Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rgx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N SER 1.A O no hydrogen 2.749 N/A ILE 6.A N LEU 2.A O no hydrogen 2.888 N/A HIS 7.A N TYR 3.A O no hydrogen 2.994 N/A HIS 7.A ND1 TYR 3.A O no hydrogen 2.862 N/A GLN 8.A N ARG 4.A O no hydrogen 2.921 N/A GLN 8.A NE2 SER 67.A OG no hydrogen 2.682 N/A LEU 9.A N GLU 5.A O no hydrogen 2.985 N/A ILE 10.A N ILE 6.A O no hydrogen 2.958 N/A SER 11.A N HIS 7.A O no hydrogen 2.949 N/A SER 11.A OG GLN 8.A O no hydrogen 2.814 N/A SER 11.A OG SER 64.A OG no hydrogen 3.175 N/A PHE 12.A N GLN 8.A O no hydrogen 2.984 N/A LYS 13.A N LEU 9.A O no hydrogen 2.935 N/A LYS 13.A NZ LEU 22.A O no hydrogen 2.939 N/A LYS 13.A NZ TRP 25.A O no hydrogen 2.781 N/A ASP 14.A N ILE 10.A O no hydrogen 2.892 N/A VAL 15.A N SER 11.A O no hydrogen 3.345 N/A VAL 15.A N PHE 12.A O no hydrogen 3.159 N/A LEU 16.A N LYS 13.A O no hydrogen 3.223 N/A LYS 19.A NZ LEU 16.A O no hydrogen 3.185 N/A ASN 20.A N ASP 18.A OD1 no hydrogen 2.846 N/A TRP 25.A N LEU 22.A O no hydrogen 2.910 N/A TRP 25.A NE1 ASP 35.A O no hydrogen 2.949 N/A SER 26.A OG SER 27.A O no hydrogen 3.189 N/A LYS 29.A NZ THR 33.A OG1 no hydrogen 2.923 N/A ASN 30.A ND2 ASP 42.A OD1 no hydrogen 2.982 N/A CYS 32.A N ASN 30.A OD1 no hydrogen 2.841 N/A CYS 32.A SG ASP 42.A OD1 no hydrogen 3.614 N/A THR 33.A N ASN 30.A O no hydrogen 2.933 N/A THR 33.A OG1 ASN 30.A O no hydrogen 2.890 N/A PHE 34.A N PRO 31.A O no hydrogen 2.845 N/A ASP 35.A N ASP 24.A OD2 no hydrogen 2.974 N/A THR 38.A N SER 46.A O no hydrogen 2.932 N/A ARG 40.A N LYS 43.A O no hydrogen 2.887 N/A ARG 40.A NH2 GLU 72.A OE2 no hydrogen 2.848 N/A LYS 43.A N ARG 40.A O no hydrogen 2.992 N/A VAL 44.A N GLU 5.A OE2 no hydrogen 3.353 N/A THR 45.A N THR 38.A O no hydrogen 2.872 N/A THR 45.A OG1 THR 38.A O no hydrogen 3.347 N/A SER 46.A N THR 38.A O no hydrogen 3.378 N/A SER 46.A OG SER 73.A O no hydrogen 3.256 N/A SER 46.A OG SER 73.A OG no hydrogen 2.574 N/A ILE 47.A N SER 73.A O no hydrogen 3.142 N/A ASP 48.A N GLY 36.A O no hydrogen 2.802 N/A LEU 49.A N PHE 75.A O no hydrogen 2.912 N/A SER 50.A N ASP 48.A OD2 no hydrogen 2.945 N/A SER 50.A OG ASP 48.A OD2 no hydrogen 2.788 N/A SER 51.A N SER 77.A O no hydrogen 2.832 N/A LEU 54.A N LYS 52.A O no hydrogen 2.772 N/A LEU 54.A N SER 79.A O no hydrogen 3.125 N/A PHE 58.A N ASN 82.A O no hydrogen 2.943 N/A ALA 60.A N GLY 57.A O no hydrogen 3.155 N/A SER 62.A N PHE 58.A O no hydrogen 2.851 N/A SER 62.A OG PHE 58.A O no hydrogen 3.112 N/A SER 62.A OG SER 59.A O no hydrogen 3.134 N/A SER 63.A N SER 59.A O no hydrogen 2.919 N/A SER 63.A OG SER 59.A O no hydrogen 2.412 N/A SER 64.A N ALA 60.A O no hydrogen 2.931 N/A SER 64.A OG SER 11.A OG no hydrogen 3.175 N/A SER 64.A OG ALA 60.A O no hydrogen 3.514 N/A LEU 65.A N VAL 61.A O no hydrogen 2.834 N/A LEU 66.A N VAL 61.A O no hydrogen 3.070 N/A SER 67.A OG SER 63.A O no hydrogen 2.685 N/A SER 67.A OG SER 64.A O no hydrogen 3.399 N/A LEU 68.A N LEU 65.A O no hydrogen 3.125 N/A LEU 71.A N LEU 68.A O no hydrogen 3.309 N/A GLU 72.A N THR 45.A O no hydrogen 2.707 N/A SER 73.A N THR 45.A O no hydrogen 3.265 N/A SER 73.A OG SER 46.A OG no hydrogen 2.574 N/A LEU 74.A N SER 96.A O no hydrogen 3.015 N/A PHE 75.A N ILE 47.A O no hydrogen 2.822 N/A LEU 76.A N ASP 98.A O no hydrogen 2.808 N/A SER 77.A N SER 50.A OG no hydrogen 3.341 N/A SER 77.A OG SER 100.A O no hydrogen 3.546 N/A SER 77.A OG SER 100.A OG no hydrogen 2.927 N/A ASN 78.A N SER 100.A O no hydrogen 3.024 N/A SER 79.A N ASN 102.A OD1 no hydrogen 2.989 N/A SER 79.A OG LEU 49.A O no hydrogen 2.913 N/A SER 79.A OG SER 77.A O no hydrogen 3.477 N/A ILE 81.A N ASN 102.A OD1 no hydrogen 3.143 N/A ASN 82.A N VAL 56.A O no hydrogen 3.093 N/A SER 84.A OG SER 105.A O no hydrogen 2.916 N/A CYS 90.A SG SER 91.A O no hydrogen 3.816 N/A SER 91.A N LEU 66.A O no hydrogen 3.458 N/A SER 91.A OG LEU 68.A O no hydrogen 2.573 N/A SER 93.A OG LEU 71.A O no hydrogen 2.804 N/A LEU 94.A N SER 91.A O no hydrogen 3.395 N/A THR 95.A N GLU 72.A O no hydrogen 2.781 N/A THR 95.A OG1 GLU 72.A O no hydrogen 3.353 N/A THR 95.A OG1 SER 96.A OG no hydrogen 3.330 N/A SER 96.A N GLU 72.A O no hydrogen 3.368 N/A SER 96.A OG THR 95.A OG1 no hydrogen 3.330 N/A LEU 97.A N PHE 122.A O no hydrogen 2.988 N/A ASP 98.A N LEU 74.A O no hydrogen 2.934 N/A LEU 99.A N ASN 124.A O no hydrogen 2.801 N/A SER 100.A N ASP 98.A OD1 no hydrogen 2.977 N/A SER 100.A OG SER 77.A OG no hydrogen 2.927 N/A SER 100.A OG ASP 98.A OD1 no hydrogen 2.985 N/A ARG 101.A N SER 126.A O no hydrogen 2.846 N/A ASN 102.A N SER 127.A O no hydrogen 3.158 N/A ASN 102.A ND2 LEU 76.A O no hydrogen 2.824 N/A ASN 102.A ND2 LEU 99.A O no hydrogen 2.755 N/A SER 103.A N ILE 81.A O no hydrogen 2.771 N/A LEU 104.A N ASN 128.A OD1 no hydrogen 2.830 N/A SER 105.A N GLY 83.A O no hydrogen 2.965 N/A VAL 108.A N ASP 131.A O no hydrogen 2.720 N/A THR 110.A N PRO 107.A O no hydrogen 2.982 N/A THR 110.A OG1 PRO 107.A O no hydrogen 2.768 N/A LEU 111.A N VAL 108.A O no hydrogen 2.919 N/A THR 112.A N THR 109.A O no hydrogen 2.964 N/A THR 112.A OG1 THR 109.A O no hydrogen 3.305 N/A THR 112.A OG1 LEU 140.A O no hydrogen 2.804 N/A SER 113.A N THR 110.A O no hydrogen 2.924 N/A SER 113.A OG THR 110.A O no hydrogen 3.257 N/A LEU 114.A N LEU 111.A O no hydrogen 2.923 N/A GLY 115.A N THR 112.A O no hydrogen 2.935 N/A SER 116.A N SER 113.A O no hydrogen 2.959 N/A SER 116.A OG PHE 88.A O no hydrogen 3.042 N/A SER 116.A OG SER 113.A O no hydrogen 3.378 N/A CYS 117.A N LEU 114.A O no hydrogen 2.996 N/A LEU 120.A N CYS 117.A O no hydrogen 2.845 N/A LYS 121.A N THR 95.A O no hydrogen 2.747 N/A PHE 122.A N THR 95.A O no hydrogen 2.843 N/A LEU 123.A N VAL 147.A O no hydrogen 2.908 N/A ASN 124.A N LEU 97.A O no hydrogen 3.134 N/A VAL 125.A N ASP 149.A O no hydrogen 2.922 N/A SER 126.A N ASN 124.A OD1 no hydrogen 3.165 N/A SER 126.A OG ASN 124.A OD1 no hydrogen 2.854 N/A SER 127.A N SER 151.A O no hydrogen 2.975 N/A ASN 128.A ND2 LEU 99.A O no hydrogen 3.117 N/A ASN 128.A ND2 VAL 125.A O no hydrogen 2.847 N/A THR 129.A N LEU 104.A O no hydrogen 2.811 N/A THR 129.A OG1 LEU 104.A O no hydrogen 2.778 N/A LEU 130.A N ASN 153.A OD1 no hydrogen 2.947 N/A ASP 131.A N GLY 106.A O no hydrogen 2.968 N/A LEU 140.A N TRP 163.A O no hydrogen 2.973 N/A LEU 145.A N LEU 142.A O no hydrogen 3.223 N/A GLU 146.A N LYS 121.A O no hydrogen 2.706 N/A VAL 147.A N LYS 121.A O no hydrogen 3.072 N/A LEU 148.A N HIS 174.A O no hydrogen 2.967 N/A ASP 149.A N LEU 123.A O no hydrogen 2.931 N/A LEU 150.A N ALA 176.A O no hydrogen 2.853 N/A SER 151.A N ASP 149.A OD1 no hydrogen 2.893 N/A SER 151.A OG ASP 149.A OD1 no hydrogen 2.668 N/A ALA 152.A N SER 178.A O no hydrogen 2.728 N/A ASN 153.A N ASN 180.A OD1 no hydrogen 3.153 N/A ASN 153.A ND2 VAL 125.A O no hydrogen 3.141 N/A ASN 153.A ND2 LEU 150.A O no hydrogen 3.112 N/A ASN 153.A ND2 SER 151.A O no hydrogen 2.984 N/A SER 154.A N LEU 130.A O no hydrogen 2.827 N/A ILE 155.A N ASN 180.A OD1 no hydrogen 3.140 N/A GLY 157.A N LYS 181.A O no hydrogen 2.967 N/A ASN 159.A N SER 183.A O no hydrogen 2.914 N/A TRP 163.A N ASN 159.A O no hydrogen 3.268 N/A VAL 164.A N VAL 160.A O no hydrogen 2.903 N/A LEU 165.A N VAL 161.A O no hydrogen 2.903 N/A SER 166.A OG GLY 138.A O no hydrogen 3.355 N/A GLY 168.A N LEU 165.A O no hydrogen 3.025 N/A LEU 172.A N CYS 169.A O no hydrogen 3.382 N/A LYS 173.A N GLU 146.A O no hydrogen 2.728 N/A HIS 174.A N GLU 146.A O no hydrogen 3.012 N/A LEU 175.A N PHE 196.A O no hydrogen 2.900 N/A ALA 176.A N LEU 148.A O no hydrogen 3.072 N/A ILE 177.A N ASP 198.A O no hydrogen 2.990 N/A SER 178.A N SER 151.A OG no hydrogen 3.135 N/A GLY 179.A N SER 200.A O no hydrogen 3.052 N/A ASN 180.A ND2 LEU 150.A O no hydrogen 3.236 N/A ASN 180.A ND2 ILE 177.A O no hydrogen 2.886 N/A LYS 181.A N ILE 155.A O no hydrogen 2.806 N/A ILE 182.A N ASN 202.A OD1 no hydrogen 3.097 N/A SER 183.A N GLY 157.A O no hydrogen 2.869 N/A SER 183.A OG GLY 157.A O no hydrogen 3.412 N/A ASP 185.A N ASN 159.A OD1 no hydrogen 2.990 N/A VAL 188.A N PHE 210.A O no hydrogen 2.968 N/A SER 189.A N ASP 187.A OD1 no hydrogen 2.990 N/A SER 189.A OG ASP 187.A OD1 no hydrogen 2.807 N/A CYS 191.A N VAL 188.A O no hydrogen 2.952 N/A CYS 191.A SG CYS 169.A O no hydrogen 3.945 N/A ASN 193.A ND2 GLY 170.A O no hydrogen 2.981 N/A LEU 194.A N CYS 191.A O no hydrogen 3.199 N/A GLU 195.A N LYS 173.A O no hydrogen 2.764 N/A PHE 196.A N LYS 173.A O no hydrogen 3.001 N/A LEU 197.A N HIS 219.A O no hydrogen 2.921 N/A ASP 198.A N LEU 175.A O no hydrogen 2.885 N/A VAL 199.A N ASP 221.A O no hydrogen 2.993 N/A SER 200.A N ASP 198.A OD1 no hydrogen 2.873 N/A SER 200.A OG ASP 198.A OD1 no hydrogen 2.519 N/A SER 200.A OG ASP 221.A OD2 no hydrogen 3.422 N/A SER 201.A N SER 223.A O no hydrogen 2.911 N/A ASN 202.A N ASN 225.A OD1 no hydrogen 3.013 N/A ASN 202.A ND2 ILE 177.A O no hydrogen 3.130 N/A ASN 202.A ND2 VAL 199.A O no hydrogen 3.112 N/A ASN 203.A N ILE 182.A O no hydrogen 2.749 N/A PHE 204.A N ASN 225.A OD1 no hydrogen 3.113 N/A PHE 210.A N VAL 186.A O no hydrogen 2.743 N/A CYS 214.A N LEU 211.A O no hydrogen 3.164 N/A GLN 218.A N GLU 195.A O no hydrogen 2.794 N/A HIS 219.A N GLU 195.A O no hydrogen 2.900 N/A LEU 220.A N LEU 243.A O no hydrogen 2.922 N/A ASP 221.A N LEU 197.A O no hydrogen 2.982 N/A ILE 222.A N ASN 245.A O no hydrogen 2.905 N/A SER 223.A N ASP 221.A OD1 no hydrogen 2.922 N/A SER 223.A OG ASP 221.A OD1 no hydrogen 2.653 N/A GLY 224.A N SER 247.A O no hydrogen 2.892 N/A ASN 225.A N ASN 249.A OD1 no hydrogen 3.178 N/A ASN 225.A ND2 VAL 199.A O no hydrogen 3.248 N/A ASN 225.A ND2 ILE 222.A O no hydrogen 3.015 N/A LYS 226.A N PHE 204.A O no hydrogen 2.807 N/A LEU 227.A N ASN 249.A OD1 no hydrogen 3.100 N/A SER 232.A OG PRO 257.A O no hydrogen 2.886 N/A ARG 233.A N ASP 230.A OD1 no hydrogen 3.409 N/A ALA 234.A N ASP 230.A O no hydrogen 3.375 N/A ILE 235.A N PHE 231.A O no hydrogen 2.909 N/A SER 236.A OG ARG 233.A O no hydrogen 3.344 N/A THR 237.A OG1 GLY 212.A O no hydrogen 2.978 N/A CYS 238.A N ILE 235.A O no hydrogen 3.003 N/A LYS 242.A N GLN 218.A O no hydrogen 2.735 N/A LEU 243.A N GLN 218.A O no hydrogen 2.881 N/A LEU 244.A N TYR 265.A O no hydrogen 2.891 N/A ASN 245.A N LEU 220.A O no hydrogen 2.877 N/A ILE 246.A N SER 267.A O no hydrogen 3.144 N/A SER 247.A N ASN 245.A OD1 no hydrogen 3.215 N/A SER 247.A OG ASN 245.A OD1 no hydrogen 2.918 N/A SER 248.A N ALA 269.A O no hydrogen 2.878 N/A ASN 249.A N GLU 270.A O no hydrogen 3.328 N/A ASN 249.A ND2 ILE 222.A O no hydrogen 3.158 N/A ASN 249.A ND2 ILE 246.A O no hydrogen 3.028 N/A GLN 250.A N LEU 227.A O no hydrogen 2.899 N/A PHE 251.A N ASN 271.A OD1 no hydrogen 3.182 N/A SER 262.A OG THR 239.A O no hydrogen 2.943 N/A LEU 263.A N LEU 260.A O no hydrogen 3.409 N/A GLN 264.A N LYS 242.A O no hydrogen 2.715 N/A TYR 265.A N LYS 242.A O no hydrogen 2.893 N/A LEU 266.A N GLY 290.A O no hydrogen 2.975 N/A SER 267.A N LEU 244.A O no hydrogen 2.959 N/A LEU 268.A N ASP 292.A O no hydrogen 2.853 N/A GLU 270.A N SER 294.A O no hydrogen 2.781 N/A ASN 271.A N ASN 296.A OD1 no hydrogen 3.222 N/A ASN 271.A ND2 ILE 246.A O no hydrogen 3.295 N/A ASN 271.A ND2 LEU 268.A O no hydrogen 3.043 N/A LYS 272.A N PHE 251.A O no hydrogen 2.817 N/A PHE 273.A N ASN 296.A OD1 no hydrogen 3.024 N/A THR 274.A N GLY 253.A O no hydrogen 2.907 N/A LEU 281.A N PRO 278.A O no hydrogen 3.373 N/A SER 282.A N ASP 279.A O no hydrogen 2.935 N/A SER 282.A OG ASP 279.A O no hydrogen 2.861 N/A GLY 283.A N PHE 280.A O no hydrogen 2.958 N/A ALA 284.A N LEU 281.A O no hydrogen 2.907 N/A CYS 285.A N SER 282.A O no hydrogen 3.043 N/A CYS 285.A SG PHE 305.A O no hydrogen 3.720 N/A CYS 285.A SG SER 308.A OG no hydrogen 3.245 N/A THR 287.A N ALA 284.A O no hydrogen 3.071 N/A THR 287.A OG1 LEU 263.A O no hydrogen 2.900 N/A THR 287.A OG1 ALA 284.A O no hydrogen 3.265 N/A LEU 288.A N ALA 284.A O no hydrogen 2.773 N/A THR 289.A N GLN 264.A O no hydrogen 2.673 N/A THR 289.A OG1 GLN 264.A O no hydrogen 2.929 N/A GLY 290.A N GLN 264.A O no hydrogen 2.836 N/A LEU 291.A N SER 314.A O no hydrogen 2.917 N/A ASP 292.A N LEU 266.A O no hydrogen 2.897 N/A LEU 293.A N ALA 316.A O no hydrogen 2.848 N/A SER 294.A N ASP 292.A OD1 no hydrogen 2.914 N/A SER 294.A OG ASP 292.A OD1 no hydrogen 2.962 N/A SER 294.A OG SER 318.A OG no hydrogen 3.297 N/A GLY 295.A N SER 318.A O no hydrogen 2.861 N/A ASN 296.A ND2 LEU 268.A O no hydrogen 2.973 N/A ASN 296.A ND2 LEU 293.A O no hydrogen 2.946 N/A HIS 297.A N PHE 273.A O no hydrogen 2.824 N/A PHE 298.A N ASN 320.A OD1 no hydrogen 2.836 N/A TYR 299.A N GLY 275.A O no hydrogen 3.107 N/A PHE 306.A N PRO 303.A O no hydrogen 3.211 N/A GLY 307.A N PRO 304.A O no hydrogen 2.950 N/A SER 308.A N PHE 305.A O no hydrogen 2.893 N/A SER 308.A OG PHE 305.A O no hydrogen 2.729 N/A CYS 309.A N PHE 306.A O no hydrogen 3.030 N/A SER 310.A OG SER 308.A O no hydrogen 3.158 N/A GLU 313.A N THR 289.A O no hydrogen 2.706 N/A SER 314.A N THR 289.A O no hydrogen 3.249 N/A LEU 315.A N VAL 339.A O no hydrogen 2.958 N/A ALA 316.A N LEU 291.A O no hydrogen 2.895 N/A LEU 317.A N ASP 341.A O no hydrogen 2.857 N/A SER 318.A N SER 294.A OG no hydrogen 3.256 N/A SER 318.A OG SER 294.A OG no hydrogen 3.297 N/A SER 319.A N SER 343.A O no hydrogen 2.929 N/A ASN 320.A N ASN 345.A OD1 no hydrogen 3.277 N/A ASN 320.A ND2 LEU 293.A O no hydrogen 3.147 N/A ASN 320.A ND2 LEU 317.A O no hydrogen 3.267 N/A ASN 321.A N PHE 298.A O no hydrogen 2.846 N/A PHE 322.A N ASN 345.A OD1 no hydrogen 2.882 N/A SER 323.A N GLY 300.A O no hydrogen 2.904 N/A MET 328.A N LEU 326.A O no hydrogen 2.694 N/A THR 330.A N PRO 327.A O no hydrogen 2.949 N/A LEU 331.A N PRO 327.A O no hydrogen 3.046 N/A LEU 332.A N MET 328.A O no hydrogen 2.940 N/A LYS 333.A N THR 330.A O no hydrogen 2.970 N/A MET 334.A N LEU 331.A O no hydrogen 3.180 N/A ARG 335.A N LYS 333.A O no hydrogen 2.864 N/A LEU 337.A N MET 334.A O no hydrogen 3.168 N/A LYS 338.A N GLU 313.A O no hydrogen 2.702 N/A VAL 339.A N GLU 313.A O no hydrogen 2.969 N/A LEU 340.A N THR 364.A O no hydrogen 2.991 N/A ASP 341.A N LEU 315.A O no hydrogen 2.952 N/A LEU 342.A N ASP 366.A O no hydrogen 2.855 N/A SER 343.A N ASP 341.A OD1 no hydrogen 3.103 N/A SER 343.A OG ASP 341.A OD1 no hydrogen 2.740 N/A PHE 344.A N SER 368.A O no hydrogen 2.913 N/A ASN 345.A N SER 369.A O no hydrogen 3.271 N/A ASN 345.A ND2 LEU 317.A O no hydrogen 3.065 N/A ASN 345.A ND2 LEU 342.A O no hydrogen 2.919 N/A GLU 346.A N PHE 322.A O no hydrogen 2.831 N/A PHE 347.A N ASN 370.A OD1 no hydrogen 2.954 N/A SER 348.A N GLY 324.A O no hydrogen 2.888 N/A LEU 355.A N PRO 352.A O no hydrogen 3.201 N/A THR 356.A N GLU 353.A O no hydrogen 2.929 N/A THR 356.A OG1 GLU 353.A O no hydrogen 3.072 N/A ASN 357.A N SER 354.A O no hydrogen 2.945 N/A ASN 357.A ND2 SER 354.A O no hydrogen 3.515 N/A LEU 358.A N LEU 355.A O no hydrogen 2.921 N/A SER 359.A N THR 356.A O no hydrogen 2.954 N/A SER 359.A OG THR 356.A O no hydrogen 3.070 N/A SER 359.A OG LEU 380.A O no hydrogen 2.514 N/A ALA 360.A N ASN 357.A O no hydrogen 2.940 N/A SER 361.A N LEU 358.A O no hydrogen 2.972 N/A SER 361.A OG LEU 358.A O no hydrogen 3.427 N/A LEU 362.A N LEU 358.A O no hydrogen 3.026 N/A LEU 363.A N LYS 338.A O no hydrogen 2.723 N/A THR 364.A N LYS 338.A O no hydrogen 3.064 N/A THR 364.A OG1 GLU 390.A OE2 no hydrogen 2.802 N/A LEU 365.A N GLU 390.A O no hydrogen 2.895 N/A ASP 366.A N LEU 340.A O no hydrogen 2.811 N/A LEU 367.A N TYR 392.A O no hydrogen 2.865 N/A SER 368.A N ASP 366.A OD1 no hydrogen 2.963 N/A SER 368.A OG ASP 366.A OD1 no hydrogen 3.145 N/A SER 368.A OG GLY 586.A O no hydrogen 3.162 N/A SER 369.A N GLN 394.A O no hydrogen 2.857 N/A SER 369.A OG GLY 586.A O no hydrogen 2.436 N/A ASN 370.A N ASN 396.A OD1 no hydrogen 3.196 N/A ASN 370.A ND2 LEU 342.A O no hydrogen 3.075 N/A ASN 370.A ND2 LEU 367.A O no hydrogen 2.967 N/A ASN 371.A N PHE 347.A O no hydrogen 2.825 N/A PHE 372.A N ASN 396.A OD1 no hydrogen 3.279 N/A SER 373.A N GLY 349.A O no hydrogen 3.158 N/A ASN 379.A ND2 GLU 353.A OE1 no hydrogen 3.251 N/A LEU 380.A N LEU 377.A O no hydrogen 3.258 N/A LYS 385.A NZ GLU 411.A OE1 no hydrogen 3.399 N/A THR 387.A N SER 359.A O no hydrogen 2.970 N/A THR 387.A OG1 LEU 362.A O no hydrogen 3.204 N/A GLN 389.A N LEU 363.A O no hydrogen 2.884 N/A GLU 390.A N LEU 363.A O no hydrogen 3.005 N/A LEU 391.A N SER 414.A O no hydrogen 2.894 N/A TYR 392.A N LEU 365.A O no hydrogen 2.923 N/A LEU 393.A N HIS 416.A O no hydrogen 2.819 N/A GLN 394.A N GLN 394.A OE1 no hydrogen 2.610 N/A GLN 394.A NE2 GLN 585.A O no hydrogen 2.840 N/A ASN 395.A N SER 418.A O no hydrogen 2.797 N/A ASN 395.A ND2 SER 369.A OG no hydrogen 3.056 N/A ASN 395.A ND2 GLN 591.A OE1 no hydrogen 2.999 N/A ASN 396.A N PHE 419.A O no hydrogen 3.250 N/A ASN 396.A N ASN 420.A OD1 no hydrogen 3.174 N/A ASN 396.A ND2 LEU 367.A O no hydrogen 3.323 N/A ASN 396.A ND2 LEU 393.A O no hydrogen 2.841 N/A GLY 397.A N PHE 372.A O no hydrogen 2.704 N/A PHE 398.A N ASN 420.A OD1 no hydrogen 2.976 N/A THR 399.A N GLY 374.A O no hydrogen 2.917 N/A THR 405.A OG1 PRO 378.A O no hydrogen 2.362 N/A LEU 406.A N PRO 403.A O no hydrogen 3.059 N/A SER 407.A N PRO 404.A O no hydrogen 2.907 N/A SER 407.A OG PRO 404.A O no hydrogen 2.856 N/A ASN 408.A N THR 405.A O no hydrogen 2.891 N/A CYS 409.A N LEU 406.A O no hydrogen 3.012 N/A CYS 409.A SG LEU 406.A O no hydrogen 3.617 N/A SER 410.A OG GLU 411.A OE1 no hydrogen 3.205 N/A LEU 412.A N CYS 409.A O no hydrogen 3.098 N/A VAL 413.A N GLN 389.A O no hydrogen 2.642 N/A SER 414.A N GLN 389.A O no hydrogen 3.048 N/A SER 414.A OG ASP 438.A OD2 no hydrogen 2.863 N/A LEU 415.A N ASP 438.A O no hydrogen 2.951 N/A HIS 416.A N LEU 391.A O no hydrogen 2.984 N/A LEU 417.A N LYS 440.A O no hydrogen 2.836 N/A PHE 419.A N TRP 442.A O no hydrogen 2.799 N/A ASN 420.A N LEU 443.A O no hydrogen 3.268 N/A ASN 420.A ND2 LEU 393.A O no hydrogen 3.012 N/A ASN 420.A ND2 LEU 417.A O no hydrogen 3.047 N/A TYR 421.A N PHE 398.A O no hydrogen 2.888 N/A LEU 422.A N ASN 444.A OD1 no hydrogen 2.813 N/A SER 423.A N GLY 400.A O no hydrogen 2.956 N/A SER 423.A OG GLY 400.A O no hydrogen 3.438 N/A SER 429.A OG PRO 404.A O no hydrogen 2.762 N/A LEU 430.A N PRO 427.A O no hydrogen 3.172 N/A GLY 431.A N SER 428.A O no hydrogen 2.932 N/A SER 432.A N SER 429.A O no hydrogen 2.900 N/A SER 432.A OG SER 429.A O no hydrogen 3.101 N/A LEU 433.A N LEU 430.A O no hydrogen 3.268 N/A LYS 435.A NZ GLU 411.A OE2 no hydrogen 2.948 N/A LEU 436.A N LEU 433.A O no hydrogen 3.036 N/A ARG 437.A N VAL 413.A O no hydrogen 2.785 N/A ASP 438.A N VAL 413.A O no hydrogen 3.146 N/A LEU 439.A N THR 462.A O no hydrogen 2.934 N/A LYS 440.A N LEU 415.A O no hydrogen 2.942 N/A LYS 440.A NZ GLU 583.A OE2 no hydrogen 3.361 N/A LEU 441.A N ILE 464.A O no hydrogen 2.863 N/A TRP 442.A N SER 418.A OG no hydrogen 3.222 N/A TRP 442.A NE1 GLU 583.A OE1 no hydrogen 3.060 N/A LEU 443.A N ASP 466.A O no hydrogen 2.784 N/A ASN 444.A N PHE 467.A O no hydrogen 3.256 N/A ASN 444.A ND2 LEU 417.A O no hydrogen 3.046 N/A ASN 444.A ND2 LEU 441.A O no hydrogen 3.181 N/A MET 445.A N LEU 422.A O no hydrogen 2.711 N/A LEU 446.A N ASN 468.A OD1 no hydrogen 2.898 N/A GLU 447.A N GLY 424.A O no hydrogen 2.834 N/A GLU 453.A N GLU 453.A OE2 no hydrogen 2.518 N/A LEU 454.A N PRO 451.A O no hydrogen 3.168 N/A MET 455.A N GLN 452.A O no hydrogen 2.891 N/A TYR 456.A N GLU 453.A O no hydrogen 2.908 N/A VAL 457.A N LEU 454.A O no hydrogen 2.899 N/A THR 459.A OG1 SER 434.A O no hydrogen 3.194 N/A THR 459.A OG1 LEU 436.A O no hydrogen 2.806 N/A LEU 460.A N VAL 457.A O no hydrogen 3.344 N/A GLU 461.A N ARG 437.A O no hydrogen 2.790 N/A THR 462.A N ARG 437.A O no hydrogen 2.995 N/A THR 462.A OG1 ASP 438.A OD1 no hydrogen 3.344 N/A LEU 463.A N TRP 486.A O no hydrogen 2.995 N/A ILE 464.A N LEU 439.A O no hydrogen 2.962 N/A LEU 465.A N SER 488.A O no hydrogen 2.797 N/A PHE 467.A N SER 490.A O no hydrogen 2.965 N/A ASN 468.A ND2 LEU 441.A O no hydrogen 3.139 N/A ASN 468.A ND2 LEU 465.A O no hydrogen 3.204 N/A ASP 469.A N LEU 446.A O no hydrogen 2.755 N/A LEU 470.A N ASN 492.A OD1 no hydrogen 2.922 N/A THR 471.A N GLY 448.A O no hydrogen 2.917 N/A THR 471.A OG1 GLY 448.A O no hydrogen 3.226 N/A GLY 477.A N GLN 452.A OE1 no hydrogen 2.830 N/A LEU 478.A N PRO 475.A O no hydrogen 3.121 N/A SER 479.A N SER 476.A O no hydrogen 2.924 N/A SER 479.A OG SER 476.A O no hydrogen 2.583 N/A ASN 480.A N GLY 477.A O no hydrogen 2.893 N/A CYS 481.A N LEU 478.A O no hydrogen 2.979 N/A CYS 481.A SG LEU 454.A O no hydrogen 3.220 N/A CYS 481.A SG VAL 457.A O no hydrogen 3.577 N/A THR 482.A N ASN 480.A O no hydrogen 3.050 N/A LEU 484.A N CYS 481.A O no hydrogen 3.188 N/A ASN 485.A N GLU 461.A O no hydrogen 2.715 N/A TRP 486.A N GLU 461.A O no hydrogen 3.186 N/A ILE 487.A N ILE 510.A O no hydrogen 2.863 N/A SER 488.A N LEU 463.A O no hydrogen 2.906 N/A SER 488.A OG ASP 466.A OD1 no hydrogen 2.872 N/A SER 488.A OG ASP 466.A OD2 no hydrogen 2.548 N/A LEU 489.A N LYS 512.A O no hydrogen 2.893 N/A SER 490.A N ASP 466.A OD2 no hydrogen 3.080 N/A SER 490.A OG ASP 466.A OD2 no hydrogen 2.712 N/A ASN 491.A N SER 514.A O no hydrogen 2.943 N/A ASN 491.A ND2 SER 490.A OG no hydrogen 2.999 N/A ASN 492.A N ASN 516.A OD1 no hydrogen 3.134 N/A ASN 492.A ND2 LEU 465.A O no hydrogen 3.000 N/A ASN 492.A ND2 LEU 489.A O no hydrogen 2.919 N/A ARG 493.A N LEU 470.A O no hydrogen 2.690 N/A LEU 494.A N ASN 516.A OD1 no hydrogen 2.892 N/A THR 495.A N GLY 472.A O no hydrogen 2.854 N/A THR 495.A OG1 GLY 472.A O no hydrogen 3.270 N/A ILE 502.A N PRO 499.A O no hydrogen 3.083 N/A GLY 503.A N LYS 500.A O no hydrogen 2.978 N/A ARG 504.A N TRP 501.A O no hydrogen 2.902 N/A LEU 505.A N ILE 502.A O no hydrogen 3.232 N/A ASN 507.A ND2 THR 482.A O no hydrogen 3.141 N/A LEU 508.A N LEU 505.A O no hydrogen 3.081 N/A ALA 509.A N ASN 485.A O no hydrogen 2.829 N/A ILE 510.A N ASN 485.A O no hydrogen 3.230 N/A LEU 511.A N TRP 534.A O no hydrogen 2.969 N/A LYS 512.A N ILE 487.A O no hydrogen 2.993 N/A LYS 512.A NZ SER 514.A OG no hydrogen 3.137 N/A LYS 512.A NZ ASP 536.A OD2 no hydrogen 2.924 N/A LYS 512.A NZ ASN 580.A OD1 no hydrogen 2.855 N/A LEU 513.A N ASP 536.A O no hydrogen 2.771 N/A ASN 515.A N ASN 538.A O no hydrogen 2.942 N/A ASN 515.A ND2 ASN 491.A OD1 no hydrogen 2.754 N/A ASN 516.A ND2 LEU 489.A O no hydrogen 2.989 N/A ASN 516.A ND2 LEU 513.A O no hydrogen 3.316 N/A SER 517.A N LEU 494.A O no hydrogen 2.884 N/A PHE 518.A N ASN 540.A OD1 no hydrogen 2.965 N/A SER 519.A N GLY 496.A O no hydrogen 2.855 N/A ASN 521.A ND2 ASN 543.A O no hydrogen 3.383 N/A ASN 521.A ND2 ASN 543.A OD1 no hydrogen 2.893 N/A GLU 525.A N GLU 525.A OE1 no hydrogen 2.700 N/A LEU 526.A N PRO 523.A O no hydrogen 2.873 N/A GLY 527.A N ALA 524.A O no hydrogen 2.905 N/A ASP 528.A N GLU 525.A O no hydrogen 2.904 N/A CYS 529.A N LEU 526.A O no hydrogen 3.184 N/A CYS 529.A SG ILE 502.A O no hydrogen 3.407 N/A SER 531.A OG GLU 506.A O no hydrogen 2.657 N/A LEU 532.A N CYS 529.A O no hydrogen 3.384 N/A ILE 533.A N ALA 509.A O no hydrogen 2.982 N/A TRP 534.A N ALA 509.A O no hydrogen 3.162 N/A LEU 535.A N PHE 620.A O no hydrogen 2.921 N/A ASP 536.A N LEU 511.A O no hydrogen 2.916 N/A LEU 537.A N ASP 622.A O no hydrogen 2.775 N/A ASN 538.A N ASP 536.A OD1 no hydrogen 3.415 N/A ASN 538.A ND2 ASP 536.A OD1 no hydrogen 2.665 N/A THR 539.A N SER 624.A O no hydrogen 2.876 N/A THR 539.A OG1 ASN 538.A OD1 no hydrogen 2.776 N/A THR 539.A OG1 HIS 576.A ND1 no hydrogen 3.161 N/A ASN 540.A N TYR 625.A O no hydrogen 3.187 N/A ASN 540.A ND2 LEU 513.A O no hydrogen 2.920 N/A ASN 540.A ND2 LEU 537.A O no hydrogen 3.106 N/A LEU 541.A N PHE 518.A O no hydrogen 2.846 N/A PHE 542.A N ASN 626.A OD1 no hydrogen 3.042 N/A ASN 543.A N GLY 520.A O no hydrogen 2.874 N/A MET 550.A N PRO 547.A O no hydrogen 2.935 N/A PHE 551.A N ALA 548.A O no hydrogen 2.935 N/A LYS 552.A N ALA 549.A O no hydrogen 2.942 N/A LYS 552.A NZ ASP 528.A OD1 no hydrogen 3.346 N/A LYS 552.A NZ ASP 528.A OD2 no hydrogen 3.118 N/A GLN 553.A N PHE 551.A O no hydrogen 2.649 N/A GLN 553.A NE2 GLY 527.A O no hydrogen 3.135 N/A SER 554.A OG PHE 551.A O no hydrogen 2.707 N/A VAL 564.A N LEU 582.A O no hydrogen 2.847 N/A TYR 565.A N VAL 607.A O no hydrogen 2.544 N/A ILE 566.A N ASN 580.A O no hydrogen 2.890 N/A LYS 567.A NZ ASN 568.A O no hydrogen 3.204 N/A ASN 568.A N ALA 578.A O no hydrogen 2.937 N/A ASN 568.A ND2 CYS 575.A O no hydrogen 3.359 N/A ASN 568.A ND2 GLY 577.A O no hydrogen 2.970 N/A GLY 570.A N ASN 568.A OD1 no hydrogen 3.252 N/A MET 571.A N ASP 569.A OD2 no hydrogen 3.101 N/A LYS 572.A NZ ASN 602.A OD1 no hydrogen 2.645 N/A CYS 575.A SG ASN 568.A OD1 no hydrogen 2.981 N/A HIS 576.A ND1 THR 539.A OG1 no hydrogen 3.161 N/A ALA 578.A N ASP 622.A OD2 no hydrogen 2.835 N/A ASN 580.A N ILE 566.A O no hydrogen 2.919 N/A LEU 582.A N VAL 564.A O no hydrogen 2.877 N/A PHE 584.A N ARG 562.A O no hydrogen 3.277 N/A GLN 585.A N GLU 583.A OE2 no hydrogen 2.840 N/A ARG 588.A NE GLN 591.A OE1 no hydrogen 2.936 N/A ARG 588.A NH1 ASN 345.A O no hydrogen 3.356 N/A ARG 588.A NH2 ASN 345.A O no hydrogen 3.566 N/A SER 589.A OG GLU 590.A OE1 no hydrogen 3.120 N/A GLN 591.A N ARG 588.A O no hydrogen 3.071 N/A LEU 592.A N SER 589.A O no hydrogen 2.893 N/A ASN 593.A ND2 GLU 590.A O no hydrogen 2.785 N/A ARG 594.A N GLN 591.A O no hydrogen 2.895 N/A ARG 594.A NH2 ASN 396.A O no hydrogen 2.666 N/A LEU 595.A N LEU 592.A O no hydrogen 2.925 N/A SER 596.A N ASN 593.A O no hydrogen 2.946 N/A SER 596.A OG ASN 593.A O no hydrogen 2.882 N/A ARG 598.A N LEU 595.A O no hydrogen 2.660 N/A ARG 598.A NH1 ASN 444.A O no hydrogen 3.228 N/A ARG 598.A NH1 PHE 467.A O no hydrogen 2.843 N/A ARG 598.A NH2 ASN 444.A O no hydrogen 2.882 N/A ASN 599.A N LEU 595.A O no hydrogen 2.830 N/A CYS 601.A N ASN 599.A OD1 no hydrogen 3.126 N/A CYS 601.A SG ASN 599.A OD1 no hydrogen 3.385 N/A SER 605.A OG LYS 567.A O no hydrogen 3.400 N/A ARG 606.A N THR 604.A O no hydrogen 3.197 N/A VAL 607.A N TYR 565.A O no hydrogen 2.876 N/A ASP 613.A N ASN 615.A OD1 no hydrogen 2.981 N/A ASN 614.A ND2 ASP 613.A OD2 no hydrogen 3.411 N/A SER 617.A OG MET 618.A O no hydrogen 3.453 N/A MET 619.A N ILE 533.A O no hydrogen 2.784 N/A PHE 620.A N ILE 533.A O no hydrogen 2.987 N/A LEU 621.A N ILE 644.A O no hydrogen 3.089 N/A ASP 622.A N LEU 535.A O no hydrogen 3.078 N/A MET 623.A N ASN 646.A O no hydrogen 2.849 N/A SER 624.A N ASP 622.A OD1 no hydrogen 2.971 N/A SER 624.A OG ASP 622.A OD1 no hydrogen 2.695 N/A TYR 625.A N GLY 648.A O no hydrogen 2.984 N/A ASN 626.A N HIS 649.A O no hydrogen 3.234 N/A ASN 626.A N ASN 650.A OD1 no hydrogen 3.235 N/A ASN 626.A ND2 LEU 537.A O no hydrogen 3.068 N/A ASN 626.A ND2 MET 623.A O no hydrogen 3.021 N/A MET 627.A N PHE 542.A O no hydrogen 2.889 N/A LEU 628.A N ASN 650.A OD1 no hydrogen 3.101 N/A SER 629.A N GLY 544.A O no hydrogen 2.820 N/A SER 629.A OG GLY 544.A O no hydrogen 3.516 N/A GLU 635.A N GLU 635.A OE1 no hydrogen 2.514 N/A ILE 636.A N PRO 633.A O no hydrogen 2.688 N/A GLY 637.A N LYS 634.A O no hydrogen 2.920 N/A SER 638.A N GLU 635.A O no hydrogen 2.942 N/A SER 638.A OG GLU 635.A O no hydrogen 2.737 N/A LEU 642.A N MET 639.A O no hydrogen 3.029 N/A PHE 643.A N MET 619.A O no hydrogen 2.985 N/A LEU 645.A N ILE 668.A O no hydrogen 3.105 N/A ASN 646.A N LEU 621.A O no hydrogen 2.852 N/A ASN 646.A ND2 ASP 622.A OD2 no hydrogen 3.425 N/A LEU 647.A N ASP 670.A O no hydrogen 2.772 N/A GLY 648.A N ASN 646.A OD1 no hydrogen 3.015 N/A HIS 649.A N SER 672.A O no hydrogen 2.996 N/A ASN 650.A N SER 673.A O no hydrogen 3.208 N/A ASN 650.A ND2 MET 623.A O no hydrogen 3.324 N/A ASN 650.A ND2 LEU 647.A O no hydrogen 2.897 N/A ASP 651.A N LEU 628.A O no hydrogen 2.796 N/A ILE 652.A N ASN 674.A OD1 no hydrogen 3.087 N/A SER 653.A N GLY 630.A O no hydrogen 2.892 N/A GLU 659.A N GLU 659.A OE1 no hydrogen 2.671 N/A VAL 660.A N PRO 657.A O no hydrogen 3.069 N/A GLY 661.A N ASP 658.A O no hydrogen 2.946 N/A ASP 662.A N GLU 659.A O no hydrogen 2.850 N/A LEU 663.A N VAL 660.A O no hydrogen 3.128 N/A ARG 664.A N ASP 662.A O no hydrogen 2.698 N/A LEU 666.A N LEU 663.A O no hydrogen 3.132 N/A ASN 667.A N PHE 643.A O no hydrogen 2.803 N/A ASN 667.A ND2 MET 689.A O no hydrogen 2.807 N/A ILE 668.A N PHE 643.A O no hydrogen 3.112 N/A LEU 669.A N GLU 692.A O no hydrogen 3.081 N/A ASP 670.A N LEU 645.A O no hydrogen 2.920 N/A LEU 671.A N ASP 694.A O no hydrogen 2.907 N/A SER 672.A N ASP 670.A OD1 no hydrogen 2.909 N/A SER 672.A OG ASP 670.A OD1 no hydrogen 2.728 N/A SER 673.A N SER 696.A O no hydrogen 2.912 N/A ASN 674.A N ASN 697.A O no hydrogen 2.977 N/A ASN 674.A ND2 LEU 647.A O no hydrogen 3.226 N/A ASN 674.A ND2 LEU 671.A O no hydrogen 3.091 N/A LYS 675.A N ILE 652.A O no hydrogen 2.806 N/A LEU 676.A N ASN 698.A OD1 no hydrogen 2.963 N/A ASP 677.A N GLY 654.A O no hydrogen 2.859 N/A MET 684.A N PRO 681.A O no hydrogen 3.018 N/A SER 685.A N GLN 682.A O no hydrogen 2.917 N/A SER 685.A OG GLN 682.A O no hydrogen 3.478 N/A ALA 686.A N ALA 683.A O no hydrogen 2.942 N/A LEU 687.A N MET 684.A O no hydrogen 3.425 N/A LEU 690.A N GLN 709.A OE1 no hydrogen 3.080 N/A THR 691.A N ASN 667.A O no hydrogen 2.695 N/A THR 691.A OG1 ASN 667.A O no hydrogen 3.376 N/A GLU 692.A N ASN 667.A O no hydrogen 3.139 N/A ASP 694.A N LEU 669.A O no hydrogen 2.905 N/A LEU 695.A N LYS 717.A O no hydrogen 2.972 N/A SER 696.A N ASP 694.A OD1 no hydrogen 3.004 N/A SER 696.A OG ASP 694.A OD1 no hydrogen 2.697 N/A ASN 697.A N LEU 719.A O no hydrogen 2.898 N/A ASN 698.A ND2 LEU 671.A O no hydrogen 2.965 N/A ASN 698.A ND2 LEU 695.A O no hydrogen 3.114 N/A ASN 698.A ND2 SER 696.A O no hydrogen 3.147 N/A ASN 699.A N LEU 676.A O no hydrogen 2.616 N/A LEU 700.A N ASN 721.A OD1 no hydrogen 2.792 N/A SER 701.A N GLY 678.A O no hydrogen 2.883 N/A GLY 702.A N GLY 723.A O no hydrogen 2.739 N/A ILE 704.A N CYS 725.A O no hydrogen 2.873 N/A GLN 709.A NE2 LEU 690.A O no hydrogen 2.881 N/A THR 712.A N GLN 709.A O no hydrogen 3.057 N/A THR 712.A OG1 GLN 709.A O no hydrogen 2.888 N/A PHE 713.A N PHE 710.A O no hydrogen 2.978 N/A LYS 717.A N PRO 714.A O no hydrogen 3.084 N/A PHE 718.A N PRO 715.A O no hydrogen 2.901 N/A LEU 719.A N ALA 716.A O no hydrogen 3.317 N/A ASN 721.A ND2 LEU 695.A O no hydrogen 3.160 N/A ASN 721.A ND2 PHE 718.A O no hydrogen 3.150 N/A ASN 721.A ND2 LEU 719.A O no hydrogen 3.029 N/A LEU 724.A N ASN 721.A O no hydrogen 2.862 N/A CYS 725.A N GLY 702.A O no hydrogen 3.091 N/A CYS 725.A SG GLY 702.A O no hydrogen 3.581 N/A GLY 726.A N PRO 730.A O no hydrogen 2.885 N/A LEU 729.A N GLY 726.A O no hydrogen 2.760 N/A