Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ay2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ LYS 3.A O no hydrogen 3.491 N/A LYS 3.A NZ PRO 4.A O no hydrogen 2.403 N/A ARG 5.A N GLN 8.A OE1 no hydrogen 2.602 N/A ARG 5.A NH1 TYR 7.A OH no hydrogen 3.105 N/A TYR 7.A OH CYS 29.A O no hydrogen 2.508 N/A GLN 8.A N ARG 5.A O no hydrogen 3.022 N/A GLN 8.A NE2 GLY 30.A O no hydrogen 3.408 N/A LEU 9.A N ARG 5.A O no hydrogen 3.227 N/A GLU 10.A N ASN 6.A O no hydrogen 2.996 N/A LEU 11.A N TYR 7.A O no hydrogen 2.853 N/A ALA 12.A N GLN 8.A O no hydrogen 3.173 N/A ALA 12.A N LEU 9.A O no hydrogen 3.320 N/A LEU 13.A N GLU 10.A O no hydrogen 3.483 N/A MET 16.A N ALA 12.A O no hydrogen 3.103 N/A LYS 17.A N LEU 13.A O no hydrogen 3.031 N/A LYS 17.A N PRO 14.A O no hydrogen 3.143 N/A GLY 18.A N ALA 15.A O no hydrogen 2.824 N/A LYS 19.A N PRO 14.A O no hydrogen 3.220 N/A LYS 19.A NZ GLU 479.A OE1 no hydrogen 2.944 N/A ASN 20.A ND2 TYR 151.A OH no hydrogen 3.264 N/A ASN 20.A ND2 ASP 196.A O no hydrogen 3.193 N/A THR 21.A N VAL 166.A O no hydrogen 3.231 N/A ILE 22.A N VAL 199.A O no hydrogen 2.910 N/A ILE 23.A N GLY 168.A O no hydrogen 2.843 N/A CYS 24.A N ALA 201.A O no hydrogen 3.095 N/A ALA 25.A N THR 170.A O no hydrogen 3.084 N/A CYS 29.A N PRO 26.A O no hydrogen 3.309 N/A CYS 29.A SG PRO 26.A O no hydrogen 3.123 N/A LYS 31.A NZ ALA 25.A O no hydrogen 3.190 N/A VAL 34.A N GLY 30.A O no hydrogen 3.367 N/A SER 35.A N LYS 31.A O no hydrogen 2.852 N/A SER 35.A OG THR 32.A O no hydrogen 2.361 N/A LEU 36.A N THR 32.A O no hydrogen 2.907 N/A LEU 37.A N PHE 33.A O no hydrogen 2.908 N/A ILE 38.A N VAL 34.A O no hydrogen 2.913 N/A CYS 39.A N SER 35.A O no hydrogen 2.914 N/A GLU 40.A N LEU 36.A O no hydrogen 2.877 N/A HIS 41.A N LEU 37.A O no hydrogen 3.000 N/A HIS 42.A N ILE 38.A O no hydrogen 2.812 N/A HIS 42.A NE2 THR 128.A OG1 no hydrogen 2.729 N/A LEU 43.A N CYS 39.A O no hydrogen 3.025 N/A LYS 44.A N GLU 40.A O no hydrogen 2.939 N/A LYS 44.A N HIS 41.A O no hydrogen 3.038 N/A LYS 45.A N HIS 41.A O no hydrogen 2.877 N/A GLN 50.A N PRO 47.A O no hydrogen 3.150 N/A LYS 53.A N THR 128.A OG1 no hydrogen 2.799 N/A LYS 53.A NZ VAL 99.A O no hydrogen 2.792 N/A LYS 53.A NZ ASN 102.A O no hydrogen 2.883 N/A VAL 54.A N ASP 103.A O no hydrogen 2.768 N/A VAL 55.A N LEU 129.A O no hydrogen 3.047 N/A PHE 56.A N ILE 105.A O no hydrogen 2.846 N/A PHE 57.A N ILE 131.A O no hydrogen 2.762 N/A ALA 58.A N LEU 107.A O no hydrogen 3.036 N/A ASN 59.A ND2 HIS 142.A NE2 no hydrogen 3.455 N/A TYR 64.A N GLN 60.A O no hydrogen 3.004 N/A GLU 65.A N ILE 61.A O no hydrogen 2.900 N/A GLN 66.A N PRO 62.A O no hydrogen 2.947 N/A ASN 67.A N VAL 63.A O no hydrogen 2.961 N/A ASN 67.A ND2 VAL 63.A O no hydrogen 3.076 N/A LYS 68.A N TYR 64.A O no hydrogen 2.950 N/A SER 69.A N GLU 65.A O no hydrogen 2.943 N/A SER 69.A OG GLU 65.A O no hydrogen 3.256 N/A VAL 70.A N GLN 66.A O no hydrogen 2.904 N/A PHE 71.A N ASN 67.A O no hydrogen 2.879 N/A SER 72.A N LYS 68.A O no hydrogen 2.962 N/A SER 72.A OG LYS 68.A O no hydrogen 2.996 N/A LYS 73.A N SER 69.A O no hydrogen 2.886 N/A TYR 74.A N VAL 70.A O no hydrogen 2.928 N/A TYR 74.A OH GLU 40.A OE1 no hydrogen 2.910 N/A PHE 75.A N PHE 71.A O no hydrogen 3.283 N/A HIS 78.A NE2 GLU 40.A OE2 no hydrogen 2.933 N/A GLY 79.A N GLU 76.A O no hydrogen 3.140 N/A ARG 81.A N ASP 103.A OD2 no hydrogen 3.006 N/A ARG 81.A NE ASP 103.A OD2 no hydrogen 3.475 N/A ARG 81.A NH2 ASP 103.A OD1 no hydrogen 3.557 N/A THR 83.A N ILE 104.A O no hydrogen 3.239 N/A ILE 85.A N ILE 106.A O no hydrogen 2.840 N/A SER 86.A N THR 89.A OG1 no hydrogen 2.765 N/A SER 86.A OG THR 89.A OG1 no hydrogen 3.099 N/A ALA 88.A N SER 86.A OG no hydrogen 3.149 N/A THR 89.A N SER 86.A O no hydrogen 2.830 N/A THR 89.A OG1 TYR 64.A OH no hydrogen 3.348 N/A THR 89.A OG1 SER 86.A O no hydrogen 3.426 N/A THR 89.A OG1 SER 86.A OG no hydrogen 3.099 N/A ILE 98.A N PRO 94.A O no hydrogen 3.088 N/A VAL 99.A N VAL 95.A O no hydrogen 2.962 N/A GLU 100.A N GLU 96.A O no hydrogen 2.937 N/A ASN 101.A N GLN 97.A O no hydrogen 2.838 N/A ASN 102.A N VAL 99.A O no hydrogen 3.443 N/A ASN 102.A ND2 ILE 98.A O no hydrogen 2.935 N/A ASP 103.A N ARG 81.A O no hydrogen 3.003 N/A ILE 104.A N ARG 81.A O no hydrogen 3.074 N/A ILE 105.A N VAL 54.A O no hydrogen 2.825 N/A ILE 106.A N THR 83.A O no hydrogen 3.153 N/A LEU 107.A N PHE 56.A O no hydrogen 2.887 N/A THR 108.A N ILE 85.A O no hydrogen 3.433 N/A GLN 110.A NE2 GLN 110.A O no hydrogen 3.384 N/A GLN 110.A NE2 ASN 114.A OD1 no hydrogen 2.862 N/A ILE 111.A N THR 108.A O no hydrogen 3.059 N/A VAL 113.A N PRO 109.A O no hydrogen 2.994 N/A ASN 114.A N GLN 110.A O no hydrogen 2.855 N/A ASN 115.A N ILE 111.A O no hydrogen 3.006 N/A LEU 116.A N LEU 112.A O no hydrogen 2.846 N/A LYS 117.A N VAL 113.A O no hydrogen 2.981 N/A LYS 118.A N ASN 114.A O no hydrogen 2.896 N/A GLY 119.A N LEU 116.A O no hydrogen 3.302 N/A ILE 121.A N ASN 115.A O no hydrogen 3.333 N/A SER 123.A OG GLN 154.A OE1 no hydrogen 2.607 N/A SER 125.A N SER 123.A OG no hydrogen 2.932 N/A SER 125.A OG SER 123.A OG no hydrogen 3.112 N/A SER 125.A OG GLN 154.A OE1 no hydrogen 3.431 N/A SER 125.A OG PRO 162.A O no hydrogen 2.641 N/A PHE 127.A N LEU 124.A O no hydrogen 2.874 N/A THR 128.A N LYS 53.A O no hydrogen 2.962 N/A THR 128.A OG1 HIS 42.A NE2 no hydrogen 2.729 N/A THR 128.A OG1 LYS 53.A O no hydrogen 3.129 N/A LEU 129.A N LYS 53.A O no hydrogen 3.340 N/A MET 130.A N GLN 165.A O no hydrogen 2.723 N/A ILE 131.A N VAL 55.A O no hydrogen 2.905 N/A PHE 132.A N ILE 167.A O no hydrogen 2.863 N/A ASP 133.A N PHE 57.A O no hydrogen 3.023 N/A CYS 135.A N LEU 169.A O no hydrogen 2.788 N/A ASN 137.A N GLU 134.A O no hydrogen 3.168 N/A ASN 137.A ND2 GLU 134.A O no hydrogen 2.740 N/A THR 138.A N CYS 135.A O no hydrogen 3.002 N/A THR 138.A OG1 CYS 135.A O no hydrogen 2.519 N/A SER 139.A N ASN 137.A O no hydrogen 2.761 N/A HIS 142.A N SER 139.A O no hydrogen 3.231 N/A TYR 144.A N HIS 142.A ND1 no hydrogen 3.206 N/A TYR 144.A OH ASP 133.A O no hydrogen 2.534 N/A ASN 145.A ND2 LYS 140.A O no hydrogen 2.909 N/A MET 146.A N HIS 142.A O no hydrogen 3.045 N/A ILE 147.A N PRO 143.A O no hydrogen 3.007 N/A MET 148.A N TYR 144.A O no hydrogen 2.993 N/A PHE 149.A N ASN 145.A O no hydrogen 2.841 N/A ASN 150.A N MET 146.A O no hydrogen 3.053 N/A TYR 151.A N ILE 147.A O no hydrogen 3.071 N/A TYR 151.A OH ASP 196.A OD2 no hydrogen 2.884 N/A LEU 152.A N MET 148.A O no hydrogen 2.834 N/A ASP 153.A N PHE 149.A O no hydrogen 2.951 N/A GLN 154.A N ASN 150.A O no hydrogen 3.084 N/A GLN 154.A N TYR 151.A O no hydrogen 2.815 N/A LYS 155.A N TYR 151.A O no hydrogen 2.893 N/A LYS 155.A NZ ASP 196.A OD1 no hydrogen 3.502 N/A LYS 155.A NZ GLN 490.A OE1 no hydrogen 3.046 N/A LEU 156.A N LEU 152.A O no hydrogen 2.858 N/A GLY 157.A N ASP 153.A O no hydrogen 3.050 N/A SER 159.A N GLN 154.A O no hydrogen 3.364 N/A SER 160.A OG GLY 161.A O no hydrogen 3.317 N/A GLN 165.A N THR 128.A O no hydrogen 2.929 N/A GLN 165.A NE2 ALA 15.A O no hydrogen 2.732 N/A GLN 165.A NE2 LYS 19.A O no hydrogen 2.957 N/A VAL 166.A N ASN 20.A OD1 no hydrogen 3.218 N/A ILE 167.A N MET 130.A O no hydrogen 2.918 N/A GLY 168.A N THR 21.A O no hydrogen 3.038 N/A LEU 169.A N PHE 132.A O no hydrogen 2.688 N/A THR 170.A N ILE 23.A O no hydrogen 3.143 N/A THR 170.A OG1 HIS 136.A ND1 no hydrogen 2.762 N/A THR 170.A OG1 SER 172.A O no hydrogen 2.927 N/A SER 172.A N THR 170.A OG1 no hydrogen 2.798 N/A ASP 177.A N ASP 177.A OD1 no hydrogen 2.516 N/A LYS 179.A N GLU 183.A OE1 no hydrogen 2.930 N/A LYS 179.A NZ ASP 177.A O no hydrogen 2.808 N/A ASP 182.A N ASN 180.A OD1 no hydrogen 2.720 N/A GLU 183.A N ASN 180.A OD1 no hydrogen 2.893 N/A ALA 184.A N ASN 180.A O no hydrogen 3.210 N/A ASP 186.A N ASP 182.A O no hydrogen 2.920 N/A TYR 187.A N GLU 183.A O no hydrogen 2.929 N/A ILE 188.A N ALA 184.A O no hydrogen 2.980 N/A CYS 189.A N LEU 185.A O no hydrogen 2.937 N/A CYS 189.A SG LEU 185.A O no hydrogen 3.483 N/A LYS 190.A N ASP 186.A O no hydrogen 2.918 N/A LEU 191.A N TYR 187.A O no hydrogen 2.936 N/A CYS 192.A N ILE 188.A O no hydrogen 2.951 N/A CYS 192.A SG ILE 188.A O no hydrogen 3.585 N/A ALA 193.A N CYS 189.A O no hydrogen 2.829 N/A SER 194.A N LYS 190.A O no hydrogen 2.911 N/A SER 194.A OG LYS 190.A O no hydrogen 2.925 N/A LEU 195.A N LEU 191.A O no hydrogen 3.028 N/A ASP 196.A N ALA 193.A O no hydrogen 3.198 N/A ALA 197.A N CYS 192.A O no hydrogen 2.812 N/A SER 198.A N ASN 20.A O no hydrogen 2.746 N/A SER 198.A OG GLU 479.A OE2 no hydrogen 2.983 N/A ALA 201.A N ILE 22.A O no hydrogen 2.735 N/A LYS 204.A N GLU 10.A OE2 no hydrogen 2.761 N/A LYS 204.A NZ GLN 475.A OE1 no hydrogen 2.556 N/A HIS 205.A N GLU 10.A OE1 no hydrogen 3.077 N/A HIS 205.A N GLU 10.A OE2 no hydrogen 3.383 N/A ASN 206.A ND2 GLU 10.A OE1 no hydrogen 2.899 N/A GLU 208.A N GLU 208.A OE1 no hydrogen 2.486 N/A GLU 209.A N ASN 206.A O no hydrogen 3.212 N/A LEU 210.A N ASN 206.A O no hydrogen 2.957 N/A GLU 211.A N LEU 207.A O no hydrogen 2.898 N/A GLN 212.A N GLU 209.A O no hydrogen 3.201 N/A VAL 213.A N LEU 210.A O no hydrogen 3.091 N/A VAL 214.A N GLU 211.A O no hydrogen 3.308 N/A TYR 215.A OH CYS 432.A O no hydrogen 2.934 N/A GLN 218.A N SER 442.A O no hydrogen 2.676 N/A PHE 220.A N CYS 444.A O no hydrogen 2.720 N/A ARG 222.A N LEU 446.A O no hydrogen 2.949 N/A ARG 222.A NH1 PHE 221.A O no hydrogen 2.754 N/A LYS 223.A NZ SER 449.A O no hydrogen 3.040 N/A VAL 224.A N THR 448.A O no hydrogen 2.873 N/A ARG 227.A NE ASN 360.A O no hydrogen 2.980 N/A ARG 227.A NH1 SER 309.A O no hydrogen 2.916 N/A ARG 227.A NH2 SER 309.A O no hydrogen 3.069 N/A ARG 227.A NH2 ALA 312.A O no hydrogen 3.467 N/A PHE 232.A N ASP 230.A OD1 no hydrogen 3.046 N/A LYS 233.A N ASP 230.A OD1 no hydrogen 3.417 N/A LYS 233.A NZ PHE 265.A O no hydrogen 3.461 N/A ILE 235.A N LYS 231.A O no hydrogen 3.434 N/A ILE 236.A N PHE 232.A O no hydrogen 3.039 N/A ALA 237.A N LYS 233.A O no hydrogen 2.847 N/A GLN 238.A N TYR 234.A O no hydrogen 3.003 N/A GLN 238.A NE2 ASP 242.A OD1 no hydrogen 2.723 N/A LEU 239.A N ILE 235.A O no hydrogen 3.000 N/A MET 240.A N ILE 236.A O no hydrogen 2.943 N/A ARG 241.A N ALA 237.A O no hydrogen 2.892 N/A ARG 241.A NE GLN 238.A OE1 no hydrogen 3.228 N/A ARG 241.A NH2 GLN 238.A OE1 no hydrogen 3.319 N/A ASP 242.A N GLN 238.A O no hydrogen 2.959 N/A THR 243.A N LEU 239.A O no hydrogen 2.923 N/A GLU 244.A N MET 240.A O no hydrogen 2.878 N/A SER 245.A N ARG 241.A O no hydrogen 2.951 N/A SER 245.A OG ARG 241.A O no hydrogen 3.107 N/A LEU 246.A N ASP 242.A O no hydrogen 2.925 N/A ALA 247.A N THR 243.A O no hydrogen 2.863 N/A LYS 248.A N GLU 244.A O no hydrogen 2.953 N/A LYS 248.A NZ GLU 255.A OE2 no hydrogen 3.243 N/A ARG 249.A N LEU 246.A O no hydrogen 3.110 N/A CYS 251.A N ALA 247.A O no hydrogen 3.271 N/A LEU 254.A N CYS 251.A O no hydrogen 3.280 N/A ASN 256.A N ASP 253.A O no hydrogen 3.031 N/A ASN 256.A ND2 ASP 253.A OD1 no hydrogen 2.916 N/A LEU 257.A N LEU 254.A O no hydrogen 3.170 N/A SER 258.A OG THR 276.A OG1 no hydrogen 2.580 N/A ILE 260.A N SER 258.A OG no hydrogen 3.270 N/A ARG 263.A NE GLU 244.A OE2 no hydrogen 3.138 N/A ARG 263.A NH1 GLU 255.A OE1 no hydrogen 3.065 N/A ARG 263.A NH2 GLU 244.A OE1 no hydrogen 3.350 N/A ARG 263.A NH2 GLU 255.A OE2 no hydrogen 2.516 N/A GLY 266.A N ASN 303.A OD1 no hydrogen 2.825 N/A THR 267.A N ASN 303.A OD1 no hydrogen 3.108 N/A THR 267.A OG1 GLU 264.A O no hydrogen 2.495 N/A LYS 269.A NZ GLN 261.A O no hydrogen 2.681 N/A TYR 270.A N THR 267.A OG1 no hydrogen 3.360 N/A TYR 270.A OH GLU 244.A OE2 no hydrogen 2.466 N/A GLN 272.A N GLN 268.A O no hydrogen 2.964 N/A TRP 273.A N LYS 269.A O no hydrogen 2.900 N/A ILE 274.A N TYR 270.A O no hydrogen 2.893 N/A VAL 275.A N GLU 271.A O no hydrogen 3.001 N/A THR 276.A N GLN 272.A O no hydrogen 2.951 N/A THR 276.A OG1 SER 258.A OG no hydrogen 2.580 N/A THR 276.A OG1 GLN 272.A O no hydrogen 3.567 N/A THR 276.A OG1 TRP 273.A O no hydrogen 2.940 N/A VAL 277.A N TRP 273.A O no hydrogen 2.937 N/A GLN 278.A N ILE 274.A O no hydrogen 2.965 N/A GLN 278.A NE2 THR 296.A OG1 no hydrogen 2.830 N/A LYS 279.A N VAL 275.A O no hydrogen 3.039 N/A ALA 280.A N VAL 277.A O no hydrogen 3.230 N/A CYS 281.A N VAL 277.A O no hydrogen 3.119 N/A ARG 287.A N GLU 284.A O no hydrogen 3.144 N/A ARG 287.A NE GLU 284.A O no hydrogen 3.628 N/A CYS 289.A N GLU 285.A O no hydrogen 3.207 N/A LYS 290.A N SER 286.A O no hydrogen 2.877 N/A ALA 291.A N ARG 287.A O no hydrogen 3.037 N/A LEU 292.A N ILE 288.A O no hydrogen 2.987 N/A PHE 293.A N CYS 289.A O no hydrogen 2.908 N/A LEU 294.A N LYS 290.A O no hydrogen 2.962 N/A TYR 295.A N ALA 291.A O no hydrogen 3.078 N/A THR 296.A N LEU 292.A O no hydrogen 2.953 N/A THR 296.A OG1 LEU 292.A O no hydrogen 3.015 N/A THR 296.A OG1 PHE 293.A O no hydrogen 3.334 N/A SER 297.A N PHE 293.A O no hydrogen 2.942 N/A SER 297.A OG PHE 293.A O no hydrogen 3.127 N/A HIS 298.A N LEU 294.A O no hydrogen 3.065 N/A HIS 298.A ND1 LEU 294.A O no hydrogen 3.230 N/A LEU 299.A N TYR 295.A O no hydrogen 2.927 N/A ARG 300.A N THR 296.A O no hydrogen 2.914 N/A LYS 301.A N SER 297.A O no hydrogen 2.987 N/A LYS 301.A NZ TYR 320.A OH no hydrogen 3.166 N/A TYR 302.A N HIS 298.A O no hydrogen 2.975 N/A ASN 303.A N LEU 299.A O no hydrogen 2.931 N/A ASN 303.A ND2 THR 267.A O no hydrogen 2.982 N/A ASP 304.A N ARG 300.A O no hydrogen 2.973 N/A ALA 305.A N LYS 301.A O no hydrogen 2.915 N/A LEU 306.A N TYR 302.A O no hydrogen 2.917 N/A ILE 307.A N ASN 303.A O no hydrogen 3.173 N/A ILE 308.A N ASP 304.A O no hydrogen 2.979 N/A SER 309.A N ALA 305.A O no hydrogen 2.998 N/A GLU 310.A N LEU 306.A O no hydrogen 2.955 N/A HIS 311.A N ILE 307.A O no hydrogen 3.130 N/A HIS 311.A N ILE 308.A O no hydrogen 3.151 N/A ALA 312.A N ILE 308.A O no hydrogen 2.615 N/A ARG 313.A N ASP 316.A OD2 no hydrogen 3.280 N/A ARG 313.A NH1 ASP 316.A OD2 no hydrogen 3.009 N/A ASP 316.A N ARG 313.A O no hydrogen 2.668 N/A ALA 317.A N ARG 313.A O no hydrogen 3.449 N/A LEU 318.A N MET 314.A O no hydrogen 2.957 N/A ASP 319.A N LYS 315.A O no hydrogen 2.846 N/A TYR 320.A N ASP 316.A O no hydrogen 2.954 N/A TYR 320.A OH ASP 304.A OD2 no hydrogen 2.910 N/A LEU 321.A N ALA 317.A O no hydrogen 2.979 N/A LYS 322.A N LEU 318.A O no hydrogen 2.892 N/A LYS 322.A NZ GLU 352.A OE1 no hydrogen 3.145 N/A ASP 323.A N ASP 319.A O no hydrogen 2.909 N/A PHE 324.A N TYR 320.A O no hydrogen 2.991 N/A PHE 325.A N LEU 321.A O no hydrogen 2.923 N/A SER 326.A N LYS 322.A O no hydrogen 2.950 N/A ASN 327.A N ASP 323.A O no hydrogen 2.950 N/A VAL 328.A N PHE 324.A O no hydrogen 2.976 N/A ARG 329.A N PHE 325.A O no hydrogen 2.957 N/A ALA 330.A N ASN 327.A O no hydrogen 3.159 N/A GLN 338.A N ASP 334.A O no hydrogen 3.054 N/A GLN 338.A NE2 PHE 333.A O no hydrogen 2.720 N/A ASP 339.A N GLU 335.A O no hydrogen 2.864 N/A LEU 340.A N ILE 336.A O no hydrogen 2.955 N/A THR 341.A N GLU 337.A O no hydrogen 2.882 N/A THR 341.A OG1 GLU 337.A O no hydrogen 2.723 N/A GLN 342.A N GLN 338.A O no hydrogen 2.974 N/A ARG 343.A N ASP 339.A O no hydrogen 2.944 N/A ARG 343.A NH1 ASP 339.A OD1 no hydrogen 3.110 N/A ARG 343.A NH1 ASP 339.A OD2 no hydrogen 3.197 N/A PHE 344.A N LEU 340.A O no hydrogen 3.008 N/A GLU 345.A N THR 341.A O no hydrogen 2.940 N/A GLU 346.A N GLN 342.A O no hydrogen 2.959 N/A LYS 347.A N PHE 344.A O no hydrogen 2.902 N/A LEU 348.A N GLU 345.A O no hydrogen 3.322 N/A LEU 351.A N LYS 347.A O no hydrogen 3.017 N/A GLU 352.A N LEU 348.A O no hydrogen 2.893 N/A SER 353.A N GLN 349.A O no hydrogen 2.921 N/A SER 353.A OG GLN 349.A O no hydrogen 2.958 N/A VAL 354.A N GLU 350.A O no hydrogen 2.924 N/A SER 355.A N LEU 351.A O no hydrogen 2.958 N/A SER 355.A OG LEU 351.A O no hydrogen 2.942 N/A ARG 356.A N GLU 352.A O no hydrogen 3.416 N/A SER 359.A N ASP 357.A OD1 no hydrogen 3.343 N/A SER 359.A OG ASP 357.A OD1 no hydrogen 3.453 N/A SER 359.A OG ASP 357.A OD2 no hydrogen 3.518 N/A ASN 360.A N ASP 357.A O no hydrogen 2.726 N/A ASN 360.A ND2 SER 229.A O no hydrogen 2.980 N/A GLU 361.A N PRO 358.A O no hydrogen 3.425 N/A ASN 362.A ND2 GLU 310.A O no hydrogen 2.998 N/A ASN 362.A ND2 ALA 312.A O no hydrogen 2.727 N/A LYS 364.A NZ GLU 310.A O no hydrogen 3.232 N/A LYS 364.A NZ HIS 311.A ND1 no hydrogen 3.046 N/A LYS 364.A NZ GLU 439.A OE2 no hydrogen 3.079 N/A ASP 367.A N PRO 363.A O no hydrogen 3.038 N/A LEU 368.A N LYS 364.A O no hydrogen 3.054 N/A CYS 369.A N LEU 365.A O no hydrogen 2.892 N/A PHE 370.A N GLU 366.A O no hydrogen 2.974 N/A ILE 371.A N ASP 367.A O no hydrogen 3.086 N/A LEU 372.A N LEU 368.A O no hydrogen 3.033 N/A GLN 373.A N CYS 369.A O no hydrogen 2.965 N/A GLU 374.A N PHE 370.A O no hydrogen 3.023 N/A GLU 375.A N ILE 371.A O no hydrogen 2.999 N/A TYR 376.A N LEU 372.A O no hydrogen 2.996 N/A TYR 376.A OH THR 382.A O no hydrogen 2.746 N/A TYR 376.A OH THR 384.A OG1 no hydrogen 2.780 N/A HIS 377.A N GLU 374.A O no hydrogen 2.947 N/A LEU 378.A N GLU 374.A O no hydrogen 2.985 N/A ASN 379.A N GLU 375.A O no hydrogen 3.158 N/A GLU 381.A N ASN 379.A OD1 no hydrogen 3.076 N/A THR 382.A OG1 ASN 379.A O no hydrogen 2.586 N/A ILE 383.A N ASN 433.A OD1 no hydrogen 2.911 N/A THR 384.A N LEU 421.A O no hydrogen 2.588 N/A THR 384.A OG1 TYR 376.A OH no hydrogen 2.780 N/A ILE 385.A N LEU 434.A O no hydrogen 3.019 N/A LEU 386.A N ALA 423.A O no hydrogen 2.768 N/A PHE 387.A N ILE 436.A O no hydrogen 2.873 N/A VAL 388.A N SER 425.A O no hydrogen 3.050 N/A LYS 389.A NZ HIS 311.A NE2 no hydrogen 2.815 N/A ARG 391.A NE ARG 391.A O no hydrogen 3.241 N/A LEU 393.A N THR 390.A OG1 no hydrogen 3.221 N/A VAL 394.A N ARG 391.A O no hydrogen 3.318 N/A ALA 396.A N ALA 392.A O no hydrogen 2.994 N/A LEU 397.A N LEU 393.A O no hydrogen 2.950 N/A LYS 398.A N VAL 394.A O no hydrogen 2.984 N/A ASN 399.A N ASP 395.A O no hydrogen 2.907 N/A TRP 400.A N ALA 396.A O no hydrogen 2.950 N/A ILE 401.A N LEU 397.A O no hydrogen 2.857 N/A GLU 402.A N LYS 398.A O no hydrogen 2.959 N/A GLY 403.A N ASN 399.A O no hydrogen 3.019 N/A ASN 404.A N ILE 401.A O no hydrogen 3.113 N/A LYS 406.A N ASN 404.A OD1 no hydrogen 3.029 N/A LEU 407.A N ASN 404.A O no hydrogen 2.996 N/A LEU 410.A N LEU 407.A O no hydrogen 3.134 N/A GLY 413.A N ILE 422.A O no hydrogen 3.253 N/A LEU 421.A N LYS 411.A O no hydrogen 3.244 N/A ALA 423.A N THR 384.A O no hydrogen 2.895 N/A THR 424.A N GLY 413.A O no hydrogen 3.208 N/A SER 425.A N LEU 386.A O no hydrogen 3.069 N/A GLU 429.A N ALA 427.A O no hydrogen 2.788 N/A LEU 434.A N ILE 383.A O no hydrogen 3.255 N/A VAL 435.A N LYS 443.A O no hydrogen 2.958 N/A ILE 436.A N ILE 385.A O no hydrogen 2.947 N/A LEU 437.A N PHE 445.A O no hydrogen 2.716 N/A TYR 438.A N PHE 387.A O no hydrogen 2.994 N/A TYR 438.A OH HIS 311.A O no hydrogen 2.423 N/A GLU 439.A N LEU 447.A O no hydrogen 2.767 N/A SER 442.A OG TYR 215.A OH no hydrogen 3.193 N/A LYS 443.A N ASN 433.A O no hydrogen 2.762 N/A LYS 443.A NZ GLU 375.A OE1 no hydrogen 3.115 N/A LYS 443.A NZ GLU 375.A OE2 no hydrogen 2.947 N/A CYS 444.A N GLN 218.A O no hydrogen 2.686 N/A CYS 444.A SG VAL 435.A O no hydrogen 3.825 N/A PHE 445.A N VAL 435.A O no hydrogen 2.774 N/A LEU 446.A N PHE 220.A O no hydrogen 2.856 N/A LEU 447.A N LEU 437.A O no hydrogen 2.935 N/A THR 448.A OG1 GLU 439.A OE1 no hydrogen 3.110 N/A SER 449.A N GLU 439.A OE2 no hydrogen 2.857 N/A SER 449.A OG GLU 439.A OE2 no hydrogen 2.971 N/A ASN 450.A N THR 448.A OG1 no hydrogen 2.936 N/A GLY 452.A N ASN 450.A OD1 no hydrogen 2.829 N/A VAL 453.A N ASN 450.A O no hydrogen 3.141 N/A GLU 455.A N ALA 451.A O no hydrogen 2.900 N/A LYS 456.A N GLY 452.A O no hydrogen 2.906 N/A GLU 457.A N VAL 453.A O no hydrogen 3.000 N/A GLN 458.A N ILE 454.A O no hydrogen 2.913 N/A ILE 459.A N GLU 455.A O no hydrogen 2.972 N/A ASN 460.A N LYS 456.A O no hydrogen 2.921 N/A MET 461.A N GLU 457.A O no hydrogen 3.038 N/A TYR 462.A N GLN 458.A O no hydrogen 2.986 N/A LYS 463.A N ILE 459.A O no hydrogen 2.931 N/A LYS 463.A NZ GLY 176.A O no hydrogen 3.065 N/A GLU 464.A N ASN 460.A O no hydrogen 2.981 N/A LYS 465.A N MET 461.A O no hydrogen 3.132 N/A MET 466.A N TYR 462.A O no hydrogen 2.969 N/A MET 467.A N LYS 463.A O no hydrogen 2.888 N/A ASN 468.A N GLU 464.A O no hydrogen 2.954 N/A ASP 469.A N LYS 465.A O no hydrogen 2.931 N/A SER 470.A N MET 466.A O no hydrogen 2.944 N/A SER 470.A OG MET 466.A O no hydrogen 2.668 N/A ILE 471.A N MET 467.A O no hydrogen 2.955 N/A LEU 472.A N ASN 468.A O no hydrogen 3.007 N/A ARG 473.A N ASP 469.A O no hydrogen 2.992 N/A LEU 474.A N SER 470.A O no hydrogen 2.882 N/A GLN 475.A N ILE 471.A O no hydrogen 2.963 N/A GLN 475.A NE2 ILE 200.A O no hydrogen 2.993 N/A GLN 475.A NE2 THR 202.A OG1 no hydrogen 2.778 N/A THR 476.A N ARG 473.A O no hydrogen 3.037 N/A THR 476.A OG1 ARG 473.A O no hydrogen 2.558 N/A TRP 477.A N LEU 474.A O no hydrogen 3.110 N/A ALA 480.A N ASP 478.A OD1 no hydrogen 3.292 N/A PHE 482.A N ASP 478.A O no hydrogen 3.278 N/A ARG 483.A N GLU 479.A O no hydrogen 2.874 N/A GLU 484.A N ALA 480.A O no hydrogen 3.000 N/A LYS 485.A N VAL 481.A O no hydrogen 3.019 N/A ILE 486.A N PHE 482.A O no hydrogen 2.858 N/A LEU 487.A N ARG 483.A O no hydrogen 2.887 N/A HIS 488.A N GLU 484.A O no hydrogen 3.176 N/A ILE 489.A N LYS 485.A O no hydrogen 3.037 N/A GLN 490.A N ILE 486.A O no hydrogen 2.953 N/A GLN 490.A NE2 ALA 193.A O no hydrogen 2.536 N/A GLN 490.A NE2 ASP 196.A OD1 no hydrogen 3.149 N/A THR 491.A N LEU 487.A O no hydrogen 3.030 N/A THR 491.A OG1 LEU 487.A O no hydrogen 3.085 N/A HIS 492.A N HIS 488.A O no hydrogen 2.990 N/A GLU 493.A N ILE 489.A O no hydrogen 2.882 N/A LYS 494.A N GLN 490.A O no hydrogen 2.956 N/A LYS 494.A NZ ASP 153.A OD1 no hydrogen 2.984 N/A LYS 494.A NZ ASP 498.A OD2 no hydrogen 3.462 N/A PHE 495.A N THR 491.A O no hydrogen 3.070 N/A ILE 496.A N HIS 492.A O no hydrogen 3.049 N/A ARG 497.A N GLU 493.A O no hydrogen 2.981 N/A ASP 498.A N LYS 494.A O no hydrogen 2.973 N/A SER 499.A N PHE 495.A O no hydrogen 2.844 N/A SER 499.A OG PHE 495.A O no hydrogen 3.132 N/A GLN 500.A N ILE 496.A O no hydrogen 3.032 N/A ASP 508.A N HIS 618.A O no hydrogen 3.143 N/A LYS 512.A N THR 526.A OG1 no hydrogen 3.030 N/A LYS 513.A N GLU 601.A O no hydrogen 2.880 N/A LYS 513.A NZ GLU 601.A OE2 no hydrogen 3.508 N/A LEU 514.A N CYS 524.A O no hydrogen 2.779 N/A LEU 515.A N VAL 599.A O no hydrogen 2.975 N/A CYS 516.A N ALA 521.A O no hydrogen 3.090 N/A ARG 517.A N SER 597.A O no hydrogen 3.293 N/A ARG 517.A NH1 PHE 598.A O no hydrogen 3.465 N/A ARG 517.A NH1 TYR 611.A O no hydrogen 3.270 N/A LYS 520.A N CYS 516.A O no hydrogen 2.519 N/A LYS 520.A NZ ARG 517.A O no hydrogen 2.611 N/A ALA 523.A N LEU 514.A O no hydrogen 2.849 N/A CYS 524.A N LEU 514.A O no hydrogen 3.064 N/A THR 526.A N LYS 512.A O no hydrogen 3.090 N/A THR 526.A OG1 ASN 511.A OD1 no hydrogen 2.787 N/A THR 526.A OG1 LYS 512.A O no hydrogen 3.454 N/A ALA 527.A N ASN 511.A OD1 no hydrogen 3.261 N/A ASP 528.A N TYR 525.A O no hydrogen 3.213 N/A VAL 529.A N THR 526.A O no hydrogen 3.038 N/A ARG 530.A N THR 538.A O no hydrogen 2.962 N/A ARG 530.A NE GLU 628.A OE2 no hydrogen 3.502 N/A ARG 530.A NH1 ALA 527.A O no hydrogen 3.227 N/A ARG 530.A NH1 VAL 529.A O no hydrogen 3.104 N/A ARG 530.A NH2 ALA 527.A O no hydrogen 3.345 N/A VAL 531.A N ILE 622.A O no hydrogen 2.950 N/A ILE 532.A N HIS 536.A O no hydrogen 2.573 N/A CYS 535.A N GLU 533.A O no hydrogen 2.611 N/A HIS 536.A N ILE 532.A O no hydrogen 3.227 N/A THR 538.A N ARG 530.A O no hydrogen 2.887 N/A THR 538.A OG1 PRO 591.A O no hydrogen 2.465 N/A LEU 540.A N ASP 528.A O no hydrogen 2.841 N/A LYS 545.A N ASP 542.A O no hydrogen 2.764 N/A LYS 545.A NZ ASP 542.A OD1 no hydrogen 3.314 N/A CYS 547.A N PHE 544.A O no hydrogen 2.974 N/A CYS 547.A SG LEU 522.A O no hydrogen 3.874 N/A CYS 547.A SG ALA 523.A O no hydrogen 3.802 N/A CYS 547.A SG ALA 543.A O no hydrogen 3.355 N/A CYS 547.A SG PHE 544.A O no hydrogen 3.370 N/A VAL 549.A N PHE 569.A O no hydrogen 2.779 N/A ARG 551.A N LYS 567.A O no hydrogen 2.900 N/A LYS 555.A N HIS 553.A ND1 no hydrogen 3.072 N/A PHE 562.A N PHE 559.A O no hydrogen 2.875 N/A LYS 564.A N LYS 557.A O no hydrogen 3.139 N/A ARG 565.A N HIS 582.A O no hydrogen 3.008 N/A ARG 565.A NH1 GLU 563.A OE2 no hydrogen 2.987 N/A ALA 566.A N HIS 582.A O no hydrogen 3.155 N/A LYS 567.A N ARG 551.A O no hydrogen 2.856 N/A LYS 567.A NZ ASP 578.A OD1 no hydrogen 2.489 N/A LYS 567.A NZ ASP 578.A OD2 no hydrogen 3.068 N/A LYS 567.A NZ GLY 580.A O no hydrogen 2.872 N/A ILE 568.A N GLY 580.A O no hydrogen 3.217 N/A PHE 569.A N VAL 549.A O no hydrogen 2.924 N/A CYS 570.A N HIS 577.A O no hydrogen 3.196 N/A ALA 571.A N CYS 547.A O no hydrogen 2.810 N/A ASN 574.A N ARG 572.A O no hydrogen 2.664 N/A TRP 579.A N ILE 568.A O no hydrogen 2.921 N/A GLY 580.A N ILE 568.A O no hydrogen 3.383 N/A ILE 581.A N VAL 592.A O no hydrogen 2.863 N/A HIS 582.A N ALA 566.A O no hydrogen 2.577 N/A VAL 583.A N ILE 590.A O no hydrogen 2.893 N/A LYS 584.A N GLU 563.A O no hydrogen 2.919 N/A TYR 585.A N PHE 588.A O no hydrogen 2.580 N/A TYR 585.A OH GLU 533.A OE2 no hydrogen 3.251 N/A PHE 588.A N TYR 585.A O no hydrogen 2.629 N/A ILE 590.A N VAL 583.A O no hydrogen 3.004 N/A VAL 592.A N ILE 581.A O no hydrogen 2.879 N/A ILE 593.A N TYR 537.A O no hydrogen 3.224 N/A LYS 594.A N TRP 579.A O no hydrogen 3.122 N/A LYS 594.A NZ ASP 578.A OD2 no hydrogen 2.605 N/A SER 597.A N LYS 594.A O no hydrogen 3.078 N/A SER 597.A OG ASP 578.A O no hydrogen 2.297 N/A PHE 598.A N ILE 595.A O no hydrogen 3.394 N/A VAL 599.A N LEU 515.A O no hydrogen 2.822 N/A VAL 600.A N THR 609.A O no hydrogen 3.245 N/A GLU 601.A N LYS 513.A O no hydrogen 2.972 N/A ASP 602.A N VAL 607.A O no hydrogen 3.340 N/A GLY 606.A N ASP 602.A O no hydrogen 3.041 N/A VAL 607.A N THR 605.A OG1 no hydrogen 2.848 N/A GLN 608.A NE2 GLU 601.A OE1 no hydrogen 3.397 N/A THR 609.A N VAL 600.A O no hydrogen 3.021 N/A TRP 614.A NE1 ILE 593.A O no hydrogen 3.190 N/A ASP 616.A N LYS 613.A O no hydrogen 3.052 N/A PHE 617.A N TRP 614.A O no hydrogen 3.255 N/A LYS 621.A NZ TRP 614.A O no hydrogen 2.944 N/A LYS 621.A NZ PHE 617.A O no hydrogen 2.627 N/A PHE 624.A N VAL 531.A O no hydrogen 3.019 N/A GLU 628.A N PRO 626.A O no hydrogen 2.760 N/A