Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jnf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ ASP 31.A OD2 no hydrogen 3.306 N/A VAL 4.A N ARG 34.A O no hydrogen 2.985 N/A ARG 5.A N ASP 56.A OD2 no hydrogen 2.856 N/A ARG 5.A NE HIS 53.A O no hydrogen 3.224 N/A ARG 5.A NH2 HIS 53.A O no hydrogen 2.250 N/A TRP 6.A N ILE 36.A O no hydrogen 2.545 N/A CYS 7.A N ALA 57.A O no hydrogen 2.901 N/A CYS 7.A SG VAL 38.A O no hydrogen 3.980 N/A ALA 8.A N VAL 38.A O no hydrogen 2.749 N/A VAL 9.A N GLU 13.A OE1 no hydrogen 2.700 N/A ASN 10.A N LYS 40.A O no hydrogen 2.786 N/A ASN 10.A ND2 ALA 41.A O no hydrogen 3.684 N/A ASP 11.A N ASN 10.A OD1 no hydrogen 2.705 N/A ALA 14.A N ASN 10.A O no hydrogen 2.981 N/A SER 15.A N ASP 11.A O no hydrogen 3.033 N/A SER 15.A OG ASP 11.A O no hydrogen 3.438 N/A LYS 16.A N HIS 12.A O no hydrogen 3.158 N/A LYS 16.A NZ LEU 282.A O no hydrogen 2.906 N/A LYS 16.A NZ LEU 291.A O no hydrogen 2.658 N/A CYS 17.A N GLU 13.A O no hydrogen 2.800 N/A ALA 18.A N ALA 14.A O no hydrogen 3.139 N/A ASN 19.A N SER 15.A O no hydrogen 3.268 N/A PHE 20.A N LYS 16.A O no hydrogen 3.030 N/A ARG 21.A N CYS 17.A O no hydrogen 2.913 N/A ARG 21.A NE ASP 22.A OD1 no hydrogen 2.892 N/A ARG 21.A NH2 ASP 22.A OD1 no hydrogen 2.848 N/A ARG 21.A NH2 ASP 22.A OD2 no hydrogen 3.448 N/A ASP 22.A N ALA 18.A O no hydrogen 3.107 N/A SER 23.A N ASN 19.A O no hydrogen 2.943 N/A SER 23.A OG ASN 19.A O no hydrogen 3.032 N/A MET 24.A N PHE 20.A O no hydrogen 2.893 N/A LYS 25.A N ARG 21.A O no hydrogen 2.936 N/A LEU 28.A N MET 24.A O no hydrogen 2.938 N/A ARG 34.A N LYS 2.A O no hydrogen 2.905 N/A ILE 36.A N VAL 4.A O no hydrogen 2.762 N/A VAL 38.A N TRP 6.A O no hydrogen 2.973 N/A LYS 39.A NZ ASP 11.A OD1 no hydrogen 2.545 N/A LYS 40.A N ALA 8.A O no hydrogen 2.903 N/A LYS 40.A NZ GLU 54.A OE1 no hydrogen 3.120 N/A TYR 43.A OH GLU 67.A OE2 no hydrogen 2.374 N/A ASP 45.A N SER 42.A OG no hydrogen 2.924 N/A CYS 46.A N SER 42.A O no hydrogen 3.095 N/A CYS 46.A SG SER 42.A O no hydrogen 3.919 N/A ILE 47.A N TYR 43.A O no hydrogen 3.010 N/A ILE 47.A N LEU 44.A O no hydrogen 2.745 N/A LYS 48.A N LEU 44.A O no hydrogen 2.981 N/A ALA 49.A N ASP 45.A O no hydrogen 3.016 N/A ILE 50.A N CYS 46.A O no hydrogen 3.125 N/A ILE 50.A N ILE 47.A O no hydrogen 3.183 N/A ALA 51.A N ILE 47.A O no hydrogen 3.176 N/A ALA 52.A N LYS 48.A O no hydrogen 3.053 N/A HIS 53.A N ILE 50.A O no hydrogen 3.166 N/A ALA 55.A N ALA 49.A O no hydrogen 2.890 N/A ASP 56.A N ARG 5.A O no hydrogen 2.857 N/A ALA 57.A N ARG 5.A O no hydrogen 3.359 N/A VAL 58.A N VAL 250.A O no hydrogen 3.422 N/A THR 59.A OG1 LEU 292.A O no hydrogen 2.757 N/A LEU 60.A N ALA 248.A O no hydrogen 2.748 N/A GLY 63.A N ASP 61.A OD2 no hydrogen 2.872 N/A LEU 64.A N ASP 61.A O no hydrogen 2.733 N/A VAL 65.A N ASP 61.A O no hydrogen 2.939 N/A HIS 66.A N ALA 62.A O no hydrogen 3.134 N/A ALA 68.A N LEU 64.A O no hydrogen 2.812 N/A ALA 68.A N VAL 65.A O no hydrogen 3.155 N/A GLY 69.A N VAL 65.A O no hydrogen 3.122 N/A ASN 73.A N LEU 70.A O no hydrogen 2.811 N/A ASN 74.A N LEU 70.A O no hydrogen 2.591 N/A LEU 75.A N ALA 68.A O no hydrogen 2.885 N/A LYS 76.A N ALA 251.A O no hydrogen 2.955 N/A LYS 76.A NZ PRO 305.A O no hydrogen 3.512 N/A VAL 78.A N VAL 249.A O no hydrogen 2.940 N/A VAL 79.A N VAL 249.A O no hydrogen 3.416 N/A ALA 80.A N PHE 301.A O no hydrogen 2.966 N/A GLU 81.A N HIS 247.A O no hydrogen 3.008 N/A PHE 82.A N GLY 299.A O no hydrogen 2.947 N/A TYR 83.A N LYS 90.A O no hydrogen 2.802 N/A TYR 83.A OH GLU 81.A OE1 no hydrogen 2.768 N/A ASN 88.A N SER 85.A OG no hydrogen 3.005 N/A LYS 90.A N TYR 83.A O no hydrogen 3.001 N/A LYS 90.A NZ ASN 88.A OD1 no hydrogen 2.904 N/A THR 91.A N LYS 673.A O no hydrogen 3.171 N/A THR 91.A OG1 HIS 672.A ND1 no hydrogen 2.760 N/A TYR 93.A N VAL 244.A O no hydrogen 2.875 N/A TYR 93.A OH HIS 247.A NE2 no hydrogen 2.912 N/A TYR 94.A N GLN 205.A OE1 no hydrogen 2.861 N/A ALA 95.A N ALA 242.A O no hydrogen 2.936 N/A VAL 96.A N VAL 203.A O no hydrogen 2.813 N/A LEU 98.A N ALA 201.A O no hydrogen 2.660 N/A VAL 99.A N GLU 222.A O no hydrogen 3.015 N/A LYS 100.A NZ LEU 193.A O no hydrogen 3.189 N/A LYS 100.A NZ LYS 194.A O no hydrogen 3.563 N/A LYS 101.A N GLN 220.A O no hydrogen 2.795 N/A LYS 101.A NZ ASP 219.A O no hydrogen 2.615 N/A SER 103.A N LYS 100.A O no hydrogen 3.264 N/A SER 103.A OG LYS 100.A O no hydrogen 2.914 N/A PHE 105.A N SER 103.A O no hydrogen 2.868 N/A GLN 106.A N GLU 109.A OE2 no hydrogen 2.948 N/A GLN 106.A NE2 ASN 104.A O no hydrogen 3.335 N/A ASN 108.A N ASN 228.A OD1 no hydrogen 3.087 N/A GLU 109.A N GLN 106.A O no hydrogen 2.857 N/A GLY 112.A N PHE 151.A O no hydrogen 2.727 N/A LYS 113.A N LEU 110.A O no hydrogen 2.769 N/A LYS 113.A NZ GLU 109.A O no hydrogen 2.909 N/A LYS 114.A N ASP 199.A OD2 no hydrogen 2.769 N/A SER 115.A N GLY 154.A O no hydrogen 2.944 N/A SER 115.A OG HIS 117.A NE2 no hydrogen 2.922 N/A SER 115.A OG SER 155.A OG no hydrogen 2.219 N/A CYS 116.A N VAL 200.A O no hydrogen 2.996 N/A HIS 117.A N CYS 156.A O no hydrogen 3.113 N/A HIS 117.A ND1 GLY 125.A O no hydrogen 2.713 N/A HIS 117.A NE2 SER 115.A OG no hydrogen 2.922 N/A LEU 120.A N PRO 158.A O no hydrogen 2.788 N/A ARG 122.A N GLY 119.A O no hydrogen 3.317 N/A SER 123.A N ASP 61.A OD1 no hydrogen 3.452 N/A SER 123.A N ASP 61.A OD2 no hydrogen 2.687 N/A SER 123.A OG ASP 61.A OD1 no hydrogen 3.347 N/A SER 123.A OG ASP 61.A OD2 no hydrogen 3.111 N/A SER 123.A OG TYR 317.A OH no hydrogen 2.544 N/A TRP 126.A N ARG 122.A O no hydrogen 3.133 N/A ASN 127.A N ARG 122.A O no hydrogen 2.741 N/A ASN 127.A ND2 GLY 121.A O no hydrogen 3.188 N/A ASN 127.A ND2 TYR 317.A OH no hydrogen 3.063 N/A ILE 128.A N SER 123.A O no hydrogen 2.951 N/A ILE 130.A N TRP 126.A O no hydrogen 2.933 N/A GLY 131.A N ASN 127.A O no hydrogen 3.002 N/A LEU 132.A N ILE 128.A O no hydrogen 3.197 N/A LEU 132.A N PRO 129.A O no hydrogen 2.987 N/A LEU 133.A N PRO 129.A O no hydrogen 3.289 N/A LEU 133.A N ILE 130.A O no hydrogen 3.031 N/A LEU 134.A N ILE 130.A O no hydrogen 2.943 N/A LEU 137.A N LEU 134.A O no hydrogen 2.766 N/A ARG 141.A N GLU 139.A O no hydrogen 2.788 N/A ARG 141.A NE LEU 137.A O no hydrogen 3.241 N/A ARG 141.A NH2 LEU 137.A O no hydrogen 3.190 N/A GLU 145.A N GLU 145.A OE1 no hydrogen 2.933 N/A LYS 146.A N PRO 143.A O no hydrogen 2.857 N/A ALA 147.A N PRO 143.A O no hydrogen 3.415 N/A VAL 148.A N LEU 144.A O no hydrogen 2.886 N/A ALA 149.A N GLU 145.A O no hydrogen 2.918 N/A SER 150.A N ALA 147.A O no hydrogen 3.288 N/A SER 150.A OG LYS 146.A O no hydrogen 3.553 N/A PHE 151.A N ALA 147.A O no hydrogen 3.188 N/A PHE 151.A N VAL 148.A O no hydrogen 3.248 N/A PHE 152.A N VAL 148.A O no hydrogen 3.303 N/A SER 153.A N LYS 113.A O no hydrogen 2.899 N/A SER 153.A OG GLY 112.A O no hydrogen 2.617 N/A SER 155.A N GLN 167.A O no hydrogen 2.982 N/A SER 155.A OG SER 115.A OG no hydrogen 2.219 N/A SER 155.A OG GLY 154.A O no hydrogen 2.862 N/A CYS 156.A N SER 115.A O no hydrogen 2.813 N/A CYS 156.A SG TYR 183.A O no hydrogen 3.938 N/A VAL 157.A N LEU 168.A O no hydrogen 2.937 N/A CYS 159.A N CYS 175.A O no hydrogen 2.737 N/A ALA 160.A N VAL 157.A O no hydrogen 3.200 N/A ASP 164.A N ASP 161.A OD1 no hydrogen 2.994 N/A PHE 165.A N ASP 161.A O no hydrogen 3.048 N/A GLN 167.A N GLN 167.A OE1 no hydrogen 2.564 N/A LEU 168.A N PHE 165.A O no hydrogen 3.160 N/A CYS 169.A N PRO 166.A O no hydrogen 2.961 N/A GLN 170.A N GLN 167.A O no hydrogen 3.227 N/A GLN 170.A NE2 SER 153.A O no hydrogen 3.352 N/A LEU 171.A N SER 155.A O no hydrogen 2.886 N/A CYS 172.A N CYS 169.A O no hydrogen 2.952 N/A CYS 175.A N CYS 172.A O no hydrogen 3.038 N/A CYS 175.A SG VAL 157.A O no hydrogen 3.322 N/A CYS 175.A SG LEU 168.A O no hydrogen 3.215 N/A SER 179.A OG HIS 12.A ND1 no hydrogen 3.335 N/A VAL 180.A N SER 178.A OG no hydrogen 3.227 N/A GLN 181.A N SER 178.A O no hydrogen 3.030 N/A GLN 181.A NE2 GLY 176.A O no hydrogen 2.887 N/A TYR 183.A N GLN 181.A OE1 no hydrogen 2.769 N/A TYR 183.A OH ASP 195.A OD2 no hydrogen 2.642 N/A PHE 184.A N GLN 181.A O no hydrogen 3.364 N/A GLY 185.A N THR 118.A O no hydrogen 3.149 N/A TYR 186.A OH TYR 93.A OH no hydrogen 2.593 N/A TYR 186.A OH HIS 247.A NE2 no hydrogen 2.474 N/A GLY 188.A N PHE 184.A O no hydrogen 2.759 N/A ALA 189.A N GLY 185.A O no hydrogen 2.966 N/A PHE 190.A N TYR 186.A O no hydrogen 3.208 N/A LYS 191.A N SER 187.A O no hydrogen 2.929 N/A LYS 191.A NZ ASP 195.A OD2 no hydrogen 3.401 N/A CYS 192.A N GLY 188.A O no hydrogen 2.774 N/A LEU 193.A N ALA 189.A O no hydrogen 3.245 N/A LYS 194.A N PHE 190.A O no hydrogen 2.841 N/A ASP 195.A N LYS 191.A O no hydrogen 2.888 N/A GLY 196.A N LEU 193.A O no hydrogen 2.805 N/A GLY 198.A N CYS 192.A O no hydrogen 3.120 N/A ASP 199.A N LYS 114.A O no hydrogen 2.929 N/A VAL 200.A N LYS 114.A O no hydrogen 3.388 N/A ALA 201.A N LEU 98.A O no hydrogen 2.812 N/A PHE 202.A N CYS 116.A O no hydrogen 2.944 N/A VAL 203.A N VAL 96.A O no hydrogen 3.344 N/A LYS 204.A N THR 207.A OG1 no hydrogen 3.368 N/A LYS 204.A NZ SER 296.A OG no hydrogen 3.007 N/A GLN 205.A N GLN 205.A OE1 no hydrogen 2.850 N/A THR 207.A N LYS 204.A O no hydrogen 3.306 N/A THR 207.A OG1 LYS 204.A O no hydrogen 3.094 N/A GLU 210.A N GLU 206.A O no hydrogen 2.715 N/A ASN 211.A N ILE 208.A O no hydrogen 3.292 N/A ASN 211.A ND2 THR 207.A O no hydrogen 2.772 N/A LEU 212.A N ILE 208.A O no hydrogen 2.981 N/A SER 214.A OG GLU 217.A OE1 no hydrogen 2.824 N/A LYS 215.A NZ ASP 219.A OD1 no hydrogen 2.614 N/A LYS 215.A NZ ASP 219.A OD2 no hydrogen 3.061 N/A ARG 218.A N SER 214.A O no hydrogen 3.138 N/A ARG 218.A NH1 LEU 212.A O no hydrogen 2.873 N/A ASP 219.A N LYS 215.A O no hydrogen 2.773 N/A GLN 220.A N GLU 217.A O no hydrogen 2.941 N/A TYR 221.A N ARG 218.A O no hydrogen 3.006 N/A GLU 222.A N VAL 99.A O no hydrogen 2.956 N/A LEU 223.A N LYS 231.A O no hydrogen 2.655 N/A LEU 224.A N ALA 97.A O no hydrogen 3.087 N/A CYS 225.A N THR 229.A O no hydrogen 2.982 N/A CYS 225.A SG THR 229.A O no hydrogen 3.469 N/A CYS 225.A SG THR 229.A OG1 no hydrogen 3.755 N/A ASN 228.A N CYS 225.A O no hydrogen 3.021 N/A THR 229.A N ASP 227.A OD1 no hydrogen 3.266 N/A THR 229.A OG1 ASP 227.A OD1 no hydrogen 2.674 N/A ARG 230.A NE PHE 105.A O no hydrogen 2.931 N/A ARG 230.A NH1 LYS 100.A O no hydrogen 3.086 N/A ARG 230.A NH1 GLU 222.A OE1 no hydrogen 2.727 N/A ARG 230.A NH2 SER 103.A OG no hydrogen 2.799 N/A ARG 230.A NH2 PHE 105.A O no hydrogen 3.147 N/A LYS 231.A N LEU 223.A O no hydrogen 2.918 N/A GLU 235.A N PRO 232.A O no hydrogen 3.098 N/A GLN 238.A N GLU 235.A O no hydrogen 3.034 N/A GLN 238.A NE2 GLU 235.A OE1 no hydrogen 2.569 N/A CYS 239.A N TYR 236.A O no hydrogen 3.101 N/A HIS 240.A ND1 TYR 236.A O no hydrogen 2.699 N/A LEU 241.A N ALA 95.A O no hydrogen 2.761 N/A VAL 244.A N TYR 93.A O no hydrogen 2.903 N/A SER 246.A N THR 91.A O no hydrogen 3.056 N/A SER 246.A OG GLU 81.A O no hydrogen 2.727 N/A HIS 247.A N TYR 83.A OH no hydrogen 3.261 N/A ALA 248.A N LEU 60.A O no hydrogen 2.820 N/A VAL 249.A N VAL 79.A O no hydrogen 2.827 N/A VAL 250.A N VAL 58.A O no hydrogen 3.026 N/A ALA 251.A N LYS 76.A O no hydrogen 3.054 N/A ARG 252.A NE ILE 50.A O no hydrogen 2.885 N/A ARG 252.A NH2 ALA 55.A O no hydrogen 3.339 N/A SER 253.A OG ASN 74.A O no hydrogen 2.811 N/A LYS 257.A NZ THR 3.A O no hydrogen 2.681 N/A LYS 257.A NZ ASP 56.A OD2 no hydrogen 2.909 N/A ILE 261.A N LYS 257.A O no hydrogen 2.965 N/A TRP 262.A N GLU 258.A O no hydrogen 2.872 N/A GLU 263.A N ASP 259.A O no hydrogen 2.883 N/A LEU 264.A N LEU 260.A O no hydrogen 2.815 N/A LEU 265.A N ILE 261.A O no hydrogen 3.008 N/A ASN 266.A N TRP 262.A O no hydrogen 2.899 N/A GLN 267.A N GLU 263.A O no hydrogen 3.027 N/A ALA 268.A N LEU 264.A O no hydrogen 2.673 N/A GLN 269.A N LEU 265.A O no hydrogen 3.021 N/A GLN 269.A NE2 ASN 266.A OD1 no hydrogen 3.175 N/A GLN 269.A NE2 PHE 300.A O no hydrogen 3.649 N/A GLU 270.A N ASN 266.A O no hydrogen 3.027 N/A HIS 271.A N GLN 267.A O no hydrogen 2.867 N/A HIS 271.A ND1 GLN 267.A O no hydrogen 2.817 N/A PHE 272.A N ALA 268.A O no hydrogen 2.706 N/A LYS 274.A NZ ASP 295.A O no hydrogen 2.722 N/A LYS 274.A NZ ALA 297.A O no hydrogen 3.077 N/A LYS 276.A NZ GLU 270.A O no hydrogen 2.836 N/A GLN 281.A NE2 GLY 278.A O no hydrogen 3.412 N/A LEU 282.A N PHE 272.A O no hydrogen 3.073 N/A HIS 287.A N SER 285.A OG no hydrogen 2.964 N/A GLY 288.A N SER 285.A O no hydrogen 3.273 N/A LYS 289.A NZ GLU 210.A O no hydrogen 3.146 N/A ASN 290.A N ASP 295.A OD1 no hydrogen 2.725 N/A ASN 290.A ND2 GLU 210.A OE2 no hydrogen 3.227 N/A LEU 292.A N GLU 13.A OE2 no hydrogen 2.700 N/A LYS 294.A N GLU 81.A OE2 no hydrogen 2.958 N/A LYS 294.A NZ TYR 83.A OH no hydrogen 3.322 N/A LYS 294.A NZ TYR 186.A OH no hydrogen 3.215 N/A ASP 295.A N ASN 290.A OD1 no hydrogen 2.874 N/A ALA 297.A N LYS 294.A O no hydrogen 3.226 N/A TYR 298.A N PHE 82.A O no hydrogen 2.816 N/A PHE 300.A N GLN 269.A OE1 no hydrogen 3.125 N/A PHE 301.A N ALA 80.A O no hydrogen 3.054 N/A LYS 302.A NZ VAL 78.A O no hydrogen 3.164 N/A LYS 302.A NZ VAL 303.A O no hydrogen 3.122 N/A VAL 303.A N VAL 78.A O no hydrogen 2.977 N/A ARG 306.A NH1 ARG 306.A O no hydrogen 3.113 N/A ARG 306.A NH2 ASP 374.A OD1 no hydrogen 3.308 N/A MET 307.A N PRO 304.A O no hydrogen 2.834 N/A LEU 311.A N ASP 308.A OD1 no hydrogen 3.122 N/A TYR 312.A N ASP 308.A O no hydrogen 2.595 N/A TYR 312.A OH SER 246.A O no hydrogen 2.713 N/A LEU 313.A N ALA 309.A O no hydrogen 2.780 N/A GLY 314.A N ASN 310.A O no hydrogen 2.637 N/A TYR 317.A OH SER 123.A OG no hydrogen 2.544 N/A VAL 318.A N GLY 314.A O no hydrogen 3.026 N/A THR 319.A N TYR 315.A O no hydrogen 2.940 N/A THR 319.A N GLU 316.A O no hydrogen 2.960 N/A THR 319.A OG1 TYR 315.A O no hydrogen 3.040 N/A ALA 320.A N GLU 316.A O no hydrogen 2.825 N/A VAL 321.A N TYR 317.A O no hydrogen 2.839 N/A ARG 322.A N VAL 318.A O no hydrogen 2.871 N/A ASN 323.A N THR 319.A O no hydrogen 2.730 N/A LEU 324.A N ALA 320.A O no hydrogen 3.164 N/A ARG 325.A N VAL 321.A O no hydrogen 3.078 N/A GLU 326.A N ARG 322.A O no hydrogen 2.769 N/A GLY 327.A N LEU 324.A O no hydrogen 3.246 N/A ILE 328.A N ASN 323.A O no hydrogen 3.154 N/A GLN 334.A NE2 LEU 333.A O no hydrogen 3.151 N/A LYS 338.A N GLU 336.A O no hydrogen 2.869 N/A VAL 340.A N LEU 363.A O no hydrogen 2.661 N/A LYS 341.A N ASP 385.A OD2 no hydrogen 2.881 N/A TRP 342.A N GLU 365.A O no hydrogen 2.454 N/A CYS 343.A N ALA 386.A O no hydrogen 2.886 N/A CYS 343.A SG GLU 367.A O no hydrogen 3.997 N/A ALA 344.A N GLU 367.A O no hydrogen 2.860 N/A LEU 345.A N GLU 349.A OE1 no hydrogen 3.185 N/A GLY 346.A N ALA 369.A O no hydrogen 3.082 N/A ARG 350.A NE ASP 354.A OD1 no hydrogen 2.811 N/A ARG 350.A NE ASP 354.A OD2 no hydrogen 3.115 N/A LEU 351.A N HIS 347.A O no hydrogen 2.947 N/A LYS 352.A N HIS 348.A O no hydrogen 2.936 N/A LYS 352.A NZ MET 616.A O no hydrogen 2.510 N/A LYS 352.A NZ HIS 618.A O no hydrogen 2.994 N/A LYS 352.A NZ LEU 624.A O no hydrogen 2.890 N/A CYS 353.A N GLU 349.A O no hydrogen 2.942 N/A ASP 354.A N ARG 350.A O no hydrogen 2.730 N/A GLU 355.A N LEU 351.A O no hydrogen 2.994 N/A TRP 356.A N LYS 352.A O no hydrogen 2.931 N/A SER 357.A N CYS 353.A O no hydrogen 2.694 N/A SER 357.A OG ILE 364.A O no hydrogen 2.297 N/A VAL 358.A N ASP 354.A O no hydrogen 2.882 N/A THR 359.A N GLU 355.A O no hydrogen 3.285 N/A THR 359.A OG1 GLU 355.A O no hydrogen 2.935 N/A SER 360.A N TRP 356.A O no hydrogen 3.243 N/A SER 360.A N SER 357.A O no hydrogen 2.800 N/A SER 360.A OG TRP 356.A O no hydrogen 2.311 N/A SER 360.A OG SER 357.A O no hydrogen 2.602 N/A GLY 361.A N SER 357.A O no hydrogen 3.273 N/A GLY 361.A N VAL 358.A O no hydrogen 2.794 N/A GLY 362.A N SER 357.A O no hydrogen 3.423 N/A GLU 365.A N VAL 340.A O no hydrogen 2.587 N/A CYS 366.A SG ASP 354.A OD1 no hydrogen 3.590 N/A GLU 367.A N TRP 342.A O no hydrogen 2.714 N/A ALA 369.A N ALA 344.A O no hydrogen 2.992 N/A ASP 374.A N THR 371.A OG1 no hydrogen 3.013 N/A CYS 375.A N THR 371.A O no hydrogen 2.929 N/A ILE 376.A N PRO 372.A O no hydrogen 2.967 N/A ALA 377.A N GLU 373.A O no hydrogen 2.996 N/A LYS 378.A N ASP 374.A O no hydrogen 2.979 N/A LYS 378.A NZ SER 368.A O no hydrogen 2.620 N/A ILE 379.A N CYS 375.A O no hydrogen 3.191 N/A MET 380.A N ILE 376.A O no hydrogen 2.912 N/A ASN 381.A N ALA 377.A O no hydrogen 3.105 N/A GLY 382.A N ILE 379.A O no hydrogen 3.175 N/A ALA 384.A N LYS 378.A O no hydrogen 2.979 N/A ASP 385.A N LYS 341.A O no hydrogen 2.862 N/A ALA 386.A N LYS 341.A O no hydrogen 3.026 N/A SER 388.A OG GLU 408.A OE2 no hydrogen 3.268 N/A LEU 389.A N ALA 581.A O no hydrogen 2.903 N/A GLY 392.A N ASP 390.A OD2 no hydrogen 3.207 N/A TYR 393.A N ASP 390.A O no hydrogen 2.840 N/A VAL 394.A N ASP 390.A O no hydrogen 2.953 N/A TYR 395.A N GLY 391.A O no hydrogen 3.099 N/A ALA 397.A N TYR 393.A O no hydrogen 2.882 N/A GLY 398.A N VAL 394.A O no hydrogen 2.938 N/A GLN 399.A N TYR 395.A O no hydrogen 2.967 N/A GLN 399.A NE2 TYR 395.A OH no hydrogen 3.236 N/A CYS 400.A N ILE 396.A O no hydrogen 2.991 N/A CYS 400.A SG ILE 396.A O no hydrogen 3.361 N/A CYS 400.A SG LEU 665.A O no hydrogen 3.922 N/A GLY 401.A N GLY 398.A O no hydrogen 2.971 N/A LEU 402.A N ALA 397.A O no hydrogen 2.963 N/A VAL 403.A N SER 584.A O no hydrogen 2.817 N/A VAL 405.A N VAL 582.A O no hydrogen 2.768 N/A ALA 407.A N VAL 634.A O no hydrogen 3.109 N/A GLU 408.A N HIS 580.A O no hydrogen 3.053 N/A ASN 409.A N CYS 632.A O no hydrogen 2.739 N/A ASN 409.A ND2 ALA 418.A O no hydrogen 2.661 N/A TYR 410.A N GLU 420.A OE1 no hydrogen 2.755 N/A TYR 410.A OH GLU 408.A OE1 no hydrogen 2.344 N/A GLU 411.A N GLU 420.A OE1 no hydrogen 3.344 N/A GLU 411.A N GLU 420.A OE2 no hydrogen 2.773 N/A ASP 414.A N SER 412.A OG no hydrogen 2.902 N/A CYS 415.A SG THR 413.A O no hydrogen 3.574 N/A LYS 416.A N ASP 414.A OD1 no hydrogen 3.029 N/A LYS 417.A N ASP 414.A O no hydrogen 2.865 N/A GLU 420.A N ASN 409.A OD1 no hydrogen 2.754 N/A TYR 423.A N ALA 577.A O no hydrogen 2.748 N/A TYR 423.A OH HIS 580.A NE2 no hydrogen 2.770 N/A SER 425.A N ALA 575.A O no hydrogen 3.050 N/A VAL 426.A N VAL 528.A O no hydrogen 2.999 N/A VAL 428.A N ALA 526.A O no hydrogen 3.019 N/A VAL 429.A N GLU 555.A O no hydrogen 2.890 N/A LYS 430.A NZ LEU 519.A O no hydrogen 2.744 N/A LYS 430.A NZ GLY 523.A O no hydrogen 2.631 N/A LYS 431.A N ASP 553.A O no hydrogen 2.748 N/A LYS 431.A NZ GLU 552.A O no hydrogen 2.831 N/A ILE 436.A N ASN 433.A OD1 no hydrogen 3.471 N/A ASN 437.A ND2 ASP 435.A O no hydrogen 3.396 N/A ASN 440.A N ASN 437.A O no hydrogen 2.926 N/A ASN 440.A ND2 ASP 435.A O no hydrogen 2.938 N/A GLY 443.A N PHE 476.A O no hydrogen 2.718 N/A LYS 444.A N LEU 441.A O no hydrogen 2.792 N/A LYS 444.A NZ ASN 440.A O no hydrogen 2.936 N/A LYS 445.A N ASP 524.A OD2 no hydrogen 2.766 N/A LYS 445.A NZ ASP 524.A OD1 no hydrogen 3.129 N/A LYS 445.A NZ ASP 524.A OD2 no hydrogen 2.532 N/A SER 446.A N GLN 479.A O no hydrogen 3.216 N/A SER 446.A OG HIS 448.A NE2 no hydrogen 2.912 N/A HIS 448.A N CYS 481.A O no hydrogen 3.125 N/A HIS 448.A ND1 GLY 456.A O no hydrogen 2.665 N/A HIS 448.A NE2 SER 446.A OG no hydrogen 2.912 N/A VAL 451.A N PRO 483.A O no hydrogen 2.841 N/A ARG 453.A N ALA 450.A O no hydrogen 3.448 N/A THR 454.A N ASP 390.A OD2 no hydrogen 2.559 N/A THR 454.A OG1 ASP 390.A OD1 no hydrogen 2.841 N/A THR 454.A OG1 ASP 390.A OD2 no hydrogen 3.013 N/A THR 454.A OG1 TYR 650.A OH no hydrogen 2.943 N/A ASN 458.A N ARG 453.A O no hydrogen 2.895 N/A ASN 458.A ND2 ASP 452.A O no hydrogen 3.182 N/A ASN 458.A ND2 TYR 650.A OH no hydrogen 3.111 N/A ILE 459.A N THR 454.A O no hydrogen 2.860 N/A MET 461.A N TRP 457.A O no hydrogen 2.562 N/A GLY 462.A N ASN 458.A O no hydrogen 3.042 N/A LEU 463.A N ILE 459.A O no hydrogen 3.220 N/A LEU 463.A N PRO 460.A O no hydrogen 3.078 N/A LEU 464.A N PRO 460.A O no hydrogen 2.985 N/A TYR 465.A N MET 461.A O no hydrogen 2.762 N/A ASN 466.A N GLY 462.A O no hydrogen 3.291 N/A ARG 467.A N LEU 464.A O no hydrogen 2.846 N/A ARG 467.A NH1 TRP 438.A O no hydrogen 3.525 N/A ARG 467.A NH2 TRP 438.A O no hydrogen 2.975 N/A ILE 468.A N LEU 464.A O no hydrogen 2.950 N/A ASN 469.A N TYR 465.A O no hydrogen 2.731 N/A ARG 472.A N HIS 470.A ND1 no hydrogen 2.888 N/A ARG 472.A NE GLU 475.A OE1 no hydrogen 2.353 N/A GLU 475.A N ARG 472.A O no hydrogen 2.690 N/A PHE 476.A N PHE 473.A O no hydrogen 3.107 N/A PHE 477.A N PHE 473.A O no hydrogen 3.113 N/A ARG 478.A N LYS 444.A O no hydrogen 3.057 N/A GLY 480.A N SER 490.A O no hydrogen 3.251 N/A CYS 481.A N SER 446.A O no hydrogen 3.178 N/A ALA 482.A N LEU 491.A O no hydrogen 2.958 N/A GLY 484.A N CYS 501.A O no hydrogen 2.902 N/A SER 485.A N ALA 482.A O no hydrogen 3.122 N/A SER 485.A OG ALA 482.A O no hydrogen 2.908 N/A LYS 487.A NZ VAL 500.A O no hydrogen 2.894 N/A SER 489.A N GLN 486.A O no hydrogen 2.798 N/A SER 489.A OG GLN 486.A O no hydrogen 3.017 N/A SER 490.A OG ASP 474.A O no hydrogen 2.471 N/A CYS 492.A N SER 489.A O no hydrogen 3.145 N/A CYS 492.A SG SER 485.A O no hydrogen 3.526 N/A CYS 492.A SG GLN 486.A O no hydrogen 3.538 N/A GLU 493.A N SER 490.A O no hydrogen 2.596 N/A LEU 494.A N GLY 480.A O no hydrogen 2.628 N/A CYS 495.A N CYS 492.A O no hydrogen 3.340 N/A CYS 495.A SG CYS 492.A O no hydrogen 3.958 N/A VAL 496.A N GLU 507.A OE1 no hydrogen 2.998 N/A VAL 496.A N GLU 507.A OE2 no hydrogen 2.841 N/A GLY 497.A N GLU 507.A OE2 no hydrogen 2.841 N/A SER 499.A N ARG 506.A O no hydrogen 2.961 N/A CYS 501.A N GLU 507.A OE1 no hydrogen 2.926 N/A CYS 501.A SG SER 485.A O no hydrogen 3.902 N/A ALA 502.A N SER 499.A O no hydrogen 3.381 N/A ASN 504.A ND2 GLU 370.A O no hydrogen 2.781 N/A ARG 506.A N ASN 504.A OD1 no hydrogen 2.805 N/A ARG 506.A NH1 GLU 370.A OE2 no hydrogen 2.751 N/A GLU 507.A N ASN 504.A O no hydrogen 3.004 N/A TYR 509.A N GLU 507.A OE2 no hydrogen 2.863 N/A TYR 509.A OH GLU 521.A OE1 no hydrogen 2.499 N/A TYR 510.A N GLU 507.A O no hydrogen 3.176 N/A GLY 511.A N THR 449.A O no hydrogen 2.906 N/A TYR 512.A OH TYR 423.A OH no hydrogen 2.766 N/A TYR 512.A OH HIS 580.A NE2 no hydrogen 2.580 N/A ALA 515.A N GLY 511.A O no hydrogen 2.943 N/A PHE 516.A N TYR 512.A O no hydrogen 3.190 N/A PHE 516.A N THR 513.A O no hydrogen 2.791 N/A ARG 517.A N THR 513.A O no hydrogen 2.929 N/A ARG 517.A NE GLU 521.A OE2 no hydrogen 2.819 N/A ARG 517.A NH2 GLU 521.A OE2 no hydrogen 3.537 N/A CYS 518.A N GLY 514.A O no hydrogen 2.869 N/A LEU 519.A N ALA 515.A O no hydrogen 3.203 N/A VAL 520.A N PHE 516.A O no hydrogen 2.908 N/A GLU 521.A N ARG 517.A O no hydrogen 2.867 N/A LYS 522.A N CYS 518.A O no hydrogen 2.910 N/A LYS 522.A NZ LEU 494.A O no hydrogen 3.374 N/A GLY 523.A N CYS 518.A O no hydrogen 2.849 N/A ASP 524.A N LYS 445.A O no hydrogen 2.727 N/A VAL 525.A N LYS 445.A O no hydrogen 3.012 N/A ALA 526.A N VAL 428.A O no hydrogen 3.001 N/A PHE 527.A N CYS 447.A O no hydrogen 2.896 N/A VAL 528.A N VAL 426.A O no hydrogen 3.337 N/A LYS 529.A NZ ASP 629.A OD1 no hydrogen 3.354 N/A LYS 529.A NZ ASP 629.A OD2 no hydrogen 2.582 N/A SER 530.A N LEU 424.A O no hydrogen 2.744 N/A THR 532.A N LYS 529.A O no hydrogen 3.171 N/A THR 532.A OG1 LYS 529.A O no hydrogen 2.642 N/A GLN 535.A N GLN 531.A O no hydrogen 3.037 N/A GLN 535.A NE2 ASP 629.A OD2 no hydrogen 3.108 N/A ASN 536.A N VAL 533.A O no hydrogen 3.034 N/A ASN 536.A ND2 THR 532.A O no hydrogen 2.987 N/A THR 537.A OG1 VAL 533.A O no hydrogen 2.822 N/A GLY 538.A N LEU 549.A O no hydrogen 3.120 N/A ARG 540.A N THR 537.A O no hydrogen 3.166 N/A ARG 540.A NH1 THR 537.A O no hydrogen 3.140 N/A ASN 541.A ND2 ASN 536.A OD1 no hydrogen 2.643 N/A GLU 543.A N ASN 541.A OD1 no hydrogen 2.864 N/A TRP 545.A NE1 GLU 543.A OE1 no hydrogen 2.751 N/A ALA 546.A N GLU 543.A O no hydrogen 2.911 N/A LYS 547.A N GLU 543.A O no hydrogen 2.953 N/A LYS 547.A NZ GLY 539.A O no hydrogen 2.792 N/A LEU 549.A N ALA 546.A O no hydrogen 3.242 N/A LYS 550.A N ASP 553.A OD2 no hydrogen 3.091 N/A ASP 553.A N LYS 550.A O no hydrogen 2.553 N/A PHE 554.A N GLU 551.A O no hydrogen 3.481 N/A GLU 555.A N VAL 429.A O no hydrogen 2.848 N/A LEU 556.A N LYS 564.A O no hydrogen 2.887 N/A LEU 557.A N ALA 427.A O no hydrogen 2.773 N/A CYS 558.A N THR 562.A O no hydrogen 3.097 N/A CYS 558.A SG THR 562.A O no hydrogen 3.799 N/A CYS 558.A SG THR 562.A OG1 no hydrogen 3.575 N/A GLY 561.A N CYS 558.A O no hydrogen 2.972 N/A THR 562.A N ASP 560.A OD1 no hydrogen 2.983 N/A THR 562.A OG1 ASP 560.A OD1 no hydrogen 2.666 N/A ARG 563.A NE GLU 555.A OE1 no hydrogen 2.858 N/A ARG 563.A NH1 ASN 433.A O no hydrogen 2.939 N/A ARG 563.A NH1 ILE 436.A O no hydrogen 2.847 N/A ARG 563.A NH2 ASN 433.A O no hydrogen 3.214 N/A ARG 563.A NH2 GLU 555.A OE1 no hydrogen 2.977 N/A LYS 564.A N LEU 556.A O no hydrogen 3.369 N/A LYS 564.A NZ ASN 571.A O no hydrogen 3.208 N/A GLU 568.A N PRO 565.A O no hydrogen 2.909 N/A ASN 571.A N GLU 568.A O no hydrogen 2.715 N/A ASN 571.A ND2 GLU 568.A OE1 no hydrogen 3.228 N/A CYS 572.A N ALA 569.A O no hydrogen 2.529 N/A HIS 573.A ND1 ALA 569.A O no hydrogen 2.987 N/A LEU 574.A N SER 425.A O no hydrogen 2.801 N/A LYS 576.A NZ GLU 421.A OE1 no hydrogen 3.145 N/A ALA 577.A N TYR 423.A O no hydrogen 2.924 N/A ASN 579.A ND2 GLU 408.A O no hydrogen 2.803 N/A ASN 579.A ND2 GLU 420.A OE1 no hydrogen 3.069 N/A HIS 580.A N TYR 410.A OH no hydrogen 3.134 N/A HIS 580.A NE2 TYR 423.A OH no hydrogen 2.770 N/A ALA 581.A N LEU 389.A O no hydrogen 3.023 N/A VAL 582.A N LEU 406.A O no hydrogen 2.711 N/A VAL 583.A N MET 387.A O no hydrogen 3.064 N/A SER 584.A N VAL 403.A O no hydrogen 3.018 N/A SER 584.A OG ASP 385.A O no hydrogen 2.292 N/A ARG 585.A NE ASP 587.A OD1 no hydrogen 2.575 N/A ARG 585.A NH1 ILE 379.A O no hydrogen 3.215 N/A ARG 585.A NH1 ASP 385.A OD1 no hydrogen 3.339 N/A ARG 585.A NH2 ASP 385.A OD1 no hydrogen 3.141 N/A ARG 585.A NH2 ASP 587.A OD2 no hydrogen 3.250 N/A LYS 588.A NZ GLU 336.A O no hydrogen 3.380 N/A ALA 589.A N LYS 586.A O no hydrogen 3.290 N/A VAL 592.A N LYS 588.A O no hydrogen 3.008 N/A LYS 593.A N ALA 589.A O no hydrogen 2.831 N/A LYS 593.A NZ ASP 635.A OD2 no hydrogen 2.494 N/A GLN 594.A N ALA 590.A O no hydrogen 3.167 N/A LYS 595.A N CYS 591.A O no hydrogen 3.133 N/A LYS 595.A NZ LYS 338.A O no hydrogen 3.536 N/A LEU 596.A N VAL 592.A O no hydrogen 3.049 N/A LEU 596.A N LYS 593.A O no hydrogen 2.457 N/A LEU 597.A N LYS 593.A O no hydrogen 2.904 N/A ASP 598.A N GLN 594.A O no hydrogen 2.896 N/A LEU 599.A N LYS 595.A O no hydrogen 2.923 N/A GLN 600.A N LEU 596.A O no hydrogen 2.850 N/A GLN 600.A NE2 LEU 633.A O no hydrogen 3.274 N/A VAL 601.A N ASP 598.A O no hydrogen 2.885 N/A GLU 602.A N LEU 599.A O no hydrogen 3.142 N/A PHE 603.A N GLN 600.A O no hydrogen 3.337 N/A GLY 604.A N GLN 600.A O no hydrogen 2.851 N/A ASN 605.A ND2 THR 413.A O no hydrogen 3.323 N/A VAL 607.A N GLY 604.A O no hydrogen 3.136 N/A SER 612.A OG ASP 609.A O no hydrogen 3.227 N/A SER 612.A OG ASP 609.A OD2 no hydrogen 3.421 N/A LYS 613.A NZ GLU 602.A O no hydrogen 2.841 N/A MET 616.A N PHE 603.A O no hydrogen 3.069 N/A HIS 618.A N CYS 615.A O no hydrogen 3.334 N/A LYS 622.A NZ ASN 536.A OD1 no hydrogen 3.054 N/A ASP 623.A N ASP 628.A OD2 no hydrogen 2.656 N/A LEU 625.A N GLU 349.A OE2 no hydrogen 2.936 N/A PHE 626.A N LEU 624.A O no hydrogen 2.613 N/A ARG 627.A N GLU 408.A OE2 no hydrogen 3.057 N/A ARG 627.A NE ASP 629.A OD1 no hydrogen 3.006 N/A ARG 627.A NH1 TYR 512.A OH no hydrogen 2.915 N/A ARG 627.A NH2 ASP 629.A OD1 no hydrogen 3.557 N/A ARG 627.A NH2 ASP 629.A OD2 no hydrogen 3.201 N/A ASP 628.A N ASP 623.A OD1 no hydrogen 2.840 N/A THR 630.A N ARG 627.A O no hydrogen 2.565 N/A THR 630.A OG1 ARG 627.A O no hydrogen 2.349 N/A LYS 631.A N ASN 409.A O no hydrogen 2.835 N/A CYS 632.A N ASN 409.A O no hydrogen 3.317 N/A CYS 632.A SG SER 412.A O no hydrogen 3.793 N/A CYS 632.A SG THR 413.A O no hydrogen 3.203 N/A LEU 633.A N GLN 600.A OE1 no hydrogen 2.647 N/A VAL 634.A N ALA 407.A O no hydrogen 2.783 N/A ARG 637.A N ASP 635.A OD1 no hydrogen 2.607 N/A LYS 639.A N LEU 636.A O no hydrogen 3.043 N/A TYR 645.A N THR 641.A O no hydrogen 2.523 N/A TYR 645.A OH ASN 579.A O no hydrogen 2.373 N/A LEU 646.A N TYR 642.A O no hydrogen 3.028 N/A GLY 647.A N GLU 643.A O no hydrogen 3.234 N/A ILE 651.A N GLY 647.A O no hydrogen 3.054 N/A LYS 652.A N ALA 648.A O no hydrogen 2.706 N/A ALA 653.A N ASP 649.A O no hydrogen 2.967 N/A VAL 654.A N TYR 650.A O no hydrogen 2.924 N/A SER 655.A N ILE 651.A O no hydrogen 2.959 N/A SER 655.A OG ILE 651.A O no hydrogen 3.061 N/A ASN 656.A N LYS 652.A O no hydrogen 3.205 N/A LEU 657.A N VAL 654.A O no hydrogen 2.999 N/A ARG 658.A N SER 655.A O no hydrogen 2.645 N/A CYS 660.A N LEU 657.A O no hydrogen 2.876 N/A SER 661.A N ARG 658.A O no hydrogen 2.940 N/A SER 663.A N SER 661.A OG no hydrogen 3.098 N/A SER 663.A OG GLU 373.A OE2 no hydrogen 2.063 N/A LEU 665.A N GLU 373.A OE1 no hydrogen 3.406 N/A LEU 666.A N SER 663.A OG no hydrogen 3.277 N/A GLU 667.A N SER 663.A O no hydrogen 3.351 N/A ALA 668.A N ARG 664.A O no hydrogen 3.237 N/A CYS 669.A N LEU 665.A O no hydrogen 2.814 N/A CYS 669.A SG LEU 665.A O no hydrogen 3.224 N/A THR 670.A N GLU 667.A O no hydrogen 2.976 N/A THR 670.A OG1 LEU 666.A O no hydrogen 2.641 N/A THR 670.A OG1 GLU 667.A O no hydrogen 2.976 N/A PHE 671.A N ALA 668.A O no hydrogen 3.205 N/A HIS 672.A ND1 THR 91.A OG1 no hydrogen 2.760 N/A HIS 672.A NE2 TYR 312.A O no hydrogen 2.781 N/A LYS 673.A N THR 91.A OG1 no hydrogen 3.023 N/A