Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jz5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N GLU 27.A OE2 no hydrogen 3.078 N/A VAL 5.A N GLU 27.A O no hydrogen 3.135 N/A CYS 6.A N HIS 124.A O no hydrogen 2.832 N/A CYS 6.A SG GLN 29.A O no hydrogen 3.926 N/A ILE 7.A N GLN 29.A O no hydrogen 2.890 N/A ILE 8.A N VAL 126.A O no hydrogen 2.745 N/A GLY 9.A N ILE 31.A O no hydrogen 2.820 N/A PHE 10.A N SER 32.A OG no hydrogen 2.821 N/A ILE 15.A N PHE 12.A O no hydrogen 3.358 N/A VAL 18.A N ALA 14.A O no hydrogen 3.059 N/A ARG 19.A N ILE 15.A O no hydrogen 2.976 N/A GLU 20.A N PRO 16.A O no hydrogen 3.147 N/A LEU 21.A N LEU 17.A O no hydrogen 2.865 N/A ALA 22.A N VAL 18.A O no hydrogen 2.991 N/A ARG 23.A N ARG 19.A O no hydrogen 3.110 N/A ARG 23.A NE GLU 20.A OE2 no hydrogen 2.737 N/A ARG 23.A NH2 GLU 20.A OE2 no hydrogen 2.950 N/A THR 24.A N GLU 20.A O no hydrogen 3.033 N/A THR 24.A OG1 GLU 20.A O no hydrogen 3.136 N/A THR 24.A OG1 LEU 21.A O no hydrogen 3.298 N/A THR 24.A OG1 THR 26.A OG1 no hydrogen 2.941 N/A THR 24.A OG1 HIS 389.A NE2 no hydrogen 3.028 N/A GLN 25.A N ALA 22.A O no hydrogen 2.935 N/A THR 26.A N LEU 21.A O no hydrogen 2.931 N/A THR 26.A OG1 THR 24.A OG1 no hydrogen 2.941 N/A GLN 29.A N VAL 5.A O no hydrogen 2.938 N/A GLN 29.A NE2 ILE 30.A O no hydrogen 3.686 N/A GLN 29.A NE2 LYS 94.A O no hydrogen 2.713 N/A ILE 30.A N LYS 94.A O no hydrogen 2.988 N/A ILE 31.A N ILE 7.A O no hydrogen 2.853 N/A SER 32.A N ILE 96.A O no hydrogen 2.868 N/A GLY 36.A N ALA 33.A O no hydrogen 3.353 N/A SER 37.A N ASP 40.A OD2 no hydrogen 2.688 N/A SER 37.A OG ASP 40.A OD2 no hydrogen 3.398 N/A TRP 39.A N SER 37.A OG no hydrogen 3.092 N/A ASP 40.A N SER 37.A O no hydrogen 2.921 N/A ARG 41.A N SER 37.A O no hydrogen 3.269 N/A ARG 41.A NH1 SER 35.A O no hydrogen 3.351 N/A ARG 41.A NH1 GLU 44.A OE2 no hydrogen 2.895 N/A ARG 41.A NH2 SER 35.A O no hydrogen 2.896 N/A LEU 42.A N VAL 38.A O no hydrogen 2.897 N/A SER 43.A N TRP 39.A O no hydrogen 3.001 N/A GLU 44.A N ASP 40.A O no hydrogen 2.855 N/A SER 45.A N ARG 41.A O no hydrogen 3.033 N/A SER 45.A OG ARG 41.A O no hydrogen 3.157 N/A SER 45.A OG LEU 42.A O no hydrogen 3.508 N/A SER 45.A OG SER 140.A O no hydrogen 3.340 N/A GLY 46.A N SER 43.A O no hydrogen 3.215 N/A ARG 47.A N LEU 42.A O no hydrogen 2.659 N/A ARG 47.A NH2 ASN 141.A O no hydrogen 3.096 N/A SER 51.A OG GLY 281.A O no hydrogen 3.009 N/A LEU 52.A N PRO 75.A O no hydrogen 3.005 N/A SER 54.A OG SER 59.A OG no hydrogen 2.518 N/A SER 55.A OG THR 58.A OG1 no hydrogen 2.878 N/A SER 55.A OG ASP 198.A OD2 no hydrogen 3.302 N/A PHE 56.A N TYR 73.A O no hydrogen 2.872 N/A GLN 57.A NE2 ASP 72.A OD1 no hydrogen 2.972 N/A THR 58.A N SER 55.A O no hydrogen 3.024 N/A THR 58.A OG1 SER 55.A O no hydrogen 3.009 N/A THR 58.A OG1 SER 55.A OG no hydrogen 2.878 N/A SER 59.A N PHE 56.A O no hydrogen 3.178 N/A SER 59.A OG SER 54.A OG no hydrogen 2.518 N/A SER 59.A OG SER 55.A O no hydrogen 2.782 N/A PHE 60.A N PHE 56.A O no hydrogen 3.234 N/A TYR 61.A OH PHE 12.A O no hydrogen 2.703 N/A TYR 61.A OH THR 381.A OG1 no hydrogen 2.845 N/A SER 62.A N GLU 382.A OE2 no hydrogen 2.953 N/A SER 62.A OG GLU 382.A OE1 no hydrogen 2.403 N/A ASP 64.A N TYR 61.A O no hydrogen 2.920 N/A LEU 65.A N TYR 61.A O no hydrogen 2.877 N/A VAL 66.A N SER 62.A O no hydrogen 2.963 N/A ARG 67.A N ASP 64.A O no hydrogen 3.070 N/A ASP 68.A N ASP 64.A O no hydrogen 2.996 N/A ASP 68.A N LEU 65.A O no hydrogen 3.248 N/A TYR 69.A N LEU 65.A O no hydrogen 2.940 N/A TYR 69.A OH ASP 72.A OD1 no hydrogen 2.857 N/A TYR 74.A OH GLN 186.A O no hydrogen 2.592 N/A THR 76.A N GLN 79.A OE1 no hydrogen 2.969 N/A ALA 77.A N PHE 50.A O no hydrogen 2.878 N/A GLN 79.A N THR 76.A OG1 no hydrogen 2.946 N/A PHE 80.A N THR 76.A O no hydrogen 2.977 N/A TYR 81.A N ALA 77.A O no hydrogen 2.969 N/A TYR 81.A OH ASP 40.A OD1 no hydrogen 2.814 N/A GLU 82.A N LYS 78.A O no hydrogen 2.894 N/A MET 83.A N GLN 79.A O no hydrogen 3.032 N/A HIS 84.A N PHE 80.A O no hydrogen 3.061 N/A GLU 85.A N TYR 81.A O no hydrogen 2.906 N/A ARG 86.A N GLU 82.A O no hydrogen 2.947 N/A ARG 86.A NH1 ASP 64.A OD2 no hydrogen 3.015 N/A ARG 86.A NH2 ASP 64.A OD1 no hydrogen 2.947 N/A TRP 87.A N MET 83.A O no hydrogen 3.179 N/A TRP 87.A NE1 ASP 64.A OD2 no hydrogen 2.928 N/A ARG 88.A N HIS 84.A O no hydrogen 2.883 N/A ARG 88.A NE GLU 85.A OE1 no hydrogen 3.211 N/A ARG 88.A NE GLU 85.A OE2 no hydrogen 3.479 N/A ARG 88.A NH1 GLU 92.A OE2 no hydrogen 2.952 N/A ARG 88.A NH2 GLU 85.A OE2 no hydrogen 3.065 N/A SER 89.A N GLU 85.A O no hydrogen 2.956 N/A VAL 90.A N ARG 86.A O no hydrogen 3.166 N/A TYR 91.A N TRP 87.A O no hydrogen 3.131 N/A TYR 91.A N ARG 88.A O no hydrogen 3.131 N/A LYS 94.A N TYR 91.A O no hydrogen 2.835 N/A LYS 94.A NZ PHE 28.A O no hydrogen 3.001 N/A ILE 95.A N GLU 92.A O no hydrogen 2.925 N/A ILE 96.A N ILE 30.A O no hydrogen 2.765 N/A ARG 97.A NE GLU 92.A OE1 no hydrogen 3.034 N/A ARG 97.A NH1 SER 32.A O no hydrogen 3.517 N/A ARG 97.A NH1 ALA 33.A O no hydrogen 3.148 N/A ARG 97.A NH2 GLU 92.A OE1 no hydrogen 3.525 N/A ARG 97.A NH2 GLU 92.A OE2 no hydrogen 2.768 N/A ASP 98.A N SER 32.A O no hydrogen 3.193 N/A PHE 99.A N ASP 98.A OD1 no hydrogen 2.858 N/A THR 101.A N SER 113.A O no hydrogen 2.855 N/A THR 101.A OG1 SER 113.A O no hydrogen 3.279 N/A LYS 102.A N SER 113.A O no hydrogen 3.406 N/A ILE 103.A N THR 336.A O no hydrogen 2.921 N/A GLU 104.A N LEU 111.A O no hydrogen 2.801 N/A ASN 105.A N LEU 338.A O no hydrogen 2.855 N/A ASN 105.A ND2 SER 110.A OG no hydrogen 2.847 N/A ASN 105.A ND2 ASN 362.A O no hydrogen 2.951 N/A PHE 106.A N TYR 109.A O no hydrogen 2.813 N/A SER 110.A N ALA 122.A O no hydrogen 2.877 N/A LEU 111.A N GLU 104.A O no hydrogen 2.822 N/A ILE 112.A N TYR 120.A O no hydrogen 2.765 N/A SER 113.A N LYS 102.A O no hydrogen 2.798 N/A THR 114.A OG1 ASP 98.A OD2 no hydrogen 2.877 N/A THR 114.A OG1 SER 116.A OG no hydrogen 3.018 N/A THR 114.A OG1 LYS 118.A O no hydrogen 2.691 N/A ARG 115.A N PHE 99.A O no hydrogen 2.900 N/A SER 116.A N ASP 98.A OD1 no hydrogen 3.297 N/A SER 116.A OG ASP 98.A OD2 no hydrogen 2.682 N/A SER 116.A OG THR 114.A OG1 no hydrogen 3.018 N/A GLY 117.A N THR 114.A O no hydrogen 3.131 N/A LYS 118.A N SER 116.A OG no hydrogen 3.153 N/A TYR 120.A N ILE 112.A O no hydrogen 2.969 N/A ALA 122.A N SER 110.A O no hydrogen 3.062 N/A LYS 123.A N LEU 3.A O no hydrogen 3.006 N/A HIS 124.A N GLU 4.A O no hydrogen 2.944 N/A HIS 124.A ND1 TYR 365.A OH no hydrogen 2.912 N/A VAL 125.A N ASN 363.A O no hydrogen 2.875 N/A VAL 126.A N CYS 6.A O no hydrogen 2.772 N/A LEU 127.A N TYR 365.A O no hydrogen 2.803 N/A ALA 128.A N ILE 8.A O no hydrogen 2.773 N/A THR 129.A N TYR 369.A OH no hydrogen 3.100 N/A THR 129.A OG1 ARG 333.A O no hydrogen 2.669 N/A THR 129.A OG1 TYR 369.A OH no hydrogen 2.432 N/A ARG 133.A NE GLU 330.A OE1 no hydrogen 2.742 N/A ARG 133.A NH1 GLU 330.A OE1 no hydrogen 3.163 N/A MET 135.A N ASP 328.A OD1 no hydrogen 3.370 N/A ASN 136.A N ARG 133.A O no hydrogen 3.162 N/A THR 137.A OG1 LEU 134.A O no hydrogen 3.072 N/A LEU 139.A N MET 135.A O no hydrogen 3.455 N/A SER 140.A N ASN 136.A O no hydrogen 2.784 N/A SER 140.A OG ASN 136.A O no hydrogen 2.902 N/A SER 140.A OG THR 137.A O no hydrogen 3.447 N/A ASN 141.A ND2 SER 140.A OG no hydrogen 2.805 N/A PHE 142.A N THR 137.A O no hydrogen 3.341 N/A HIS 145.A N ASP 143.A OD1 no hydrogen 2.968 N/A ASN 148.A N ASN 170.A O no hydrogen 3.272 N/A LYS 149.A N ASN 172.A OD1 no hydrogen 3.187 N/A PHE 151.A N LYS 173.A O no hydrogen 3.073 N/A VAL 152.A N GLN 323.A O no hydrogen 2.943 N/A PHE 153.A N ILE 175.A O no hydrogen 2.890 N/A ASP 154.A N VAL 325.A O no hydrogen 3.100 N/A ASN 161.A N GLY 157.A O no hydrogen 2.975 N/A ASN 161.A ND2 ASN 285.A O no hydrogen 3.088 N/A LEU 162.A N ASP 158.A O no hydrogen 3.035 N/A LEU 163.A N SER 159.A O no hydrogen 3.131 N/A ILE 164.A N ALA 160.A O no hydrogen 2.822 N/A ALA 165.A N ASN 161.A O no hydrogen 3.002 N/A LYS 166.A N LEU 162.A O no hydrogen 3.217 N/A LYS 166.A N LEU 163.A O no hydrogen 2.953 N/A LYS 166.A NZ ASP 49.A OD1 no hydrogen 2.934 N/A LEU 167.A N LEU 163.A O no hydrogen 2.914 N/A LEU 167.A N ILE 164.A O no hydrogen 3.061 N/A ILE 168.A N ILE 164.A O no hydrogen 2.956 N/A ASN 170.A N LEU 167.A O no hydrogen 2.850 N/A ASN 171.A N ILE 168.A O no hydrogen 2.897 N/A ASN 171.A ND2 ASP 555.A OD1 no hydrogen 2.466 N/A ASN 172.A ND2 VAL 146.A O no hydrogen 3.411 N/A ASN 172.A ND2 LEU 167.A O no hydrogen 2.915 N/A LYS 173.A N LYS 149.A O no hydrogen 3.110 N/A LYS 173.A NZ ASN 171.A O no hydrogen 2.888 N/A ILE 174.A N LYS 295.A O no hydrogen 3.394 N/A ILE 175.A N PHE 151.A O no hydrogen 2.983 N/A LEU 176.A N ILE 297.A O no hydrogen 2.879 N/A ARG 177.A N PHE 153.A O no hydrogen 2.850 N/A ARG 177.A NE THR 303.A O no hydrogen 3.123 N/A ARG 177.A NH1 ASP 154.A OD1 no hydrogen 3.165 N/A ARG 177.A NH1 ASP 154.A OD2 no hydrogen 3.325 N/A ARG 177.A NH2 THR 303.A O no hydrogen 2.786 N/A GLY 180.A N THR 178.A OG1 no hydrogen 2.406 N/A PHE 181.A N ILE 238.A O no hydrogen 2.824 N/A LEU 184.A N ILE 258.A O no hydrogen 2.822 N/A GLN 186.A N TYR 260.A O no hydrogen 2.735 N/A VAL 188.A N PHE 195.A O no hydrogen 2.807 N/A VAL 190.A N LYS 193.A O no hydrogen 2.745 N/A LYS 193.A N VAL 190.A O no hydrogen 2.829 N/A LYS 193.A NZ LYS 491.A O no hydrogen 2.781 N/A LYS 193.A NZ ASP 493.A OD2 no hydrogen 3.413 N/A PHE 195.A N VAL 188.A O no hydrogen 2.781 N/A THR 196.A N GLN 199.A OE1 no hydrogen 2.992 N/A THR 196.A OG1 ASP 198.A OD1 no hydrogen 2.644 N/A THR 196.A OG1 ASP 198.A OD2 no hydrogen 3.312 N/A THR 196.A OG1 GLN 199.A OE1 no hydrogen 3.299 N/A LEU 197.A N GLN 186.A O no hydrogen 2.938 N/A GLN 199.A N THR 196.A O no hydrogen 2.992 N/A GLN 199.A NE2 TYR 495.A OH no hydrogen 2.760 N/A LEU 200.A N LEU 197.A O no hydrogen 3.112 N/A ASN 204.A ND2 TYR 460.A O no hydrogen 3.000 N/A PHE 205.A N SER 202.A O no hydrogen 3.111 N/A ARG 206.A N PRO 203.A O no hydrogen 2.987 N/A ARG 206.A NH1 TYR 416.A OH no hydrogen 2.934 N/A ARG 206.A NH2 ASP 437.A OD1 no hydrogen 2.818 N/A TYR 207.A N ASN 204.A O no hydrogen 2.930 N/A TYR 207.A OH GLU 436.A OE1 no hydrogen 2.602 N/A VAL 208.A N PHE 205.A O no hydrogen 3.060 N/A SER 210.A OG GLU 211.A OE1 no hydrogen 3.238 N/A SER 210.A OG GLU 211.A OE2 no hydrogen 2.994 N/A LEU 212.A N SER 209.A OG no hydrogen 2.989 N/A TYR 213.A N SER 209.A O no hydrogen 3.144 N/A TYR 213.A OH GLU 201.A O no hydrogen 2.473 N/A ASP 214.A N SER 210.A O no hydrogen 2.770 N/A ARG 215.A N GLU 211.A O no hydrogen 3.066 N/A ARG 215.A NE ILE 505.A O no hydrogen 3.170 N/A ARG 215.A NH2 ARG 506.A O no hydrogen 3.040 N/A LEU 216.A N LEU 212.A O no hydrogen 3.041 N/A MET 217.A N ASP 214.A O no hydrogen 3.199 N/A MET 218.A N ASP 214.A O no hydrogen 2.970 N/A SER 219.A OG ASP 517.A OD2 no hydrogen 3.202 N/A VAL 221.A N MET 218.A O no hydrogen 3.011 N/A TYR 222.A N MET 218.A O no hydrogen 2.901 N/A ARG 224.A N TYR 222.A O no hydrogen 2.917 N/A ARG 224.A N TYR 232.A OH no hydrogen 3.177 N/A ARG 224.A NH1 ASP 214.A OD2 no hydrogen 2.817 N/A ARG 224.A NH2 ASP 214.A OD2 no hydrogen 2.926 N/A THR 225.A N TYR 232.A OH no hydrogen 3.364 N/A THR 225.A OG1 GLU 515.A OE1 no hydrogen 3.030 N/A THR 225.A OG1 GLU 515.A OE2 no hydrogen 3.256 N/A VAL 226.A N GLU 515.A OE1 no hydrogen 3.274 N/A ASN 227.A N THR 225.A OG1 no hydrogen 3.007 N/A ALA 229.A N ASN 227.A OD1 no hydrogen 3.077 N/A VAL 230.A N ASN 227.A O no hydrogen 3.393 N/A SER 231.A N ASN 526.A O no hydrogen 3.154 N/A TYR 232.A OH SER 219.A O no hydrogen 2.690 N/A ASN 233.A N VAL 230.A O no hydrogen 2.878 N/A ASN 233.A ND2 THR 225.A O no hydrogen 2.865 N/A ASN 233.A ND2 ASN 227.A O no hydrogen 2.714 N/A GLN 234.A N VAL 230.A O no hydrogen 3.180 N/A GLN 234.A NE2 PRO 228.A O no hydrogen 3.094 N/A PHE 235.A N SER 231.A O no hydrogen 2.820 N/A ILE 238.A N PHE 235.A O no hydrogen 3.014 N/A ARG 239.A N PRO 236.A O no hydrogen 3.174 N/A ARG 239.A NE TYR 232.A O no hydrogen 2.831 N/A ARG 239.A NH2 TYR 232.A O no hydrogen 3.008 N/A ARG 240.A NH2 GLY 180.A O no hydrogen 2.962 N/A SER 243.A N ASP 241.A OD1 no hydrogen 3.006 N/A SER 243.A OG ASP 241.A OD1 no hydrogen 2.307 N/A VAL 245.A N PHE 242.A O no hydrogen 3.055 N/A SER 247.A OG HIS 415.A O no hydrogen 2.774 N/A SER 249.A N SER 247.A OG no hydrogen 2.993 N/A SER 250.A OG ASP 214.A OD1 no hydrogen 2.638 N/A ASN 253.A ND2 TYR 412.A OH no hydrogen 3.143 N/A ASN 253.A ND2 TYR 417.A OH no hydrogen 3.428 N/A GLY 254.A N THR 428.A O no hydrogen 2.816 N/A LEU 255.A N PRO 252.A O no hydrogen 3.294 N/A ILE 258.A N THR 182.A O no hydrogen 2.757 N/A LYS 259.A N ASP 158.A OD1 no hydrogen 3.050 N/A LYS 259.A NZ ALA 257.A O no hydrogen 2.984 N/A LYS 259.A NZ PHE 373.A O no hydrogen 3.025 N/A TYR 260.A N LEU 184.A O no hydrogen 3.028 N/A TYR 260.A OH ASN 526.A OD1 no hydrogen 2.711 N/A TRP 261.A N ASN 285.A OD1 no hydrogen 2.900 N/A ILE 263.A N ASP 286.A OD2 no hydrogen 2.885 N/A GLN 265.A N ASP 264.A OD1 no hydrogen 2.815 N/A TYR 266.A N PRO 262.A O no hydrogen 3.028 N/A TYR 266.A OH TYR 282.A O no hydrogen 2.662 N/A TYR 267.A N ILE 263.A O no hydrogen 2.765 N/A TYR 268.A N ASP 264.A O no hydrogen 3.032 N/A HIS 269.A N GLN 265.A O no hydrogen 3.032 N/A HIS 269.A NE2 GLU 187.A OE1 no hydrogen 2.836 N/A PHE 270.A N TYR 266.A O no hydrogen 3.049 N/A ASN 271.A N TYR 267.A O no hydrogen 2.998 N/A ASP 273.A N PHE 270.A O no hydrogen 3.297 N/A TYR 277.A N ASP 273.A O no hydrogen 3.101 N/A ILE 278.A N LEU 274.A O no hydrogen 2.966 N/A SER 279.A N GLU 275.A O no hydrogen 3.048 N/A SER 279.A OG ASN 276.A O no hydrogen 2.901 N/A LYS 280.A N ASN 276.A O no hydrogen 3.284 N/A LYS 280.A N TYR 277.A O no hydrogen 3.187 N/A GLY 281.A N ILE 278.A O no hydrogen 3.074 N/A TYR 282.A N TYR 277.A O no hydrogen 3.084 N/A TYR 282.A OH TYR 74.A O no hydrogen 2.529 N/A LEU 284.A N TYR 541.A OH no hydrogen 3.007 N/A MET 289.A N ASP 286.A OD1 no hydrogen 2.855 N/A TRP 290.A N ASP 286.A O no hydrogen 3.002 N/A LEU 291.A N ILE 287.A O no hydrogen 2.890 N/A HIS 292.A N ALA 288.A O no hydrogen 2.877 N/A HIS 292.A NE2 GLU 532.A OE2 no hydrogen 2.818 N/A THR 293.A N MET 289.A O no hydrogen 2.974 N/A THR 293.A OG1 MET 289.A O no hydrogen 2.792 N/A THR 293.A OG1 TRP 290.A O no hydrogen 3.471 N/A GLY 294.A N LEU 291.A O no hydrogen 3.299 N/A VAL 296.A N TRP 290.A O no hydrogen 3.240 N/A ILE 297.A N ILE 174.A O no hydrogen 2.931 N/A VAL 299.A N LEU 176.A O no hydrogen 3.044 N/A SER 301.A OG THR 178.A O no hydrogen 3.502 N/A SER 301.A OG ASN 179.A OD1 no hydrogen 2.778 N/A THR 303.A N PRO 300.A O no hydrogen 3.389 N/A THR 303.A OG1 PRO 300.A O no hydrogen 2.723 N/A ASN 306.A N THR 311.A O no hydrogen 2.477 N/A LYS 310.A NZ HIS 322.A O no hydrogen 2.810 N/A THR 311.A N ASN 306.A O no hydrogen 2.991 N/A ILE 312.A N ARG 319.A O no hydrogen 2.617 N/A THR 313.A N PRO 304.A O no hydrogen 2.677 N/A TYR 314.A N ILE 317.A O no hydrogen 2.763 N/A ILE 317.A N TYR 314.A O no hydrogen 3.198 N/A ARG 319.A N ILE 312.A O no hydrogen 2.730 N/A ARG 319.A NH1 ASP 559.A OD1 no hydrogen 3.114 N/A ARG 319.A NH1 ASP 559.A OD2 no hydrogen 3.289 N/A ARG 319.A NH1 GLU 561.A OE1 no hydrogen 2.997 N/A ARG 319.A NH2 THR 150.A OG1 no hydrogen 2.854 N/A ARG 319.A NH2 ASP 559.A OD2 no hydrogen 2.638 N/A SER 320.A OG LYS 310.A O no hydrogen 2.787 N/A PHE 321.A N LYS 310.A O no hydrogen 3.221 N/A HIS 322.A N THR 150.A O no hydrogen 2.971 N/A TYR 324.A OH ASP 154.A OD2 no hydrogen 2.285 N/A VAL 325.A N VAL 152.A O no hydrogen 2.795 N/A GLN 331.A NE2 GLU 330.A O no hydrogen 3.218 N/A ARG 333.A N GLY 130.A O no hydrogen 2.876 N/A LEU 334.A N PRO 332.A O no hydrogen 2.981 N/A LEU 338.A N ILE 103.A O no hydrogen 2.847 N/A ILE 339.A N THR 343.A O no hydrogen 2.837 N/A GLY 341.A N ASN 105.A O no hydrogen 3.073 N/A GLY 341.A N LEU 338.A O no hydrogen 3.229 N/A GLU 342.A N ILE 339.A O no hydrogen 2.642 N/A THR 343.A N ILE 339.A O no hydrogen 3.089 N/A THR 343.A OG1 GLU 342.A OE2 no hydrogen 3.140 N/A PHE 345.A N ILE 337.A O no hydrogen 2.698 N/A TYR 349.A OH THR 370.A OG1 no hydrogen 2.741 N/A ARG 350.A NE ASP 426.A OD2 no hydrogen 2.528 N/A ARG 350.A NH1 ALA 420.A O no hydrogen 2.610 N/A ARG 350.A NH2 ALA 420.A O no hydrogen 3.444 N/A ARG 350.A NH2 ASP 426.A OD1 no hydrogen 3.193 N/A ARG 350.A NH2 ASP 426.A OD2 no hydrogen 3.149 N/A ASP 351.A N LEU 348.A O no hydrogen 2.896 N/A THR 352.A N TYR 349.A O no hydrogen 2.984 N/A THR 352.A OG1 TYR 349.A O no hydrogen 2.720 N/A PHE 353.A N ILE 357.A O no hydrogen 2.837 N/A VAL 356.A N PHE 353.A O no hydrogen 2.918 N/A ILE 357.A N PHE 353.A O no hydrogen 3.058 N/A ASN 362.A N ASN 105.A OD1 no hydrogen 2.833 N/A ASN 362.A ND2 PHE 106.A O no hydrogen 3.296 N/A ASN 363.A ND2 LYS 123.A O no hydrogen 3.355 N/A TYR 365.A N VAL 125.A O no hydrogen 2.843 N/A TYR 365.A OH HIS 124.A ND1 no hydrogen 2.912 N/A TYR 365.A OH HIS 398.A NE2 no hydrogen 3.203 N/A PHE 366.A N VAL 356.A O no hydrogen 2.819 N/A LEU 367.A N LEU 127.A O no hydrogen 2.782 N/A GLY 368.A N GLN 384.A OE1 no hydrogen 3.088 N/A TYR 369.A OH THR 129.A OG1 no hydrogen 2.432 N/A THR 370.A OG1 TYR 349.A OH no hydrogen 2.741 N/A ARG 371.A N HIS 427.A O no hydrogen 2.826 N/A PHE 373.A N VAL 429.A O no hydrogen 2.835 N/A THR 374.A OG1 GLU 201.A OE1 no hydrogen 3.301 N/A THR 374.A OG1 GLU 201.A OE2 no hydrogen 2.415 N/A GLY 376.A N THR 58.A OG1 no hydrogen 2.946 N/A ASN 379.A ND2 ASN 466.A OD1 no hydrogen 3.191 N/A THR 381.A N LEU 377.A O no hydrogen 2.994 N/A THR 381.A OG1 TYR 61.A OH no hydrogen 2.845 N/A THR 381.A OG1 LEU 377.A O no hydrogen 3.309 N/A THR 381.A OG1 ALA 378.A O no hydrogen 3.567 N/A GLU 382.A N ALA 378.A O no hydrogen 2.909 N/A MET 383.A N ASN 379.A O no hydrogen 3.464 N/A GLN 384.A N ILE 380.A O no hydrogen 2.843 N/A GLN 384.A NE2 TYR 434.A OH no hydrogen 2.870 N/A SER 385.A N THR 381.A O no hydrogen 2.889 N/A SER 385.A OG THR 381.A O no hydrogen 2.822 N/A LEU 386.A N GLU 382.A O no hydrogen 3.192 N/A LEU 386.A N MET 383.A O no hydrogen 3.148 N/A PHE 387.A N MET 383.A O no hydrogen 3.082 N/A ILE 388.A N GLN 384.A O no hydrogen 2.898 N/A HIS 389.A N SER 385.A O no hydrogen 2.931 N/A HIS 389.A ND1 TYR 476.A OH no hydrogen 2.815 N/A HIS 389.A NE2 THR 24.A OG1 no hydrogen 3.028 N/A LYS 390.A N LEU 386.A O no hydrogen 3.000 N/A LYS 390.A NZ GLN 394.A OE1 no hydrogen 2.947 N/A LYS 390.A NZ GLU 475.A OE1 no hydrogen 3.171 N/A LYS 390.A NZ GLU 475.A OE2 no hydrogen 2.675 N/A LEU 391.A N PHE 387.A O no hydrogen 2.955 N/A ILE 392.A N ILE 388.A O no hydrogen 2.916 N/A THR 393.A N HIS 389.A O no hydrogen 3.019 N/A THR 393.A OG1 HIS 389.A O no hydrogen 2.743 N/A GLN 394.A N LYS 390.A O no hydrogen 2.950 N/A GLN 394.A NE2 GLU 475.A OE1 no hydrogen 2.723 N/A HIS 398.A N GLN 394.A O no hydrogen 2.953 N/A GLN 399.A N PRO 395.A O no hydrogen 2.860 N/A LYS 400.A N GLN 396.A O no hydrogen 3.037 N/A ILE 401.A N PHE 397.A O no hydrogen 3.017 N/A HIS 402.A N HIS 398.A O no hydrogen 2.947 N/A GLN 403.A N GLN 399.A O no hydrogen 2.834 N/A LEU 405.A N HIS 402.A O no hydrogen 3.003 N/A ARG 408.A N ASN 404.A O no hydrogen 2.951 N/A ARG 408.A NE ASN 404.A OD1 no hydrogen 2.814 N/A ARG 408.A NH1 PHE 628.A O no hydrogen 2.973 N/A ARG 408.A NH1 ILE 629.A O no hydrogen 3.492 N/A ARG 408.A NH2 LYS 400.A O no hydrogen 3.097 N/A ILE 409.A N LEU 405.A O no hydrogen 2.996 N/A THR 410.A N SER 406.A O no hydrogen 3.028 N/A THR 410.A OG1 SER 406.A O no hydrogen 3.030 N/A ALA 411.A N LYS 407.A O no hydrogen 2.933 N/A TYR 412.A N ARG 408.A O no hydrogen 2.811 N/A ASN 413.A N ILE 409.A O no hydrogen 2.866 N/A ASN 413.A ND2 ARG 350.A O no hydrogen 2.874 N/A GLN 414.A N THR 410.A O no hydrogen 2.948 N/A HIS 415.A N ALA 411.A O no hydrogen 3.118 N/A TYR 416.A N TYR 412.A O no hydrogen 3.006 N/A TYR 416.A OH ASP 437.A OD1 no hydrogen 3.288 N/A TYR 416.A OH ASP 437.A OD2 no hydrogen 2.584 N/A TYR 417.A N ASN 413.A O no hydrogen 2.662 N/A TYR 417.A OH ASP 426.A O no hydrogen 2.478 N/A GLY 418.A N ASN 413.A O no hydrogen 3.021 N/A ALA 419.A N ASP 246.A OD2 no hydrogen 2.631 N/A ALA 420.A N TYR 417.A O no hydrogen 3.230 N/A ARG 423.A N ASP 426.A OD1 no hydrogen 3.193 N/A ARG 423.A N ASP 426.A OD2 no hydrogen 3.307 N/A ARG 423.A NH2 GLY 254.A O no hydrogen 3.051 N/A LYS 424.A NZ ASP 328.A O no hydrogen 2.547 N/A ASP 426.A N ARG 423.A O no hydrogen 3.061 N/A HIS 427.A NE2 GLU 330.A OE2 no hydrogen 2.997 N/A THR 428.A N HIS 425.A O no hydrogen 2.995 N/A VAL 429.A N ARG 371.A O no hydrogen 2.900 N/A PHE 433.A N PRO 430.A O no hydrogen 3.132 N/A TYR 434.A N PRO 430.A O no hydrogen 3.059 N/A TYR 434.A OH MET 354.A O no hydrogen 2.504 N/A THR 435.A N PHE 431.A O no hydrogen 2.901 N/A THR 435.A OG1 PHE 431.A O no hydrogen 3.245 N/A THR 435.A OG1 ASN 465.A O no hydrogen 2.589 N/A ASP 437.A N PHE 433.A O no hydrogen 2.833 N/A ILE 438.A N TYR 434.A O no hydrogen 2.965 N/A ALA 439.A N THR 435.A O no hydrogen 2.916 N/A ARG 440.A N GLU 436.A O no hydrogen 2.914 N/A ARG 440.A NH1 TYR 207.A OH no hydrogen 2.997 N/A ARG 440.A NH1 TYR 624.A O no hydrogen 2.730 N/A ARG 440.A NH2 TYR 624.A O no hydrogen 2.949 N/A LEU 441.A N ASP 437.A O no hydrogen 3.027 N/A ILE 442.A N ILE 438.A O no hydrogen 2.837 N/A GLY 443.A N ALA 439.A O no hydrogen 2.778 N/A ILE 444.A N ALA 439.A O no hydrogen 2.922 N/A TYR 446.A OH LYS 469.A O no hydrogen 2.584 N/A GLN 447.A NE2 ASN 449.A OD1 no hydrogen 3.594 N/A GLU 450.A N GLN 447.A O no hydrogen 3.009 N/A CYS 451.A N PRO 448.A O no hydrogen 3.242 N/A CYS 451.A SG PRO 448.A O no hydrogen 3.446 N/A CYS 451.A SG ASP 456.A O no hydrogen 3.664 N/A ARG 452.A N ASP 456.A OD2 no hydrogen 2.969 N/A SER 453.A N ASP 456.A OD2 no hydrogen 3.155 N/A VAL 454.A N SER 600.A O no hydrogen 3.063 N/A ARG 455.A N LEU 598.A O no hydrogen 2.830 N/A ARG 455.A NE ASP 599.A OD1 no hydrogen 2.747 N/A ARG 455.A NH1 ASP 599.A OD1 no hydrogen 3.172 N/A ARG 455.A NH1 ASP 599.A OD2 no hydrogen 3.058 N/A ASP 456.A N SER 453.A OG no hydrogen 3.187 N/A LEU 457.A N SER 453.A O no hydrogen 3.083 N/A LEU 458.A N VAL 454.A O no hydrogen 2.975 N/A PHE 459.A N ARG 455.A O no hydrogen 3.080 N/A TYR 460.A N ASP 456.A O no hydrogen 2.973 N/A TYR 461.A N LEU 457.A O no hydrogen 2.939 N/A TYR 461.A OH LEU 618.A O no hydrogen 2.713 N/A ALA 462.A N LEU 458.A O no hydrogen 2.724 N/A PHE 463.A N LEU 458.A O no hydrogen 2.958 N/A ASN 465.A ND2 ASN 204.A OD1 no hydrogen 2.978 N/A ASN 465.A ND2 GLY 432.A O no hydrogen 2.948 N/A ALA 467.A N ASN 379.A OD1 no hydrogen 2.964 N/A LYS 469.A N ASN 466.A O no hydrogen 2.895 N/A LYS 469.A NZ PHE 459.A O no hydrogen 2.948 N/A LYS 469.A NZ TYR 460.A O no hydrogen 2.974 N/A LYS 469.A NZ PHE 463.A O no hydrogen 2.867 N/A LYS 469.A NZ ASN 465.A OD1 no hydrogen 2.994 N/A TYR 470.A N ALA 467.A O no hydrogen 2.940 N/A TYR 470.A OH GLU 436.A OE2 no hydrogen 2.643 N/A ARG 471.A N PHE 468.A O no hydrogen 2.997 N/A ARG 471.A NE TYR 476.A O no hydrogen 2.765 N/A ARG 471.A NH1 GLU 382.A OE1 no hydrogen 2.733 N/A ARG 471.A NH2 GLU 20.A OE1 no hydrogen 2.974 N/A ARG 471.A NH2 TYR 476.A O no hydrogen 3.285 N/A TYR 476.A OH HIS 389.A ND1 no hydrogen 2.815 N/A ALA 477.A N GLY 474.A O no hydrogen 3.190 N/A VAL 478.A N ARG 471.A O no hydrogen 2.826 N/A VAL 481.A N VAL 478.A O no hydrogen 3.302 N/A GLU 483.A N GLU 483.A OE1 no hydrogen 2.754 N/A LEU 484.A N GLY 480.A O no hydrogen 3.060 N/A ILE 485.A N VAL 481.A O no hydrogen 2.972 N/A GLN 486.A N ASP 482.A O no hydrogen 3.106 N/A LYS 487.A N GLU 483.A O no hydrogen 2.956 N/A VAL 488.A N LEU 484.A O no hydrogen 2.907 N/A ASN 489.A N ILE 485.A O no hydrogen 2.743 N/A ASP 490.A N GLN 486.A O no hydrogen 2.891 N/A LYS 491.A N LYS 487.A O no hydrogen 3.172 N/A LYS 491.A NZ LYS 487.A O no hydrogen 2.843 N/A HIS 492.A N VAL 488.A O no hydrogen 3.170 N/A HIS 492.A N ASN 489.A O no hydrogen 3.252 N/A HIS 494.A N ASN 489.A O no hydrogen 2.859 N/A TYR 495.A N HIS 492.A O no hydrogen 2.921 N/A ALA 496.A N ASP 493.A O no hydrogen 3.212 N/A PHE 499.A N TYR 495.A O no hydrogen 3.122 N/A VAL 500.A N ALA 496.A O no hydrogen 2.886 N/A GLN 501.A N GLN 497.A O no hydrogen 3.076 N/A ALA 502.A N PHE 499.A O no hydrogen 3.264 N/A LEU 503.A N PHE 499.A O no hydrogen 3.321 N/A SER 504.A N VAL 500.A O no hydrogen 2.866 N/A SER 504.A N GLN 501.A O no hydrogen 3.257 N/A SER 504.A OG VAL 500.A O no hydrogen 2.686 N/A ARG 506.A NH1 LEU 503.A O no hydrogen 2.628 N/A MET 508.A N ILE 505.A O no hydrogen 3.079 N/A ASN 509.A N GLU 512.A OE2 no hydrogen 2.724 N/A GLU 512.A N ASN 509.A OD1 no hydrogen 2.805 N/A ALA 513.A N ASN 509.A O no hydrogen 2.948 N/A ALA 514.A N SER 510.A O no hydrogen 2.908 N/A GLU 515.A N ASP 511.A O no hydrogen 3.034 N/A TRP 516.A N GLU 512.A O no hydrogen 2.935 N/A TRP 516.A NE1 ASP 586.A OD2 no hydrogen 3.034 N/A ASP 517.A N ALA 513.A O no hydrogen 2.837 N/A HIS 518.A N GLU 515.A O no hydrogen 3.135 N/A HIS 518.A ND1 ALA 514.A O no hydrogen 2.723 N/A SER 519.A N TRP 516.A O no hydrogen 3.097 N/A SER 519.A OG TRP 516.A O no hydrogen 2.807 N/A ARG 521.A N ASP 584.A OD2 no hydrogen 3.287 N/A PHE 523.A N ASP 527.A OD2 no hydrogen 3.038 N/A ASN 526.A N ASP 185.A OD1 no hydrogen 2.902 N/A ASN 526.A ND2 ALA 183.A O no hydrogen 2.893 N/A MET 528.A N ALA 229.A O no hydrogen 2.895 N/A ARG 529.A N ASP 527.A OD1 no hydrogen 3.067 N/A ARG 529.A NE ASP 527.A OD1 no hydrogen 2.935 N/A ARG 529.A NE ASP 527.A OD2 no hydrogen 3.423 N/A ARG 529.A NH2 ALA 520.A O no hydrogen 2.729 N/A ARG 529.A NH2 ASP 527.A OD2 no hydrogen 2.795 N/A HIS 530.A N ASP 527.A O no hydrogen 3.363 N/A HIS 530.A NE2 ARG 521.A O no hydrogen 2.758 N/A LYS 531.A NZ ASP 286.A OD2 no hydrogen 2.886 N/A TYR 534.A N LYS 531.A O no hydrogen 2.787 N/A ARG 535.A N GLU 532.A O no hydrogen 3.080 N/A ARG 535.A NE GLU 532.A OE2 no hydrogen 2.942 N/A LEU 538.A N TYR 534.A O no hydrogen 2.809 N/A ASP 539.A N ARG 535.A O no hydrogen 3.223 N/A THR 540.A N ALA 536.A O no hydrogen 3.205 N/A THR 540.A OG1 ALA 536.A O no hydrogen 3.325 N/A TYR 541.A N PHE 537.A O no hydrogen 2.755 N/A LEU 542.A N LEU 538.A O no hydrogen 2.891 N/A LYS 543.A N ASP 539.A O no hydrogen 3.142 N/A ALA 544.A N THR 540.A O no hydrogen 2.952 N/A TYR 545.A N TYR 541.A O no hydrogen 2.796 N/A ARG 546.A N LEU 542.A O no hydrogen 2.890 N/A ARG 546.A NE PRO 169.A O no hydrogen 3.083 N/A ARG 546.A NH1 ASP 555.A OD2 no hydrogen 3.041 N/A ARG 546.A NH2 PRO 169.A O no hydrogen 3.245 N/A ARG 546.A NH2 ASP 555.A OD1 no hydrogen 3.354 N/A GLN 547.A N LYS 543.A O no hydrogen 2.995 N/A VAL 548.A N ALA 544.A O no hydrogen 2.883 N/A GLU 549.A N TYR 545.A O no hydrogen 2.872 N/A ASN 550.A N GLN 547.A O no hydrogen 3.502 N/A ASN 550.A ND2 VAL 548.A O no hydrogen 3.496 N/A ILE 551.A N ARG 546.A O no hydrogen 2.705 N/A THR 556.A N ASP 554.A OD1 no hydrogen 2.738 N/A THR 556.A OG1 ASP 554.A OD1 no hydrogen 2.644 N/A TRP 562.A N ASP 559.A OD1 no hydrogen 3.095 N/A ASN 563.A N ASP 559.A O no hydrogen 3.053 N/A PHE 564.A N GLU 560.A O no hydrogen 3.037 N/A MET 565.A N GLU 561.A O no hydrogen 3.066 N/A VAL 566.A N TRP 562.A O no hydrogen 2.597 N/A LYS 567.A N ASN 563.A O no hydrogen 2.729 N/A GLU 568.A N PHE 564.A O no hydrogen 2.741 N/A ALA 569.A N MET 565.A O no hydrogen 2.637 N/A CYS 570.A N VAL 566.A O no hydrogen 2.726 N/A CYS 570.A N LYS 567.A O no hydrogen 3.286 N/A CYS 570.A SG VAL 566.A O no hydrogen 3.228 N/A ARG 573.A NE ASP 574.A OD1 no hydrogen 2.856 N/A ARG 573.A NH1 HIS 292.A O no hydrogen 3.072 N/A ARG 573.A NH2 ASP 574.A OD1 no hydrogen 3.497 N/A ASP 574.A N CYS 570.A O no hydrogen 3.174 N/A ASP 574.A N GLN 571.A O no hydrogen 3.083 N/A LYS 575.A N GLN 571.A O no hydrogen 3.187 N/A VAL 576.A N VAL 572.A O no hydrogen 2.886 N/A ALA 577.A N ARG 573.A O no hydrogen 3.054 N/A ASN 579.A N VAL 576.A O no hydrogen 2.870 N/A ILE 580.A N ALA 577.A O no hydrogen 3.207 N/A LYS 583.A N SER 519.A OG no hydrogen 3.090 N/A LYS 583.A NZ GLN 501.A OE1 no hydrogen 3.523 N/A ASP 586.A N SER 582.A O no hydrogen 2.901 N/A VAL 587.A N LYS 583.A O no hydrogen 2.928 N/A ASN 588.A N ASP 584.A O no hydrogen 3.143 N/A ASN 588.A ND2 ASP 584.A O no hydrogen 3.107 N/A LYS 589.A N GLU 585.A O no hydrogen 3.251 N/A GLY 590.A N ASP 586.A O no hydrogen 2.941 N/A ILE 591.A N VAL 587.A O no hydrogen 2.918 N/A ARG 592.A N ASN 588.A O no hydrogen 3.289 N/A LEU 593.A N LYS 589.A O no hydrogen 2.995 N/A ILE 594.A N GLY 590.A O no hydrogen 2.937 N/A LEU 595.A N ILE 591.A O no hydrogen 2.873 N/A SER 596.A N ARG 592.A O no hydrogen 3.308 N/A SER 596.A N LEU 593.A O no hydrogen 3.273 N/A SER 596.A OG ARG 592.A O no hydrogen 3.482 N/A SER 596.A OG LEU 593.A O no hydrogen 2.668 N/A ILE 597.A N ILE 594.A O no hydrogen 2.998 N/A SER 600.A N ILE 597.A O no hydrogen 2.879 N/A SER 600.A OG ILE 597.A O no hydrogen 3.214 N/A ILE 602.A N ARG 452.A O no hydrogen 2.877 N/A SER 603.A OG ASP 601.A OD2 no hydrogen 2.947 N/A SER 604.A N ASP 601.A OD2 no hydrogen 3.080 N/A SER 604.A OG ASP 601.A O no hydrogen 3.492 N/A SER 604.A OG ASP 601.A OD2 no hydrogen 3.048 N/A LEU 605.A N ILE 602.A O no hydrogen 2.995 N/A SER 611.A OG GLU 608.A O no hydrogen 3.194 N/A PHE 614.A N GLN 610.A O no hydrogen 3.167 N/A ILE 615.A N SER 611.A O no hydrogen 2.999 N/A ARG 616.A N ILE 612.A O no hydrogen 3.013 N/A ARG 616.A N GLU 613.A O no hydrogen 2.957 N/A ARG 616.A NH1 LEU 605.A O no hydrogen 2.568 N/A ARG 616.A NH1 ASP 607.A OD1 no hydrogen 2.761 N/A ARG 616.A NH2 ASP 607.A OD1 no hydrogen 2.656 N/A ARG 617.A N GLU 613.A O no hydrogen 3.131 N/A ARG 617.A NE GLU 613.A OE1 no hydrogen 2.789 N/A LEU 618.A N ILE 615.A O no hydrogen 3.338 N/A LEU 619.A N ARG 616.A O no hydrogen 3.424 N/A GLN 620.A N ARG 617.A O no hydrogen 2.962 N/A LYS 622.A NZ GLN 620.A O no hydrogen 3.458 N/A ASN 623.A N TYR 207.A O no hydrogen 2.770 N/A ASN 623.A ND2 ARG 206.A O no hydrogen 2.868 N/A ILE 629.A N LEU 626.A O no hydrogen 2.984 N/A ARG 630.A N LEU 626.A O no hydrogen 3.259 N/A