Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3h4k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A N GLY 1.A O no hydrogen 2.904 N/A TRP 5.A NE1 GLY 454.A O no hydrogen 2.824 N/A LEU 6.A N THR 2.A O no hydrogen 3.153 N/A ARG 7.A N SER 3.A O no hydrogen 3.427 N/A LYS 8.A N GLN 4.A O no hydrogen 3.282 N/A THR 9.A N TRP 5.A O no hydrogen 2.964 N/A THR 9.A OG1 TRP 5.A O no hydrogen 2.705 N/A VAL 10.A N LEU 6.A O no hydrogen 2.906 N/A ASP 11.A N ARG 7.A O no hydrogen 2.965 N/A SER 12.A N LYS 8.A O no hydrogen 3.135 N/A SER 12.A OG LEU 451.A O no hydrogen 2.801 N/A ALA 13.A N THR 9.A O no hydrogen 3.041 N/A ILE 16.A N PHE 71.A O no hydrogen 3.069 N/A LEU 17.A N ALA 41.A O no hydrogen 2.770 N/A PHE 18.A N GLN 69.A O no hydrogen 3.074 N/A SER 19.A N ILE 43.A O no hydrogen 2.794 N/A SER 19.A OG LYS 20.A O no hydrogen 3.357 N/A SER 19.A OG GLU 44.A OE1 no hydrogen 3.353 N/A LYS 20.A NZ GLN 55.A OE1 no hydrogen 3.113 N/A THR 21.A N ASP 46.A OD1 no hydrogen 2.885 N/A THR 21.A OG1 ASP 46.A OD2 no hydrogen 2.563 N/A CYS 26.A SG SER 19.A OG no hydrogen 3.081 N/A CYS 26.A SG LYS 20.A O no hydrogen 4.006 N/A LYS 27.A N CYS 23.A O no hydrogen 3.171 N/A LYS 28.A N PRO 24.A O no hydrogen 3.185 N/A VAL 29.A N TYR 25.A O no hydrogen 3.418 N/A LYS 30.A N CYS 26.A O no hydrogen 3.019 N/A LYS 30.A NZ GLU 44.A OE2 no hydrogen 2.704 N/A ASP 31.A N LYS 27.A O no hydrogen 2.912 N/A VAL 32.A N LYS 28.A O no hydrogen 3.218 N/A LEU 33.A N VAL 29.A O no hydrogen 2.760 N/A ALA 34.A N LYS 30.A O no hydrogen 3.015 N/A GLU 35.A N ASP 31.A O no hydrogen 3.110 N/A ALA 36.A N VAL 32.A O no hydrogen 2.889 N/A LYS 37.A N ALA 34.A O no hydrogen 3.327 N/A ILE 38.A N LEU 33.A O no hydrogen 2.749 N/A LYS 39.A NZ ALA 122.A O no hydrogen 3.113 N/A LYS 39.A NZ GLN 215.A OE1 no hydrogen 3.059 N/A ALA 41.A N VAL 15.A O no hydrogen 2.919 N/A ILE 43.A N LEU 17.A O no hydrogen 2.896 N/A LEU 45.A N SER 19.A O no hydrogen 2.689 N/A GLN 47.A N GLU 44.A O no hydrogen 3.259 N/A LEU 48.A N LEU 45.A O no hydrogen 3.228 N/A ASN 50.A ND2 THR 2.A OG1 no hydrogen 2.923 N/A GLY 51.A N LEU 48.A O no hydrogen 3.444 N/A ILE 54.A N ASN 50.A O no hydrogen 3.062 N/A GLN 55.A N GLY 51.A O no hydrogen 3.311 N/A GLN 55.A NE2 GLU 65.A O no hydrogen 3.056 N/A CYS 57.A N ALA 53.A O no hydrogen 3.271 N/A CYS 57.A SG.B ALA 53.A O no hydrogen 3.323 N/A LEU 58.A N ILE 54.A O no hydrogen 2.778 N/A SER 60.A N CYS 57.A O no hydrogen 3.272 N/A PHE 61.A N LEU 58.A O no hydrogen 3.053 N/A SER 62.A N LEU 58.A O no hydrogen 2.904 N/A SER 62.A OG LEU 58.A O no hydrogen 2.747 N/A SER 62.A OG ILE 64.A O no hydrogen 3.083 N/A SER 62.A OG GLN 69.A OE1 no hydrogen 2.641 N/A LYS 63.A N ALA 59.A O no hydrogen 2.753 N/A GLN 69.A N PHE 18.A O no hydrogen 3.171 N/A GLN 69.A NE2 ILE 64.A O no hydrogen 2.787 N/A GLN 69.A NE2 THR 66.A O no hydrogen 2.799 N/A MET 70.A N GLY 78.A O no hydrogen 3.351 N/A PHE 71.A N ILE 16.A O no hydrogen 2.932 N/A VAL 72.A N LYS 75.A O no hydrogen 2.760 N/A ARG 73.A N ALA 14.A O no hydrogen 2.832 N/A ARG 73.A NE ASP 104.A OD1 no hydrogen 2.744 N/A ARG 73.A NH1 VAL 96.A O no hydrogen 2.698 N/A ARG 73.A NH2 ASP 104.A OD2 no hydrogen 2.922 N/A LYS 75.A N VAL 72.A O no hydrogen 3.242 N/A ILE 77.A N MET 70.A O no hydrogen 3.073 N/A THR 82.A N ASP 79.A OD1 no hydrogen 3.051 N/A THR 82.A OG1 ASP 79.A OD1 no hydrogen 2.714 N/A VAL 83.A N ASP 79.A O no hydrogen 2.775 N/A LEU 84.A N SER 80.A O no hydrogen 3.204 N/A LYS 85.A N GLN 81.A O no hydrogen 3.168 N/A TYR 86.A N THR 82.A O no hydrogen 2.858 N/A TYR 87.A N VAL 83.A O no hydrogen 2.983 N/A TYR 87.A OH GLU 35.A OE2 no hydrogen 2.896 N/A SER 88.A N LEU 84.A O no hydrogen 3.093 N/A SER 88.A OG LYS 85.A O no hydrogen 2.422 N/A GLU 91.A N TYR 86.A O no hydrogen 2.926 N/A ILE 95.A N GLU 91.A O no hydrogen 3.246 N/A VAL 96.A N LEU 92.A O no hydrogen 3.080 N/A ASN 97.A N ALA 93.A O no hydrogen 3.259 N/A GLU 98.A N ILE 95.A O no hydrogen 3.330 N/A SER 99.A OG TYR 101.A O no hydrogen 2.982 N/A TYR 101.A N SER 99.A OG no hydrogen 3.164 N/A ASP 102.A N THR 244.A OG1 no hydrogen 2.962 N/A TYR 103.A N THR 244.A O no hydrogen 2.953 N/A ASP 104.A N LYS 127.A O no hydrogen 2.833 N/A LEU 105.A N LYS 127.A O no hydrogen 3.075 N/A ILE 106.A N LYS 247.A O no hydrogen 2.991 N/A VAL 107.A N ALA 129.A O no hydrogen 2.760 N/A ILE 108.A N ILE 249.A O no hydrogen 2.947 N/A GLY 109.A N LEU 131.A O no hydrogen 2.682 N/A GLY 110.A N ASP 132.A OD1 no hydrogen 2.967 N/A LEU 115.A N GLY 111.A O no hydrogen 2.950 N/A ALA 116.A N SER 112.A O no hydrogen 3.210 N/A ALA 117.A N GLY 113.A O no hydrogen 2.877 N/A GLY 118.A N GLY 114.A O no hydrogen 3.047 N/A LYS 119.A N LEU 115.A O no hydrogen 3.071 N/A GLU 120.A N ALA 116.A O no hydrogen 3.242 N/A ALA 121.A N ALA 117.A O no hydrogen 2.907 N/A ALA 122.A N GLY 118.A O no hydrogen 3.120 N/A LYS 123.A N GLU 120.A O no hydrogen 3.278 N/A TYR 124.A N ALA 121.A O no hydrogen 3.370 N/A TYR 124.A OH GLU 120.A OE2 no hydrogen 2.676 N/A GLY 125.A N ALA 122.A O no hydrogen 2.959 N/A ALA 126.A N ALA 121.A O no hydrogen 3.365 N/A LYS 127.A N ASP 104.A OD2 no hydrogen 2.804 N/A LYS 127.A NZ ASN 97.A O no hydrogen 3.107 N/A LYS 127.A NZ ASN 97.A OD1.B no hydrogen 2.931 N/A THR 128.A OG1 ALA 126.A O no hydrogen 2.848 N/A ALA 129.A N LEU 105.A O no hydrogen 2.940 N/A VAL 130.A N THR 217.A O no hydrogen 2.911 N/A LEU 131.A N VAL 107.A O no hydrogen 2.783 N/A ASP 132.A N LEU 219.A O no hydrogen 3.217 N/A THR 137.A N THR 141.A O no hydrogen 3.153 N/A THR 137.A OG1 ASP 273.A OD1 no hydrogen 2.725 N/A GLY 140.A N THR 137.A O no hydrogen 2.592 N/A THR 141.A N THR 137.A OG1 no hydrogen 3.055 N/A THR 141.A OG1 ASP 273.A OD1 no hydrogen 2.950 N/A THR 142.A OG1.B VAL 134.A O no hydrogen 3.407 N/A GLY 146.A N GLY 110.A O no hydrogen 3.325 N/A CYS 149.A SG.A SER 112.A OG no hydrogen 3.541 N/A CYS 149.A SG.B SER 112.A OG no hydrogen 2.724 N/A CYS 149.A SG.B GLY 146.A O no hydrogen 3.147 N/A ASN 151.A N GLY 147.A O no hydrogen 3.437 N/A ASN 151.A ND2 GLY 147.A O no hydrogen 2.748 N/A VAL 152.A N THR 148.A O no hydrogen 2.676 N/A CYS 154.A SG THR 437.A OG1 no hydrogen 3.235 N/A ILE 155.A N CYS 149.A O no hydrogen 3.136 N/A LYS 157.A N GLY 153.A O no hydrogen 3.019 N/A LYS 157.A NZ GLU 295.A OE1 no hydrogen 2.808 N/A LYS 157.A NZ GLU 295.A OE2 no hydrogen 3.211 N/A LYS 158.A N CYS 154.A O no hydrogen 2.959 N/A LEU 159.A N ILE 155.A O no hydrogen 3.103 N/A MET 160.A N PRO 156.A O no hydrogen 3.104 N/A HIS 161.A N LYS 157.A O no hydrogen 2.953 N/A HIS 161.A NE2 GLU 473.A OE2 no hydrogen 2.931 N/A GLN 162.A N LYS 158.A O no hydrogen 2.816 N/A ALA 163.A N LEU 159.A O no hydrogen 3.017 N/A GLY 164.A N MET 160.A O no hydrogen 3.061 N/A LEU 165.A N HIS 161.A O no hydrogen 2.900 N/A LEU 166.A N GLN 162.A O no hydrogen 2.961 N/A SER 167.A N GLY 164.A O no hydrogen 3.291 N/A ALA 169.A N LEU 165.A O no hydrogen 3.119 N/A LEU 170.A N LEU 166.A O no hydrogen 2.799 N/A GLU 171.A N SER 167.A O no hydrogen 3.330 N/A ASP 172.A N HIS 168.A O no hydrogen 2.873 N/A ALA 173.A N ALA 169.A O no hydrogen 2.994 N/A HIS 175.A N ASP 172.A O no hydrogen 2.967 N/A PHE 176.A N ASP 172.A O no hydrogen 3.134 N/A GLY 177.A N GLU 174.A O no hydrogen 3.131 N/A TRP 178.A N ALA 173.A O no hydrogen 2.872 N/A ARG 182.A NH1 ILE 185.A O no hydrogen 3.270 N/A TRP 189.A NE1 LEU 277.A O no hydrogen 2.764 N/A SER 190.A OG PRO 278.A O no hydrogen 3.488 N/A THR 191.A N ASN 188.A OD1 no hydrogen 3.147 N/A MET 192.A N ASN 188.A O no hydrogen 3.336 N/A VAL 193.A N TRP 189.A O no hydrogen 2.900 N/A GLU 194.A N SER 190.A O no hydrogen 3.056 N/A GLY 195.A N THR 191.A O no hydrogen 3.198 N/A VAL 196.A N MET 192.A O no hydrogen 2.887 N/A GLN 197.A N VAL 193.A O no hydrogen 2.718 N/A GLN 197.A NE2 PHE 275.A O no hydrogen 2.866 N/A SER 198.A N GLU 194.A O no hydrogen 2.949 N/A HIS 199.A N GLY 195.A O no hydrogen 3.162 N/A ILE 200.A N VAL 196.A O no hydrogen 2.959 N/A GLY 201.A N GLN 197.A O no hydrogen 2.843 N/A SER 202.A N SER 198.A O no hydrogen 3.259 N/A SER 202.A OG HIS 199.A O no hydrogen 2.771 N/A LEU 203.A N HIS 199.A O no hydrogen 3.240 N/A ASN 204.A N ILE 200.A O no hydrogen 2.887 N/A TRP 205.A N GLY 201.A O no hydrogen 3.111 N/A GLY 206.A N SER 202.A O no hydrogen 2.800 N/A TYR 207.A N LEU 203.A O no hydrogen 3.028 N/A LYS 208.A N ASN 204.A O no hydrogen 3.449 N/A LYS 208.A NZ ASN 204.A O no hydrogen 3.522 N/A VAL 209.A N TRP 205.A O no hydrogen 2.976 N/A ALA 210.A N GLY 206.A O no hydrogen 2.990 N/A LEU 211.A N TYR 207.A O no hydrogen 3.034 N/A ARG 212.A N LYS 208.A O no hydrogen 3.270 N/A ARG 212.A NE ASP 213.A OD1 no hydrogen 3.297 N/A ARG 212.A NH2 ASP 213.A OD1 no hydrogen 3.162 N/A ASP 213.A N VAL 209.A O no hydrogen 2.850 N/A ASN 214.A N ALA 210.A O no hydrogen 2.988 N/A GLN 215.A N ARG 212.A O no hydrogen 2.872 N/A VAL 216.A N LEU 211.A O no hydrogen 2.647 N/A THR 217.A N THR 128.A O no hydrogen 3.046 N/A LEU 219.A N VAL 130.A O no hydrogen 3.089 N/A LYS 222.A N THR 234.A O no hydrogen 2.959 N/A ARG 224.A N GLN 232.A O no hydrogen 2.676 N/A LEU 225.A N VAL 395.A O no hydrogen 3.031 N/A ILE 226.A N GLU 230.A O no hydrogen 3.147 N/A SER 227.A N GLU 230.A O no hydrogen 3.454 N/A SER 227.A OG GLU 230.A OE1 no hydrogen 3.175 N/A GLU 230.A N SER 227.A O no hydrogen 2.905 N/A VAL 231.A N ILE 243.A O no hydrogen 2.920 N/A GLN 232.A N ARG 224.A O no hydrogen 2.639 N/A ILE 233.A N SER 241.A O no hydrogen 2.780 N/A THR 234.A N LYS 222.A O no hydrogen 3.014 N/A ASP 235.A N LYS 239.A O no hydrogen 3.363 N/A ASN 237.A N ASP 235.A OD1 no hydrogen 2.970 N/A GLN 238.A N ASP 235.A O no hydrogen 3.175 N/A LYS 239.A N ASP 235.A OD1 no hydrogen 2.952 N/A SER 241.A N ILE 233.A O no hydrogen 3.138 N/A ILE 243.A N VAL 231.A O no hydrogen 2.975 N/A THR 244.A N ASP 102.A OD2 no hydrogen 2.843 N/A GLY 245.A N HIS 229.A O no hydrogen 3.048 N/A ASN 246.A N TYR 103.A O no hydrogen 2.907 N/A LYS 247.A N ASP 104.A O no hydrogen 2.942 N/A LYS 247.A NZ.A ASN 246.A OD1 no hydrogen 3.394 N/A LYS 247.A NZ.B TYR 424.A OH no hydrogen 3.540 N/A ILE 248.A N ASN 422.A O no hydrogen 2.865 N/A ILE 249.A N ILE 106.A O no hydrogen 2.953 N/A LEU 250.A N TYR 424.A O no hydrogen 2.633 N/A ALA 251.A N ILE 108.A O no hydrogen 2.848 N/A ARG 255.A N GLU 389.A O no hydrogen 3.007 N/A ARG 255.A NE ASP 272.A OD2 no hydrogen 2.752 N/A ARG 255.A NH1 GLU 135.A O no hydrogen 2.844 N/A ARG 255.A NH2 GLU 135.A O no hydrogen 3.011 N/A ARG 255.A NH2 ASP 272.A OD2 no hydrogen 3.054 N/A LYS 257.A N GLY 387.A O no hydrogen 2.970 N/A ILE 261.A N PRO 259.A O no hydrogen 2.866 N/A GLU 266.A N GLU 266.A OE1 no hydrogen 2.786 N/A TYR 267.A N GLY 263.A O no hydrogen 2.744 N/A GLY 268.A N ALA 264.A O no hydrogen 3.049 N/A ILE 269.A N VAL 382.A O no hydrogen 2.871 N/A THR 270.A N ASP 273.A OD2 no hydrogen 3.194 N/A ASP 272.A N THR 270.A OG1 no hydrogen 3.202 N/A ASP 273.A N THR 270.A O no hydrogen 3.164 N/A LEU 274.A N THR 270.A O no hydrogen 3.250 N/A LEU 277.A N LEU 274.A O no hydrogen 3.244 N/A LYS 283.A N GLU 380.A OE1 no hydrogen 2.992 N/A LYS 283.A NZ GLU 377.A OE2 no hydrogen 2.821 N/A LYS 283.A NZ GLU 378.A O no hydrogen 2.834 N/A THR 284.A N ASP 306.A O no hydrogen 2.757 N/A THR 284.A OG1 GLY 282.A O no hydrogen 2.663 N/A LEU 285.A N THR 381.A O no hydrogen 2.907 N/A VAL 286.A N THR 308.A O no hydrogen 2.747 N/A ILE 287.A N ILE 383.A O no hydrogen 2.815 N/A GLY 288.A N MET 310.A O no hydrogen 3.087 N/A ALA 293.A N SER 290.A OG no hydrogen 3.358 N/A LEU 294.A N SER 290.A O no hydrogen 3.121 N/A GLU 295.A N TYR 291.A O no hydrogen 2.906 N/A CYS 296.A N VAL 292.A O no hydrogen 3.035 N/A CYS 296.A SG VAL 292.A O no hydrogen 3.300 N/A ALA 297.A N ALA 293.A O no hydrogen 3.014 N/A GLY 298.A N LEU 294.A O no hydrogen 2.822 N/A PHE 299.A N GLU 295.A O no hydrogen 3.240 N/A LEU 300.A N CYS 296.A O no hydrogen 3.135 N/A ALA 301.A N ALA 297.A O no hydrogen 3.188 N/A SER 302.A N GLY 298.A O no hydrogen 3.401 N/A SER 302.A OG GLY 298.A O no hydrogen 3.355 N/A LEU 303.A N PHE 299.A O no hydrogen 2.848 N/A LEU 303.A N LEU 300.A O no hydrogen 3.313 N/A GLY 304.A N ALA 301.A O no hydrogen 3.276 N/A THR 308.A N THR 284.A O no hydrogen 2.860 N/A VAL 309.A N LYS 337.A O no hydrogen 2.736 N/A MET 310.A N VAL 286.A O no hydrogen 2.805 N/A VAL 311.A N ALA 339.A O no hydrogen 2.960 N/A ILE 314.A N SER 313.A OG no hydrogen 2.782 N/A LEU 316.A N ALA 289.A O no hydrogen 2.928 N/A ARG 317.A NH2 SER 313.A OG no hydrogen 3.101 N/A PHE 319.A N LEU 316.A O no hydrogen 3.051 N/A GLN 321.A N GLU 482.A OE2 no hydrogen 2.998 N/A GLN 322.A NE2 TYR 516.A OH no hydrogen 3.009 N/A MET 323.A N ASP 320.A OD1 no hydrogen 3.010 N/A ALA 324.A N ASP 320.A O no hydrogen 2.829 N/A GLU 325.A N GLN 321.A O no hydrogen 3.041 N/A LYS 326.A N GLN 322.A O no hydrogen 3.210 N/A VAL 327.A N MET 323.A O no hydrogen 3.015 N/A GLY 328.A N ALA 324.A O no hydrogen 3.124 N/A ASP 329.A N GLU 325.A O no hydrogen 2.851 N/A TYR 330.A N LYS 326.A O no hydrogen 3.165 N/A MET 331.A N VAL 327.A O no hydrogen 3.339 N/A GLU 332.A N GLY 328.A O no hydrogen 2.833 N/A ASN 333.A N ASP 329.A O no hydrogen 2.941 N/A HIS 334.A N MET 331.A O no hydrogen 3.124 N/A HIS 334.A ND1 TYR 330.A O no hydrogen 3.137 N/A VAL 336.A N MET 331.A O no hydrogen 2.954 N/A LYS 337.A N VAL 307.A O no hydrogen 3.009 N/A LYS 337.A NZ ASP 306.A OD1 no hydrogen 2.704 N/A ALA 339.A N VAL 309.A O no hydrogen 2.741 N/A CYS 342.A N VAL 311.A O no hydrogen 2.804 N/A CYS 342.A SG HIS 368.A O no hydrogen 3.921 N/A VAL 343.A N HIS 368.A O no hydrogen 3.150 N/A ASP 345.A N LYS 366.A O no hydrogen 2.714 N/A GLU 346.A N LYS 366.A O no hydrogen 3.153 N/A ILE 347.A N PRO 262.A O no hydrogen 2.985 N/A LYS 348.A N LEU 364.A O no hydrogen 2.918 N/A LEU 350.A N LEU 362.A O no hydrogen 2.752 N/A LYS 351.A N LEU 362.A O no hydrogen 2.951 N/A ASP 354.A N LYS 359.A O no hydrogen 3.159 N/A ASN 357.A ND2 GLU 356.A O no hydrogen 2.886 N/A LYS 359.A N ASP 354.A O no hydrogen 3.320 N/A LEU 362.A N LYS 351.A O no hydrogen 3.009 N/A LEU 363.A N PHE 379.A O no hydrogen 2.690 N/A LEU 364.A N LYS 348.A O no hydrogen 2.755 N/A VAL 365.A N GLU 377.A O no hydrogen 3.038 N/A LYS 366.A N GLU 346.A O no hydrogen 3.009 N/A GLY 367.A N PHE 375.A O no hydrogen 2.865 N/A HIS 368.A N VAL 343.A O no hydrogen 2.990 N/A HIS 368.A ND1 TYR 369.A O no hydrogen 3.082 N/A TYR 369.A N LYS 373.A O no hydrogen 2.865 N/A THR 370.A N LEU 341.A O no hydrogen 3.120 N/A GLY 372.A N TYR 369.A O no hydrogen 3.247 N/A LYS 373.A N ASP 371.A OD1 no hydrogen 2.786 N/A PHE 375.A N GLY 367.A O no hydrogen 2.681 N/A GLU 377.A N VAL 365.A O no hydrogen 3.288 N/A PHE 379.A N LEU 363.A O no hydrogen 2.840 N/A GLU 380.A N LYS 283.A O no hydrogen 2.830 N/A THR 381.A N LYS 283.A O no hydrogen 3.129 N/A THR 381.A OG1 PRO 281.A O no hydrogen 2.706 N/A ILE 383.A N LEU 285.A O no hydrogen 2.736 N/A PHE 384.A N ILE 269.A O no hydrogen 2.804 N/A ALA 385.A N ILE 287.A O no hydrogen 2.862 N/A GLU 389.A N ARG 255.A O no hydrogen 2.842 N/A LYS 394.A NZ GLU 135.A OE1 no hydrogen 2.933 N/A VAL 395.A N LEU 392.A O no hydrogen 3.103 N/A LEU 396.A N LEU 392.A O no hydrogen 2.656 N/A CYS 397.A N LEU 225.A O no hydrogen 3.456 N/A CYS 397.A SG LEU 225.A O no hydrogen 3.702 N/A VAL 400.A N CYS 397.A O no hydrogen 3.321 N/A LYS 403.A N THR 419.A OG1 no hydrogen 2.883 N/A ASP 405.A N ARG 409.A O no hydrogen 2.843 N/A ASN 407.A N ASP 405.A OD1 no hydrogen 3.192 N/A GLY 408.A N ASP 405.A O no hydrogen 3.079 N/A ARG 409.A N ASP 405.A OD1 no hydrogen 2.780 N/A ARG 409.A NE GLU 254.A OE2 no hydrogen 2.979 N/A ARG 409.A NH2 GLU 254.A OE2 no hydrogen 3.117 N/A VAL 410.A N ILE 429.A O no hydrogen 2.864 N/A VAL 411.A N LYS 403.A O no hydrogen 3.078 N/A CYS 412.A SG VAL 410.A O no hydrogen 3.604 N/A CYS 412.A SG GLU 416.A O no hydrogen 4.024 N/A CYS 412.A SG ALA 425.A O no hydrogen 3.822 N/A THR 413.A N GLN 417.A O no hydrogen 3.010 N/A THR 413.A OG1 ASP 415.A OD1 no hydrogen 2.407 N/A THR 413.A OG1 GLN 417.A O no hydrogen 3.446 N/A GLU 416.A N THR 413.A O no hydrogen 3.159 N/A GLN 417.A N THR 413.A OG1 no hydrogen 3.165 N/A GLN 417.A NE2 SER 421.A O no hydrogen 2.762 N/A THR 418.A N VAL 423.A O no hydrogen 2.945 N/A THR 418.A OG1 VAL 420.A O no hydrogen 2.714 N/A THR 418.A OG1 VAL 423.A O no hydrogen 2.708 N/A THR 419.A OG1 GLY 401.A O no hydrogen 2.553 N/A VAL 420.A N THR 418.A OG1 no hydrogen 3.164 N/A ASN 422.A ND2 PRO 228.A O no hydrogen 2.708 N/A ASN 422.A ND2 ASN 246.A O no hydrogen 3.144 N/A VAL 423.A N VAL 420.A O no hydrogen 3.012 N/A TYR 424.A N ILE 248.A O no hydrogen 2.646 N/A ALA 425.A N GLU 416.A O no hydrogen 3.058 N/A ILE 426.A N LEU 250.A O no hydrogen 3.035 N/A ASN 430.A N GLY 427.A O no hydrogen 3.238 N/A ASN 430.A ND2 ALA 425.A O no hydrogen 2.708 N/A ALA 431.A N VAL 410.A O no hydrogen 3.058 N/A LYS 433.A N ASN 430.A O no hydrogen 3.301 N/A LYS 433.A NZ ASN 430.A OD1 no hydrogen 2.780 N/A LYS 433.A NZ ALA 431.A O no hydrogen 3.011 N/A GLN 435.A NE2 GLU 254.A OE2 no hydrogen 3.036 N/A GLN 435.A NE2 ASP 428.A O no hydrogen 2.964 N/A ALA 440.A N LEU 436.A O no hydrogen 3.234 N/A ILE 441.A N THR 437.A O no hydrogen 2.963 N/A GLN 442.A N PRO 438.A O no hydrogen 2.853 N/A ALA 443.A N VAL 439.A O no hydrogen 2.908 N/A GLY 444.A N ALA 440.A O no hydrogen 2.960 N/A ARG 445.A N ILE 441.A O no hydrogen 2.895 N/A TYR 446.A N GLN 442.A O no hydrogen 2.946 N/A LEU 447.A N ALA 443.A O no hydrogen 2.915 N/A ALA 448.A N GLY 444.A O no hydrogen 3.044 N/A ARG 449.A N ARG 445.A O no hydrogen 3.014 N/A ARG 449.A NE GLU 120.A OE2 no hydrogen 2.888 N/A ARG 450.A N TYR 446.A O no hydrogen 2.977 N/A ARG 450.A NH1 GLU 457.A O no hydrogen 3.052 N/A ARG 450.A NH2 ASP 415.A O no hydrogen 3.052 N/A ARG 450.A NH2 GLU 416.A OE1 no hydrogen 2.765 N/A LEU 451.A N LEU 447.A O no hydrogen 2.926 N/A PHE 452.A N ALA 448.A O no hydrogen 3.100 N/A ALA 453.A N ARG 449.A O no hydrogen 2.986 N/A ALA 455.A N ARG 449.A O no hydrogen 3.163 N/A TYR 461.A OH GLU 416.A OE2 no hydrogen 2.848 N/A SER 462.A N ASP 460.A OD1 no hydrogen 3.159 N/A SER 462.A OG ASP 460.A OD1 no hydrogen 2.707 N/A THR 466.A N ALA 476.A O no hydrogen 2.770 N/A THR 467.A OG1 THR 466.A O no hydrogen 2.916 N/A VAL 468.A N TYR 474.A O no hydrogen 2.773 N/A PHE 469.A N GLU 295.A OE2 no hydrogen 2.713 N/A THR 470.A OG1 LEU 472.A O no hydrogen 2.787 N/A TYR 474.A N VAL 468.A O no hydrogen 2.947 N/A GLY 475.A N VAL 534.A O no hydrogen 2.775 N/A ALA 476.A N THR 466.A O no hydrogen 2.903 N/A CYS 477.A N LEU 532.A O no hydrogen 2.918 N/A CYS 477.A SG ASN 463.A O no hydrogen 3.302 N/A LEU 479.A N LEU 530.A O no hydrogen 2.995 N/A GLU 481.A N ASP 320.A OD2 no hydrogen 2.912 N/A GLU 482.A N GLU 482.A OE1 no hydrogen 2.776 N/A ASP 483.A N SER 480.A OG no hydrogen 3.301 N/A ALA 484.A N SER 480.A O no hydrogen 3.073 N/A ILE 485.A N GLU 481.A O no hydrogen 3.013 N/A GLU 486.A N GLU 482.A O no hydrogen 3.074 N/A LYS 487.A N ASP 483.A O no hydrogen 2.958 N/A TYR 488.A N ALA 484.A O no hydrogen 3.071 N/A GLY 489.A N ILE 485.A O no hydrogen 2.734 N/A ASP 492.A N GLY 489.A O no hydrogen 3.047 N/A ILE 493.A N ASP 490.A O no hydrogen 3.428 N/A GLU 494.A N CYS 521.A O no hydrogen 2.963 N/A TYR 496.A N LEU 519.A O no hydrogen 3.057 N/A HIS 497.A N VAL 578.A O no hydrogen 2.944 N/A HIS 497.A ND1 TYR 516.A OH no hydrogen 2.771 N/A SER 498.A N MET 517.A O no hydrogen 3.093 N/A SER 498.A OG ASN 499.A O no hydrogen 2.843 N/A ASN 499.A N PRO 586.A O no hydrogen 2.850 N/A ASN 499.A ND2 CYS 515.A O no hydrogen 3.444 N/A PHE 500.A N CYS 515.A O no hydrogen 2.839 N/A LYS 501.A NZ ARG 510.A O no hydrogen 3.012 N/A LYS 501.A NZ ASP 512.A OD1 no hydrogen 2.759 N/A GLU 504.A N GLU 504.A OE1 no hydrogen 2.726 N/A TRP 505.A N PRO 502.A O no hydrogen 2.987 N/A THR 506.A N LEU 503.A O no hydrogen 3.226 N/A THR 506.A OG1 LEU 503.A O no hydrogen 2.559 N/A HIS 509.A N THR 506.A O no hydrogen 3.273 N/A ARG 510.A N TRP 505.A O no hydrogen 3.028 N/A ARG 510.A NE ASP 172.A OD1 no hydrogen 3.020 N/A ARG 510.A NH2 HIS 168.A O no hydrogen 3.210 N/A ARG 510.A NH2 ASP 172.A OD1 no hydrogen 2.779 N/A GLU 511.A N GLU 511.A OE1 no hydrogen 2.834 N/A TYR 516.A N LEU 535.A O no hydrogen 3.178 N/A TYR 516.A OH HIS 497.A ND1 no hydrogen 2.771 N/A MET 517.A N SER 498.A O no hydrogen 3.181 N/A LYS 518.A N HIS 533.A O no hydrogen 2.895 N/A LYS 518.A NZ ASP 320.A OD1 no hydrogen 3.104 N/A LYS 518.A NZ ASP 320.A OD2 no hydrogen 2.836 N/A LYS 518.A NZ GLN 322.A OE1 no hydrogen 2.759 N/A LYS 518.A NZ GLU 481.A OE1 no hydrogen 2.996 N/A LEU 519.A N TYR 496.A O no hydrogen 2.765 N/A VAL 520.A N GLY 531.A O no hydrogen 2.833 N/A CYS 521.A N GLU 494.A O no hydrogen 2.886 N/A CYS 521.A SG LEU 519.A O no hydrogen 3.784 N/A ARG 522.A N ARG 528.A O no hydrogen 2.879 N/A ARG 522.A NE ASP 492.A OD2 no hydrogen 3.184 N/A LYS 523.A N ASP 492.A O no hydrogen 2.775 N/A SER 524.A N ASP 492.A OD1 no hydrogen 3.023 N/A SER 524.A OG ASP 492.A OD1 no hydrogen 2.957 N/A SER 524.A OG ASP 492.A OD2 no hydrogen 2.939 N/A ASP 525.A N ARG 522.A O no hydrogen 3.267 N/A ARG 528.A N ARG 522.A O no hydrogen 3.253 N/A ARG 528.A NE ASP 525.A OD2 no hydrogen 2.989 N/A ARG 528.A NH1 GLY 553.A O no hydrogen 2.848 N/A ARG 528.A NH2 ASP 525.A OD1 no hydrogen 2.967 N/A VAL 529.A N ALA 554.A O no hydrogen 2.841 N/A LEU 530.A N VAL 520.A O no hydrogen 2.740 N/A GLY 531.A N VAL 520.A O no hydrogen 3.246 N/A LEU 532.A N CYS 477.A O no hydrogen 2.800 N/A HIS 533.A N LYS 518.A O no hydrogen 3.084 N/A VAL 534.A N GLY 475.A O no hydrogen 2.808 N/A LEU 535.A N TYR 516.A O no hydrogen 2.724 N/A GLY 536.A N GLU 473.A O no hydrogen 2.920 N/A ILE 542.A N ASN 538.A O no hydrogen 2.982 N/A THR 543.A N ALA 539.A O no hydrogen 3.019 N/A THR 543.A OG1 ALA 539.A O no hydrogen 2.610 N/A GLN 544.A N GLY 540.A O no hydrogen 3.295 N/A GLN 544.A NE2 GLN 544.A O no hydrogen 3.046 N/A TYR 546.A OH SER 570.A O no hydrogen 3.012 N/A TYR 546.A OH SER 570.A OG no hydrogen 3.003 N/A ALA 547.A N THR 543.A O no hydrogen 3.203 N/A ALA 547.A N GLN 544.A O no hydrogen 3.097 N/A ILE 550.A N TYR 546.A O no hydrogen 2.844 N/A LYS 551.A N ALA 547.A O no hydrogen 3.084 N/A LYS 551.A NZ ASP 460.A OD2 no hydrogen 2.928 N/A LYS 551.A NZ SER 462.A O no hydrogen 2.864 N/A MET 552.A N VAL 548.A O no hydrogen 3.131 N/A GLY 553.A N ILE 550.A O no hydrogen 2.917 N/A THR 555.A N ASP 558.A OD2 no hydrogen 3.033 N/A THR 555.A OG1 ASP 558.A OD2 no hydrogen 3.035 N/A LYS 556.A N MET 527.A O no hydrogen 2.950 N/A LYS 556.A NZ ASP 560.A OD1 no hydrogen 2.673 N/A LYS 556.A NZ ASP 560.A OD2 no hydrogen 3.188 N/A LYS 556.A NZ LEU 576.A O no hydrogen 2.604 N/A ASP 558.A N THR 555.A O no hydrogen 3.144 N/A ASP 558.A N THR 555.A OG1 no hydrogen 3.365 N/A ASP 560.A N LYS 556.A O no hydrogen 3.024 N/A ARG 561.A N.A ALA 557.A O no hydrogen 3.032 N/A ARG 561.A N.B ALA 557.A O no hydrogen 3.017 N/A THR 562.A OG1 ASP 558.A O no hydrogen 2.625 N/A HIS 566.A ND1 GLU 571.A OE1 no hydrogen 3.273 N/A HIS 566.A ND1 GLU 571.A OE2 no hydrogen 2.723 N/A THR 568.A N GLU 571.A OE2 no hydrogen 3.146 N/A THR 568.A OG1 ILE 565.A O no hydrogen 2.661 N/A SER 570.A OG TYR 546.A OH no hydrogen 3.003 N/A GLU 571.A N THR 568.A OG1 no hydrogen 3.241 N/A THR 572.A N CYS 569.A O no hydrogen 3.242 N/A THR 572.A OG1 CYS 569.A O no hydrogen 2.920 N/A PHE 573.A N SER 570.A O no hydrogen 3.037 N/A THR 574.A N GLU 571.A O no hydrogen 2.946 N/A THR 574.A OG1 GLU 571.A O no hydrogen 2.497 N/A THR 575.A N THR 572.A O no hydrogen 3.408 N/A LYS 580.A N VAL 495.A O no hydrogen 2.958 N/A LYS 580.A NZ GLN 322.A OE1 no hydrogen 2.983 N/A LYS 580.A NZ GLU 481.A OE1 no hydrogen 2.780 N/A LYS 580.A NZ GLU 481.A OE2 no hydrogen 3.402 N/A LYS 581.A NZ ASP 490.A O no hydrogen 3.011 N/A LYS 581.A NZ ILE 493.A O no hydrogen 2.936 N/A SER 582.A N THR 579.A OG1 no hydrogen 3.307 N/A SER 582.A OG THR 579.A O no hydrogen 2.881 N/A GLY 583.A N LYS 580.A O no hydrogen 3.305 N/A VAL 584.A N SER 582.A OG no hydrogen 3.409 N/A