Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ecl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N LYS 78.A O no hydrogen 2.527 N/A GLY 1.A N ASP 80.A OD1 no hydrogen 3.320 N/A ALA 3.A N ASP 23.A O no hydrogen 2.504 N/A LEU 4.A N HIS 81.A O no hydrogen 2.896 N/A VAL 5.A N VAL 25.A O no hydrogen 2.763 N/A ILE 6.A N TYR 83.A O no hydrogen 2.825 N/A VAL 7.A N LYS 27.A O no hydrogen 2.923 N/A GLU 8.A N GLU 8.A OE1 no hydrogen 2.886 N/A SER 9.A OG GLU 289.A OE1 no hydrogen 2.821 N/A LYS 12.A N SER 9.A OG no hydrogen 3.059 N/A LYS 12.A NZ GLU 8.A OE1 no hydrogen 2.935 N/A LYS 12.A NZ ALA 85.A O no hydrogen 2.916 N/A LYS 12.A NZ ASP 87.A OD1 no hydrogen 2.890 N/A ALA 13.A N SER 9.A O no hydrogen 2.947 N/A LYS 14.A N PRO 10.A O no hydrogen 2.964 N/A THR 15.A N ALA 11.A O no hydrogen 3.300 N/A THR 15.A OG1 ALA 11.A O no hydrogen 3.302 N/A THR 15.A OG1 GLU 289.A O no hydrogen 2.810 N/A ILE 16.A N LYS 12.A O no hydrogen 2.881 N/A ASN 17.A N ALA 13.A O no hydrogen 2.897 N/A LYS 18.A N THR 15.A O no hydrogen 3.092 N/A TYR 19.A N ILE 16.A O no hydrogen 2.905 N/A LEU 20.A N ASN 17.A O no hydrogen 3.192 N/A TYR 24.A N GLY 21.A O no hydrogen 2.894 N/A VAL 25.A N ALA 3.A O no hydrogen 2.780 N/A LYS 27.A N VAL 5.A O no hydrogen 2.772 N/A SER 29.A N VAL 7.A O no hydrogen 2.958 N/A SER 29.A OG VAL 7.A O no hydrogen 3.366 N/A SER 29.A OG GLY 31.A O no hydrogen 2.927 N/A GLY 31.A N GLU 8.A O no hydrogen 2.999 N/A ARG 34.A N HIS 32.A O no hydrogen 2.903 N/A ASP 35.A N GLU 60.A O no hydrogen 3.205 N/A LEU 43.A N ARG 40.A O no hydrogen 3.008 N/A VAL 44.A N ARG 40.A O no hydrogen 3.291 N/A ASN 45.A N GLY 41.A O no hydrogen 3.062 N/A ARG 46.A N ALA 42.A O no hydrogen 3.103 N/A MET 47.A N LEU 43.A O no hydrogen 2.760 N/A GLY 48.A N VAL 44.A O no hydrogen 2.750 N/A ASP 50.A N GLU 56.A O no hydrogen 2.799 N/A TRP 52.A N ASP 50.A OD1 no hydrogen 3.214 N/A HIS 53.A N ASP 50.A O no hydrogen 3.296 N/A HIS 53.A N ASP 50.A OD1 no hydrogen 3.292 N/A HIS 53.A ND1 ASP 50.A OD2 no hydrogen 2.788 N/A TRP 55.A N ASP 50.A O no hydrogen 2.772 N/A TRP 55.A NE1 ASP 527.A OD1 no hydrogen 2.813 N/A GLU 56.A N HIS 53.A O no hydrogen 3.234 N/A HIS 58.A N GLY 48.A O no hydrogen 2.655 N/A TYR 59.A OH GLN 142.A OE1 no hydrogen 2.697 N/A GLU 60.A N ASP 35.A O no hydrogen 3.009 N/A LEU 62.A N ILE 33.A O no hydrogen 2.864 N/A LYS 65.A N LEU 62.A O no hydrogen 3.116 N/A LYS 65.A NZ VAL 30.A O no hydrogen 2.618 N/A VAL 69.A N LYS 65.A O no hydrogen 3.011 N/A SER 70.A N GLU 66.A O no hydrogen 3.266 N/A SER 70.A OG GLU 66.A O no hydrogen 3.357 N/A GLU 71.A N LYS 67.A O no hydrogen 2.982 N/A LEU 72.A N VAL 68.A O no hydrogen 2.878 N/A LYS 73.A N VAL 69.A O no hydrogen 2.877 N/A GLN 74.A N SER 70.A O no hydrogen 2.791 N/A LEU 75.A N GLU 71.A O no hydrogen 3.112 N/A ALA 76.A N LEU 72.A O no hydrogen 2.667 N/A GLU 77.A N GLN 74.A O no hydrogen 3.355 N/A ASP 80.A N LYS 2.A O no hydrogen 2.926 N/A HIS 81.A NE2 SER 111.A OG no hydrogen 3.128 N/A ILE 82.A N ARG 109.A O no hydrogen 2.765 N/A TYR 83.A N LEU 4.A O no hydrogen 2.690 N/A LEU 84.A N SER 111.A O no hydrogen 2.755 N/A ALA 85.A N ILE 6.A O no hydrogen 2.930 N/A THR 86.A OG1 GLY 92.A O no hydrogen 2.749 N/A ASP 87.A N GLU 8.A OE2 no hydrogen 2.875 N/A ARG 90.A NH2 ASP 513.A OD1 no hydrogen 2.570 N/A GLY 92.A N ASP 89.A OD1 no hydrogen 2.983 N/A GLU 93.A N ASP 89.A O no hydrogen 2.923 N/A ALA 94.A N ARG 90.A O no hydrogen 3.024 N/A ILE 95.A N GLU 91.A O no hydrogen 2.784 N/A ALA 96.A N GLY 92.A O no hydrogen 2.932 N/A TRP 97.A N GLU 93.A O no hydrogen 2.919 N/A HIS 98.A N ALA 94.A O no hydrogen 2.988 N/A LEU 99.A N ILE 95.A O no hydrogen 2.980 N/A ARG 100.A N ALA 96.A O no hydrogen 2.937 N/A GLU 101.A N TRP 97.A O no hydrogen 2.761 N/A VAL 102.A N HIS 98.A O no hydrogen 2.950 N/A ILE 103.A N LEU 99.A O no hydrogen 2.882 N/A GLY 104.A N ARG 100.A O no hydrogen 2.801 N/A ARG 109.A N ASP 106.A O no hydrogen 2.746 N/A ARG 109.A NH2 ALA 79.A O no hydrogen 2.398 N/A TYR 110.A N ASP 107.A O no hydrogen 2.570 N/A TYR 110.A OH GLY 104.A O no hydrogen 2.788 N/A SER 111.A N ILE 82.A O no hydrogen 2.851 N/A SER 111.A OG HIS 81.A NE2 no hydrogen 3.128 N/A SER 111.A OG PRO 130.A O no hydrogen 3.461 N/A ARG 112.A N GLY 131.A O no hydrogen 2.548 N/A ARG 112.A NE GLU 93.A OE1 no hydrogen 2.588 N/A ARG 112.A NH1 THR 86.A O no hydrogen 2.931 N/A ARG 112.A NH1 VAL 113.A O no hydrogen 2.990 N/A ARG 112.A NH2 ASP 87.A O no hydrogen 2.707 N/A ARG 112.A NH2 GLU 93.A OE1 no hydrogen 2.848 N/A VAL 113.A N LEU 84.A O no hydrogen 3.011 N/A ALA 122.A N THR 119.A OG1 no hydrogen 3.212 N/A ILE 123.A N THR 119.A O no hydrogen 2.992 N/A ARG 124.A N LYS 120.A O no hydrogen 3.058 N/A ARG 124.A NH1 ASN 121.A OD1 no hydrogen 2.736 N/A GLN 125.A N ASN 121.A O no hydrogen 3.099 N/A ALA 126.A N ALA 122.A O no hydrogen 2.993 N/A PHE 127.A N ILE 123.A O no hydrogen 3.051 N/A LYS 129.A N GLN 125.A O no hydrogen 3.093 N/A ASN 134.A N GLU 93.A OE2 no hydrogen 2.865 N/A ASP 136.A N ASN 134.A OD1 no hydrogen 3.065 N/A ARG 137.A N ASN 134.A O no hydrogen 3.153 N/A ARG 137.A N ASN 134.A OD1 no hydrogen 3.459 N/A ARG 137.A NH1 LEU 88.A O no hydrogen 2.854 N/A ARG 137.A NH2 LEU 88.A O no hydrogen 2.755 N/A VAL 138.A N ASN 134.A O no hydrogen 3.247 N/A ASN 139.A N ILE 135.A O no hydrogen 2.855 N/A ALA 140.A N ASP 136.A O no hydrogen 2.804 N/A GLN 141.A N ARG 137.A O no hydrogen 3.089 N/A GLN 142.A N VAL 138.A O no hydrogen 2.893 N/A ALA 143.A N ASN 139.A O no hydrogen 2.901 N/A ARG 144.A N ALA 140.A O no hydrogen 3.245 N/A ARG 144.A NH1 GLU 509.A OE1 no hydrogen 3.231 N/A ARG 144.A NH1 GLU 509.A OE2 no hydrogen 3.019 N/A ARG 144.A NH2 GLU 509.A OE1 no hydrogen 2.896 N/A ARG 145.A N GLN 141.A O no hydrogen 3.061 N/A PHE 146.A N GLN 142.A O no hydrogen 2.793 N/A PHE 146.A N ALA 143.A O no hydrogen 2.983 N/A MET 147.A N ALA 143.A O no hydrogen 2.910 N/A ASP 148.A N ARG 144.A O no hydrogen 3.020 N/A ARG 149.A N ARG 145.A O no hydrogen 3.018 N/A ARG 149.A NH1 PRO 37.A O no hydrogen 2.851 N/A ARG 149.A NH1 MET 47.A O no hydrogen 2.548 N/A ARG 149.A NH2 PRO 37.A O no hydrogen 2.950 N/A VAL 150.A N PHE 146.A O no hydrogen 3.003 N/A VAL 151.A N MET 147.A O no hydrogen 3.089 N/A GLY 152.A N ASP 148.A O no hydrogen 2.940 N/A TYR 153.A N ARG 149.A O no hydrogen 2.702 N/A MET 154.A N VAL 150.A O no hydrogen 2.843 N/A VAL 155.A N VAL 151.A O no hydrogen 3.008 N/A SER 156.A N GLY 152.A O no hydrogen 3.435 N/A SER 156.A OG GLY 152.A O no hydrogen 2.708 N/A LEU 159.A N VAL 155.A O no hydrogen 3.216 N/A TRP 160.A N SER 156.A O no hydrogen 2.999 N/A TRP 160.A NE1 LEU 167.A O no hydrogen 2.826 N/A LYS 161.A N PRO 157.A O no hydrogen 2.969 N/A LYS 162.A N LEU 158.A O no hydrogen 2.921 N/A LYS 162.A NZ LYS 542.A O no hydrogen 3.057 N/A LYS 162.A NZ MET 549.A O no hydrogen 2.650 N/A ILE 163.A N LEU 159.A O no hydrogen 2.691 N/A ALA 164.A N LEU 159.A O no hydrogen 2.803 N/A ARG 165.A NE TRP 160.A O no hydrogen 2.794 N/A ALA 169.A N SER 156.A OG no hydrogen 2.942 N/A ARG 171.A NE ASP 148.A OD1 no hydrogen 2.818 N/A ARG 171.A NH2 ASP 148.A OD1 no hydrogen 3.410 N/A GLN 173.A N GLN 173.A OE1 no hydrogen 2.814 N/A SER 174.A N GLY 170.A O no hydrogen 2.956 N/A SER 174.A OG GLY 170.A O no hydrogen 2.804 N/A ALA 176.A N VAL 172.A O no hydrogen 3.062 N/A VAL 177.A N GLN 173.A O no hydrogen 2.944 N/A ARG 178.A N SER 174.A O no hydrogen 2.932 N/A ARG 178.A NE GLU 182.A OE2 no hydrogen 3.166 N/A ARG 178.A NH1 MET 500.A O no hydrogen 2.790 N/A ARG 178.A NH2 GLU 182.A OE2 no hydrogen 3.072 N/A LEU 179.A N VAL 175.A O no hydrogen 3.136 N/A LEU 179.A N ALA 176.A O no hydrogen 2.879 N/A VAL 180.A N ALA 176.A O no hydrogen 3.317 N/A VAL 181.A N VAL 177.A O no hydrogen 2.966 N/A GLU 182.A N ARG 178.A O no hydrogen 3.260 N/A ARG 183.A N LEU 179.A O no hydrogen 3.223 N/A ARG 183.A NE GLU 186.A OE1 no hydrogen 2.876 N/A ARG 183.A NH1 ALA 437.A O no hydrogen 2.902 N/A GLU 184.A N VAL 180.A O no hydrogen 3.031 N/A ARG 185.A N VAL 181.A O no hydrogen 3.051 N/A ARG 185.A NE GLU 486.A OE1 no hydrogen 3.521 N/A ARG 185.A NH1 ASP 490.A OD1 no hydrogen 2.917 N/A ARG 185.A NH1 ASP 490.A OD2 no hydrogen 3.440 N/A ARG 185.A NH2 ASP 490.A OD2 no hydrogen 2.810 N/A GLU 186.A N GLU 182.A O no hydrogen 2.954 N/A ILE 187.A N ARG 183.A O no hydrogen 2.887 N/A LYS 188.A N GLU 184.A O no hydrogen 2.881 N/A ALA 189.A N ARG 185.A O no hydrogen 2.974 N/A PHE 190.A N ILE 187.A O no hydrogen 3.278 N/A GLU 193.A N THR 433.A OG1 no hydrogen 2.731 N/A PHE 195.A N HIS 431.A O no hydrogen 2.989 N/A TRP 196.A N PRO 224.A O no hydrogen 2.845 N/A GLU 197.A N ALA 429.A O no hydrogen 2.899 N/A ASP 199.A N THR 427.A O no hydrogen 3.288 N/A ALA 200.A N LEU 212.A O no hydrogen 2.839 N/A SER 201.A N GLU 425.A O no hydrogen 2.849 N/A THR 202.A N LEU 210.A O no hydrogen 2.720 N/A THR 202.A OG1 LEU 210.A O no hydrogen 2.729 N/A THR 203.A N THR 422.A O no hydrogen 3.032 N/A THR 203.A OG1 GLY 207.A O no hydrogen 3.456 N/A THR 203.A OG1 GLU 208.A O no hydrogen 3.360 N/A THR 204.A N GLU 208.A O no hydrogen 2.699 N/A THR 204.A OG1 SER 206.A OG no hydrogen 2.510 N/A THR 204.A OG1 GLU 208.A O no hydrogen 3.204 N/A SER 206.A OG THR 204.A OG1 no hydrogen 2.510 N/A SER 206.A OG GLU 208.A OE2 no hydrogen 2.718 N/A GLY 207.A N THR 204.A O no hydrogen 2.719 N/A LEU 210.A N THR 202.A O no hydrogen 2.838 N/A LEU 212.A N ALA 200.A O no hydrogen 2.722 N/A GLN 213.A N LYS 391.A O no hydrogen 3.144 N/A GLN 213.A NE2 VAL 198.A O no hydrogen 3.680 N/A VAL 214.A N VAL 198.A O no hydrogen 2.967 N/A THR 215.A N ARG 389.A O no hydrogen 2.825 N/A THR 215.A OG1 HIS 216.A ND1 no hydrogen 2.727 N/A THR 215.A OG1 ARG 389.A O no hydrogen 3.196 N/A HIS 216.A N ARG 389.A O no hydrogen 3.167 N/A HIS 216.A ND1 THR 215.A OG1 no hydrogen 2.727 N/A GLN 217.A N LYS 220.A O no hydrogen 2.964 N/A ASN 218.A N ASP 387.A O no hydrogen 2.882 N/A LYS 220.A N GLN 217.A O no hydrogen 2.989 N/A PHE 222.A N THR 215.A O no hydrogen 2.924 N/A VAL 225.A N GLN 229.A OE1 no hydrogen 2.968 N/A LYS 227.A NZ GLN 430.A OE1 no hydrogen 3.435 N/A THR 230.A N ASN 226.A O no hydrogen 3.346 N/A THR 230.A OG1 ASN 226.A O no hydrogen 2.824 N/A GLN 231.A N LYS 227.A O no hydrogen 2.820 N/A ALA 232.A N GLU 228.A O no hydrogen 3.033 N/A ALA 233.A N GLN 229.A O no hydrogen 3.138 N/A VAL 234.A N THR 230.A O no hydrogen 2.939 N/A SER 235.A N GLN 231.A O no hydrogen 2.980 N/A SER 235.A OG GLN 231.A O no hydrogen 3.125 N/A LEU 236.A N ALA 232.A O no hydrogen 3.387 N/A LEU 237.A N ALA 233.A O no hydrogen 2.946 N/A GLU 238.A N VAL 234.A O no hydrogen 3.007 N/A LYS 239.A N LEU 236.A O no hydrogen 2.896 N/A LYS 239.A NZ SER 235.A O no hydrogen 3.344 N/A ALA 240.A N LEU 236.A O no hydrogen 3.064 N/A TYR 242.A OH LEU 237.A O no hydrogen 2.793 N/A SER 243.A N GLY 384.A O no hydrogen 2.995 N/A VAL 244.A N ASP 419.A O no hydrogen 2.811 N/A LEU 245.A N THR 382.A O no hydrogen 2.750 N/A GLU 246.A N THR 382.A O no hydrogen 3.237 N/A ARG 247.A NE ASP 249.A OD1 no hydrogen 3.005 N/A ARG 247.A NH1 VAL 415.A O no hydrogen 3.058 N/A ARG 247.A NH2 ASP 249.A OD1 no hydrogen 3.234 N/A GLU 248.A N THR 380.A O no hydrogen 2.818 N/A LYS 250.A N SER 378.A O no hydrogen 2.911 N/A THR 252.A N TYR 376.A O no hydrogen 2.804 N/A THR 252.A OG1 TYR 376.A O no hydrogen 3.307 N/A THR 252.A OG1 SER 378.A OG no hydrogen 2.422 N/A SER 254.A N ALA 374.A O no hydrogen 3.133 N/A ILE 261.A N THR 264.A OG1 no hydrogen 3.063 N/A THR 262.A N THR 298.A O no hydrogen 3.015 N/A THR 262.A OG1 MET 296.A O no hydrogen 2.665 N/A THR 262.A OG1 THR 298.A O no hydrogen 2.960 N/A SER 263.A OG GLU 449.A OE1 no hydrogen 2.789 N/A THR 264.A OG1 ILE 261.A O no hydrogen 3.197 N/A LEU 265.A N ILE 261.A O no hydrogen 3.029 N/A GLN 266.A N THR 262.A O no hydrogen 3.193 N/A GLN 267.A N SER 263.A O no hydrogen 3.111 N/A GLN 267.A NE2 SER 263.A O no hydrogen 3.364 N/A GLN 267.A NE2 SER 263.A OG no hydrogen 3.002 N/A ALA 268.A N THR 264.A O no hydrogen 2.915 N/A ALA 269.A N LEU 265.A O no hydrogen 2.838 N/A SER 270.A N GLN 266.A O no hydrogen 2.886 N/A SER 270.A OG PHE 275.A O no hydrogen 3.513 N/A THR 271.A N GLN 267.A O no hydrogen 2.735 N/A THR 271.A OG1 GLN 267.A O no hydrogen 3.247 N/A ARG 272.A N ALA 268.A O no hydrogen 2.785 N/A LEU 273.A N ALA 269.A O no hydrogen 3.057 N/A GLY 274.A N SER 270.A O no hydrogen 2.894 N/A PHE 275.A N ALA 269.A O no hydrogen 3.077 N/A VAL 277.A N GLU 441.A OE1 no hydrogen 3.001 N/A LYS 279.A NZ ASP 354.A OD2 no hydrogen 2.785 N/A THR 280.A N GLY 276.A O no hydrogen 2.987 N/A THR 280.A OG1 GLY 276.A O no hydrogen 3.328 N/A MET 281.A N VAL 277.A O no hydrogen 3.330 N/A MET 282.A N LYS 278.A O no hydrogen 3.135 N/A MET 283.A N LYS 279.A O no hydrogen 2.948 N/A ALA 284.A N THR 280.A O no hydrogen 2.713 N/A GLN 285.A N MET 281.A O no hydrogen 2.897 N/A ARG 286.A N MET 282.A O no hydrogen 3.153 N/A ARG 286.A NH1 GLU 352.A OE1 no hydrogen 2.662 N/A ARG 286.A NH1 GLU 352.A OE2 no hydrogen 3.237 N/A ARG 286.A NH2 GLU 352.A OE2 no hydrogen 2.782 N/A LEU 287.A N MET 283.A O no hydrogen 3.019 N/A TYR 288.A N ALA 284.A O no hydrogen 2.987 N/A TYR 288.A OH ASP 87.A OD1 no hydrogen 2.906 N/A GLU 289.A N GLN 285.A O no hydrogen 2.949 N/A ALA 290.A N ARG 286.A O no hydrogen 3.040 N/A GLY 291.A N TYR 288.A O no hydrogen 2.883 N/A TYR 292.A N LEU 287.A O no hydrogen 2.790 N/A THR 294.A N ARG 337.A O no hydrogen 2.970 N/A THR 294.A OG1 ALA 335.A O no hydrogen 2.732 N/A THR 294.A OG1 ARG 337.A O no hydrogen 3.329 N/A TYR 295.A N ASN 116.A O no hydrogen 2.700 N/A ARG 297.A NH1 ASP 89.A OD2 no hydrogen 2.741 N/A ARG 297.A NH1 GLU 91.A OE1 no hydrogen 3.000 N/A THR 298.A N THR 262.A OG1 no hydrogen 2.756 N/A THR 298.A OG1 SER 300.A O no hydrogen 3.535 N/A THR 298.A OG1 GLU 334.A O no hydrogen 2.858 N/A SER 300.A N THR 298.A OG1 no hydrogen 2.915 N/A SER 300.A OG HIS 333.A O no hydrogen 3.274 N/A THR 301.A OG1 TYR 331.A O no hydrogen 2.745 N/A ASN 302.A N SER 300.A OG no hydrogen 2.887 N/A SER 304.A N GLU 334.A OE2 no hydrogen 2.836 N/A ALA 307.A N SER 304.A OG no hydrogen 3.197 N/A VAL 308.A N SER 304.A O no hydrogen 2.911 N/A ASN 309.A N GLN 305.A O no hydrogen 2.895 N/A MET 310.A N ASP 306.A O no hydrogen 2.866 N/A VAL 311.A N ALA 307.A O no hydrogen 3.042 N/A ARG 312.A N VAL 308.A O no hydrogen 2.945 N/A ARG 312.A NH1 PRO 325.A O no hydrogen 3.109 N/A ARG 312.A NH2 PRO 325.A O no hydrogen 3.190 N/A ARG 312.A NH2 GLU 326.A O no hydrogen 3.467 N/A GLY 313.A N ASN 309.A O no hydrogen 3.011 N/A TYR 314.A N MET 310.A O no hydrogen 3.021 N/A ILE 315.A N VAL 311.A O no hydrogen 2.755 N/A SER 316.A N ARG 312.A O no hydrogen 2.790 N/A ASP 317.A N GLY 313.A O no hydrogen 2.999 N/A ASN 318.A N TYR 314.A O no hydrogen 2.924 N/A ASN 318.A ND2 TYR 314.A O no hydrogen 2.953 N/A PHE 319.A N ILE 315.A O no hydrogen 2.798 N/A GLY 320.A N ILE 315.A O no hydrogen 3.077 N/A TYR 323.A N GLY 320.A O no hydrogen 2.822 N/A TYR 323.A OH ASP 400.A OD1 no hydrogen 2.586 N/A TYR 323.A OH ASP 400.A OD2 no hydrogen 3.216 N/A LEU 324.A N LYS 321.A O no hydrogen 3.415 N/A ASN 329.A N GLN 370.A OE1 no hydrogen 3.072 N/A ASN 329.A ND2 CYS 369.A O no hydrogen 2.844 N/A ASN 329.A ND2 MET 371.A O no hydrogen 3.455 N/A TYR 331.A OH CYS 369.A O no hydrogen 2.569 N/A ALA 335.A N ASN 302.A O no hydrogen 2.784 N/A ILE 336.A N PHE 260.A O no hydrogen 2.685 N/A ARG 337.A N THR 294.A OG1 no hydrogen 2.831 N/A ARG 337.A NE GLU 334.A OE2 no hydrogen 2.759 N/A ARG 337.A NH1 GLU 117.A OE1 no hydrogen 3.391 N/A ARG 337.A NH1 PRO 338.A O no hydrogen 3.108 N/A ARG 337.A NH2 GLU 117.A OE2 no hydrogen 3.149 N/A ARG 337.A NH2 GLU 334.A OE1 no hydrogen 2.778 N/A ARG 337.A NH2 GLU 334.A OE2 no hydrogen 2.839 N/A SER 339.A N TYR 292.A O no hydrogen 2.955 N/A SER 339.A OG GLU 117.A OE1 no hydrogen 3.136 N/A SER 339.A OG GLY 291.A O no hydrogen 3.306 N/A ASN 342.A N ASP 340.A OD1 no hydrogen 2.849 N/A VAL 343.A N ASP 340.A O no hydrogen 3.110 N/A SER 347.A N MET 344.A O no hydrogen 2.760 N/A LEU 348.A N ALA 345.A O no hydrogen 3.099 N/A LYS 349.A N TYR 292.A OH no hydrogen 3.070 N/A GLU 352.A N GLU 352.A OE1 no hydrogen 2.517 N/A GLN 356.A N GLU 352.A O no hydrogen 2.884 N/A GLN 356.A NE2 LEU 348.A O no hydrogen 3.599 N/A LYS 357.A N ALA 353.A O no hydrogen 2.858 N/A LEU 358.A N ASP 354.A O no hydrogen 3.024 N/A TYR 359.A N ALA 355.A O no hydrogen 2.995 N/A TYR 359.A OH VAL 343.A O no hydrogen 2.736 N/A GLN 360.A N GLN 356.A O no hydrogen 2.798 N/A LEU 361.A N LYS 357.A O no hydrogen 2.984 N/A ILE 362.A N LEU 358.A O no hydrogen 3.013 N/A TRP 363.A N TYR 359.A O no hydrogen 2.765 N/A TRP 363.A NE1 VAL 341.A O no hydrogen 2.867 N/A ARG 364.A N GLN 360.A O no hydrogen 2.982 N/A GLN 365.A N LEU 361.A O no hydrogen 3.125 N/A GLN 365.A NE2 ALA 258.A O no hydrogen 2.751 N/A PHE 366.A N ILE 362.A O no hydrogen 2.980 N/A VAL 367.A N TRP 363.A O no hydrogen 2.879 N/A ALA 368.A N ARG 364.A O no hydrogen 2.745 N/A CYS 369.A N GLN 365.A O no hydrogen 2.916 N/A CYS 369.A SG PHE 366.A O no hydrogen 2.958 N/A GLN 370.A N VAL 367.A O no hydrogen 3.031 N/A GLN 370.A NE2 ASN 329.A O no hydrogen 3.196 N/A MET 371.A N ALA 368.A O no hydrogen 3.146 N/A THR 372.A N TYR 323.A O no hydrogen 2.965 N/A THR 372.A OG1 LYS 322.A O no hydrogen 3.017 N/A ALA 374.A N SER 254.A O no hydrogen 3.059 N/A LYS 375.A N PHE 399.A O no hydrogen 2.744 N/A TYR 376.A N THR 252.A O no hydrogen 2.699 N/A ASP 377.A N ILE 396.A O no hydrogen 2.916 N/A SER 378.A N LYS 250.A O no hydrogen 3.140 N/A SER 378.A OG THR 252.A OG1 no hydrogen 2.422 N/A THR 379.A N GLY 394.A O no hydrogen 2.856 N/A THR 379.A OG1 ASP 249.A OD1 no hydrogen 2.464 N/A THR 380.A N GLU 248.A O no hydrogen 2.832 N/A LEU 381.A N ALA 392.A O no hydrogen 2.758 N/A THR 382.A N GLU 246.A O no hydrogen 2.871 N/A VAL 383.A N LEU 390.A O no hydrogen 2.798 N/A GLY 384.A N SER 243.A O no hydrogen 2.874 N/A ALA 385.A N PHE 388.A O no hydrogen 2.850 N/A PHE 388.A N ALA 385.A O no hydrogen 2.795 N/A ARG 389.A N HIS 216.A O no hydrogen 3.001 N/A ARG 389.A NH2 ASP 219.A OD1 no hydrogen 3.544 N/A LEU 390.A N VAL 383.A O no hydrogen 2.996 N/A LYS 391.A N GLN 213.A O no hydrogen 2.857 N/A ALA 392.A N LEU 381.A O no hydrogen 3.011 N/A ARG 393.A NH2 GLY 394.A O no hydrogen 2.729 N/A GLY 394.A N THR 379.A O no hydrogen 2.814 N/A ARG 395.A N ARG 410.A O no hydrogen 3.004 N/A ILE 396.A N ASP 377.A O no hydrogen 3.076 N/A ARG 398.A N LYS 375.A O no hydrogen 2.665 N/A PHE 399.A N LYS 375.A O no hydrogen 3.046 N/A TRP 402.A N THR 372.A O no hydrogen 2.824 N/A TRP 402.A NE1 SER 254.A O no hydrogen 3.137 N/A TRP 402.A NE1 SER 254.A OG no hydrogen 3.140 N/A THR 403.A N ASP 400.A O no hydrogen 3.091 N/A THR 403.A OG1 ASP 400.A O no hydrogen 2.559 N/A LYS 404.A N GLY 401.A O no hydrogen 2.945 N/A VAL 405.A N TRP 402.A O no hydrogen 3.216 N/A MET 406.A N THR 403.A O no hydrogen 3.160 N/A ASN 416.A N ASP 419.A OD2 no hydrogen 2.912 N/A GLY 418.A N VAL 244.A O no hydrogen 2.783 N/A ASP 419.A N ASN 416.A O no hydrogen 3.057 N/A LEU 421.A N TYR 242.A O no hydrogen 2.774 N/A THR 422.A N THR 203.A O no hydrogen 3.157 N/A VAL 424.A N SER 201.A O no hydrogen 2.925 N/A GLU 425.A N SER 201.A O no hydrogen 3.363 N/A LEU 426.A N GLU 425.A OE2 no hydrogen 3.187 N/A THR 427.A N ASP 199.A O no hydrogen 2.723 N/A ALA 429.A N GLU 197.A O no hydrogen 2.567 N/A HIS 431.A N PHE 195.A O no hydrogen 2.679 N/A THR 433.A N GLU 193.A O no hydrogen 2.960 N/A THR 433.A OG1 GLU 193.A O no hydrogen 3.507 N/A ARG 438.A NH1 GLU 184.A OE1 no hydrogen 2.728 N/A ARG 438.A NH1 GLU 184.A OE2 no hydrogen 3.155 N/A ARG 438.A NH1 PHE 479.A O no hydrogen 3.241 N/A ARG 438.A NH2 GLU 184.A OE2 no hydrogen 3.088 N/A SER 440.A N SER 443.A OG no hydrogen 3.025 N/A SER 440.A OG SER 443.A OG no hydrogen 2.329 N/A SER 443.A N SER 440.A OG no hydrogen 2.848 N/A SER 443.A OG SER 440.A OG no hydrogen 2.329 N/A LEU 444.A N SER 440.A O no hydrogen 2.990 N/A VAL 445.A N GLU 441.A O no hydrogen 3.204 N/A LYS 446.A N ALA 442.A O no hydrogen 2.998 N/A GLU 447.A N SER 443.A O no hydrogen 2.989 N/A LEU 448.A N LEU 444.A O no hydrogen 2.895 N/A GLU 449.A N VAL 445.A O no hydrogen 2.899 N/A LYS 450.A N LYS 446.A O no hydrogen 2.812 N/A LYS 450.A NZ GLU 447.A OE1 no hydrogen 3.555 N/A ARG 451.A N GLU 447.A O no hydrogen 2.911 N/A ARG 451.A NE GLU 447.A OE2 no hydrogen 2.613 N/A GLY 452.A N GLU 449.A O no hydrogen 2.967 N/A ILE 453.A N LEU 448.A O no hydrogen 2.954 N/A GLY 454.A N LEU 448.A O no hydrogen 3.139 N/A ARG 455.A N THR 458.A OG1 no hydrogen 2.884 N/A ARG 455.A NH2 ASP 513.A OD2 no hydrogen 2.504 N/A THR 458.A N ARG 455.A O no hydrogen 2.857 N/A THR 458.A OG1 ARG 455.A O no hydrogen 3.204 N/A TYR 459.A N ARG 455.A O no hydrogen 2.921 N/A SER 461.A OG THR 458.A O no hydrogen 2.591 N/A ILE 462.A N THR 458.A O no hydrogen 2.811 N/A ILE 463.A N TYR 459.A O no hydrogen 3.099 N/A SER 464.A N ALA 460.A O no hydrogen 2.963 N/A SER 464.A OG ALA 460.A O no hydrogen 3.070 N/A THR 465.A N SER 461.A O no hydrogen 2.798 N/A THR 465.A OG1 SER 461.A O no hydrogen 2.998 N/A ILE 466.A N ILE 462.A O no hydrogen 3.105 N/A GLN 467.A N SER 464.A O no hydrogen 3.225 N/A ASP 468.A N SER 464.A O no hydrogen 3.059 N/A ARG 469.A N THR 465.A O no hydrogen 2.853 N/A GLY 470.A N GLN 467.A O no hydrogen 2.674 N/A TYR 471.A N ILE 466.A O no hydrogen 3.130 N/A TYR 471.A OH SER 168.A O no hydrogen 2.438 N/A ARG 473.A N TYR 480.A O no hydrogen 2.787 N/A ARG 473.A NH1 GLU 482.A OE1 no hydrogen 3.458 N/A ARG 473.A NH2 GLU 475.A OE2 no hydrogen 3.175 N/A GLU 475.A N ARG 478.A O no hydrogen 2.767 N/A ARG 477.A NH1 SER 270.A O no hydrogen 3.561 N/A ARG 478.A N GLU 475.A O no hydrogen 2.820 N/A PHE 479.A N PHE 439.A O no hydrogen 2.695 N/A TYR 480.A N ARG 473.A O no hydrogen 2.748 N/A ALA 481.A N GLU 184.A OE1 no hydrogen 2.964 N/A GLU 482.A N TYR 471.A O no hydrogen 2.887 N/A LYS 483.A NZ GLU 482.A OE1 no hydrogen 3.429 N/A GLU 486.A N GLU 482.A O no hydrogen 3.066 N/A ILE 487.A N LYS 483.A O no hydrogen 2.834 N/A VAL 488.A N MET 484.A O no hydrogen 2.848 N/A THR 489.A N GLY 485.A O no hydrogen 2.880 N/A THR 489.A OG1 GLY 485.A O no hydrogen 2.791 N/A ASP 490.A N GLU 486.A O no hydrogen 3.059 N/A ARG 491.A N ILE 487.A O no hydrogen 3.195 N/A ARG 491.A NE ARG 550.A O no hydrogen 2.907 N/A ARG 491.A NH1 ILE 487.A O no hydrogen 3.018 N/A ARG 491.A NH2 PRO 551.A O no hydrogen 2.956 N/A LEU 492.A N VAL 488.A O no hydrogen 2.790 N/A GLU 493.A N THR 489.A O no hydrogen 2.783 N/A GLU 494.A N ASP 490.A O no hydrogen 2.975 N/A ASN 495.A N ARG 491.A O no hydrogen 3.009 N/A ASN 495.A ND2 ARG 491.A O no hydrogen 3.634 N/A PHE 496.A N LEU 492.A O no hydrogen 2.708 N/A MET 500.A N PHE 496.A O no hydrogen 3.012 N/A ASN 501.A N GLU 498.A O no hydrogen 3.289 N/A THR 505.A N ASN 501.A O no hydrogen 3.068 N/A THR 505.A OG1 ASN 501.A O no hydrogen 2.840 N/A ALA 506.A N TYR 502.A O no hydrogen 3.013 N/A GLN 507.A N ASP 503.A O no hydrogen 2.846 N/A MET 508.A N PHE 504.A O no hydrogen 3.029 N/A ASN 510.A N ALA 506.A O no hydrogen 3.308 N/A SER 511.A N GLN 507.A O no hydrogen 2.703 N/A SER 511.A OG GLN 507.A O no hydrogen 3.351 N/A SER 511.A OG GLN 507.A OE1 no hydrogen 3.241 N/A LEU 512.A N MET 508.A O no hydrogen 2.988 N/A ASP 513.A N GLU 509.A O no hydrogen 3.103 N/A GLN 514.A N ASN 510.A O no hydrogen 2.830 N/A VAL 515.A N SER 511.A O no hydrogen 3.130 N/A ALA 516.A N LEU 512.A O no hydrogen 3.046 N/A ASN 517.A N ASP 513.A O no hydrogen 3.149 N/A ASN 517.A ND2 ASP 513.A O no hydrogen 2.848 N/A HIS 518.A N VAL 515.A O no hydrogen 2.985 N/A GLU 519.A N GLN 514.A O no hydrogen 2.655 N/A LYS 523.A N GLU 521.A OE2 no hydrogen 3.307 N/A LYS 523.A NZ ASN 54.A O no hydrogen 2.803 N/A ALA 524.A N GLU 521.A OE1 no hydrogen 2.972 N/A VAL 525.A N GLU 521.A O no hydrogen 2.982 N/A LEU 526.A N TRP 522.A O no hydrogen 2.796 N/A ASP 527.A N LYS 523.A O no hydrogen 2.873 N/A HIS 528.A N ALA 524.A O no hydrogen 2.988 N/A PHE 529.A N VAL 525.A O no hydrogen 2.989 N/A PHE 530.A N LEU 526.A O no hydrogen 2.859 N/A SER 531.A N ASP 527.A O no hydrogen 3.064 N/A ASP 532.A N HIS 528.A O no hydrogen 3.224 N/A PHE 533.A N PHE 529.A O no hydrogen 2.862 N/A THR 534.A N PHE 530.A O no hydrogen 2.800 N/A THR 534.A OG1 PHE 530.A O no hydrogen 2.878 N/A GLN 535.A N SER 531.A O no hydrogen 3.310 N/A GLN 536.A N ASP 532.A O no hydrogen 3.300 N/A LEU 537.A N PHE 533.A O no hydrogen 2.763 N/A ASP 538.A N THR 534.A O no hydrogen 2.702 N/A ASP 538.A N GLN 535.A O no hydrogen 3.108 N/A LYS 539.A N GLN 535.A O no hydrogen 3.168 N/A ALA 540.A N GLN 536.A O no hydrogen 3.088 N/A GLU 541.A N ASP 538.A O no hydrogen 3.364 N/A LYS 542.A N LYS 539.A O no hydrogen 2.800 N/A LYS 542.A NZ ASP 538.A O no hydrogen 3.546 N/A GLU 546.A N ASP 543.A O no hydrogen 2.837 N/A GLY 547.A N PRO 544.A O no hydrogen 3.061 N/A GLY 548.A N ASP 543.A O no hydrogen 3.080 N/A MET 549.A N ALA 540.A O no hydrogen 2.912 N/A ARG 550.A NH1 GLU 494.A OE1 no hydrogen 3.103 N/A ASN 552.A N LYS 162.A O no hydrogen 3.055 N/A