Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4y9u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ GLU 54.A O no hydrogen 2.585 N/A LYS 4.A NZ TYR 56.A O no hydrogen 3.197 N/A LYS 4.A NZ ASP 86.A OD2 no hydrogen 3.109 N/A GLU 5.A N GLU 55.A O no hydrogen 2.728 N/A GLU 10.A N SER 7.A OG no hydrogen 3.150 N/A LYS 11.A N SER 7.A O no hydrogen 3.185 N/A LYS 11.A NZ TYR 56.A OH no hydrogen 3.167 N/A MET 12.A N PHE 8.A O no hydrogen 2.910 N/A LYS 13.A N VAL 9.A O no hydrogen 2.873 N/A LYS 13.A NZ GLU 66.A OE2 no hydrogen 2.546 N/A LYS 14.A N GLU 10.A O no hydrogen 2.883 N/A THR 15.A N LYS 11.A O no hydrogen 3.058 N/A THR 15.A N MET 12.A O no hydrogen 3.295 N/A THR 15.A OG1 LYS 11.A O no hydrogen 2.740 N/A GLY 16.A N LYS 13.A O no hydrogen 3.482 N/A ARG 17.A N MET 12.A O no hydrogen 2.860 N/A ARG 17.A NE GLY 48.A O no hydrogen 3.017 N/A ARG 17.A NH1 THR 15.A OG1 no hydrogen 2.739 N/A ARG 17.A NH2 ASP 286.A OD2 no hydrogen 2.809 N/A ASN 18.A N ARG 47.A O no hydrogen 2.985 N/A ASN 18.A ND2 LYS 69.A O no hydrogen 3.168 N/A ILE 19.A N ARG 47.A O no hydrogen 3.290 N/A ILE 20.A N LEU 71.A O no hydrogen 3.225 N/A VAL 21.A N MET 49.A O no hydrogen 2.818 N/A PHE 22.A N VAL 73.A O no hydrogen 2.820 N/A TYR 23.A N ALA 51.A O no hydrogen 3.131 N/A GLY 24.A N CYS 75.A O no hydrogen 2.762 N/A SER 25.A N ASN 83.A OD1 no hydrogen 3.309 N/A GLN 26.A NE2 ASP 82.A OD2 no hydrogen 3.304 N/A THR 27.A OG1 TYR 79.A OH no hydrogen 3.153 N/A GLU 32.A N GLY 28.A O no hydrogen 3.264 N/A PHE 33.A N THR 29.A O no hydrogen 3.042 N/A ALA 34.A N ALA 30.A O no hydrogen 2.924 N/A ASN 35.A N GLU 31.A O no hydrogen 2.987 N/A ASN 35.A ND2 GLU 32.A OE2 no hydrogen 3.548 N/A ARG 36.A N GLU 32.A O no hydrogen 2.981 N/A ARG 36.A NH1 GLU 148.A OE1 no hydrogen 3.074 N/A ARG 36.A NH1 GLU 148.A OE2 no hydrogen 3.142 N/A ARG 36.A NH2 GLU 148.A OE2 no hydrogen 3.015 N/A LEU 37.A N PHE 33.A O no hydrogen 2.921 N/A SER 38.A N ALA 34.A O no hydrogen 2.842 N/A LYS 39.A N ASN 35.A O no hydrogen 2.988 N/A LYS 39.A NZ GLN 178.A OE1 no hydrogen 3.157 N/A ASP 40.A N ARG 36.A O no hydrogen 2.930 N/A ALA 41.A N LEU 37.A O no hydrogen 3.369 N/A HIS 42.A N LYS 39.A O no hydrogen 3.352 N/A ARG 43.A N ASP 40.A O no hydrogen 2.729 N/A ARG 43.A NH1 ASP 40.A OD1 no hydrogen 3.165 N/A TYR 44.A N ALA 41.A O no hydrogen 2.894 N/A GLY 45.A N HIS 42.A O no hydrogen 3.234 N/A MET 46.A N ALA 41.A O no hydrogen 3.108 N/A ARG 47.A N ASN 18.A OD1 no hydrogen 2.975 N/A ARG 47.A NH1 THR 15.A O no hydrogen 2.584 N/A MET 49.A N ILE 19.A O no hydrogen 3.065 N/A SER 50.A OG ASN 35.A OD1 no hydrogen 2.986 N/A ALA 51.A N VAL 21.A O no hydrogen 2.812 N/A GLU 54.A N ASP 52.A OD1 no hydrogen 3.045 N/A GLU 55.A N ASP 52.A O no hydrogen 3.039 N/A TYR 56.A N PRO 53.A O no hydrogen 3.120 N/A ALA 59.A N ASP 57.A OD1 no hydrogen 3.099 N/A ASP 60.A N ASP 57.A O no hydrogen 3.108 N/A LEU 61.A N LEU 58.A O no hydrogen 2.990 N/A SER 62.A N ALA 59.A O no hydrogen 3.222 N/A SER 62.A OG ALA 59.A O no hydrogen 3.072 N/A SER 63.A N ASP 60.A O no hydrogen 2.935 N/A LEU 64.A N LEU 61.A O no hydrogen 2.948 N/A GLU 66.A N SER 63.A O no hydrogen 2.953 N/A ILE 67.A N LEU 64.A O no hydrogen 3.029 N/A LYS 69.A NZ PHE 166.A O no hydrogen 3.543 N/A SER 70.A OG LEU 64.A O no hydrogen 2.898 N/A SER 70.A OG ILE 67.A O no hydrogen 3.069 N/A LEU 71.A N ASN 18.A O no hydrogen 3.025 N/A VAL 72.A N LYS 102.A O no hydrogen 2.927 N/A VAL 73.A N ILE 20.A O no hydrogen 3.008 N/A PHE 74.A N ALA 104.A O no hydrogen 2.936 N/A CYS 75.A N PHE 22.A O no hydrogen 2.856 N/A MET 76.A N PHE 106.A O no hydrogen 3.054 N/A ALA 77.A N GLY 24.A O no hydrogen 3.161 N/A THR 78.A N LEU 108.A O no hydrogen 3.192 N/A THR 81.A OG1 ASN 83.A OD1 no hydrogen 2.656 N/A ASN 83.A ND2 TYR 23.A O no hydrogen 2.899 N/A ASN 83.A ND2 ASP 52.A OD1 no hydrogen 2.855 N/A ALA 84.A N THR 81.A O no hydrogen 2.868 N/A GLN 85.A N ASP 82.A O no hydrogen 3.301 N/A TYR 88.A N ALA 84.A O no hydrogen 2.675 N/A ASP 89.A N GLN 85.A O no hydrogen 2.692 N/A TRP 90.A N ASP 86.A O no hydrogen 2.895 N/A LEU 91.A N PHE 87.A O no hydrogen 2.882 N/A GLN 92.A N TYR 88.A O no hydrogen 3.241 N/A GLU 93.A N ASP 89.A O no hydrogen 3.181 N/A THR 94.A N TRP 90.A O no hydrogen 2.983 N/A VAL 96.A N THR 94.A OG1 no hydrogen 2.981 N/A LEU 98.A N LEU 130.A O no hydrogen 3.040 N/A THR 99.A OG1 ASP 97.A OD1 no hydrogen 2.605 N/A THR 99.A OG1 ASP 97.A OD2 no hydrogen 3.047 N/A VAL 101.A N LEU 98.A O no hydrogen 2.967 N/A PHE 103.A N GLN 133.A O no hydrogen 3.267 N/A ALA 104.A N VAL 72.A O no hydrogen 3.126 N/A PHE 106.A N PHE 74.A O no hydrogen 2.792 N/A GLY 107.A N GLY 139.A O no hydrogen 2.808 N/A LEU 108.A N MET 76.A O no hydrogen 2.882 N/A GLY 109.A N GLY 141.A O no hydrogen 2.925 N/A LYS 111.A N ASP 142.A OD1 no hydrogen 3.268 N/A LYS 111.A NZ ASP 142.A OD2 no hydrogen 2.685 N/A THR 112.A N ASN 110.A OD1 no hydrogen 2.921 N/A THR 112.A OG1 ASN 110.A OD1 no hydrogen 2.688 N/A TYR 113.A N ASN 110.A O no hydrogen 3.040 N/A ASN 117.A ND2 GLY 141.A O no hydrogen 3.217 N/A MET 119.A N THR 78.A OG1 no hydrogen 3.114 N/A LYS 121.A N ASN 117.A O no hydrogen 3.038 N/A LYS 121.A NZ PHE 116.A O no hydrogen 3.311 N/A TYR 122.A N ALA 118.A O no hydrogen 2.916 N/A VAL 123.A N MET 119.A O no hydrogen 3.021 N/A ASP 124.A N GLY 120.A O no hydrogen 3.220 N/A GLN 125.A N LYS 121.A O no hydrogen 3.017 N/A ARG 126.A N TYR 122.A O no hydrogen 2.738 N/A ARG 126.A NE LEU 91.A O no hydrogen 2.883 N/A ARG 126.A NH1 GLN 129.A OE1 no hydrogen 2.768 N/A ARG 126.A NH2 THR 94.A O no hydrogen 3.372 N/A LEU 127.A N VAL 123.A O no hydrogen 2.988 N/A GLN 129.A N GLN 125.A O no hydrogen 3.082 N/A LEU 130.A N ARG 126.A O no hydrogen 2.921 N/A GLY 131.A N GLU 128.A O no hydrogen 2.911 N/A ALA 132.A N LEU 127.A O no hydrogen 3.002 N/A GLN 133.A N VAL 101.A O no hydrogen 2.856 N/A ARG 134.A NE ASP 124.A OD1 no hydrogen 2.638 N/A ARG 134.A NH1 GLU 128.A OE1 no hydrogen 3.032 N/A ARG 134.A NH2 ASP 124.A OD1 no hydrogen 3.338 N/A ARG 134.A NH2 ASP 124.A OD2 no hydrogen 2.858 N/A ARG 134.A NH2 GLU 128.A OE2 no hydrogen 3.245 N/A ILE 135.A N PHE 103.A O no hydrogen 2.735 N/A GLY 139.A N VAL 105.A O no hydrogen 2.863 N/A GLY 141.A N GLY 107.A O no hydrogen 2.852 N/A ASP 142.A N ASP 150.A OD2 no hydrogen 2.951 N/A ASP 143.A N GLY 109.A O no hydrogen 2.995 N/A ASP 144.A N ASP 142.A OD1 no hydrogen 2.626 N/A GLY 145.A N ASP 142.A O no hydrogen 3.153 N/A GLU 149.A N ASN 146.A OD1 no hydrogen 2.903 N/A ASP 150.A N ASN 146.A O no hydrogen 3.190 N/A PHE 151.A N LEU 147.A O no hydrogen 2.905 N/A ILE 152.A N GLU 148.A O no hydrogen 2.939 N/A THR 153.A N GLU 149.A O no hydrogen 2.948 N/A THR 153.A OG1 GLU 149.A O no hydrogen 2.930 N/A TRP 154.A N ASP 150.A O no hydrogen 3.077 N/A TRP 154.A NE1 GLU 137.A O no hydrogen 3.022 N/A ARG 155.A N PHE 151.A O no hydrogen 2.797 N/A ARG 155.A NE ASP 40.A OD1 no hydrogen 3.474 N/A ARG 155.A NE ASP 40.A OD2 no hydrogen 2.733 N/A ARG 155.A NH2 ASP 40.A OD1 no hydrogen 2.991 N/A GLU 156.A N ILE 152.A O no hydrogen 2.990 N/A GLN 157.A N TRP 154.A O no hydrogen 3.117 N/A PHE 158.A N TRP 154.A O no hydrogen 2.781 N/A TRP 159.A N ARG 155.A O no hydrogen 3.381 N/A TRP 159.A NE1 ASP 40.A OD2 no hydrogen 3.025 N/A ALA 161.A N GLN 157.A O no hydrogen 3.231 N/A VAL 162.A N PHE 158.A O no hydrogen 2.913 N/A CYS 163.A N TRP 159.A O no hydrogen 2.818 N/A CYS 163.A SG TRP 159.A O no hydrogen 3.211 N/A GLU 164.A N PRO 160.A O no hydrogen 2.863 N/A PHE 165.A N ALA 161.A O no hydrogen 3.044 N/A PHE 166.A N VAL 162.A O no hydrogen 2.997 N/A GLY 167.A N GLU 164.A O no hydrogen 3.343 N/A VAL 168.A N CYS 163.A O no hydrogen 2.899 N/A SER 175.A OG GLU 322.A OE2 no hydrogen 2.916 N/A ARG 177.A NE GLU 380.A OE2 no hydrogen 2.872 N/A ARG 177.A NH1 ASP 376.A OD2 no hydrogen 2.996 N/A ARG 177.A NH2 ASP 376.A OD2 no hydrogen 2.831 N/A ARG 177.A NH2 GLU 380.A OE2 no hydrogen 3.289 N/A GLN 178.A N GLU 380.A OE1 no hydrogen 2.855 N/A TYR 179.A N GLU 380.A OE2 no hydrogen 3.205 N/A GLU 180.A N ASN 283.A O no hydrogen 2.784 N/A VAL 182.A N SER 281.A O no hydrogen 2.917 N/A HIS 184.A N ILE 279.A O no hydrogen 2.909 N/A HIS 184.A NE2 SER 281.A OG no hydrogen 3.061 N/A LYS 191.A N ASP 188.A O no hydrogen 2.828 N/A VAL 192.A N VAL 189.A O no hydrogen 3.293 N/A TYR 193.A N PRO 298.A O no hydrogen 2.756 N/A TYR 193.A OH GLY 198.A O no hydrogen 3.057 N/A THR 194.A N GLU 196.A OE1 no hydrogen 2.625 N/A THR 194.A OG1 GLU 196.A OE1 no hydrogen 3.377 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.650 N/A LYS 201.A N GLU 196.A OE2 no hydrogen 2.720 N/A SER 202.A N ARG 199.A O no hydrogen 2.990 N/A SER 202.A OG ARG 199.A O no hydrogen 2.626 N/A GLU 204.A N LYS 201.A O no hydrogen 3.104 N/A ASN 205.A N LYS 201.A O no hydrogen 2.767 N/A GLN 206.A NE2 SER 202.A O no hydrogen 3.049 N/A GLN 206.A NE2 PRO 215.A O no hydrogen 3.124 N/A ASP 211.A N ASN 214.A O no hydrogen 2.899 N/A LYS 213.A N ASP 211.A OD1 no hydrogen 2.864 N/A ASN 214.A N ASP 211.A OD1 no hydrogen 2.896 N/A ASN 214.A ND2 LYS 207.A O no hydrogen 2.816 N/A ASN 214.A ND2 PRO 209.A O no hydrogen 3.085 N/A PHE 216.A N MET 441.A O no hydrogen 2.725 N/A LEU 217.A N GLN 206.A OE1 no hydrogen 2.732 N/A ALA 218.A N VAL 439.A O no hydrogen 2.907 N/A VAL 220.A N ALA 437.A O no hydrogen 2.848 N/A THR 221.A N GLU 238.A O no hydrogen 2.930 N/A THR 221.A OG1 GLU 238.A O no hydrogen 3.180 N/A ASN 223.A ND2 LEU 428.A O no hydrogen 3.202 N/A ASN 223.A ND2 ARG 429.A O no hydrogen 3.280 N/A ASN 223.A ND2 LYS 431.A O no hydrogen 2.723 N/A ARG 224.A N HIS 236.A O no hydrogen 3.028 N/A LYS 225.A NZ ASN 227.A OD1 no hydrogen 3.052 N/A LYS 225.A NZ GLY 229.A O no hydrogen 2.970 N/A LEU 226.A N LEU 234.A O no hydrogen 2.746 N/A ASN 227.A ND2 ARG 232.A O no hydrogen 2.675 N/A GLN 228.A NE2 TYR 503.A O no hydrogen 2.919 N/A GLY 229.A N GLU 501.A O no hydrogen 2.800 N/A GLU 231.A N GLU 501.A OE1 no hydrogen 3.135 N/A ARG 232.A NH2 ASP 502.A OD2 no hydrogen 3.033 N/A LEU 234.A N ASN 227.A OD1 no hydrogen 2.999 N/A MET 235.A N ALA 407.A O no hydrogen 2.851 N/A HIS 236.A N ARG 224.A O no hydrogen 2.922 N/A HIS 236.A ND1 TYR 505.A OH no hydrogen 2.789 N/A HIS 236.A NE2 GLU 238.A OE1 no hydrogen 2.858 N/A LEU 237.A N ILE 405.A O no hydrogen 2.937 N/A GLU 238.A N ALA 222.A O no hydrogen 2.948 N/A LEU 239.A N VAL 403.A O no hydrogen 2.966 N/A ASP 240.A N ALA 219.A O no hydrogen 2.819 N/A ILE 241.A N ASN 401.A O no hydrogen 3.091 N/A SER 242.A N ASP 240.A OD1 no hydrogen 2.864 N/A SER 242.A OG ASP 240.A OD1 no hydrogen 2.670 N/A SER 244.A N ILE 241.A O no hydrogen 3.114 N/A SER 244.A OG ILE 241.A O no hydrogen 2.556 N/A ILE 246.A N SER 244.A OG no hydrogen 3.112 N/A TYR 248.A OH SER 394.A OG no hydrogen 2.971 N/A TYR 248.A OH HIS 399.A O no hydrogen 2.722 N/A TYR 248.A OH SER 402.A O no hydrogen 2.783 N/A GLU 249.A N ASP 252.A OD2 no hydrogen 2.931 N/A SER 250.A OG SER 394.A O no hydrogen 3.422 N/A SER 250.A OG GLU 476.A OE1 no hydrogen 3.357 N/A ASP 252.A N GLU 249.A O no hydrogen 2.926 N/A HIS 253.A N ARG 444.A O no hydrogen 3.104 N/A HIS 253.A NE2 ASP 605.A OD1 no hydrogen 2.937 N/A VAL 254.A N TYR 390.A O no hydrogen 2.872 N/A ALA 255.A N PHE 442.A O no hydrogen 2.893 N/A VAL 256.A N ARG 388.A O no hydrogen 2.954 N/A TYR 257.A N PRO 440.A O no hydrogen 3.064 N/A TYR 257.A OH ALA 212.A O no hydrogen 2.604 N/A ASN 260.A N THR 306.A O no hydrogen 2.885 N/A ASN 260.A ND2 LEU 305.A O no hydrogen 2.926 N/A ASN 260.A ND2 LEU 309.A O no hydrogen 2.870 N/A LEU 264.A N ASP 261.A OD1 no hydrogen 3.124 N/A VAL 265.A N ASP 261.A O no hydrogen 3.116 N/A ASN 266.A N SER 262.A O no hydrogen 2.838 N/A GLN 267.A N ALA 263.A O no hydrogen 2.979 N/A ILE 268.A N LEU 264.A O no hydrogen 3.155 N/A GLY 269.A N VAL 265.A O no hydrogen 3.219 N/A GLU 270.A N ASN 266.A O no hydrogen 2.949 N/A ILE 271.A N GLN 267.A O no hydrogen 2.828 N/A LEU 272.A N ILE 268.A O no hydrogen 3.113 N/A GLY 273.A N GLU 270.A O no hydrogen 3.087 N/A ALA 274.A N GLY 269.A O no hydrogen 2.967 N/A ASP 277.A N ASP 275.A OD1 no hydrogen 2.978 N/A VAL 278.A N ASP 275.A O no hydrogen 3.366 N/A MET 280.A N THR 299.A O no hydrogen 2.938 N/A SER 281.A N VAL 182.A O no hydrogen 2.929 N/A SER 281.A OG HIS 184.A NE2 no hydrogen 3.061 N/A ASN 283.A N GLU 180.A O no hydrogen 2.900 N/A ASN 284.A N LYS 292.A O no hydrogen 2.944 N/A ASN 284.A ND2 LYS 291.A O no hydrogen 2.658 N/A LEU 285.A N GLN 178.A O no hydrogen 2.845 N/A ASP 286.A N ASN 284.A OD1 no hydrogen 2.955 N/A GLU 288.A N ASP 286.A OD1 no hydrogen 2.974 N/A SER 289.A N ASP 286.A O no hydrogen 3.183 N/A LYS 291.A N SER 289.A OG no hydrogen 3.253 N/A LYS 292.A N ASN 290.A O no hydrogen 2.995 N/A LYS 292.A NZ GLU 287.A O no hydrogen 3.142 N/A HIS 293.A ND1 LEU 282.A O no hydrogen 2.979 N/A CYS 297.A SG PHE 295.A O no hydrogen 3.386 N/A THR 299.A N MET 280.A O no hydrogen 2.936 N/A THR 299.A OG1 TYR 193.A O no hydrogen 2.920 N/A THR 300.A OG1 THR 303.A OG1 no hydrogen 3.216 N/A ARG 302.A N LEU 276.A O no hydrogen 2.912 N/A ARG 302.A NE ASP 277.A OD1 no hydrogen 2.780 N/A ARG 302.A NH2 ASP 277.A OD1 no hydrogen 3.438 N/A ARG 302.A NH2 ASP 277.A OD2 no hydrogen 3.010 N/A THR 303.A N THR 300.A OG1 no hydrogen 3.056 N/A THR 303.A OG1 THR 300.A OG1 no hydrogen 3.216 N/A ALA 304.A N THR 300.A O no hydrogen 3.009 N/A LEU 305.A N TYR 301.A O no hydrogen 2.837 N/A THR 306.A N ARG 302.A O no hydrogen 2.949 N/A THR 306.A N THR 303.A O no hydrogen 3.176 N/A THR 306.A OG1 ARG 302.A O no hydrogen 2.669 N/A TYR 307.A N THR 303.A O no hydrogen 2.880 N/A TYR 308.A N ALA 304.A O no hydrogen 2.978 N/A TYR 308.A OH GLU 196.A O no hydrogen 2.616 N/A LEU 309.A N ALA 304.A O no hydrogen 2.901 N/A ASP 310.A N PRO 383.A O no hydrogen 2.901 N/A THR 312.A N ASP 310.A OD1 no hydrogen 3.096 N/A THR 312.A OG1 ASP 310.A OD1 no hydrogen 3.569 N/A ASN 313.A N ASP 310.A OD1 no hydrogen 2.976 N/A ASN 313.A ND2 ASP 310.A OD2 no hydrogen 2.760 N/A ARG 316.A NH1 GLU 148.A OE1 no hydrogen 3.048 N/A THR 317.A N GLU 148.A OE2 no hydrogen 3.022 N/A THR 317.A OG1 GLU 148.A OE2 no hydrogen 2.624 N/A LEU 320.A N ARG 316.A O no hydrogen 3.304 N/A TYR 321.A N THR 317.A O no hydrogen 2.847 N/A GLU 322.A N ASN 318.A O no hydrogen 2.929 N/A LEU 323.A N VAL 319.A O no hydrogen 3.022 N/A LEU 323.A N LEU 320.A O no hydrogen 3.239 N/A ALA 324.A N LEU 320.A O no hydrogen 3.107 N/A GLN 325.A NE2 SER 175.A OG no hydrogen 2.941 N/A GLN 325.A NE2 GLU 322.A O no hydrogen 2.805 N/A TYR 326.A N LEU 323.A O no hydrogen 2.837 N/A TYR 326.A OH HIS 377.A ND1 no hydrogen 2.652 N/A ALA 327.A N ALA 324.A O no hydrogen 3.070 N/A SER 328.A N SER 370.A O no hydrogen 3.232 N/A GLU 329.A N SER 370.A OG no hydrogen 3.018 N/A SER 331.A N GLU 329.A OE2 no hydrogen 3.143 N/A SER 331.A OG GLU 329.A OE2 no hydrogen 3.081 N/A GLU 332.A N GLU 329.A O no hydrogen 2.900 N/A GLN 333.A N GLU 329.A O no hydrogen 2.987 N/A GLU 334.A N PRO 330.A O no hydrogen 2.900 N/A HIS 335.A N SER 331.A O no hydrogen 3.054 N/A LEU 336.A N GLU 332.A O no hydrogen 2.993 N/A HIS 337.A N GLN 333.A O no hydrogen 2.930 N/A LYS 338.A N GLU 334.A O no hydrogen 2.940 N/A LYS 338.A NZ GLU 345.A OE1 no hydrogen 3.455 N/A MET 339.A N LEU 336.A O no hydrogen 3.306 N/A SER 341.A N LYS 338.A O no hydrogen 3.097 N/A SER 341.A OG LYS 338.A O no hydrogen 2.684 N/A SER 342.A OG GLU 156.A OE1 no hydrogen 2.526 N/A SER 342.A OG GLU 156.A OE2 no hydrogen 3.393 N/A LYS 347.A NZ SER 342.A O no hydrogen 3.172 N/A GLU 348.A N GLY 344.A O no hydrogen 3.104 N/A LEU 349.A N GLU 345.A O no hydrogen 2.864 N/A TYR 350.A N GLY 346.A O no hydrogen 3.054 N/A TYR 350.A OH PRO 315.A O no hydrogen 3.184 N/A LEU 351.A N LYS 347.A O no hydrogen 2.959 N/A SER 352.A N GLU 348.A O no hydrogen 2.955 N/A SER 352.A OG GLU 348.A O no hydrogen 3.153 N/A SER 352.A OG LEU 349.A O no hydrogen 3.568 N/A TRP 353.A N LEU 349.A O no hydrogen 2.719 N/A VAL 354.A N TYR 350.A O no hydrogen 3.111 N/A VAL 355.A N TYR 350.A O no hydrogen 3.044 N/A GLU 356.A N LEU 351.A O no hydrogen 2.813 N/A ALA 357.A N SER 352.A O no hydrogen 3.079 N/A ARG 358.A N VAL 355.A O no hydrogen 3.051 N/A ARG 358.A NE TYR 412.A OH no hydrogen 3.194 N/A ARG 358.A NH1 ASN 313.A OD1 no hydrogen 3.094 N/A ARG 359.A N VAL 354.A O no hydrogen 2.969 N/A ARG 359.A NE ASP 367.A OD2 no hydrogen 2.792 N/A ARG 359.A NH1 TRP 353.A O no hydrogen 2.877 N/A ARG 359.A NH2 ASP 367.A OD2 no hydrogen 3.212 N/A ALA 363.A N HIS 360.A ND1 no hydrogen 3.149 N/A ILE 364.A N HIS 360.A O no hydrogen 3.124 N/A LEU 365.A N ILE 361.A O no hydrogen 2.886 N/A GLN 366.A N LEU 362.A O no hydrogen 2.841 N/A ASP 367.A N ALA 363.A O no hydrogen 2.781 N/A TYR 368.A N ILE 364.A O no hydrogen 2.860 N/A SER 370.A N GLU 332.A OE2 no hydrogen 2.942 N/A SER 370.A OG GLU 332.A OE2 no hydrogen 2.466 N/A LEU 371.A N TYR 368.A O no hydrogen 3.008 N/A ARG 372.A N TYR 326.A O no hydrogen 3.074 N/A ARG 372.A NH1 LEU 365.A O no hydrogen 3.094 N/A ARG 372.A NH1 LEU 371.A O no hydrogen 2.766 N/A HIS 377.A N PRO 374.A O no hydrogen 3.244 N/A HIS 377.A ND1 TYR 326.A OH no hydrogen 2.652 N/A LEU 378.A N PRO 374.A O no hydrogen 3.210 N/A CYS 379.A N ILE 375.A O no hydrogen 2.957 N/A CYS 379.A SG ILE 375.A O no hydrogen 3.424 N/A GLU 380.A N ASP 376.A O no hydrogen 3.199 N/A LEU 381.A N HIS 377.A O no hydrogen 3.026 N/A LEU 381.A N LEU 378.A O no hydrogen 2.954 N/A LEU 382.A N LEU 378.A O no hydrogen 3.004 N/A ARG 384.A NE TYR 308.A O no hydrogen 2.828 N/A LEU 385.A N TYR 308.A O no hydrogen 2.812 N/A GLN 386.A NE2 ARG 384.A O no hydrogen 3.335 N/A ARG 388.A N VAL 256.A O no hydrogen 2.944 N/A ARG 388.A NH2 GLN 386.A O no hydrogen 2.708 N/A TYR 390.A N VAL 254.A O no hydrogen 2.880 N/A SER 391.A OG ASP 605.A OD2 no hydrogen 2.586 N/A ILE 392.A N ASP 252.A O no hydrogen 3.167 N/A ALA 393.A N HIS 404.A O no hydrogen 2.811 N/A SER 394.A OG TYR 248.A OH no hydrogen 2.971 N/A SER 394.A OG SER 402.A O no hydrogen 3.420 N/A SER 395.A N GLN 475.A OE1 no hydrogen 3.085 N/A SER 395.A OG GLU 476.A OE1 no hydrogen 2.452 N/A SER 396.A OG TYR 248.A O no hydrogen 2.713 N/A LYS 397.A N SER 395.A OG no hydrogen 3.147 N/A VAL 398.A N SER 395.A O no hydrogen 3.052 N/A HIS 399.A N SER 395.A O no hydrogen 2.715 N/A SER 402.A N HIS 399.A O no hydrogen 3.246 N/A SER 402.A OG LEU 239.A O no hydrogen 3.405 N/A VAL 403.A N LEU 239.A O no hydrogen 2.973 N/A HIS 404.A N SER 394.A OG no hydrogen 3.166 N/A ILE 405.A N LEU 237.A O no hydrogen 2.868 N/A ALA 407.A N MET 235.A O no hydrogen 2.998 N/A ALA 409.A N HIS 233.A O no hydrogen 2.939 N/A VAL 410.A N THR 425.A OG1 no hydrogen 2.991 N/A TYR 412.A N ASN 420.A O no hydrogen 3.057 N/A ALA 414.A N ARG 418.A O no hydrogen 2.943 N/A GLY 417.A N ALA 414.A O no hydrogen 2.890 N/A ARG 418.A N SER 416.A OG no hydrogen 3.396 N/A ARG 418.A NH1 GLN 366.A OE1 no hydrogen 2.826 N/A ARG 418.A NH1 ASP 367.A OD1 no hydrogen 3.253 N/A ARG 418.A NH2 ASP 367.A OD2 no hydrogen 2.811 N/A ARG 418.A NH2 SER 416.A O no hydrogen 2.917 N/A ASN 420.A N TYR 412.A O no hydrogen 2.863 N/A ASN 420.A ND2 ARG 358.A O no hydrogen 3.220 N/A ASN 420.A ND2 TYR 412.A OH no hydrogen 2.937 N/A GLY 422.A N VAL 410.A O no hydrogen 2.837 N/A SER 426.A N GLY 422.A O no hydrogen 2.985 N/A SER 426.A OG GLY 422.A O no hydrogen 2.720 N/A TRP 427.A N VAL 423.A O no hydrogen 3.142 N/A LEU 428.A N ALA 424.A O no hydrogen 2.774 N/A ARG 429.A N THR 425.A O no hydrogen 2.802 N/A ALA 430.A N SER 426.A O no hydrogen 3.176 N/A LYS 431.A N LEU 428.A O no hydrogen 3.036 N/A LYS 431.A NZ LEU 438.A O no hydrogen 2.970 N/A VAL 439.A N ALA 218.A O no hydrogen 2.757 N/A MET 441.A N PHE 216.A O no hydrogen 2.771 N/A PHE 442.A N ALA 255.A O no hydrogen 3.162 N/A ARG 444.A N HIS 253.A O no hydrogen 2.928 N/A SER 446.A N ASP 252.A OD1 no hydrogen 2.862 N/A SER 446.A OG GLY 251.A O no hydrogen 2.555 N/A PHE 448.A N SER 446.A OG no hydrogen 3.173 N/A ARG 449.A NH1 ASP 252.A OD1 no hydrogen 2.956 N/A ARG 449.A NH1 PHE 448.A O no hydrogen 3.104 N/A ARG 449.A NH2 ASP 252.A OD1 no hydrogen 2.748 N/A SER 454.A OG GLU 486.A O no hydrogen 2.707 N/A THR 456.A N LYS 453.A O no hydrogen 3.188 N/A VAL 458.A N GLU 489.A O no hydrogen 2.838 N/A ILE 459.A N HIS 556.A O no hydrogen 2.908 N/A MET 460.A N LEU 491.A O no hydrogen 2.884 N/A VAL 461.A N TYR 558.A O no hydrogen 2.775 N/A GLY 462.A N TYR 493.A O no hydrogen 3.054 N/A GLY 464.A N GLY 495.A O no hydrogen 2.777 N/A GLY 466.A N PRO 463.A O no hydrogen 2.925 N/A ILE 467.A N GLY 464.A O no hydrogen 3.122 N/A ALA 468.A N THR 465.A O no hydrogen 3.187 N/A MET 471.A N ILE 467.A O no hydrogen 3.243 N/A MET 471.A N ALA 468.A O no hydrogen 3.272 N/A PHE 473.A N PRO 469.A O no hydrogen 2.954 N/A ILE 474.A N PHE 470.A O no hydrogen 2.802 N/A GLN 475.A N MET 471.A O no hydrogen 3.032 N/A GLU 476.A N GLY 472.A O no hydrogen 2.883 N/A ARG 477.A N PHE 473.A O no hydrogen 2.939 N/A ARG 477.A NE THR 490.A OG1 no hydrogen 2.978 N/A ARG 477.A NH1 THR 456.A O no hydrogen 3.131 N/A ARG 477.A NH2 THR 456.A O no hydrogen 2.883 N/A ARG 477.A NH2 GLU 489.A O no hydrogen 3.151 N/A ARG 477.A NH2 THR 490.A OG1 no hydrogen 3.237 N/A ALA 478.A N ILE 474.A O no hydrogen 2.892 N/A TRP 479.A N GLN 475.A O no hydrogen 2.983 N/A LEU 480.A N GLU 476.A O no hydrogen 2.914 N/A ARG 481.A N ARG 477.A O no hydrogen 3.156 N/A GLU 482.A N ALA 478.A O no hydrogen 3.041 N/A GLN 483.A N TRP 479.A O no hydrogen 2.794 N/A GLY 484.A N ARG 481.A O no hydrogen 3.204 N/A LYS 485.A N LEU 480.A O no hydrogen 3.004 N/A GLY 488.A N SER 454.A O no hydrogen 2.982 N/A THR 490.A N THR 519.A OG1 no hydrogen 2.826 N/A THR 490.A OG1 GLY 488.A O no hydrogen 3.495 N/A LEU 491.A N VAL 458.A O no hydrogen 2.863 N/A LEU 492.A N GLN 520.A O no hydrogen 3.101 N/A TYR 493.A N MET 460.A O no hydrogen 2.743 N/A TYR 493.A OH ASP 542.A OD2 no hydrogen 2.702 N/A TYR 494.A N ASN 522.A O no hydrogen 2.790 N/A TYR 494.A OH ASP 502.A O no hydrogen 3.224 N/A CYS 496.A N ALA 524.A O no hydrogen 3.065 N/A CYS 496.A SG ARG 498.A O no hydrogen 3.811 N/A ARG 497.A N ASP 502.A OD1 no hydrogen 2.959 N/A ARG 497.A NH1 GLU 231.A OE1 no hydrogen 3.128 N/A ARG 498.A N ASP 502.A OD1 no hydrogen 3.489 N/A ARG 498.A NE ASP 500.A OD1 no hydrogen 3.563 N/A ARG 498.A NH1 ARG 527.A O no hydrogen 2.927 N/A SER 499.A N GLU 528.A OE1 no hydrogen 2.702 N/A SER 499.A OG GLU 528.A OE1 no hydrogen 2.973 N/A GLU 501.A N ARG 498.A O no hydrogen 2.898 N/A ASP 502.A N ARG 498.A O no hydrogen 3.203 N/A TYR 503.A N GLN 228.A OE1 no hydrogen 3.042 N/A LEU 504.A N TYR 494.A OH no hydrogen 2.920 N/A TYR 505.A OH HIS 236.A ND1 no hydrogen 2.789 N/A ARG 506.A NE GLU 507.A OE2 no hydrogen 2.825 N/A ARG 506.A NH1 SER 499.A O no hydrogen 3.039 N/A ARG 506.A NH2 GLU 507.A OE2 no hydrogen 3.298 N/A GLU 508.A N GLU 508.A OE1 no hydrogen 2.665 N/A LEU 509.A N TYR 505.A O no hydrogen 2.802 N/A ALA 510.A N ARG 506.A O no hydrogen 3.003 N/A ARG 511.A N GLU 507.A O no hydrogen 3.088 N/A ARG 511.A NH1 ASP 515.A OD1 no hydrogen 2.681 N/A PHE 512.A N GLU 508.A O no hydrogen 3.030 N/A HIS 513.A N LEU 509.A O no hydrogen 2.927 N/A LYS 514.A N ALA 510.A O no hydrogen 2.830 N/A ASP 515.A N ARG 511.A O no hydrogen 2.869 N/A GLY 516.A N HIS 513.A O no hydrogen 3.058 N/A ALA 517.A N PHE 512.A O no hydrogen 2.729 N/A LEU 518.A N PHE 512.A O no hydrogen 3.153 N/A THR 519.A N THR 490.A O no hydrogen 2.666 N/A THR 519.A OG1 THR 490.A O no hydrogen 3.515 N/A ASN 522.A N LEU 492.A O no hydrogen 2.880 N/A ASN 522.A ND2 GLN 520.A OE1 no hydrogen 2.961 N/A ALA 524.A N TYR 494.A O no hydrogen 2.813 N/A SER 526.A N CYS 496.A O no hydrogen 2.880 N/A SER 526.A OG CYS 496.A O no hydrogen 3.439 N/A ARG 527.A N ARG 497.A O no hydrogen 2.863 N/A GLN 529.A NE2 PHE 525.A O no hydrogen 2.874 N/A GLN 529.A NE2 HIS 531.A O no hydrogen 2.991 N/A TYR 534.A N HIS 537.A ND1 no hydrogen 2.776 N/A GLN 536.A N GLN 536.A OE1 no hydrogen 2.711 N/A HIS 537.A N TYR 534.A O no hydrogen 2.950 N/A LEU 538.A N VAL 535.A O no hydrogen 2.855 N/A LEU 539.A N VAL 535.A O no hydrogen 2.943 N/A LYS 540.A N GLN 536.A O no hydrogen 2.992 N/A ARG 541.A N HIS 537.A O no hydrogen 3.065 N/A ARG 541.A NE ASP 542.A OD1 no hydrogen 2.887 N/A ARG 541.A NH2 ASN 522.A OD1 no hydrogen 2.889 N/A ARG 541.A NH2 ASP 542.A OD1 no hydrogen 3.503 N/A ARG 541.A NH2 ASP 542.A OD2 no hydrogen 2.942 N/A ASP 542.A N LEU 538.A O no hydrogen 2.992 N/A ARG 543.A N LYS 540.A O no hydrogen 3.126 N/A ARG 543.A NE GLU 580.A OE2 no hydrogen 3.374 N/A ARG 543.A NH1 LYS 540.A O no hydrogen 2.819 N/A HIS 545.A NE2 GLU 489.A OE1 no hydrogen 2.828 N/A LEU 546.A N ASP 542.A O no hydrogen 2.956 N/A TRP 547.A N ARG 543.A O no hydrogen 2.864 N/A LYS 548.A N GLU 544.A O no hydrogen 3.150 N/A LEU 549.A N HIS 545.A O no hydrogen 2.983 N/A ILE 550.A N LEU 546.A O no hydrogen 2.819 N/A HIS 551.A N TRP 547.A O no hydrogen 2.702 N/A HIS 551.A ND1 TYR 592.A OH no hydrogen 3.153 N/A GLU 552.A N LYS 548.A O no hydrogen 2.857 N/A GLY 553.A N LYS 548.A O no hydrogen 3.029 N/A ALA 555.A N LEU 549.A O no hydrogen 2.942 N/A HIS 556.A N PRO 457.A O no hydrogen 2.867 N/A ILE 557.A N ARG 601.A O no hydrogen 2.821 N/A TYR 558.A N ILE 459.A O no hydrogen 2.842 N/A TYR 558.A OH ARG 449.A O no hydrogen 2.493 N/A VAL 559.A N SER 603.A O no hydrogen 2.893 N/A CYS 560.A N VAL 461.A O no hydrogen 2.879 N/A CYS 560.A SG GLY 466.A O no hydrogen 3.197 N/A CYS 560.A SG ASP 605.A O no hydrogen 3.172 N/A CYS 560.A SG ASP 605.A OD2 no hydrogen 3.689 N/A GLY 561.A N ASP 605.A O no hydrogen 3.059 N/A ALA 563.A N TRP 607.A O no hydrogen 2.958 N/A ARG 564.A NH2 SER 608.A O no hydrogen 3.294 N/A ASN 565.A N ASP 562.A OD2 no hydrogen 2.766 N/A MET 566.A N ASP 562.A OD2 no hydrogen 2.886 N/A ALA 567.A N ASP 562.A O no hydrogen 3.055 N/A LYS 568.A NZ THR 112.A O no hydrogen 3.461 N/A ASP 569.A N ASN 565.A O no hydrogen 2.946 N/A VAL 570.A N MET 566.A O no hydrogen 2.864 N/A GLN 571.A N ALA 567.A O no hydrogen 2.941 N/A GLN 571.A NE2 GLU 114.A OE1 no hydrogen 2.714 N/A GLN 571.A NE2 TYR 575.A OH no hydrogen 2.607 N/A ASN 572.A N LYS 568.A O no hydrogen 2.882 N/A THR 573.A N ASP 569.A O no hydrogen 2.999 N/A THR 573.A OG1 ASP 569.A O no hydrogen 3.372 N/A PHE 574.A N VAL 570.A O no hydrogen 3.002 N/A TYR 575.A N GLN 571.A O no hydrogen 2.948 N/A ASP 576.A N ASN 572.A O no hydrogen 3.027 N/A ILE 577.A N THR 573.A O no hydrogen 2.998 N/A VAL 578.A N PHE 574.A O no hydrogen 3.027 N/A ALA 579.A N TYR 575.A O no hydrogen 2.800 N/A GLU 580.A N ASP 576.A O no hydrogen 3.010 N/A PHE 581.A N ILE 577.A O no hydrogen 2.998 N/A GLY 582.A N VAL 578.A O no hydrogen 2.742 N/A MET 584.A N ALA 579.A O no hydrogen 2.901 N/A ALA 589.A N GLU 585.A O no hydrogen 2.902 N/A VAL 590.A N HIS 586.A O no hydrogen 2.897 N/A ASP 591.A N THR 587.A O no hydrogen 3.216 N/A TYR 592.A N GLN 588.A O no hydrogen 2.919 N/A TYR 592.A OH HIS 551.A ND1 no hydrogen 3.153 N/A VAL 593.A N ALA 589.A O no hydrogen 3.042 N/A LYS 594.A N VAL 590.A O no hydrogen 2.827 N/A LYS 594.A NZ GLU 114.A OE2 no hydrogen 3.227 N/A LYS 595.A N ASP 591.A O no hydrogen 2.902 N/A LEU 596.A N TYR 592.A O no hydrogen 3.126 N/A MET 597.A N VAL 593.A O no hydrogen 3.242 N/A THR 598.A N LYS 594.A O no hydrogen 3.334 N/A THR 598.A OG1 LYS 595.A O no hydrogen 2.665 N/A LYS 599.A N LYS 595.A O no hydrogen 2.961 N/A GLY 600.A N MET 597.A O no hydrogen 3.250 N/A ARG 601.A N LEU 596.A O no hydrogen 2.701 N/A ARG 601.A NE ALA 555.A O no hydrogen 3.085 N/A ARG 601.A NH2 ILE 550.A O no hydrogen 2.747 N/A ARG 601.A NH2 ALA 555.A O no hydrogen 2.994 N/A SER 603.A N ILE 557.A O no hydrogen 2.847 N/A ASP 605.A N VAL 559.A O no hydrogen 2.941 N/A TRP 607.A N GLY 561.A O no hydrogen 2.962 N/A