/A ASN 189.A N ASP 203.A OD1 no hydrogen 3.339 N/A GLY 190.A N ASP 203.A OD2 no hydrogen 3.321 N/A ILE 192.A N LEU 391.A O no hydrogen 2.455 N/A GLN 193.A N ALA 198.A O no hydrogen 3.219 N/A LEU 199.A N PRO 263.A O no hydrogen 2.672 N/A SER 202.A OG ASN 184.A O no hydrogen 3.347 N/A VAL 204.A N ALA 200.A O no hydrogen 3.053 N/A ALA 205.A N VAL 201.A O no hydrogen 2.918 N/A HIS 206.A N SER 202.A O no hydrogen 2.920 N/A HIS 206.A ND1 THR 187.A O no hydrogen 3.192 N/A HIS 207.A N ASP 203.A O no hydrogen 2.846 N/A HIS 207.A ND1 HIS 208.A ND1 no hydrogen 3.117 N/A HIS 208.A N VAL 204.A O no hydrogen 2.917 N/A HIS 208.A ND1 VAL 204.A O no hydrogen 2.616 N/A VAL 209.A N ALA 205.A O no hydrogen 2.975 N/A ALA 210.A N HIS 206.A O no hydrogen 2.983 N/A ILE 211.A N HIS 207.A O no hydrogen 2.836 N/A GLY 212.A N HIS 208.A O no hydrogen 2.873 N/A ILE 213.A N VAL 209.A O no hydrogen 2.996 N/A VAL 214.A N ALA 210.A O no hydrogen 2.917 N/A GLY 215.A N ILE 211.A O no hydrogen 2.804 N/A LEU 216.A N GLY 212.A O no hydrogen 2.924 N/A TRP 217.A N ILE 213.A O no hydrogen 3.000 N/A ILE 218.A N VAL 214.A O no hydrogen 2.826 N/A SER 219.A N GLY 215.A O no hydrogen 2.863 N/A SER 219.A OG GLY 215.A O no hydrogen 2.509 N/A ALA 220.A N LEU 216.A O no hydrogen 2.987 N/A LEU 221.A N TRP 217.A O no hydrogen 2.906 N/A LEU 222.A N ILE 218.A O no hydrogen 2.847 N/A ARG 223.A N SER 219.A O no hydrogen 2.926 N/A VAL 224.A N ALA 220.A O no hydrogen 2.946 N/A SER 225.A N LEU 221.A O no hydrogen 2.903 N/A SER 225.A OG LEU 221.A O no hydrogen 3.526 N/A SER 225.A OG LEU 222.A O no hydrogen 2.353 N/A LYS 226.A N LEU 222.A O no hydrogen 2.902 N/A TYR 227.A N VAL 224.A O no hydrogen 2.919 N/A GLN 234.A NE2 THR 306.A OG1 no hydrogen 3.417 N/A SER 236.A OG ASP 304.A OD2 no hydrogen 3.186 N/A HIS 238.A N SER 236.A OG no hydrogen 2.807 N/A HIS 238.A ND1 HIS 296.A ND1 no hydrogen 2.937 N/A LEU 239.A N SER 236.A OG no hydrogen 2.873 N/A ASP 240.A N SER 236.A O no hydrogen 3.204 N/A LEU 241.A N TYR 237.A O no hydrogen 2.951 N/A SER 242.A N HIS 238.A O no hydrogen 2.869 N/A SER 242.A OG GLY 293.A O no hydrogen 2.640 N/A LEU 243.A N LEU 239.A O no hydrogen 2.958 N/A SER 244.A N ASP 240.A O no hydrogen 2.899 N/A SER 244.A OG ASP 240.A O no hydrogen 2.998 N/A LEU 245.A N LEU 241.A O no hydrogen 2.849 N/A THR 246.A N SER 242.A O no hydrogen 2.900 N/A THR 246.A OG1 SER 242.A O no hydrogen 2.820 N/A THR 246.A OG1 LEU 243.A O no hydrogen 2.852 N/A VAL 247.A N LEU 243.A O no hydrogen 2.976 N/A GLY 248.A N SER 244.A O no hydrogen 2.842 N/A GLY 249.A N LEU 245.A O no hydrogen 2.847 N/A ILE 250.A N THR 246.A O no hydrogen 2.955 N/A LEU 251.A N VAL 247.A O no hydrogen 2.881 N/A THR 252.A N GLY 248.A O no hydrogen 2.833 N/A THR 252.A OG1 GLY 248.A O no hydrogen 2.491 N/A SER 253.A N GLY 249.A O no hydrogen 2.937 N/A SER 253.A OG GLY 249.A O no hydrogen 2.848 N/A LEU 254.A N ILE 250.A O no hydrogen 2.907 N/A LEU 255.A N LEU 251.A O no hydrogen 2.801 N/A ALA 256.A N THR 252.A O no hydrogen 2.929 N/A GLN 257.A N SER 253.A O no hydrogen 2.992 N/A GLN 258.A N LEU 254.A O no hydrogen 2.867 N/A ALA 259.A N LEU 255.A O no hydrogen 2.816 N/A TYR 260.A N ALA 256.A O no hydrogen 3.005 N/A VAL 261.A N GLN 257.A O no hydrogen 2.945 N/A TYR 262.A N GLN 258.A O no hydrogen 2.889 N/A SER 266.A N THR 104.A OG1 no hydrogen 3.035 N/A TYR 267.A N THR 196.A O no hydrogen 2.765 N/A LEU 268.A N LEU 265.A O no hydrogen 3.289 N/A TYR 270.A OH GLY 195.A O no hydrogen 3.379 N/A ASP 271.A N LEU 268.A O no hydrogen 2.873 N/A THR 274.A N ASP 271.A OD1 no hydrogen 3.438 N/A THR 274.A OG1 ASP 271.A O no hydrogen 3.110 N/A THR 275.A N ASP 271.A O no hydrogen 3.286 N/A THR 275.A OG1 ASP 271.A O no hydrogen 2.937 N/A THR 276.A N TYR 272.A O no hydrogen 2.952 N/A THR 276.A OG1 TYR 272.A O no hydrogen 3.086 N/A SER 277.A N LEU 273.A O no hydrogen 2.900 N/A SER 277.A OG ASN 95.A OD1 no hydrogen 2.902 N/A SER 277.A OG LEU 273.A O no hydrogen 3.021 N/A LEU 278.A N THR 274.A O no hydrogen 2.836 N/A TYR 279.A N THR 275.A O no hydrogen 2.994 N/A TYR 279.A OH GLN 257.A OE1 no hydrogen 2.321 N/A VAL 280.A N THR 276.A O no hydrogen 2.957 N/A HIS 281.A N SER 277.A O no hydrogen 2.858 N/A HIS 282.A N LEU 278.A O no hydrogen 2.937 N/A GLN 283.A N TYR 279.A O no hydrogen 2.935 N/A GLN 283.A NE2 TYR 279.A OH no hydrogen 2.799 N/A TYR 284.A N VAL 280.A O no hydrogen 2.940 N/A ILE 285.A N HIS 281.A O no hydrogen 2.932 N/A GLY 286.A N HIS 282.A O no hydrogen 2.873 N/A ALA 287.A N GLN 283.A O no hydrogen 2.924 N/A PHE 288.A N TYR 284.A O no hydrogen 2.908 N/A LEU 289.A N ILE 285.A O no hydrogen 2.894 N/A ALA 290.A N GLY 286.A O no hydrogen 2.938 N/A THR 291.A N ALA 287.A O no hydrogen 2.922 N/A THR 291.A OG1 ALA 287.A O no hydrogen 2.586 N/A GLY 292.A N PHE 288.A O no hydrogen 2.862 N/A GLY 293.A N LEU 289.A O no hydrogen 2.897 N/A PHE 294.A N ALA 290.A O no hydrogen 3.015 N/A VAL 295.A N THR 291.A O no hydrogen 2.862 N/A HIS 296.A N GLY 292.A O no hydrogen 2.875 N/A HIS 296.A ND1 HIS 238.A ND1 no hydrogen 2.937 N/A GLY 297.A N GLY 293.A O no hydrogen 2.931 N/A GLY 298.A N PHE 294.A O no hydrogen 2.933 N/A ILE 299.A N VAL 295.A O no hydrogen 2.890 N/A PHE 300.A N HIS 296.A O no hydrogen 2.884 N/A LEU 301.A N GLY 297.A O no hydrogen 2.957 N/A VAL 302.A N GLY 298.A O no hydrogen 2.863 N/A ARG 303.A N ILE 299.A O no hydrogen 2.955 N/A ARG 303.A NH1 ASP 18.A OD2 no hydrogen 3.203 N/A ARG 303.A NH2 ASP 18.A OD1 no hydrogen 2.634 N/A ARG 303.A NH2 ASP 18.A OD2 no hydrogen 3.212 N/A ARG 303.A NH2 HIS 238.A NE2 no hydrogen 3.284 N/A ASP 304.A N PHE 300.A O no hydrogen 2.957 N/A TYR 305.A OH SER 308.A OG no hydrogen 3.297 N/A TYR 305.A OH ASP 310.A OD1 no hydrogen 2.575 N/A SER 308.A N TYR 305.A OH no hydrogen 3.227 N/A SER 308.A OG TYR 305.A OH no hydrogen 3.297 N/A GLY 313.A N ASP 310.A OD1 no hydrogen 2.828 N/A LYS 314.A N ASP 310.A O no hydrogen 2.872 N/A LEU 315.A N LEU 311.A O no hydrogen 2.962 N/A LEU 316.A N VAL 312.A O no hydrogen 2.864 N/A ALA 317.A N GLY 313.A O no hydrogen 2.916 N/A THR 318.A N LYS 314.A O no hydrogen 3.409 N/A THR 318.A OG1 LYS 314.A O no hydrogen 3.071 N/A LYS 319.A N LEU 316.A O no hydrogen 3.188 N/A LYS 319.A NZ LEU 424.A O no hydrogen 2.901 N/A LYS 319.A NZ ASP 425.A OD1 no hydrogen 3.562 N/A LYS 319.A NZ GLY 428.A O no hydrogen 2.651 N/A VAL 322.A N THR 318.A O no hydrogen 3.259 N/A ILE 323.A N LYS 319.A O no hydrogen 2.925 N/A SER 324.A N ALA 320.A O no hydrogen 2.881 N/A SER 324.A OG ALA 320.A O no hydrogen 2.607 N/A THR 325.A N THR 321.A O no hydrogen 2.903 N/A THR 325.A OG1 THR 321.A O no hydrogen 2.571 N/A THR 325.A OG1 VAL 322.A O no hydrogen 2.988 N/A LEU 326.A N VAL 322.A O no hydrogen 2.928 N/A SER 327.A N ILE 323.A O no hydrogen 2.859 N/A TRP 328.A N SER 324.A O no hydrogen 2.891 N/A ILE 329.A N THR 325.A O no hydrogen 2.906 N/A THR 330.A N LEU 326.A O no hydrogen 2.909 N/A THR 330.A OG1 LEU 326.A O no hydrogen 3.079 N/A THR 330.A OG1 SER 327.A O no hydrogen 2.739 N/A LEU 331.A N SER 327.A O no hydrogen 2.858 N/A PHE 332.A N TRP 328.A O no hydrogen 2.887 N/A LEU 333.A N ILE 329.A O no hydrogen 2.902 N/A GLY 334.A N THR 330.A O no hydrogen 2.851 N/A PHE 335.A N LEU 331.A O no hydrogen 2.859 N/A HIS 336.A N PHE 332.A O no hydrogen 2.933 N/A ALA 337.A N LEU 333.A O no hydrogen 2.867 N/A THR 338.A N GLY 334.A O no hydrogen 2.896 N/A THR 338.A OG1 GLY 334.A O no hydrogen 2.457 N/A GLY 339.A N PHE 335.A O no hydrogen 2.842 N/A LEU 340.A N HIS 336.A O no hydrogen 2.862 N/A TYR 341.A N ALA 337.A O no hydrogen 2.927 N/A MET 342.A N THR 338.A O no hydrogen 2.856 N/A HIS 343.A N GLY 339.A O no hydrogen 2.837 N/A HIS 343.A NE2 LYS 355.A O no hydrogen 2.696 N/A ASN 344.A N LEU 340.A O no hydrogen 2.903 N/A ASN 344.A ND2 LEU 499.A O no hydrogen 2.638 N/A ASP 345.A N TYR 341.A O no hydrogen 2.862 N/A ALA 346.A N MET 342.A O no hydrogen 2.874 N/A MET 347.A N HIS 343.A O no hydrogen 2.899 N/A ALA 348.A N ASN 344.A O no hydrogen 2.884 N/A ALA 349.A N ASP 345.A O no hydrogen 2.861 N/A PHE 350.A N ALA 346.A O no hydrogen 2.825 N/A GLY 351.A N ALA 348.A O no hydrogen 3.312 N/A VAL 352.A N MET 347.A O no hydrogen 2.765 N/A GLN 354.A N GLN 354.A OE1 no hydrogen 2.759 N/A LYS 355.A N VAL 352.A O no hydrogen 3.219 N/A GLN 356.A N PRO 353.A O no hydrogen 3.491 N/A GLN 356.A NE2 ASN 344.A O no hydrogen 3.213 N/A ILE 357.A N ASN 344.A OD1 no hydrogen 3.120 N/A VAL 362.A N GLU 360.A O no hydrogen 2.586 N/A GLU 365.A N PRO 361.A O no hydrogen 2.919 N/A PHE 366.A N VAL 362.A O no hydrogen 2.837 N/A ILE 367.A N PHE 363.A O no hydrogen 2.935 N/A GLN 368.A N ALA 364.A O no hydrogen 2.855 N/A GLN 368.A NE2 PRO 395.A O no hydrogen 2.710 N/A GLN 369.A N GLU 365.A O no hydrogen 2.878 N/A GLN 369.A NE2 GLN 369.A O no hydrogen 3.274 N/A GLN 369.A NE2 THR 375.A O no hydrogen 2.952 N/A VAL 370.A N PHE 366.A O no hydrogen 2.913 N/A PHE 371.A N ILE 367.A O no hydrogen 2.875 N/A PHE 372.A N GLN 368.A O no hydrogen 2.892 N/A LEU 373.A N GLN 368.A O no hydrogen 2.708 N/A VAL 377.A N GLN 369.A OE1 no hydrogen 2.909 N/A TYR 378.A N GLN 369.A OE1 no hydrogen 3.195 N/A TYR 378.A OH GLN 368.A OE1 no hydrogen 3.050 N/A ALA 384.A N SER 382.A OG no hydrogen 3.303 N/A SER 386.A N GLY 374.A O no hydrogen 2.504 N/A SER 392.A OG VAL 261.A O no hydrogen 2.334 N/A PHE 393.A N VAL 261.A O no hydrogen 3.228 N/A PHE 393.A N SER 392.A OG no hydrogen 2.537 N/A ILE 397.A N TYR 378.A OH no hydrogen 3.154 N/A SER 398.A N ASP 401.A OD2 no hydrogen 3.352 N/A GLY 399.A N SER 398.A OG no hydrogen 2.696 N/A ASP 401.A N SER 398.A O no hydrogen 3.294 N/A PHE 402.A N GLY 399.A O no hydrogen 3.240 N/A VAL 404.A N GLY 400.A O no hydrogen 2.977 N/A HIS 405.A N ASP 401.A O no hydrogen 2.864 N/A HIS 405.A ND1 ASP 401.A O no hydrogen 2.426 N/A HIS 406.A N PHE 402.A O no hydrogen 2.962 N/A ALA 407.A N LEU 403.A O no hydrogen 2.900 N/A ILE 408.A N VAL 404.A O no hydrogen 2.887 N/A ALA 409.A N HIS 405.A O no hydrogen 2.863 N/A LEU 410.A N HIS 406.A O no hydrogen 2.876 N/A GLY 411.A N ALA 407.A O no hydrogen 2.902 N/A LEU 412.A N ILE 408.A O no hydrogen 2.901 N/A HIS 413.A N ALA 409.A O no hydrogen 2.868 N/A HIS 413.A ND1 ALA 409.A O no hydrogen 2.358 N/A THR 414.A N LEU 410.A O no hydrogen 2.871 N/A THR 414.A OG1 LEU 410.A O no hydrogen 2.501 N/A THR 415.A N GLY 411.A O no hydrogen 2.931 N/A THR 415.A OG1 GLY 411.A O no hydrogen 3.076 N/A VAL 416.A N LEU 412.A O no hydrogen 2.908 N/A LEU 417.A N HIS 413.A O no hydrogen 2.795 N/A VAL 418.A N THR 414.A O no hydrogen 2.923 N/A LEU 419.A N THR 415.A O no hydrogen 2.955 N/A ILE 420.A N VAL 416.A O no hydrogen 2.829 N/A LYS 421.A N LEU 417.A O no hydrogen 2.846 N/A GLY 422.A N VAL 418.A O no hydrogen 2.917 N/A ALA 423.A N LEU 419.A O no hydrogen 2.911 N/A LEU 424.A N ILE 420.A O no hydrogen 2.876 N/A ASP 425.A N LYS 421.A O no hydrogen 2.888 N/A SER 426.A N GLY 422.A O no hydrogen 2.898 N/A SER 426.A N ALA 423.A O no hydrogen 3.336 N/A SER 426.A OG ALA 423.A O no hydrogen 2.270 N/A GLN 427.A NE2 LEU 301.A O no hydrogen 2.846 N/A GLY 428.A N ASP 425.A O no hydrogen 2.759 N/A SER 429.A N PHE 432.A O no hydrogen 3.175 N/A PHE 432.A N SER 429.A O no hydrogen 3.056 N/A PHE 432.A N SER 429.A OG no hydrogen 3.267 N/A LYS 435.A NZ ASP 425.A O no hydrogen 3.450 N/A LYS 435.A NZ ILE 455.A O no hydrogen 2.788 N/A GLN 436.A NE2 GLN 427.A OE1 no hydrogen 2.712 N/A SER 437.A N ASP 434.A O no hydrogen 3.231 N/A SER 437.A OG ASP 434.A O no hydrogen 3.017 N/A PHE 438.A N LYS 435.A O no hydrogen 3.416 N/A PHE 442.A N SER 456.A OG no hydrogen 3.147 N/A ASP 445.A N THR 452.A OG1 no hydrogen 2.929 N/A ARG 449.A NE LEU 431.A O no hydrogen 2.754 N/A ARG 449.A NH1 ASP 445.A OD2 no hydrogen 2.676 N/A ARG 449.A NH2 LEU 431.A O no hydrogen 2.627 N/A ARG 449.A NH2 ASP 445.A OD2 no hydrogen 2.565 N/A GLY 451.A N GLY 448.A O no hydrogen 2.981 N/A THR 452.A OG1 GLY 446.A O no hydrogen 2.565 N/A SER 456.A N ASP 459.A OD2 no hydrogen 3.177 N/A TRP 458.A N TYR 440.A O no hydrogen 2.927 N/A TRP 458.A N SER 456.A OG no hydrogen 3.178 N/A SER 460.A N SER 456.A O no hydrogen 3.304 N/A SER 460.A N THR 457.A O no hydrogen 3.079 N/A SER 460.A OG THR 457.A O no hydrogen 2.288 N/A TYR 462.A N TRP 458.A O no hydrogen 2.913 N/A LEU 463.A N ASP 459.A O no hydrogen 2.879 N/A ALA 464.A N SER 460.A O no hydrogen 2.872 N/A PHE 465.A N PHE 461.A O no hydrogen 2.846 N/A VAL 468.A N ALA 464.A O no hydrogen 2.850 N/A ASN 469.A N PHE 465.A O no hydrogen 2.937 N/A ASN 470.A N PHE 466.A O no hydrogen 2.860 N/A THR 471.A N TRP 467.A O no hydrogen 2.863 N/A THR 471.A OG1 TRP 467.A O no hydrogen 2.619 N/A VAL 472.A N VAL 468.A O no hydrogen 2.966 N/A ALA 473.A N ASN 469.A O no hydrogen 2.839 N/A TRP 474.A N ASN 470.A O no hydrogen 2.877 N/A PHE 475.A N THR 471.A O no hydrogen 3.014 N/A THR 476.A N VAL 472.A O no hydrogen 2.841 N/A THR 476.A OG1 VAL 472.A O no hydrogen 2.235 N/A THR 476.A OG1 ALA 473.A O no hydrogen 3.066 N/A TYR 477.A N ALA 473.A O no hydrogen 2.841 N/A TYR 478.A N TRP 474.A O no hydrogen 2.969 N/A PHE 479.A N PHE 475.A O no hydrogen 2.886 N/A HIS 480.A N THR 476.A O no hydrogen 2.836 N/A HIS 480.A ND1 TYR 508.A OH no hydrogen 2.739 N/A TRP 481.A N TYR 477.A O no hydrogen 2.892 N/A LYS 482.A N TYR 478.A O no hydrogen 2.922 N/A LYS 482.A NZ ILE 396.A O no hydrogen 2.730 N/A VAL 483.A N PHE 479.A O no hydrogen 2.906 N/A LEU 484.A N HIS 480.A O no hydrogen 2.862 N/A SER 485.A N TRP 481.A O no hydrogen 2.899 N/A SER 485.A OG TRP 481.A O no hydrogen 3.054 N/A SER 485.A OG LYS 482.A O no hydrogen 2.551 N/A LEU 486.A N LYS 482.A O no hydrogen 2.932 N/A TRP 487.A N VAL 483.A O no hydrogen 2.864 N/A GLN 488.A N LEU 484.A O no hydrogen 2.843 N/A SER 489.A N LEU 486.A O no hydrogen 3.266 N/A THR 491.A OG1 SER 490.A O no hydrogen 2.620 N/A GLU 496.A N ALA 492.A O no hydrogen 3.079 N/A ASN 497.A N VAL 493.A O no hydrogen 2.876 N/A ASN 497.A ND2 VAL 493.A O no hydrogen 3.149 N/A SER 498.A N PHE 494.A O no hydrogen 2.894 N/A SER 498.A OG PHE 494.A O no hydrogen 2.508 N/A TYR 500.A OH ASN 497.A OD1 no hydrogen 2.620 N/A MET 502.A N ASP 345.A OD1 no hydrogen 3.173 N/A GLY 503.A N TYR 500.A O no hydrogen 2.976 N/A TRP 504.A NE1 SER 498.A O no hydrogen 2.964 N/A PHE 505.A N LEU 501.A O no hydrogen 2.950 N/A ARG 506.A N MET 502.A O no hydrogen 2.861 N/A ARG 506.A NE ASP 507.A OD1 no hydrogen 3.453 N/A ARG 506.A NH2 TYR 500.A OH no hydrogen 2.500 N/A ARG 506.A NH2 ASP 507.A OD2 no hydrogen 3.434 N/A ASP 507.A N GLY 503.A O no hydrogen 2.907 N/A TYR 508.A OH HIS 480.A ND1 no hydrogen 2.739 N/A LEU 509.A N PHE 505.A O no hydrogen 2.905 N/A TRP 510.A N PHE 505.A O no hydrogen 2.906 N/A ASN 512.A N TYR 508.A O no hydrogen 2.951 N/A CYS 513.A SG LEU 509.A O no hydrogen 3.234 N/A ALA 514.A N GLN 511.A O no hydrogen 3.507 N/A LEU 517.A N CYS 513.A O no hydrogen 3.151 N/A SER 518.A OG ALA 514.A O no hydrogen 3.392 N/A GLY 519.A N LEU 516.A O no hydrogen 3.058 N/A ASP 521.A N GLY 524.A O no hydrogen 2.769 N/A GLY 524.A N ASP 521.A OD1 no hydrogen 3.387 N/A SER 525.A N TYR 84.A OH no hydrogen 2.450 N/A SER 525.A OG TYR 84.A OH no hydrogen 2.665 N/A ASN 526.A N GLY 519.A O no hydrogen 2.906 N/A ASN 526.A ND2 SER 518.A O no hydrogen 3.674 N/A LEU 528.A N ASN 526.A OD1 no hydrogen 3.316 N/A ALA 529.A N ASN 526.A O no hydrogen 2.925 N/A ALA 532.A N LEU 528.A O no hydrogen 3.052 N/A TRP 533.A N ALA 529.A O no hydrogen 2.944 N/A ALA 534.A N VAL 530.A O no hydrogen 2.879 N/A PHE 535.A N TRP 531.A O no hydrogen 2.841 N/A LEU 536.A N ALA 532.A O no hydrogen 3.003 N/A LEU 537.A N TRP 533.A O no hydrogen 2.894 N/A ALA 538.A N ALA 534.A O no hydrogen 2.842 N/A HIS 539.A N PHE 535.A O no hydrogen 2.999 N/A HIS 539.A ND1 PHE 535.A O no hydrogen 2.473 N/A LEU 540.A N LEU 536.A O no hydrogen 2.939 N/A ALA 541.A N LEU 537.A O no hydrogen 2.922 N/A TRP 542.A N ALA 538.A O no hydrogen 2.892 N/A ALA 543.A N HIS 539.A O no hydrogen 2.957 N/A THR 544.A N LEU 540.A O no hydrogen 2.939 N/A THR 544.A OG1 LEU 540.A O no hydrogen 2.716 N/A GLY 545.A N ALA 541.A O no hydrogen 2.931 N/A PHE 546.A N TRP 542.A O no hydrogen 2.936 N/A MET 547.A N ALA 543.A O no hydrogen 2.948 N/A PHE 548.A N THR 544.A O no hydrogen 2.989 N/A LEU 549.A N GLY 545.A O no hydrogen 2.898 N/A LEU 549.A N PHE 546.A O no hydrogen 3.284 N/A ILE 550.A N PHE 546.A O no hydrogen 2.880 N/A SER 551.A N MET 547.A O no hydrogen 3.263 N/A SER 551.A OG MET 547.A O no hydrogen 2.639 N/A TRP 552.A NE1 LEU 549.A O no hydrogen 2.783 N/A ARG 553.A NE ALA 586.A O no hydrogen 3.079 N/A ARG 553.A NE LEU 587.A O no hydrogen 3.128 N/A ARG 553.A NH2 ALA 586.A O no hydrogen 2.811 N/A TRP 556.A NE1 SER 551.A OG no hydrogen 2.775 N/A GLN 557.A N ARG 553.A O no hydrogen 2.850 N/A GLN 557.A NE2 ASP 561.A OD2 no hydrogen 3.526 N/A GLU 558.A N GLY 554.A O no hydrogen 2.955 N/A LEU 559.A N TYR 555.A O no hydrogen 2.945 N/A ILE 560.A N TRP 556.A O no hydrogen 2.849 N/A ASP 561.A N GLN 557.A O no hydrogen 2.881 N/A THR 562.A N GLU 558.A O no hydrogen 2.964 N/A THR 562.A OG1 GLU 558.A O no hydrogen 3.047 N/A VAL 563.A N LEU 559.A O no hydrogen 2.917 N/A ILE 564.A N ILE 560.A O no hydrogen 2.844 N/A TYR 565.A N ASP 561.A O no hydrogen 2.917 N/A MET 566.A N THR 562.A O no hydrogen 2.938 N/A HIS 567.A N VAL 563.A O no hydrogen 2.940 N/A LEU 568.A N ILE 564.A O no hydrogen 2.871 N/A LYS 569.A N TYR 565.A O no hydrogen 2.909 N/A ALA 570.A N HIS 567.A O no hydrogen 3.153 N/A ILE 576.A N PHE 573.A O no hydrogen 3.066 N/A TRP 577.A N PHE 573.A O no hydrogen 2.859 N/A VAL 582.A N GLY 2.A O no hydrogen 3.191 N/A THR 583.A N CYS 4.A O no hydrogen 2.852 N/A THR 583.A OG1 ALA 579.A O no hydrogen 2.562 N/A VAL 585.A N THR 6.A OG1 no hydrogen 3.038 N/A ALA 586.A N GLN 557.A OE1 no hydrogen 2.753 N/A SER 588.A N GLN 591.A OE1 no hydrogen 2.855 N/A GLN 591.A NE2 GLN 7.A O no hydrogen 3.505 N/A ALA 592.A N SER 588.A O no hydrogen 2.662 N/A ARG 593.A N ILE 589.A O no hydrogen 2.913 N/A ARG 593.A NE ASP 459.A OD1 no hydrogen 2.955 N/A ARG 593.A NH2 ALA 443.A O no hydrogen 2.560 N/A PHE 594.A N VAL 590.A O no hydrogen 2.922 N/A ILE 595.A N GLN 591.A O no hydrogen 2.886 N/A GLY 596.A N ALA 592.A O no hydrogen 2.893 N/A LEU 597.A N ARG 593.A O no hydrogen 2.920 N/A ALA 598.A N PHE 594.A O no hydrogen 2.821 N/A HIS 599.A N ILE 595.A O no hydrogen 2.917 N/A TYR 600.A N GLY 596.A O no hydrogen 2.895 N/A VAL 601.A N LEU 597.A O no hydrogen 2.889 N/A ALA 602.A N ALA 598.A O no hydrogen 2.854 N/A GLY 603.A N HIS 599.A O no hydrogen 2.907 N/A PHE 604.A N TYR 600.A O no hydrogen 2.875 N/A ILE 605.A N VAL 601.A O no hydrogen 2.857 N/A LEU 606.A N ALA 602.A O no hydrogen 2.933 N/A THR 607.A N GLY 603.A O no hydrogen 2.833 N/A THR 607.A OG1 GLY 603.A O no hydrogen 2.272 N/A TYR 608.A N PHE 604.A O no hydrogen 2.989 N/A TYR 608.A OH THR 476.A O no hydrogen 2.885 N/A TYR 608.A OH TYR 508.A OH no hydrogen 3.105 N/A LEU 609.A N ILE 605.A O no hydrogen 2.874 N/A ALA 610.A N LEU 606.A O no hydrogen 2.906 N/A PHE 611.A N THR 607.A O no hydrogen 2.905 N/A VAL 612.A N TYR 608.A O no hydrogen 2.854 N/A VAL 613.A N LEU 609.A O no hydrogen 2.940 N/A GLY 614.A N ALA 610.A O no hydrogen 2.894 N/A ALA 615.A N PHE 611.A O no hydrogen 2.871 N/A THR 616.A N VAL 612.A O no hydrogen 2.912 N/A THR 616.A OG1 VAL 612.A O no hydrogen 2.389 N/A