Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6nna_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N PHE 603.A O no hydrogen 2.777 N/A GLU 7.A N SER 601.A O no hydrogen 3.049 N/A LYS 8.A N PHE 371.A O no hydrogen 2.833 N/A LYS 8.A NZ HIS 597.A NE2 no hydrogen 3.556 N/A PHE 9.A N VAL 599.A O no hydrogen 2.898 N/A CYS 10.A N ARG 369.A O no hydrogen 2.921 N/A THR 12.A N ALA 367.A O no hydrogen 2.848 N/A THR 12.A OG1 CYS 10.A O no hydrogen 2.903 N/A HIS 14.A N TRP 365.A O no hydrogen 3.070 N/A GLU 16.A N LEU 245.A O no hydrogen 2.813 N/A CYS 19.A N LYS 247.A O no hydrogen 3.046 N/A CYS 19.A SG GLU 16.A O no hydrogen 3.882 N/A CYS 19.A SG LYS 247.A O no hydrogen 3.417 N/A SER 21.A N GLY 18.A O no hydrogen 3.292 N/A SER 21.A OG GLY 18.A O no hydrogen 2.752 N/A ARG 23.A N LEU 20.A O no hydrogen 3.212 N/A ARG 23.A NH1 ASP 80.A O no hydrogen 3.269 N/A ARG 23.A NH2 ASP 80.A O no hydrogen 3.177 N/A LEU 26.A N ARG 23.A O no hydrogen 3.165 N/A GLN 27.A N ARG 23.A O no hydrogen 3.147 N/A GLU 28.A N ALA 24.A O no hydrogen 2.804 N/A GLU 29.A N ALA 25.A O no hydrogen 3.075 N/A LEU 30.A N LEU 26.A O no hydrogen 2.946 N/A GLN 31.A N GLN 27.A O no hydrogen 3.362 N/A LEU 32.A N GLU 28.A O no hydrogen 3.071 N/A CYS 33.A N GLU 29.A O no hydrogen 2.935 N/A CYS 33.A SG GLU 29.A O no hydrogen 3.362 N/A LYS 34.A N LEU 30.A O no hydrogen 2.765 N/A GLY 35.A N GLN 31.A O no hydrogen 3.095 N/A LEU 36.A N LEU 32.A O no hydrogen 3.004 N/A VAL 37.A N CYS 33.A O no hydrogen 3.183 N/A GLN 38.A N LYS 34.A O no hydrogen 2.931 N/A ALA 39.A N GLY 35.A O no hydrogen 2.722 N/A LEU 40.A N LEU 36.A O no hydrogen 3.213 N/A GLN 41.A N VAL 37.A O no hydrogen 2.984 N/A THR 42.A N GLN 38.A O no hydrogen 2.894 N/A THR 42.A OG1 GLN 38.A O no hydrogen 2.834 N/A GLN 46.A N PRO 43.A O no hydrogen 3.441 N/A LEU 48.A N ASP 72.A OD1 no hydrogen 3.121 N/A ARG 50.A N GLN 46.A O no hydrogen 2.860 N/A LEU 51.A N GLU 47.A O no hydrogen 2.806 N/A LEU 52.A N LEU 48.A O no hydrogen 2.971 N/A SER 53.A N PRO 49.A O no hydrogen 2.813 N/A SER 53.A OG PRO 49.A O no hydrogen 2.906 N/A ALA 54.A N ARG 50.A O no hydrogen 3.139 N/A ALA 55.A N LEU 51.A O no hydrogen 3.137 N/A ALA 55.A N LEU 52.A O no hydrogen 3.229 N/A CYS 56.A N LEU 52.A O no hydrogen 3.163 N/A CYS 56.A SG LEU 36.A O no hydrogen 3.697 N/A ARG 57.A NH1 ARG 57.A O no hydrogen 3.351 N/A GLN 64.A N GLN 60.A O no hydrogen 3.412 N/A GLU 65.A N LEU 62.A O no hydrogen 2.912 N/A LYS 68.A N GLU 65.A O no hydrogen 3.168 N/A LEU 69.A N ARG 66.A O no hydrogen 3.133 N/A ASP 72.A N LEU 69.A O no hydrogen 2.919 N/A LEU 74.A N ASP 72.A OD2 no hydrogen 2.992 N/A LEU 75.A N ASP 72.A OD2 no hydrogen 3.387 N/A SER 76.A N ASP 72.A O no hydrogen 2.864 N/A SER 76.A OG ASP 72.A O no hydrogen 2.973 N/A GLY 77.A N LEU 74.A O no hydrogen 3.271 N/A ASP 80.A N SER 76.A O no hydrogen 3.174 N/A ASP 80.A N GLY 77.A O no hydrogen 3.291 N/A SER 81.A OG LEU 78.A O no hydrogen 2.781 N/A ALA 83.A N SER 81.A OG no hydrogen 3.125 N/A LEU 84.A N SER 81.A O no hydrogen 3.295 N/A LYS 85.A NZ GLU 7.A OE2 no hydrogen 3.493 N/A LYS 85.A NZ ASP 89.A OD2 no hydrogen 2.681 N/A LYS 85.A NZ HIS 370.A O no hydrogen 2.861 N/A ALA 86.A N PRO 82.A O no hydrogen 3.005 N/A CYS 87.A N ALA 83.A O no hydrogen 3.177 N/A CYS 87.A SG ALA 83.A O no hydrogen 3.473 N/A LEU 88.A N LEU 84.A O no hydrogen 3.009 N/A ASP 89.A N LYS 85.A O no hydrogen 2.803 N/A THR 90.A N ALA 86.A O no hydrogen 3.068 N/A THR 90.A OG1 ALA 86.A O no hydrogen 2.730 N/A ALA 91.A N CYS 87.A O no hydrogen 3.210 N/A VAL 92.A N LEU 88.A O no hydrogen 3.018 N/A GLU 93.A N ASP 89.A O no hydrogen 2.894 N/A ASN 94.A N ALA 91.A O no hydrogen 2.824 N/A ASN 94.A ND2 THR 90.A O no hydrogen 2.865 N/A MET 95.A N VAL 92.A O no hydrogen 3.025 N/A LYS 99.A N SER 97.A OG no hydrogen 3.173 N/A MET 100.A N GLN 127.A O no hydrogen 3.118 N/A LYS 101.A N ASP 171.A OD2 no hydrogen 2.666 N/A LYS 101.A NZ ALA 166.A O no hydrogen 2.611 N/A LYS 101.A NZ GLY 168.A O no hydrogen 2.657 N/A VAL 102.A N SER 129.A O no hydrogen 2.847 N/A VAL 103.A N LEU 172.A O no hydrogen 3.126 N/A GLU 104.A N THR 131.A O no hydrogen 2.921 N/A VAL 105.A N VAL 174.A O no hydrogen 2.892 N/A ALA 107.A N THR 133.A O no hydrogen 2.956 N/A GLY 108.A N ASP 134.A OD2 no hydrogen 2.781 N/A GLY 110.A N LEU 106.A O no hydrogen 2.988 N/A HIS 111.A N ALA 107.A O no hydrogen 2.899 N/A HIS 111.A ND1 GLU 71.A OE2 no hydrogen 2.881 N/A LEU 112.A N GLU 104.A OE2 no hydrogen 2.834 N/A SER 114.A OG HIS 111.A O no hydrogen 3.120 N/A ARG 115.A N LEU 112.A O no hydrogen 3.113 N/A ARG 115.A NE ASP 80.A OD1 no hydrogen 2.763 N/A ARG 115.A NH1 GLU 71.A OE2 no hydrogen 3.111 N/A ARG 115.A NH1 HIS 111.A O no hydrogen 3.083 N/A ARG 115.A NH2 GLU 71.A OE1 no hydrogen 2.710 N/A ARG 115.A NH2 ASP 80.A OD1 no hydrogen 3.430 N/A ARG 115.A NH2 ASP 80.A OD2 no hydrogen 2.866 N/A ILE 116.A N LEU 112.A O no hydrogen 2.916 N/A LEU 119.A N ARG 115.A O no hydrogen 2.888 N/A LEU 120.A N ILE 116.A O no hydrogen 3.089 N/A SER 121.A OG GLY 118.A O no hydrogen 3.028 N/A HIS 123.A N LEU 120.A O no hydrogen 3.005 N/A LEU 125.A N HIS 123.A ND1 no hydrogen 3.270 N/A LEU 126.A N HIS 123.A ND1 no hydrogen 3.282 N/A GLN 127.A N LEU 98.A O no hydrogen 2.695 N/A SER 129.A N MET 100.A O no hydrogen 3.168 N/A TYR 130.A OH GLU 104.A OE1 no hydrogen 2.573 N/A THR 131.A N VAL 102.A O no hydrogen 3.022 N/A ALA 132.A N ALA 153.A O no hydrogen 2.951 N/A THR 133.A N GLU 104.A O no hydrogen 3.045 N/A THR 133.A OG1 GLU 104.A O no hydrogen 2.642 N/A ARG 135.A N ASP 134.A OD1 no hydrogen 2.652 N/A ARG 135.A NE ASP 158.A OD2 no hydrogen 2.952 N/A ARG 135.A NH1 ALA 181.A O no hydrogen 3.288 N/A ARG 135.A NH2 ASP 158.A OD1 no hydrogen 3.566 N/A ARG 135.A NH2 ALA 181.A O no hydrogen 3.422 N/A GLN 138.A N GLN 138.A OE1 no hydrogen 2.883 N/A ALA 139.A N HIS 136.A O no hydrogen 3.080 N/A LEU 140.A N PRO 137.A O no hydrogen 3.487 N/A GLU 141.A N GLN 138.A O no hydrogen 3.262 N/A ALA 143.A N LEU 140.A O no hydrogen 3.419 N/A LEU 147.A N ALA 143.A O no hydrogen 2.980 N/A GLN 148.A N GLN 144.A O no hydrogen 3.226 N/A GLN 149.A N ALA 145.A O no hydrogen 3.055 N/A HIS 150.A N GLU 146.A O no hydrogen 3.156 N/A ASP 151.A N GLN 148.A O no hydrogen 3.036 N/A VAL 152.A N LEU 147.A O no hydrogen 2.726 N/A ALA 153.A N TYR 130.A O no hydrogen 2.890 N/A GLY 155.A N ALA 132.A O no hydrogen 3.219 N/A TRP 157.A N ASP 134.A O no hydrogen 2.925 N/A TRP 157.A NE1 ASP 161.A O no hydrogen 3.232 N/A ALA 160.A N ASP 158.A OD1 no hydrogen 3.123 N/A ASP 161.A N ASP 158.A O no hydrogen 2.820 N/A LEU 167.A N PRO 164.A O no hydrogen 3.045 N/A GLY 168.A N SER 165.A O no hydrogen 2.767 N/A ALA 170.A N ALA 195.A O no hydrogen 3.025 N/A ASP 171.A N LYS 101.A O no hydrogen 2.886 N/A LEU 172.A N LYS 101.A O no hydrogen 3.323 N/A LEU 173.A N PHE 201.A O no hydrogen 2.884 N/A VAL 174.A N VAL 103.A O no hydrogen 3.042 N/A CYS 175.A N LEU 203.A O no hydrogen 3.044 N/A CYS 175.A SG VAL 105.A O no hydrogen 3.691 N/A ASN 176.A ND2 GLY 110.A O no hydrogen 2.825 N/A CYS 177.A N HIS 205.A O no hydrogen 2.860 N/A CYS 177.A SG HIS 205.A O no hydrogen 3.621 N/A CYS 177.A SG THR 206.A OG1 no hydrogen 3.610 N/A ALA 178.A N ASN 176.A OD1 no hydrogen 3.104 N/A SER 187.A N ASP 184.A OD2 no hydrogen 3.294 N/A SER 187.A OG ASP 184.A OD2 no hydrogen 2.389 N/A ALA 188.A N ASP 184.A O no hydrogen 3.051 N/A LEU 189.A N PRO 185.A O no hydrogen 2.869 N/A SER 190.A N ALA 186.A O no hydrogen 2.926 N/A ASN 191.A N SER 187.A O no hydrogen 2.996 N/A ASN 191.A ND2 PRO 159.A O no hydrogen 2.918 N/A MET 192.A N ALA 188.A O no hydrogen 2.989 N/A VAL 193.A N LEU 189.A O no hydrogen 2.835 N/A ALA 194.A N SER 190.A O no hydrogen 3.239 N/A ALA 195.A N ASN 191.A O no hydrogen 3.244 N/A LEU 196.A N VAL 193.A O no hydrogen 2.762 N/A ARG 197.A N ALA 170.A O no hydrogen 2.984 N/A ARG 197.A NE ASP 171.A OD1 no hydrogen 2.551 N/A GLY 199.A N ARG 259.A O no hydrogen 2.819 N/A GLY 200.A N ARG 197.A O no hydrogen 3.011 N/A PHE 201.A N ASP 171.A O no hydrogen 2.813 N/A LEU 202.A N CYS 257.A O no hydrogen 2.682 N/A LEU 203.A N LEU 173.A O no hydrogen 2.839 N/A LEU 204.A N PHE 255.A O no hydrogen 2.969 N/A HIS 205.A N CYS 175.A O no hydrogen 2.868 N/A HIS 205.A ND1 ASN 176.A OD1 no hydrogen 2.726 N/A THR 206.A N THR 253.A O no hydrogen 2.902 N/A THR 206.A OG1 LEU 207.A O no hydrogen 3.516 N/A LEU 208.A N GLY 251.A O no hydrogen 2.822 N/A ARG 209.A N LEU 226.A O no hydrogen 2.941 N/A GLY 210.A N ASP 215.A OD1 no hydrogen 3.015 N/A LEU 213.A N TYR 250.A O no hydrogen 3.276 N/A ASP 215.A N HIS 211.A O no hydrogen 3.167 N/A ILE 216.A N PRO 212.A O no hydrogen 2.978 N/A VAL 217.A N LEU 213.A O no hydrogen 3.061 N/A ALA 218.A N GLY 214.A O no hydrogen 2.658 N/A PHE 219.A N ASP 215.A O no hydrogen 2.909 N/A LEU 220.A N ILE 216.A O no hydrogen 3.010 N/A THR 221.A N VAL 217.A O no hydrogen 3.141 N/A THR 221.A OG1 VAL 217.A O no hydrogen 3.241 N/A THR 221.A OG1 ALA 218.A O no hydrogen 3.566 N/A SER 222.A OG PHE 219.A O no hydrogen 2.929 N/A GLN 228.A NE2 GLU 232.A OE1 no hydrogen 2.787 N/A ALA 230.A N SER 227.A OG no hydrogen 3.181 N/A TRP 231.A N SER 227.A O no hydrogen 3.258 N/A GLU 232.A N GLN 228.A O no hydrogen 2.827 N/A SER 233.A N ASP 229.A O no hydrogen 2.767 N/A LEU 234.A N ALA 230.A O no hydrogen 2.819 N/A PHE 235.A N TRP 231.A O no hydrogen 2.905 N/A SER 236.A N GLU 232.A O no hydrogen 3.326 N/A SER 236.A OG GLU 232.A O no hydrogen 3.181 N/A ARG 237.A N SER 233.A O no hydrogen 2.927 N/A VAL 238.A N LEU 234.A O no hydrogen 3.065 N/A SER 239.A N SER 236.A O no hydrogen 3.027 N/A LEU 240.A N PHE 235.A O no hydrogen 2.733 N/A ARG 241.A N ARG 258.A O no hydrogen 2.941 N/A ARG 241.A NH1 GLN 352.A O no hydrogen 2.893 N/A VAL 243.A N LEU 256.A O no hydrogen 2.839 N/A GLY 244.A N LEU 256.A O no hydrogen 3.044 N/A LEU 245.A N HIS 14.A O no hydrogen 2.955 N/A LYS 246.A N LEU 254.A O no hydrogen 2.988 N/A LYS 246.A NZ HIS 14.A O no hydrogen 3.153 N/A LYS 246.A NZ GLU 16.A OE2 no hydrogen 2.769 N/A LYS 247.A N GLU 16.A O no hydrogen 2.702 N/A LYS 247.A NZ GLN 228.A OE1 no hydrogen 2.779 N/A SER 248.A N SER 252.A O no hydrogen 2.902 N/A SER 248.A OG SER 252.A O no hydrogen 3.149 N/A SER 248.A OG SER 252.A OG no hydrogen 2.512 N/A PHE 249.A N CYS 19.A O no hydrogen 2.957 N/A TYR 250.A OH LEU 74.A O no hydrogen 2.611 N/A GLY 251.A N SER 248.A O no hydrogen 3.282 N/A SER 252.A N SER 248.A OG no hydrogen 2.835 N/A SER 252.A OG SER 248.A OG no hydrogen 2.512 N/A THR 253.A N THR 206.A O no hydrogen 2.755 N/A LEU 254.A N LYS 246.A O no hydrogen 2.933 N/A PHE 255.A N LEU 204.A O no hydrogen 2.806 N/A LEU 256.A N GLY 244.A O no hydrogen 2.792 N/A CYS 257.A N LEU 202.A O no hydrogen 2.670 N/A ARG 258.A N ARG 241.A O no hydrogen 2.922 N/A ARG 258.A NE GLY 199.A O no hydrogen 2.969 N/A ARG 258.A NH1 GLY 353.A O no hydrogen 3.192 N/A ARG 258.A NH1 ASP 354.A O no hydrogen 2.737 N/A ARG 258.A NH2 GLY 199.A O no hydrogen 3.540 N/A ARG 259.A N GLY 200.A O no hydrogen 2.897 N/A ARG 259.A NH2 VAL 193.A O no hydrogen 3.385 N/A ARG 259.A NH2 LEU 196.A O no hydrogen 2.514 N/A GLN 263.A NE2 GLN 263.A O no hydrogen 2.944 N/A SER 265.A N ASP 264.A OD1 no hydrogen 3.027 N/A ILE 267.A N PRO 294.A O no hydrogen 2.741 N/A LEU 269.A N TRP 296.A O no hydrogen 2.962 N/A VAL 271.A N LYS 298.A O no hydrogen 3.141 N/A SER 275.A N ASP 273.A OD1 no hydrogen 3.182 N/A PHE 276.A N ASP 273.A O no hydrogen 3.037 N/A ARG 277.A N ASP 273.A OD2 no hydrogen 2.669 N/A VAL 279.A N PHE 276.A O no hydrogen 3.179 N/A LEU 282.A N TRP 278.A O no hydrogen 2.969 N/A LYS 283.A N VAL 279.A O no hydrogen 2.977 N/A LYS 283.A NZ GLU 280.A OE1 no hydrogen 3.151 N/A LYS 283.A NZ GLN 482.A O no hydrogen 2.717 N/A GLY 284.A N GLU 280.A O no hydrogen 3.152 N/A ILE 285.A N SER 281.A O no hydrogen 3.079 N/A LEU 286.A N LEU 282.A O no hydrogen 2.937 N/A ALA 287.A N LYS 283.A O no hydrogen 2.851 N/A GLU 289.A N ALA 287.A O no hydrogen 3.012 N/A SER 291.A N ASP 288.A O no hydrogen 3.024 N/A ARG 293.A N SER 291.A OG no hydrogen 3.401 N/A ARG 293.A NE SER 265.A O no hydrogen 2.985 N/A VAL 295.A N ARG 322.A O no hydrogen 2.978 N/A TRP 296.A N ILE 267.A O no hydrogen 2.549 N/A LEU 297.A N ARG 324.A O no hydrogen 2.989 N/A LYS 298.A N LEU 269.A O no hydrogen 3.017 N/A LYS 298.A NZ VAL 340.A O no hydrogen 3.124 N/A ALA 299.A N VAL 326.A O no hydrogen 2.764 N/A ILE 300.A N ASP 272.A OD2 no hydrogen 3.258 N/A ASN 301.A ND2 ASP 272.A OD2 no hydrogen 3.421 N/A CYS 302.A SG THR 304.A OG1 no hydrogen 3.237 N/A CYS 302.A SG TYR 495.A OH no hydrogen 3.293 N/A THR 304.A OG1 TYR 495.A OH no hydrogen 2.618 N/A SER 305.A N CYS 302.A O no hydrogen 3.158 N/A VAL 307.A N SER 305.A OG no hydrogen 3.220 N/A GLY 309.A N SER 538.A OG no hydrogen 3.187 N/A LEU 310.A N GLY 306.A O no hydrogen 3.076 N/A VAL 311.A N VAL 307.A O no hydrogen 2.850 N/A ASN 312.A N VAL 308.A O no hydrogen 3.089 N/A ASN 312.A ND2 CYS 523.A O no hydrogen 2.992 N/A CYS 313.A N GLY 309.A O no hydrogen 3.282 N/A CYS 313.A N LEU 310.A O no hydrogen 3.043 N/A CYS 313.A SG GLY 309.A O no hydrogen 3.519 N/A CYS 313.A SG SER 522.A O no hydrogen 3.027 N/A CYS 313.A SG ASN 527.A O no hydrogen 3.418 N/A CYS 313.A SG GLN 530.A O no hydrogen 3.513 N/A LEU 314.A N LEU 310.A O no hydrogen 2.995 N/A ARG 315.A N VAL 311.A O no hydrogen 2.857 N/A ARG 315.A NH1 ASN 321.A O no hydrogen 3.200 N/A ARG 315.A NH1 LEU 323.A O no hydrogen 3.255 N/A ARG 315.A NH2 MET 95.A O no hydrogen 2.985 N/A ARG 316.A N CYS 313.A O no hydrogen 3.116 N/A ARG 316.A NH1.B ARG 525.A O no hydrogen 2.934 N/A GLU 317.A N LEU 314.A O no hydrogen 3.197 N/A GLY 320.A N GLU 317.A O no hydrogen 2.887 N/A ARG 322.A N GLY 319.A O no hydrogen 3.196 N/A ARG 322.A NE ARG 293.A O no hydrogen 2.833 N/A ARG 322.A NH1 ILE 285.A O no hydrogen 3.151 N/A ARG 322.A NH2 ARG 293.A O no hydrogen 2.870 N/A LEU 323.A N GLY 320.A O no hydrogen 2.924 N/A ARG 324.A N VAL 295.A O no hydrogen 2.904 N/A ARG 324.A NE ASP 354.A O no hydrogen 3.322 N/A ARG 324.A NE ASP 354.A OD1 no hydrogen 2.859 N/A ARG 324.A NH1 ASN 321.A O no hydrogen 2.760 N/A ARG 324.A NH1 LEU 323.A O no hydrogen 3.280 N/A ARG 324.A NH2 ASP 354.A OD2 no hydrogen 3.102 N/A CYS 325.A N VAL 356.A O no hydrogen 2.826 N/A CYS 325.A SG VAL 356.A O no hydrogen 3.698 N/A VAL 326.A N LEU 297.A O no hydrogen 2.782 N/A LEU 327.A N ASN 358.A O no hydrogen 2.889 N/A LEU 328.A N ALA 299.A O no hydrogen 2.897 N/A SER 329.A N TYR 360.A O no hydrogen 2.818 N/A SER 329.A OG ALA 303.A O no hydrogen 2.720 N/A ASN 330.A ND2 HIS 336.A O no hydrogen 3.132 N/A LEU 331.A N ASP 362.A OD2 no hydrogen 3.021 N/A SER 332.A N ASP 362.A OD1 no hydrogen 3.182 N/A SER 335.A N SER 332.A O no hydrogen 3.278 N/A SER 335.A OG ASP 362.A OD1 no hydrogen 2.540 N/A SER 344.A N ASP 341.A O no hydrogen 2.915 N/A SER 344.A OG GLU 339.A O no hydrogen 3.297 N/A SER 344.A OG ASP 341.A O no hydrogen 2.830 N/A GLN 348.A NE2 PRO 342.A O no hydrogen 2.894 N/A LYS 349.A N ALA 345.A O no hydrogen 3.242 N/A LYS 349.A NZ GLU 346.A OE2 no hydrogen 3.237 N/A LEU 351.A N LEU 347.A O no hydrogen 2.844 N/A GLN 352.A N GLN 348.A O no hydrogen 2.966 N/A GLY 353.A N LYS 349.A O no hydrogen 3.129 N/A ASP 354.A N VAL 350.A O no hydrogen 2.920 N/A VAL 356.A N ASN 94.A OD1 no hydrogen 2.996 N/A ASN 358.A ND2 CYS 325.A O no hydrogen 3.035 N/A ASN 358.A ND2 LEU 355.A O no hydrogen 2.789 N/A VAL 359.A N GLY 366.A O no hydrogen 2.958 N/A TYR 360.A N LEU 327.A O no hydrogen 2.824 N/A ARG 361.A N ALA 364.A O no hydrogen 3.026 N/A ARG 361.A NE SER 329.A O no hydrogen 2.869 N/A ARG 361.A NH1 GLU 545.A OE2 no hydrogen 3.095 N/A ARG 361.A NH2 SER 329.A OG no hydrogen 3.075 N/A ARG 361.A NH2 GLU 545.A OE2 no hydrogen 3.009 N/A ASP 362.A N ASN 330.A OD1 no hydrogen 2.725 N/A ALA 364.A N ARG 361.A O no hydrogen 3.519 N/A GLY 366.A N VAL 359.A O no hydrogen 2.861 N/A ALA 367.A N THR 12.A O no hydrogen 3.097 N/A ARG 369.A N CYS 10.A O no hydrogen 2.938 N/A ARG 369.A NH1 GLU 93.A OE1 no hydrogen 3.457 N/A ARG 369.A NH1 GLU 93.A OE2 no hydrogen 2.943 N/A ARG 369.A NH2 GLU 93.A OE1 no hydrogen 2.890 N/A HIS 370.A NE2 GLN 558.A OE1 no hydrogen 2.963 N/A PHE 371.A N LYS 8.A O no hydrogen 2.901 N/A LEU 373.A N LEU 6.A O no hydrogen 2.857 N/A THR 379.A N ASP 590.A OD1 no hydrogen 2.766 N/A THR 379.A OG1 ASP 590.A OD1 no hydrogen 2.769 N/A LYS 384.A N PRO 381.A O no hydrogen 3.455 N/A LYS 384.A NZ GLU 511.A O no hydrogen 2.759 N/A LYS 384.A NZ ASP 513.A OD2 no hydrogen 2.727 N/A SER 385.A N PRO 463.A O no hydrogen 2.765 N/A SER 385.A OG ALA 458.A O no hydrogen 3.183 N/A SER 385.A OG GLY 462.A O no hydrogen 2.746 N/A TYR 386.A N LYS 410.A O no hydrogen 2.892 N/A TYR 386.A OH PRO 381.A O no hydrogen 2.850 N/A ILE 387.A N GLY 466.A O no hydrogen 2.828 N/A ILE 388.A N VAL 412.A O no hydrogen 2.979 N/A ALA 389.A N PHE 468.A O no hydrogen 2.994 N/A GLY 390.A N THR 414.A O no hydrogen 2.983 N/A GLY 391.A N THR 414.A O no hydrogen 3.226 N/A GLY 393.A N GLY 390.A O no hydrogen 3.028 N/A LEU 397.A N GLY 393.A O no hydrogen 3.026 N/A LEU 399.A N PHE 395.A O no hydrogen 2.817 N/A ALA 400.A N GLY 396.A O no hydrogen 2.914 N/A GLN 401.A N LEU 397.A O no hydrogen 3.116 N/A TRP 402.A N GLU 398.A O no hydrogen 2.956 N/A LEU 403.A N LEU 399.A O no hydrogen 2.961 N/A ILE 404.A N ALA 400.A O no hydrogen 3.051 N/A GLN 405.A N GLN 401.A O no hydrogen 2.917 N/A ARG 406.A N LEU 403.A O no hydrogen 3.009 N/A ARG 406.A NE ASP 590.A OD1 no hydrogen 3.372 N/A ARG 406.A NE ASP 590.A OD2 no hydrogen 3.237 N/A ARG 406.A NH1 TRP 402.A O no hydrogen 2.760 N/A ARG 406.A NH2 ASP 590.A OD2 no hydrogen 2.633 N/A GLY 407.A N ILE 404.A O no hydrogen 3.106 N/A VAL 408.A N LEU 403.A O no hydrogen 3.060 N/A LYS 410.A NZ GLN 437.A OE1 no hydrogen 3.099 N/A LYS 410.A NZ LEU 461.A O no hydrogen 2.958 N/A LEU 411.A N GLN 437.A O no hydrogen 2.776 N/A VAL 412.A N TYR 386.A O no hydrogen 3.018 N/A LEU 413.A N GLN 439.A O no hydrogen 2.762 N/A THR 414.A N ILE 388.A O no hydrogen 2.972 N/A SER 415.A N SER 441.A O no hydrogen 2.996 N/A SER 415.A OG GLY 418.A O no hydrogen 3.410 N/A ARG 420.A N GLN 424.A OE1 no hydrogen 2.664 N/A THR 421.A N GLN 424.A OE1 no hydrogen 3.026 N/A GLN 424.A N THR 421.A OG1 no hydrogen 3.119 N/A GLN 424.A NE2 LEU 392.A O no hydrogen 3.006 N/A ALA 425.A N THR 421.A O no hydrogen 3.150 N/A LYS 426.A N GLY 422.A O no hydrogen 2.815 N/A GLN 427.A N TYR 423.A O no hydrogen 3.018 N/A VAL 428.A N GLN 424.A O no hydrogen 3.211 N/A ARG 429.A N ALA 425.A O no hydrogen 3.148 N/A ARG 430.A N LYS 426.A O no hydrogen 3.017 N/A ARG 430.A NH2 GLN 401.A OE1 no hydrogen 3.271 N/A TRP 431.A N GLN 427.A O no hydrogen 2.985 N/A TRP 431.A NE1 GLN 401.A OE1 no hydrogen 3.176 N/A ARG 432.A N VAL 428.A O no hydrogen 2.998 N/A ARG 432.A NE VAL 438.A O no hydrogen 2.980 N/A ARG 432.A NH2 VAL 438.A O no hydrogen 2.682 N/A ARG 433.A N ARG 429.A O no hydrogen 2.972 N/A GLN 434.A N ARG 430.A O no hydrogen 2.886 N/A GLY 435.A N ARG 432.A O no hydrogen 2.845 N/A VAL 436.A N TRP 431.A O no hydrogen 3.032 N/A GLN 437.A N GLN 409.A O no hydrogen 2.768 N/A GLN 439.A N LEU 411.A O no hydrogen 2.788 N/A SER 441.A N LEU 413.A O no hydrogen 2.896 N/A SER 441.A OG GLU 457.A OE1 no hydrogen 2.605 N/A SER 441.A OG GLU 457.A OE2 no hydrogen 3.323 N/A SER 443.A N SER 441.A OG no hydrogen 3.039 N/A SER 443.A OG SER 441.A OG no hydrogen 3.293 N/A SER 443.A OG GLU 457.A OE1 no hydrogen 3.566 N/A SER 443.A OG GLU 457.A OE2 no hydrogen 2.945 N/A SER 446.A N ASN 444.A OD1 no hydrogen 2.891 N/A SER 446.A OG ASN 444.A OD1 no hydrogen 3.219 N/A SER 447.A N ASN 444.A O no hydrogen 3.353 N/A GLY 450.A N SER 447.A OG no hydrogen 3.112 N/A ALA 451.A N SER 447.A O no hydrogen 3.071 N/A ARG 452.A N LEU 448.A O no hydrogen 2.902 N/A ARG 452.A NH2 GLU 507.A OE1 no hydrogen 2.995 N/A GLY 453.A N GLU 449.A O no hydrogen 2.806 N/A LEU 454.A N GLY 450.A O no hydrogen 2.792 N/A ILE 455.A N ALA 451.A O no hydrogen 3.020 N/A ALA 456.A N ARG 452.A O no hydrogen 2.975 N/A GLU 457.A N GLY 453.A O no hydrogen 3.011 N/A ALA 458.A N LEU 454.A O no hydrogen 3.035 N/A ALA 459.A N ILE 455.A O no hydrogen 2.796 N/A GLN 460.A N ALA 456.A O no hydrogen 3.190 N/A LEU 461.A N ALA 458.A O no hydrogen 2.959 N/A GLY 462.A N ALA 458.A O no hydrogen 3.261 N/A GLY 465.A N SER 385.A O no hydrogen 2.700 N/A GLY 466.A N SER 385.A O no hydrogen 3.466 N/A VAL 467.A N TYR 514.A O no hydrogen 2.934 N/A PHE 468.A N ILE 387.A O no hydrogen 2.843 N/A ASN 469.A N VAL 516.A O no hydrogen 2.769 N/A ASN 469.A ND2 PRO 493.A O no hydrogen 3.033 N/A ASN 469.A ND2 THR 498.A OG1 no hydrogen 2.921 N/A LEU 470.A N ALA 389.A O no hydrogen 2.723 N/A ALA 471.A N ASN 469.A OD1 no hydrogen 3.200 N/A ARG 475.A NE ASP 489.A OD2 no hydrogen 3.180 N/A ARG 475.A NH2 LEU 474.A O no hydrogen 2.912 N/A GLY 477.A N GLY 529.A O no hydrogen 2.704 N/A LEU 479.A N GLU 317.A OE2 no hydrogen 3.033 N/A ASN 481.A N LEU 478.A O no hydrogen 2.920 N/A GLN 482.A N LEU 479.A O no hydrogen 2.909 N/A GLN 482.A NE2 ARG 475.A O no hydrogen 2.780 N/A GLN 482.A NE2 GLY 477.A O no hydrogen 3.087 N/A GLU 485.A N GLU 485.A OE1 no hydrogen 2.904 N/A PHE 486.A N THR 483.A OG1 no hydrogen 3.021 N/A PHE 487.A N THR 483.A O no hydrogen 3.231 N/A GLN 488.A N PRO 484.A O no hydrogen 2.964 N/A GLN 488.A NE2 SER 275.A O no hydrogen 3.162 N/A ASP 489.A N GLU 485.A O no hydrogen 2.969 N/A VAL 490.A N PHE 486.A O no hydrogen 3.164 N/A CYS 491.A N PHE 487.A O no hydrogen 2.902 N/A CYS 491.A SG PHE 487.A O no hydrogen 3.263 N/A LYS 492.A N GLN 488.A O no hydrogen 2.886 N/A LYS 494.A N CYS 491.A O no hydrogen 3.170 N/A LYS 494.A NZ ASN 537.A OD1 no hydrogen 2.809 N/A TYR 495.A N CYS 491.A O no hydrogen 2.746 N/A TYR 495.A OH THR 304.A OG1 no hydrogen 2.618 N/A SER 496.A N CYS 491.A O no hydrogen 3.286 N/A GLY 497.A N LYS 492.A O no hydrogen 2.864 N/A THR 498.A N LYS 494.A O no hydrogen 2.902 N/A THR 498.A OG1 LYS 494.A O no hydrogen 2.391 N/A LEU 499.A N TYR 495.A O no hydrogen 2.796 N/A ASN 500.A N SER 496.A O no hydrogen 2.720 N/A ASN 500.A ND2 ILE 445.A O no hydrogen 2.952 N/A LEU 501.A N GLY 497.A O no hydrogen 2.971 N/A ASP 502.A N THR 498.A O no hydrogen 2.850 N/A ARG 503.A N LEU 499.A O no hydrogen 2.983 N/A ARG 503.A NE GLU 507.A OE2 no hydrogen 3.136 N/A VAL 504.A N ASN 500.A O no hydrogen 2.939 N/A THR 505.A N LEU 501.A O no hydrogen 2.786 N/A THR 505.A OG1 LEU 501.A O no hydrogen 2.664 N/A THR 505.A OG1 ASP 502.A O no hydrogen 3.068 N/A ARG 506.A N ASP 502.A O no hydrogen 3.052 N/A ARG 506.A NE ASP 502.A OD1 no hydrogen 2.747 N/A ARG 506.A NH1 GLU 550.A OE1 no hydrogen 3.263 N/A ARG 506.A NH2 GLU 550.A OE1 no hydrogen 3.236 N/A GLU 507.A N ARG 503.A O no hydrogen 3.073 N/A CYS 509.A N THR 505.A O no hydrogen 2.948 N/A LEU 512.A N CYS 509.A O no hydrogen 3.307 N/A ASP 513.A N GLY 465.A O no hydrogen 2.697 N/A TYR 514.A N GLY 465.A O no hydrogen 3.121 N/A VAL 516.A N VAL 467.A O no hydrogen 3.026 N/A VAL 517.A N LEU 555.A O no hydrogen 3.003 N/A PHE 518.A N ASN 469.A O no hydrogen 3.104 N/A SER 519.A OG GLU 541.A OE2 no hydrogen 2.532 N/A SER 520.A N SER 519.A OG no hydrogen 2.813 N/A VAL 521.A N TRP 559.A O no hydrogen 2.863 N/A SER 522.A N SER 520.A OG no hydrogen 2.949 N/A SER 522.A OG SER 520.A OG no hydrogen 3.295 N/A SER 522.A OG GLN 530.A OE1 no hydrogen 2.631 N/A CYS 523.A N SER 520.A O no hydrogen 3.066 N/A CYS 523.A SG GLU 541.A OE1 no hydrogen 3.484 N/A CYS 523.A SG GLU 541.A OE2 no hydrogen 3.185 N/A GLY 524.A N SER 520.A O no hydrogen 3.023 N/A ARG 525.A N VAL 521.A O no hydrogen 2.766 N/A ARG 525.A NH1 GLU 7.A OE1 no hydrogen 3.227 N/A ARG 525.A NH2 GLU 7.A OE1 no hydrogen 3.451 N/A GLY 526.A N VAL 521.A O no hydrogen 3.183 N/A ASN 527.A ND2 GLN 530.A OE1 no hydrogen 2.737 N/A GLY 529.A N GLU 317.A OE1 no hydrogen 2.669 N/A GLN 530.A N ASN 527.A O no hydrogen 3.193 N/A GLN 530.A NE2 ASP 476.A OD1 no hydrogen 2.951 N/A ASN 532.A ND2 ARG 475.A O no hydrogen 2.905 N/A TYR 533.A N ASN 532.A OD1 no hydrogen 2.709 N/A GLY 534.A N GLN 530.A O no hydrogen 2.730 N/A PHE 535.A N SER 531.A O no hydrogen 2.988 N/A ALA 536.A N ASN 532.A O no hydrogen 3.012 N/A ASN 537.A N TYR 533.A O no hydrogen 3.024 N/A ASN 537.A ND2 TYR 533.A O no hydrogen 2.953 N/A SER 538.A N GLY 534.A O no hydrogen 2.999 N/A ALA 539.A N PHE 535.A O no hydrogen 2.949 N/A MET 540.A N ALA 536.A O no hydrogen 3.343 N/A GLU 541.A N ASN 537.A O no hydrogen 3.247 N/A ARG 542.A N SER 538.A O no hydrogen 3.178 N/A ARG 542.A NE GLU 545.A OE2 no hydrogen 2.684 N/A ARG 542.A NH1 GLU 545.A OE1 no hydrogen 2.632 N/A ARG 542.A NH1 GLU 545.A OE2 no hydrogen 3.343 N/A ILE 543.A N ALA 539.A O no hydrogen 3.003 N/A CYS 544.A N MET 540.A O no hydrogen 3.008 N/A CYS 544.A SG MET 540.A O no hydrogen 3.544 N/A GLU 545.A N GLU 541.A O no hydrogen 3.042 N/A LYS 546.A N ARG 542.A O no hydrogen 3.302 N/A LYS 546.A NZ LEU 331.A O no hydrogen 2.904 N/A LYS 546.A NZ GLU 550.A OE1 no hydrogen 2.795 N/A ARG 547.A N ILE 543.A O no hydrogen 2.975 N/A ARG 547.A NE PRO 553.A O no hydrogen 2.796 N/A ARG 547.A NH1 ASP 502.A OD1 no hydrogen 2.856 N/A ARG 547.A NH2 PRO 553.A O no hydrogen 3.034 N/A ARG 548.A N CYS 544.A O no hydrogen 2.978 N/A HIS 549.A N GLU 545.A O no hydrogen 2.965 N/A GLU 550.A N LYS 546.A O no hydrogen 3.258 N/A GLU 550.A N ARG 547.A O no hydrogen 3.124 N/A GLY 551.A N ARG 548.A O no hydrogen 2.903 N/A LEU 552.A N ARG 547.A O no hydrogen 2.905 N/A LEU 555.A N PHE 515.A O no hydrogen 2.862 N/A ALA 556.A N MET 598.A O no hydrogen 2.809 N/A VAL 557.A N VAL 517.A O no hydrogen 3.068 N/A GLN 558.A N LEU 600.A O no hydrogen 2.739 N/A GLN 558.A NE2 GLU 541.A OE1 no hydrogen 3.485 N/A GLN 558.A NE2 GLU 541.A OE2 no hydrogen 2.851 N/A TRP 559.A N SER 519.A O no hydrogen 3.353 N/A GLY 560.A N SER 602.A O no hydrogen 2.853 N/A GLY 563.A N GLN 580.A O no hydrogen 2.892 N/A VAL 565.A N GLY 563.A O no hydrogen 2.623 N/A GLU 570.A N GLY 566.A O no hydrogen 3.313 N/A VAL 574.A N THR 577.A O no hydrogen 2.718 N/A THR 577.A N VAL 574.A O no hydrogen 2.795 N/A THR 577.A OG1 VAL 574.A O no hydrogen 2.596 N/A LEU 578.A N VAL 604.A O no hydrogen 2.866 N/A GLN 580.A N ALA 561.A O no hydrogen 2.934 N/A GLN 580.A NE2 SER 584.A OG no hydrogen 2.989 N/A MET 582.A N ASP 564.A OD2 no hydrogen 2.913 N/A CYS 585.A N ARG 581.A O no hydrogen 2.994 N/A CYS 585.A SG GLN 580.A O no hydrogen 3.504 N/A CYS 585.A SG ARG 581.A O no hydrogen 3.622 N/A LEU 586.A N MET 582.A O no hydrogen 3.037 N/A GLU 587.A N ALA 583.A O no hydrogen 3.296 N/A VAL 588.A N SER 584.A O no hydrogen 3.041 N/A LEU 589.A N CYS 585.A O no hydrogen 3.053 N/A ASP 590.A N LEU 586.A O no hydrogen 3.321 N/A LEU 591.A N GLU 587.A O no hydrogen 3.370 N/A PHE 592.A N VAL 588.A O no hydrogen 2.822 N/A LEU 593.A N LEU 589.A O no hydrogen 2.809 N/A LEU 600.A N ALA 556.A O no hydrogen 2.960 N/A SER 601.A N GLU 7.A O no hydrogen 2.714 N/A SER 602.A N GLN 558.A O no hydrogen 3.145 N/A SER 602.A OG GLN 580.A OE1 no hydrogen 2.640 N/A PHE 603.A N ILE 5.A O no hydrogen 3.406 N/A ALA 606.A N GLY 576.A O no hydrogen 3.043 N/A