Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hyl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 3.A OE1 no hydrogen 3.472 N/A GLU 3.A N GLU 3.A OE1 no hydrogen 2.695 N/A LEU 5.A N SER 1.A O no hydrogen 3.024 N/A SER 6.A N ILE 2.A O no hydrogen 2.751 N/A ILE 7.A N GLU 3.A O no hydrogen 2.826 N/A ASN 8.A N GLN 4.A O no hydrogen 2.946 N/A ASN 8.A ND2 TYR 267.A O no hydrogen 3.544 N/A THR 9.A N LEU 5.A O no hydrogen 2.959 N/A THR 9.A N SER 6.A O no hydrogen 3.011 N/A THR 9.A OG1 LEU 5.A O no hydrogen 2.760 N/A ILE 10.A N SER 6.A O no hydrogen 3.025 N/A ARG 11.A N ILE 7.A O no hydrogen 3.065 N/A ARG 11.A NH1 ASN 8.A OD1 no hydrogen 3.013 N/A ARG 11.A NH2 ASN 209.A OD1 no hydrogen 2.959 N/A THR 12.A N ASN 8.A O no hydrogen 2.946 N/A LEU 13.A N THR 9.A O no hydrogen 2.724 N/A SER 14.A N ILE 10.A O no hydrogen 3.034 N/A SER 14.A OG ILE 10.A O no hydrogen 2.947 N/A ILE 15.A N ARG 11.A O no hydrogen 3.012 N/A ASP 16.A N THR 12.A O no hydrogen 2.974 N/A ALA 17.A N LEU 13.A O no hydrogen 2.805 N/A ILE 18.A N SER 14.A O no hydrogen 3.050 N/A GLU 19.A N ILE 15.A O no hydrogen 2.938 N/A LYS 20.A N ASP 16.A O no hydrogen 2.926 N/A LYS 20.A NZ LYS 81.A O no hydrogen 2.749 N/A ALA 21.A N ALA 17.A O no hydrogen 2.998 N/A ASN 22.A N GLU 19.A O no hydrogen 3.183 N/A SER 23.A N ILE 18.A O no hydrogen 3.277 N/A ALA 31.A N PRO 28.A O no hydrogen 2.976 N/A TYR 34.A N ALA 31.A O no hydrogen 2.869 N/A THR 35.A N PRO 32.A O no hydrogen 2.960 N/A THR 35.A OG1 PRO 32.A O no hydrogen 2.848 N/A TRP 37.A N ALA 33.A O no hydrogen 2.905 N/A TRP 37.A NE1 SER 72.A OG no hydrogen 2.833 N/A THR 38.A N TYR 34.A O no hydrogen 2.898 N/A THR 38.A OG1 TYR 34.A O no hydrogen 2.776 N/A GLN 39.A N THR 35.A O no hydrogen 2.989 N/A PHE 40.A N LEU 36.A O no hydrogen 3.202 N/A LYS 41.A NZ PHE 40.A O no hydrogen 3.464 N/A HIS 42.A ND1 TYR 74.A OH no hydrogen 2.593 N/A HIS 42.A NE2 TRP 37.A O no hydrogen 3.009 N/A ASN 43.A ND2 GLU 294.A OE2 no hydrogen 3.542 N/A ASN 43.A ND2 GLN 297.A OE1 no hydrogen 2.945 N/A ASN 45.A N ASN 43.A OD1 no hydrogen 3.013 N/A ASN 46.A N ASN 43.A O no hydrogen 2.760 N/A ASN 46.A ND2 GLN 297.A OE1 no hydrogen 3.033 N/A TRP 49.A N ASN 46.A O no hydrogen 3.084 N/A ASN 51.A ND2 ASP 137.A O no hydrogen 3.107 N/A ARG 52.A N TRP 49.A O no hydrogen 3.014 N/A ARG 52.A NE ASP 103.A OD1 no hydrogen 3.261 N/A ARG 52.A NH1 ASP 103.A OD1 no hydrogen 2.973 N/A ARG 52.A NH2 TRP 49.A O no hydrogen 3.000 N/A ASP 53.A N LYS 41.A O no hydrogen 2.805 N/A ARG 54.A N TYR 139.A O no hydrogen 3.110 N/A ARG 54.A NH1 PHE 50.A O no hydrogen 2.768 N/A ARG 54.A NH1 ARG 52.A O no hydrogen 2.943 N/A ARG 54.A NH2 PHE 50.A O no hydrogen 3.171 N/A ARG 54.A NH2 HIS 408.A O no hydrogen 2.888 N/A PHE 55.A N ASP 103.A OD2 no hydrogen 2.744 N/A VAL 56.A N TYR 141.A O no hydrogen 2.877 N/A SER 58.A OG ASP 148.A OD1 no hydrogen 2.839 N/A ALA 59.A N ILE 143.A O no hydrogen 3.293 N/A GLY 60.A N SER 58.A O no hydrogen 2.883 N/A GLY 62.A N ALA 59.A O no hydrogen 3.141 N/A SER 63.A OG GLY 92.A O no hydrogen 2.758 N/A TYR 66.A N SER 63.A O no hydrogen 2.843 N/A TYR 66.A OH PRO 91.A O no hydrogen 2.672 N/A LEU 68.A N LEU 64.A O no hydrogen 3.238 N/A LEU 69.A N LEU 65.A O no hydrogen 2.853 N/A HIS 70.A N TYR 66.A O no hydrogen 2.879 N/A LEU 71.A N SER 67.A O no hydrogen 2.892 N/A SER 72.A N LEU 68.A O no hydrogen 2.980 N/A SER 72.A N LEU 69.A O no hydrogen 3.311 N/A SER 72.A OG LEU 68.A O no hydrogen 2.622 N/A GLY 73.A N HIS 70.A O no hydrogen 3.173 N/A TYR 74.A N LEU 69.A O no hydrogen 2.956 N/A TYR 74.A OH HIS 42.A ND1 no hydrogen 2.593 N/A VAL 76.A N TYR 74.A O no hydrogen 2.658 N/A THR 77.A N ASP 79.A OD2 no hydrogen 2.795 N/A ASP 79.A N THR 77.A OG1 no hydrogen 2.954 N/A LEU 80.A N THR 77.A O no hydrogen 3.114 N/A ASN 82.A N ASP 79.A O no hydrogen 2.827 N/A PHE 83.A N LEU 80.A O no hydrogen 3.332 N/A ARG 84.A N THR 90.A O no hydrogen 2.791 N/A ARG 84.A NE SER 23.A OG no hydrogen 3.135 N/A ARG 84.A NH2 SER 23.A OG no hydrogen 2.896 N/A GLN 85.A N ASN 82.A O no hydrogen 2.998 N/A GLN 85.A NE2 PHE 83.A O no hydrogen 3.103 N/A SER 88.A N GLN 85.A O no hydrogen 2.764 N/A SER 88.A OG ASN 82.A O no hydrogen 2.238 N/A SER 88.A OG THR 90.A OG1 no hydrogen 2.964 N/A THR 90.A OG1 ASP 79.A O no hydrogen 2.798 N/A THR 90.A OG1 SER 88.A OG no hydrogen 2.964 N/A TYR 96.A N THR 105.A OG1 no hydrogen 2.777 N/A HIS 98.A N GLU 95.A O no hydrogen 3.033 N/A THR 99.A OG1 LYS 89.A O no hydrogen 2.670 N/A VAL 102.A N THR 99.A O no hydrogen 3.074 N/A THR 106.A OG1 LEU 57.A O no hydrogen 2.673 N/A GLY 110.A N ASP 148.A OD1 no hydrogen 2.633 N/A GLN 111.A NE2 PRO 427.A O no hydrogen 3.289 N/A ILE 113.A N GLY 110.A O no hydrogen 3.287 N/A THR 115.A N GLN 111.A O no hydrogen 2.783 N/A THR 115.A OG1 GLN 111.A O no hydrogen 2.870 N/A ALA 116.A N GLY 112.A O no hydrogen 2.943 N/A VAL 117.A N ILE 113.A O no hydrogen 3.066 N/A GLY 118.A N ALA 114.A O no hydrogen 3.170 N/A ARG 122.A N ALA 119.A O no hydrogen 3.132 N/A ARG 122.A NE GLU 121.A OE1 no hydrogen 2.727 N/A ARG 122.A NH2 GLU 121.A OE2 no hydrogen 2.963 N/A HIS 123.A ND1 TYR 386.A O no hydrogen 2.823 N/A LEU 124.A N ALA 120.A O no hydrogen 2.852 N/A ALA 125.A N GLU 121.A O no hydrogen 2.968 N/A ALA 126.A N ARG 122.A O no hydrogen 3.050 N/A LYS 127.A N HIS 123.A O no hydrogen 3.066 N/A TYR 128.A N LEU 124.A O no hydrogen 2.816 N/A TYR 128.A OH GLU 316.A OE2 no hydrogen 2.620 N/A ASN 129.A N ALA 125.A O no hydrogen 2.764 N/A ASN 129.A ND2 VAL 136.A O no hydrogen 2.711 N/A ARG 130.A N TYR 133.A O no hydrogen 3.226 N/A ARG 130.A NH1 LYS 127.A O no hydrogen 3.044 N/A ARG 130.A NH1 ASN 129.A O no hydrogen 3.452 N/A ASN 134.A N ALA 132.A O no hydrogen 3.085 N/A ASN 134.A ND2 ASP 137.A OD2 no hydrogen 3.301 N/A VAL 136.A N ASN 129.A OD1 no hydrogen 2.839 N/A ASP 137.A N ASN 51.A OD1 no hydrogen 2.838 N/A HIS 138.A N GLU 121.A OE2 no hydrogen 2.869 N/A HIS 138.A ND1 TYR 139.A O no hydrogen 2.790 N/A HIS 138.A NE2 HIS 408.A NE2 no hydrogen 2.781 N/A TYR 139.A N ASP 53.A OD1 no hydrogen 2.714 N/A TYR 139.A OH LYS 222.A O no hydrogen 3.234 N/A THR 140.A N ARG 167.A O no hydrogen 2.940 N/A TYR 141.A N ARG 54.A O no hydrogen 2.894 N/A ALA 142.A N VAL 169.A O no hydrogen 3.139 N/A ILE 143.A N VAL 56.A O no hydrogen 3.066 N/A CYS 144.A N LEU 171.A O no hydrogen 2.956 N/A CYS 144.A SG GLY 145.A O no hydrogen 3.931 N/A GLY 145.A N ASP 148.A OD2 no hydrogen 2.973 N/A LEU 149.A N ASP 146.A O no hydrogen 2.868 N/A SER 153.A N GLU 150.A O no hydrogen 3.178 N/A SER 153.A OG ASP 148.A O no hydrogen 2.864 N/A SER 153.A OG GLU 150.A O no hydrogen 3.219 N/A ALA 154.A N GLU 150.A O no hydrogen 3.493 N/A GLU 155.A N GLY 151.A O no hydrogen 2.814 N/A ALA 156.A N VAL 152.A O no hydrogen 3.053 N/A SER 157.A N SER 153.A O no hydrogen 2.860 N/A SER 157.A OG SER 153.A O no hydrogen 2.715 N/A SER 157.A OG TYR 195.A OH no hydrogen 2.835 N/A SER 158.A N ALA 154.A O no hydrogen 3.076 N/A LEU 159.A N GLU 155.A O no hydrogen 3.032 N/A ALA 160.A N ALA 156.A O no hydrogen 2.850 N/A ALA 161.A N SER 157.A O no hydrogen 3.002 N/A HIS 162.A N SER 158.A O no hydrogen 3.080 N/A LEU 163.A N LEU 159.A O no hydrogen 3.018 N/A GLN 164.A N ALA 161.A O no hydrogen 2.872 N/A LEU 165.A N ALA 160.A O no hydrogen 3.149 N/A GLY 166.A N GLN 164.A O no hydrogen 2.914 N/A ARG 167.A NH1 ASP 137.A OD1 no hydrogen 2.466 N/A ARG 167.A NH1 HIS 138.A O no hydrogen 3.264 N/A ARG 167.A NH2 ASP 137.A OD1 no hydrogen 2.850 N/A LEU 168.A N LEU 165.A O no hydrogen 3.081 N/A VAL 169.A N THR 140.A O no hydrogen 2.844 N/A VAL 170.A N THR 229.A O no hydrogen 2.794 N/A LEU 171.A N ALA 142.A O no hydrogen 2.782 N/A TYR 172.A N ILE 231.A O no hydrogen 2.887 N/A TYR 172.A OH ASP 146.A OD1 no hydrogen 2.702 N/A ASP 173.A N CYS 144.A O no hydrogen 2.803 N/A SER 174.A N VAL 233.A O no hydrogen 2.934 N/A SER 174.A OG GLU 232.A OE2 no hydrogen 2.662 N/A ILE 177.A N ASN 175.A OD1 no hydrogen 3.130 N/A SER 178.A N GLY 181.A O no hydrogen 2.901 N/A SER 178.A OG GLY 181.A O no hydrogen 3.446 N/A LEU 183.A N ASP 176.A O no hydrogen 2.792 N/A ARG 185.A N ASP 182.A O no hydrogen 3.029 N/A SER 186.A N LEU 183.A O no hydrogen 2.839 N/A SER 186.A OG LEU 183.A O no hydrogen 3.227 N/A ASP 193.A N SER 190.A OG no hydrogen 3.135 N/A ARG 194.A N SER 190.A O no hydrogen 3.025 N/A ARG 194.A NE GLU 189.A OE1 no hydrogen 2.812 N/A ARG 194.A NH1 TYR 198.A OH no hydrogen 2.758 N/A ARG 194.A NH2 GLU 189.A OE1 no hydrogen 3.117 N/A TYR 195.A N VAL 191.A O no hydrogen 2.919 N/A TYR 195.A OH SER 157.A OG no hydrogen 2.835 N/A LYS 196.A N GLU 192.A O no hydrogen 2.926 N/A ALA 197.A N ASP 193.A O no hydrogen 2.928 N/A TYR 198.A N ARG 194.A O no hydrogen 2.905 N/A GLY 199.A N TYR 195.A O no hydrogen 3.064 N/A TRP 200.A N TYR 195.A O no hydrogen 2.814 N/A TRP 200.A NE1 SER 157.A O no hydrogen 2.876 N/A GLN 201.A N PRO 228.A O no hydrogen 2.967 N/A ILE 203.A N LEU 230.A O no hydrogen 2.897 N/A ARG 204.A NH1 GLU 206.A OE1 no hydrogen 2.740 N/A VAL 205.A N GLU 232.A O no hydrogen 2.834 N/A GLY 208.A N ARG 234.A O no hydrogen 2.754 N/A ASN 209.A N ASP 207.A OD2 no hydrogen 3.266 N/A ASP 210.A N ASP 207.A O no hydrogen 2.683 N/A ALA 213.A N ASP 210.A OD2 no hydrogen 2.927 N/A ILE 214.A N ASP 210.A O no hydrogen 3.145 N/A ALA 215.A N ILE 211.A O no hydrogen 2.877 N/A LYS 216.A N GLU 212.A O no hydrogen 2.979 N/A ALA 217.A N ALA 213.A O no hydrogen 2.873 N/A ILE 218.A N ILE 214.A O no hydrogen 3.049 N/A GLU 219.A N ALA 215.A O no hydrogen 3.087 N/A GLU 220.A N LYS 216.A O no hydrogen 2.921 N/A ALA 221.A N ALA 217.A O no hydrogen 2.694 N/A LYS 222.A N ILE 218.A O no hydrogen 2.868 N/A ALA 223.A N GLU 219.A O no hydrogen 3.156 N/A ALA 223.A N GLU 220.A O no hydrogen 3.208 N/A ASP 224.A N GLU 220.A O no hydrogen 3.331 N/A LYS 226.A N ASP 224.A OD1 no hydrogen 2.950 N/A ARG 227.A N ASP 224.A OD1 no hydrogen 3.422 N/A THR 229.A N LEU 168.A O no hydrogen 3.122 N/A THR 229.A OG1 GLN 201.A OE1 no hydrogen 2.770 N/A THR 229.A OG1 ALA 221.A O no hydrogen 3.411 N/A LEU 230.A N GLN 201.A O no hydrogen 2.800 N/A ILE 231.A N VAL 170.A O no hydrogen 2.880 N/A GLU 232.A N ILE 203.A O no hydrogen 2.925 N/A VAL 233.A N TYR 172.A O no hydrogen 2.797 N/A ARG 234.A N VAL 205.A O no hydrogen 2.869 N/A ARG 234.A NH1 SER 174.A OG no hydrogen 2.886 N/A ARG 234.A NH1 ASP 176.A OD1 no hydrogen 3.001 N/A ARG 234.A NH2 ASP 176.A OD1 no hydrogen 3.205 N/A ARG 234.A NH2 ASP 176.A OD2 no hydrogen 2.854 N/A THR 235.A N SER 174.A O no hydrogen 3.144 N/A THR 235.A OG1 ASP 173.A OD1 no hydrogen 2.491 N/A GLY 238.A N GLY 27.A O no hydrogen 2.838 N/A SER 241.A N GLY 238.A O no hydrogen 3.066 N/A SER 241.A OG GLU 259.A OE2 no hydrogen 2.494 N/A ASN 243.A N GLU 259.A OE1 no hydrogen 3.304 N/A LYS 244.A N SER 241.A OG no hydrogen 3.339 N/A LYS 244.A NZ LEU 255.A O no hydrogen 3.407 N/A SER 245.A N SER 241.A O no hydrogen 2.796 N/A SER 245.A OG SER 241.A O no hydrogen 2.892 N/A LYS 247.A N SER 245.A O no hydrogen 2.515 N/A SER 250.A N LYS 247.A O no hydrogen 3.192 N/A SER 250.A OG LYS 247.A O no hydrogen 2.765 N/A HIS 251.A N SER 248.A O no hydrogen 2.929 N/A GLY 256.A N GLU 19.A OE2 no hydrogen 2.777 N/A THR 260.A N GLY 256.A O no hydrogen 2.722 N/A THR 260.A OG1 GLY 256.A O no hydrogen 2.597 N/A LYS 261.A N VAL 257.A O no hydrogen 3.218 N/A LEU 262.A N GLU 258.A O no hydrogen 3.229 N/A THR 263.A N GLU 259.A O no hydrogen 2.916 N/A THR 263.A OG1 GLU 259.A O no hydrogen 2.736 N/A LYS 264.A N THR 260.A O no hydrogen 2.870 N/A LYS 264.A NZ ASP 16.A OD1 no hydrogen 2.809 N/A LYS 264.A NZ ASP 16.A OD2 no hydrogen 3.173 N/A GLU 265.A N LYS 261.A O no hydrogen 3.009 N/A ALA 266.A N LEU 262.A O no hydrogen 3.071 N/A TYR 267.A N THR 263.A O no hydrogen 3.045 N/A TYR 267.A N LYS 264.A O no hydrogen 2.983 N/A TYR 267.A OH PHE 239.A O no hydrogen 2.619 N/A ALA 268.A N GLU 265.A O no hydrogen 2.662 N/A TRP 269.A N LYS 264.A O no hydrogen 2.943 N/A PHE 275.A N ASP 16.A OD2 no hydrogen 2.918 N/A VAL 281.A N ALA 278.A O no hydrogen 3.039 N/A TYR 282.A N ALA 278.A O no hydrogen 3.281 N/A GLU 283.A N GLU 279.A O no hydrogen 2.981 N/A ASN 284.A N GLU 280.A O no hydrogen 2.971 N/A ASN 284.A ND2 SER 6.A OG no hydrogen 2.845 N/A ASN 284.A ND2 TYR 34.A OH no hydrogen 2.837 N/A PHE 285.A N VAL 281.A O no hydrogen 3.187 N/A PHE 285.A N TYR 282.A O no hydrogen 3.018 N/A ARG 286.A N TYR 282.A O no hydrogen 2.964 N/A LYS 287.A N GLU 283.A O no hydrogen 2.888 N/A THR 288.A N ASN 284.A O no hydrogen 2.865 N/A THR 288.A OG1 ASN 284.A O no hydrogen 2.758 N/A VAL 289.A N PHE 285.A O no hydrogen 2.606 N/A GLN 290.A N PHE 285.A O no hydrogen 3.132 N/A ASP 291.A N ARG 286.A O no hydrogen 2.747 N/A GLY 293.A N VAL 289.A O no hydrogen 2.873 N/A GLU 294.A N GLN 290.A O no hydrogen 2.985 N/A THR 295.A N ASP 291.A O no hydrogen 3.129 N/A THR 295.A OG1 ASP 291.A O no hydrogen 3.065 N/A ALA 296.A N VAL 292.A O no hydrogen 3.015 N/A GLN 297.A N GLY 293.A O no hydrogen 2.734 N/A ALA 298.A N GLU 294.A O no hydrogen 3.028 N/A GLU 299.A N THR 295.A O no hydrogen 3.106 N/A TRP 300.A N ALA 296.A O no hydrogen 3.107 N/A TRP 300.A NE1 ILE 135.A O no hydrogen 2.824 N/A ASN 301.A N GLN 297.A O no hydrogen 2.880 N/A THR 302.A N ALA 298.A O no hydrogen 3.032 N/A THR 302.A OG1 ALA 298.A O no hydrogen 3.232 N/A GLY 304.A N ASN 301.A O no hydrogen 3.093 N/A GLU 305.A N THR 302.A O no hydrogen 3.214 N/A TYR 306.A OH TYR 128.A O no hydrogen 2.698 N/A ALA 307.A N LEU 303.A O no hydrogen 2.834 N/A GLN 308.A N GLY 304.A O no hydrogen 3.429 N/A GLN 308.A N GLN 308.A OE1 no hydrogen 3.165 N/A ALA 309.A N GLU 305.A O no hydrogen 3.085 N/A TYR 310.A N TYR 306.A O no hydrogen 2.774 N/A TYR 310.A N ALA 307.A O no hydrogen 3.145 N/A ALA 314.A N TYR 310.A O no hydrogen 2.843 N/A ASN 315.A N PRO 311.A O no hydrogen 2.967 N/A ASN 315.A ND2 PRO 311.A O no hydrogen 3.665 N/A GLU 316.A N GLU 312.A O no hydrogen 2.896 N/A LEU 317.A N LEU 313.A O no hydrogen 3.072 N/A GLN 318.A N ALA 314.A O no hydrogen 3.073 N/A ALA 319.A N ASN 315.A O no hydrogen 3.092 N/A ALA 320.A N GLU 316.A O no hydrogen 2.942 N/A ASN 321.A ND2 GLN 318.A O no hydrogen 3.065 N/A GLY 322.A N ALA 320.A O no hydrogen 2.991 N/A LEU 323.A N ALA 319.A O no hydrogen 2.939 N/A TRP 328.A N PRO 325.A O no hydrogen 3.107 N/A GLN 330.A N GLY 327.A O no hydrogen 2.997 N/A GLN 330.A NE2 GLY 327.A O no hydrogen 3.255 N/A LEU 332.A N GLU 329.A O no hydrogen 3.215 N/A SER 339.A N GLU 336.A O no hydrogen 2.925 N/A SER 339.A OG GLU 336.A O no hydrogen 2.607 N/A SER 339.A OG THR 507.A OG1 no hydrogen 2.720 N/A ALA 341.A N LEU 505.A O no hydrogen 2.888 N/A THR 343.A N THR 501.A OG1 no hydrogen 3.024 N/A ARG 344.A N THR 501.A O no hydrogen 3.120 N/A ARG 344.A NH1 SER 371.A O no hydrogen 2.955 N/A ASN 345.A N ALA 342.A O no hydrogen 2.839 N/A SER 346.A N ALA 342.A O no hydrogen 3.039 N/A SER 346.A OG GLY 478.A O no hydrogen 3.162 N/A SER 346.A OG SER 481.A OG no hydrogen 2.775 N/A SER 347.A N THR 343.A O no hydrogen 2.950 N/A GLY 348.A N ARG 344.A O no hydrogen 3.012 N/A ALA 349.A N ASN 345.A O no hydrogen 2.935 N/A VAL 350.A N SER 346.A O no hydrogen 3.102 N/A ILE 351.A N SER 347.A O no hydrogen 2.805 N/A ASN 352.A N GLY 348.A O no hydrogen 2.960 N/A ASN 352.A ND2 GLY 348.A O no hydrogen 2.795 N/A ASN 352.A ND2 TYR 375.A O no hydrogen 3.311 N/A ALA 353.A N ALA 349.A O no hydrogen 2.995 N/A ILE 354.A N VAL 350.A O no hydrogen 2.713 N/A ALA 355.A N ILE 351.A O no hydrogen 2.895 N/A GLU 356.A N ASN 352.A O no hydrogen 3.335 N/A SER 357.A N ALA 353.A O no hydrogen 3.201 N/A SER 357.A N ILE 354.A O no hydrogen 2.972 N/A SER 357.A OG TRP 328.A O no hydrogen 3.343 N/A SER 357.A OG ALA 353.A O no hydrogen 3.129 N/A VAL 358.A N ILE 354.A O no hydrogen 2.788 N/A PHE 361.A N VAL 358.A O no hydrogen 3.345 N/A PHE 362.A N LYS 412.A O no hydrogen 3.049 N/A GLY 363.A N LYS 389.A O no hydrogen 3.303 N/A GLY 364.A N TYR 414.A O no hydrogen 3.289 N/A SER 365.A N ILE 391.A O no hydrogen 3.385 N/A SER 365.A OG GLY 416.A O no hydrogen 3.304 N/A ALA 366.A N GLY 416.A O no hydrogen 2.932 N/A LEU 368.A N SER 365.A OG no hydrogen 3.160 N/A ASN 372.A N LEU 368.A O no hydrogen 2.596 N/A ASN 372.A ND2 SER 365.A OG no hydrogen 2.582 N/A LYS 373.A N ALA 369.A O no hydrogen 2.902 N/A TYR 375.A OH ASP 380.A OD1 no hydrogen 2.582 N/A PHE 381.A N ASN 390.A O no hydrogen 2.795 N/A THR 382.A N ASP 385.A O no hydrogen 3.395 N/A ARG 383.A NH1 HIS 162.A O no hydrogen 3.019 N/A ASP 385.A N THR 382.A O no hydrogen 2.985 N/A TYR 386.A OH LEU 163.A O no hydrogen 2.593 N/A SER 387.A N ASP 385.A OD1 no hydrogen 3.129 N/A SER 387.A OG ASP 385.A OD1 no hydrogen 2.481 N/A SER 387.A OG ASP 385.A OD2 no hydrogen 3.456 N/A GLY 388.A N ASP 385.A O no hydrogen 3.035 N/A LYS 389.A N LYS 379.A O no hydrogen 2.970 N/A LYS 389.A NZ PRO 359.A O no hydrogen 2.793 N/A LYS 389.A NZ PHE 361.A O no hydrogen 3.525 N/A ASN 390.A N LYS 379.A O no hydrogen 3.039 N/A ASN 390.A ND2 LYS 379.A O no hydrogen 3.118 N/A ILE 391.A N GLY 363.A O no hydrogen 2.945 N/A TRP 392.A NE1 ASP 380.A OD1 no hydrogen 3.073 N/A TYR 393.A N SER 365.A O no hydrogen 3.141 N/A ARG 396.A N GLY 394.A O no hydrogen 2.791 N/A ARG 396.A NH1 TYR 393.A O no hydrogen 2.665 N/A ARG 396.A NH2 SER 158.A OG no hydrogen 3.068 N/A ALA 399.A N GLU 155.A OE1 no hydrogen 2.895 N/A ALA 401.A N PHE 398.A O no hydrogen 2.940 N/A ALA 402.A N ALA 399.A O no hydrogen 2.715 N/A ASN 403.A ND2 ALA 428.A O no hydrogen 3.033 N/A GLY 404.A N ALA 401.A O no hydrogen 3.184 N/A ILE 405.A N ALA 402.A O no hydrogen 2.804 N/A LEU 407.A N ASN 403.A O no hydrogen 2.956 N/A HIS 408.A N GLY 404.A O no hydrogen 3.069 N/A HIS 408.A ND1 GLY 409.A O no hydrogen 3.136 N/A HIS 408.A NE2 HIS 138.A NE2 no hydrogen 2.781 N/A LYS 412.A N SER 360.A O no hydrogen 2.914 N/A LYS 412.A NZ LEU 489.A O no hydrogen 2.810 N/A TYR 414.A OH THR 374.A O no hydrogen 2.627 N/A GLY 415.A N THR 439.A O no hydrogen 3.025 N/A GLY 416.A N GLY 364.A O no hydrogen 2.916 N/A THR 417.A N VAL 441.A O no hydrogen 3.108 N/A PHE 419.A N THR 443.A O no hydrogen 2.780 N/A PHE 421.A N PHE 418.A O no hydrogen 2.809 N/A SER 422.A N PHE 419.A O no hydrogen 2.989 N/A SER 422.A OG PHE 419.A O no hydrogen 2.732 N/A TYR 424.A N PHE 421.A O no hydrogen 2.922 N/A LEU 425.A N SER 422.A O no hydrogen 3.136 N/A ARG 426.A N ASP 423.A O no hydrogen 3.378 N/A ARG 426.A NH1 ALA 464.A O no hydrogen 3.040 N/A ARG 426.A NH2 ALA 464.A O no hydrogen 2.730 N/A ALA 428.A N LEU 425.A O no hydrogen 2.901 N/A ILE 429.A N LEU 425.A O no hydrogen 3.148 N/A ARG 430.A N ARG 426.A O no hydrogen 3.028 N/A LEU 431.A N PRO 427.A O no hydrogen 3.227 N/A ALA 432.A N ALA 428.A O no hydrogen 2.902 N/A ALA 433.A N ILE 429.A O no hydrogen 2.772 N/A LEU 434.A N ARG 430.A O no hydrogen 2.903 N/A LEU 436.A N ALA 432.A O no hydrogen 2.928 N/A VAL 438.A N LEU 436.A O no hydrogen 2.818 N/A THR 439.A N THR 413.A O no hydrogen 3.188 N/A TYR 440.A N THR 496.A O no hydrogen 2.835 N/A VAL 441.A N GLY 415.A O no hydrogen 2.803 N/A PHE 442.A N LEU 498.A O no hydrogen 2.932 N/A THR 443.A N THR 417.A O no hydrogen 3.269 N/A THR 443.A OG1 ASN 372.A OD1 no hydrogen 3.103 N/A THR 443.A OG1 HIS 444.A ND1 no hydrogen 2.635 N/A HIS 444.A ND1 THR 443.A OG1 no hydrogen 2.635 N/A ALA 448.A N SER 446.A OG no hydrogen 2.968 N/A VAL 449.A N SER 446.A O no hydrogen 2.996 N/A GLY 450.A N ILE 447.A O no hydrogen 2.983 N/A GLU 451.A N GLU 451.A OE1 no hydrogen 2.561 N/A GLY 453.A N GLY 450.A O no hydrogen 3.224 N/A THR 455.A OG1 HIS 456.A ND1 no hydrogen 2.965 N/A HIS 456.A N GLY 453.A O no hydrogen 2.896 N/A HIS 456.A ND1 THR 455.A OG1 no hydrogen 2.965 N/A GLU 457.A N PRO 454.A O no hydrogen 3.384 N/A GLU 460.A N GLU 460.A OE1 no hydrogen 2.561 N/A ALA 464.A N GLU 460.A O no hydrogen 3.053 N/A LEU 465.A N LEU 462.A O no hydrogen 3.193 N/A ARG 466.A N LEU 462.A O no hydrogen 2.882 N/A ARG 466.A NH1 GLU 594.A OE1 no hydrogen 2.831 N/A ARG 466.A NH1 GLU 594.A OE2 no hydrogen 3.440 N/A ARG 466.A NH2 GLU 594.A OE2 no hydrogen 2.903 N/A ALA 467.A N ALA 463.A O no hydrogen 3.032 N/A SER 471.A N PRO 495.A O no hydrogen 2.883 N/A SER 471.A OG ASP 569.A OD1 no hydrogen 2.723 N/A VAL 472.A N ASP 569.A OD2 no hydrogen 2.918 N/A ILE 473.A N ALA 497.A O no hydrogen 2.901 N/A ARG 474.A N PRO 567.A O no hydrogen 2.690 N/A ARG 474.A NE ASP 445.A OD2 no hydrogen 2.882 N/A ARG 474.A NH1 THR 541.A OG1 no hydrogen 2.675 N/A ARG 474.A NH1 GLU 544.A OE1 no hydrogen 2.972 N/A ARG 474.A NH2 ASP 445.A OD2 no hydrogen 2.984 N/A ARG 474.A NH2 GLU 544.A OE1 no hydrogen 3.009 N/A ALA 476.A N GLU 480.A OE1 no hydrogen 2.811 N/A GLU 480.A N ASP 477.A OD1 no hydrogen 2.772 N/A SER 481.A N ASP 477.A O no hydrogen 2.954 N/A SER 481.A N GLY 478.A O no hydrogen 2.994 N/A SER 481.A OG SER 346.A OG no hydrogen 2.775 N/A SER 481.A OG GLY 478.A O no hydrogen 2.821 N/A VAL 482.A N GLY 478.A O no hydrogen 3.032 N/A ALA 483.A N ASN 479.A O no hydrogen 3.087 N/A ALA 484.A N GLU 480.A O no hydrogen 2.884 N/A TRP 485.A N SER 481.A O no hydrogen 3.039 N/A TRP 485.A NE1 SER 347.A OG no hydrogen 3.001 N/A ARG 486.A N VAL 482.A O no hydrogen 3.068 N/A LEU 487.A N ALA 483.A O no hydrogen 2.924 N/A ALA 488.A N ALA 484.A O no hydrogen 2.937 N/A LEU 489.A N TRP 485.A O no hydrogen 2.997 N/A GLU 490.A N ARG 486.A O no hydrogen 2.917 N/A SER 491.A N ALA 488.A O no hydrogen 3.276 N/A SER 491.A OG LYS 494.A O no hydrogen 2.583 N/A LYS 494.A N SER 491.A OG no hydrogen 3.331 N/A THR 496.A N VAL 438.A O no hydrogen 2.982 N/A ALA 497.A N SER 471.A O no hydrogen 2.724 N/A LEU 498.A N TYR 440.A O no hydrogen 2.895 N/A VAL 499.A N ILE 473.A O no hydrogen 2.906 N/A LEU 500.A N PHE 442.A O no hydrogen 2.823 N/A THR 501.A N THR 343.A OG1 no hydrogen 2.784 N/A THR 501.A OG1 GLN 503.A O no hydrogen 2.644 N/A GLN 503.A N GLN 503.A OE1 no hydrogen 2.656 N/A LEU 505.A N ALA 341.A O no hydrogen 2.866 N/A THR 507.A N SER 339.A O no hydrogen 2.798 N/A THR 507.A OG1 SER 339.A O no hydrogen 3.195 N/A THR 507.A OG1 SER 339.A OG no hydrogen 2.720 N/A LEU 508.A N ASP 477.A OD2 no hydrogen 2.740 N/A ALA 511.A N LEU 508.A O no hydrogen 3.449 N/A LYS 512.A N GLU 509.A O no hydrogen 3.224 N/A THR 515.A OG1 ALA 511.A O no hydrogen 2.768 N/A THR 515.A OG1 LYS 512.A O no hydrogen 3.219 N/A TYR 516.A OH GLU 490.A OE1 no hydrogen 2.751 N/A LYS 518.A N ASP 514.A O no hydrogen 3.008 N/A LYS 518.A NZ GLY 510.A O no hydrogen 3.013 N/A LYS 518.A NZ ASP 513.A O no hydrogen 2.796 N/A VAL 519.A N THR 515.A O no hydrogen 2.720 N/A ALA 520.A N TYR 516.A O no hydrogen 2.865 N/A LYS 521.A N GLU 517.A O no hydrogen 3.344 N/A LYS 521.A N LYS 518.A O no hydrogen 3.106 N/A GLY 522.A N VAL 519.A O no hydrogen 2.842 N/A TYR 524.A N SER 566.A O no hydrogen 3.036 N/A TYR 524.A OH GLU 480.A OE2 no hydrogen 2.642 N/A VAL 526.A N VAL 564.A O no hydrogen 2.757 N/A SER 527.A N VAL 564.A O no hydrogen 3.207 N/A SER 527.A OG GLN 552.A OE1 no hydrogen 2.750 N/A SER 529.A OG LYS 531.A O no hydrogen 2.841 N/A LYS 530.A N ASP 561.A OD1 no hydrogen 2.861 N/A LYS 530.A N ASP 561.A OD2 no hydrogen 3.217 N/A LYS 531.A N ASP 561.A OD2 no hydrogen 3.178 N/A ASP 535.A N ASP 561.A O no hydrogen 2.613 N/A VAL 536.A N ASP 561.A O no hydrogen 3.394 N/A ILE 537.A N LYS 589.A O no hydrogen 2.993 N/A LEU 538.A N SER 563.A O no hydrogen 2.771 N/A LEU 539.A N PHE 591.A O no hydrogen 2.946 N/A ALA 540.A N VAL 565.A O no hydrogen 3.049 N/A THR 541.A OG1 GLU 594.A OE2 no hydrogen 2.477 N/A SER 543.A OG GLU 544.A OE1 no hydrogen 3.309 N/A SER 543.A OG GLU 544.A OE2 no hydrogen 2.617 N/A GLU 544.A N THR 541.A O no hydrogen 2.867 N/A VAL 545.A N GLY 542.A O no hydrogen 3.244 N/A SER 546.A OG SER 543.A O no hydrogen 3.337 N/A ALA 548.A N GLU 544.A O no hydrogen 2.868 N/A VAL 549.A N VAL 545.A O no hydrogen 2.931 N/A GLU 550.A N SER 546.A O no hydrogen 3.019 N/A ALA 551.A N LEU 547.A O no hydrogen 2.933 N/A GLN 552.A N ALA 548.A O no hydrogen 3.069 N/A GLN 552.A N VAL 549.A O no hydrogen 3.183 N/A GLN 552.A NE2 SER 527.A O no hydrogen 3.220 N/A GLN 552.A NE2 ALA 528.A O no hydrogen 3.588 N/A GLN 552.A NE2 ALA 562.A O no hydrogen 2.604 N/A LYS 553.A N VAL 549.A O no hydrogen 3.330 N/A ALA 554.A N GLU 550.A O no hydrogen 2.976 N/A LEU 555.A N ALA 551.A O no hydrogen 2.887 N/A ALA 556.A N GLN 552.A O no hydrogen 3.056 N/A VAL 557.A N LYS 553.A O no hydrogen 3.159 N/A ASP 558.A N LEU 555.A O no hydrogen 2.978 N/A GLY 559.A N ALA 556.A O no hydrogen 2.951 N/A VAL 560.A N LEU 555.A O no hydrogen 2.900 N/A ASP 561.A N ASP 535.A OD2 no hydrogen 2.651 N/A SER 563.A N VAL 536.A O no hydrogen 2.911 N/A VAL 564.A N SER 527.A O no hydrogen 2.788 N/A VAL 565.A N LEU 538.A O no hydrogen 2.791 N/A SER 566.A N TYR 524.A O no hydrogen 2.825 N/A SER 566.A OG GLU 480.A OE2 no hydrogen 2.849 N/A SER 568.A N GLY 522.A O no hydrogen 3.074 N/A SER 568.A OG VAL 472.A O no hydrogen 3.179 N/A SER 568.A OG ASP 569.A OD2 no hydrogen 2.817 N/A ARG 570.A N SER 568.A OG no hydrogen 3.192 N/A ARG 570.A NE ALA 520.A O no hydrogen 2.867 N/A ARG 570.A NH2 ALA 520.A O no hydrogen 3.298 N/A PHE 571.A N SER 568.A O no hydrogen 3.121 N/A ALA 573.A N ARG 570.A O no hydrogen 3.111 N/A GLN 574.A N PHE 571.A O no hydrogen 3.023 N/A GLN 574.A NE2 ARG 570.A O no hydrogen 2.972 N/A TYR 578.A N THR 575.A OG1 no hydrogen 2.877 N/A TYR 578.A OH ALA 523.A O no hydrogen 2.718 N/A LYS 579.A N THR 575.A O no hydrogen 2.879 N/A LYS 579.A NZ GLU 572.A O no hydrogen 3.285 N/A LYS 579.A NZ GLU 572.A OE1 no hydrogen 3.529 N/A GLU 580.A N ALA 576.A O no hydrogen 3.017 N/A SER 581.A N GLU 577.A O no hydrogen 3.140 N/A SER 581.A N TYR 578.A O no hydrogen 2.950 N/A SER 581.A OG TYR 578.A O no hydrogen 2.864 N/A VAL 582.A N LYS 579.A O no hydrogen 2.683 N/A LEU 583.A N LYS 579.A O no hydrogen 2.705 N/A LYS 585.A N GLU 580.A OE1 no hydrogen 2.905 N/A VAL 587.A N PRO 584.A O no hydrogen 2.754 N/A LYS 589.A NZ GLU 607.A OE1 no hydrogen 3.182 N/A ARG 590.A NE VAL 587.A O no hydrogen 2.612 N/A ARG 590.A NH1 TYR 603.A O no hydrogen 3.021 N/A ARG 590.A NH2 PRO 584.A O no hydrogen 3.017 N/A ARG 590.A NH2 VAL 587.A O no hydrogen 3.371 N/A PHE 591.A N ILE 537.A O no hydrogen 2.830 N/A ALA 592.A N ASP 609.A O no hydrogen 3.149 N/A ILE 593.A N LEU 539.A O no hydrogen 2.746 N/A GLU 594.A N LEU 611.A O no hydrogen 3.019 N/A ALA 596.A N ILE 459.A O no hydrogen 2.959 N/A THR 597.A N ASP 614.A OD1 no hydrogen 3.094 N/A THR 597.A OG1 ASP 614.A OD1 no hydrogen 3.518 N/A THR 597.A OG1 ASP 614.A OD2 no hydrogen 2.543 N/A TRP 600.A N THR 597.A O no hydrogen 2.987 N/A TRP 600.A NE1 GLU 594.A OE1 no hydrogen 2.943 N/A ARG 602.A NH2 GLU 572.A OE1 no hydrogen 3.155 N/A TYR 603.A N TRP 600.A O no hydrogen 2.970 N/A TYR 603.A OH GLU 572.A OE2 no hydrogen 2.724 N/A VAL 604.A N TRP 600.A O no hydrogen 2.855 N/A GLY 605.A N HIS 601.A O no hydrogen 2.788 N/A ASP 609.A N ARG 590.A O no hydrogen 3.110 N/A LEU 611.A N ALA 592.A O no hydrogen 2.818 N/A ILE 613.A N GLY 595.A O no hydrogen 2.765 N/A THR 615.A OG1 PHE 616.A O no hydrogen 3.008 N/A ALA 618.A N GLU 457.A OE1 no hydrogen 2.982 N/A SER 619.A OG GLU 451.A O no hydrogen 2.563 N/A ALA 620.A N GLY 450.A O no hydrogen 3.481 N/A LYS 624.A NZ GLU 627.A OE2 no hydrogen 2.684 N/A ILE 625.A N PRO 621.A O no hydrogen 3.264 N/A GLU 627.A N LYS 624.A O no hydrogen 2.872 N/A TYR 628.A N ILE 625.A O no hydrogen 2.732 N/A TYR 628.A OH PHE 616.A O no hydrogen 2.764 N/A GLY 629.A N GLU 626.A O no hydrogen 3.028 N/A THR 631.A N GLY 629.A O no hydrogen 2.964 N/A ASN 634.A N THR 631.A OG1 no hydrogen 2.972 N/A ASN 634.A ND2 GLY 629.A O no hydrogen 2.827 N/A VAL 635.A N THR 631.A O no hydrogen 3.035 N/A VAL 636.A N VAL 632.A O no hydrogen 2.807 N/A ARG 637.A N GLU 633.A O no hydrogen 3.109 N/A LYS 638.A N ASN 634.A O no hydrogen 2.887 N/A VAL 639.A N VAL 635.A O no hydrogen 2.927 N/A LYS 640.A N VAL 636.A O no hydrogen 2.935 N/A GLU 641.A N ARG 637.A O no hydrogen 2.849 N/A