Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yn3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N LEU 390.A O no hydrogen 2.885 N/A THR 1.A OG1 LEU 390.A O no hydrogen 2.873 N/A THR 2.A OG1 GLY 116.A O no hydrogen 2.801 N/A ARG 3.A NE ASP 221.A OD1 no hydrogen 3.003 N/A ARG 3.A NE ASP 221.A OD2 no hydrogen 3.377 N/A ARG 3.A NH2 ASP 221.A OD2 no hydrogen 2.579 N/A SER 4.A OG HIS 420.A NE2 no hydrogen 2.841 N/A TRP 5.A NE1 ARG 121.A O no hydrogen 2.808 N/A PHE 7.A N ARG 3.A O no hydrogen 2.767 N/A LEU 8.A N SER 4.A O no hydrogen 2.982 N/A GLY 9.A N ASP 6.A O no hydrogen 2.928 N/A PHE 10.A N TRP 5.A O no hydrogen 2.886 N/A VAL 14.A N PRO 11.A O no hydrogen 3.213 N/A ARG 16.A NH1 GLU 21.A OE1 no hydrogen 2.892 N/A ARG 16.A NH1 GLY 123.A O no hydrogen 2.959 N/A ARG 16.A NH2 GLY 123.A O no hydrogen 2.950 N/A GLU 21.A N ARG 17.A O no hydrogen 2.831 N/A SER 22.A N SER 18.A O no hydrogen 2.899 N/A SER 22.A OG SER 18.A O no hydrogen 3.197 N/A SER 22.A OG GLN 19.A O no hydrogen 2.720 N/A ASN 23.A N VAL 20.A O no hydrogen 3.028 N/A ASN 23.A ND2 GLN 19.A O no hydrogen 3.020 N/A ILE 24.A N GLU 21.A O no hydrogen 3.257 N/A VAL 25.A N ASP 158.A OD2 no hydrogen 2.808 N/A VAL 26.A N ARG 128.A O no hydrogen 2.949 N/A GLY 27.A N ILE 159.A O no hydrogen 2.853 N/A VAL 28.A N ALA 130.A O no hydrogen 2.868 N/A LEU 29.A N SER 161.A O no hydrogen 3.201 N/A ASP 30.A N TYR 132.A O no hydrogen 3.098 N/A THR 31.A N ASP 30.A OD1 no hydrogen 2.706 N/A THR 31.A OG1 ASP 90.A OD1 no hydrogen 2.742 N/A ILE 33.A N PRO 88.A O no hydrogen 3.320 N/A TRP 34.A N THR 96.A OG1 no hydrogen 2.898 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.829 N/A SER 37.A N TRP 34.A O no hydrogen 3.172 N/A SER 39.A N SER 37.A OG no hydrogen 3.264 N/A PHE 40.A N SER 37.A O no hydrogen 2.943 N/A ASP 41.A N PRO 38.A O no hydrogen 3.336 N/A GLU 43.A N ASP 41.A OD2 no hydrogen 3.022 N/A PHE 45.A N ASP 42.A O no hydrogen 3.058 N/A LYS 51.A NZ ASN 23.A O no hydrogen 2.914 N/A LYS 51.A NZ ASP 158.A OD1 no hydrogen 3.301 N/A LYS 51.A NZ ASP 158.A OD2 no hydrogen 2.820 N/A TRP 52.A N PRO 49.A O no hydrogen 2.966 N/A TRP 52.A NE1 ILE 69.A O no hydrogen 3.179 N/A LYS 53.A N ASP 155.A O no hydrogen 2.930 N/A CYS 56.A SG GLU 57.A O no hydrogen 3.713 N/A GLU 57.A N ALA 71.A O no hydrogen 2.853 N/A PHE 62.A N THR 58.A O no hydrogen 3.246 N/A ASN 65.A N ILE 68.A O no hydrogen 2.937 N/A ASN 65.A ND2 PHE 40.A O no hydrogen 3.297 N/A ARG 66.A N ASP 42.A OD2 no hydrogen 2.878 N/A ARG 66.A NH1 PHE 45.A O no hydrogen 2.865 N/A LYS 67.A N ASN 65.A OD1 no hydrogen 2.617 N/A LYS 67.A NZ ALA 103.A O no hydrogen 2.710 N/A LYS 67.A NZ PRO 125.A O no hydrogen 2.823 N/A LYS 67.A NZ ALA 127.A O no hydrogen 2.778 N/A ILE 68.A N ASN 65.A OD1 no hydrogen 2.695 N/A ILE 69.A N ILE 129.A O no hydrogen 3.003 N/A ALA 71.A N THR 55.A O no hydrogen 3.286 N/A ARG 72.A N ALA 131.A O no hydrogen 2.936 N/A ARG 72.A NE GLU 57.A OE2 no hydrogen 3.077 N/A SER 73.A N GLU 57.A OE2 no hydrogen 2.884 N/A SER 73.A OG GLU 57.A OE1 no hydrogen 2.632 N/A TYR 74.A N LYS 133.A O no hydrogen 2.980 N/A TYR 74.A OH ASP 151.A OD2 no hydrogen 2.669 N/A ILE 76.A N ASP 144.A OD1 no hydrogen 2.843 N/A ARG 78.A NE ASP 138.A OD2 no hydrogen 2.993 N/A ARG 78.A NH1 ILE 76.A O no hydrogen 2.974 N/A ARG 78.A NH1 ASP 144.A OD2 no hydrogen 2.871 N/A ARG 78.A NH2 ASP 138.A OD1 no hydrogen 3.146 N/A SER 81.A N ASP 84.A OD2 no hydrogen 2.728 N/A ASP 84.A N SER 81.A O no hydrogen 2.977 N/A ARG 89.A NE ASN 60.A O no hydrogen 2.986 N/A ARG 89.A NH1 GLU 36.A OE1 no hydrogen 2.895 N/A ARG 89.A NH2 GLU 36.A OE2 no hydrogen 3.013 N/A ARG 89.A NH2 ASN 61.A O no hydrogen 2.872 N/A ASP 90.A N ILE 33.A O no hydrogen 3.130 N/A ASN 92.A N ASP 90.A OD1 no hydrogen 3.033 N/A GLY 93.A N ASP 90.A OD1 no hydrogen 2.713 N/A HIS 94.A N ASN 92.A OD1 no hydrogen 2.870 N/A HIS 94.A ND1 ASP 30.A OD1 no hydrogen 2.674 N/A HIS 94.A ND1 ASP 30.A OD2 no hydrogen 3.163 N/A HIS 94.A NE2 SER 415.A OG.A no hydrogen 3.074 N/A GLY 95.A N THR 31.A OG1 no hydrogen 2.790 N/A THR 96.A N ASP 90.A OD2 no hydrogen 3.039 N/A THR 96.A OG1 ASP 90.A OD2 no hydrogen 2.770 N/A HIS 97.A N GLY 93.A O no hydrogen 3.077 N/A HIS 97.A NE2 ILE 389.A O no hydrogen 2.991 N/A HIS 97.A NE2 ASN 409.A O no hydrogen 3.095 N/A THR 98.A N HIS 94.A O no hydrogen 2.964 N/A THR 98.A OG1 ASP 30.A OD2 no hydrogen 3.028 N/A THR 98.A OG1 HIS 94.A O no hydrogen 3.436 N/A THR 98.A OG1 GLY 95.A O no hydrogen 3.354 N/A ALA 99.A N GLY 95.A O no hydrogen 2.981 N/A SER 100.A N THR 96.A O no hydrogen 3.031 N/A SER 100.A OG THR 96.A O no hydrogen 3.015 N/A SER 100.A OG HIS 97.A O no hydrogen 2.876 N/A THR 101.A N HIS 97.A O no hydrogen 3.059 N/A THR 101.A N THR 98.A O no hydrogen 3.110 N/A THR 101.A OG1 HIS 97.A O no hydrogen 2.960 N/A ALA 102.A N THR 98.A O no hydrogen 3.041 N/A ALA 103.A N ALA 99.A O no hydrogen 2.860 N/A GLY 104.A N SER 100.A O no hydrogen 2.847 N/A GLY 105.A N SER 39.A O no hydrogen 2.773 N/A VAL 107.A N ALA 120.A O no hydrogen 2.917 N/A ALA 110.A N GLY 118.A O no hydrogen 2.817 N/A LEU 112.A N LEU 115.A O no hydrogen 3.145 N/A LEU 115.A N LEU 112.A O no hydrogen 2.925 N/A GLY 118.A N ALA 110.A O no hydrogen 3.159 N/A ALA 120.A N VAL 107.A O no hydrogen 2.907 N/A ARG 121.A N THR 1.A OG1 no hydrogen 3.300 N/A ARG 121.A NH1 THR 119.A O no hydrogen 3.023 N/A ARG 121.A NH2 ASP 6.A OD1 no hydrogen 3.204 N/A ARG 121.A NH2 PHE 10.A O no hydrogen 3.566 N/A GLY 122.A N GLY 104.A O no hydrogen 2.909 N/A VAL 124.A N ALA 102.A O no hydrogen 3.253 N/A LEU 126.A N GLU 21.A OE2 no hydrogen 2.876 N/A ALA 127.A N VAL 124.A O no hydrogen 3.114 N/A ARG 128.A N ILE 24.A O no hydrogen 2.880 N/A ARG 128.A NE SER 22.A O no hydrogen 2.579 N/A ARG 128.A NH1 SER 46.A O no hydrogen 2.922 N/A ARG 128.A NH1 ARG 66.A O no hydrogen 2.819 N/A ARG 128.A NH2 SER 22.A O no hydrogen 3.174 N/A ARG 128.A NH2 SER 46.A O no hydrogen 3.426 N/A ARG 128.A NH2 SER 46.A OG no hydrogen 3.102 N/A ARG 128.A NH2 PRO 47.A O no hydrogen 3.054 N/A ILE 129.A N LYS 67.A O no hydrogen 2.912 N/A ALA 130.A N VAL 26.A O no hydrogen 2.976 N/A ALA 131.A N GLY 70.A O no hydrogen 3.032 N/A TYR 132.A N VAL 28.A O no hydrogen 2.878 N/A TYR 132.A OH ASP 155.A OD2 no hydrogen 2.700 N/A LYS 133.A N ARG 72.A O no hydrogen 2.887 N/A LYS 133.A NZ VAL 85.A O no hydrogen 3.251 N/A LYS 133.A NZ GLY 87.A O no hydrogen 3.178 N/A LYS 133.A NZ ARG 89.A O no hydrogen 2.851 N/A VAL 134.A N ASP 30.A O no hydrogen 2.928 N/A CYS 135.A N ASP 30.A O no hydrogen 3.202 N/A TRP 136.A N GLY 139.A O no hydrogen 2.831 N/A TRP 136.A NE1 TYR 74.A O no hydrogen 2.719 N/A ASN 137.A N ASP 84.A OD1 no hydrogen 2.949 N/A GLY 139.A N TRP 136.A O no hydrogen 2.847 N/A SER 141.A OG THR 143.A OG1 no hydrogen 2.786 N/A THR 143.A OG1 SER 141.A OG no hydrogen 2.786 N/A ASP 144.A N SER 141.A OG no hydrogen 3.288 N/A ILE 145.A N SER 141.A O no hydrogen 3.114 N/A LEU 146.A N ASP 142.A O no hydrogen 3.096 N/A ALA 147.A N THR 143.A O no hydrogen 3.065 N/A ALA 148.A N ASP 144.A O no hydrogen 2.892 N/A TYR 149.A N ILE 145.A O no hydrogen 2.995 N/A TYR 149.A OH THR 191.A OG1 no hydrogen 2.884 N/A ASP 150.A N LEU 146.A O no hydrogen 2.924 N/A ASP 151.A N ALA 147.A O no hydrogen 3.285 N/A ALA 152.A N ALA 148.A O no hydrogen 2.798 N/A ILE 153.A N TYR 149.A O no hydrogen 3.047 N/A ASP 155.A N ASP 151.A O no hydrogen 2.579 N/A GLY 156.A N ALA 152.A O no hydrogen 3.286 N/A VAL 157.A N ALA 152.A O no hydrogen 3.348 N/A ASP 158.A N VAL 25.A O no hydrogen 2.822 N/A ILE 160.A N LEU 190.A O no hydrogen 2.835 N/A SER 161.A N GLY 27.A O no hydrogen 2.814 N/A SER 161.A OG THR 422.A OG1 no hydrogen 2.722 N/A LEU 162.A N SER 192.A O no hydrogen 2.888 N/A SER 163.A OG SER 415.A O.A no hydrogen 2.936 N/A SER 163.A OG SER 415.A O.B no hydrogen 2.925 N/A ARG 170.A NE ASP 175.A OD1 no hydrogen 2.812 N/A ARG 170.A NH1 ASP 142.A OD2 no hydrogen 2.876 N/A ARG 170.A NH2 ASP 142.A OD1 no hydrogen 2.832 N/A ARG 170.A NH2 ASP 142.A OD2 no hydrogen 3.400 N/A ARG 170.A NH2 ASP 175.A OD1 no hydrogen 2.889 N/A TYR 172.A OH LEU 208.A O no hydrogen 3.317 N/A TYR 172.A OH THR 374.A OG1 no hydrogen 2.739 N/A VAL 174.A N HIS 171.A O.A no hydrogen 3.111 N/A VAL 174.A N HIS 171.A O.B no hydrogen 3.089 N/A ALA 178.A N ASP 175.A OD2 no hydrogen 3.082 N/A ILE 179.A N ASP 175.A O no hydrogen 2.947 N/A GLY 180.A N ALA 176.A O no hydrogen 2.893 N/A SER 181.A N ILE 177.A O no hydrogen 3.016 N/A SER 181.A OG ILE 177.A O no hydrogen 2.751 N/A SER 181.A OG ALA 178.A O no hydrogen 3.125 N/A PHE 182.A N ALA 178.A O no hydrogen 3.016 N/A HIS 183.A N ILE 179.A O no hydrogen 3.213 N/A HIS 183.A ND1 GLU 186.A OE2 no hydrogen 3.101 N/A ALA 184.A N GLY 180.A O no hydrogen 2.984 N/A VAL 185.A N SER 181.A O no hydrogen 2.830 N/A GLU 186.A N PHE 182.A O no hydrogen 3.094 N/A ARG 187.A N ALA 184.A O no hydrogen 2.986 N/A GLY 188.A N VAL 185.A O no hydrogen 2.883 N/A ILE 189.A N ALA 184.A O no hydrogen 2.832 N/A THR 191.A OG1 TYR 149.A OH no hydrogen 2.884 N/A SER 192.A N ILE 160.A O no hydrogen 2.928 N/A SER 192.A OG CYS 418.A O no hydrogen 2.984 N/A ASN 193.A N LEU 213.A O no hydrogen 2.833 N/A ASN 193.A ND2 SER 207.A OG no hydrogen 2.668 N/A SER 194.A N LEU 162.A O no hydrogen 3.377 N/A ALA 195.A N VAL 215.A O no hydrogen 2.889 N/A GLY 196.A N THR 414.A OG1 no hydrogen 3.133 N/A GLY 198.A N SER 367.A OG no hydrogen 2.784 N/A GLY 199.A N PHE 365.A O no hydrogen 2.747 N/A PHE 203.A N GLY 369.A O no hydrogen 2.823 N/A THR 204.A N ARG 368.A O no hydrogen 2.873 N/A THR 204.A OG1 ASN 201.A O no hydrogen 2.807 N/A THR 204.A OG1 ARG 368.A O no hydrogen 3.569 N/A THR 205.A N ARG 368.A O no hydrogen 3.067 N/A THR 205.A OG1 ALA 195.A O no hydrogen 2.701 N/A SER 207.A N THR 205.A OG1 no hydrogen 3.257 N/A SER 207.A OG SER 214.A OG no hydrogen 2.674 N/A TRP 211.A NE1 ALA 178.A O no hydrogen 3.163 N/A TRP 211.A NE1 SER 181.A OG no hydrogen 2.926 N/A LEU 212.A N SER 209.A O no hydrogen 3.197 N/A LEU 213.A N THR 191.A O no hydrogen 3.112 N/A SER 214.A N ASP 381.A OD2 no hydrogen 3.047 N/A SER 214.A OG SER 207.A O no hydrogen 3.310 N/A SER 214.A OG SER 207.A OG no hydrogen 2.674 N/A VAL 215.A N ASN 193.A O no hydrogen 2.855 N/A ALA 216.A N ILE 382.A O no hydrogen 2.824 N/A ALA 217.A N SER 366.A OG no hydrogen 3.027 N/A SER 218.A N GLY 384.A O no hydrogen 2.878 N/A SER 218.A OG SER 383.A OG no hydrogen 2.830 N/A SER 218.A OG GLY 384.A O no hydrogen 3.167 N/A THR 219.A N VAL 361.A O no hydrogen 2.966 N/A THR 219.A OG1 VAL 361.A O no hydrogen 3.511 N/A ARG 222.A NH1 THR 2.A OG1 no hydrogen 3.014 N/A ARG 222.A NH2 GLU 388.A O no hydrogen 2.922 N/A LYS 223.A N ILE 354.A O no hydrogen 3.019 N/A LYS 223.A NZ ARG 313.A O no hydrogen 3.173 N/A PHE 224.A N GLU 388.A OE1 no hydrogen 2.994 N/A VAL 225.A N THR 352.A O no hydrogen 2.877 N/A THR 226.A N GLY 238.A O no hydrogen 2.831 N/A THR 226.A OG1 SER 240.A O no hydrogen 2.995 N/A THR 226.A OG1 SER 240.A OG no hydrogen 2.626 N/A THR 226.A OG1 SER 351.A OG no hydrogen 2.793 N/A GLN 227.A NE2 SER 235.A OG no hydrogen 2.857 N/A VAL 228.A N PHE 236.A O no hydrogen 2.887 N/A GLN 229.A N THR 347.A O no hydrogen 2.970 N/A ILE 230.A N GLN 234.A O no hydrogen 3.058 N/A GLY 231.A N GLY 345.A O no hydrogen 2.775 N/A ASN 232.A ND2 GLN 234.A OE1 no hydrogen 2.882 N/A GLY 233.A N ILE 230.A O no hydrogen 2.994 N/A GLN 234.A N ASN 232.A OD1 no hydrogen 2.892 N/A PHE 236.A N VAL 228.A O no hydrogen 2.767 N/A GLY 238.A N THR 226.A O no hydrogen 3.101 N/A VAL 239.A N.A VAL 325.A O no hydrogen 2.978 N/A VAL 239.A N.B VAL 325.A O no hydrogen 2.979 N/A SER 240.A OG THR 226.A OG1 no hydrogen 2.626 N/A SER 240.A OG SER 323.A O no hydrogen 2.696 N/A ILE 241.A N ASP 317.A O no hydrogen 2.845 N/A ASN 242.A N SER 351.A OG no hydrogen 2.724 N/A ASN 242.A ND2 PHE 349.A O no hydrogen 2.903 N/A GLN 247.A NE2 ASN 246.A O no hydrogen 3.563 N/A TYR 249.A N ALA 346.A O no hydrogen 2.943 N/A LEU 251.A N PRO 344.A O no hydrogen 2.907 N/A VAL 252.A N ILE 284.A O no hydrogen 2.950 N/A GLY 254.A N VAL 286.A O no hydrogen 3.174 N/A ARG 255.A N SER 253.A OG no hydrogen 3.255 N/A ARG 255.A NH2 GLU 288.A OE1 no hydrogen 2.921 N/A ASP 256.A N SER 253.A O no hydrogen 2.973 N/A ILE 257.A N GLY 254.A O no hydrogen 3.267 N/A ASN 259.A N SER 274.A O no hydrogen 2.689 N/A ASN 259.A ND2 LYS 273.A O no hydrogen 2.981 N/A PHE 262.A N ASN 259.A O no hydrogen 2.798 N/A SER 265.A N ASP 263.A OD2 no hydrogen 3.424 N/A SER 265.A OG ASP 263.A OD2 no hydrogen 2.934 N/A THR 266.A N ASP 263.A O no hydrogen 2.920 N/A THR 266.A OG1 ASP 263.A O no hydrogen 3.566 N/A SER 267.A N ASP 263.A O no hydrogen 3.007 N/A SER 267.A OG GLY 254.A O no hydrogen 2.926 N/A SER 267.A OG ASP 263.A O no hydrogen 3.288 N/A ARG 268.A N LYS 264.A O no hydrogen 3.419 N/A PHE 269.A N THR 266.A O no hydrogen 2.968 N/A CYS 270.A N SER 267.A O no hydrogen 3.100 N/A CYS 270.A SG VAL 286.A O no hydrogen 3.898 N/A ASP 272.A N GLU 295.A OE2 no hydrogen 3.194 N/A LYS 273.A N SER 299.A OG no hydrogen 2.760 N/A LYS 273.A NZ LYS 298.A O no hydrogen 3.568 N/A SER 274.A N THR 271.A O no hydrogen 3.105 N/A SER 274.A OG THR 266.A O no hydrogen 3.481 N/A SER 274.A OG THR 271.A O no hydrogen 2.882 N/A ASN 276.A N ILE 257.A O no hydrogen 2.802 N/A ASN 278.A N ASN 276.A OD1 no hydrogen 2.681 N/A ASN 278.A ND2 ASN 276.A OD1 no hydrogen 3.373 N/A LEU 279.A N ASN 276.A O no hydrogen 3.125 N/A LEU 279.A N ASN 276.A OD1 no hydrogen 3.174 N/A GLY 282.A N GLY 302.A O no hydrogen 2.927 N/A LYS 283.A N LEU 280.A O no hydrogen 3.140 N/A ILE 284.A N PRO 250.A O no hydrogen 2.943 N/A VAL 285.A N GLY 305.A O no hydrogen 3.114 N/A VAL 286.A N VAL 252.A O no hydrogen 2.822 N/A CYS 287.A N LEU 307.A O no hydrogen 2.795 N/A GLU 288.A N ARG 268.A O no hydrogen 2.883 N/A GLU 295.A N GLY 292.A O no hydrogen 3.079 N/A PHE 297.A N PRO 293.A O no hydrogen 3.402 N/A LYS 298.A N HIS 294.A O no hydrogen 3.000 N/A LYS 298.A NZ ASP 272.A OD1 no hydrogen 3.543 N/A SER 299.A N GLU 295.A O no hydrogen 2.862 N/A SER 299.A OG GLU 295.A OE2 no hydrogen 2.770 N/A LEU 300.A N PHE 296.A O no hydrogen 2.948 N/A ALA 303.A N LEU 300.A O no hydrogen 3.197 N/A ALA 304.A N LYS 283.A O no hydrogen 2.860 N/A GLY 305.A N LYS 283.A O no hydrogen 3.355 N/A VAL 306.A N PRO 322.A O no hydrogen 2.980 N/A LEU 307.A N VAL 285.A O no hydrogen 2.940 N/A MET 308.A N SER 324.A O no hydrogen 3.004 N/A THR 309.A N ALA 289.A O no hydrogen 3.139 N/A THR 309.A OG1 LEU 326.A O no hydrogen 2.863 N/A SER 310.A N LEU 326.A O no hydrogen 3.332 N/A SER 310.A OG THR 312.A O no hydrogen 3.080 N/A THR 312.A N SER 310.A OG no hydrogen 3.001 N/A ARG 313.A NH1 GLN 237.A O no hydrogen 3.076 N/A ARG 313.A NH1 VAL 325.A O no hydrogen 3.144 N/A ALA 316.A N GLU 388.A OE2 no hydrogen 2.865 N/A SER 323.A N ASN 242.A OD1 no hydrogen 3.380 N/A SER 323.A OG VAL 306.A O no hydrogen 2.797 N/A SER 324.A N VAL 306.A O no hydrogen 3.327 N/A SER 324.A OG THR 226.A O no hydrogen 3.014 N/A VAL 325.A N VAL 239.A O.A no hydrogen 3.034 N/A VAL 325.A N VAL 239.A O.B no hydrogen 3.004 N/A LEU 326.A N MET 308.A O no hydrogen 2.719 N/A ASN 329.A N ASP 327.A OD2 no hydrogen 3.420 N/A ASP 330.A N ASP 327.A OD1 no hydrogen 2.795 N/A LEU 331.A N ASP 327.A O no hydrogen 3.062 N/A LEU 332.A N PRO 328.A O no hydrogen 2.984 N/A ALA 333.A N ASN 329.A O no hydrogen 2.994 N/A THR 334.A N ASP 330.A O no hydrogen 3.014 N/A THR 334.A OG1 ASP 330.A O no hydrogen 2.906 N/A LEU 335.A N LEU 331.A O no hydrogen 3.066 N/A ARG 336.A N LEU 332.A O no hydrogen 3.076 N/A TYR 337.A N ALA 333.A O no hydrogen 3.057 N/A ILE 338.A N THR 334.A O no hydrogen 2.971 N/A TYR 339.A N LEU 335.A O no hydrogen 3.179 N/A TYR 339.A OH ASP 256.A OD1 no hydrogen 2.722 N/A TYR 339.A OH ASP 256.A OD2 no hydrogen 2.669 N/A SER 340.A N TYR 337.A O no hydrogen 2.901 N/A SER 340.A OG TYR 337.A O no hydrogen 2.745 N/A GLY 345.A N TYR 337.A OH no hydrogen 3.106 N/A ALA 346.A N TYR 249.A O no hydrogen 2.976 N/A THR 347.A N GLN 229.A O no hydrogen 2.940 N/A PHE 349.A N GLN 227.A O no hydrogen 2.992 N/A LYS 350.A N ASN 246.A OD1 no hydrogen 3.010 N/A LYS 350.A NZ TYR 113.A O no hydrogen 2.651 N/A SER 351.A N ASN 242.A O no hydrogen 2.977 N/A SER 351.A OG THR 226.A OG1 no hydrogen 2.793 N/A SER 351.A OG SER 240.A O no hydrogen 3.038 N/A SER 351.A OG ASN 242.A O no hydrogen 3.439 N/A THR 352.A N VAL 225.A O no hydrogen 2.949 N/A ILE 354.A N LYS 223.A O no hydrogen 3.001 N/A ASN 356.A N ASP 221.A O no hydrogen 2.798 N/A SER 358.A N ASN 356.A OD1 no hydrogen 2.842 N/A ALA 359.A N ASN 356.A O no hydrogen 3.343 N/A VAL 361.A N THR 219.A OG1 no hydrogen 3.087 N/A VAL 362.A N ASN 456.A OD1 no hydrogen 2.844 N/A VAL 363.A N ALA 217.A O no hydrogen 3.035 N/A SER 364.A N ASP 314.A OD2 no hydrogen 2.836 N/A SER 364.A OG ASP 314.A OD1 no hydrogen 2.935 N/A SER 364.A OG ASP 314.A OD2 no hydrogen 3.494 N/A SER 366.A N VAL 363.A O no hydrogen 3.125 N/A SER 367.A N GLY 196.A O no hydrogen 2.822 N/A ARG 368.A N THR 204.A OG1 no hydrogen 2.869 N/A ARG 368.A NE GLN 458.A OE1 no hydrogen 2.680 N/A ARG 368.A NH1 VAL 363.A O no hydrogen 3.057 N/A ARG 368.A NH1 SER 366.A O no hydrogen 2.797 N/A ARG 368.A NH2 GLN 458.A OE1 no hydrogen 3.232 N/A GLY 369.A N PHE 461.A O no hydrogen 2.883 N/A ASN 371.A ND2 LEU 208.A O no hydrogen 2.885 N/A ASN 371.A ND2 VAL 377.A O no hydrogen 3.600 N/A ALA 373.A N ASN 371.A OD1 no hydrogen 2.709 N/A THR 374.A N ASN 371.A OD1 no hydrogen 2.626 N/A THR 374.A OG1 TYR 172.A OH no hydrogen 2.739 N/A VAL 377.A N THR 374.A O no hydrogen 2.743 N/A LYS 379.A NZ SER 209.A O no hydrogen 2.908 N/A LYS 379.A NZ SER 214.A OG no hydrogen 2.920 N/A LYS 379.A NZ ASP 381.A OD2 no hydrogen 2.689 N/A LYS 379.A NZ TYR 499.A OH no hydrogen 3.492 N/A ASP 381.A N SER 214.A O no hydrogen 2.936 N/A ILE 382.A N SER 214.A O no hydrogen 3.339 N/A SER 383.A N GLY 466.A O no hydrogen 2.898 N/A SER 383.A OG SER 218.A OG no hydrogen 2.830 N/A GLY 384.A N ALA 216.A O no hydrogen 3.321 N/A GLY 386.A N SER 218.A O no hydrogen 3.072 N/A GLU 388.A N SER 412.A OG no hydrogen 2.847 N/A ILE 389.A N ILE 411.A O no hydrogen 2.924 N/A ALA 391.A N ASN 409.A O no hydrogen 3.147 N/A ALA 392.A N SER 100.A OG no hydrogen 2.960 N/A TRP 393.A N LEU 407.A O no hydrogen 3.012 N/A TRP 393.A NE1 ALA 397.A O no hydrogen 3.154 N/A TRP 393.A NE1 PRO 398.A O no hydrogen 3.208 N/A ALA 397.A N PRO 394.A O no hydrogen 3.132 N/A VAL 399.A N ILE 402.A O no hydrogen 2.682 N/A ILE 402.A N VAL 399.A O no hydrogen 3.205 N/A ARG 404.A NE VAL 399.A O no hydrogen 2.794 N/A ARG 404.A NH2 TYR 319.A O no hydrogen 2.817 N/A ARG 404.A NH2 VAL 399.A O no hydrogen 2.864 N/A ASN 405.A N TYR 113.A OH no hydrogen 2.884 N/A THR 406.A N ARG 404.A O no hydrogen 3.034 N/A THR 406.A OG1 ASN 111.A O no hydrogen 3.455 N/A THR 406.A OG1 PHE 408.A O no hydrogen 2.578 N/A PHE 408.A N THR 406.A OG1 no hydrogen 2.910 N/A ASN 409.A N ALA 391.A O no hydrogen 3.005 N/A ILE 410.A N ASN 409.A OD1 no hydrogen 2.846 N/A ILE 411.A N ILE 389.A O no hydrogen 3.095 N/A GLY 413.A N GLY 386.A O no hydrogen 2.776 N/A THR 414.A N ASN 197.A OD1 no hydrogen 2.967 N/A THR 414.A OG1 ASN 197.A OD1 no hydrogen 2.816 N/A SER 415.A OG.A HIS 94.A NE2 no hydrogen 3.074 N/A SER 415.A OG.B HIS 94.A NE2 no hydrogen 3.273 N/A SER 415.A OG.B SER 163.A O no hydrogen 2.831 N/A MET 416.A N GLY 413.A O no hydrogen 2.898 N/A SER 417.A OG ALA 216.A O no hydrogen 2.908 N/A SER 417.A OG THR 414.A O no hydrogen 3.134 N/A CYS 418.A N THR 414.A O no hydrogen 3.018 N/A CYS 418.A SG SER 163.A OG no hydrogen 3.621 N/A CYS 418.A SG SER 192.A O no hydrogen 3.250 N/A CYS 418.A SG SER 192.A OG no hydrogen 3.541 N/A HIS 420.A N SER 417.A O no hydrogen 3.108 N/A HIS 420.A ND1 MET 416.A O no hydrogen 2.788 N/A HIS 420.A NE2 SER 4.A OG no hydrogen 2.841 N/A ILE 421.A N SER 417.A O no hydrogen 3.105 N/A THR 422.A N CYS 418.A O no hydrogen 2.925 N/A THR 422.A OG1 SER 161.A OG no hydrogen 2.722 N/A THR 422.A OG1 CYS 418.A O no hydrogen 3.161 N/A GLY 423.A N PRO 419.A O no hydrogen 2.939 N/A ILE 424.A N HIS 420.A O no hydrogen 2.977 N/A ALA 425.A N ILE 421.A O no hydrogen 2.796 N/A THR 426.A N THR 422.A O no hydrogen 2.977 N/A THR 426.A OG1 THR 422.A O no hydrogen 2.737 N/A TYR 427.A N GLY 423.A O no hydrogen 2.964 N/A TYR 427.A OH PRO 15.A O no hydrogen 2.628 N/A VAL 428.A N ILE 424.A O no hydrogen 2.940 N/A LYS 429.A N ALA 425.A O no hydrogen 2.968 N/A THR 430.A N THR 426.A O no hydrogen 2.953 N/A THR 430.A OG1 TYR 427.A O no hydrogen 2.553 N/A TYR 431.A N VAL 428.A O no hydrogen 3.133 N/A ASN 432.A N LYS 429.A O no hydrogen 3.091 N/A ASN 432.A ND2 VAL 428.A O no hydrogen 3.056 N/A ASN 432.A ND2 VAL 474.A O no hydrogen 3.165 N/A TRP 435.A N ASN 432.A O no hydrogen 3.183 N/A SER 436.A OG ASP 481.A OD1 no hydrogen 2.765 N/A ALA 439.A N SER 436.A OG no hydrogen 3.191 N/A ILE 440.A N SER 436.A O no hydrogen 3.061 N/A LYS 441.A N PRO 437.A O no hydrogen 2.966 N/A LYS 441.A NZ LEU 212.A O no hydrogen 2.916 N/A LYS 441.A NZ ASP 381.A OD2 no hydrogen 3.392 N/A LYS 441.A NZ TYR 499.A OH no hydrogen 2.673 N/A SER 442.A N ALA 438.A O no hydrogen 2.868 N/A ALA 443.A N ALA 439.A O no hydrogen 2.987 N/A LEU 444.A N ILE 440.A O no hydrogen 3.255 N/A MET 445.A N LYS 441.A O no hydrogen 3.081 N/A THR 446.A N SER 442.A O no hydrogen 2.848 N/A THR 446.A OG1 SER 442.A O no hydrogen 3.117 N/A THR 447.A OG1 ALA 443.A O no hydrogen 2.783 N/A ALA 448.A N MET 445.A O no hydrogen 3.337 N/A SER 449.A N HIS 467.A O no hydrogen 2.733 N/A ARG 454.A N ASN 452.A OD1 no hydrogen 2.707 N/A PHE 455.A N ASN 452.A O no hydrogen 3.078 N/A ASN 456.A N ASN 452.A O no hydrogen 3.254 N/A ASN 456.A ND2 VAL 362.A O no hydrogen 3.580 N/A GLN 458.A NE2 PRO 200.A O no hydrogen 2.819 N/A ALA 459.A N ASN 456.A O no hydrogen 2.753 N/A PHE 461.A N GLN 458.A O no hydrogen 3.136 N/A ALA 462.A N ALA 459.A O no hydrogen 2.824 N/A TYR 463.A N ALA 459.A O no hydrogen 3.108 N/A GLY 464.A N GLU 460.A O no hydrogen 2.765 N/A SER 465.A N ASP 381.A O no hydrogen 2.936 N/A GLY 466.A N TYR 463.A O no hydrogen 2.981 N/A HIS 467.A N SER 449.A O no hydrogen 2.880 N/A VAL 468.A N SER 383.A O no hydrogen 3.063 N/A LYS 472.A N ASN 469.A O no hydrogen 3.260 N/A ALA 473.A N ASN 469.A O no hydrogen 3.151 N/A ARG 475.A N LYS 472.A O no hydrogen 3.355 N/A VAL 479.A N THR 521.A O no hydrogen 2.934 N/A TYR 480.A N SER 442.A OG no hydrogen 2.929 N/A ALA 482.A N ASP 481.A OD1 no hydrogen 2.583 N/A ASN 483.A ND2 SER 485.A OG no hydrogen 2.608 N/A GLU 484.A N GLU 484.A OE1 no hydrogen 2.519 N/A SER 485.A OG ASP 486.A OD1 no hydrogen 3.298 N/A TYR 487.A N GLU 484.A O no hydrogen 3.081 N/A VAL 488.A N SER 485.A O no hydrogen 2.808 N/A LYS 489.A NZ ASP 486.A O no hydrogen 2.820 N/A ARG 493.A NH1 ASP 496.A OD1 no hydrogen 3.288 N/A ARG 493.A NH1 ASP 496.A OD2 no hydrogen 2.805 N/A ARG 493.A NH2 GLN 514.A OE1 no hydrogen 2.986 N/A LEU 497.A N VAL 494.A O no hydrogen 3.343 N/A ASN 498.A ND2 ASP 481.A O no hydrogen 2.898 N/A ASN 498.A ND2 THR 519.A O no hydrogen 2.909 N/A TYR 499.A N LEU 497.A O no hydrogen 2.673 N/A TYR 499.A OH ASP 381.A OD1 no hydrogen 2.600 N/A PHE 502.A N PRO 589.A O no hydrogen 3.027 N/A LEU 504.A N THR 591.A O no hydrogen 3.040 N/A SER 505.A OG.B ASP 376.A OD1 no hydrogen 3.442 N/A VAL 506.A N THR 593.A O no hydrogen 2.929 N/A SER 509.A N ILE 568.A O no hydrogen 3.139 N/A THR 511.A OG1 SER 567.A OG no hydrogen 3.374 N/A PHE 512.A N GLY 566.A O no hydrogen 2.989 N/A GLN 514.A N VAL 564.A O no hydrogen 3.124 N/A TYR 515.A N GLN 514.A OE1 no hydrogen 2.994 N/A PHE 516.A N LEU 562.A O no hydrogen 2.693 N/A ASN 517.A N TRP 495.A O no hydrogen 3.351 N/A ARG 518.A N PHE 560.A O no hydrogen 2.898 N/A ARG 518.A NE TYR 499.A O no hydrogen 2.734 N/A ARG 518.A NH1 TRP 495.A O no hydrogen 3.271 N/A ARG 518.A NH1 ASN 517.A O no hydrogen 3.093 N/A ARG 518.A NH2 SER 501.A O no hydrogen 3.030 N/A THR 519.A N ASN 498.A OD1 no hydrogen 2.859 N/A THR 519.A OG1 SER 559.A OG no hydrogen 2.793 N/A LEU 520.A N LYS 558.A O no hydrogen 2.741 N/A THR 521.A N VAL 479.A O no hydrogen 2.991 N/A SER 522.A N ASP 556.A O no hydrogen 2.948 N/A SER 522.A OG ALA 524.A O no hydrogen 3.345 N/A VAL 523.A N GLY 477.A O no hydrogen 3.068 N/A GLN 526.A N GLN 526.A OE1 no hydrogen 2.655 N/A SER 528.A N PHE 551.A O no hydrogen 3.268 N/A SER 528.A OG ASP 581.A OD2 no hydrogen 2.751 N/A THR 529.A OG1 SER 550.A OG no hydrogen 2.757 N/A TYR 530.A N LEU 549.A O no hydrogen 2.729 N/A ARG 531.A N SER 580.A O no hydrogen 2.926 N/A ALA 532.A N ASN 547.A O no hydrogen 3.035 N/A MET 533.A N VAL 578.A O no hydrogen 2.781 N/A SER 535.A N SER 576.A O no hydrogen 3.016 N/A GLN 538.A N GLN 538.A OE1 no hydrogen 2.436 N/A LEU 540.A N PRO 537.A O no hydrogen 3.344 N/A THR 541.A N ARG 565.A O no hydrogen 2.685 N/A SER 543.A N THR 563.A O no hydrogen 3.130 N/A ASN 545.A N THR 561.A O no hydrogen 2.981 N/A LEU 549.A N TYR 530.A O no hydrogen 2.876 N/A SER 550.A OG THR 529.A OG1 no hydrogen 2.757 N/A PHE 551.A N SER 528.A O no hydrogen 3.028 N/A ASN 552.A N ASP 556.A OD2 no hydrogen 3.007 N/A GLY 555.A N SER 522.A O no hydrogen 2.863 N/A ASP 556.A N GLY 553.A O no hydrogen 3.081 N/A LYS 558.A N LEU 520.A O no hydrogen 2.875 N/A SER 559.A OG THR 519.A OG1 no hydrogen 2.793 N/A PHE 560.A N ARG 518.A O no hydrogen 2.889 N/A THR 561.A N ASN 545.A O no hydrogen 2.946 N/A LEU 562.A N PHE 516.A O no hydrogen 2.737 N/A THR 563.A N SER 543.A O no hydrogen 2.977 N/A VAL 564.A N GLN 514.A O no hydrogen 2.897 N/A ARG 565.A N THR 541.A O no hydrogen 2.946 N/A ARG 565.A NE ASN 513.A OD1 no hydrogen 2.733 N/A GLY 566.A N PHE 512.A O no hydrogen 3.271 N/A SER 567.A N GLY 539.A O no hydrogen 3.203 N/A SER 567.A OG GLN 510.A O no hydrogen 2.692 N/A SER 567.A OG GLY 566.A O no hydrogen 2.783 N/A VAL 573.A N ILE 592.A O no hydrogen 2.841 N/A SER 574.A OG GLU 460.A OE1 no hydrogen 2.591 N/A ALA 575.A N ILE 590.A O no hydrogen 2.819 N/A SER 576.A N SER 535.A O no hydrogen 2.949 N/A LEU 577.A N SER 588.A O no hydrogen 2.946 N/A VAL 578.A N MET 533.A O no hydrogen 2.924 N/A TRP 579.A N VAL 586.A O no hydrogen 2.992 N/A SER 580.A N ARG 531.A O no hydrogen 3.060 N/A SER 580.A OG HIS 584.A O no hydrogen 2.816 N/A GLY 582.A N SER 580.A OG no hydrogen 2.969 N/A VAL 583.A N ASP 581.A OD1 no hydrogen 2.798 N/A HIS 584.A N ASP 581.A OD1 no hydrogen 2.694 N/A HIS 584.A ND1 ASP 581.A OD2 no hydrogen 3.109 N/A VAL 586.A N TRP 579.A O no hydrogen 2.818 N/A ARG 587.A N THR 446.A O no hydrogen 3.043 N/A ARG 587.A NH1 SER 465.A O no hydrogen 2.730 N/A SER 588.A N LEU 577.A O no hydrogen 2.850 N/A SER 588.A OG PRO 500.A O no hydrogen 2.709 N/A ILE 590.A N ALA 575.A O no hydrogen 2.817 N/A THR 591.A N PHE 502.A O no hydrogen 2.916 N/A THR 591.A OG1 GLU 460.A OE1 no hydrogen 3.004 N/A ILE 592.A N VAL 573.A O no hydrogen 2.881 N/A THR 593.A N LEU 504.A O no hydrogen 3.031 N/A THR 593.A OG1 PHE 571.A O no hydrogen 2.910 N/A SER 594.A N PHE 571.A O no hydrogen 3.066 N/A SER 594.A OG GLY 570.A O no hydrogen 3.107 N/A LEU 595.A N THR 593.A OG1 no hydrogen 3.021 N/A