Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nke_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A N ARG 47.A O no hydrogen 2.970 N/A ALA 8.A N PHE 49.A O no hydrogen 3.094 N/A MET 15.A N THR 12.A O no hydrogen 2.959 N/A LEU 16.A N GLU 13.A O no hydrogen 2.973 N/A LYS 19.A NZ GLU 162.A OE1 no hydrogen 2.831 N/A LYS 19.A NZ GLU 162.A OE2 no hydrogen 3.164 N/A ALA 20.A N LYS 71.A O no hydrogen 3.008 N/A ALA 21.A N VAL 42.A O no hydrogen 2.875 N/A LEU 22.A N SER 73.A O no hydrogen 2.853 N/A VAL 23.A N ALA 40.A O no hydrogen 2.920 N/A GLU 25.A N GLY 38.A O no hydrogen 3.090 N/A ASN 30.A ND2 GLU 324.A OE1 no hydrogen 3.095 N/A TYR 31.A OH GLU 193.A OE1 no hydrogen 3.304 N/A TYR 31.A OH GLU 193.A OE2 no hydrogen 2.559 N/A HIS 32.A N ASN 30.A OD1 no hydrogen 3.133 N/A HIS 32.A NE2 THR 308.A O no hydrogen 3.117 N/A ALA 34.A N TYR 31.A O no hydrogen 3.234 N/A VAL 37.A N GLU 25.A O no hydrogen 2.931 N/A ILE 39.A N LEU 50.A O no hydrogen 3.091 N/A ALA 40.A N VAL 23.A O no hydrogen 2.993 N/A VAL 41.A N PHE 48.A O no hydrogen 2.925 N/A VAL 42.A N ALA 21.A O no hydrogen 3.024 N/A ASN 43.A N GLY 46.A O no hydrogen 2.997 N/A ASN 43.A ND2 GLU 14.A O no hydrogen 3.021 N/A HIS 45.A N ASN 43.A OD1 no hydrogen 2.621 N/A GLY 46.A N ASN 43.A O no hydrogen 3.194 N/A ARG 47.A NH1 ALA 4.A O no hydrogen 2.859 N/A PHE 48.A N VAL 41.A O no hydrogen 2.765 N/A PHE 49.A N THR 6.A O no hydrogen 2.860 N/A LEU 50.A N ILE 39.A O no hydrogen 2.845 N/A ARG 51.A NE GLU 144.A OE2 no hydrogen 2.724 N/A ARG 51.A NH1 ASP 9.A OD1 no hydrogen 3.417 N/A ARG 51.A NH2 GLU 144.A OE1 no hydrogen 3.141 N/A GLU 53.A N GLU 53.A OE2 no hydrogen 2.725 N/A THR 54.A N ARG 51.A O no hydrogen 3.103 N/A ALA 55.A N ARG 51.A O no hydrogen 3.060 N/A LEU 56.A N PRO 52.A O no hydrogen 2.962 N/A ALA 57.A N THR 54.A O no hydrogen 3.273 N/A ASP 58.A N ALA 55.A O no hydrogen 2.970 N/A PHE 61.A N ASP 58.A OD2 no hydrogen 2.813 N/A VAL 62.A N ASP 58.A O no hydrogen 2.975 N/A ALA 63.A N PRO 59.A O no hydrogen 3.034 N/A TRP 64.A N GLN 60.A O no hydrogen 2.950 N/A TRP 64.A NE1 ALA 17.A O no hydrogen 2.934 N/A LEU 65.A N PHE 61.A O no hydrogen 2.933 N/A GLY 66.A N VAL 62.A O no hydrogen 3.144 N/A ASP 67.A N TRP 64.A O no hydrogen 3.251 N/A THR 69.A N ASP 67.A OD1 no hydrogen 2.832 N/A THR 69.A OG1 ASP 67.A OD1 no hydrogen 2.674 N/A THR 69.A OG1 ASP 67.A OD2 no hydrogen 3.289 N/A LYS 70.A N ASP 67.A O no hydrogen 3.094 N/A LYS 71.A N ASP 18.A O no hydrogen 2.993 N/A LYS 71.A NZ GLU 68.A O no hydrogen 2.729 N/A LYS 72.A N GLY 93.A O no hydrogen 2.929 N/A LYS 72.A NZ TRP 64.A O no hydrogen 2.858 N/A LYS 72.A NZ LEU 65.A O no hydrogen 3.084 N/A LYS 72.A NZ ASP 67.A O no hydrogen 3.092 N/A LYS 72.A NZ LYS 70.A O no hydrogen 2.842 N/A LYS 72.A NZ CYS 92.A O no hydrogen 2.786 N/A SER 73.A N ALA 20.A O no hydrogen 2.794 N/A SER 73.A OG GLU 162.A OE2 no hydrogen 2.636 N/A MET 74.A N PHE 96.A O no hydrogen 2.878 N/A ASP 76.A N ASP 97.A OD1 no hydrogen 2.934 N/A SER 77.A N ASP 97.A OD2 no hydrogen 2.842 N/A SER 77.A OG ASP 97.A OD2 no hydrogen 2.764 N/A LYS 78.A NZ TYR 31.A OH no hydrogen 2.828 N/A LYS 78.A NZ GLU 193.A OE1 no hydrogen 2.725 N/A LYS 78.A NZ PHE 310.A O no hydrogen 2.897 N/A ARG 79.A N ASP 76.A OD1 no hydrogen 3.302 N/A ARG 79.A NE ASP 76.A OD2 no hydrogen 3.219 N/A ARG 79.A NH1 VAL 26.A O no hydrogen 3.206 N/A ARG 79.A NH1 GLU 28.A O no hydrogen 2.853 N/A ARG 79.A NH2 GLU 29.A O no hydrogen 2.998 N/A ALA 81.A N SER 77.A O no hydrogen 2.786 N/A VAL 82.A N LYS 78.A O no hydrogen 2.869 N/A ALA 83.A N ARG 79.A O no hydrogen 3.071 N/A LEU 84.A N ALA 80.A O no hydrogen 2.915 N/A LYS 85.A N ALA 81.A O no hydrogen 2.892 N/A TRP 86.A N VAL 82.A O no hydrogen 3.110 N/A TRP 86.A NE1 HIS 32.A ND1 no hydrogen 3.042 N/A LYS 87.A N LEU 84.A O no hydrogen 2.894 N/A GLY 88.A N LYS 85.A O no hydrogen 2.969 N/A ILE 89.A N LEU 84.A O no hydrogen 2.910 N/A CYS 92.A N LEU 65.A O no hydrogen 2.896 N/A CYS 92.A SG GLY 66.A O no hydrogen 3.306 N/A SER 95.A N LYS 72.A O no hydrogen 2.987 N/A ASP 97.A N GLN 183.A OE1 no hydrogen 2.853 N/A LEU 98.A N MET 74.A O no hydrogen 2.742 N/A LEU 99.A N ASP 97.A OD1 no hydrogen 3.081 N/A ALA 101.A N ASP 97.A O no hydrogen 2.979 N/A ALA 102.A N LEU 98.A O no hydrogen 2.884 N/A TYR 103.A N LEU 99.A O no hydrogen 2.918 N/A TYR 103.A OH THR 315.A O no hydrogen 2.699 N/A LEU 104.A N LEU 100.A O no hydrogen 3.038 N/A LEU 105.A N ALA 101.A O no hydrogen 3.132 N/A ASP 106.A N ALA 102.A O no hydrogen 3.133 N/A ALA 108.A N ASP 106.A OD1 no hydrogen 3.092 N/A GLN 109.A N ASP 106.A O no hydrogen 3.198 N/A GLN 109.A NE2 ASP 106.A OD2 no hydrogen 3.192 N/A GLY 110.A N PRO 107.A O no hydrogen 3.450 N/A ALA 116.A N ASP 113.A OD2 no hydrogen 2.881 N/A ALA 117.A N ASP 113.A O no hydrogen 3.330 N/A ALA 118.A N VAL 114.A O no hydrogen 2.838 N/A LYS 119.A N ALA 115.A O no hydrogen 2.968 N/A LYS 119.A NZ GLU 124.A OE2 no hydrogen 3.080 N/A MET 120.A N ALA 117.A O no hydrogen 3.012 N/A LYS 121.A N ALA 118.A O no hydrogen 3.011 N/A LYS 121.A NZ GLU 168.A OE2 no hydrogen 3.044 N/A GLN 122.A N LYS 119.A O no hydrogen 3.202 N/A TYR 123.A N ALA 118.A O no hydrogen 3.010 N/A ASP 129.A N ASP 113.A OD1 no hydrogen 3.029 N/A ALA 131.A N PRO 128.A O no hydrogen 3.047 N/A VAL 132.A N PRO 128.A O no hydrogen 3.413 N/A VAL 132.A N ASP 129.A O no hydrogen 2.998 N/A TYR 133.A N ASP 129.A O no hydrogen 2.848 N/A TYR 133.A OH GLU 25.A OE2 no hydrogen 2.463 N/A GLY 134.A N GLU 130.A O no hydrogen 2.724 N/A LYS 138.A N LYS 135.A O no hydrogen 3.204 N/A ARG 139.A N GLY 136.A O no hydrogen 2.965 N/A ARG 139.A NH2 VAL 27.A O no hydrogen 2.741 N/A ALA 140.A N TYR 133.A O no hydrogen 2.938 N/A LEU 147.A N ASP 143.A O no hydrogen 2.976 N/A ALA 148.A N GLU 144.A O no hydrogen 2.755 N/A GLU 149.A N PRO 145.A O no hydrogen 3.347 N/A HIS 150.A N VAL 146.A O no hydrogen 3.160 N/A HIS 150.A NE2 ASP 129.A OD1 no hydrogen 2.902 N/A LEU 151.A N LEU 147.A O no hydrogen 2.959 N/A VAL 152.A N ALA 148.A O no hydrogen 3.013 N/A ARG 153.A N GLU 149.A O no hydrogen 2.894 N/A ARG 153.A NE GLU 149.A OE2 no hydrogen 3.053 N/A ARG 153.A NH1 ALA 125.A O no hydrogen 2.990 N/A ARG 153.A NH2 ALA 1.A O no hydrogen 2.927 N/A LYS 154.A N HIS 150.A O no hydrogen 2.955 N/A LYS 154.A NZ GLU 25.A OE1 no hydrogen 3.031 N/A LYS 154.A NZ GLU 25.A OE2 no hydrogen 2.947 N/A LYS 154.A NZ ASP 129.A OD1 no hydrogen 3.036 N/A LYS 154.A NZ ASP 129.A OD2 no hydrogen 3.535 N/A ALA 155.A N LEU 151.A O no hydrogen 3.045 N/A ALA 156.A N VAL 152.A O no hydrogen 2.848 N/A ALA 157.A N ARG 153.A O no hydrogen 2.981 N/A ILE 158.A N LYS 154.A O no hydrogen 3.029 N/A TRP 159.A N ALA 155.A O no hydrogen 2.941 N/A GLU 160.A N ALA 156.A O no hydrogen 3.063 N/A LEU 161.A N ALA 157.A O no hydrogen 2.774 N/A GLU 162.A N ILE 158.A O no hydrogen 3.184 N/A ARG 163.A NH1 ASP 167.A OD2 no hydrogen 3.373 N/A PHE 165.A N LEU 161.A O no hydrogen 3.095 N/A LEU 166.A N GLU 162.A O no hydrogen 2.949 N/A ASP 167.A N ARG 163.A O no hydrogen 2.849 N/A GLU 168.A N PRO 164.A O no hydrogen 3.108 N/A LEU 169.A N PHE 165.A O no hydrogen 2.958 N/A ARG 170.A N LEU 166.A O no hydrogen 2.915 N/A ARG 170.A NH1 ASP 175.A OD1 no hydrogen 3.568 N/A ARG 171.A N ASP 167.A O no hydrogen 3.039 N/A ASN 172.A N GLU 168.A O no hydrogen 2.935 N/A ASN 172.A ND2 GLN 174.A OE1 no hydrogen 3.013 N/A GLU 173.A N ARG 170.A O no hydrogen 3.020 N/A GLN 174.A N LEU 169.A O no hydrogen 2.790 N/A GLN 174.A NE2 LEU 104.A O no hydrogen 3.189 N/A GLN 174.A NE2 HIS 472.A O no hydrogen 3.100 N/A ARG 176.A NE GLU 180.A OE1 no hydrogen 3.405 N/A ARG 176.A NE GLU 180.A OE2 no hydrogen 3.228 N/A ARG 176.A NH2 GLU 180.A OE2 no hydrogen 3.287 N/A LEU 178.A N GLN 174.A O no hydrogen 3.185 N/A VAL 179.A N ASP 175.A O no hydrogen 3.011 N/A GLU 180.A N ARG 176.A O no hydrogen 2.721 N/A LEU 181.A N LEU 177.A O no hydrogen 3.290 N/A GLU 182.A N LEU 177.A O no hydrogen 2.996 N/A GLN 183.A N LEU 178.A O no hydrogen 2.962 N/A GLN 183.A NE2 SER 95.A O no hydrogen 3.136 N/A LEU 185.A N LEU 181.A O no hydrogen 2.962 N/A SER 186.A N GLU 182.A O no hydrogen 2.883 N/A SER 187.A N PRO 184.A O no hydrogen 3.226 N/A ILE 188.A N PRO 184.A O no hydrogen 3.385 N/A LEU 189.A N LEU 185.A O no hydrogen 2.899 N/A ALA 190.A N SER 186.A O no hydrogen 3.077 N/A GLU 191.A N SER 187.A O no hydrogen 3.234 N/A MET 192.A N ILE 188.A O no hydrogen 3.050 N/A GLU 193.A N LEU 189.A O no hydrogen 2.870 N/A PHE 194.A N ALA 190.A O no hydrogen 3.017 N/A ALA 195.A N GLU 191.A O no hydrogen 2.937 N/A GLY 196.A N MET 192.A O no hydrogen 3.070 N/A VAL 197.A N VAL 306.A O no hydrogen 2.993 N/A VAL 199.A N LYS 304.A O no hydrogen 2.831 N/A ASP 200.A N ALA 343.A O no hydrogen 2.693 N/A ARG 203.A N ASP 200.A OD1 no hydrogen 3.003 N/A LEU 204.A N ASP 200.A O no hydrogen 3.180 N/A GLU 205.A N THR 201.A O no hydrogen 2.846 N/A GLN 206.A N LYS 202.A O no hydrogen 2.994 N/A MET 207.A N ARG 203.A O no hydrogen 3.108 N/A GLY 208.A N LEU 204.A O no hydrogen 2.897 N/A LYS 209.A N GLU 205.A O no hydrogen 3.143 N/A GLU 210.A N GLN 206.A O no hydrogen 3.218 N/A LEU 211.A N MET 207.A O no hydrogen 3.027 N/A ALA 212.A N GLY 208.A O no hydrogen 3.018 N/A GLU 213.A N LYS 209.A O no hydrogen 3.245 N/A GLN 214.A N GLU 210.A O no hydrogen 3.050 N/A GLN 214.A NE2 GLU 210.A O no hydrogen 3.447 N/A LEU 215.A N LEU 211.A O no hydrogen 2.692 N/A GLY 216.A N ALA 212.A O no hydrogen 3.215 N/A THR 217.A N GLU 213.A O no hydrogen 3.211 N/A THR 217.A OG1 GLU 213.A O no hydrogen 3.446 N/A VAL 218.A N GLN 214.A O no hydrogen 3.128 N/A GLU 219.A N LEU 215.A O no hydrogen 2.775 N/A GLN 220.A N GLY 216.A O no hydrogen 3.232 N/A ARG 221.A N THR 217.A O no hydrogen 3.114 N/A ARG 221.A NH2 GLU 273.A OE2 no hydrogen 2.604 N/A ILE 222.A N VAL 218.A O no hydrogen 2.932 N/A TYR 223.A N GLU 219.A O no hydrogen 3.200 N/A TYR 223.A OH GLU 219.A OE1 no hydrogen 2.772 N/A TYR 223.A OH PHE 230.A O no hydrogen 3.401 N/A GLU 224.A N GLN 220.A O no hydrogen 2.891 N/A LEU 225.A N ARG 221.A O no hydrogen 2.774 N/A ALA 226.A N ILE 222.A O no hydrogen 2.859 N/A GLY 227.A N GLU 224.A O no hydrogen 3.208 N/A GLN 228.A N TYR 223.A O no hydrogen 3.072 N/A ASN 231.A N GLN 237.A OE1 no hydrogen 3.018 N/A SER 234.A N ASN 231.A O no hydrogen 3.001 N/A GLN 237.A N SER 234.A OG no hydrogen 3.197 N/A LEU 238.A N SER 234.A O no hydrogen 2.770 N/A GLY 239.A N PRO 235.A O no hydrogen 2.832 N/A VAL 240.A N LYS 236.A O no hydrogen 3.370 N/A ILE 241.A N GLN 237.A O no hydrogen 3.261 N/A LEU 242.A N LEU 238.A O no hydrogen 2.974 N/A PHE 243.A N GLY 239.A O no hydrogen 2.821 N/A GLU 244.A N VAL 240.A O no hydrogen 3.094 N/A LYS 245.A N VAL 240.A O no hydrogen 3.031 N/A LYS 245.A NZ ALA 226.A O no hydrogen 3.031 N/A LEU 246.A N ILE 241.A O no hydrogen 2.963 N/A GLN 247.A NE2 GLU 244.A O no hydrogen 2.791 N/A LEU 248.A N LEU 242.A O no hydrogen 2.916 N/A THR 254.A N GLY 257.A O no hydrogen 2.682 N/A THR 254.A OG1 GLY 257.A O no hydrogen 3.171 N/A GLY 257.A N THR 254.A OG1 no hydrogen 2.966 N/A TYR 258.A OH GLU 244.A OE2 no hydrogen 2.842 N/A SER 259.A N LYS 252.A O no hydrogen 3.255 N/A SER 261.A OG ASP 263.A OD2 no hydrogen 2.566 N/A LEU 265.A N SER 261.A O no hydrogen 2.971 N/A GLU 266.A N ALA 262.A O no hydrogen 2.995 N/A LYS 267.A NZ ASN 430.A OD1 no hydrogen 3.409 N/A LEU 268.A N VAL 264.A O no hydrogen 3.295 N/A LEU 268.A N LEU 265.A O no hydrogen 2.772 N/A ALA 269.A N GLU 266.A O no hydrogen 3.376 N/A TYR 271.A N LEU 268.A O no hydrogen 2.947 N/A ILE 274.A N HIS 272.A ND1 no hydrogen 2.916 N/A VAL 275.A N HIS 272.A O no hydrogen 3.172 N/A ILE 278.A N ILE 274.A O no hydrogen 3.010 N/A LEU 279.A N VAL 275.A O no hydrogen 3.067 N/A HIS 280.A N GLU 276.A O no hydrogen 3.047 N/A TYR 281.A N ASN 277.A O no hydrogen 2.916 N/A ARG 282.A N ILE 278.A O no hydrogen 2.925 N/A ARG 282.A NH1 THR 260.A O no hydrogen 2.896 N/A ARG 282.A NH2 THR 260.A O no hydrogen 3.301 N/A ARG 282.A NH2 THR 260.A OG1 no hydrogen 3.029 N/A GLN 283.A N LEU 279.A O no hydrogen 3.074 N/A GLN 283.A NE2 GLU 336.A OE1 no hydrogen 2.590 N/A LEU 284.A N HIS 280.A O no hydrogen 2.990 N/A GLY 285.A N TYR 281.A O no hydrogen 2.831 N/A LYS 286.A N ARG 282.A O no hydrogen 3.142 N/A LEU 287.A N GLN 283.A O no hydrogen 3.388 N/A GLN 288.A N LEU 284.A O no hydrogen 2.879 N/A GLN 288.A NE2 GLY 208.A O no hydrogen 3.048 N/A SER 289.A N GLY 285.A O no hydrogen 3.047 N/A SER 289.A OG GLY 285.A O no hydrogen 3.333 N/A THR 290.A N LYS 286.A O no hydrogen 3.024 N/A TYR 291.A N LEU 287.A O no hydrogen 3.092 N/A TYR 291.A OH ASN 329.A O no hydrogen 2.775 N/A ILE 292.A N LEU 287.A O no hydrogen 2.955 N/A ILE 292.A N GLN 288.A O no hydrogen 3.355 N/A GLU 293.A N GLN 288.A O no hydrogen 2.920 N/A GLY 294.A N SER 289.A O no hydrogen 3.257 N/A LEU 296.A N ILE 292.A O no hydrogen 3.052 N/A LYS 297.A N GLU 293.A O no hydrogen 3.122 N/A VAL 298.A N LEU 295.A O no hydrogen 3.173 N/A ARG 300.A N LYS 305.A O no hydrogen 2.868 N/A LYS 304.A N ARG 300.A O no hydrogen 2.585 N/A LYS 305.A NZ ALA 195.A O no hydrogen 2.853 N/A VAL 306.A N VAL 197.A O no hydrogen 2.926 N/A HIS 307.A ND1 GLU 193.A O no hydrogen 2.905 N/A THR 308.A OG1 SER 322.A OG no hydrogen 2.679 N/A THR 308.A OG1 THR 323.A O no hydrogen 3.024 N/A THR 308.A OG1 PRO 325.A O no hydrogen 2.796 N/A ILE 309.A N THR 323.A O no hydrogen 3.089 N/A PHE 310.A N GLU 193.A OE1 no hydrogen 2.778 N/A ASN 311.A N SER 321.A O no hydrogen 2.870 N/A GLN 312.A NE2 GLU 182.A O no hydrogen 2.867 N/A GLN 312.A NE2 GLU 182.A OE1 no hydrogen 2.811 N/A ALA 313.A N ASN 311.A OD1 no hydrogen 3.060 N/A THR 315.A OG1 ARG 319.A O.A no hydrogen 2.651 N/A THR 315.A OG1 ARG 319.A O.B no hydrogen 2.573 N/A GLN 316.A NE2 PRO 107.A O no hydrogen 3.200 N/A GLN 316.A NE2 LEU 314.A O no hydrogen 3.141 N/A THR 317.A OG1 GLN 501.A OE1.A no hydrogen 2.672 N/A GLY 318.A N THR 315.A OG1 no hydrogen 3.145 N/A SER 321.A N ASN 311.A O no hydrogen 3.348 N/A SER 322.A OG THR 308.A OG1 no hydrogen 2.679 N/A SER 322.A OG PRO 325.A O no hydrogen 3.107 N/A THR 323.A N ILE 309.A O no hydrogen 3.110 N/A THR 323.A OG1 ILE 309.A O no hydrogen 3.555 N/A LEU 327.A N SER 322.A OG no hydrogen 3.067 N/A GLN 328.A N ASN 326.A OD1 no hydrogen 2.830 N/A GLN 328.A NE2 GLN 531.A O no hydrogen 3.138 N/A ARG 338.A N LEU 334.A O no hydrogen 2.847 N/A LYS 339.A N GLU 335.A O no hydrogen 3.256 N/A LYS 339.A NZ GLU 335.A OE2 no hydrogen 3.218 N/A ILE 340.A N GLY 337.A O no hydrogen 2.975 N/A ARG 341.A N ARG 338.A O no hydrogen 2.964 N/A ARG 341.A NE PRO 331.A O no hydrogen 2.885 N/A ARG 341.A NH2 ILE 330.A O no hydrogen 2.835 N/A GLN 342.A N LYS 339.A O no hydrogen 3.044 N/A ALA 343.A N ILE 340.A O no hydrogen 3.039 N/A PHE 344.A N ARG 341.A O no hydrogen 3.224 N/A VAL 345.A N LYS 198.A O no hydrogen 3.068 N/A SER 347.A N GLU 539.A OE1 no hydrogen 2.838 N/A SER 347.A OG GLU 539.A OE1 no hydrogen 3.352 N/A SER 347.A OG GLU 539.A OE2 no hydrogen 2.635 N/A LEU 352.A N ALA 540.A O no hydrogen 2.776 N/A ILE 353.A N GLY 573.A O no hydrogen 2.896 N/A PHE 354.A N LEU 538.A O no hydrogen 2.886 N/A ALA 355.A N HIS 571.A O no hydrogen 2.874 N/A ALA 356.A N LEU 536.A O no hydrogen 2.982 N/A ASP 357.A N ASP 569.A O no hydrogen 2.841 N/A TYR 358.A N ASP 534.A O.A no hydrogen 2.890 N/A TYR 358.A N ASP 534.A O.B no hydrogen 2.936 N/A TYR 358.A OH MET 556.A O no hydrogen 2.744 N/A SER 359.A N LYS 567.A O no hydrogen 2.811 N/A ARG 364.A N GLN 360.A O no hydrogen 3.084 N/A ARG 364.A NE SER 359.A O no hydrogen 2.971 N/A ARG 364.A NH1 PRO 565.A O no hydrogen 2.723 N/A ARG 364.A NH2 ASP 382.A OD1 no hydrogen 3.437 N/A VAL 365.A N ILE 361.A O no hydrogen 2.875 N/A LEU 366.A N GLU 362.A O.A no hydrogen 2.908 N/A LEU 366.A N GLU 362.A O.B no hydrogen 2.945 N/A ALA 367.A N LEU 363.A O no hydrogen 2.972 N/A HIS 368.A N ARG 364.A O no hydrogen 3.033 N/A ILE 369.A N VAL 365.A O no hydrogen 2.884 N/A ALA 370.A N LEU 366.A O no hydrogen 2.931 N/A ASN 374.A ND2 ASP 392.A OD1 no hydrogen 2.834 N/A ASN 374.A ND2 SER 446.A O no hydrogen 3.040 N/A LEU 375.A N ASP 372.A OD1 no hydrogen 2.841 N/A MET 376.A N ASP 372.A O no hydrogen 2.888 N/A GLU 377.A N ASP 373.A O no hydrogen 3.069 N/A ALA 378.A N ASN 374.A O no hydrogen 3.040 N/A PHE 379.A N LEU 375.A O no hydrogen 3.159 N/A ARG 380.A N MET 376.A O no hydrogen 2.926 N/A ARG 380.A NE ARG 563.A O no hydrogen 3.293 N/A ARG 380.A NH2 ARG 563.A O no hydrogen 2.834 N/A ARG 381.A N GLU 377.A O no hydrogen 3.025 N/A ARG 381.A NE GLU 377.A OE2 no hydrogen 2.703 N/A ARG 381.A NH2 GLU 377.A OE2 no hydrogen 3.211 N/A ASP 382.A N PHE 379.A O no hydrogen 2.942 N/A LEU 383.A N ALA 378.A O no hydrogen 3.115 N/A THR 387.A N ASP 384.A OD2 no hydrogen 2.995 N/A THR 387.A OG1 ASP 384.A OD2 no hydrogen 3.311 N/A LYS 388.A N ASP 384.A O no hydrogen 2.982 N/A LYS 388.A NZ ASN 374.A OD1 no hydrogen 3.216 N/A LYS 388.A NZ ASP 392.A OD1 no hydrogen 3.087 N/A LYS 388.A NZ ASP 392.A OD2 no hydrogen 3.311 N/A THR 389.A N ILE 385.A O no hydrogen 3.001 N/A THR 389.A OG1 ILE 385.A O no hydrogen 2.817 N/A THR 389.A OG1 ASN 413.A OD1 no hydrogen 3.385 N/A ALA 390.A N HIS 386.A O no hydrogen 3.012 N/A MET 391.A N THR 387.A O no hydrogen 2.947 N/A ASP 392.A N LYS 388.A O no hydrogen 3.133 N/A ILE 393.A N THR 389.A O no hydrogen 2.900 N/A PHE 394.A N ALA 390.A O no hydrogen 2.969 N/A GLN 395.A N ASP 392.A O no hydrogen 3.424 N/A VAL 396.A N MET 391.A O no hydrogen 3.049 N/A SER 397.A N GLU 400.A OE1 no hydrogen 2.953 N/A GLU 400.A N SER 397.A O no hydrogen 2.959 N/A VAL 401.A N GLU 398.A O no hydrogen 3.202 N/A MET 405.A N THR 402.A OG1 no hydrogen 3.294 N/A ARG 406.A N THR 402.A O no hydrogen 3.088 N/A ARG 406.A NH2 ASP 384.A OD1 no hydrogen 2.948 N/A ARG 406.A NH2 ASP 384.A OD2 no hydrogen 3.279 N/A ARG 407.A N PRO 403.A O no hydrogen 3.014 N/A ARG 407.A NE ASN 404.A OD1 no hydrogen 3.067 N/A ARG 407.A NH2 ASN 404.A OD1 no hydrogen 2.870 N/A GLN 408.A N ASN 404.A O no hydrogen 3.016 N/A ALA 409.A N MET 405.A O no hydrogen 2.957 N/A LYS 410.A N ARG 406.A O no hydrogen 2.853 N/A ALA 411.A N ARG 407.A O no hydrogen 3.174 N/A VAL 412.A N GLN 408.A O no hydrogen 3.076 N/A ASN 413.A N ALA 409.A O no hydrogen 3.015 N/A ASN 413.A ND2 HIS 386.A ND1 no hydrogen 3.104 N/A ASN 413.A ND2 THR 389.A OG1 no hydrogen 3.124 N/A PHE 414.A N LYS 410.A O no hydrogen 3.074 N/A GLY 415.A N ALA 411.A O no hydrogen 3.080 N/A ILE 416.A N VAL 412.A O no hydrogen 2.979 N/A VAL 417.A N ASN 413.A O no hydrogen 3.373 N/A TYR 418.A N PHE 414.A O no hydrogen 2.937 N/A GLY 424.A N SER 421.A OG no hydrogen 3.107 N/A LEU 425.A N SER 421.A O no hydrogen 3.272 N/A GLN 427.A N TYR 423.A O no hydrogen 3.235 N/A ASN 428.A N GLY 424.A O no hydrogen 3.136 N/A LEU 429.A N LEU 425.A O no hydrogen 2.748 N/A ILE 431.A N ALA 426.A O no hydrogen 2.888 N/A SER 432.A N GLU 435.A OE1 no hydrogen 2.947 N/A SER 432.A OG GLU 435.A OE1 no hydrogen 2.942 N/A ALA 436.A N SER 432.A O no hydrogen 2.925 N/A ALA 437.A N ARG 433.A O no hydrogen 2.612 N/A GLU 438.A N LYS 434.A O no hydrogen 3.118 N/A GLU 438.A N GLU 435.A O no hydrogen 2.721 N/A PHE 439.A N GLU 435.A O no hydrogen 3.089 N/A ILE 440.A N ALA 436.A O no hydrogen 3.099 N/A GLU 441.A N ALA 437.A O no hydrogen 3.005 N/A ARG 442.A N GLU 438.A O no hydrogen 3.174 N/A ARG 442.A NH2 ASP 392.A O no hydrogen 2.898 N/A TYR 443.A N PHE 439.A O no hydrogen 2.921 N/A PHE 444.A N ILE 440.A O no hydrogen 3.034 N/A GLU 445.A N GLU 441.A O no hydrogen 3.145 N/A GLU 445.A N ARG 442.A O no hydrogen 3.203 N/A SER 446.A N ARG 442.A O no hydrogen 3.227 N/A SER 446.A N TYR 443.A O no hydrogen 2.898 N/A SER 446.A OG ARG 442.A O no hydrogen 3.365 N/A PHE 447.A N TYR 443.A O no hydrogen 2.865 N/A VAL 450.A N ASP 372.A OD2 no hydrogen 3.098 N/A LYS 451.A N PHE 447.A O no hydrogen 3.213 N/A ARG 452.A N PRO 448.A O no hydrogen 2.980 N/A TYR 453.A N GLY 449.A O no hydrogen 2.964 N/A TYR 453.A OH MET 496.A O no hydrogen 2.944 N/A MET 454.A N VAL 450.A O no hydrogen 2.996 N/A GLU 455.A N LYS 451.A O no hydrogen 3.110 N/A ASN 456.A N ARG 452.A O no hydrogen 2.850 N/A ILE 457.A N TYR 453.A O no hydrogen 2.758 N/A GLN 459.A N GLU 455.A O no hydrogen 3.250 N/A GLU 460.A N ASN 456.A O no hydrogen 2.894 N/A ALA 461.A N ILE 457.A O no hydrogen 2.962 N/A LYS 462.A N VAL 458.A O no hydrogen 3.156 N/A GLN 463.A N GLN 459.A O no hydrogen 3.006 N/A LYS 464.A N GLU 460.A O no hydrogen 2.854 N/A LYS 464.A NZ GLN 463.A OE1 no hydrogen 3.132 N/A GLY 465.A N ALA 461.A O no hydrogen 2.801 N/A VAL 467.A N ARG 475.A O no hydrogen 3.108 N/A THR 469.A N ARG 473.A O no hydrogen 2.985 N/A THR 469.A OG1 ASP 506.A OD1 no hydrogen 2.542 N/A LEU 470.A N SER 503.A OG no hydrogen 2.904 N/A LEU 471.A N ASP 506.A OD1 no hydrogen 3.061 N/A HIS 472.A N THR 469.A O no hydrogen 3.023 N/A HIS 472.A ND1 GLU 173.A O no hydrogen 2.806 N/A ARG 473.A N THR 469.A OG1 no hydrogen 2.982 N/A ARG 473.A NE ASP 506.A OD2 no hydrogen 2.997 N/A ARG 473.A NH1 GLU 182.A OE2 no hydrogen 2.886 N/A ARG 473.A NH2 GLU 182.A OE2 no hydrogen 2.805 N/A ARG 473.A NH2 ASP 506.A OD2 no hydrogen 2.931 N/A ARG 474.A NH1 TYR 476.A OH no hydrogen 2.961 N/A ARG 475.A N VAL 467.A O no hydrogen 3.117 N/A ARG 475.A NH1 THR 498.A OG1 no hydrogen 2.976 N/A LEU 477.A N GLY 465.A O no hydrogen 3.027 N/A ILE 480.A N LEU 477.A O no hydrogen 3.066 N/A THR 481.A OG1 PRO 478.A O no hydrogen 3.486 N/A SER 482.A N ASP 479.A O no hydrogen 3.020 N/A ARG 483.A NH1 THR 481.A O no hydrogen 2.865 N/A ASN 484.A N SER 482.A OG no hydrogen 3.148 N/A VAL 487.A N ASN 484.A OD1 no hydrogen 3.044 N/A ARG 488.A N ASN 484.A O no hydrogen 2.852 N/A ARG 488.A NH1 SER 482.A O no hydrogen 2.902 N/A SER 489.A N PHE 485.A O no hydrogen 2.809 N/A SER 489.A OG PHE 485.A O no hydrogen 2.844 N/A PHE 490.A N ASN 486.A O no hydrogen 3.133 N/A ALA 491.A N VAL 487.A O no hydrogen 3.326 N/A GLU 492.A N ARG 488.A O no hydrogen 2.960 N/A ARG 493.A N SER 489.A O no hydrogen 2.958 N/A MET 494.A N PHE 490.A O no hydrogen 2.981 N/A ALA 495.A N ALA 491.A O no hydrogen 2.932 N/A MET 496.A N GLU 492.A O no hydrogen 3.084 N/A ASN 497.A N ARG 493.A O no hydrogen 2.865 N/A ASN 497.A ND2 VAL 417.A O no hydrogen 2.536 N/A THR 498.A N MET 494.A O no hydrogen 2.928 N/A THR 498.A OG1 MET 494.A O no hydrogen 2.915 N/A ILE 500.A N ASN 497.A O no hydrogen 3.097 N/A GLN 501.A N.A ASN 497.A O no hydrogen 2.943 N/A GLN 501.A N.B ASN 497.A O no hydrogen 2.936 N/A GLY 502.A N THR 498.A O no hydrogen 2.672 N/A SER 503.A N PRO 499.A O no hydrogen 3.198 N/A SER 503.A OG PRO 499.A O no hydrogen 2.651 N/A ALA 504.A N ILE 500.A O no hydrogen 3.113 N/A ALA 505.A N GLN 501.A O.A no hydrogen 3.053 N/A ALA 505.A N GLN 501.A O.B no hydrogen 3.038 N/A ASP 506.A N GLY 502.A O no hydrogen 2.951 N/A ILE 507.A N SER 503.A O no hydrogen 2.985 N/A ILE 508.A N ALA 504.A O no hydrogen 3.181 N/A LYS 509.A N ALA 505.A O no hydrogen 3.103 N/A LYS 509.A NZ GLU 182.A OE1 no hydrogen 3.291 N/A LYS 509.A NZ GLU 182.A OE2 no hydrogen 2.803 N/A LYS 509.A NZ GLY 318.A O no hydrogen 2.755 N/A LYS 510.A N ASP 506.A O no hydrogen 3.009 N/A LYS 510.A NZ ASP 514.A OD2 no hydrogen 2.905 N/A LYS 510.A NZ ALA 559.A O no hydrogen 2.788 N/A ALA 511.A N ILE 507.A O no hydrogen 2.896 N/A MET 512.A N ILE 508.A O no hydrogen 2.968 N/A ILE 513.A N LYS 509.A O no hydrogen 3.244 N/A ASP 514.A N LYS 510.A O no hydrogen 2.881 N/A LEU 515.A N ALA 511.A O no hydrogen 2.809 N/A ASN 516.A N MET 512.A O no hydrogen 3.041 N/A ALA 517.A N ILE 513.A O no hydrogen 3.196 N/A ARG 518.A N ASP 514.A O no hydrogen 3.029 N/A ARG 518.A NH1 GLU 521.A OE1 no hydrogen 3.237 N/A ARG 518.A NH1 GLU 522.A OE2 no hydrogen 3.054 N/A LEU 519.A N LEU 515.A O no hydrogen 2.857 N/A LYS 520.A N ASN 516.A O no hydrogen 3.289 N/A GLU 521.A N ALA 517.A O no hydrogen 3.035 N/A GLU 522.A N ARG 518.A O no hydrogen 2.975 N/A ARG 523.A N LYS 520.A O no hydrogen 3.038 N/A ARG 523.A NH1 LYS 520.A O no hydrogen 2.981 N/A LEU 524.A N LEU 519.A O no hydrogen 3.016 N/A GLN 525.A N GLU 544.A OE1 no hydrogen 2.817 N/A ALA 526.A N GLU 544.A OE2 no hydrogen 3.037 N/A HIS 527.A N GLU 539.A O no hydrogen 3.152 N/A HIS 527.A NE2 GLU 539.A OE2 no hydrogen 2.896 N/A LEU 529.A N ILE 537.A O no hydrogen 2.753 N/A LEU 530.A N ILE 537.A O no hydrogen 3.154 N/A VAL 532.A N GLU 535.A O no hydrogen 2.939 N/A HIS 533.A N GLN 531.A OE1 no hydrogen 2.877 N/A ASP 534.A N.A VAL 532.A O no hydrogen 2.783 N/A ASP 534.A N.B VAL 532.A O no hydrogen 2.798 N/A LEU 536.A N ALA 356.A O no hydrogen 2.841 N/A ILE 537.A N LEU 530.A O no hydrogen 2.871 N/A LEU 538.A N PHE 354.A O no hydrogen 2.775 N/A GLU 539.A N HIS 527.A O no hydrogen 3.135 N/A ALA 540.A N LEU 352.A O no hydrogen 3.042 N/A LYS 542.A N ASP 350.A O no hydrogen 2.999 N/A GLU 543.A N GLU 543.A OE2 no hydrogen 2.703 N/A GLU 544.A N PRO 541.A O no hydrogen 2.868 N/A MET 545.A N LYS 542.A O no hydrogen 3.390 N/A LEU 548.A N GLU 544.A O no hydrogen 2.954 N/A CYS 549.A N MET 545.A O no hydrogen 2.897 N/A CYS 549.A SG MET 545.A O no hydrogen 3.343 N/A ARG 550.A N ARG 547.A O no hydrogen 3.203 N/A LEU 551.A N ARG 547.A O no hydrogen 2.950 N/A VAL 552.A N LEU 548.A O no hydrogen 2.997 N/A VAL 555.A N LEU 551.A O no hydrogen 3.036 N/A MET 556.A N VAL 552.A O no hydrogen 3.036 N/A GLU 557.A N PRO 553.A O no hydrogen 2.780 N/A GLN 558.A N GLU 554.A O no hydrogen 2.924 N/A ARG 563.A N HIS 368.A ND1 no hydrogen 2.908 N/A ARG 563.A NH1 HIS 368.A O no hydrogen 2.818 N/A LYS 567.A NZ ASP 382.A OD1 no hydrogen 3.048 N/A LYS 567.A NZ ASP 382.A OD2 no hydrogen 2.684 N/A VAL 568.A N GLU 557.A OE1 no hydrogen 3.194 N/A ASP 569.A N ASP 357.A O no hydrogen 2.844 N/A HIS 571.A N ALA 355.A O no hydrogen 2.982 N/A GLY 573.A N ILE 353.A O no hydrogen 2.961 N/A SER 574.A OG ASP 578.A OD1 no hydrogen 3.324 N/A THR 575.A OG1 ASP 578.A OD1 no hydrogen 2.745 N/A TRP 576.A N PHE 344.A O no hydrogen 2.971 N/A TYR 577.A N ARG 341.A O no hydrogen 3.319 N/A TYR 577.A OH GLU 335.A OE2 no hydrogen 2.803 N/A ASP 578.A N THR 575.A OG1 no hydrogen 3.250 N/A ALA 579.A N THR 575.A O no hydrogen 3.200 N/A ALA 579.A N TRP 576.A O no hydrogen 3.234 N/A LYS 580.A NZ TYR 577.A OH no hydrogen 3.331 N/A