Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c2u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A ND2 GLU 315.A OE2 no hydrogen 2.814 N/A ILE 3.A N VAL 316.A O no hydrogen 2.921 N/A ASN 5.A N LEU 314.A O no hydrogen 2.853 N/A ASN 5.A ND2 ILE 294.A O no hydrogen 2.875 N/A ASN 5.A ND2 SER 313.A O no hydrogen 2.984 N/A LEU 8.A N THR 292.A O no hydrogen 3.108 N/A LYS 9.A NZ PRO 6.A O no hydrogen 2.670 N/A GLY 10.A N GLU 291.A OE2 no hydrogen 2.840 N/A ASN 12.A N ARG 290.A O no hydrogen 2.785 N/A ASN 12.A ND2 LYS 9.A O no hydrogen 3.028 N/A ASN 12.A ND2 GLY 10.A O no hydrogen 3.680 N/A SER 16.A N ALA 27.A O no hydrogen 2.881 N/A SER 16.A OG LEU 77.A O no hydrogen 3.524 N/A ILE 17.A N SER 250.A OG no hydrogen 2.923 N/A VAL 18.A N TYR 25.A O no hydrogen 2.884 N/A ARG 19.A NE GLU 253.A O no hydrogen 2.890 N/A ARG 19.A NH1 GLY 21.A O no hydrogen 2.752 N/A ALA 20.A N ASP 23.A O no hydrogen 2.814 N/A ASP 23.A N ALA 20.A O no hydrogen 2.983 N/A TYR 24.A N SER 42.A O no hydrogen 2.804 N/A TYR 24.A OH GLN 255.A OE1 no hydrogen 2.609 N/A TYR 25.A N VAL 18.A O no hydrogen 2.939 N/A ILE 26.A N HIS 40.A O no hydrogen 2.923 N/A ALA 27.A N SER 16.A O no hydrogen 2.916 N/A THR 28.A N GLN 38.A O no hydrogen 2.861 N/A THR 28.A OG1 ASN 12.A OD1 no hydrogen 2.903 N/A SER 29.A N PRO 13.A O no hydrogen 3.159 N/A SER 29.A OG PRO 13.A O no hydrogen 3.365 N/A SER 29.A OG ASP 14.A OD2 no hydrogen 2.744 N/A PHE 31.A N ILE 72.A O no hydrogen 2.803 N/A GLU 32.A N GLU 32.A OE2 no hydrogen 2.727 N/A TRP 33.A N THR 30.A O no hydrogen 2.942 N/A PHE 34.A N THR 347.A O no hydrogen 2.774 N/A GLY 36.A N LEU 55.A O no hydrogen 2.929 N/A VAL 37.A N THR 30.A OG1 no hydrogen 2.871 N/A GLN 38.A N THR 28.A O no hydrogen 3.179 N/A GLN 38.A NE2 ASN 12.A OD1 no hydrogen 2.947 N/A ILE 39.A N ALA 52.A O no hydrogen 2.889 N/A HIS 40.A N ILE 26.A O no hydrogen 2.956 N/A HIS 41.A N HIS 49.A O no hydrogen 2.849 N/A HIS 41.A ND1 HIS 49.A NE2 no hydrogen 2.888 N/A HIS 41.A NE2 ASP 23.A OD1 no hydrogen 2.852 N/A SER 42.A N TYR 24.A O no hydrogen 2.889 N/A SER 42.A OG HIS 47.A O no hydrogen 2.706 N/A ASP 44.A N SER 42.A OG no hydrogen 3.122 N/A LEU 45.A N SER 42.A OG no hydrogen 2.883 N/A VAL 46.A N ASP 44.A OD1 no hydrogen 2.889 N/A HIS 47.A N ASP 44.A OD1 no hydrogen 2.933 N/A HIS 47.A ND1 ASP 44.A OD2 no hydrogen 2.861 N/A TRP 48.A NE1 LEU 45.A O no hydrogen 2.932 N/A HIS 49.A N HIS 41.A O no hydrogen 3.026 N/A HIS 49.A NE2 HIS 41.A ND1 no hydrogen 2.888 N/A VAL 51.A N ILE 39.A O no hydrogen 2.929 N/A ALA 52.A N ILE 39.A O no hydrogen 3.289 N/A HIS 53.A NE2 GLN 38.A OE1 no hydrogen 2.734 N/A LEU 55.A N GLY 36.A O no hydrogen 3.085 N/A GLU 59.A N THR 57.A OG1 no hydrogen 3.251 N/A PHE 60.A N THR 57.A O no hydrogen 3.000 N/A LEU 61.A N THR 57.A O no hydrogen 3.079 N/A GLY 65.A N LYS 377.A O.A no hydrogen 2.839 N/A GLY 65.A N LYS 377.A O.B no hydrogen 2.692 N/A ASN 66.A N MET 63.A O no hydrogen 2.851 N/A ASN 66.A ND2 ASP 90.A OD1 no hydrogen 2.860 N/A SER 69.A N GLU 32.A OE2 no hydrogen 2.809 N/A GLY 70.A N PRO 67.A O.A no hydrogen 2.950 N/A GLY 70.A N PRO 67.A O.B no hydrogen 2.903 N/A GLY 71.A N VAL 91.A O no hydrogen 2.896 N/A ILE 72.A N PHE 31.A O no hydrogen 3.080 N/A TRP 73.A N THR 89.A O no hydrogen 3.245 N/A TRP 73.A NE1 SER 69.A O no hydrogen 2.857 N/A ASP 76.A N ILE 87.A O no hydrogen 2.935 N/A LEU 77.A N SER 16.A OG no hydrogen 2.910 N/A SER 78.A N TRP 85.A O no hydrogen 2.915 N/A SER 78.A OG HIS 132.A NE2 no hydrogen 2.819 N/A ALA 80.A N LYS 83.A O no hydrogen 2.951 N/A LYS 83.A N ALA 80.A O no hydrogen 3.129 N/A PHE 84.A N ALA 108.A O no hydrogen 2.806 N/A TRP 85.A N SER 78.A O no hydrogen 2.871 N/A TRP 85.A NE1 ALA 80.A O no hydrogen 2.907 N/A LEU 86.A N THR 106.A O no hydrogen 2.750 N/A ILE 87.A N ASP 76.A O no hydrogen 2.831 N/A TYR 88.A N TYR 104.A O no hydrogen 2.902 N/A TYR 88.A OH PHE 60.A O no hydrogen 2.731 N/A ASP 90.A N HIS 102.A O no hydrogen 2.917 N/A VAL 91.A N GLY 71.A O no hydrogen 2.919 N/A LYS 92.A N ASP 100.A O no hydrogen 2.810 N/A LYS 92.A NZ ASP 62.A O no hydrogen 3.112 N/A LYS 92.A NZ ASN 66.A OD1 no hydrogen 2.805 N/A LYS 92.A NZ ASP 90.A OD1 no hydrogen 3.460 N/A LYS 92.A NZ ASP 90.A OD2 no hydrogen 2.782 N/A VAL 93.A N ASP 100.A O no hydrogen 3.370 N/A CYS 101.A SG LYS 99.A O no hydrogen 3.670 N/A CYS 101.A SG GLY 123.A O no hydrogen 3.990 N/A HIS 102.A N ASP 90.A O no hydrogen 3.002 N/A ASN 103.A N ASN 122.A O no hydrogen 2.833 N/A TYR 104.A N TYR 88.A O no hydrogen 2.782 N/A LEU 105.A N ILE 119.A O no hydrogen 2.869 N/A THR 106.A N LEU 86.A O no hydrogen 2.917 N/A THR 106.A OG1 SER 116.A O no hydrogen 2.728 N/A THR 107.A N SER 116.A OG no hydrogen 2.917 N/A THR 107.A OG1 SER 116.A OG no hydrogen 2.945 N/A ALA 108.A N PHE 84.A O no hydrogen 3.024 N/A LYS 112.A N ASP 110.A OD1.B no hydrogen 2.961 N/A LYS 112.A NZ ASP 110.A OD1.B no hydrogen 3.408 N/A GLY 113.A N ASP 110.A O.A no hydrogen 2.747 N/A GLY 113.A N ASP 110.A O.B no hydrogen 2.903 N/A TRP 115.A NE1 ILE 111.A O no hydrogen 3.162 N/A SER 116.A N THR 107.A O no hydrogen 2.850 N/A SER 116.A OG THR 107.A O no hydrogen 3.275 N/A SER 116.A OG THR 107.A OG1 no hydrogen 2.945 N/A ILE 119.A N LEU 105.A O no hydrogen 2.899 N/A LEU 121.A N ASN 103.A O no hydrogen 2.741 N/A SER 129.A N VAL 141.A O no hydrogen 2.833 N/A SER 129.A OG ASP 76.A OD1 no hydrogen 2.765 N/A SER 129.A OG HIS 189.A ND1 no hydrogen 2.929 N/A LEU 130.A N ASP 76.A OD2 no hydrogen 3.044 N/A PHE 131.A N TYR 139.A O no hydrogen 2.809 N/A HIS 132.A NE2 SER 78.A OG no hydrogen 2.819 N/A ASP 133.A N LYS 137.A O no hydrogen 2.935 N/A SER 135.A N ASP 133.A OD2 no hydrogen 2.944 N/A SER 135.A OG ASP 133.A OD2 no hydrogen 2.776 N/A GLY 136.A N ASP 133.A O no hydrogen 2.898 N/A LYS 137.A N SER 135.A OG no hydrogen 3.104 N/A LYS 138.A NZ ASP 81.A OD2 no hydrogen 2.791 N/A LYS 138.A NZ HIS 132.A ND1 no hydrogen 2.905 N/A TYR 139.A N PHE 131.A O no hydrogen 2.949 N/A LEU 140.A N GLN 160.A O no hydrogen 2.814 N/A VAL 141.A N SER 129.A O no hydrogen 2.892 N/A ASN 142.A N ALA 158.A O no hydrogen 3.105 N/A MET 143.A N PHE 126.A O no hydrogen 3.150 N/A TYR 144.A N GLY 156.A O no hydrogen 3.012 N/A TRP 145.A N ALA 124.A O no hydrogen 2.961 N/A TRP 145.A NE1 MET 97.A O no hydrogen 2.779 N/A ASP 146.A N ASN 153.A O no hydrogen 2.899 N/A GLN 147.A N GLN 147.A OE1 no hydrogen 2.852 N/A ARG 148.A N ASP 146.A OD1 no hydrogen 2.974 N/A ARG 148.A NE ASP 146.A OD1 no hydrogen 2.806 N/A ARG 148.A NE ASP 146.A OD2 no hydrogen 3.403 N/A ARG 148.A NH2 ASP 146.A OD2 no hydrogen 2.949 N/A HIS 151.A N ARG 148.A O no hydrogen 2.991 N/A HIS 151.A ND1 ASP 146.A OD2 no hydrogen 2.784 N/A ASN 153.A ND2 ASP 146.A O no hydrogen 2.762 N/A TYR 155.A N TYR 144.A O no hydrogen 3.016 N/A ILE 157.A N TYR 177.A O no hydrogen 2.847 N/A ALA 158.A N ASN 142.A O no hydrogen 2.865 N/A LEU 159.A N GLU 174.A O no hydrogen 2.814 N/A GLN 160.A N LEU 140.A O no hydrogen 3.062 N/A GLN 160.A NE2 ILE 170.A O no hydrogen 3.080 N/A TYR 162.A N LYS 138.A O no hydrogen 2.823 N/A SER 163.A N LYS 168.A O no hydrogen 2.829 N/A GLU 166.A N SER 163.A OG no hydrogen 3.012 N/A LYS 168.A N SER 163.A O no hydrogen 3.421 N/A ILE 170.A N GLU 161.A O no hydrogen 2.949 N/A GLU 174.A N LEU 159.A O no hydrogen 3.151 N/A ILE 176.A N ILE 157.A O no hydrogen 2.897 N/A LYS 178.A NZ TYR 155.A O no hydrogen 2.686 N/A THR 180.A N GLU 203.A OE2 no hydrogen 2.784 N/A THR 180.A OG1 GLU 203.A OE1 no hydrogen 2.560 N/A THR 180.A OG1 GLU 203.A OE2 no hydrogen 3.525 N/A ILE 182.A N THR 180.A OG1 no hydrogen 2.958 N/A ALA 183.A N THR 180.A O no hydrogen 3.116 N/A TYR 184.A N HIS 152.A NE2 no hydrogen 2.949 N/A THR 185.A OG1 GLU 203.A OE2 no hydrogen 2.756 N/A GLU 186.A N ALA 202.A O no hydrogen 2.896 N/A GLY 187.A N ASP 127.A OD2 no hydrogen 2.808 N/A HIS 189.A N MET 200.A O no hydrogen 2.857 N/A HIS 189.A ND1 SER 129.A OG no hydrogen 2.929 N/A TYR 191.A N TYR 198.A O no hydrogen 2.880 N/A ILE 193.A N MET 196.A O no hydrogen 3.050 N/A ASN 194.A ND2 TYR 198.A OH no hydrogen 2.997 N/A MET 196.A N ILE 193.A O no hydrogen 3.001 N/A TYR 197.A N SER 217.A O no hydrogen 2.848 N/A TYR 197.A OH ASP 133.A OD1 no hydrogen 2.627 N/A TYR 198.A N TYR 191.A O no hydrogen 2.840 N/A TYR 198.A OH GLY 302.A O no hydrogen 2.575 N/A LEU 199.A N ALA 215.A O no hydrogen 2.838 N/A MET 200.A N HIS 189.A O no hydrogen 2.885 N/A THR 201.A N THR 213.A O no hydrogen 2.936 N/A ALA 202.A N GLU 186.A O no hydrogen 2.904 N/A GLU 203.A N SER 211.A O no hydrogen 2.925 N/A GLY 204.A N ALA 183.A O no hydrogen 2.828 N/A TYR 208.A OH ALA 284.A O no hydrogen 2.808 N/A TYR 208.A OH ASP 500.A OD2 no hydrogen 3.317 N/A GLN 209.A N THR 207.A OG1 no hydrogen 3.251 N/A HIS 210.A N THR 207.A O no hydrogen 3.173 N/A HIS 210.A ND1 LYS 245.A O no hydrogen 2.862 N/A SER 211.A OG GLU 203.A O no hydrogen 2.996 N/A GLU 212.A N LEU 233.A O no hydrogen 2.844 N/A THR 213.A N THR 201.A O no hydrogen 2.920 N/A ILE 214.A N GLN 227.A OE1 no hydrogen 2.832 N/A ALA 215.A N LEU 199.A O no hydrogen 2.938 N/A ARG 216.A N GLU 225.A O no hydrogen 2.882 N/A ARG 216.A NH1 ASP 301.A O no hydrogen 3.212 N/A ARG 216.A NH1 GLY 302.A O no hydrogen 3.044 N/A SER 217.A N TYR 197.A O no hydrogen 2.820 N/A SER 217.A OG THR 219.A O no hydrogen 2.650 N/A SER 217.A OG PRO 223.A O no hydrogen 3.304 N/A GLY 222.A N THR 219.A O no hydrogen 3.257 N/A TYR 224.A OH ILE 220.A O no hydrogen 2.701 N/A GLU 225.A N ARG 216.A O no hydrogen 2.813 N/A GLN 227.A N ILE 214.A O no hydrogen 2.989 N/A GLN 227.A NE2 ASP 229.A OD1 no hydrogen 2.786 N/A TYR 230.A OH ASP 181.A OD1 no hydrogen 2.501 N/A LEU 233.A N GLU 212.A O no hydrogen 3.187 N/A SER 234.A N GLN 310.A O no hydrogen 2.784 N/A SER 234.A OG HIS 210.A O no hydrogen 2.714 N/A TRP 236.A N SER 234.A OG no hydrogen 3.291 N/A GLU 238.A N ALA 235.A O no hydrogen 3.047 N/A ASN 241.A N GLU 238.A O no hydrogen 3.073 N/A ASN 241.A ND2 LEU 243.A O no hydrogen 2.822 N/A ASN 241.A ND2 GLY 312.A O no hydrogen 2.983 N/A GLN 244.A N GLY 266.A O no hydrogen 2.941 N/A GLN 244.A NE2 GLU 238.A O no hydrogen 2.915 N/A GLN 244.A NE2 ASN 241.A O no hydrogen 2.881 N/A LYS 245.A NZ ASP 500.A OD1 no hydrogen 3.384 N/A LYS 245.A NZ ASP 500.A OD2 no hydrogen 2.854 N/A CYS 246.A SG GLN 311.A O no hydrogen 3.492 N/A GLY 247.A N LEU 264.A O no hydrogen 3.378 N/A ALA 249.A N GLU 212.A OE1 no hydrogen 2.980 N/A SER 250.A N ALA 262.A O no hydrogen 2.870 N/A SER 250.A OG PRO 15.A O no hydrogen 2.812 N/A LEU 251.A N TYR 191.A OH no hydrogen 3.044 N/A VAL 252.A N TYR 260.A O no hydrogen 2.912 N/A THR 254.A N GLN 258.A O no hydrogen 2.823 N/A GLN 255.A N GLN 255.A OE1 no hydrogen 2.680 N/A GLN 255.A NE2 ASP 22.A OD1 no hydrogen 2.906 N/A ASN 256.A N THR 254.A OG1 no hydrogen 3.220 N/A GLY 257.A N THR 254.A O no hydrogen 3.047 N/A GLN 258.A N THR 254.A OG1 no hydrogen 3.062 N/A TYR 260.A N VAL 252.A O no hydrogen 2.911 N/A TYR 260.A OH GLU 317.A O no hydrogen 2.778 N/A LEU 261.A N GLN 295.A O no hydrogen 2.772 N/A ALA 262.A N SER 250.A O no hydrogen 2.895 N/A HIS 263.A N ALA 293.A O no hydrogen 2.865 N/A HIS 263.A ND1 LEU 264.A O no hydrogen 2.863 N/A HIS 263.A NE2 GLN 295.A OE1 no hydrogen 3.123 N/A LEU 264.A N GLY 247.A O no hydrogen 2.944 N/A THR 265.A N GLU 291.A O no hydrogen 2.893 N/A THR 265.A OG1 GLN 244.A O no hydrogen 2.794 N/A GLY 266.A N GLN 244.A O no hydrogen 2.842 N/A ARG 267.A NE GLU 291.A OE1 no hydrogen 2.743 N/A ARG 267.A NH1 GLU 291.A OE1 no hydrogen 3.445 N/A ARG 267.A NH1 GLU 291.A OE2 no hydrogen 2.881 N/A LEU 269.A N PHE 285.A O no hydrogen 2.830 N/A PHE 275.A N PRO 272.A O no hydrogen 3.204 N/A GLU 279.A N PRO 276.A O no hydrogen 3.130 N/A ARG 280.A NH1 ALA 235.A O no hydrogen 3.327 N/A ARG 280.A NH1 TRP 236.A O no hydrogen 3.092 N/A ARG 280.A NH1 GLN 244.A OE1 no hydrogen 2.822 N/A ARG 280.A NH2 TRP 236.A O no hydrogen 2.746 N/A GLU 281.A N GLU 281.A OE1 no hydrogen 2.780 N/A GLN 282.A N GLU 279.A O no hydrogen 3.101 N/A HIS 283.A N GLU 279.A O no hydrogen 2.986 N/A HIS 283.A NE2 GLU 279.A OE1 no hydrogen 3.026 N/A ALA 284.A N ARG 280.A O no hydrogen 2.887 N/A CYS 286.A N ASP 500.A OD1 no hydrogen 2.824 N/A CYS 286.A SG TYR 208.A OH no hydrogen 3.579 N/A GLY 289.A N CYS 286.A O no hydrogen 3.069 N/A ARG 290.A NH1 PHE 508.A O no hydrogen 2.944 N/A ARG 290.A NH2 THR 206.A OG1 no hydrogen 2.967 N/A GLU 291.A N THR 265.A O no hydrogen 2.796 N/A THR 292.A N LEU 8.A O no hydrogen 3.041 N/A THR 292.A OG1 ASN 12.A O no hydrogen 2.745 N/A ALA 293.A N HIS 263.A O no hydrogen 2.846 N/A ILE 294.A N ASN 5.A OD1 no hydrogen 2.842 N/A GLN 295.A N LEU 261.A O no hydrogen 2.852 N/A GLN 295.A NE2 SER 313.A O no hydrogen 3.643 N/A ILE 297.A N TRP 259.A O no hydrogen 2.872 N/A GLU 298.A N VAL 305.A O no hydrogen 2.963 N/A GLN 300.A N TRP 303.A O no hydrogen 2.876 N/A TRP 303.A N GLN 300.A O no hydrogen 2.957 N/A VAL 305.A N GLU 298.A O no hydrogen 2.802 N/A VAL 307.A N LYS 296.A O no hydrogen 2.902 N/A GLY 309.A N VAL 306.A O no hydrogen 3.131 N/A GLN 311.A N GLN 311.A OE1 no hydrogen 2.846 N/A GLN 311.A NE2 GLY 308.A O no hydrogen 2.896 N/A GLY 312.A N GLY 309.A O no hydrogen 3.252 N/A VAL 316.A N ILE 3.A O no hydrogen 3.006 N/A ALA 318.A N ASN 2.A OD1 no hydrogen 3.111 N/A ASP 320.A N GLN 258.A OE1 no hydrogen 3.022 N/A LEU 321.A N PRO 319.A O no hydrogen 2.872 N/A GLN 324.A N ASP 44.A OD2 no hydrogen 3.132 N/A TRP 326.A NE1 HIS 47.A O no hydrogen 3.009 N/A ARG 333.A NE ASP 335.A OD1 no hydrogen 2.815 N/A ARG 333.A NH2 ASP 335.A OD1 no hydrogen 3.361 N/A ASP 334.A N PHE 532.A O no hydrogen 2.914 N/A PHE 336.A N ASP 334.A OD1 no hydrogen 2.874 N/A ASN 342.A ND2 THR 329.A O no hydrogen 2.845 N/A ASN 344.A N ASN 342.A OD1 no hydrogen 2.864 N/A ASN 344.A ND2 THR 329.A OG1 no hydrogen 2.935 N/A ASN 344.A ND2 ASN 342.A OD1 no hydrogen 2.876 N/A PHE 345.A N ASN 342.A O no hydrogen 2.918 N/A GLN 346.A N ALA 384.A O no hydrogen 2.884 N/A GLN 346.A NE2 PRO 35.A O no hydrogen 2.727 N/A THR 347.A N PHE 34.A O no hydrogen 2.962 N/A THR 347.A OG1 PHE 34.A O no hydrogen 3.422 N/A THR 347.A OG1 ILE 350.A O no hydrogen 2.662 N/A ARG 349.A N GLU 32.A O no hydrogen 2.717 N/A ARG 349.A NE ASN 66.A O no hydrogen 2.853 N/A ARG 349.A NH2 ASN 66.A O no hydrogen 2.982 N/A ARG 349.A NH2 ASP 68.A OD1 no hydrogen 2.818 N/A ILE 350.A N LEU 348.A O no hydrogen 2.726 N/A HIS 355.A N SER 353.A OG no hydrogen 3.178 N/A LEU 356.A N SER 353.A O no hydrogen 2.927 N/A GLY 357.A N SER 353.A O no hydrogen 3.085 N/A SER 358.A N ARG 367.A O no hydrogen 2.754 N/A THR 360.A N SER 358.A OG no hydrogen 3.070 N/A THR 360.A OG1 SER 358.A OG no hydrogen 3.216 N/A ALA 361.A N SER 358.A OG no hydrogen 2.947 N/A ARG 362.A NH1 GLU 399.A OE1 no hydrogen 2.964 N/A ARG 362.A NH1 ASP 528.A OD2 no hydrogen 2.755 N/A ARG 362.A NH2 GLU 399.A OE1 no hydrogen 3.389 N/A ARG 362.A NH2 GLU 399.A OE2 no hydrogen 2.993 N/A PHE 365.A N ARG 362.A O no hydrogen 3.016 N/A LEU 366.A N PHE 529.A O no hydrogen 2.893 N/A ARG 367.A N SER 358.A O no hydrogen 2.864 N/A ARG 367.A NE ASP 528.A OD1 no hydrogen 2.692 N/A ARG 367.A NH1 ASP 528.A OD1 no hydrogen 3.428 N/A ARG 367.A NH1 ASP 528.A OD2 no hydrogen 2.855 N/A LEU 368.A N ALA 527.A O no hydrogen 2.872 N/A TYR 369.A N LEU 356.A O no hydrogen 2.921 N/A GLY 370.A N LEU 525.A O.A no hydrogen 2.999 N/A GLY 370.A N LEU 525.A O.B no hydrogen 2.857 N/A ARG 371.A N ALA 517.A O no hydrogen 3.174 N/A ARG 371.A NE HIS 355.A O no hydrogen 2.827 N/A ARG 371.A NH2 HIS 355.A O no hydrogen 2.959 N/A GLU 372.A N THR 379.A O no hydrogen 2.973 N/A GLN 375.A N SER 373.A OG no hydrogen 3.118 N/A SER 376.A N SER 373.A O no hydrogen 2.951 N/A SER 376.A OG GLU 372.A OE1 no hydrogen 2.563 N/A PHE 378.A N SER 376.A OG no hydrogen 2.989 N/A THR 379.A N GLU 372.A OE1 no hydrogen 2.872 N/A GLN 380.A NE2 LEU 374.A O no hydrogen 3.156 N/A GLN 380.A NE2 SER 376.A O no hydrogen 2.941 N/A GLN 380.A NE2 TYR 414.A OH no hydrogen 3.513 N/A HIS 382.A ND1 GLN 380.A OE1 no hydrogen 2.978 N/A HIS 382.A NE2 THR 412.A OG1 no hydrogen 2.934 N/A ILE 383.A N ILE 515.A O no hydrogen 2.987 N/A ALA 384.A N GLN 346.A O no hydrogen 2.981 N/A ARG 385.A N VAL 513.A O no hydrogen 2.893 N/A ARG 385.A NH2 ARG 386.A O no hydrogen 2.883 N/A ARG 385.A NH2 GLN 388.A OE1 no hydrogen 2.867 N/A ARG 386.A NE PHE 11.A O no hydrogen 2.763 N/A ARG 386.A NH1 GLN 346.A OE1 no hydrogen 2.816 N/A ARG 386.A NH2 GLN 346.A OE1 no hydrogen 2.815 N/A TRP 387.A N ALA 511.A O no hydrogen 2.932 N/A GLN 388.A N TYR 534.A OH no hydrogen 2.906 N/A GLN 388.A NE2 LYS 9.A O no hydrogen 2.803 N/A SER 389.A OG ASN 391.A O no hydrogen 3.131 N/A ASN 391.A N SER 389.A OG no hydrogen 3.101 N/A PHE 392.A N VAL 469.A O no hydrogen 3.088 N/A ASP 393.A N LYS 535.A O no hydrogen 2.930 N/A ALA 394.A N VAL 467.A O no hydrogen 2.951 N/A GLY 395.A N THR 533.A O.A no hydrogen 3.025 N/A GLY 395.A N THR 533.A O.B no hydrogen 2.865 N/A THR 396.A N PHE 465.A O no hydrogen 2.899 N/A THR 396.A OG1 TYR 531.A O no hydrogen 2.729 N/A VAL 398.A N VAL 463.A O no hydrogen 2.829 N/A GLU 399.A N ASP 528.A O no hydrogen 2.875 N/A ASN 403.A N GLN 407.A OE1 no hydrogen 2.745 N/A SER 404.A N GLN 407.A OE1 no hydrogen 3.187 N/A GLN 406.A N SER 404.A OG no hydrogen 2.991 N/A GLN 407.A N SER 404.A O no hydrogen 3.056 N/A GLN 407.A NE2 ASN 403.A OD1 no hydrogen 3.078 N/A GLN 407.A NE2 THR 521.A OG1 no hydrogen 3.182 N/A MET 408.A N ILE 518.A O no hydrogen 2.992 N/A ALA 409.A N VAL 425.A O no hydrogen 3.041 N/A GLY 410.A N ASN 516.A O no hydrogen 3.098 N/A LEU 411.A N ILE 423.A O no hydrogen 2.943 N/A THR 412.A N GLY 514.A O no hydrogen 2.837 N/A THR 412.A OG1 HIS 382.A NE2 no hydrogen 2.934 N/A CYS 413.A N SER 421.A O no hydrogen 2.976 N/A CYS 413.A SG TYR 476.A OH no hydrogen 3.550 N/A TYR 414.A N PHE 512.A O no hydrogen 2.901 N/A TYR 415.A N ASN 419.A O no hydrogen 2.871 N/A TYR 415.A OH ASP 499.A OD1 no hydrogen 2.680 N/A ASN 416.A N ASN 419.A O no hydrogen 3.152 N/A THR 417.A N ASP 68.A OD2 no hydrogen 3.080 N/A THR 417.A OG1 ASP 68.A OD2 no hydrogen 2.686 N/A GLU 418.A N ASN 416.A OD1 no hydrogen 2.965 N/A ASN 419.A N ASN 416.A O no hydrogen 3.166 N/A ASN 419.A ND2 ASN 416.A OD1 no hydrogen 3.048 N/A ASN 419.A ND2 ASN 442.A OD1 no hydrogen 3.025 N/A TRP 420.A N ALA 440.A O no hydrogen 3.075 N/A TRP 420.A NE1 THR 417.A O no hydrogen 3.092 N/A SER 421.A N CYS 413.A O no hydrogen 2.800 N/A SER 421.A OG TYR 474.A OH no hydrogen 2.704 N/A SER 421.A OG TYR 476.A OH no hydrogen 2.720 N/A SER 422.A N VAL 438.A O no hydrogen 2.950 N/A SER 422.A OG HIS 424.A ND1 no hydrogen 2.798 N/A ILE 423.A N LEU 411.A O no hydrogen 3.050 N/A HIS 424.A N ASP 436.A O no hydrogen 3.002 N/A HIS 424.A ND1 SER 422.A OG no hydrogen 2.798 N/A VAL 425.A N ALA 409.A O no hydrogen 2.891 N/A THR 426.A N ILE 434.A O no hydrogen 2.878 N/A THR 426.A OG1 GLN 407.A O no hydrogen 2.698 N/A TRP 427.A N THR 426.A OG1 no hydrogen 2.831 N/A ASN 428.A N GLY 432.A O no hydrogen 2.887 N/A GLU 429.A N GLU 429.A OE1 no hydrogen 2.766 N/A GLU 430.A N ASN 428.A OD1 no hydrogen 2.916 N/A LYS 431.A N ASN 428.A OD1 no hydrogen 2.984 N/A LYS 431.A NZ GLU 453.A OE1 no hydrogen 2.825 N/A GLY 432.A N ASN 428.A O no hydrogen 2.903 N/A ARG 433.A NH1 PRO 457.A O no hydrogen 3.117 N/A ARG 433.A NH1 VAL 460.A O no hydrogen 2.607 N/A ARG 433.A NH2 PHE 400.A O no hydrogen 3.343 N/A ARG 433.A NH2 VAL 460.A O no hydrogen 3.434 N/A ILE 434.A N THR 426.A O no hydrogen 2.845 N/A ILE 435.A N ILE 454.A O.A no hydrogen 2.839 N/A ILE 435.A N ILE 454.A O.B no hydrogen 2.837 N/A ASP 436.A N HIS 424.A O no hydrogen 3.005 N/A LEU 437.A N ASP 436.A OD1 no hydrogen 2.926 N/A VAL 438.A N SER 422.A O no hydrogen 3.003 N/A THR 439.A N SER 446.A O no hydrogen 2.907 N/A ALA 440.A N TRP 420.A O no hydrogen 2.802 N/A ASP 441.A N THR 444.A O no hydrogen 2.835 N/A ASN 442.A N ASN 419.A OD1 no hydrogen 2.848 N/A ASN 442.A ND2 TYR 501.A O no hydrogen 3.135 N/A GLY 443.A N GLU 418.A O no hydrogen 3.156 N/A THR 444.A N ASP 441.A O no hydrogen 2.868 N/A SER 446.A N THR 439.A O no hydrogen 2.863 N/A ALA 450.A N MET 447.A O no hydrogen 3.154 N/A GLY 451.A N GLU 453.A OE2 no hydrogen 2.880 N/A ALA 452.A N LEU 449.A O no hydrogen 2.689 N/A GLU 453.A N GLU 453.A OE1 no hydrogen 2.736 N/A ILE 454.A N.A ILE 435.A O no hydrogen 3.115 N/A ILE 454.A N.B ILE 435.A O no hydrogen 3.103 N/A ILE 456.A N ARG 433.A O no hydrogen 2.826 N/A VAL 460.A N PRO 457.A O no hydrogen 2.958 N/A VAL 463.A N VAL 398.A O no hydrogen 2.976 N/A HIS 464.A N SER 479.A O no hydrogen 2.907 N/A HIS 464.A ND1 TYR 531.A OH no hydrogen 2.776 N/A PHE 465.A N THR 396.A O no hydrogen 2.891 N/A LYS 466.A N ALA 477.A O no hydrogen 2.896 N/A VAL 467.A N ALA 394.A O no hydrogen 2.780 N/A SER 468.A N GLN 475.A O no hydrogen 2.880 N/A SER 468.A OG ASP 393.A OD1 no hydrogen 3.252 N/A VAL 469.A N PHE 392.A O no hydrogen 2.868 N/A ARG 470.A N ILE 473.A O no hydrogen 2.804 N/A ARG 470.A NH1 PHE 392.A O no hydrogen 3.017 N/A ARG 470.A NH1 ASP 393.A OD1 no hydrogen 2.896 N/A ARG 470.A NH1 VAL 469.A O no hydrogen 2.930 N/A ARG 470.A NH2 ASP 393.A OD1 no hydrogen 2.730 N/A GLY 471.A N PHE 390.A O no hydrogen 2.858 N/A ARG 472.A NH2 PRO 270.A O no hydrogen 3.020 N/A ILE 473.A N ARG 470.A O no hydrogen 3.252 N/A TYR 474.A N LEU 492.A O no hydrogen 2.861 N/A TYR 474.A OH SER 421.A OG no hydrogen 2.704 N/A GLN 475.A N SER 468.A O no hydrogen 3.032 N/A GLN 475.A NE2 ILE 490.A O no hydrogen 3.200 N/A TYR 476.A OH SER 421.A O no hydrogen 3.258 N/A TYR 476.A OH SER 421.A OG no hydrogen 2.720 N/A ALA 477.A N LYS 466.A O no hydrogen 2.891 N/A TYR 478.A N HIS 486.A O no hydrogen 2.937 N/A SER 479.A N HIS 464.A O no hydrogen 2.847 N/A SER 479.A OG THR 484.A O no hydrogen 2.760 N/A ASP 481.A N SER 479.A OG no hydrogen 3.093 N/A GLY 482.A N SER 479.A OG no hydrogen 2.766 N/A GLU 483.A N ASP 481.A OD1 no hydrogen 2.778 N/A THR 484.A N ASP 481.A OD1 no hydrogen 2.837 N/A HIS 486.A N TYR 478.A O no hydrogen 2.879 N/A LEU 488.A N TYR 476.A O no hydrogen 2.881 N/A ILE 490.A N LEU 488.A O no hydrogen 2.872 N/A LEU 492.A N TYR 474.A O no hydrogen 2.887 N/A SER 494.A N ARG 472.A O no hydrogen 2.902 N/A SER 494.A OG GLY 471.A O no hydrogen 2.766 N/A LYS 496.A N PRO 493.A O no hydrogen 3.161 N/A LYS 496.A NZ ASP 441.A OD2 no hydrogen 2.717 N/A LYS 496.A NZ TYR 501.A OH no hydrogen 3.557 N/A LEU 497.A N SER 494.A O no hydrogen 3.018 N/A SER 498.A OG TRP 495.A O no hydrogen 2.718 N/A TYR 501.A N SER 498.A O no hydrogen 3.171 N/A TYR 501.A OH ASP 441.A OD1 no hydrogen 2.561 N/A VAL 502.A N SER 498.A O no hydrogen 3.303 N/A ARG 503.A N ASN 442.A OD1 no hydrogen 2.860 N/A ARG 503.A NE GLU 418.A OE2 no hydrogen 2.788 N/A ARG 503.A NH2 GLU 418.A OE1 no hydrogen 2.827 N/A PHE 508.A N SER 69.A OG no hydrogen 2.916 N/A THR 509.A N TYR 415.A OH no hydrogen 3.133 N/A ALA 511.A N PRO 287.A O no hydrogen 2.896 N/A PHE 512.A N TYR 414.A O no hydrogen 2.907 N/A VAL 513.A N ARG 385.A O no hydrogen 2.790 N/A GLY 514.A N THR 412.A O no hydrogen 2.899 N/A ILE 515.A N ILE 383.A O no hydrogen 2.930 N/A ASN 516.A N GLY 410.A O no hydrogen 3.017 N/A ALA 517.A N ALA 381.A O no hydrogen 2.962 N/A ILE 518.A N MET 408.A O no hydrogen 2.797 N/A ASP 519.A N ARG 371.A O no hydrogen 2.952 N/A ILE 520.A N GLN 406.A O no hydrogen 3.006 N/A THR 521.A OG1 GLN 406.A OE1 no hydrogen 2.680 N/A GLY 522.A N ASP 519.A OD1 no hydrogen 3.233 N/A THR 523.A OG1 ASP 519.A OD1 no hydrogen 3.326 N/A THR 523.A OG1 ASP 519.A OD2 no hydrogen 2.595 N/A LEU 525.A N.A ASP 519.A OD2 no hydrogen 2.940 N/A LEU 525.A N.B ASP 519.A OD2 no hydrogen 2.940 N/A ALA 527.A N LEU 368.A O no hydrogen 2.822 N/A ASP 528.A N GLU 399.A O no hydrogen 2.898 N/A PHE 529.A N LEU 366.A O no hydrogen 2.851 N/A ASP 530.A N SER 397.A O no hydrogen 3.313 N/A TYR 531.A OH HIS 464.A ND1 no hydrogen 2.776 N/A PHE 532.A N ASP 334.A O no hydrogen 2.859 N/A THR 533.A N.A GLY 395.A O no hydrogen 2.786 N/A THR 533.A N.B GLY 395.A O no hydrogen 2.773 N/A TYR 534.A N GLU 332.A O no hydrogen 2.893 N/A TYR 534.A OH GLU 536.A OE2 no hydrogen 2.626 N/A LYS 535.A N ASP 393.A O no hydrogen 2.837 N/A LYS 535.A NZ GLU 536.A O no hydrogen 2.736 N/A LEU 537.A N ASN 391.A O no hydrogen 2.951 N/A