Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4po7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N GLN 473.A OE1 no hydrogen 3.268 N/A LYS 10.A NZ ARG 5.A O no hydrogen 2.720 N/A LEU 11.A N VAL 8.A O no hydrogen 3.186 N/A ALA 12.A N VAL 8.A O no hydrogen 2.742 N/A ASN 14.A N LEU 11.A O no hydrogen 2.842 N/A ASN 14.A ND2 LYS 10.A O no hydrogen 2.834 N/A ASN 14.A ND2 ASP 520.A OD2 no hydrogen 2.989 N/A THR 15.A OG1 LEU 11.A O no hydrogen 2.778 N/A THR 15.A OG1 TYR 475.A OH no hydrogen 2.669 N/A HIS 16.A N THR 515.A O no hydrogen 2.802 N/A HIS 18.A N SER 513.A O no hydrogen 2.905 N/A PHE 20.A N TRP 511.A O no hydrogen 2.880 N/A SER 26.A OG THR 44.A O no hydrogen 3.495 N/A SER 28.A N LEU 42.A O no hydrogen 2.863 N/A SER 30.A N LEU 40.A O no hydrogen 2.924 N/A VAL 32.A N VAL 38.A O no hydrogen 2.988 N/A ASP 34.A N ASN 93.A OD1 no hydrogen 2.760 N/A SER 35.A N GLU 490.A OE2 no hydrogen 2.916 N/A SER 35.A OG ASP 34.A OD2 no hydrogen 3.247 N/A THR 36.A OG1 VAL 32.A O no hydrogen 2.691 N/A THR 36.A OG1 GLY 33.A O no hydrogen 3.464 N/A VAL 38.A N THR 36.A OG1 no hydrogen 3.298 N/A ILE 39.A N SER 62.A O no hydrogen 3.066 N/A LEU 40.A N SER 30.A O no hydrogen 2.853 N/A VAL 41.A N TYR 60.A O no hydrogen 2.963 N/A LEU 42.A N SER 28.A O no hydrogen 2.825 N/A THR 43.A N LYS 58.A O no hydrogen 3.193 N/A THR 44.A OG1 ILE 81.A O no hydrogen 2.983 N/A PHE 45.A N GLN 56.A O no hydrogen 2.769 N/A ILE 51.A N PRO 48.A O no hydrogen 3.130 N/A GLN 56.A N PHE 45.A O no hydrogen 3.055 N/A SER 57.A OG THR 43.A O no hydrogen 3.230 N/A LYS 58.A N THR 43.A OG1 no hydrogen 3.296 N/A LYS 58.A NZ ASP 71.A OD2 no hydrogen 2.850 N/A LEU 59.A N THR 73.A OG1 no hydrogen 2.970 N/A TYR 60.A N VAL 41.A O no hydrogen 2.921 N/A TYR 60.A OH ASP 21.A O no hydrogen 3.174 N/A ARG 61.A N LYS 70.A O no hydrogen 2.851 N/A ARG 61.A NE PHE 118.A O no hydrogen 2.826 N/A ARG 61.A NH1 GLU 63.A OE1 no hydrogen 3.524 N/A ARG 61.A NH2 PHE 118.A O no hydrogen 3.371 N/A SER 62.A N ILE 39.A O no hydrogen 2.925 N/A SER 62.A OG ASP 64.A OD1 no hydrogen 2.746 N/A SER 62.A OG ASN 68.A O no hydrogen 2.985 N/A ASP 64.A N SER 62.A OG no hydrogen 3.247 N/A TYR 65.A N GLY 37.A O no hydrogen 2.943 N/A TYR 65.A OH GLU 490.A OE2 no hydrogen 2.659 N/A GLY 66.A N SER 62.A OG no hydrogen 3.014 N/A LYS 67.A N ASP 64.A O no hydrogen 3.403 N/A LYS 67.A NZ ASP 517.A OD2 no hydrogen 2.705 N/A ASN 68.A N ASP 64.A OD1 no hydrogen 2.945 N/A ASN 68.A ND2 ASP 64.A OD2 no hydrogen 2.998 N/A LYS 70.A N ARG 61.A O no hydrogen 2.732 N/A ILE 72.A N LEU 59.A O no hydrogen 2.838 N/A THR 73.A N ASP 71.A OD1 no hydrogen 3.135 N/A THR 73.A OG1 ASP 71.A OD1 no hydrogen 2.372 N/A LEU 75.A N ILE 72.A O no hydrogen 2.855 N/A ILE 76.A N THR 73.A O no hydrogen 3.060 N/A ASN 77.A N ASP 74.A O no hydrogen 3.076 N/A ASN 78.A N THR 73.A O no hydrogen 3.103 N/A THR 79.A N ILE 76.A O no hydrogen 3.158 N/A THR 79.A OG1 ILE 76.A O no hydrogen 2.879 N/A ILE 81.A N SER 57.A OG no hydrogen 3.189 N/A ARG 82.A N THR 100.A O no hydrogen 2.943 N/A GLY 86.A N ARG 82.A O no hydrogen 3.293 N/A GLY 86.A N THR 83.A O no hydrogen 3.079 N/A ALA 88.A N VAL 98.A O no hydrogen 2.912 N/A GLY 90.A N LYS 96.A O no hydrogen 2.587 N/A ASN 93.A ND2 ASP 34.A O no hydrogen 3.170 N/A SER 94.A N PRO 91.A O no hydrogen 3.200 N/A SER 94.A OG PRO 91.A O no hydrogen 2.773 N/A LYS 96.A NZ SER 142.A OG no hydrogen 2.409 N/A LYS 96.A NZ ASP 143.A OD1 no hydrogen 2.657 N/A VAL 97.A N SER 115.A O no hydrogen 2.786 N/A VAL 98.A N ALA 88.A O no hydrogen 3.037 N/A LEU 99.A N PHE 113.A O no hydrogen 3.027 N/A ALA 101.A N ARG 111.A O no hydrogen 2.956 N/A GLU 102.A N PHE 80.A O no hydrogen 2.927 N/A SER 107.A N SER 104.A O no hydrogen 3.334 N/A SER 107.A OG SER 104.A O no hydrogen 2.997 N/A GLY 110.A N PHE 129.A O no hydrogen 2.821 N/A ARG 111.A NE ASP 126.A OD1 no hydrogen 2.776 N/A ARG 111.A NH2 ASP 126.A OD1 no hydrogen 2.699 N/A ARG 111.A NH2 ASP 126.A OD2 no hydrogen 3.231 N/A ILE 112.A N THR 125.A O no hydrogen 3.068 N/A PHE 113.A N LEU 99.A O no hydrogen 2.858 N/A ARG 114.A N VAL 123.A O no hydrogen 2.897 N/A ARG 114.A NH1 THR 125.A OG1 no hydrogen 2.760 N/A SER 115.A N VAL 97.A O no hydrogen 2.812 N/A SER 115.A OG ASP 117.A OD1 no hydrogen 2.868 N/A SER 115.A OG ASN 121.A O no hydrogen 3.108 N/A ASP 117.A N SER 115.A OG no hydrogen 3.427 N/A PHE 118.A N GLY 95.A O no hydrogen 3.003 N/A ALA 119.A N SER 115.A OG no hydrogen 2.894 N/A LYS 120.A N ASP 117.A O no hydrogen 3.175 N/A ASN 121.A N ASP 117.A OD1 no hydrogen 3.141 N/A ASN 121.A ND2 ASP 117.A OD2 no hydrogen 2.434 N/A VAL 123.A N ARG 114.A O no hydrogen 2.889 N/A THR 125.A N ILE 112.A O no hydrogen 3.011 N/A LEU 127.A N GLY 110.A O no hydrogen 2.591 N/A HIS 130.A NE2 SER 107.A O no hydrogen 3.023 N/A LEU 132.A N LEU 148.A O no hydrogen 2.636 N/A THR 133.A OG1 GLN 134.A O no hydrogen 3.435 N/A GLN 134.A NE2 PHE 85.A O no hydrogen 3.077 N/A MET 136.A N LEU 146.A O no hydrogen 3.027 N/A TYR 137.A OH ALA 88.A O no hydrogen 2.650 N/A SER 138.A N TYR 144.A O no hydrogen 2.940 N/A SER 138.A OG ASN 180.A OD1 no hydrogen 2.696 N/A ASN 141.A N SER 138.A O no hydrogen 2.959 N/A ASP 143.A N ASN 141.A OD1 no hydrogen 3.165 N/A TYR 144.A N ASN 141.A O no hydrogen 2.789 N/A LEU 145.A N SER 157.A O no hydrogen 2.963 N/A LEU 146.A N MET 136.A O no hydrogen 3.099 N/A ALA 147.A N TRP 155.A O no hydrogen 2.993 N/A LEU 148.A N THR 133.A OG1 no hydrogen 3.288 N/A SER 149.A N GLY 153.A O no hydrogen 2.812 N/A THR 150.A N HIS 130.A O no hydrogen 2.909 N/A GLU 151.A N SER 149.A OG no hydrogen 2.988 N/A ASN 152.A N SER 149.A O no hydrogen 3.024 N/A GLY 153.A N SER 149.A OG no hydrogen 2.918 N/A LEU 154.A N HIS 168.A O no hydrogen 2.846 N/A TRP 155.A N ALA 147.A O no hydrogen 2.879 N/A VAL 156.A N GLU 165.A O no hydrogen 2.997 N/A SER 157.A N LEU 145.A O no hydrogen 2.843 N/A SER 157.A OG ASN 159.A OD1 no hydrogen 2.876 N/A SER 157.A OG LYS 163.A O no hydrogen 3.005 N/A ASN 159.A N SER 157.A OG no hydrogen 3.350 N/A PHE 160.A N ASP 143.A O no hydrogen 2.772 N/A GLY 161.A N SER 157.A OG no hydrogen 2.810 N/A GLY 162.A N ASN 159.A O no hydrogen 3.448 N/A LYS 163.A N ASN 159.A OD1 no hydrogen 2.797 N/A TRP 164.A NE1 GLY 161.A O no hydrogen 2.759 N/A GLU 165.A N VAL 156.A O no hydrogen 3.132 N/A ILE 167.A N LEU 154.A O no hydrogen 2.853 N/A LYS 169.A NZ GLU 166.A OE1 no hydrogen 2.961 N/A VAL 171.A N ASN 152.A O no hydrogen 2.882 N/A CYS 172.A N THR 185.A O no hydrogen 3.078 N/A LYS 175.A N PHE 183.A O no hydrogen 2.800 N/A TRP 176.A NE1 MET 136.A O no hydrogen 2.814 N/A GLY 177.A N THR 181.A O no hydrogen 2.571 N/A THR 181.A N SER 178.A O no hydrogen 3.030 N/A THR 181.A OG1 SER 178.A O no hydrogen 3.087 N/A ILE 182.A N THR 204.A O no hydrogen 2.996 N/A PHE 183.A N LYS 175.A O no hydrogen 2.912 N/A PHE 184.A N TRP 202.A O no hydrogen 3.110 N/A THR 185.A N LEU 173.A O no hydrogen 2.981 N/A THR 186.A N GLU 200.A O no hydrogen 2.777 N/A THR 186.A OG1 GLU 200.A O no hydrogen 3.064 N/A TYR 187.A N ALA 170.A O no hydrogen 3.083 N/A ALA 188.A N ASP 195.A OD2 no hydrogen 3.011 N/A ASN 189.A N ASP 195.A OD2 no hydrogen 3.413 N/A ASP 195.A N SER 191.A O no hydrogen 3.109 N/A ALA 198.A N ASP 195.A O no hydrogen 2.936 N/A LEU 199.A N ILE 218.A O no hydrogen 3.048 N/A GLU 200.A N THR 186.A O no hydrogen 2.927 N/A LEU 201.A N GLY 215.A O no hydrogen 2.686 N/A TRP 202.A N PHE 184.A O no hydrogen 2.698 N/A ARG 203.A N LYS 212.A O no hydrogen 3.046 N/A ARG 203.A NH1 GLN 248.A O no hydrogen 2.836 N/A ARG 203.A NH1 ASP 250.A OD1 no hydrogen 3.392 N/A ARG 203.A NH1 ASP 250.A OD2 no hydrogen 3.356 N/A ARG 203.A NH2 ASP 250.A OD2 no hydrogen 3.277 N/A THR 204.A N ILE 182.A O no hydrogen 3.044 N/A THR 204.A OG1 ASP 206.A OD1 no hydrogen 3.130 N/A THR 204.A OG1 SER 210.A O no hydrogen 2.636 N/A ASP 206.A N ASP 206.A OD1 no hydrogen 2.437 N/A GLY 208.A N THR 204.A OG1 no hydrogen 2.979 N/A LYS 209.A N ASP 206.A O no hydrogen 3.392 N/A SER 210.A N ASP 206.A OD1 no hydrogen 3.198 N/A SER 210.A OG ASP 206.A OD1 no hydrogen 2.899 N/A SER 210.A OG ASP 206.A OD2 no hydrogen 2.629 N/A LYS 212.A N ARG 203.A O no hydrogen 2.998 N/A LYS 212.A NZ ASP 250.A OD2 no hydrogen 2.909 N/A THR 213.A OG1 GLU 200.A OE1 no hydrogen 3.200 N/A ILE 214.A N LEU 201.A O no hydrogen 2.815 N/A LYS 217.A NZ ALA 234.A O no hydrogen 2.911 N/A LYS 217.A NZ ASP 235.A OD1 no hydrogen 2.789 N/A ILE 218.A N LEU 199.A O no hydrogen 2.753 N/A TYR 219.A N SER 231.A O no hydrogen 2.814 N/A SER 220.A N SER 231.A OG no hydrogen 3.119 N/A GLY 222.A N PHE 229.A O no hydrogen 2.800 N/A GLY 224.A N PHE 227.A O no hydrogen 2.988 N/A ARG 226.A NH1 ASP 273.A O no hydrogen 3.504 N/A ARG 226.A NH1 ASP 296.A O no hydrogen 2.497 N/A ARG 226.A NH2 ASP 296.A O no hydrogen 3.171 N/A PHE 227.A N GLY 224.A O no hydrogen 2.787 N/A LEU 228.A N SER 245.A O no hydrogen 2.782 N/A PHE 229.A N GLY 222.A O no hydrogen 2.857 N/A ALA 230.A N HIS 243.A O no hydrogen 2.949 N/A SER 231.A N SER 220.A O no hydrogen 2.863 N/A SER 231.A OG SER 220.A O no hydrogen 3.234 N/A VAL 232.A N ARG 241.A O no hydrogen 2.968 N/A MET 233.A N LYS 217.A O no hydrogen 3.125 N/A ALA 234.A N THR 239.A O no hydrogen 2.884 N/A THR 238.A N ASP 237.A OD2 no hydrogen 2.606 N/A THR 239.A OG1 ASP 237.A OD1 no hydrogen 2.498 N/A ARG 240.A N VAL 260.A O no hydrogen 2.883 N/A ARG 240.A NH1 GLN 264.A O no hydrogen 3.147 N/A ARG 240.A NH2 GLN 264.A O no hydrogen 2.656 N/A ARG 241.A N VAL 232.A O no hydrogen 2.947 N/A ARG 241.A NH1 GLU 611.A OE1 no hydrogen 3.000 N/A ARG 241.A NH2 LEU 257.A O no hydrogen 3.008 N/A ARG 241.A NH2 GLU 611.A OE1 no hydrogen 3.003 N/A HIS 243.A N ALA 230.A O no hydrogen 2.815 N/A VAL 244.A N SER 253.A O no hydrogen 2.881 N/A SER 245.A N LEU 228.A O no hydrogen 2.788 N/A SER 245.A OG ASP 247.A OD1 no hydrogen 2.727 N/A SER 245.A OG THR 251.A O no hydrogen 2.994 N/A ASP 247.A N SER 245.A OG no hydrogen 3.306 N/A GLY 249.A N SER 245.A OG no hydrogen 2.759 N/A ASP 250.A N ASP 247.A O no hydrogen 3.448 N/A THR 251.A N ASP 247.A OD1 no hydrogen 2.866 N/A THR 251.A OG1 ASP 247.A OD2 no hydrogen 2.301 N/A SER 253.A N VAL 244.A O no hydrogen 3.098 N/A SER 253.A OG HIS 620.A NE2 no hydrogen 3.022 N/A ALA 255.A N ILE 242.A O no hydrogen 3.029 N/A GLN 256.A N ILE 299.A O no hydrogen 2.871 N/A VAL 260.A N ARG 240.A O no hydrogen 2.844 N/A GLY 261.A N GLN 264.A OE1 no hydrogen 2.918 N/A GLN 264.A NE2 ASP 281.A O no hydrogen 2.866 N/A TYR 266.A OH ARG 240.A O no hydrogen 3.115 N/A TYR 266.A OH PRO 258.A O no hydrogen 2.802 N/A SER 267.A N HIS 279.A O no hydrogen 2.927 N/A SER 267.A OG TYR 310.A OH no hydrogen 2.685 N/A LEU 269.A N PHE 277.A O no hydrogen 2.953 N/A ASN 272.A N MET 275.A O no hydrogen 3.005 N/A ASP 274.A N ASN 272.A OD1 no hydrogen 2.741 N/A MET 275.A N ASN 272.A OD1 no hydrogen 2.808 N/A VAL 276.A N SER 294.A OG no hydrogen 3.101 N/A PHE 277.A N ALA 270.A O no hydrogen 2.783 N/A MET 278.A N PHE 292.A O no hydrogen 2.680 N/A HIS 279.A N SER 267.A O no hydrogen 2.968 N/A HIS 279.A ND1 HIS 308.A ND1 no hydrogen 2.940 N/A VAL 280.A N THR 290.A O no hydrogen 2.939 N/A ASP 281.A N PHE 265.A O no hydrogen 3.001 N/A GLU 282.A N PHE 288.A O no hydrogen 3.215 N/A THR 286.A OG1 PHE 288.A O no hydrogen 3.298 N/A GLY 289.A N HIS 308.A O no hydrogen 2.811 N/A THR 290.A N VAL 280.A O no hydrogen 3.025 N/A ILE 291.A N LEU 305.A O no hydrogen 2.874 N/A PHE 292.A N MET 278.A O no hydrogen 2.669 N/A THR 293.A N SER 302.A O no hydrogen 3.000 N/A THR 293.A OG1 SER 302.A O no hydrogen 3.559 N/A THR 293.A OG1 SER 302.A OG no hydrogen 3.169 N/A SER 294.A N VAL 276.A O no hydrogen 3.115 N/A SER 294.A OG ASP 295.A O no hydrogen 2.764 N/A ASP 295.A N VAL 300.A O no hydrogen 2.827 N/A ARG 297.A N ASP 295.A OD1 no hydrogen 3.206 N/A ARG 297.A NE ASP 295.A OD2 no hydrogen 2.882 N/A ARG 297.A NH2 ASP 295.A OD2 no hydrogen 3.092 N/A GLY 298.A N ASP 295.A O no hydrogen 3.148 N/A ILE 299.A N ASP 295.A OD1 no hydrogen 2.987 N/A VAL 300.A N ASP 295.A OD1 no hydrogen 3.148 N/A TYR 301.A N GLN 256.A OE1 no hydrogen 3.420 N/A TYR 301.A OH GLY 298.A O no hydrogen 2.781 N/A SER 302.A N THR 293.A O no hydrogen 2.860 N/A SER 302.A OG THR 293.A OG1 no hydrogen 3.169 N/A SER 304.A N ILE 291.A O no hydrogen 2.799 N/A SER 304.A OG GLY 349.A O no hydrogen 2.727 N/A LEU 305.A N ILE 291.A O no hydrogen 3.256 N/A ARG 307.A NE LEU 334.A O no hydrogen 2.541 N/A ARG 307.A NH2 SER 335.A O no hydrogen 2.661 N/A HIS 308.A N GLY 289.A O no hydrogen 2.662 N/A HIS 308.A ND1 HIS 279.A ND1 no hydrogen 2.940 N/A HIS 308.A NE2 THR 331.A OG1 no hydrogen 2.466 N/A LEU 309.A N SER 332.A O no hydrogen 2.932 N/A TYR 310.A N GLY 287.A O no hydrogen 3.200 N/A TYR 310.A OH SER 267.A OG no hydrogen 2.685 N/A THR 311.A N GLU 316.A O no hydrogen 3.174 N/A THR 312.A OG1 ASP 285.A OD1 no hydrogen 2.957 N/A GLY 315.A N THR 311.A O no hydrogen 3.320 N/A GLU 316.A N THR 311.A OG1 no hydrogen 3.017 N/A THR 317.A OG1 LEU 309.A O no hydrogen 3.383 N/A PHE 319.A N THR 317.A OG1 no hydrogen 3.202 N/A THR 320.A N ILE 330.A O no hydrogen 2.724 N/A THR 320.A OG1 ASP 318.A O no hydrogen 2.915 N/A VAL 322.A N VAL 328.A O no hydrogen 2.976 N/A THR 323.A N SER 395.A OG no hydrogen 3.213 N/A THR 323.A OG1 SER 395.A OG no hydrogen 2.977 N/A SER 324.A OG ILE 402.A O no hydrogen 2.787 N/A LEU 325.A N VAL 322.A O no hydrogen 3.404 N/A ARG 326.A NE GLU 554.A OE1 no hydrogen 3.318 N/A ARG 326.A NH1 ILE 549.A O no hydrogen 2.794 N/A ARG 326.A NH2 ILE 549.A O no hydrogen 3.247 N/A ARG 326.A NH2 TYR 552.A O no hydrogen 3.139 N/A VAL 328.A N LEU 325.A O no hydrogen 3.259 N/A TYR 329.A N THR 345.A O no hydrogen 3.039 N/A ILE 330.A N THR 320.A O no hydrogen 2.935 N/A THR 331.A N MET 343.A O no hydrogen 2.967 N/A THR 331.A OG1 HIS 308.A NE2 no hydrogen 2.466 N/A SER 332.A OG ASP 318.A OD2 no hydrogen 2.447 N/A VAL 333.A N GLN 341.A O no hydrogen 2.837 N/A LEU 334.A N ARG 307.A O no hydrogen 2.832 N/A SER 335.A N SER 339.A O no hydrogen 3.060 N/A SER 335.A OG ASP 337.A OD1 no hydrogen 3.279 N/A SER 335.A OG ASP 337.A OD2 no hydrogen 3.263 N/A SER 335.A OG SER 339.A O no hydrogen 3.158 N/A SER 335.A OG SER 339.A OG no hydrogen 2.701 N/A SER 339.A N SER 335.A OG no hydrogen 3.082 N/A SER 339.A OG SER 335.A OG no hydrogen 2.701 N/A SER 339.A OG ASP 337.A OD1 no hydrogen 2.487 N/A GLN 341.A N VAL 333.A O no hydrogen 3.078 N/A GLN 341.A NE2 SER 339.A OG no hydrogen 2.797 N/A GLN 341.A NE2 ASP 411.A O no hydrogen 3.421 N/A THR 342.A N HIS 376.A ND1 no hydrogen 3.072 N/A MET 343.A N THR 331.A O no hydrogen 2.875 N/A ILE 344.A N THR 353.A O no hydrogen 2.884 N/A THR 345.A N TYR 329.A O no hydrogen 2.872 N/A THR 345.A OG1 ASP 347.A OD1 no hydrogen 3.001 N/A THR 345.A OG1 ARG 351.A O no hydrogen 2.895 N/A ASP 347.A N THR 345.A OG1 no hydrogen 3.409 N/A GLN 348.A N GLY 327.A O no hydrogen 2.892 N/A GLN 348.A NE2 PRO 630.A O no hydrogen 3.186 N/A GLY 349.A N THR 345.A OG1 no hydrogen 2.875 N/A GLY 350.A N ASP 347.A O no hydrogen 3.301 N/A ARG 351.A N ASP 347.A OD1 no hydrogen 3.021 N/A TRP 352.A NE1 SER 304.A OG no hydrogen 2.774 N/A THR 353.A N ILE 344.A O no hydrogen 3.069 N/A ARG 356.A NH2 GLU 359.A OE2 no hydrogen 2.765 N/A LYS 357.A NZ PRO 358.A O no hydrogen 3.281 N/A LYS 357.A NZ SER 361.A O no hydrogen 3.444 N/A SER 361.A N PRO 358.A O no hydrogen 3.178 N/A CYS 363.A SG ASN 369.A O no hydrogen 4.018 N/A CYS 363.A SG LYS 370.A O no hydrogen 3.380 N/A ASP 364.A N VAL 409.A O no hydrogen 2.718 N/A ALA 367.A N ASP 364.A O no hydrogen 3.261 N/A LYS 368.A N ASP 411.A OD2 no hydrogen 2.901 N/A ASN 371.A N ASN 369.A OD1 no hydrogen 3.096 N/A GLU 372.A N ASN 369.A O no hydrogen 3.319 N/A GLU 372.A N ASN 369.A OD1 no hydrogen 3.072 N/A SER 374.A N GLY 410.A O no hydrogen 3.232 N/A SER 374.A OG HIS 376.A NE2 no hydrogen 3.065 N/A SER 374.A OG GLY 410.A O no hydrogen 3.518 N/A LEU 375.A N LEU 355.A O no hydrogen 3.068 N/A HIS 376.A N SER 408.A O no hydrogen 2.853 N/A HIS 376.A NE2 GLY 410.A O no hydrogen 2.689 N/A ILE 377.A N THR 342.A OG1 no hydrogen 2.803 N/A HIS 378.A N HIS 406.A O no hydrogen 2.719 N/A HIS 378.A ND1 SER 382.A OG no hydrogen 2.825 N/A SER 380.A OG THR 317.A O no hydrogen 3.272 N/A TYR 381.A N ASP 318.A OD1 no hydrogen 2.727 N/A SER 382.A OG HIS 378.A ND1 no hydrogen 2.825 N/A ILE 383.A N ALA 379.A O no hydrogen 3.096 N/A SER 384.A N SER 380.A O no hydrogen 3.007 N/A SER 384.A OG TYR 381.A O no hydrogen 2.467 N/A SER 384.A OG GLN 385.A OE1 no hydrogen 3.425 N/A GLN 385.A N TYR 381.A O no hydrogen 3.035 N/A LYS 386.A N ILE 383.A O no hydrogen 3.067 N/A LEU 387.A N SER 382.A O no hydrogen 3.186 N/A VAL 389.A N LEU 387.A O no hydrogen 2.670 N/A LEU 394.A N ILE 404.A O no hydrogen 2.769 N/A SER 395.A OG THR 323.A OG1 no hydrogen 2.977 N/A ASN 398.A N ASN 398.A OD1 no hydrogen 2.345 N/A ASN 398.A ND2 GLY 492.A O no hydrogen 2.320 N/A ALA 399.A N GLU 396.A O no hydrogen 2.913 N/A GLY 401.A N SER 324.A O no hydrogen 2.792 N/A ILE 402.A N ALA 399.A O no hydrogen 3.243 N/A VAL 403.A N SER 423.A O no hydrogen 2.776 N/A ILE 404.A N LEU 394.A O no hydrogen 3.045 N/A ALA 405.A N TYR 421.A O no hydrogen 2.972 N/A HIS 406.A ND1 MET 391.A O no hydrogen 3.225 N/A GLY 407.A N ASP 419.A O no hydrogen 3.413 N/A SER 408.A N HIS 376.A O no hydrogen 2.899 N/A GLY 410.A N SER 374.A O no hydrogen 2.964 N/A ASP 411.A N THR 366.A OG1 no hydrogen 3.231 N/A ILE 413.A N ILE 340.A O no hydrogen 2.873 N/A SER 414.A N SER 408.A OG no hydrogen 3.135 N/A MET 416.A N SER 414.A OG no hydrogen 3.058 N/A VAL 420.A N LEU 434.A O no hydrogen 2.794 N/A TYR 421.A N ALA 405.A O no hydrogen 2.768 N/A ILE 422.A N THR 431.A O no hydrogen 2.800 N/A SER 423.A N VAL 403.A O no hydrogen 2.801 N/A SER 423.A OG SER 429.A O no hydrogen 2.805 N/A ASP 425.A N SER 423.A OG no hydrogen 3.406 N/A GLY 426.A N GLY 401.A O no hydrogen 2.702 N/A GLY 427.A N SER 423.A OG no hydrogen 2.945 N/A TYR 428.A OH HIS 537.A ND1 no hydrogen 2.739 N/A SER 429.A N ASP 425.A OD1 no hydrogen 3.085 N/A SER 429.A OG ASP 425.A OD2 no hydrogen 2.460 N/A TRP 430.A NE1 GLY 427.A O no hydrogen 2.965 N/A THR 431.A N ILE 422.A O no hydrogen 2.932 N/A LYS 432.A NZ ASP 419.A OD2 no hydrogen 3.170 N/A MET 433.A N VAL 420.A O no hydrogen 2.623 N/A LEU 434.A N VAL 420.A O no hydrogen 3.201 N/A GLY 436.A N ASP 419.A OD1 no hydrogen 3.058 N/A HIS 438.A N HIS 406.A NE2 no hydrogen 2.952 N/A HIS 438.A ND1 GLY 436.A O no hydrogen 2.761 N/A TYR 439.A N ILE 452.A O no hydrogen 2.738 N/A TYR 439.A OH HIS 454.A ND1 no hydrogen 3.338 N/A TYR 440.A OH ALA 392.A O no hydrogen 2.907 N/A TYR 440.A OH HIS 406.A ND1 no hydrogen 3.348 N/A THR 441.A N VAL 450.A O no hydrogen 2.963 N/A LEU 443.A N ILE 448.A O no hydrogen 2.810 N/A ASP 444.A N SER 495.A O no hydrogen 3.165 N/A SER 445.A N ALA 493.A O no hydrogen 2.821 N/A GLY 446.A N LEU 443.A O no hydrogen 3.148 N/A GLY 447.A N ASP 444.A O no hydrogen 2.770 N/A ILE 448.A N LEU 443.A O no hydrogen 3.191 N/A ILE 449.A N SER 465.A O no hydrogen 2.843 N/A VAL 450.A N THR 441.A O no hydrogen 2.917 N/A ALA 451.A N LYS 463.A O no hydrogen 2.696 N/A ILE 452.A N TYR 439.A O no hydrogen 2.818 N/A HIS 454.A N PRO 437.A O no hydrogen 2.956 N/A SER 455.A OG ARG 457.A O no hydrogen 3.186 N/A ARG 457.A N SER 455.A OG no hydrogen 2.967 N/A ILE 459.A N ILE 482.A O no hydrogen 2.828 N/A ASN 460.A ND2 THR 478.A O no hydrogen 3.125 N/A ILE 462.A N TYR 475.A O no hydrogen 2.842 N/A LYS 463.A N ALA 451.A O no hydrogen 2.823 N/A LYS 463.A NZ HIS 438.A NE2 no hydrogen 2.991 N/A PHE 464.A N GLN 473.A O no hydrogen 3.048 N/A SER 465.A N ILE 449.A O no hydrogen 2.804 N/A SER 465.A OG CYS 471.A O no hydrogen 2.599 N/A GLY 469.A N SER 465.A OG no hydrogen 3.023 N/A CYS 471.A N ASP 467.A OD1 no hydrogen 2.953 N/A CYS 471.A N ASP 467.A OD2 no hydrogen 3.270 N/A TRP 472.A NE1 GLY 469.A O no hydrogen 2.934 N/A GLN 473.A N PHE 464.A O no hydrogen 3.118 N/A TYR 475.A N ILE 462.A O no hydrogen 2.783 N/A TYR 475.A OH THR 15.A OG1 no hydrogen 2.669 N/A PHE 477.A N ASN 460.A O no hydrogen 3.098 N/A THR 478.A OG1 ASP 480.A O no hydrogen 3.496 N/A THR 478.A OG1 TYR 514.A OH no hydrogen 2.934 N/A ILE 482.A N ILE 459.A O no hydrogen 2.882 N/A TYR 483.A N PHE 503.A O no hydrogen 2.831 N/A THR 485.A N TRP 501.A O no hydrogen 2.951 N/A GLY 486.A N TRP 501.A O no hydrogen 3.441 N/A ALA 488.A N SER 499.A O no hydrogen 2.858 N/A ARG 494.A NH1 ARG 569.A O no hydrogen 3.127 N/A ARG 494.A NH1 TYR 571.A O no hydrogen 2.648 N/A ARG 494.A NH2 TYR 571.A O no hydrogen 3.418 N/A ASN 497.A N SER 495.A OG no hydrogen 3.047 N/A ILE 498.A N ILE 516.A O no hydrogen 3.195 N/A SER 499.A N ALA 488.A O no hydrogen 2.721 N/A SER 499.A OG THR 515.A OG1 no hydrogen 2.681 N/A ILE 500.A N TYR 514.A O no hydrogen 2.961 N/A TRP 501.A N GLY 486.A O no hydrogen 2.752 N/A GLY 502.A N VAL 512.A O no hydrogen 3.041 N/A PHE 503.A N TYR 483.A O no hydrogen 3.069 N/A THR 504.A N GLN 510.A O no hydrogen 3.136 N/A SER 506.A OG GLU 505.A O no hydrogen 2.624 N/A SER 509.A OG THR 504.A O no hydrogen 3.348 N/A GLN 510.A N THR 504.A OG1 no hydrogen 3.318 N/A VAL 512.A N GLY 502.A O no hydrogen 2.765 N/A SER 513.A N HIS 18.A O no hydrogen 3.249 N/A TYR 514.A N ILE 500.A O no hydrogen 2.917 N/A TYR 514.A OH GLN 17.A OE1 no hydrogen 3.094 N/A THR 515.A N HIS 16.A O no hydrogen 2.875 N/A THR 515.A OG1 GLY 66.A O no hydrogen 3.003 N/A THR 515.A OG1 SER 499.A OG no hydrogen 2.681 N/A ILE 516.A N ILE 498.A O no hydrogen 2.931 N/A ASP 517.A N ASN 14.A O no hydrogen 3.114 N/A PHE 518.A N MET 496.A O no hydrogen 3.011 N/A ILE 521.A N PHE 518.A O no hydrogen 3.193 N/A LEU 522.A N PHE 518.A O no hydrogen 3.293 N/A ARG 524.A NH1 ASP 530.A OD1 no hydrogen 3.351 N/A ARG 524.A NH1 ASP 530.A OD2 no hydrogen 2.778 N/A ARG 524.A NH2 MET 564.A O no hydrogen 3.345 N/A CYS 526.A N GLN 566.A O no hydrogen 3.058 N/A CYS 526.A SG ASN 567.A OD1 no hydrogen 3.999 N/A GLU 527.A N ASP 530.A OD2 no hydrogen 2.827 N/A ASP 530.A N GLU 527.A O no hydrogen 2.914 N/A TYR 531.A N GLU 528.A O no hydrogen 3.126 N/A TYR 531.A OH ASN 567.A OD1 no hydrogen 2.847 N/A THR 532.A N ARG 558.A O no hydrogen 2.757 N/A TRP 534.A N PHE 556.A O no hydrogen 2.954 N/A ALA 536.A N GLU 554.A O no hydrogen 3.081 N/A HIS 537.A ND1 TYR 428.A OH no hydrogen 2.739 N/A HIS 537.A NE2 ARG 326.A O no hydrogen 2.809 N/A SER 538.A OG ASP 546.A OD2 no hydrogen 2.444 N/A THR 539.A N ASP 546.A OD1 no hydrogen 2.658 N/A THR 539.A OG1 ASP 546.A OD1 no hydrogen 3.531 N/A ASP 540.A N ASP 546.A OD1 no hydrogen 2.769 N/A ASP 543.A N ASP 540.A O no hydrogen 2.833 N/A GLU 545.A N ASP 543.A OD1 no hydrogen 3.138 N/A ASP 546.A N ASP 543.A O no hydrogen 3.159 N/A CYS 548.A N GLU 545.A O no hydrogen 3.107 N/A CYS 548.A SG GLU 545.A O no hydrogen 3.250 N/A ILE 549.A N TYR 552.A O no hydrogen 2.976 N/A TYR 552.A N ILE 549.A O no hydrogen 3.468 N/A LYS 553.A N SER 578.A O no hydrogen 2.780 N/A LYS 553.A NZ TYR 544.A O no hydrogen 2.849 N/A LYS 553.A NZ ASP 546.A O no hydrogen 3.269 N/A GLN 555.A N GLN 576.A O no hydrogen 2.979 N/A PHE 556.A N TRP 534.A O no hydrogen 2.716 N/A LEU 557.A N THR 574.A O no hydrogen 2.962 N/A ARG 558.A N THR 532.A O no hydrogen 2.935 N/A ARG 558.A NH1 ASP 424.A O no hydrogen 2.677 N/A ARG 558.A NH2 ASP 424.A O no hydrogen 2.855 N/A ARG 560.A N ASP 530.A O no hydrogen 2.896 N/A ARG 560.A NE LYS 529.A O no hydrogen 3.135 N/A LYS 561.A NZ ASP 424.A OD2 no hydrogen 2.790 N/A LYS 561.A NZ GLN 470.A OE1 no hydrogen 2.794 N/A SER 563.A OG ASP 530.A OD1 no hydrogen 2.911 N/A GLN 566.A N ARG 524.A O no hydrogen 2.884 N/A ASN 567.A N ASP 444.A OD2 no hydrogen 2.626 N/A ASN 567.A ND2 ASP 444.A O no hydrogen 2.902 N/A GLY 568.A N ASP 444.A OD1 no hydrogen 2.923 N/A ARG 569.A NE SER 35.A OG no hydrogen 3.348 N/A ARG 569.A NH1 GLU 490.A OE1 no hydrogen 2.864 N/A ARG 569.A NH2 SER 35.A OG no hydrogen 2.824 N/A ARG 569.A NH2 GLU 490.A OE1 no hydrogen 2.828 N/A ARG 569.A NH2 GLU 490.A OE2 no hydrogen 3.090 N/A TYR 571.A N GLY 568.A O no hydrogen 3.340 N/A GLN 576.A N GLN 555.A O no hydrogen 2.828 N/A SER 578.A N LYS 553.A O no hydrogen 3.065 N/A CYS 580.A N GLY 551.A O no hydrogen 2.787 N/A CYS 580.A SG SER 578.A O no hydrogen 3.861 N/A CYS 582.A N GLY 636.A O no hydrogen 3.409 N/A SER 583.A N ASP 586.A OD2 no hydrogen 3.026 N/A ASP 586.A N SER 583.A O no hydrogen 3.037 N/A PHE 587.A N LEU 584.A O no hydrogen 2.986 N/A LEU 588.A N ARG 627.A O no hydrogen 2.567 N/A ASP 590.A N GLY 625.A O no hydrogen 2.933 N/A PHE 591.A N ASP 590.A OD1 no hydrogen 2.709 N/A TYR 594.A N VAL 600.A O no hydrogen 2.966 N/A ARG 595.A NH2 LEU 584.A O no hydrogen 3.550 N/A CYS 599.A N TYR 626.A OH no hydrogen 2.783 N/A VAL 600.A N TYR 594.A O no hydrogen 2.720 N/A GLN 602.A N GLY 592.A O no hydrogen 3.006 N/A GLN 602.A NE2 TYR 593.A O no hydrogen 3.681 N/A ASP 609.A N LYS 606.A O no hydrogen 3.236 N/A LEU 610.A N GLY 607.A O no hydrogen 3.001 N/A GLU 611.A N GLY 607.A O no hydrogen 3.131 N/A PHE 612.A N HIS 608.A O no hydrogen 2.865 N/A CYS 613.A N ASP 609.A O no hydrogen 3.036 N/A CYS 613.A SG LEU 647.A O no hydrogen 3.502 N/A LEU 614.A N LEU 610.A O no hydrogen 3.011 N/A TYR 615.A N PHE 612.A O no hydrogen 3.181 N/A ARG 617.A NE TRP 252.A O no hydrogen 2.840 N/A ARG 617.A NH2 TRP 252.A O no hydrogen 2.675 N/A GLU 618.A N GLU 618.A OE1 no hydrogen 2.484 N/A HIS 620.A N ARG 617.A O no hydrogen 2.797 N/A LEU 621.A N ARG 617.A O no hydrogen 3.136 N/A LEU 621.A N GLU 618.A O no hydrogen 2.946 N/A THR 622.A N GLU 618.A O no hydrogen 2.881 N/A THR 622.A OG1 GLU 618.A O no hydrogen 3.431 N/A THR 622.A OG1 GLU 619.A O no hydrogen 3.076 N/A THR 623.A OG1 PHE 591.A O no hydrogen 3.546 N/A ASN 624.A ND2 TYR 626.A O no hydrogen 2.783 N/A ARG 627.A N LEU 588.A O no hydrogen 2.659 N/A LYS 628.A NZ CYS 634.A O no hydrogen 3.359 N/A ILE 629.A N ASP 586.A O no hydrogen 3.045 N/A ASP 632.A N ILE 629.A O no hydrogen 3.075 N/A LYS 633.A N LEU 550.A O no hydrogen 3.027 N/A LYS 633.A NZ GLY 631.A O no hydrogen 3.339 N/A CYS 634.A N ASP 632.A OD1 no hydrogen 3.135 N/A CYS 634.A SG ASP 632.A OD1 no hydrogen 3.289 N/A GLN 635.A N CYS 580.A O no hydrogen 3.158 N/A VAL 638.A N CYS 582.A O no hydrogen 3.042 N/A LYS 645.A N THR 623.A O no hydrogen 3.458 N/A LYS 645.A NZ GLU 601.A OE1 no hydrogen 3.397 N/A LEU 647.A N LEU 621.A O no hydrogen 2.828 N/A LYS 650.A NZ PRO 603.A O no hydrogen 3.361 N/A CYS 651.A SG CYS 613.A O no hydrogen 3.501 N/A CYS 651.A SG LEU 647.A O no hydrogen 3.581 N/A CYS 651.A SG LYS 648.A O no hydrogen 3.212 N/A THR 652.A N LYS 648.A O no hydrogen 3.362 N/A THR 652.A OG1 LYS 648.A O no hydrogen 3.073 N/A THR 652.A OG1 LYS 649.A O no hydrogen 3.287 N/A SER 653.A N LYS 650.A O no hydrogen 3.372 N/A SER 653.A OG LYS 650.A O no hydrogen 2.406 N/A