Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4axh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG ASP 4.A OD1 no hydrogen 2.653 N/A SER 5.A OG GLU 477.A OE2 no hydrogen 3.257 N/A SER 5.A OG TYR 481.A OH no hydrogen 3.239 N/A LYS 6.A NZ SER 2.A O no hydrogen 2.905 N/A LYS 6.A NZ SER 2.A OG no hydrogen 3.195 N/A LYS 6.A NZ ASP 4.A O no hydrogen 3.027 N/A LYS 6.A NZ ASP 474.A OD1 no hydrogen 3.256 N/A LYS 6.A NZ ASP 474.A OD2 no hydrogen 3.408 N/A SER 9.A N GLN 478.A OE1 no hydrogen 3.143 N/A SER 9.A OG TYR 448.A OH no hydrogen 2.599 N/A SER 9.A OG GLN 478.A OE1 no hydrogen 3.412 N/A THR 12.A N SER 9.A OG no hydrogen 3.316 N/A THR 12.A OG1 GLN 478.A OE1 no hydrogen 2.874 N/A ALA 13.A N SER 9.A O no hydrogen 3.041 N/A ALA 14.A N ALA 10.A O no hydrogen 3.174 N/A LYS 15.A N ILE 11.A O no hydrogen 2.854 N/A ASN 16.A N THR 12.A O no hydrogen 3.006 N/A ASN 16.A ND2 ASP 70.A O no hydrogen 2.677 N/A ASN 16.A ND2 TYR 481.A O no hydrogen 3.230 N/A ALA 17.A N ALA 13.A O no hydrogen 3.116 N/A GLU 18.A N ALA 14.A O no hydrogen 3.011 N/A VAL 19.A N ASN 16.A O no hydrogen 2.995 N/A LEU 20.A N ALA 17.A O no hydrogen 3.215 N/A LYS 21.A N GLU 18.A O no hydrogen 3.310 N/A ASN 22.A ND2 GLU 18.A OE2.B no hydrogen 3.447 N/A ALA 26.A N PRO 24.A O no hydrogen 2.549 N/A GLU 32.A N ARG 28.A O no hydrogen 3.048 N/A ALA 33.A N GLU 29.A O no hydrogen 2.870 N/A ALA 34.A N GLU 30.A O no hydrogen 2.834 N/A LYS 35.A N PHE 31.A O no hydrogen 3.110 N/A ARG 36.A N GLU 32.A O no hydrogen 3.175 N/A LEU 38.A N LYS 35.A O no hydrogen 3.462 N/A ILE 39.A N LEU 88.A O no hydrogen 3.002 N/A ALA 40.A N LEU 88.A O no hydrogen 3.424 N/A PHE 42.A N ALA 86.A O no hydrogen 3.134 N/A GLN 45.A NE2 ASP 56.A OD2 no hydrogen 3.460 N/A ILE 46.A N TRP 55.A O no hydrogen 2.843 N/A LYS 47.A NZ GLN 45.A O no hydrogen 3.509 N/A ASN 48.A N GLN 52.A O no hydrogen 2.747 N/A ASN 48.A ND2.B GLN 52.A OE1 no hydrogen 2.377 N/A ASN 48.A ND2.B ASN 227.A O no hydrogen 2.990 N/A GLU 50.A N ASN 48.A OD1.A no hydrogen 2.927 N/A GLY 51.A N ASN 48.A O no hydrogen 3.114 N/A GLN 52.A N ASN 48.A OD1.B no hydrogen 2.729 N/A VAL 54.A N ILE 46.A O no hydrogen 2.755 N/A TRP 55.A N ILE 46.A O no hydrogen 3.255 N/A TRP 55.A NE1 GLY 100.A O no hydrogen 2.773 N/A MET 57.A N GLY 44.A O no hydrogen 3.214 N/A TYR 60.A N MET 57.A O no hydrogen 3.119 N/A TYR 60.A OH GLN 215.A OE1 no hydrogen 2.373 N/A LEU 63.A N TYR 60.A O no hydrogen 3.228 N/A ASN 64.A N GLN 61.A O no hydrogen 3.111 N/A LYS 66.A NZ GLN 61.A O no hydrogen 3.569 N/A LYS 66.A NZ ASN 64.A O no hydrogen 2.604 N/A THR 71.A OG1 ALA 212.A O no hydrogen 2.720 N/A VAL 72.A N ALA 69.A O no hydrogen 3.284 N/A ASN 73.A ND2 GLN 482.A O no hydrogen 2.764 N/A SER 75.A N ASN 73.A OD1 no hydrogen 2.969 N/A SER 75.A OG.A TYR 387.A OH no hydrogen 2.627 N/A SER 75.A OG.A GLU 484.A OE2 no hydrogen 2.499 N/A SER 75.A OG.B ASN 73.A OD1 no hydrogen 2.800 N/A SER 75.A OG.B GLU 484.A OE2 no hydrogen 2.746 N/A TRP 77.A N ASN 73.A O no hydrogen 3.070 N/A ARG 78.A N PRO 74.A O no hydrogen 3.073 N/A GLN 79.A N SER 75.A O no hydrogen 3.218 N/A GLN 79.A NE2 GLY 219.A O no hydrogen 3.541 N/A GLN 79.A NE2 PRO 285.A O no hydrogen 3.059 N/A ALA 80.A N LEU 76.A O no hydrogen 2.797 N/A GLN 81.A N TRP 77.A O no hydrogen 2.943 N/A GLN 81.A NE2 LEU 63.A O no hydrogen 3.183 N/A LEU 82.A N ARG 78.A O no hydrogen 3.150 N/A ASN 83.A N GLN 79.A O no hydrogen 2.977 N/A ASN 83.A ND2 ASP 217.A OD1 no hydrogen 3.216 N/A ASN 83.A ND2 ASP 217.A OD2 no hydrogen 2.850 N/A ASN 83.A ND2 GLY 219.A O no hydrogen 2.773 N/A ASN 84.A N GLN 81.A O no hydrogen 3.371 N/A ASN 84.A ND2 TYR 60.A O no hydrogen 3.666 N/A ILE 85.A N LEU 82.A O no hydrogen 2.965 N/A GLY 87.A N ARG 99.A O no hydrogen 2.790 N/A LEU 88.A N ALA 40.A O no hydrogen 2.891 N/A PHE 89.A N GLN 97.A O no hydrogen 2.888 N/A GLU 90.A N GLY 37.A O no hydrogen 2.819 N/A VAL 91.A N LEU 95.A O no hydrogen 2.838 N/A MET 92.A N LEU 95.A O no hydrogen 3.365 N/A LEU 95.A N MET 92.A O no hydrogen 2.931 N/A TYR 96.A N ILE 108.A O no hydrogen 2.947 N/A GLN 97.A N PHE 89.A O no hydrogen 2.879 N/A VAL 98.A N MET 106.A O no hydrogen 2.951 N/A ARG 99.A N GLY 87.A O no hydrogen 3.038 N/A ALA 104.A N ASP 102.A OD2 no hydrogen 2.947 N/A ASN 105.A N GLN 325.A O no hydrogen 2.840 N/A ASN 105.A ND2 GLN 324.A O no hydrogen 3.248 N/A ASN 105.A ND2 ASN 327.A O no hydrogen 2.887 N/A MET 106.A N VAL 98.A O no hydrogen 3.053 N/A THR 107.A N ILE 118.A O no hydrogen 3.050 N/A THR 107.A OG1 GLN 97.A OE1 no hydrogen 3.208 N/A THR 107.A OG1 GLN 325.A OE1 no hydrogen 2.674 N/A ILE 108.A N TYR 96.A O no hydrogen 2.861 N/A ILE 109.A N VAL 116.A O no hydrogen 2.798 N/A GLU 110.A N LYS 94.A O no hydrogen 2.736 N/A ASP 112.A N ASP 249.A O no hydrogen 2.754 N/A SER 113.A N ASP 249.A OD1 no hydrogen 2.782 N/A SER 113.A N ASP 249.A OD2 no hydrogen 2.798 N/A SER 113.A OG ASP 249.A OD1 no hydrogen 2.630 N/A SER 113.A OG ASP 249.A OD2 no hydrogen 3.385 N/A GLY 114.A N ASP 249.A OD2 no hydrogen 2.699 N/A VAL 116.A N ILE 109.A O no hydrogen 2.876 N/A LEU 117.A N ALA 145.A O no hydrogen 2.897 N/A ILE 118.A N THR 107.A O no hydrogen 2.953 N/A ASP 119.A N VAL 147.A O no hydrogen 2.734 N/A THR 120.A N HIS 155.A O no hydrogen 2.814 N/A THR 120.A OG1 HIS 155.A O no hydrogen 3.117 N/A THR 122.A N ASP 102.A OD1 no hydrogen 3.018 N/A THR 122.A N ASP 102.A OD2 no hydrogen 3.196 N/A THR 122.A OG1 ASP 102.A OD1 no hydrogen 3.130 N/A THR 122.A OG1 ASP 102.A OD2 no hydrogen 2.629 N/A THR 123.A OG1 GLU 125.A OE1 no hydrogen 3.490 N/A THR 123.A OG1 THR 126.A OG1 no hydrogen 2.744 N/A ALA 124.A N THR 229.A O no hydrogen 3.036 N/A GLU 125.A N GLU 125.A OE1 no hydrogen 2.720 N/A THR 126.A N THR 123.A OG1 no hydrogen 3.192 N/A THR 126.A OG1 ASP 102.A OD1 no hydrogen 2.535 N/A THR 126.A OG1 THR 123.A O no hydrogen 3.287 N/A THR 126.A OG1 THR 123.A OG1 no hydrogen 2.744 N/A ALA 127.A N THR 123.A O no hydrogen 2.948 N/A ARG 128.A N ALA 124.A O no hydrogen 2.999 N/A ALA 129.A N GLU 125.A O no hydrogen 3.023 N/A ALA 130.A N THR 126.A O no hydrogen 2.825 N/A LEU 131.A N ALA 127.A O no hydrogen 3.161 N/A ASP 132.A N ARG 128.A O no hydrogen 2.857 N/A LEU 133.A N ALA 129.A O no hydrogen 3.028 N/A TYR 134.A N ALA 130.A O no hydrogen 3.046 N/A TYR 134.A OH GLU 110.A OE2 no hydrogen 2.549 N/A PHE 135.A N LEU 131.A O no hydrogen 2.966 N/A GLN 136.A N ASP 132.A O no hydrogen 3.039 N/A HIS 137.A N TYR 134.A O no hydrogen 3.192 N/A HIS 137.A ND1 LEU 133.A O no hydrogen 3.056 N/A ARG 138.A N TYR 134.A O no hydrogen 2.843 N/A ARG 138.A NE GLU 110.A OE2 no hydrogen 2.815 N/A ARG 138.A NH2 GLU 110.A OE1 no hydrogen 2.540 N/A ARG 138.A NH2 GLU 110.A OE2 no hydrogen 3.113 N/A LYS 140.A NZ.B PHE 135.A O no hydrogen 2.991 N/A LYS 141.A NZ.B SER 113.A O no hydrogen 3.315 N/A VAL 144.A N LEU 115.A O no hydrogen 2.982 N/A ALA 145.A N LEU 115.A O no hydrogen 3.274 N/A VAL 146.A N LYS 174.A O no hydrogen 2.783 N/A VAL 147.A N LEU 117.A O no hydrogen 2.676 N/A TYR 148.A N PHE 176.A O no hydrogen 2.784 N/A TYR 148.A OH VAL 233.A O no hydrogen 2.629 N/A SER 149.A N ASP 119.A OD1 no hydrogen 2.780 N/A SER 149.A OG ASP 119.A OD1 no hydrogen 3.438 N/A SER 149.A OG ASP 119.A OD2 no hydrogen 2.754 N/A SER 149.A OG HIS 150.A ND1 no hydrogen 2.637 N/A HIS 150.A ND1 SER 149.A OG no hydrogen 2.637 N/A SER 151.A N SER 265.A O no hydrogen 3.012 N/A SER 151.A OG GLU 188.A OE2 no hydrogen 3.003 N/A SER 151.A OG SER 265.A O no hydrogen 3.454 N/A ASP 154.A N ASP 154.A OD1 no hydrogen 2.701 N/A HIS 155.A N HIS 152.A O no hydrogen 2.840 N/A HIS 155.A ND1 ASP 119.A OD2 no hydrogen 2.591 N/A HIS 155.A NE2 ASP 281.A OD2 no hydrogen 2.960 N/A PHE 156.A N HIS 152.A O no hydrogen 3.387 N/A GLY 157.A N ILE 153.A O no hydrogen 2.946 N/A GLY 158.A N LEU 121.A O no hydrogen 3.143 N/A ALA 159.A N PHE 156.A O no hydrogen 3.174 N/A ARG 160.A N THR 231.A OG1 no hydrogen 2.988 N/A ARG 160.A NH2 LEU 232.A O no hydrogen 2.903 N/A GLY 161.A N GLY 158.A O no hydrogen 3.107 N/A ILE 162.A N ALA 159.A O no hydrogen 3.051 N/A ILE 163.A N ALA 159.A O no hydrogen 2.896 N/A ASP 167.A N ASP 164.A O no hydrogen 2.964 N/A VAL 168.A N ASP 164.A O no hydrogen 3.391 N/A LYS 169.A N GLU 165.A O no hydrogen 2.859 N/A ALA 170.A N ALA 166.A O no hydrogen 3.110 N/A GLY 171.A N VAL 168.A O no hydrogen 2.779 N/A LYS 172.A N ASP 167.A O no hydrogen 2.911 N/A LYS 172.A NZ ALA 170.A O no hydrogen 2.775 N/A VAL 173.A N ASP 167.A O no hydrogen 3.338 N/A LYS 174.A N VAL 144.A O no hydrogen 2.844 N/A PHE 176.A N VAL 146.A O no hydrogen 2.820 N/A ALA 177.A N VAL 237.A O no hydrogen 3.201 N/A SER 179.A OG GLU 240.A OE1 no hydrogen 2.856 N/A HIS 184.A N GLY 180.A O no hydrogen 3.190 N/A HIS 184.A ND1 GLY 180.A O no hydrogen 2.800 N/A ALA 185.A N PHE 181.A O no hydrogen 2.648 N/A VAL 186.A N MET 182.A O no hydrogen 3.242 N/A SER 187.A N GLU 183.A O no hydrogen 3.219 N/A SER 187.A OG GLU 183.A O no hydrogen 2.613 N/A GLU 188.A N HIS 184.A O no hydrogen 3.220 N/A ASN 189.A ND2 SER 151.A O no hydrogen 3.589 N/A ASN 189.A ND2 ALA 185.A O no hydrogen 2.938 N/A LEU 191.A N SER 187.A O no hydrogen 3.409 N/A MET 196.A N ALA 192.A O no hydrogen 3.379 N/A ALA 197.A N GLY 193.A O no hydrogen 2.784 N/A ARG 198.A N THR 194.A O no hydrogen 3.424 N/A ARG 198.A NE PHE 627.A O no hydrogen 2.688 N/A ARG 198.A NH1 GLN 201.A OE1 no hydrogen 2.875 N/A ARG 198.A NH1 GLU 498.A OE2 no hydrogen 2.803 N/A ARG 198.A NH2 GLU 498.A OE1 no hydrogen 2.831 N/A ARG 198.A NH2 GLU 498.A OE2 no hydrogen 2.733 N/A ARG 198.A NH2 PHE 627.A O no hydrogen 2.936 N/A ARG 199.A N ALA 195.A O no hydrogen 2.970 N/A ARG 199.A NE ARG 294.A O no hydrogen 2.960 N/A ARG 199.A NH2 PRO 293.A O no hydrogen 3.149 N/A GLY 200.A N MET 196.A O no hydrogen 2.792 N/A GLN 201.A N ARG 198.A O no hydrogen 3.155 N/A TYR 202.A N ARG 199.A O no hydrogen 3.197 N/A TYR 202.A OH GLU 498.A OE1 no hydrogen 2.557 N/A SER 204.A N GLY 200.A O no hydrogen 3.003 N/A SER 204.A OG GLY 200.A O no hydrogen 2.683 N/A GLY 205.A N GLN 201.A O no hydrogen 3.151 N/A VAL 208.A N GLY 205.A O no hydrogen 3.015 N/A ARG 210.A NH1 GLY 205.A O no hydrogen 2.875 N/A GLY 211.A N GLN 215.A O no hydrogen 3.110 N/A GLN 213.A NE2 SER 5.A O no hydrogen 3.049 N/A GLN 213.A NE2 TYR 481.A OH no hydrogen 2.699 N/A ALA 214.A N GLY 211.A O no hydrogen 2.788 N/A GLN 215.A N PRO 209.A O no hydrogen 2.836 N/A GLN 215.A NE2 LYS 222.A O no hydrogen 3.119 N/A GLN 215.A NE2 ASN 490.A OD1 no hydrogen 3.023 N/A SER 218.A N PHE 221.A O no hydrogen 2.690 N/A SER 218.A OG LYS 222.A O no hydrogen 3.091 N/A GLY 219.A N ASP 217.A OD2 no hydrogen 2.982 N/A LEU 220.A N SER 218.A O no hydrogen 2.927 N/A LYS 222.A NZ ALA 80.A O no hydrogen 3.126 N/A LYS 222.A NZ VAL 216.A O no hydrogen 2.831 N/A LYS 222.A NZ ASP 217.A OD1 no hydrogen 2.775 N/A THR 226.A N VAL 54.A O no hydrogen 2.947 N/A THR 226.A OG1 TYR 506.A OH no hydrogen 2.687 N/A ASN 227.A N TYR 506.A OH no hydrogen 3.249 N/A ASN 227.A ND2 VAL 53.A O no hydrogen 3.358 N/A ALA 228.A N SER 508.A OG no hydrogen 3.344 N/A THR 229.A N GLU 125.A OE1 no hydrogen 3.240 N/A THR 229.A OG1 GLU 125.A OE1 no hydrogen 3.405 N/A THR 229.A OG1 GLU 125.A OE2 no hydrogen 3.286 N/A ASN 230.A ND2 THR 122.A O no hydrogen 2.869 N/A THR 231.A N GLY 157.A O no hydrogen 2.640 N/A THR 231.A OG1 GLY 157.A O no hydrogen 2.866 N/A ALA 234.A N GLU 165.A OE1.A no hydrogen 2.899 N/A ASN 236.A N VAL 175.A O no hydrogen 2.816 N/A VAL 237.A N VAL 175.A O no hydrogen 3.019 N/A ILE 239.A N ALA 177.A O no hydrogen 2.938 N/A GLU 240.A N GLU 244.A OE2 no hydrogen 2.746 N/A LYS 241.A N GLU 244.A OE2 no hydrogen 2.857 N/A GLU 244.A N PHE 255.A O no hydrogen 3.001 N/A HIS 246.A N LEU 253.A O no hydrogen 2.719 N/A HIS 246.A NE2 GLU 244.A OE1 no hydrogen 2.873 N/A THR 247.A OG1 VAL 251.A O no hydrogen 3.482 N/A VAL 248.A N VAL 251.A O no hydrogen 3.030 N/A VAL 251.A N VAL 248.A O no hydrogen 3.115 N/A LEU 253.A N HIS 246.A O no hydrogen 2.787 N/A GLU 254.A N TYR 270.A O no hydrogen 3.065 N/A PHE 255.A N GLU 244.A O no hydrogen 2.942 N/A GLN 256.A N ASN 268.A O no hydrogen 2.961 N/A GLN 256.A NE2 TYR 307.A O no hydrogen 3.542 N/A LEU 257.A N PRO 242.A O no hydrogen 3.018 N/A THR 258.A N ASP 266.A O no hydrogen 2.918 N/A GLY 260.A N ALA 263.A O no hydrogen 3.214 N/A SER 261.A N THR 258.A O no hydrogen 3.457 N/A SER 261.A OG THR 258.A O no hydrogen 2.887 N/A SER 261.A OG ASP 266.A OD2 no hydrogen 2.930 N/A SER 261.A OG ASN 282.A OD1 no hydrogen 3.242 N/A SER 265.A OG SER 179.A O no hydrogen 2.686 N/A ASN 268.A N GLN 256.A O no hydrogen 2.890 N/A ASN 268.A ND2 GLN 256.A OE1 no hydrogen 2.894 N/A ILE 269.A N ASN 278.A O no hydrogen 2.772 N/A TYR 270.A N GLU 254.A O no hydrogen 2.665 N/A TYR 270.A OH ARG 318.A O no hydrogen 2.662 N/A LEU 271.A N VAL 276.A O no hydrogen 3.005 N/A GLN 273.A NE2 GLY 250.A O no hydrogen 3.408 N/A GLN 273.A NE2 GLU 252.A OE2 no hydrogen 3.192 N/A PHE 274.A N LEU 271.A O no hydrogen 3.079 N/A LYS 275.A N LEU 271.A O no hydrogen 2.832 N/A LYS 275.A NZ.A ASP 320.A OD1 no hydrogen 3.510 N/A LYS 275.A NZ.B GLN 273.A O no hydrogen 3.375 N/A LEU 277.A N VAL 321.A O no hydrogen 3.253 N/A ASN 278.A N ILE 269.A O no hydrogen 2.835 N/A ASN 278.A ND2 GLN 325.A OE1 no hydrogen 2.961 N/A THR 279.A N ILE 323.A O no hydrogen 3.262 N/A ALA 280.A N ASN 278.A OD1 no hydrogen 2.937 N/A ASN 282.A N THR 279.A O no hydrogen 2.810 N/A ASN 282.A ND2 ASP 266.A OD1 no hydrogen 3.567 N/A ASN 282.A ND2 ASN 268.A OD1 no hydrogen 2.701 N/A ASN 282.A ND2 THR 279.A O no hydrogen 3.064 N/A ALA 286.A N PRO 284.A O no hydrogen 2.829 N/A MET 287.A N ARG 385.A O no hydrogen 2.919 N/A HIS 288.A N TYR 347.A OH no hydrogen 3.010 N/A ASN 289.A N HIS 288.A ND1 no hydrogen 2.846 N/A LEU 290.A N ASN 394.A OD1 no hydrogen 2.802 N/A THR 292.A OG1 GLN 203.A OE1 no hydrogen 3.060 N/A GLY 295.A N THR 292.A O no hydrogen 3.125 N/A ARG 299.A N LEU 290.A O no hydrogen 2.875 N/A ARG 299.A NH1 ASN 289.A O no hydrogen 2.793 N/A LYS 302.A N ASP 300.A OD1 no hydrogen 3.042 N/A TRP 304.A N ASP 300.A O no hydrogen 2.993 N/A TRP 304.A NE1 ASN 282.A O no hydrogen 2.609 N/A ALA 305.A N ALA 301.A O no hydrogen 2.884 N/A GLY 306.A N LYS 302.A O no hydrogen 3.170 N/A TYR 307.A N ALA 303.A O no hydrogen 3.022 N/A TYR 307.A N TRP 304.A O no hydrogen 3.111 N/A TYR 307.A OH LEU 259.A O no hydrogen 2.971 N/A ILE 308.A N TRP 304.A O no hydrogen 3.132 N/A ASP 309.A N ALA 305.A O no hydrogen 3.033 N/A ALA 310.A N GLY 306.A O no hydrogen 3.007 N/A SER 311.A N TYR 307.A O no hydrogen 3.052 N/A SER 311.A OG ILE 308.A O no hydrogen 2.714 N/A LEU 312.A N ILE 308.A O no hydrogen 2.858 N/A GLU 313.A N ASP 309.A O no hydrogen 2.977 N/A LYS 314.A N ALA 310.A O no hydrogen 3.033 N/A TYR 315.A N SER 311.A O no hydrogen 2.934 N/A GLY 316.A N LEU 312.A O no hydrogen 2.840 N/A ARG 318.A N TYR 315.A O no hydrogen 2.896 N/A ARG 318.A NE LYS 314.A O no hydrogen 3.132 N/A ARG 318.A NH2 LYS 314.A O no hydrogen 2.903 N/A THR 319.A OG1 LYS 275.A O no hydrogen 3.443 N/A ASP 320.A N LYS 275.A O no hydrogen 2.645 N/A LEU 322.A N VAL 330.A O no hydrogen 2.930 N/A ILE 323.A N LEU 277.A O no hydrogen 2.662 N/A GLN 324.A NE2 ALA 283.A O no hydrogen 2.699 N/A GLN 324.A NE2 TYR 339.A OH no hydrogen 2.616 N/A GLN 325.A N ALA 280.A O no hydrogen 3.144 N/A GLN 325.A NE2 ILE 118.A O no hydrogen 3.009 N/A GLN 325.A NE2 ASP 119.A OD2 no hydrogen 2.954 N/A HIS 326.A ND1 PRO 103.A O no hydrogen 2.764 N/A VAL 330.A N LEU 322.A O no hydrogen 3.025 N/A GLY 332.A N ASP 320.A O no hydrogen 2.611 N/A VAL 336.A N GLY 332.A O no hydrogen 2.934 N/A ARG 337.A N GLY 333.A O no hydrogen 2.905 N/A ARG 337.A NE GLY 316.A O no hydrogen 2.885 N/A ARG 337.A NH2 GLY 316.A O no hydrogen 3.458 N/A THR 338.A N ASP 334.A O no hydrogen 3.099 N/A THR 338.A OG1 ASP 334.A O no hydrogen 3.139 N/A TYR 339.A N LYS 335.A O no hydrogen 3.056 N/A TYR 339.A OH ALA 283.A O no hydrogen 2.702 N/A LEU 340.A N VAL 336.A O no hydrogen 2.917 N/A ALA 341.A N ARG 337.A O no hydrogen 3.099 N/A ASP 342.A N THR 338.A O no hydrogen 2.911 N/A GLN 343.A N TYR 339.A O no hydrogen 2.927 N/A GLN 343.A NE2 PRO 284.A O no hydrogen 3.066 N/A GLN 343.A NE2 TYR 383.A O no hydrogen 3.410 N/A ARG 344.A N LEU 340.A O no hydrogen 2.890 N/A ARG 344.A NE ASP 345.A OD1 no hydrogen 2.830 N/A ARG 344.A NH1 ASP 309.A OD1 no hydrogen 3.346 N/A ARG 344.A NH2 ASP 345.A OD1 no hydrogen 2.731 N/A ARG 344.A NH2 ASP 345.A OD2 no hydrogen 3.412 N/A ASP 345.A N ALA 341.A O no hydrogen 2.934 N/A MET 346.A N ASP 342.A O no hydrogen 2.831 N/A TYR 347.A N GLN 343.A O no hydrogen 3.223 N/A ALA 348.A N ARG 344.A O no hydrogen 3.063 N/A PHE 349.A N ASP 345.A O no hydrogen 2.914 N/A LEU 350.A N MET 346.A O no hydrogen 3.203 N/A ASN 351.A N TYR 347.A O no hydrogen 3.167 N/A ASN 351.A ND2 ASN 352.A OD1 no hydrogen 3.253 N/A ASN 352.A N ALA 348.A O no hydrogen 2.775 N/A ARG 353.A N PHE 349.A O no hydrogen 2.756 N/A ALA 354.A N LEU 350.A O no hydrogen 3.386 N/A LEU 355.A N ASN 351.A O no hydrogen 3.030 N/A ASN 356.A N ASN 352.A O no hydrogen 2.965 N/A LEU 357.A N ARG 353.A O no hydrogen 2.890 N/A MET 358.A N ALA 354.A O no hydrogen 2.764 N/A ASN 359.A N LEU 355.A O no hydrogen 3.149 N/A ASN 359.A ND2 LEU 355.A O no hydrogen 2.649 N/A LYS 360.A N LEU 357.A O no hydrogen 3.240 N/A LYS 360.A NZ ASN 356.A OD1 no hydrogen 2.854 N/A GLY 361.A N MET 358.A O no hydrogen 2.845 N/A LEU 362.A N LEU 357.A O no hydrogen 2.920 N/A THR 363.A N GLU 366.A OE1 no hydrogen 3.348 N/A ILE 367.A N THR 363.A O no hydrogen 2.939 N/A ALA 368.A N LEU 364.A O no hydrogen 3.253 N/A ALA 369.A N HIS 365.A O no hydrogen 3.135 N/A GLU 370.A N GLU 366.A O no hydrogen 2.958 N/A VAL 371.A N ILE 367.A O no hydrogen 3.000 N/A SER 372.A OG VAL 371.A O no hydrogen 2.661 N/A LYS 373.A N VAL 371.A O no hydrogen 2.747 N/A LEU 378.A N PRO 375.A O no hydrogen 3.072 N/A ARG 380.A N GLU 377.A O no hydrogen 3.117 N/A ARG 380.A NE GLU 377.A OE1 no hydrogen 2.772 N/A LYS 381.A NZ ASP 342.A OD2 no hydrogen 2.741 N/A TYR 383.A OH ASP 342.A OD2 no hydrogen 2.502 N/A LEU 384.A N LYS 381.A O no hydrogen 3.379 N/A ARG 385.A N TRP 382.A O no hydrogen 3.440 N/A ARG 385.A NE GLU 484.A OE2 no hydrogen 2.816 N/A ARG 385.A NH1 ASP 379.A OD1 no hydrogen 3.140 N/A ARG 385.A NH2 GLU 484.A OE1 no hydrogen 2.737 N/A ARG 385.A NH2 GLU 484.A OE2 no hydrogen 3.318 N/A TYR 387.A N ARG 385.A O no hydrogen 3.001 N/A TYR 387.A OH SER 75.A O no hydrogen 3.142 N/A TYR 387.A OH SER 75.A OG.A no hydrogen 2.627 N/A GLY 389.A N MET 287.A O no hydrogen 2.681 N/A ASN 394.A N ALA 390.A O no hydrogen 2.857 N/A ASN 394.A ND2 HIS 288.A O no hydrogen 2.973 N/A LEU 395.A N LEU 391.A O no hydrogen 2.965 N/A ARG 396.A N SER 392.A O no hydrogen 3.027 N/A ARG 396.A NH1 HIS 365.A ND1 no hydrogen 3.353 N/A ALA 397.A N THR 393.A O no hydrogen 2.753 N/A VAL 398.A N ASN 394.A O no hydrogen 3.000 N/A TYR 399.A N LEU 395.A O no hydrogen 3.262 N/A GLN 400.A N ARG 396.A O no hydrogen 2.938 N/A ARG 401.A N ALA 397.A O no hydrogen 2.747 N/A TYR 402.A N VAL 398.A O no hydrogen 3.034 N/A TYR 402.A OH ASN 351.A OD1 no hydrogen 2.792 N/A LEU 403.A N TYR 399.A O no hydrogen 2.690 N/A GLY 404.A N TYR 399.A O no hydrogen 3.084 N/A ASN 409.A N ASP 407.A OD1 no hydrogen 3.229 N/A ALA 411.A N ASN 409.A OD1 no hydrogen 3.144 N/A ASN 412.A N ASN 409.A O no hydrogen 3.069 N/A LEU 413.A N PRO 410.A O no hydrogen 2.916 N/A ALA 421.A N PRO 417.A O no hydrogen 2.846 N/A GLY 422.A N PRO 418.A O no hydrogen 2.878 N/A LYS 423.A N VAL 419.A O no hydrogen 3.246 N/A LYS 423.A NZ ALA 461.A O no hydrogen 3.047 N/A ARG 424.A N GLU 420.A O no hydrogen 3.387 N/A ARG 424.A NH1 GLU 420.A OE1 no hydrogen 2.647 N/A TYR 425.A N ALA 421.A O no hydrogen 2.883 N/A VAL 426.A N GLY 422.A O no hydrogen 3.054 N/A GLU 427.A N LYS 423.A O no hydrogen 3.128 N/A ALA 428.A N ARG 424.A O no hydrogen 3.019 N/A MET 429.A N TYR 425.A O no hydrogen 2.779 N/A MET 429.A N VAL 426.A O no hydrogen 3.248 N/A GLY 430.A N GLU 427.A O no hydrogen 3.080 N/A GLY 431.A N VAL 426.A O no hydrogen 2.822 N/A VAL 435.A N GLY 431.A O no hydrogen 2.857 N/A LEU 436.A N ALA 432.A O no hydrogen 3.100 N/A LYS 437.A N ASP 433.A O no hydrogen 2.996 N/A GLN 438.A N ALA 434.A O no hydrogen 3.113 N/A MET 439.A N VAL 435.A O no hydrogen 2.834 N/A ARG 440.A N LEU 436.A O no hydrogen 3.040 N/A ALA 441.A N LYS 437.A O no hydrogen 3.083 N/A ALA 442.A N GLN 438.A O no hydrogen 3.107 N/A ILE 443.A N MET 439.A O no hydrogen 3.216 N/A ASP 444.A N ARG 440.A O no hydrogen 3.219 N/A LYS 445.A N ALA 441.A O no hydrogen 2.985 N/A GLY 446.A N ALA 442.A O no hydrogen 3.094 N/A GLY 446.A N ILE 443.A O no hydrogen 2.970 N/A ASP 447.A N ALA 442.A O no hydrogen 2.822 N/A TYR 448.A OH SER 9.A OG no hydrogen 2.599 N/A TRP 450.A N ASP 447.A OD1 no hydrogen 3.238 N/A ALA 451.A N ASP 447.A O no hydrogen 3.057 N/A VAL 452.A N TYR 448.A O no hydrogen 3.058 N/A GLN 453.A N TRP 450.A O no hydrogen 3.044 N/A LEU 454.A N TRP 450.A O no hydrogen 3.228 N/A GLY 455.A N ALA 451.A O no hydrogen 2.988 N/A ASN 456.A N VAL 452.A O no hydrogen 3.026 N/A LEU 458.A N LEU 454.A O no hydrogen 3.115 N/A VAL 459.A N GLY 455.A O no hydrogen 2.935 N/A PHE 460.A N ASN 456.A O no hydrogen 3.086 N/A ALA 461.A N HIS 457.A O no hydrogen 3.126 N/A ASP 462.A N LEU 458.A O no hydrogen 2.893 N/A ASN 465.A N ASP 462.A O no hydrogen 3.342 N/A ALA 468.A N ASN 465.A OD1 no hydrogen 3.314 N/A ARG 469.A N ASN 465.A O no hydrogen 3.159 N/A ARG 469.A NE LEU 499.A O no hydrogen 2.771 N/A ARG 469.A NH1 PRO 463.A O no hydrogen 2.913 N/A ARG 469.A NH2 LEU 499.A O no hydrogen 3.103 N/A ARG 469.A NH2 GLU 631.A OE1 no hydrogen 3.160 N/A ALA 470.A N LYS 466.A O no hydrogen 3.172 N/A LEU 471.A N ASP 467.A O no hydrogen 3.070 N/A GLN 472.A N ALA 468.A O no hydrogen 2.964 N/A GLN 472.A NE2 VAL 452.A O no hydrogen 3.041 N/A ALA 473.A N ARG 469.A O no hydrogen 2.919 N/A ASP 474.A N ALA 470.A O no hydrogen 2.981 N/A ALA 475.A N LEU 471.A O no hydrogen 2.995 N/A MET 476.A N GLN 472.A O no hydrogen 3.026 N/A GLU 477.A N ALA 473.A O no hydrogen 2.978 N/A GLN 478.A N ASP 474.A O no hydrogen 3.232 N/A GLN 478.A NE2 PRO 7.A O no hydrogen 2.913 N/A LEU 479.A N ALA 475.A O no hydrogen 3.142 N/A GLY 480.A N MET 476.A O no hydrogen 2.921 N/A TYR 481.A N GLU 477.A O no hydrogen 2.877 N/A TYR 481.A OH LYS 6.A O no hydrogen 2.724 N/A GLN 482.A N GLN 478.A O no hydrogen 2.984 N/A GLN 482.A NE2 THR 12.A OG1 no hydrogen 2.811 N/A THR 483.A N LEU 479.A O no hydrogen 2.928 N/A ASN 485.A N THR 483.A OG1 no hydrogen 3.209 N/A ASN 485.A ND2 SER 386.A O no hydrogen 2.899 N/A ASN 485.A ND2 TYR 388.A O no hydrogen 3.215 N/A ALA 486.A N TYR 387.A O no hydrogen 2.929 N/A TRP 488.A N ASN 485.A OD1 no hydrogen 2.741 N/A ARG 489.A N ASN 485.A O no hydrogen 2.972 N/A ARG 489.A NE ALA 214.A O no hydrogen 2.782 N/A ARG 489.A NH1 THR 71.A O no hydrogen 3.047 N/A ARG 489.A NH2 THR 71.A O no hydrogen 3.236 N/A ARG 489.A NH2 ALA 214.A O no hydrogen 3.107 N/A ASN 490.A N ALA 486.A O no hydrogen 2.956 N/A ASN 490.A ND2 GLN 203.A O no hydrogen 2.860 N/A ASN 490.A ND2 ASP 217.A O no hydrogen 3.658 N/A ASN 490.A ND2 SER 218.A OG no hydrogen 2.951 N/A MET 491.A N LEU 487.A O no hydrogen 2.904 N/A TYR 492.A N TRP 488.A O no hydrogen 3.003 N/A MET 493.A N ARG 489.A O no hydrogen 3.105 N/A THR 494.A N ASN 490.A O no hydrogen 2.985 N/A THR 494.A OG1 ASN 490.A O no hydrogen 2.660 N/A GLY 495.A N MET 491.A O no hydrogen 2.784 N/A ALA 496.A N TYR 492.A O no hydrogen 2.720 N/A MET 497.A N MET 493.A O no hydrogen 3.072 N/A GLU 498.A N THR 494.A O no hydrogen 3.107 N/A LEU 499.A N GLY 495.A O no hydrogen 3.038 N/A ARG 500.A N ALA 496.A O no hydrogen 3.202 N/A ARG 500.A NH1 GLU 477.A OE2 no hydrogen 2.711 N/A ARG 500.A NH2 ASP 474.A OD1 no hydrogen 2.793 N/A ARG 500.A NH2 GLU 477.A OE1 no hydrogen 3.045 N/A ARG 500.A NH2 GLU 477.A OE2 no hydrogen 3.192 N/A HIS 501.A N MET 497.A O no hydrogen 2.824 N/A TYR 506.A OH THR 226.A OG1 no hydrogen 2.687 N/A LYS 511.A NZ GLU 50.A OE2 no hydrogen 2.823 N/A LYS 511.A NZ GLN 52.A OE1 no hydrogen 3.438 N/A ALA 517.A N MET 514.A O no hydrogen 3.419 N/A THR 519.A OG1 ASP 521.A OD2 no hydrogen 2.758 N/A MET 522.A N THR 519.A OG1 no hydrogen 3.258 N/A PHE 523.A N THR 519.A O no hydrogen 2.980 N/A PHE 524.A N PRO 520.A O no hydrogen 2.724 N/A ASP 525.A N ASP 521.A O no hydrogen 3.091 N/A LEU 526.A N MET 522.A O no hydrogen 3.297 N/A LEU 527.A N PHE 523.A O no hydrogen 3.158 N/A ALA 528.A N PHE 524.A O no hydrogen 2.868 N/A ILE 529.A N ASP 525.A O no hydrogen 3.274 N/A ILE 529.A N LEU 526.A O no hydrogen 3.253 N/A ARG 530.A N LEU 526.A O no hydrogen 2.812 N/A ARG 530.A NE ASP 621.A O no hydrogen 2.633 N/A ARG 530.A NH2 ASP 621.A O no hydrogen 2.875 N/A LEU 531.A N LEU 527.A O no hydrogen 2.711 N/A ASP 532.A N LEU 619.A O no hydrogen 2.951 N/A THR 533.A OG1 GLY 561.A O no hydrogen 3.056 N/A ALA 536.A N ASP 532.A O no hydrogen 2.905 N/A HIS 539.A N ALA 536.A O no hydrogen 3.164 N/A HIS 539.A ND1 GLU 615.A OE2 no hydrogen 2.727 N/A MET 541.A N LEU 558.A O no hydrogen 3.073 N/A THR 542.A N ASP 575.A OD2 no hydrogen 2.810 N/A THR 542.A OG1 ASP 575.A OD2 no hydrogen 3.011 N/A LEU 543.A N LEU 556.A O no hydrogen 3.069 N/A ASN 544.A N VAL 576.A O no hydrogen 2.951 N/A ASN 544.A ND2 ASN 571.A O no hydrogen 2.860 N/A TRP 545.A N ILE 554.A O no hydrogen 2.853 N/A VAL 546.A N VAL 578.A O no hydrogen 2.840 N/A PHE 547.A N GLN 552.A O no hydrogen 3.060 N/A LEU 550.A N PHE 547.A O no hydrogen 3.129 N/A GLN 552.A N PHE 547.A O no hydrogen 3.380 N/A ILE 554.A N TRP 545.A O no hydrogen 2.891 N/A ALA 555.A N ARG 566.A O no hydrogen 3.015 N/A LEU 556.A N LEU 543.A O no hydrogen 2.862 N/A THR 557.A N THR 564.A O no hydrogen 3.074 N/A LEU 558.A N MET 541.A O no hydrogen 2.785 N/A ARG 559.A N VAL 562.A O no hydrogen 2.953 N/A ASN 560.A N ASP 540.A OD1 no hydrogen 3.310 N/A VAL 562.A N ARG 559.A O no hydrogen 2.948 N/A THR 564.A N THR 557.A O no hydrogen 2.986 N/A GLN 565.A NE2 ASP 521.A O no hydrogen 2.912 N/A GLN 565.A NE2 ASP 525.A OD1 no hydrogen 2.782 N/A ARG 566.A N ALA 555.A O no hydrogen 3.186 N/A GLY 568.A N ASP 553.A O no hydrogen 2.783 N/A ASN 571.A N ASN 544.A OD1 no hydrogen 2.844 N/A LYS 573.A N ASN 571.A OD1 no hydrogen 3.099 N/A ASP 575.A N THR 542.A OG1 no hydrogen 3.180 N/A THR 577.A N ASP 607.A O no hydrogen 2.892 N/A THR 577.A OG1 ASP 607.A OD2.A no hydrogen 3.156 N/A VAL 578.A N ASN 544.A O no hydrogen 2.756 N/A LYS 579.A N LYS 605.A O no hydrogen 3.031 N/A LEU 580.A N VAL 546.A O no hydrogen 3.113 N/A THR 581.A N THR 584.A OG1 no hydrogen 3.224 N/A LYS 582.A N ASP 549.A OD1 no hydrogen 3.054 N/A LYS 582.A N ASP 549.A OD2 no hydrogen 3.256 N/A LYS 582.A NZ ARG 516.A O no hydrogen 2.923 N/A THR 584.A OG1 THR 581.A O no hydrogen 2.906 N/A LEU 585.A N THR 581.A O no hydrogen 2.908 N/A ASP 586.A N LYS 582.A O no hydrogen 2.796 N/A GLN 587.A N PRO 583.A O no hydrogen 3.165 N/A ILE 588.A N THR 584.A O no hydrogen 3.126 N/A ALA 589.A N LEU 585.A O no hydrogen 2.843 N/A ALA 590.A N ASP 586.A O no hydrogen 2.785 N/A ARG 591.A N ILE 588.A O no hydrogen 3.238 N/A LYS 592.A N GLN 587.A O no hydrogen 3.104 N/A LYS 592.A NZ ALA 590.A O no hydrogen 2.895 N/A LEU 593.A N GLN 587.A O no hydrogen 3.145 N/A THR 597.A OG1 ASP 594.A OD2 no hydrogen 2.803 N/A ALA 598.A N ASP 594.A O no hydrogen 3.063 N/A ILE 599.A N LEU 595.A O no hydrogen 3.040 N/A LYS 600.A N PRO 596.A O no hydrogen 3.009 N/A GLN 601.A N THR 597.A O no hydrogen 3.032 N/A GLY 602.A N ALA 598.A O no hydrogen 3.160 N/A THR 603.A OG1 ALA 598.A O no hydrogen 3.153 N/A VAL 604.A N ALA 598.A O no hydrogen 3.387 N/A LYS 605.A N LYS 579.A O no hydrogen 3.033 N/A ASP 607.A N THR 577.A O no hydrogen 3.114 N/A ASP 609.A N ASP 575.A O no hydrogen 2.721 N/A LYS 611.A NZ GLU 615.A OE1 no hydrogen 2.820 N/A LYS 612.A N ASP 609.A O no hydrogen 2.977 N/A LEU 613.A N GLY 610.A O no hydrogen 3.436 N/A GLU 615.A N LYS 611.A O no hydrogen 3.301 N/A PHE 616.A N LYS 612.A O no hydrogen 2.964 N/A PHE 617.A N LEU 613.A O no hydrogen 3.001 N/A GLY 618.A N GLY 614.A O no hydrogen 3.116 N/A GLY 618.A N GLU 615.A O no hydrogen 3.122 N/A LEU 619.A N PHE 616.A O no hydrogen 3.131 N/A ASP 621.A N ARG 530.A O no hydrogen 2.831 N/A