Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s3j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 7.A N HIS 43.A O no hydrogen 2.709 N/A ARG 8.A N HIS 43.A O no hydrogen 3.232 N/A ARG 8.A NH1 ASP 10.A OD2 no hydrogen 3.484 N/A ASP 10.A N THR 41.A O no hydrogen 2.876 N/A GLU 12.A N ASP 10.A OD1 no hydrogen 2.878 N/A THR 15.A OG1 GLU 12.A O no hydrogen 3.554 N/A ASN 16.A N GLU 12.A O no hydrogen 2.837 N/A ASN 16.A ND2 LEU 11.A O no hydrogen 2.617 N/A ASN 16.A ND2 TRP 39.A O no hydrogen 2.751 N/A GLY 17.A N LEU 13.A O no hydrogen 2.857 N/A ARG 18.A N GLU 14.A O no hydrogen 3.264 N/A ARG 18.A NH2 GLU 14.A OE2 no hydrogen 2.941 N/A ASP 19.A N THR 15.A O no hydrogen 3.181 N/A HIS 20.A N ASN 16.A O no hydrogen 2.802 N/A HIS 20.A NE2 PRO 37.A O no hydrogen 2.937 N/A THR 22.A N GLY 17.A O no hydrogen 2.887 N/A THR 22.A OG1 VAL 31.A O no hydrogen 2.884 N/A LEU 25.A N THR 22.A O no hydrogen 2.963 N/A CYS 26.A N THR 22.A O no hydrogen 2.999 N/A CYS 26.A N ALA 23.A O no hydrogen 3.059 N/A CYS 26.A SG LEU 13.A O no hydrogen 4.014 N/A CYS 26.A SG THR 22.A O no hydrogen 3.403 N/A CYS 26.A SG THR 22.A OG1 no hydrogen 3.565 N/A CYS 26.A SG VAL 31.A O no hydrogen 3.653 N/A ARG 27.A N LEU 25.A O no hydrogen 2.812 N/A VAL 32.A N ILE 135.A O no hydrogen 2.771 N/A ARG 33.A N HIS 20.A ND1 no hydrogen 3.042 N/A ARG 33.A NE HIS 20.A O no hydrogen 2.715 N/A ARG 33.A NH1 PHE 138.A O no hydrogen 3.158 N/A ARG 33.A NH2 HIS 21.A O no hydrogen 2.812 N/A ARG 34.A N LEU 137.A O no hydrogen 3.037 N/A ARG 34.A NE ASP 145.A OD2 no hydrogen 2.866 N/A ARG 34.A NH1 ALA 109.A O no hydrogen 2.642 N/A ARG 34.A NH1 SER 214.A O no hydrogen 2.891 N/A ARG 34.A NH2 ASP 145.A OD1 no hydrogen 2.931 N/A ARG 34.A NH2 SER 214.A O no hydrogen 3.353 N/A GLY 35.A N THR 105.A OG1 no hydrogen 2.736 N/A GLN 36.A NE2 ASP 19.A O no hydrogen 2.904 N/A PHE 38.A N LEU 103.A O no hydrogen 2.683 N/A TRP 39.A N ASN 16.A OD1 no hydrogen 2.929 N/A TRP 39.A NE1 GLN 102.A OE1 no hydrogen 2.833 N/A LEU 40.A N LEU 101.A O no hydrogen 3.277 N/A THR 41.A N ASP 10.A O no hydrogen 3.047 N/A THR 41.A OG1 GLU 12.A OE2 no hydrogen 2.735 N/A LEU 42.A N LEU 99.A O no hydrogen 2.860 N/A HIS 43.A N ARG 8.A O no hydrogen 2.874 N/A PHE 44.A N CYS 97.A O no hydrogen 2.994 N/A GLU 45.A N VAL 5.A O no hydrogen 2.713 N/A ARG 47.A NE GLU 2.A O no hydrogen 2.772 N/A ARG 47.A NH1 ASP 54.A OD1 no hydrogen 2.967 N/A ARG 47.A NH1 ASP 54.A OD2 no hydrogen 3.452 N/A ARG 47.A NH2 GLU 2.A O no hydrogen 2.820 N/A ARG 47.A NH2 ASP 54.A OD2 no hydrogen 2.821 N/A ASN 48.A ND2 GLN 95.A O no hydrogen 2.965 N/A ASN 48.A ND2 ASP 96.A O no hydrogen 3.315 N/A ASN 48.A ND2 THR 98.A O no hydrogen 3.104 N/A TYR 49.A N ASN 48.A OD1 no hydrogen 2.581 N/A GLU 50.A N ASP 54.A OD1 no hydrogen 2.690 N/A VAL 53.A N GLU 50.A O no hydrogen 2.953 N/A ASP 54.A N GLU 50.A O no hydrogen 2.775 N/A SER 55.A N SER 121.A O no hydrogen 2.899 N/A THR 57.A N GLU 119.A O no hydrogen 2.743 N/A PHE 58.A N PHE 76.A O no hydrogen 2.765 N/A SER 59.A N SER 117.A O no hydrogen 2.835 N/A VAL 60.A N ALA 74.A O no hydrogen 2.832 N/A VAL 61.A N ARG 115.A O no hydrogen 3.298 N/A THR 62.A N THR 72.A O no hydrogen 2.815 N/A THR 62.A OG1 LEU 113.A O no hydrogen 2.557 N/A SER 67.A N THR 72.A OG1 no hydrogen 2.988 N/A ALA 70.A N SER 67.A O no hydrogen 3.128 N/A ALA 70.A N SER 67.A OG no hydrogen 3.369 N/A GLY 71.A N GLN 68.A O no hydrogen 3.033 N/A THR 72.A N SER 67.A O no hydrogen 3.093 N/A THR 72.A OG1 SER 67.A O no hydrogen 3.439 N/A ALA 74.A N VAL 60.A O no hydrogen 2.961 N/A PHE 76.A N PHE 58.A O no hydrogen 3.041 N/A LEU 78.A N LEU 56.A O no hydrogen 2.887 N/A ARG 79.A N ALA 89.A O no hydrogen 3.053 N/A ASP 86.A N GLU 83.A O no hydrogen 3.250 N/A THR 88.A N THR 104.A O no hydrogen 3.137 N/A THR 90.A N GLN 102.A O no hydrogen 3.089 N/A THR 90.A OG1 ARG 79.A O no hydrogen 2.634 N/A VAL 92.A N SER 100.A O no hydrogen 2.999 N/A ASP 93.A N SER 100.A O no hydrogen 3.420 N/A GLN 95.A N THR 98.A O no hydrogen 3.022 N/A GLN 95.A NE2 ASP 93.A OD1 no hydrogen 3.078 N/A LEU 99.A N LEU 42.A O no hydrogen 2.924 N/A SER 100.A N ASP 93.A O no hydrogen 2.818 N/A LEU 101.A N LEU 40.A O no hydrogen 2.787 N/A GLN 102.A N THR 90.A O no hydrogen 2.909 N/A LEU 103.A N PHE 38.A O no hydrogen 2.713 N/A THR 104.A N THR 88.A O no hydrogen 3.042 N/A THR 105.A OG1 PRO 106.A O no hydrogen 3.326 N/A ALA 109.A N PRO 106.A O no hydrogen 3.402 N/A ILE 111.A N ARG 213.A O no hydrogen 3.302 N/A GLY 112.A N LEU 136.A O no hydrogen 2.965 N/A TYR 114.A N PHE 134.A O no hydrogen 2.709 N/A TYR 114.A OH PRO 110.A O no hydrogen 2.624 N/A ARG 115.A N VAL 61.A O no hydrogen 3.079 N/A LEU 116.A N GLY 132.A O no hydrogen 2.700 N/A SER 117.A N SER 59.A O no hydrogen 2.758 N/A LEU 118.A N PHE 129.A O no hydrogen 2.801 N/A GLU 119.A N THR 57.A O no hydrogen 2.704 N/A ALA 120.A N SER 127.A O no hydrogen 3.021 N/A SER 121.A N SER 55.A O no hydrogen 2.866 N/A SER 121.A OG GLY 123.A O no hydrogen 3.496 N/A THR 122.A N GLN 125.A O no hydrogen 3.188 N/A THR 122.A OG1 ASP 54.A OD2 no hydrogen 2.993 N/A SER 127.A N ALA 120.A O no hydrogen 3.251 N/A SER 127.A OG GLU 3.A OE1 no hydrogen 2.955 N/A PHE 129.A N LEU 118.A O no hydrogen 2.904 N/A LEU 131.A N LEU 116.A O no hydrogen 2.923 N/A GLY 132.A N LEU 116.A O no hydrogen 3.314 N/A PHE 134.A N TYR 114.A O no hydrogen 2.951 N/A ILE 135.A N LEU 30.A O no hydrogen 2.821 N/A LEU 136.A N GLY 112.A O no hydrogen 2.914 N/A LEU 137.A N VAL 32.A O no hydrogen 2.889 N/A PHE 138.A N LEU 290.A O no hydrogen 3.069 N/A ASN 139.A N ASP 145.A OD2 no hydrogen 2.850 N/A ASN 139.A ND2 ARG 34.A O no hydrogen 3.115 N/A ASN 139.A ND2 GLN 36.A OE1 no hydrogen 2.913 N/A TRP 141.A N ASN 139.A OD1 no hydrogen 2.996 N/A TRP 141.A NE1 GLU 152.A OE2 no hydrogen 3.016 N/A CYS 142.A N ASN 139.A O no hydrogen 3.304 N/A CYS 142.A SG GLY 35.A O no hydrogen 3.713 N/A ASP 145.A N CYS 142.A O no hydrogen 2.980 N/A VAL 147.A N ASP 145.A OD1 no hydrogen 2.915 N/A TYR 148.A N ASP 145.A O no hydrogen 2.928 N/A LEU 149.A N ALA 140.A O no hydrogen 3.060 N/A GLU 154.A N SER 151.A O no hydrogen 3.223 N/A GLU 154.A N SER 151.A OG no hydrogen 3.182 N/A ARG 155.A N SER 151.A O no hydrogen 3.133 N/A ARG 155.A NE GLU 152.A OE2 no hydrogen 3.056 N/A ARG 155.A NH1 LEU 149.A O no hydrogen 2.569 N/A ARG 155.A NH2 GLU 152.A OE2 no hydrogen 2.833 N/A GLN 156.A N GLU 152.A O no hydrogen 3.085 N/A GLN 156.A NE2 GLU 152.A OE1 no hydrogen 3.087 N/A GLU 157.A N GLU 153.A O no hydrogen 3.098 N/A TYR 158.A N GLU 154.A O no hydrogen 2.797 N/A VAL 159.A N ARG 155.A O no hydrogen 3.088 N/A LEU 160.A N ARG 155.A O no hydrogen 3.244 N/A THR 161.A OG1 GLN 156.A O no hydrogen 2.513 N/A GLN 163.A NE2 ASN 180.A OD1 no hydrogen 3.003 N/A GLY 164.A N TRP 179.A O no hydrogen 3.014 N/A ILE 166.A N ILE 177.A O no hydrogen 2.855 N/A GLN 168.A N LYS 175.A O no hydrogen 2.726 N/A SER 170.A N PHE 173.A O no hydrogen 3.115 N/A PHE 173.A N SER 170.A OG no hydrogen 3.041 N/A LYS 175.A N GLN 168.A O no hydrogen 3.024 N/A LYS 175.A NZ GLN 168.A OE1 no hydrogen 2.827 N/A ILE 177.A N ILE 166.A O no hydrogen 2.934 N/A TRP 179.A N GLY 164.A O no hydrogen 2.955 N/A TRP 179.A NE1 SER 256.A OG no hydrogen 2.982 N/A ASN 180.A N ILE 254.A O no hydrogen 2.865 N/A ASN 180.A ND2 GLU 185.A OE2 no hydrogen 3.047 N/A PHE 181.A N GLN 162.A O no hydrogen 2.642 N/A GLY 182.A N GLN 162.A O no hydrogen 3.168 N/A GLN 183.A N GLN 183.A OE1 no hydrogen 2.751 N/A GLN 183.A NE2 VAL 159.A O no hydrogen 3.069 N/A GLN 183.A NE2 THR 161.A O no hydrogen 2.874 N/A PHE 184.A N GLN 162.A OE1 no hydrogen 2.696 N/A GLU 185.A N GLY 182.A O no hydrogen 2.963 N/A ILE 188.A N GLU 185.A O no hydrogen 2.942 N/A ILE 191.A N GLY 187.A O no hydrogen 3.142 N/A CYS 192.A N ILE 188.A O no hydrogen 2.963 N/A CYS 192.A SG ILE 188.A O no hydrogen 3.264 N/A LEU 193.A N LEU 189.A O no hydrogen 2.999 N/A ILE 194.A N ASP 190.A O no hydrogen 3.019 N/A LEU 195.A N ILE 191.A O no hydrogen 2.888 N/A LEU 196.A N CYS 192.A O no hydrogen 3.131 N/A ASP 197.A N LEU 193.A O no hydrogen 2.886 N/A VAL 198.A N LEU 195.A O no hydrogen 3.459 N/A ASN 199.A N LEU 196.A O no hydrogen 3.132 N/A ASN 199.A ND2 LEU 196.A O no hydrogen 2.690 N/A ASN 199.A ND2 ASP 209.A OD2 no hydrogen 3.014 N/A LYS 201.A N ASN 199.A OD1 no hydrogen 2.858 N/A PHE 202.A N ASN 199.A O no hydrogen 2.967 N/A LEU 203.A N ASN 199.A O no hydrogen 3.367 N/A LEU 203.A N PRO 200.A O no hydrogen 3.236 N/A LYS 204.A N PRO 200.A O no hydrogen 3.050 N/A ASN 205.A N LYS 201.A O no hydrogen 3.037 N/A ARG 208.A N ASN 205.A OD1 no hydrogen 3.326 N/A ASP 209.A N ASN 205.A O no hydrogen 2.963 N/A CYS 210.A N ALA 206.A O no hydrogen 2.996 N/A CYS 210.A SG ALA 206.A O no hydrogen 3.623 N/A SER 211.A N GLY 207.A O no hydrogen 3.246 N/A SER 211.A OG ALA 70.A O no hydrogen 2.748 N/A ARG 212.A N ARG 208.A O no hydrogen 2.920 N/A ARG 213.A N ASP 209.A O no hydrogen 3.192 N/A ARG 213.A NE ASP 209.A OD1 no hydrogen 3.176 N/A ARG 213.A NH1 ASP 197.A OD1 no hydrogen 2.967 N/A ARG 213.A NH2 ASP 197.A OD1 no hydrogen 2.738 N/A ARG 213.A NH2 ASP 209.A OD1 no hydrogen 2.690 N/A SER 214.A N SER 211.A O no hydrogen 3.280 N/A SER 215.A N ARG 212.A O no hydrogen 2.914 N/A TYR 218.A N SER 215.A OG no hydrogen 3.140 N/A TYR 218.A OH ASP 209.A OD2 no hydrogen 2.539 N/A VAL 219.A N SER 215.A O no hydrogen 3.015 N/A GLY 220.A N PRO 216.A O no hydrogen 2.878 N/A ARG 221.A N VAL 217.A O no hydrogen 3.019 N/A ARG 221.A NH1 GLY 353.A O no hydrogen 2.827 N/A ARG 221.A NH1 ASP 370.A OD2 no hydrogen 2.998 N/A VAL 222.A N TYR 218.A O no hydrogen 2.928 N/A VAL 223.A N VAL 219.A O no hydrogen 2.858 N/A SER 224.A N GLY 220.A O no hydrogen 2.971 N/A SER 224.A N ARG 221.A O no hydrogen 3.213 N/A SER 224.A OG ARG 221.A O no hydrogen 2.883 N/A GLY 225.A N VAL 222.A O no hydrogen 3.217 N/A MET 226.A N VAL 222.A O no hydrogen 3.166 N/A MET 226.A N VAL 223.A O no hydrogen 3.281 N/A GLY 234.A N ASP 231.A O no hydrogen 2.894 N/A VAL 235.A N MET 226.A O no hydrogen 3.219 N/A LEU 236.A N VAL 227.A O no hydrogen 2.982 N/A LEU 237.A N VAL 271.A O no hydrogen 2.737 N/A ARG 239.A N GLY 274.A O no hydrogen 3.170 N/A ARG 239.A NE ASP 241.A OD1 no hydrogen 2.860 N/A ARG 239.A NE ASP 241.A OD2 no hydrogen 2.993 N/A ARG 239.A NH1 TYR 273.A OH no hydrogen 3.326 N/A ARG 239.A NH2 ASP 241.A OD1 no hydrogen 2.648 N/A ASN 243.A N ASP 241.A OD2 no hydrogen 2.644 N/A ASP 246.A N ASP 246.A OD1 no hydrogen 2.684 N/A GLY 247.A N TYR 244.A O no hydrogen 3.101 N/A VAL 248.A N LYS 272.A O no hydrogen 2.882 N/A SER 252.A N SER 249.A O no hydrogen 2.804 N/A TRP 253.A NE1 TYR 273.A O no hydrogen 2.742 N/A SER 256.A N ASN 180.A O no hydrogen 3.009 N/A SER 256.A OG THR 285.A OG1 no hydrogen 2.815 N/A LEU 260.A N SER 256.A O no hydrogen 2.951 N/A ARG 261.A N VAL 257.A O no hydrogen 2.875 N/A ARG 261.A NH2 ASP 186.A O no hydrogen 3.029 N/A ARG 262.A N ASP 258.A O no hydrogen 2.902 N/A ARG 262.A NH1 ASP 258.A OD1 no hydrogen 2.926 N/A TRP 263.A N ILE 259.A O no hydrogen 3.000 N/A TRP 263.A NE1 GLN 233.A O no hydrogen 2.844 N/A LYS 264.A N LEU 260.A O no hydrogen 3.075 N/A ASN 265.A N ARG 261.A O no hydrogen 2.738 N/A HIS 266.A N ARG 262.A O no hydrogen 3.105 N/A HIS 266.A N TRP 263.A O no hydrogen 3.390 N/A GLY 267.A N LYS 264.A O no hydrogen 2.949 N/A CYS 268.A N TRP 263.A O no hydrogen 2.823 N/A GLN 269.A N TRP 263.A O no hydrogen 3.399 N/A VAL 271.A N VAL 235.A O no hydrogen 2.782 N/A TYR 273.A N VAL 248.A O no hydrogen 2.733 N/A TYR 273.A OH ASP 246.A OD1 no hydrogen 2.744 N/A TYR 273.A OH ASP 246.A OD2 no hydrogen 2.886 N/A GLY 274.A N LEU 237.A O no hydrogen 2.883 N/A GLN 275.A NE2 ARG 239.A O no hydrogen 3.121 N/A PHE 279.A N GLN 275.A O no hydrogen 2.983 N/A ALA 280.A N CYS 276.A O no hydrogen 2.969 N/A ALA 281.A N TRP 277.A O no hydrogen 2.844 N/A VAL 282.A N VAL 278.A O no hydrogen 3.182 N/A ALA 283.A N PHE 279.A O no hydrogen 3.130 N/A CYS 284.A N ALA 280.A O no hydrogen 2.961 N/A CYS 284.A SG THR 294.A O no hydrogen 3.818 N/A THR 285.A N ALA 281.A O no hydrogen 3.033 N/A THR 285.A OG1 PHE 181.A O no hydrogen 2.998 N/A THR 285.A OG1 SER 256.A OG no hydrogen 2.815 N/A THR 285.A OG1 ALA 281.A O no hydrogen 3.353 N/A VAL 286.A N VAL 282.A O no hydrogen 2.929 N/A LEU 287.A N ALA 283.A O no hydrogen 2.884 N/A ARG 288.A N CYS 284.A O no hydrogen 2.904 N/A ARG 288.A NE THR 294.A O no hydrogen 2.901 N/A ARG 288.A NH1 THR 161.A O no hydrogen 2.888 N/A ARG 288.A NH2 THR 294.A O no hydrogen 2.930 N/A CYS 289.A N THR 285.A O no hydrogen 2.969 N/A CYS 289.A SG GLN 183.A O no hydrogen 3.286 N/A LEU 290.A N VAL 286.A O no hydrogen 3.098 N/A GLY 291.A N LEU 287.A O no hydrogen 3.041 N/A ILE 292.A N LEU 287.A O no hydrogen 2.858 N/A THR 294.A N TYR 158.A O no hydrogen 3.069 N/A THR 294.A OG1 ILE 292.A O no hydrogen 2.701 N/A THR 294.A OG1 SER 326.A OG no hydrogen 2.833 N/A ARG 295.A N GLU 325.A O no hydrogen 2.962 N/A ARG 295.A NE GLU 325.A OE1 no hydrogen 2.837 N/A ARG 295.A NH1 TYR 158.A OH no hydrogen 3.126 N/A ARG 295.A NH2 GLU 325.A OE1 no hydrogen 2.902 N/A VAL 297.A N TRP 323.A O no hydrogen 2.939 N/A THR 298.A N SER 401.A O no hydrogen 2.823 N/A THR 298.A OG1 TYR 167.A O no hydrogen 2.664 N/A ASN 299.A N HIS 321.A O no hydrogen 2.802 N/A ASN 299.A ND2 ASN 301.A OD1 no hydrogen 3.098 N/A TYR 300.A N LEU 398.A O no hydrogen 2.950 N/A TYR 300.A OH GLN 168.A O no hydrogen 2.613 N/A ASN 301.A N ASN 319.A O no hydrogen 2.814 N/A ASN 301.A ND2 TRP 318.A O no hydrogen 2.972 N/A SER 302.A N ILE 395.A O no hydrogen 2.846 N/A HIS 304.A N SER 393.A O no hydrogen 3.083 N/A TYR 310.A N LEU 306.A O no hydrogen 2.940 N/A PHE 311.A N LEU 307.A O no hydrogen 3.217 N/A ARG 312.A N ILE 308.A O no hydrogen 2.999 N/A ASN 313.A N GLU 309.A O no hydrogen 3.216 N/A ASN 319.A N ASN 319.A OD1 no hydrogen 2.436 N/A ASN 319.A ND2 GLY 169.A O no hydrogen 3.540 N/A HIS 321.A N ASN 299.A O no hydrogen 2.949 N/A HIS 321.A NE2 ASP 344.A OD2 no hydrogen 2.835 N/A CYS 322.A SG TYR 167.A O no hydrogen 3.919 N/A CYS 322.A SG THR 298.A OG1 no hydrogen 3.394 N/A TRP 323.A N VAL 297.A O no hydrogen 2.982 N/A TRP 323.A NE1 TYR 417.A OH no hydrogen 2.982 N/A VAL 324.A N LEU 343.A O no hydrogen 2.959 N/A GLU 325.A N ARG 295.A O no hydrogen 3.022 N/A SER 326.A N GLN 341.A O no hydrogen 2.786 N/A SER 326.A OG THR 294.A OG1 no hydrogen 2.833 N/A TRP 327.A N PRO 293.A O no hydrogen 2.921 N/A TRP 327.A NE1 TYR 148.A O no hydrogen 2.784 N/A MET 328.A N GLY 339.A O no hydrogen 3.117 N/A THR 329.A N ALA 146.A O no hydrogen 2.964 N/A ARG 330.A NE ASP 332.A OD1 no hydrogen 2.904 N/A ARG 330.A NH1 GLN 341.A OE1 no hydrogen 2.940 N/A ARG 330.A NH1 PRO 354.A O no hydrogen 3.308 N/A ARG 330.A NH2 ASP 332.A OD2 no hydrogen 2.710 N/A ARG 330.A NH2 LYS 368.A O no hydrogen 3.193 N/A LEU 333.A N ARG 330.A O no hydrogen 2.861 N/A TYR 337.A OH ASP 364.A OD2 no hydrogen 2.875 N/A GLY 339.A N MET 328.A O no hydrogen 2.917 N/A GLN 341.A N SER 326.A O no hydrogen 2.747 N/A GLN 341.A NE2 MET 328.A O no hydrogen 3.362 N/A GLN 341.A NE2 TYR 337.A O no hydrogen 3.054 N/A GLN 341.A NE2 GLY 339.A O no hydrogen 2.885 N/A ALA 342.A N VAL 355.A O no hydrogen 2.793 N/A LEU 343.A N VAL 324.A O no hydrogen 2.761 N/A ASP 344.A N CYS 352.A O no hydrogen 3.141 N/A THR 346.A N ASP 344.A OD1 no hydrogen 2.863 N/A THR 349.A OG1 GLY 348.A O no hydrogen 2.588 N/A CYS 351.A SG ARG 221.A O no hydrogen 3.333 N/A CYS 352.A N SER 224.A OG no hydrogen 3.018 N/A GLY 353.A N ASP 370.A OD2 no hydrogen 2.766 N/A VAL 355.A N ALA 342.A O no hydrogen 3.066 N/A VAL 357.A N TRP 340.A O no hydrogen 3.107 N/A ILE 360.A N PRO 356.A O no hydrogen 3.234 N/A LYS 361.A N VAL 357.A O no hydrogen 3.115 N/A LYS 361.A NZ HIS 415.A O no hydrogen 2.867 N/A GLU 362.A N ARG 358.A O no hydrogen 3.098 N/A GLY 363.A N ILE 360.A O no hydrogen 3.276 N/A ASP 364.A N ALA 359.A O no hydrogen 2.877 N/A SER 366.A OG ASP 364.A OD1 no hydrogen 3.559 N/A THR 367.A N ASP 364.A O no hydrogen 3.391 N/A THR 367.A OG1 ASP 364.A O no hydrogen 2.974 N/A TYR 369.A N PRO 354.A O no hydrogen 2.783 N/A PHE 375.A N ALA 371.A O no hydrogen 2.870 N/A ALA 376.A N PRO 372.A O no hydrogen 2.837 N/A GLU 377.A N PHE 373.A O no hydrogen 3.298 N/A GLU 377.A N VAL 374.A O no hydrogen 2.899 N/A VAL 378.A N PHE 375.A O no hydrogen 3.137 N/A ASN 379.A ND2 PHE 375.A O no hydrogen 3.168 N/A ASP 381.A N ASN 538.A O no hydrogen 3.101 N/A VAL 383.A N TYR 540.A O no hydrogen 3.025 N/A ASP 384.A N SER 389.A O no hydrogen 3.034 N/A TRP 385.A N LEU 542.A O no hydrogen 2.883 N/A SER 389.A N ASP 384.A O no hydrogen 3.163 N/A ASN 391.A N VAL 382.A O no hydrogen 2.910 N/A ASN 391.A ND2 ASP 384.A OD1 no hydrogen 3.145 N/A ASN 391.A ND2 ASP 384.A OD2 no hydrogen 3.264 N/A SER 393.A N ASN 391.A OD1 no hydrogen 2.427 N/A ILE 395.A N SER 302.A O no hydrogen 2.968 N/A GLY 397.A N ASN 301.A OD1 no hydrogen 3.074 N/A LEU 398.A N TYR 300.A O no hydrogen 2.817 N/A ILE 400.A N THR 414.A OG1 no hydrogen 3.000 N/A SER 401.A N THR 298.A O no hydrogen 2.737 N/A SER 401.A OG LYS 399.A O no hydrogen 2.547 N/A THR 402.A N GLU 411.A O no hydrogen 3.016 N/A THR 402.A OG1 VAL 296.A O no hydrogen 2.847 N/A LYS 403.A NZ GLU 157.A OE1 no hydrogen 3.229 N/A LYS 403.A NZ GLU 157.A OE2 no hydrogen 2.729 N/A LYS 403.A NZ SER 404.A O no hydrogen 2.908 N/A LYS 403.A NZ ARG 407.A O no hydrogen 3.162 N/A SER 404.A N GLU 409.A O no hydrogen 2.762 N/A SER 404.A OG GLU 409.A O no hydrogen 3.259 N/A GLY 406.A N GLU 157.A OE1 no hydrogen 2.862 N/A ARG 407.A N SER 404.A O no hydrogen 3.387 N/A ARG 410.A NE SER 401.A OG no hydrogen 2.743 N/A GLU 411.A N THR 402.A O no hydrogen 2.708 N/A ILE 413.A N ILE 400.A O no hydrogen 2.815 N/A THR 414.A N ASP 412.A OD1 no hydrogen 3.032 N/A THR 414.A OG1 ASP 412.A OD1 no hydrogen 2.800 N/A THR 416.A N ILE 413.A O no hydrogen 2.939 N/A THR 416.A OG1 ILE 413.A O no hydrogen 2.667 N/A TYR 417.A N THR 414.A O no hydrogen 3.058 N/A TYR 417.A OH GLU 325.A OE2 no hydrogen 2.590 N/A LYS 418.A N THR 414.A O no hydrogen 3.069 N/A LYS 418.A NZ VAL 378.A O no hydrogen 3.107 N/A LYS 418.A NZ VAL 396.A O no hydrogen 2.822 N/A LYS 418.A NZ GLY 397.A O no hydrogen 3.065 N/A TYR 419.A OH GLU 362.A OE1 no hydrogen 2.673 N/A GLY 422.A N GLU 426.A OE2 no hydrogen 2.942 N/A SER 423.A N PRO 420.A O no hydrogen 3.038 N/A SER 423.A OG PRO 420.A O no hydrogen 2.592 N/A GLU 425.A N GLU 425.A OE2 no hydrogen 2.895 N/A GLU 426.A N SER 423.A OG no hydrogen 2.952 N/A ARG 427.A N SER 423.A O no hydrogen 3.396 N/A GLU 428.A N SER 424.A O no hydrogen 3.125 N/A ALA 429.A N GLU 425.A O no hydrogen 3.173 N/A ALA 429.A N GLU 426.A O no hydrogen 3.250 N/A PHE 430.A N GLU 426.A O no hydrogen 3.153 N/A THR 431.A N ARG 427.A O no hydrogen 3.146 N/A THR 431.A OG1 ARG 427.A O no hydrogen 3.100 N/A ARG 432.A N GLU 428.A O no hydrogen 2.957 N/A ARG 432.A NE GLU 362.A O no hydrogen 3.087 N/A ARG 432.A NH2 GLU 362.A O no hydrogen 3.283 N/A ALA 433.A N ALA 429.A O no hydrogen 2.842 N/A ASN 434.A N PHE 430.A O no hydrogen 2.960 N/A ASN 434.A ND2 ASN 434.A O no hydrogen 2.743 N/A ALA 439.A N THR 461.A O no hydrogen 2.870 N/A ARG 441.A N HIS 459.A O no hydrogen 3.073 N/A ARG 443.A N PHE 457.A O no hydrogen 2.887 N/A GLN 446.A NE2 SER 447.A O no hydrogen 3.630 N/A MET 450.A N GLU 550.A O no hydrogen 2.860 N/A GLY 451.A N TYR 516.A OH no hydrogen 2.935 N/A SER 452.A N ASN 449.A O no hydrogen 2.903 N/A SER 452.A OG ASN 449.A O no hydrogen 3.068 N/A PHE 454.A N ILE 511.A O no hydrogen 2.963 N/A VAL 456.A N LEU 509.A O no hydrogen 2.921 N/A PHE 457.A N ARG 443.A O no hydrogen 2.941 N/A ALA 458.A N VAL 507.A O no hydrogen 2.734 N/A HIS 459.A N ARG 441.A O no hydrogen 2.930 N/A HIS 459.A ND1 SER 506.A OG no hydrogen 3.233 N/A ILE 460.A N LYS 505.A O no hydrogen 2.768 N/A THR 461.A N ALA 439.A O no hydrogen 2.961 N/A ASN 462.A N SER 503.A O no hydrogen 2.939 N/A ASN 462.A ND2 GLU 466.A O no hydrogen 2.894 N/A ASN 462.A ND2 LEU 499.A O no hydrogen 3.376 N/A ASN 462.A ND2 GLU 500.A O no hydrogen 2.992 N/A ASN 463.A N GLY 437.A O no hydrogen 2.838 N/A THR 464.A N ASN 462.A OD1 no hydrogen 3.428 N/A THR 464.A OG1 ASN 462.A OD1 no hydrogen 3.136 N/A THR 464.A OG1 TYR 468.A OH no hydrogen 3.062 N/A GLU 466.A N THR 464.A OG1 no hydrogen 3.082 N/A TYR 468.A N LEU 499.A O no hydrogen 3.269 N/A TYR 468.A OH THR 464.A OG1 no hydrogen 3.062 N/A CYS 470.A N LEU 497.A O no hydrogen 2.858 N/A ARG 471.A N VAL 533.A O no hydrogen 2.898 N/A ARG 471.A NH1 LEU 495.A O no hydrogen 2.686 N/A LEU 472.A N LEU 494.A O no hydrogen 2.937 N/A LEU 473.A N LEU 531.A O no hydrogen 3.056 N/A LEU 474.A N LYS 492.A O no hydrogen 2.895 N/A CYS 475.A N ARG 529.A O no hydrogen 2.948 N/A CYS 475.A SG ARG 529.A O no hydrogen 3.861 N/A ALA 476.A N GLY 490.A O no hydrogen 2.833 N/A ARG 477.A N LYS 527.A O no hydrogen 3.034 N/A ARG 477.A NE GLY 486.A O no hydrogen 2.730 N/A ARG 477.A NH2 GLY 486.A O no hydrogen 2.888 N/A THR 478.A N PRO 487.A O no hydrogen 3.133 N/A THR 478.A OG1 PRO 487.A O no hydrogen 3.420 N/A THR 478.A OG1 CYS 519.A O no hydrogen 2.816 N/A VAL 479.A N LEU 525.A O no hydrogen 2.842 N/A SER 480.A N ILE 484.A O no hydrogen 3.035 N/A SER 480.A OG ASN 482.A OD1 no hydrogen 2.699 N/A SER 480.A OG ILE 484.A O no hydrogen 3.156 N/A GLY 483.A N SER 480.A O no hydrogen 3.375 N/A GLY 486.A N THR 478.A O no hydrogen 2.510 N/A CYS 489.A N ALA 476.A O no hydrogen 2.725 N/A GLY 490.A N GLU 488.A OE2 no hydrogen 2.668 N/A THR 491.A OG1 GLU 488.A OE2 no hydrogen 2.835 N/A LYS 492.A N LEU 474.A O no hydrogen 2.740 N/A LEU 494.A N LEU 472.A O no hydrogen 2.903 N/A LEU 497.A N CYS 470.A O no hydrogen 2.827 N/A ASN 498.A ND2 GLU 467.A OE2 no hydrogen 3.182 N/A LEU 499.A N TYR 468.A O no hydrogen 2.979 N/A PHE 502.A N THR 464.A O no hydrogen 2.986 N/A SER 503.A OG GLU 500.A O no hydrogen 2.815 N/A LYS 505.A N ILE 460.A O no hydrogen 2.889 N/A LYS 505.A NZ ASN 498.A O no hydrogen 3.091 N/A SER 506.A OG HIS 459.A ND1 no hydrogen 3.233 N/A VAL 507.A N ALA 458.A O no hydrogen 2.738 N/A LEU 509.A N VAL 456.A O no hydrogen 2.872 N/A ILE 511.A N PHE 454.A O no hydrogen 2.648 N/A TYR 513.A N ASP 453.A OD1 no hydrogen 3.113 N/A LYS 515.A N LEU 512.A O no hydrogen 2.923 N/A TYR 516.A N LEU 512.A O no hydrogen 2.918 N/A TYR 516.A OH SER 452.A O no hydrogen 2.776 N/A ARG 517.A N TYR 513.A O no hydrogen 2.589 N/A ASP 518.A N ASP 518.A OD1 no hydrogen 2.617 N/A CYS 519.A SG LYS 515.A O no hydrogen 3.184 N/A CYS 519.A SG TYR 516.A O no hydrogen 3.602 N/A THR 521.A OG1 VAL 479.A O no hydrogen 3.544 N/A SER 523.A N THR 521.A OG1 no hydrogen 3.081 N/A ASN 524.A N THR 521.A O no hydrogen 3.179 N/A ASN 524.A ND2 LEU 549.A O no hydrogen 2.678 N/A ILE 526.A N LEU 547.A O no hydrogen 3.138 N/A LYS 527.A N ARG 477.A O no hydrogen 2.688 N/A LYS 527.A NZ GLU 544.A OE2 no hydrogen 2.738 N/A LYS 527.A NZ ASP 546.A OD1 no hydrogen 3.554 N/A LYS 527.A NZ ASP 546.A OD2 no hydrogen 3.049 N/A VAL 528.A N ARG 545.A O no hydrogen 2.687 N/A ARG 529.A N CYS 475.A O no hydrogen 2.911 N/A ARG 529.A NH1 GLU 309.A OE2 no hydrogen 2.986 N/A ARG 529.A NH2 GLU 309.A OE2 no hydrogen 3.236 N/A ALA 530.A N ALA 543.A O no hydrogen 2.814 N/A LEU 531.A N LEU 473.A O no hydrogen 2.843 N/A LEU 532.A N LEU 541.A O no hydrogen 2.758 N/A VAL 533.A N ARG 471.A O no hydrogen 2.810 N/A GLU 534.A N SER 539.A O no hydrogen 2.889 N/A VAL 536.A N GLU 534.A OE1 no hydrogen 2.914 N/A ASN 538.A ND2 ALA 376.A O no hydrogen 2.860 N/A ASN 538.A ND2 ASN 379.A O no hydrogen 2.957 N/A SER 539.A N GLU 534.A O no hydrogen 3.029 N/A SER 539.A OG ASP 381.A OD2 no hydrogen 3.418 N/A TYR 540.A N ASP 381.A O no hydrogen 2.667 N/A TYR 540.A OH ASN 538.A OD1 no hydrogen 2.766 N/A LEU 541.A N LEU 532.A O no hydrogen 2.830 N/A LEU 542.A N VAL 383.A O no hydrogen 2.888 N/A ALA 543.A N ALA 530.A O no hydrogen 3.115 N/A ARG 545.A N VAL 528.A O no hydrogen 2.815 N/A ARG 545.A NH1 ILE 442.A O no hydrogen 2.883 N/A LEU 547.A N ILE 526.A O no hydrogen 2.807 N/A LEU 549.A N ASN 524.A O no hydrogen 2.887 N/A GLU 550.A N MET 448.A O no hydrogen 2.962 N/A LYS 555.A N SER 573.A O no hydrogen 2.734 N/A ARG 557.A N GLU 571.A O no hydrogen 2.641 N/A LEU 559.A N VAL 569.A O no hydrogen 2.672 N/A ARG 566.A N LYS 563.A O no hydrogen 3.036 N/A LEU 568.A N LEU 619.A O no hydrogen 3.238 N/A VAL 569.A N LEU 559.A O no hydrogen 2.852 N/A ALA 570.A N MET 617.A O no hydrogen 2.748 N/A GLU 571.A N ARG 557.A O no hydrogen 2.596 N/A VAL 572.A N VAL 615.A O no hydrogen 2.912 N/A SER 573.A N LYS 555.A O no hydrogen 2.857 N/A LEU 574.A N VAL 613.A O no hydrogen 3.222 N/A GLN 575.A NE2 GLY 610.A O no hydrogen 2.760 N/A ASN 576.A N GLU 611.A O no hydrogen 3.112 N/A ASN 576.A ND2 VAL 580.A O no hydrogen 2.902 N/A ASN 576.A ND2 VAL 607.A O no hydrogen 3.266 N/A LEU 578.A N ASN 576.A OD1 no hydrogen 2.837 N/A LEU 582.A N VAL 607.A O no hydrogen 2.805 N/A GLU 583.A N ASP 636.A OD2 no hydrogen 2.960 N/A THR 586.A N GLU 634.A O no hydrogen 3.030 N/A PHE 587.A N VAL 601.A O no hydrogen 3.337 N/A THR 588.A N ASN 632.A O no hydrogen 2.682 N/A VAL 589.A N LYS 599.A O no hydrogen 3.062 N/A GLU 590.A N VAL 630.A O no hydrogen 3.030 N/A LEU 594.A N GLY 591.A O no hydrogen 2.941 N/A THR 595.A N GLY 591.A O no hydrogen 3.084 N/A THR 595.A OG1 GLU 597.A O no hydrogen 2.713 N/A GLU 597.A N THR 595.A OG1 no hydrogen 3.151 N/A GLN 598.A NE2 GLU 590.A OE2 no hydrogen 2.502 N/A LYS 599.A N VAL 589.A O no hydrogen 3.202 N/A VAL 601.A N PHE 587.A O no hydrogen 3.267 N/A ILE 603.A N CYS 585.A O no hydrogen 2.697 N/A VAL 607.A N LEU 582.A O no hydrogen 2.704 N/A GLU 611.A N GLU 608.A O no hydrogen 2.961 N/A VAL 615.A N VAL 572.A O no hydrogen 3.070 N/A MET 617.A N ALA 570.A O no hydrogen 2.781 N/A LEU 619.A N LEU 568.A O no hydrogen 2.690 N/A LEU 620.A N LEU 594.A O no hydrogen 2.884 N/A HIS 627.A N VAL 647.A O no hydrogen 2.863 N/A HIS 627.A NE2 HIS 623.A O no hydrogen 3.072 N/A LYS 628.A NZ ASN 646.A OD1 no hydrogen 2.939 N/A LEU 629.A N ARG 645.A O no hydrogen 2.963 N/A VAL 630.A N GLU 590.A O no hydrogen 2.897 N/A VAL 631.A N GLY 643.A O no hydrogen 2.868 N/A ASN 632.A N THR 588.A O no hydrogen 2.680 N/A ASN 632.A ND2 GLU 634.A OE2 no hydrogen 2.630 N/A PHE 633.A N VAL 641.A O no hydrogen 2.729 N/A GLU 634.A N THR 586.A O no hydrogen 2.812 N/A SER 635.A OG LEU 638.A O no hydrogen 2.780 N/A ASP 636.A N GLU 583.A O no hydrogen 3.007 N/A LEU 638.A N SER 635.A OG no hydrogen 2.905 N/A LYS 639.A NZ SER 635.A O no hydrogen 2.844 N/A ALA 640.A N GLU 634.A OE1 no hydrogen 2.939 N/A ALA 640.A N GLU 634.A OE2 no hydrogen 3.218 N/A VAL 641.A N PHE 633.A O no hydrogen 3.000 N/A LYS 642.A NZ ASN 632.A OD1 no hydrogen 3.144 N/A GLY 643.A N VAL 631.A O no hydrogen 3.122 N/A ARG 645.A N LEU 629.A O no hydrogen 2.986 N/A VAL 647.A N HIS 627.A O no hydrogen 2.881 N/A ILE 649.A N GLY 625.A O no hydrogen 3.267 N/A GLY 650.A N PRO 562.A O no hydrogen 2.818 N/A