Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4p00_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N VAL 1.A O no hydrogen 3.059 N/A LEU 6.A N VAL 2.A O no hydrogen 2.751 N/A PHE 7.A N PRO 3.A O no hydrogen 2.909 N/A LEU 8.A N VAL 4.A O no hydrogen 2.816 N/A LEU 9.A N LEU 5.A O no hydrogen 3.012 N/A TRP 10.A N LEU 6.A O no hydrogen 2.924 N/A VAL 11.A N PHE 7.A O no hydrogen 2.829 N/A ALA 12.A N LEU 8.A O no hydrogen 2.794 N/A LEU 13.A N LEU 9.A O no hydrogen 3.093 N/A LEU 14.A N VAL 11.A O no hydrogen 3.128 N/A VAL 15.A N ALA 12.A O no hydrogen 3.424 N/A GLY 18.A N VAL 15.A O no hydrogen 3.142 N/A LEU 19.A N VAL 15.A O no hydrogen 3.284 N/A LEU 20.A N PRO 16.A O no hydrogen 3.191 N/A ALA 21.A N PHE 17.A O no hydrogen 3.204 N/A ALA 22.A N GLY 18.A O no hydrogen 2.854 N/A ALA 23.A N LEU 19.A O no hydrogen 2.948 N/A ALA 29.A N ALA 26.A O no hydrogen 2.683 N/A GLN 30.A N ALA 26.A O no hydrogen 3.195 N/A GLN 30.A NE2 ALA 438.A O no hydrogen 3.371 N/A GLY 31.A N PRO 27.A O no hydrogen 2.922 N/A LEU 32.A N ALA 29.A O no hydrogen 3.076 N/A ILE 33.A N ALA 29.A O no hydrogen 3.259 N/A ALA 34.A N GLN 30.A O no hydrogen 2.884 N/A LEU 35.A N GLY 31.A O no hydrogen 2.816 N/A SER 36.A N LEU 32.A O no hydrogen 2.911 N/A SER 36.A OG LEU 32.A O no hydrogen 2.927 N/A ALA 37.A N ILE 33.A O no hydrogen 3.013 N/A VAL 38.A N ALA 34.A O no hydrogen 2.977 N/A VAL 39.A N LEU 35.A O no hydrogen 2.996 N/A LEU 40.A N SER 36.A O no hydrogen 2.931 N/A VAL 41.A N ALA 37.A O no hydrogen 2.962 N/A ALA 42.A N VAL 38.A O no hydrogen 2.931 N/A LEU 43.A N VAL 39.A O no hydrogen 2.956 N/A LEU 44.A N LEU 40.A O no hydrogen 2.900 N/A LYS 45.A NZ ASN 452.A OD1 no hydrogen 2.895 N/A PHE 47.A N LEU 44.A O no hydrogen 3.186 N/A ALA 48.A N LYS 45.A O no hydrogen 3.090 N/A LYS 50.A N PHE 47.A O no hydrogen 2.920 N/A ARG 54.A N LYS 50.A O no hydrogen 3.228 N/A ARG 54.A NE ALA 48.A O no hydrogen 2.969 N/A ARG 54.A NH2 ASP 49.A O no hydrogen 2.647 N/A PHE 55.A N MET 51.A O no hydrogen 2.808 N/A LEU 56.A N VAL 52.A O no hydrogen 2.960 N/A LEU 57.A N PRO 53.A O no hydrogen 3.020 N/A LEU 58.A N ARG 54.A O no hydrogen 2.973 N/A SER 59.A N PHE 55.A O no hydrogen 3.106 N/A SER 59.A OG PHE 55.A O no hydrogen 2.881 N/A SER 59.A OG LEU 56.A O no hydrogen 2.799 N/A ALA 60.A N LEU 56.A O no hydrogen 2.977 N/A ALA 61.A N LEU 57.A O no hydrogen 2.885 N/A SER 62.A N LEU 58.A O no hydrogen 2.817 N/A SER 62.A OG SER 59.A O no hydrogen 2.596 N/A MET 63.A N SER 59.A O no hydrogen 3.061 N/A VAL 65.A N ALA 61.A O no hydrogen 3.082 N/A MET 66.A N SER 62.A O no hydrogen 3.103 N/A ARG 67.A N MET 63.A O no hydrogen 3.293 N/A ARG 67.A NE LEU 20.A O no hydrogen 3.411 N/A ARG 67.A NH1 GLN 30.A OE1 no hydrogen 2.321 N/A ARG 67.A NH1 TYR 439.A OH no hydrogen 3.424 N/A TYR 68.A N LEU 64.A O no hydrogen 3.040 N/A TYR 68.A OH GLU 96.A OE1 no hydrogen 3.080 N/A TYR 68.A OH GLU 96.A OE2 no hydrogen 2.790 N/A TRP 69.A N VAL 65.A O no hydrogen 3.065 N/A TRP 69.A NE1 THR 97.A OG1 no hydrogen 2.983 N/A PHE 70.A N MET 66.A O no hydrogen 3.078 N/A TRP 71.A N ARG 67.A O no hydrogen 3.040 N/A ARG 72.A N TYR 68.A O no hydrogen 2.888 N/A ARG 72.A NE THR 76.A OG1 no hydrogen 3.363 N/A ARG 72.A NH1 GLU 96.A OE1 no hydrogen 2.420 N/A LEU 73.A N TRP 69.A O no hydrogen 2.757 N/A PHE 74.A N PHE 70.A O no hydrogen 2.918 N/A GLU 75.A N TRP 71.A O no hydrogen 2.957 N/A THR 76.A OG1 ARG 72.A O no hydrogen 2.686 N/A ASP 83.A N ALA 81.A O no hydrogen 3.034 N/A SER 85.A OG GLU 427.A O no hydrogen 2.462 N/A PHE 86.A N ASP 83.A OD1 no hydrogen 3.437 N/A LEU 87.A N ASP 83.A O no hydrogen 3.243 N/A PHE 88.A N ALA 84.A O no hydrogen 3.173 N/A ALA 89.A N SER 85.A O no hydrogen 3.029 N/A LEU 90.A N PHE 86.A O no hydrogen 2.989 N/A LEU 91.A N LEU 87.A O no hydrogen 2.965 N/A LEU 92.A N PHE 88.A O no hydrogen 2.988 N/A PHE 93.A N ALA 89.A O no hydrogen 3.045 N/A ALA 94.A N LEU 90.A O no hydrogen 2.976 N/A VAL 95.A N LEU 91.A O no hydrogen 2.949 N/A GLU 96.A N LEU 92.A O no hydrogen 3.006 N/A THR 97.A N PHE 93.A O no hydrogen 2.824 N/A THR 97.A OG1 PHE 93.A O no hydrogen 2.618 N/A PHE 98.A N ALA 94.A O no hydrogen 2.956 N/A SER 99.A N VAL 95.A O no hydrogen 2.882 N/A SER 99.A OG VAL 95.A O no hydrogen 3.071 N/A ILE 100.A N GLU 96.A O no hydrogen 2.753 N/A SER 101.A N THR 97.A O no hydrogen 2.974 N/A SER 101.A OG THR 97.A O no hydrogen 2.649 N/A ILE 102.A N PHE 98.A O no hydrogen 2.940 N/A PHE 103.A N SER 99.A O no hydrogen 2.902 N/A PHE 104.A N ILE 100.A O no hydrogen 2.953 N/A LEU 105.A N SER 101.A O no hydrogen 2.847 N/A ASN 106.A N ILE 102.A O no hydrogen 2.735 N/A GLY 107.A N PHE 103.A O no hydrogen 3.004 N/A PHE 108.A N PHE 104.A O no hydrogen 2.876 N/A LEU 109.A N LEU 105.A O no hydrogen 2.963 N/A SER 110.A N ASN 106.A O no hydrogen 3.207 N/A SER 110.A OG ASN 106.A O no hydrogen 3.381 N/A THR 114.A N ARG 295.A O no hydrogen 3.230 N/A THR 114.A OG1 ARG 295.A O no hydrogen 3.403 N/A THR 114.A OG1 ASP 298.A OD2 no hydrogen 3.174 N/A ARG 116.A NE ASP 298.A OD2 no hydrogen 2.996 N/A ARG 116.A NH2 ASP 298.A OD1 no hydrogen 3.275 N/A ARG 116.A NH2 ASP 298.A OD2 no hydrogen 3.225 N/A ARG 120.A N GLU 253.A OE2 no hydrogen 3.227 N/A GLN 123.A N GLU 126.A OE2 no hydrogen 3.091 N/A GLU 126.A N GLN 123.A O no hydrogen 2.747 N/A VAL 130.A N LEU 160.A O no hydrogen 2.961 N/A ASP 131.A N LEU 229.A O no hydrogen 2.879 N/A ILE 132.A N THR 162.A O no hydrogen 2.717 N/A LEU 133.A N VAL 231.A O no hydrogen 2.736 N/A VAL 134.A N VAL 164.A O no hydrogen 3.165 N/A SER 136.A N CYS 166.A O no hydrogen 2.796 N/A SER 136.A OG GLU 139.A OE1 no hydrogen 3.056 N/A TYR 137.A N GLU 139.A OE1 no hydrogen 2.598 N/A ASN 138.A N GLU 139.A OE1 no hydrogen 2.882 N/A GLU 139.A N GLU 139.A OE1 no hydrogen 2.646 N/A ASP 142.A N ASP 142.A OD1 no hydrogen 2.550 N/A MET 143.A N PRO 140.A O no hydrogen 3.230 N/A LEU 144.A N PRO 140.A O no hydrogen 3.159 N/A SER 145.A N ALA 141.A O no hydrogen 2.785 N/A SER 145.A OG ALA 141.A O no hydrogen 3.121 N/A SER 145.A OG ASP 142.A O no hydrogen 2.858 N/A THR 147.A N MET 143.A O no hydrogen 3.145 N/A THR 147.A OG1 MET 143.A O no hydrogen 3.208 N/A THR 147.A OG1 ALA 235.A O no hydrogen 2.663 N/A LEU 148.A N LEU 144.A O no hydrogen 2.846 N/A ALA 149.A N SER 145.A O no hydrogen 3.079 N/A ALA 150.A N VAL 146.A O no hydrogen 3.068 N/A ALA 151.A N THR 147.A O no hydrogen 3.017 N/A LYS 152.A N LEU 148.A O no hydrogen 2.880 N/A LYS 152.A NZ LEU 200.A O no hydrogen 3.085 N/A ASN 153.A N ALA 149.A O no hydrogen 2.899 N/A MET 154.A N ALA 151.A O no hydrogen 3.498 N/A ILE 155.A N ARG 241.A O no hydrogen 3.048 N/A TYR 156.A OH PRO 128.A O no hydrogen 2.754 N/A LEU 160.A N PRO 157.A O no hydrogen 3.110 N/A ARG 161.A N PRO 157.A O no hydrogen 3.101 N/A THR 162.A N VAL 130.A O no hydrogen 2.980 N/A VAL 164.A N ILE 132.A O no hydrogen 2.753 N/A LEU 165.A N VAL 203.A O no hydrogen 2.649 N/A CYS 166.A N VAL 134.A O no hydrogen 2.958 N/A CYS 166.A SG VAL 164.A O no hydrogen 3.905 N/A ASP 167.A N SER 205.A O no hydrogen 2.957 N/A ASP 168.A N SER 136.A O no hydrogen 2.803 N/A GLY 170.A N ASP 167.A OD1 no hydrogen 2.957 N/A THR 171.A OG1 ASP 168.A O no hydrogen 2.697 N/A ASP 172.A N ARG 207.A O no hydrogen 3.470 N/A ARG 174.A NE GLY 169.A O no hydrogen 3.522 N/A CYS 175.A N THR 171.A O no hydrogen 2.591 N/A CYS 175.A SG THR 171.A O no hydrogen 3.241 N/A MET 176.A N GLN 173.A O no hydrogen 3.290 N/A SER 177.A OG ARG 174.A O no hydrogen 3.038 N/A SER 177.A OG ASP 179.A O no hydrogen 3.393 N/A GLU 181.A N ASP 179.A OD1 no hydrogen 3.190 N/A ALA 183.A N ASP 179.A O no hydrogen 3.078 N/A GLN 184.A N PRO 180.A O no hydrogen 2.936 N/A LYS 185.A N GLU 181.A O no hydrogen 3.138 N/A ALA 186.A N LEU 182.A O no hydrogen 3.011 N/A GLN 187.A N ALA 183.A O no hydrogen 3.116 N/A GLU 188.A N GLN 184.A O no hydrogen 3.022 N/A ARG 189.A N LYS 185.A O no hydrogen 3.043 N/A ARG 189.A NH1 ASP 167.A OD1 no hydrogen 2.840 N/A ARG 189.A NH1 ASP 167.A OD2 no hydrogen 3.382 N/A ARG 189.A NH2 SER 136.A OG no hydrogen 3.409 N/A ARG 190.A N ALA 186.A O no hydrogen 2.806 N/A ARG 190.A NH1 ASP 172.A OD1 no hydrogen 3.182 N/A ARG 191.A N GLN 187.A O no hydrogen 2.813 N/A ARG 191.A NH1 ARG 191.A O no hydrogen 3.496 N/A GLU 192.A N GLU 188.A O no hydrogen 3.065 N/A LEU 193.A N ARG 189.A O no hydrogen 2.983 N/A GLN 194.A N ARG 190.A O no hydrogen 3.023 N/A GLN 195.A N ARG 191.A O no hydrogen 2.918 N/A LEU 196.A N GLU 192.A O no hydrogen 2.976 N/A CYS 197.A N LEU 193.A O no hydrogen 2.802 N/A CYS 197.A SG LEU 193.A O no hydrogen 3.189 N/A ARG 198.A N GLN 194.A O no hydrogen 2.978 N/A GLU 199.A N GLN 195.A O no hydrogen 2.928 N/A LEU 200.A N LEU 196.A O no hydrogen 2.886 N/A VAL 202.A N CYS 197.A O no hydrogen 2.785 N/A VAL 203.A N VAL 163.A O no hydrogen 3.083 N/A TYR 204.A OH ASP 167.A OD2 no hydrogen 2.938 N/A SER 205.A N LEU 165.A O no hydrogen 2.801 N/A THR 206.A OG1 GLY 170.A O no hydrogen 2.678 N/A THR 206.A OG1 ARG 207.A O no hydrogen 3.549 N/A ARG 207.A N THR 206.A OG1 no hydrogen 2.541 N/A ARG 207.A NH2 GLU 211.A O no hydrogen 2.642 N/A ARG 209.A NE GLU 211.A OE2 no hydrogen 3.268 N/A ARG 209.A NH1 GLU 208.A OE1 no hydrogen 3.202 N/A ASN 210.A N GLN 173.A OE1 no hydrogen 2.521 N/A ASN 210.A ND2 ASP 168.A O no hydrogen 3.389 N/A ASN 210.A ND2 THR 171.A OG1 no hydrogen 3.202 N/A LYS 214.A NZ ASP 234.A OD1 no hydrogen 2.800 N/A LYS 214.A NZ GLY 307.A O no hydrogen 2.502 N/A LYS 214.A NZ GLU 330.A OE2 no hydrogen 3.546 N/A GLY 216.A N HIS 212.A O no hydrogen 3.427 N/A ASN 217.A N ALA 213.A O no hydrogen 3.277 N/A ASN 217.A ND2 CYS 166.A O no hydrogen 3.260 N/A MET 218.A N LYS 214.A O no hydrogen 3.178 N/A SER 219.A N ALA 215.A O no hydrogen 3.116 N/A SER 219.A OG ALA 215.A O no hydrogen 2.877 N/A ALA 220.A N GLY 216.A O no hydrogen 3.063 N/A ALA 221.A N ASN 217.A O no hydrogen 2.988 N/A LEU 222.A N MET 218.A O no hydrogen 2.780 N/A GLU 223.A N ALA 220.A O no hydrogen 3.395 N/A ARG 224.A N ALA 221.A O no hydrogen 3.385 N/A ARG 224.A NH2 SER 205.A OG no hydrogen 3.274 N/A LEU 225.A N LEU 222.A O no hydrogen 3.262 N/A GLY 227.A N ASP 131.A OD2 no hydrogen 2.907 N/A GLU 228.A N THR 129.A OG1 no hydrogen 2.892 N/A LEU 229.A N THR 129.A O no hydrogen 3.032 N/A VAL 230.A N LEU 312.A O no hydrogen 2.864 N/A VAL 231.A N ASP 131.A O no hydrogen 2.715 N/A VAL 232.A N ALA 310.A O no hydrogen 2.959 N/A PHE 233.A N LEU 133.A O no hydrogen 3.019 N/A ASP 234.A N SER 308.A OG no hydrogen 2.852 N/A ASP 236.A N ASP 236.A OD1 no hydrogen 2.573 N/A HIS 237.A N ASP 234.A O no hydrogen 2.889 N/A VAL 238.A N ALA 354.A O no hydrogen 3.397 N/A SER 240.A N MET 352.A O no hydrogen 2.667 N/A SER 240.A OG ASP 242.A OD1 no hydrogen 2.749 N/A SER 240.A OG GLY 679.A O no hydrogen 2.477 N/A SER 240.A OG SER 681.A OG no hydrogen 2.935 N/A ARG 241.A N GLY 679.A O no hydrogen 3.227 N/A ARG 241.A NE ASN 153.A O no hydrogen 2.751 N/A PHE 243.A N SER 240.A O no hydrogen 3.351 N/A ARG 246.A N PHE 243.A O no hydrogen 3.387 N/A THR 247.A N LEU 244.A O no hydrogen 3.202 N/A THR 247.A OG1 PHE 243.A O no hydrogen 2.414 N/A VAL 248.A N LEU 244.A O no hydrogen 3.198 N/A TYR 250.A N THR 247.A O no hydrogen 3.258 N/A TYR 250.A OH PRO 117.A O no hydrogen 2.599 N/A PHE 251.A N VAL 248.A O no hydrogen 3.259 N/A ASP 254.A N PHE 251.A O no hydrogen 3.366 N/A ASP 256.A N ASP 254.A OD1 no hydrogen 3.419 N/A LEU 257.A N ASP 254.A O no hydrogen 3.303 N/A PHE 258.A N LYS 344.A O no hydrogen 2.988 N/A VAL 260.A N VAL 311.A O no hydrogen 3.272 N/A GLN 261.A N LEU 346.A O no hydrogen 3.157 N/A GLN 261.A NE2 THR 262.A O no hydrogen 2.870 N/A GLN 261.A NE2 SER 308.A O no hydrogen 3.047 N/A THR 262.A N ALA 309.A O no hydrogen 3.243 N/A THR 262.A OG1 ALA 309.A O no hydrogen 2.208 N/A HIS 264.A NE2 SER 308.A O no hydrogen 3.104 N/A ILE 267.A N GLY 355.A O no hydrogen 3.450 N/A ASN 268.A ND2 GLN 357.A O no hydrogen 2.609 N/A ASN 268.A ND2 GLU 359.A OE1 no hydrogen 3.158 N/A GLN 273.A N ASP 270.A OD1 no hydrogen 2.714 N/A GLN 273.A NE2 GLY 279.A O no hydrogen 3.570 N/A ARG 274.A N ASP 270.A O no hydrogen 2.979 N/A ARG 274.A NH1 GLU 359.A O no hydrogen 3.234 N/A ARG 274.A NH2 ASN 275.A OD1 no hydrogen 3.342 N/A ARG 274.A NH2 GLU 359.A O no hydrogen 2.921 N/A ASN 275.A N PRO 271.A O no hydrogen 2.933 N/A ASN 275.A ND2 ALA 560.A O no hydrogen 2.919 N/A ASN 275.A ND2 GLU 563.A OE1 no hydrogen 3.161 N/A LEU 276.A N ILE 272.A O no hydrogen 3.067 N/A ALA 277.A N ARG 274.A O no hydrogen 3.102 N/A LEU 278.A N GLN 273.A O no hydrogen 3.187 N/A CYS 282.A SG PRO 283.A O no hydrogen 3.646 N/A GLU 287.A N PRO 284.A O no hydrogen 3.397 N/A TYR 290.A N ASN 286.A O no hydrogen 3.107 N/A LYS 292.A N MET 288.A O no hydrogen 3.384 N/A ILE 293.A N MET 288.A O no hydrogen 3.248 N/A HIS 294.A N PHE 289.A O no hydrogen 2.725 N/A HIS 294.A ND1 HIS 294.A O no hydrogen 2.763 N/A GLY 296.A N LYS 292.A O no hydrogen 3.229 N/A LEU 297.A N ILE 293.A O no hydrogen 2.711 N/A ASP 298.A N HIS 294.A O no hydrogen 2.873 N/A ARG 299.A N ARG 295.A O no hydrogen 3.141 N/A ARG 299.A NE ASP 112.A OD2 no hydrogen 3.156 N/A ARG 299.A NH1 ARG 299.A O no hydrogen 2.884 N/A TRP 300.A N LEU 297.A O no hydrogen 3.434 N/A GLY 301.A N ASP 298.A O no hydrogen 2.978 N/A GLY 302.A N LEU 297.A O no hydrogen 2.897 N/A CYS 306.A N GLN 261.A OE1 no hydrogen 2.789 N/A CYS 306.A SG TYR 290.A OH no hydrogen 3.777 N/A CYS 306.A SG HIS 294.A NE2 no hydrogen 3.831 N/A CYS 306.A SG PHE 304.A O no hydrogen 3.719 N/A SER 308.A OG HIS 237.A ND1 no hydrogen 2.782 N/A ALA 309.A N VAL 232.A O no hydrogen 2.763 N/A VAL 311.A N VAL 260.A O no hydrogen 3.253 N/A LEU 312.A N VAL 230.A O no hydrogen 2.848 N/A ARG 313.A N PHE 258.A O no hydrogen 3.130 N/A ARG 313.A NE LEU 257.A O no hydrogen 3.085 N/A ARG 313.A NH1 PHE 251.A O no hydrogen 3.222 N/A ARG 313.A NH1 LEU 257.A O no hydrogen 3.368 N/A ARG 314.A N GLU 228.A O no hydrogen 2.922 N/A ARG 314.A NE ASP 318.A OD1 no hydrogen 2.743 N/A ARG 314.A NH1 LEU 222.A O no hydrogen 3.162 N/A ARG 314.A NH1 LEU 225.A O no hydrogen 3.248 N/A ARG 314.A NH2 LEU 222.A O no hydrogen 2.773 N/A LEU 317.A N ARG 313.A O no hydrogen 3.025 N/A ASP 318.A N ARG 314.A O no hydrogen 2.778 N/A GLU 319.A N ARG 315.A O no hydrogen 2.869 N/A ALA 320.A N LEU 317.A O no hydrogen 3.349 N/A GLY 322.A N LEU 317.A O no hydrogen 2.903 N/A ALA 324.A N THR 334.A OG1 no hydrogen 3.119 N/A GLU 326.A N GLU 333.A OE2 no hydrogen 2.818 N/A THR 327.A N GLU 333.A OE2 no hydrogen 3.280 N/A THR 327.A OG1 GLY 374.A O no hydrogen 3.252 N/A THR 327.A OG1 GLN 377.A OE1 no hydrogen 2.580 N/A ILE 328.A N THR 327.A OG1 no hydrogen 2.583 N/A THR 329.A OG1 ASP 331.A OD1 no hydrogen 2.525 N/A GLU 330.A N GLU 330.A OE1 no hydrogen 2.704 N/A ASP 331.A N ASP 331.A OD1 no hydrogen 2.377 N/A GLU 333.A N THR 329.A O no hydrogen 3.297 N/A THR 334.A N GLU 330.A O no hydrogen 3.040 N/A THR 334.A OG1 GLU 330.A O no hydrogen 2.538 N/A ALA 335.A N ASP 331.A O no hydrogen 2.951 N/A LEU 336.A N ALA 332.A O no hydrogen 2.977 N/A GLU 337.A N GLU 333.A O no hydrogen 2.850 N/A ILE 338.A N THR 334.A O no hydrogen 2.991 N/A HIS 339.A N ALA 335.A O no hydrogen 2.825 N/A HIS 339.A ND1 ALA 335.A O no hydrogen 2.557 N/A HIS 339.A NE2 SER 345.A OG no hydrogen 2.759 N/A SER 340.A N LEU 336.A O no hydrogen 3.240 N/A SER 340.A OG LEU 336.A O no hydrogen 3.211 N/A SER 340.A OG GLU 337.A O no hydrogen 2.724 N/A ARG 341.A N ILE 338.A O no hydrogen 2.992 N/A GLY 342.A N HIS 339.A O no hydrogen 3.348 N/A LYS 344.A N ASP 256.A O no hydrogen 2.791 N/A LYS 344.A NZ ASP 254.A OD1 no hydrogen 3.423 N/A LYS 344.A NZ ASP 254.A OD2 no hydrogen 2.897 N/A SER 345.A OG ALA 303.A O no hydrogen 2.460 N/A SER 345.A OG HIS 339.A NE2 no hydrogen 2.759 N/A LEU 346.A N LEU 259.A O no hydrogen 3.172 N/A TYR 347.A N ASP 298.A OD2 no hydrogen 3.125 N/A TYR 347.A OH TYR 290.A O no hydrogen 2.570 N/A ILE 348.A N GLN 261.A O no hydrogen 3.187 N/A GLY 355.A N PHE 265.A O no hydrogen 2.588 N/A LEU 356.A N ASP 236.A OD2 no hydrogen 2.878 N/A GLN 357.A N ASN 268.A OD1 no hydrogen 2.689 N/A THR 360.A OG1 GLU 498.A OE1 no hydrogen 3.521 N/A PHE 361.A N GLU 563.A OE2 no hydrogen 2.688 N/A SER 363.A N THR 360.A OG1 no hydrogen 3.241 N/A PHE 364.A N THR 360.A O no hydrogen 3.132 N/A ILE 365.A N PHE 361.A O no hydrogen 2.996 N/A GLN 366.A N ALA 362.A O no hydrogen 2.992 N/A GLN 367.A N SER 363.A O no hydrogen 2.911 N/A ARG 368.A N PHE 364.A O no hydrogen 2.921 N/A ARG 368.A NH2 GLU 285.A OE2 no hydrogen 3.040 N/A GLY 369.A N ILE 365.A O no hydrogen 2.706 N/A ARG 370.A N GLN 366.A O no hydrogen 3.124 N/A ARG 370.A NE ALA 492.A O no hydrogen 3.306 N/A ARG 370.A NH2 ALA 492.A O no hydrogen 2.608 N/A TRP 371.A N GLN 367.A O no hydrogen 3.130 N/A ALA 372.A N ARG 368.A O no hydrogen 2.980 N/A THR 373.A N GLY 369.A O no hydrogen 2.996 N/A THR 373.A OG1 GLY 369.A O no hydrogen 3.055 N/A GLY 374.A N ARG 370.A O no hydrogen 3.014 N/A MET 375.A N TRP 371.A O no hydrogen 3.062 N/A MET 376.A N ALA 372.A O no hydrogen 2.844 N/A GLN 377.A N THR 373.A O no hydrogen 2.973 N/A GLN 377.A NE2 PRO 486.A O no hydrogen 2.507 N/A MET 378.A N GLY 374.A O no hydrogen 2.761 N/A LEU 379.A N MET 375.A O no hydrogen 3.090 N/A LEU 380.A N MET 376.A O no hydrogen 3.110 N/A LEU 381.A N GLN 377.A O no hydrogen 2.778 N/A LYS 382.A NZ GLU 326.A OE1 no hydrogen 2.878 N/A LYS 382.A NZ GLU 337.A OE2 no hydrogen 2.545 N/A ARG 387.A NE SER 340.A OG no hydrogen 3.404 N/A ARG 395.A N GLY 391.A O no hydrogen 2.990 N/A ARG 395.A NH1 ARG 387.A O no hydrogen 2.723 N/A LEU 396.A N ILE 392.A O no hydrogen 3.012 N/A CYS 397.A N ALA 393.A O no hydrogen 2.980 N/A CYS 397.A SG LEU 297.A O no hydrogen 3.689 N/A CYS 397.A SG ALA 393.A O no hydrogen 3.197 N/A TYR 398.A N GLN 394.A O no hydrogen 3.085 N/A TYR 398.A OH HIS 339.A ND1 no hydrogen 2.564 N/A LEU 399.A N ARG 395.A O no hydrogen 2.874 N/A ASN 400.A N LEU 396.A O no hydrogen 2.872 N/A ASN 400.A ND2 ASN 106.A OD1 no hydrogen 3.463 N/A SER 401.A N CYS 397.A O no hydrogen 3.053 N/A SER 401.A OG CYS 397.A O no hydrogen 3.102 N/A MET 402.A N TYR 398.A O no hydrogen 3.019 N/A SER 403.A N LEU 399.A O no hydrogen 2.910 N/A SER 403.A OG LEU 399.A O no hydrogen 2.602 N/A PHE 404.A N ASN 400.A O no hydrogen 3.161 N/A TRP 405.A N MET 402.A O no hydrogen 3.160 N/A PHE 406.A N SER 403.A O no hydrogen 3.201 N/A PHE 407.A N PHE 404.A O no hydrogen 2.996 N/A LEU 409.A N PHE 406.A O no hydrogen 3.003 N/A VAL 410.A N PHE 406.A O no hydrogen 3.192 N/A ARG 411.A N PHE 407.A O no hydrogen 3.045 N/A ARG 411.A NE GLU 468.A OE1 no hydrogen 2.574 N/A ARG 411.A NH2 GLU 468.A OE1 no hydrogen 2.835 N/A MET 413.A N LEU 409.A O no hydrogen 3.375 N/A PHE 414.A N VAL 410.A O no hydrogen 3.308 N/A LEU 415.A N ARG 411.A O no hydrogen 2.868 N/A VAL 416.A N MET 412.A O no hydrogen 3.305 N/A ILE 420.A N VAL 416.A O no hydrogen 3.298 N/A TYR 421.A N PRO 418.A O no hydrogen 3.338 N/A LEU 422.A N PRO 418.A O no hydrogen 3.131 N/A PHE 423.A N LEU 419.A O no hydrogen 2.753 N/A PHE 424.A N ILE 420.A O no hydrogen 3.361 N/A GLY 425.A N TYR 421.A O no hydrogen 2.928 N/A VAL 430.A N THR 76.A O no hydrogen 2.857 N/A THR 432.A N GLU 435.A OE2 no hydrogen 3.111 N/A GLU 435.A N THR 432.A OG1 no hydrogen 3.126 N/A VAL 436.A N THR 432.A O no hydrogen 3.197 N/A LEU 437.A N PHE 433.A O no hydrogen 3.183 N/A ALA 438.A N GLU 435.A O no hydrogen 3.246 N/A TYR 439.A N GLU 435.A O no hydrogen 3.204 N/A MET 440.A N VAL 436.A O no hydrogen 3.171 N/A TYR 443.A N TYR 439.A O no hydrogen 3.117 N/A LEU 444.A N MET 440.A O no hydrogen 2.825 N/A ALA 445.A N PRO 441.A O no hydrogen 2.857 N/A VAL 446.A N GLY 442.A O no hydrogen 3.069 N/A SER 447.A N TYR 443.A O no hydrogen 3.129 N/A SER 447.A OG TYR 443.A O no hydrogen 2.611 N/A PHE 448.A N LEU 444.A O no hydrogen 3.124 N/A LEU 449.A N ALA 445.A O no hydrogen 2.867 N/A VAL 450.A N VAL 446.A O no hydrogen 2.896 N/A ASN 452.A N PHE 448.A O no hydrogen 3.320 N/A ASN 452.A ND2 ILE 695.A O no hydrogen 3.166 N/A ALA 453.A N LEU 449.A O no hydrogen 2.843 N/A LEU 454.A N GLN 451.A O no hydrogen 3.224 N/A PHE 455.A N GLN 451.A O no hydrogen 2.601 N/A ARG 457.A NH1 MET 692.A O no hydrogen 3.421 N/A ARG 459.A N PHE 455.A O no hydrogen 2.905 N/A ARG 459.A NH1 SER 464.A OG no hydrogen 2.770 N/A ARG 459.A NH2 GLU 285.A O no hydrogen 2.676 N/A VAL 463.A N TRP 460.A O no hydrogen 3.325 N/A GLU 465.A N GLU 465.A OE1 no hydrogen 2.605 N/A VAL 466.A N LEU 462.A O no hydrogen 3.128 N/A TYR 467.A N VAL 463.A O no hydrogen 2.986 N/A TYR 467.A OH ASP 270.A OD1 no hydrogen 2.634 N/A TYR 467.A OH ASP 270.A OD2 no hydrogen 2.934 N/A GLU 468.A N SER 464.A O no hydrogen 2.904 N/A VAL 469.A N GLU 465.A O no hydrogen 2.971 N/A ALA 470.A N VAL 466.A O no hydrogen 3.150 N/A GLN 471.A N TYR 467.A O no hydrogen 3.224 N/A GLN 471.A N GLU 468.A O no hydrogen 3.196 N/A GLN 471.A NE2 TYR 467.A O no hydrogen 3.179 N/A TYR 474.A OH ILE 508.A O no hydrogen 2.522 N/A LEU 475.A N GLN 471.A O no hydrogen 2.919 N/A ALA 476.A N ALA 472.A O no hydrogen 2.957 N/A ILE 479.A N LEU 475.A O no hydrogen 3.057 N/A VAL 480.A N ALA 476.A O no hydrogen 3.305 N/A THR 481.A N ARG 477.A O no hydrogen 3.093 N/A THR 481.A OG1 ARG 477.A O no hydrogen 2.353 N/A THR 482.A OG1 ILE 479.A O no hydrogen 2.768 N/A LEU 483.A N ILE 479.A O no hydrogen 3.034 N/A LEU 484.A N VAL 480.A O no hydrogen 3.268 N/A ARG 485.A N THR 481.A O no hydrogen 3.138 N/A ARG 487.A NH1 GLU 326.A OE2 no hydrogen 3.260 N/A ARG 487.A NH2 GLU 326.A OE2 no hydrogen 3.120 N/A SER 488.A OG ARG 485.A O no hydrogen 2.679 N/A LYS 496.A NZ GLU 139.A OE2 no hydrogen 3.539 N/A LYS 496.A NZ THR 494.A O no hydrogen 2.668 N/A LYS 496.A NZ THR 494.A OG1 no hydrogen 3.408 N/A LEU 500.A N GLN 566.A O no hydrogen 2.860 N/A SER 501.A N GLN 566.A O no hydrogen 3.153 N/A SER 501.A OG LEU 500.A O no hydrogen 2.467 N/A GLU 502.A N LEU 500.A O no hydrogen 2.533 N/A TYR 504.A N GLU 563.A O no hydrogen 3.207 N/A ILE 505.A N GLU 722.A OE2 no hydrogen 3.047 N/A SER 506.A N VAL 561.A O no hydrogen 3.212 N/A LEU 513.A N TYR 509.A O no hydrogen 3.019 N/A PHE 514.A N ARG 510.A O no hydrogen 2.960 N/A THR 515.A N PRO 511.A O no hydrogen 3.116 N/A THR 515.A OG1 PRO 511.A O no hydrogen 2.759 N/A PHE 516.A N LEU 512.A O no hydrogen 3.068 N/A LEU 517.A N LEU 513.A O no hydrogen 2.804 N/A LEU 518.A N PHE 514.A O no hydrogen 2.900 N/A CYS 519.A N THR 515.A O no hydrogen 3.004 N/A CYS 519.A SG THR 515.A O no hydrogen 3.290 N/A LEU 520.A N PHE 516.A O no hydrogen 2.781 N/A SER 521.A N LEU 517.A O no hydrogen 2.911 N/A SER 521.A OG LEU 517.A O no hydrogen 3.236 N/A SER 521.A OG LEU 518.A O no hydrogen 2.451 N/A GLY 522.A N LEU 518.A O no hydrogen 3.325 N/A GLY 522.A N CYS 519.A O no hydrogen 3.102 N/A VAL 523.A N CYS 519.A O no hydrogen 3.236 N/A LEU 524.A N LEU 520.A O no hydrogen 2.982 N/A ALA 525.A N SER 521.A O no hydrogen 2.984 N/A THR 526.A N GLY 522.A O no hydrogen 2.981 N/A THR 526.A OG1 VAL 523.A O no hydrogen 2.300 N/A LEU 527.A N VAL 523.A O no hydrogen 3.101 N/A VAL 528.A N LEU 524.A O no hydrogen 3.051 N/A ARG 529.A N ALA 525.A O no hydrogen 2.876 N/A ARG 529.A NE LEU 422.A O no hydrogen 2.958 N/A TRP 530.A N THR 526.A O no hydrogen 2.730 N/A VAL 531.A N LEU 527.A O no hydrogen 3.252 N/A ALA 532.A N VAL 528.A O no hydrogen 3.042 N/A PHE 533.A N ARG 529.A O no hydrogen 2.851 N/A ASP 536.A N PHE 533.A O no hydrogen 3.182 N/A ARG 537.A NE TRP 530.A O no hydrogen 3.276 N/A ARG 537.A NH2 TRP 530.A O no hydrogen 3.528 N/A VAL 539.A N ASP 536.A O no hydrogen 3.098 N/A LEU 540.A N ASP 536.A O no hydrogen 3.135 N/A LEU 541.A N ARG 537.A O no hydrogen 3.130 N/A VAL 542.A N VAL 539.A O no hydrogen 3.148 N/A VAL 543.A N VAL 539.A O no hydrogen 3.058 N/A GLY 544.A N LEU 540.A O no hydrogen 2.661 N/A ALA 547.A N VAL 543.A O no hydrogen 3.064 N/A VAL 548.A N GLY 544.A O no hydrogen 2.796 N/A LEU 549.A N GLY 545.A O no hydrogen 3.095 N/A ASN 550.A N TRP 546.A O no hydrogen 2.702 N/A ASN 550.A N ALA 547.A O no hydrogen 3.218 N/A ASN 550.A ND2 PHE 414.A O no hydrogen 3.691 N/A VAL 551.A N VAL 548.A O no hydrogen 3.402 N/A LEU 552.A N VAL 548.A O no hydrogen 3.345 N/A LEU 553.A N LEU 549.A O no hydrogen 3.376 N/A GLY 555.A N VAL 551.A O no hydrogen 2.977 N/A PHE 556.A N LEU 552.A O no hydrogen 3.031 N/A ALA 557.A N LEU 553.A O no hydrogen 2.749 N/A LEU 558.A N GLY 555.A O no hydrogen 3.240 N/A ARG 559.A N PHE 556.A O no hydrogen 3.185 N/A ARG 559.A NH1 THR 715.A OG1 no hydrogen 3.321 N/A ARG 559.A NH1 ASP 718.A OD2 no hydrogen 3.314 N/A ALA 560.A N ALA 557.A O no hydrogen 3.165 N/A VAL 561.A N LEU 558.A O no hydrogen 3.097 N/A GLU 563.A N TYR 504.A O no hydrogen 2.937 N/A LYS 564.A N ASN 275.A OD1 no hydrogen 2.947 N/A LYS 564.A NZ ARG 274.A O no hydrogen 3.146 N/A GLN 565.A NE2 SER 501.A O no hydrogen 2.803 N/A VAL 573.A N ALA 598.A O no hydrogen 3.103 N/A MET 575.A N LEU 596.A O no hydrogen 2.413 N/A VAL 577.A N VAL 595.A O no hydrogen 3.175 N/A ALA 579.A N ALA 593.A O no hydrogen 3.089 N/A GLU 580.A N GLN 628.A O no hydrogen 3.039 N/A ALA 581.A N LEU 591.A O no hydrogen 2.823 N/A GLN 582.A N GLN 626.A O no hydrogen 2.680 N/A PHE 586.A N ILE 583.A O no hydrogen 2.959 N/A GLY 587.A N PRO 584.A O no hydrogen 3.384 N/A ARG 589.A NH1 PHE 586.A O no hydrogen 3.100 N/A LEU 591.A N ALA 581.A O no hydrogen 2.754 N/A ALA 593.A N ALA 579.A O no hydrogen 2.882 N/A THR 594.A N LEU 606.A O no hydrogen 3.252 N/A VAL 595.A N VAL 577.A O no hydrogen 2.793 N/A LEU 596.A N ARG 604.A O no hydrogen 3.003 N/A ALA 598.A N VAL 573.A O no hydrogen 3.147 N/A SER 599.A N GLY 602.A O no hydrogen 2.858 N/A SER 599.A OG SER 601.A OG no hydrogen 2.931 N/A SER 599.A OG GLY 602.A O no hydrogen 3.442 N/A SER 601.A N SER 599.A OG no hydrogen 3.301 N/A SER 601.A OG SER 599.A OG no hydrogen 2.931 N/A GLY 602.A N SER 599.A OG no hydrogen 3.168 N/A VAL 603.A N VAL 659.A O no hydrogen 2.822 N/A ARG 604.A N ASP 597.A O no hydrogen 2.792 N/A LEU 605.A N VAL 657.A O no hydrogen 2.868 N/A LEU 606.A N THR 594.A O no hydrogen 3.026 N/A VAL 607.A N VAL 655.A O no hydrogen 2.920 N/A ARG 608.A N THR 592.A O no hydrogen 2.889 N/A LEU 609.A N GLY 653.A O no hydrogen 2.842 N/A GLY 622.A N ILE 645.A O no hydrogen 2.561 N/A ILE 625.A N GLY 643.A O no hydrogen 3.221 N/A GLN 626.A N GLN 582.A O no hydrogen 3.134 N/A GLN 626.A NE2 GLN 582.A OE1 no hydrogen 2.927 N/A PHE 627.A N VAL 641.A O no hydrogen 2.838 N/A GLN 628.A N GLU 580.A O no hydrogen 2.958 N/A GLN 628.A NE2 GLU 638.A OE1 no hydrogen 3.134 N/A LYS 630.A N PRO 578.A O no hydrogen 2.735 N/A PHE 631.A N GLU 638.A OE2 no hydrogen 2.711 N/A ALA 634.A N PHE 631.A O no hydrogen 3.186 N/A GLN 636.A N GLN 636.A OE1 no hydrogen 2.625 N/A LEU 637.A N ALA 634.A O no hydrogen 3.163 N/A GLU 638.A N PRO 635.A O no hydrogen 3.100 N/A VAL 641.A N PHE 627.A O no hydrogen 2.699 N/A ARG 642.A N GLN 665.A OE1 no hydrogen 3.022 N/A ARG 642.A NE GLU 662.A OE1 no hydrogen 3.110 N/A GLY 643.A N ILE 625.A O no hydrogen 2.863 N/A ARG 644.A N ILE 660.A O no hydrogen 2.864 N/A ARG 644.A NH1 GLU 662.A OE1 no hydrogen 2.934 N/A ILE 645.A N GLY 623.A O no hydrogen 3.013 N/A ARG 646.A N GLY 658.A O no hydrogen 2.788 N/A SER 647.A N GLY 658.A O no hydrogen 3.338 N/A ARG 649.A N MET 656.A O no hydrogen 2.812 N/A ARG 649.A NH2 GLU 651.A OE1 no hydrogen 3.198 N/A GLU 651.A N THR 654.A O no hydrogen 2.936 N/A THR 654.A OG1 GLU 651.A O no hydrogen 2.984 N/A VAL 655.A N VAL 607.A O no hydrogen 2.839 N/A MET 656.A N ARG 649.A O no hydrogen 2.737 N/A VAL 657.A N LEU 605.A O no hydrogen 2.947 N/A GLY 658.A N SER 647.A O no hydrogen 2.828 N/A VAL 659.A N VAL 603.A O no hydrogen 2.890 N/A ILE 660.A N ARG 644.A O no hydrogen 2.855 N/A PHE 661.A N SER 601.A O no hydrogen 3.009 N/A GLU 662.A N ARG 642.A O no hydrogen 3.006 N/A GLN 665.A NE2 ARG 642.A O no hydrogen 2.392 N/A GLN 665.A NE2 GLU 662.A O no hydrogen 3.192 N/A VAL 669.A N PRO 666.A O no hydrogen 3.123 N/A ARG 670.A NH2 THR 600.A O no hydrogen 2.992 N/A THR 672.A N ALA 668.A O no hydrogen 3.134 N/A THR 672.A OG1 LEU 637.A O no hydrogen 2.629 N/A THR 672.A OG1 ALA 668.A O no hydrogen 3.230 N/A VAL 673.A N VAL 669.A O no hydrogen 3.021 N/A ALA 674.A N ARG 670.A O no hydrogen 2.875 N/A TYR 675.A N GLU 671.A O no hydrogen 3.162 N/A TYR 675.A OH GLU 680.A OE2 no hydrogen 2.555 N/A LEU 676.A N THR 672.A O no hydrogen 2.759 N/A ILE 677.A N VAL 673.A O no hydrogen 3.213 N/A PHE 678.A N ALA 674.A O no hydrogen 2.935 N/A SER 681.A OG SER 240.A OG no hydrogen 2.935 N/A SER 681.A OG ASP 242.A OD1 no hydrogen 2.422 N/A SER 681.A OG ASP 242.A OD2 no hydrogen 3.152 N/A HIS 683.A NE2 GLN 574.A O no hydrogen 3.010 N/A TRP 684.A N SER 681.A O no hydrogen 3.074 N/A ARG 685.A N SER 681.A O no hydrogen 3.173 N/A THR 686.A N ALA 682.A O no hydrogen 2.998 N/A THR 686.A OG1 ALA 682.A O no hydrogen 2.821 N/A MET 687.A N HIS 683.A O no hydrogen 3.138 N/A ARG 688.A N TRP 684.A O no hydrogen 2.854 N/A ARG 688.A NE GLU 287.A OE2 no hydrogen 2.993 N/A ARG 688.A NH1 ASP 349.A OD1 no hydrogen 3.183 N/A ARG 688.A NH2 GLU 287.A OE2 no hydrogen 2.702 N/A ARG 688.A NH2 TYR 290.A O no hydrogen 3.558 N/A ARG 688.A NH2 ASP 349.A OD1 no hydrogen 2.913 N/A GLU 689.A N ARG 685.A O no hydrogen 2.908 N/A ALA 690.A N MET 687.A O no hydrogen 3.337 N/A THR 691.A N ARG 688.A O no hydrogen 3.239 N/A THR 691.A OG1 ARG 688.A O no hydrogen 3.096 N/A GLY 700.A N GLY 696.A O no hydrogen 2.699 N/A MET 701.A N LEU 697.A O no hydrogen 2.881 N/A ALA 702.A N LEU 698.A O no hydrogen 2.936 N/A ARG 703.A N HIS 699.A O no hydrogen 2.899 N/A ARG 703.A NH2 LEU 278.A O no hydrogen 2.832 N/A ILE 704.A N GLY 700.A O no hydrogen 3.047 N/A LEU 705.A N MET 701.A O no hydrogen 2.936 N/A TRP 706.A N ALA 702.A O no hydrogen 3.001 N/A MET 707.A N ARG 703.A O no hydrogen 2.941 N/A ALA 708.A N ILE 704.A O no hydrogen 2.773 N/A ALA 709.A N LEU 705.A O no hydrogen 3.068 N/A ALA 710.A N TRP 706.A O no hydrogen 3.040 N/A SER 711.A N MET 707.A O no hydrogen 2.911 N/A SER 711.A OG MET 707.A O no hydrogen 3.329 N/A SER 711.A OG ALA 708.A O no hydrogen 2.793 N/A THR 715.A N SER 711.A O no hydrogen 2.852 N/A THR 715.A OG1 SER 711.A O no hydrogen 2.790 N/A ALA 716.A N LEU 712.A O no hydrogen 3.080 N/A ARG 717.A N PRO 713.A O no hydrogen 3.281 N/A ASP 718.A N LYS 714.A O no hydrogen 3.100 N/A PHE 719.A N ALA 716.A O no hydrogen 3.172 N/A MET 720.A N ALA 716.A O no hydrogen 3.180 N/A ASP 721.A N ARG 717.A O no hydrogen 2.997 N/A ARG 725.A N GLU 722.A O no hydrogen 3.063 N/A ARG 725.A NE GLU 722.A OE1 no hydrogen 3.484 N/A ARG 725.A NE GLU 722.A OE2 no hydrogen 3.300 N/A ARG 725.A NH1 GLU 502.A OE1 no hydrogen 3.446 N/A ARG 725.A NH2 GLU 722.A OE1 no hydrogen 2.973 N/A ARG 726.A N GLU 722.A O no hydrogen 3.042 N/A