Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ji9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ILE 171.A O no hydrogen 2.741 N/A GLY 6.A N GLN 169.A O no hydrogen 3.014 N/A PHE 7.A N PHE 167.A O no hydrogen 3.343 N/A HIS 8.A N ASP 5.A OD1 no hydrogen 3.100 N/A VAL 9.A N ASP 5.A O no hydrogen 3.021 N/A LEU 10.A N GLY 6.A O no hydrogen 2.944 N/A ILE 11.A N PHE 7.A O no hydrogen 3.035 N/A ASP 12.A N HIS 8.A O no hydrogen 2.803 N/A ALA 13.A N VAL 9.A O no hydrogen 2.848 N/A LEU 14.A N LEU 10.A O no hydrogen 2.927 N/A LYS 15.A N ILE 11.A O no hydrogen 3.010 N/A LYS 15.A NZ ASP 40.A OD1 no hydrogen 2.752 N/A MET 16.A N ASP 12.A O no hydrogen 2.915 N/A ASN 17.A N ALA 13.A O no hydrogen 3.362 N/A ASN 17.A N LEU 14.A O no hydrogen 3.219 N/A ASN 17.A ND2 ALA 13.A O no hydrogen 2.967 N/A ASP 18.A N LYS 15.A O no hydrogen 2.869 N/A ILE 19.A N LEU 14.A O no hydrogen 3.077 N/A THR 21.A OG1 ASP 20.A OD1 no hydrogen 2.617 N/A MET 22.A N ARG 43.A O no hydrogen 3.034 N/A TYR 23.A N VAL 69.A O no hydrogen 3.045 N/A GLY 24.A N TYR 45.A O no hydrogen 2.891 N/A VAL 25.A N LEU 71.A O no hydrogen 3.254 N/A GLY 27.A N THR 31.A OG1 no hydrogen 2.744 N/A ILE 30.A N GLY 27.A O no hydrogen 2.935 N/A LEU 33.A N ILE 30.A O no hydrogen 3.312 N/A ALA 34.A N ILE 30.A O no hydrogen 3.384 N/A ARG 35.A N THR 31.A O no hydrogen 3.005 N/A ARG 35.A NH1 ASN 32.A OD1 no hydrogen 3.380 N/A MET 36.A N ASN 32.A O no hydrogen 3.106 N/A TRP 37.A N LEU 33.A O no hydrogen 2.847 N/A TRP 37.A NE1 ARG 43.A O no hydrogen 3.112 N/A GLN 38.A N ALA 34.A O no hydrogen 3.259 N/A ASP 39.A N ARG 35.A O no hydrogen 2.782 N/A ASP 40.A N MET 36.A O no hydrogen 2.917 N/A GLY 41.A N GLN 38.A O no hydrogen 3.024 N/A GLN 42.A N TRP 37.A O no hydrogen 3.131 N/A GLN 42.A NE2 ASP 40.A OD1 no hydrogen 3.528 N/A ARG 43.A N ASP 20.A O no hydrogen 3.046 N/A ARG 43.A NE THR 21.A OG1 no hydrogen 2.946 N/A ARG 43.A NH1 ALA 434.A O no hydrogen 3.337 N/A ARG 43.A NH2 THR 21.A OG1 no hydrogen 3.364 N/A ARG 43.A NH2 ALA 434.A O no hydrogen 3.088 N/A TYR 45.A N MET 22.A O no hydrogen 2.947 N/A SER 46.A N TYR 462.A OH no hydrogen 2.854 N/A PHE 47.A N GLY 24.A O no hydrogen 2.853 N/A ARG 48.A N GLU 455.A OE1 no hydrogen 2.968 N/A ARG 48.A N GLU 455.A OE2 no hydrogen 3.096 N/A GLU 50.A N GLU 50.A OE1 no hydrogen 2.952 N/A GLN 51.A N HIS 49.A ND1 no hydrogen 3.156 N/A GLN 51.A NE2 THR 83.A OG1 no hydrogen 2.968 N/A HIS 52.A N HIS 49.A O no hydrogen 3.280 N/A GLY 54.A N GLU 50.A O no hydrogen 2.930 N/A TYR 55.A N GLN 51.A O no hydrogen 2.936 N/A ALA 56.A N HIS 52.A O no hydrogen 3.034 N/A ALA 57.A N ALA 53.A O no hydrogen 3.105 N/A SER 58.A N GLY 54.A O no hydrogen 2.965 N/A SER 58.A OG TYR 55.A O no hydrogen 2.634 N/A ILE 59.A N TYR 55.A O no hydrogen 3.180 N/A ALA 60.A N ALA 56.A O no hydrogen 3.009 N/A GLY 61.A N ALA 57.A O no hydrogen 3.204 N/A GLY 61.A N SER 58.A O no hydrogen 3.201 N/A TYR 62.A N SER 58.A O no hydrogen 3.260 N/A ILE 63.A N ILE 59.A O no hydrogen 2.961 N/A GLU 64.A N ALA 60.A O no hydrogen 3.112 N/A GLY 65.A N GLY 61.A O no hydrogen 2.857 N/A LYS 66.A NZ ASP 18.A O no hydrogen 2.770 N/A GLY 68.A N PRO 94.A O no hydrogen 3.201 N/A CYS 70.A N ILE 96.A O no hydrogen 3.007 N/A CYS 70.A SG TYR 23.A O no hydrogen 3.702 N/A LEU 71.A N TYR 23.A O no hydrogen 2.959 N/A THR 72.A N LEU 98.A O no hydrogen 3.056 N/A THR 72.A OG1 VAL 73.A O no hydrogen 2.994 N/A THR 72.A OG1 SER 99.A OG no hydrogen 2.574 N/A SER 74.A OG GLU 115.A OE1 no hydrogen 2.848 N/A ALA 75.A N GLN 119.A OE1 no hydrogen 2.986 N/A GLY 77.A N SER 74.A O no hydrogen 2.971 N/A PHE 78.A N SER 74.A O no hydrogen 3.343 N/A LEU 79.A N ALA 75.A O no hydrogen 2.803 N/A ASN 80.A N PRO 76.A O no hydrogen 3.174 N/A ASN 80.A ND2 GLU 50.A OE1 no hydrogen 2.842 N/A GLY 81.A N GLY 77.A O no hydrogen 3.083 N/A VAL 82.A N PHE 78.A O no hydrogen 2.732 N/A THR 83.A N LEU 79.A O no hydrogen 3.301 N/A THR 83.A OG1 ASN 80.A O no hydrogen 2.585 N/A SER 84.A N GLY 81.A O no hydrogen 2.920 N/A SER 84.A OG GLN 51.A O no hydrogen 2.642 N/A LEU 85.A N GLY 81.A O no hydrogen 3.132 N/A ALA 86.A N VAL 82.A O no hydrogen 3.078 N/A HIS 87.A NE2 TYR 428.A OH no hydrogen 2.761 N/A ALA 88.A N SER 84.A O no hydrogen 2.902 N/A THR 89.A N LEU 85.A O no hydrogen 2.856 N/A THR 89.A OG1 LEU 85.A O no hydrogen 3.104 N/A THR 89.A OG1 HIS 126.A O no hydrogen 2.812 N/A THR 90.A N ALA 86.A O no hydrogen 2.982 N/A THR 90.A OG1 ALA 86.A O no hydrogen 2.855 N/A ASN 91.A N HIS 87.A O no hydrogen 3.106 N/A ASN 91.A N ALA 88.A O no hydrogen 3.272 N/A ASN 91.A ND2 HIS 87.A O no hydrogen 2.821 N/A CYS 92.A N THR 89.A O no hydrogen 3.267 N/A PHE 93.A N ALA 88.A O no hydrogen 2.897 N/A MET 95.A N GLY 156.A O no hydrogen 3.323 N/A ILE 96.A N GLY 68.A O no hydrogen 2.839 N/A LEU 97.A N VAL 158.A O no hydrogen 2.828 N/A LEU 98.A N CYS 70.A O no hydrogen 2.740 N/A SER 99.A N VAL 160.A O no hydrogen 3.199 N/A SER 99.A OG THR 72.A OG1 no hydrogen 2.574 N/A GLY 100.A N THR 72.A O no hydrogen 3.282 N/A SER 101.A N LEU 162.A O no hydrogen 3.072 N/A SER 101.A OG ASP 161.A OD2 no hydrogen 2.757 N/A SER 102.A OG TYR 114.A O no hydrogen 2.486 N/A SER 102.A OG GLU 115.A O no hydrogen 3.238 N/A GLU 103.A N ASP 113.A OD2 no hydrogen 2.887 N/A ARG 104.A NE ASP 108.A OD1 no hydrogen 3.049 N/A ARG 104.A NE ASP 108.A OD2 no hydrogen 3.220 N/A ARG 104.A NH2 ASP 108.A OD1 no hydrogen 3.260 N/A ILE 106.A N GLU 103.A O no hydrogen 3.247 N/A VAL 107.A N GLU 103.A O no hydrogen 3.005 N/A ASP 108.A N ARG 104.A O no hydrogen 3.024 N/A GLN 110.A N VAL 107.A O no hydrogen 3.028 N/A GLN 111.A N ILE 106.A O no hydrogen 3.193 N/A GLY 112.A N GLU 116.A OE1 no hydrogen 2.741 N/A ASP 113.A N GLU 116.A OE1 no hydrogen 3.069 N/A TYR 114.A N ASP 113.A OD1 no hydrogen 2.843 N/A GLN 119.A NE2 GLY 100.A O no hydrogen 3.269 N/A GLN 119.A NE2 TYR 159.A OH no hydrogen 2.881 N/A ASN 121.A N ASP 118.A OD1 no hydrogen 2.982 N/A VAL 122.A N ASP 118.A O no hydrogen 2.862 N/A ALA 123.A N GLN 119.A O no hydrogen 3.059 N/A ARG 124.A N ASN 121.A O no hydrogen 3.307 N/A ARG 124.A NE ASN 121.A OD1.A no hydrogen 3.225 N/A ARG 124.A NH2 ASN 121.A OD1.A no hydrogen 2.940 N/A HIS 126.A N ALA 123.A O no hydrogen 2.849 N/A CYS 127.A SG ALA 123.A O no hydrogen 3.140 N/A CYS 127.A SG ALA 129.A O no hydrogen 3.253 N/A LYS 128.A N GLY 157.A O no hydrogen 2.800 N/A LYS 128.A NZ THR 149.A O no hydrogen 2.482 N/A LYS 128.A NZ ARG 154.A O no hydrogen 2.744 N/A SER 130.A OG MET 120.A O no hydrogen 2.440 N/A PHE 131.A N TYR 159.A O no hydrogen 2.884 N/A ARG 132.A NE ASP 161.A OD2 no hydrogen 2.882 N/A ARG 132.A NH2 ASP 118.A OD1 no hydrogen 3.467 N/A ILE 133.A N ASP 161.A O no hydrogen 3.165 N/A ILE 136.A N GLN 169.A OE1 no hydrogen 2.931 N/A LYS 137.A NZ ASP 138.A OD1 no hydrogen 3.025 N/A LYS 137.A NZ ASP 138.A OD2 no hydrogen 2.921 N/A ASP 138.A N SER 135.A O no hydrogen 3.168 N/A ILE 139.A N ILE 136.A O no hydrogen 3.226 N/A GLY 142.A N ASP 138.A O no hydrogen 2.758 N/A ILE 143.A N ILE 139.A O no hydrogen 2.948 N/A ALA 144.A N PRO 140.A O no hydrogen 3.035 N/A ARG 145.A N ILE 141.A O no hydrogen 2.922 N/A ALA 146.A N GLY 142.A O no hydrogen 3.107 N/A VAL 147.A N ILE 143.A O no hydrogen 3.016 N/A ARG 148.A N ALA 144.A O no hydrogen 2.980 N/A ARG 148.A NH1 ILE 184.A O no hydrogen 3.409 N/A ARG 148.A NH1 ASP 185.A O no hydrogen 3.416 N/A ARG 148.A NH2 ILE 184.A O no hydrogen 2.760 N/A THR 149.A N ARG 145.A O no hydrogen 2.926 N/A THR 149.A OG1 ARG 145.A O no hydrogen 2.638 N/A ALA 150.A N ALA 146.A O no hydrogen 2.977 N/A VAL 151.A N VAL 147.A O no hydrogen 3.031 N/A SER 152.A N ARG 148.A O no hydrogen 2.807 N/A SER 152.A OG ARG 148.A O no hydrogen 2.527 N/A ARG 154.A NH2 GLU 305.A OE2 no hydrogen 3.092 N/A GLY 156.A N ALA 150.A O no hydrogen 2.939 N/A GLY 157.A N THR 89.A OG1 no hydrogen 3.279 N/A VAL 158.A N MET 95.A O no hydrogen 2.800 N/A TYR 159.A N ALA 129.A O no hydrogen 3.204 N/A TYR 159.A OH ASP 161.A OD1 no hydrogen 2.489 N/A VAL 160.A N LEU 97.A O no hydrogen 2.883 N/A ASP 161.A N PHE 131.A O no hydrogen 2.985 N/A LEU 162.A N SER 99.A O no hydrogen 2.804 N/A ALA 164.A N SER 101.A O no hydrogen 2.728 N/A LEU 166.A N PRO 163.A O no hydrogen 2.901 N/A PHE 167.A N ALA 164.A O no hydrogen 3.399 N/A GLN 169.A N LEU 166.A O no hydrogen 3.469 N/A GLN 169.A NE2 ASN 134.A O no hydrogen 3.039 N/A GLN 169.A NE2 LYS 165.A O no hydrogen 3.469 N/A ILE 171.A N THR 4.A O no hydrogen 2.972 N/A VAL 173.A N GLU 2.A O no hydrogen 3.321 N/A GLU 175.A N SER 172.A OG no hydrogen 3.320 N/A ALA 176.A N SER 172.A O no hydrogen 2.969 N/A ASN 177.A N VAL 173.A O no hydrogen 2.850 N/A LYS 178.A N GLU 174.A O no hydrogen 3.238 N/A LYS 178.A N GLU 175.A O no hydrogen 3.168 N/A LEU 179.A N GLU 175.A O no hydrogen 3.092 N/A LEU 180.A N ALA 176.A O no hydrogen 2.959 N/A GLN 190.A N ASP 319.A OD1 no hydrogen 2.918 N/A GLN 190.A NE2 ALA 189.A O no hydrogen 3.021 N/A ILE 197.A N ALA 193.A O no hydrogen 3.397 N/A ALA 198.A N GLU 194.A O no hydrogen 2.906 N/A ARG 199.A N ASP 195.A O no hydrogen 2.930 N/A ALA 200.A N ALA 196.A O no hydrogen 3.383 N/A ALA 201.A N ILE 197.A O no hydrogen 2.770 N/A ASP 202.A N ALA 198.A O no hydrogen 2.973 N/A LEU 203.A N ARG 199.A O no hydrogen 3.355 N/A ILE 204.A N ALA 200.A O no hydrogen 3.060 N/A LYS 205.A N ALA 201.A O no hydrogen 2.857 N/A ASN 206.A N ASP 202.A O no hydrogen 3.236 N/A ASN 206.A ND2 ASP 202.A O no hydrogen 2.739 N/A ALA 207.A N ILE 204.A O no hydrogen 3.212 N/A LYS 208.A N ASP 268.A OD2 no hydrogen 2.821 N/A LYS 208.A NZ ASN 206.A O no hydrogen 2.873 N/A ARG 209.A N ASP 268.A OD1 no hydrogen 3.016 N/A ARG 209.A NE GLN 266.A O no hydrogen 2.823 N/A VAL 211.A N VAL 269.A O no hydrogen 3.028 N/A ILE 212.A N PRO 237.A O no hydrogen 2.993 N/A MET 213.A N VAL 271.A O no hydrogen 2.926 N/A LEU 214.A N LEU 239.A O no hydrogen 2.873 N/A GLY 215.A N ILE 273.A O no hydrogen 3.097 N/A LYS 216.A NZ ASN 91.A OD1 no hydrogen 3.122 N/A LYS 216.A NZ THR 418.A OG1 no hydrogen 3.009 N/A GLY 217.A N GLY 274.A O no hydrogen 3.220 N/A ALA 218.A N GLY 215.A O no hydrogen 3.057 N/A ALA 219.A N GLY 215.A O no hydrogen 3.395 N/A TYR 220.A N LYS 216.A O no hydrogen 2.822 N/A ALA 221.A N GLY 217.A O no hydrogen 3.177 N/A GLN 222.A N ALA 219.A O no hydrogen 3.276 N/A ILE 227.A N CYS 223.A O no hydrogen 3.067 N/A ARG 228.A N ASP 224.A O no hydrogen 2.986 N/A ARG 228.A NE GLU 232.A OE2 no hydrogen 2.914 N/A ALA 229.A N ASP 225.A O no hydrogen 2.818 N/A LEU 230.A N GLU 226.A O no hydrogen 3.004 N/A VAL 231.A N ILE 227.A O no hydrogen 3.152 N/A GLU 232.A N ARG 228.A O no hydrogen 2.951 N/A GLU 233.A N ALA 229.A O no hydrogen 2.927 N/A THR 234.A N LEU 230.A O no hydrogen 3.155 N/A THR 234.A OG1 LEU 230.A O no hydrogen 2.634 N/A THR 234.A OG1 VAL 231.A O no hydrogen 3.382 N/A GLY 235.A N VAL 231.A O no hydrogen 2.998 N/A PHE 238.A N GLN 254.A O no hydrogen 3.005 N/A LEU 239.A N ILE 212.A O no hydrogen 2.758 N/A MET 241.A N LEU 214.A O no hydrogen 2.783 N/A ALA 244.A N MET 241.A O no hydrogen 2.861 N/A LYS 245.A N MET 241.A O no hydrogen 3.210 N/A LYS 245.A NZ ASP 250.A OD2 no hydrogen 2.787 N/A LYS 245.A NZ ARG 402.A O no hydrogen 2.880 N/A LYS 245.A NZ VAL 405.A O no hydrogen 3.342 N/A GLY 246.A N ASP 250.A OD1 no hydrogen 3.055 N/A LEU 247.A N ALA 244.A O no hydrogen 3.049 N/A ASP 250.A N MET 407.A O no hydrogen 3.004 N/A HIS 252.A N PRO 249.A O no hydrogen 2.966 N/A HIS 252.A NE2 GLU 232.A OE2 no hydrogen 3.037 N/A GLN 254.A N HIS 252.A ND1 no hydrogen 3.211 N/A SER 255.A N HIS 252.A O no hydrogen 3.088 N/A ALA 256.A N PHE 238.A O no hydrogen 2.810 N/A ALA 257.A N SER 255.A OG no hydrogen 3.345 N/A THR 259.A N ALA 256.A O no hydrogen 2.870 N/A ARG 260.A NH2 GLN 282.A OE1 no hydrogen 3.471 N/A ALA 263.A N THR 259.A O no hydrogen 3.032 N/A LEU 264.A N ARG 260.A O no hydrogen 2.912 N/A ALA 265.A N ALA 261.A O no hydrogen 3.078 N/A GLN 266.A N PHE 262.A O no hydrogen 3.056 N/A CYS 267.A N ALA 263.A O no hydrogen 3.039 N/A CYS 267.A SG LEU 264.A O no hydrogen 3.480 N/A ASP 268.A N ARG 209.A O no hydrogen 3.102 N/A VAL 269.A N ASP 268.A OD1 no hydrogen 2.751 N/A CYS 270.A N LYS 295.A O no hydrogen 2.952 N/A VAL 271.A N VAL 211.A O no hydrogen 2.843 N/A LEU 272.A N VAL 297.A O no hydrogen 2.657 N/A ILE 273.A N MET 213.A O no hydrogen 2.940 N/A GLY 274.A N ILE 299.A O no hydrogen 3.137 N/A ARG 276.A NH2 THR 90.A O no hydrogen 2.756 N/A TRP 279.A NE1 THR 418.A O no hydrogen 2.773 N/A LEU 280.A N ASN 278.A OD1 no hydrogen 3.107 N/A MET 281.A N ASN 278.A O no hydrogen 3.038 N/A GLN 282.A N TRP 279.A O no hydrogen 3.003 N/A GLN 282.A NE2 LEU 280.A O no hydrogen 3.425 N/A HIS 283.A N ASN 278.A O no hydrogen 2.822 N/A HIS 283.A ND1 ASN 309.A OD1 no hydrogen 2.729 N/A GLY 284.A N MET 281.A O no hydrogen 3.281 N/A LYS 285.A N GLN 282.A O no hydrogen 3.144 N/A THR 288.A OG1 GLN 282.A OE1 no hydrogen 3.268 N/A TRP 289.A N GLY 286.A O no hydrogen 3.340 N/A TRP 289.A NE1 MET 281.A O no hydrogen 2.818 N/A GLY 290.A N LYS 287.A O no hydrogen 3.101 N/A ASP 291.A N GLY 286.A O no hydrogen 3.036 N/A LYS 294.A NZ ALA 265.A O no hydrogen 2.922 N/A LYS 294.A NZ CYS 267.A O no hydrogen 3.054 N/A LYS 294.A NZ TRP 289.A O no hydrogen 3.168 N/A LYS 295.A N ASP 268.A O no hydrogen 2.989 N/A VAL 297.A N CYS 270.A O no hydrogen 2.887 N/A GLN 298.A N ALA 314.A O no hydrogen 3.148 N/A GLN 298.A NE2 ALA 275.A O no hydrogen 3.109 N/A ILE 299.A N LEU 272.A O no hydrogen 2.758 N/A ASP 300.A N VAL 316.A O no hydrogen 3.086 N/A GLN 302.A N ASP 300.A OD1 no hydrogen 2.945 N/A GLN 302.A NE2 ASN 304.A OD1 no hydrogen 2.676 N/A GLU 305.A N GLN 302.A O no hydrogen 3.331 N/A MET 306.A N ALA 303.A O no hydrogen 3.369 N/A SER 308.A N GLU 305.A O no hydrogen 3.345 N/A SER 308.A OG GLU 305.A O no hydrogen 2.880 N/A SER 308.A OG GLU 305.A OE1 no hydrogen 2.939 N/A ASN 309.A ND2 SER 308.A OG no hydrogen 3.191 N/A GLN 310.A NE2 GLY 284.A O no hydrogen 2.687 N/A ILE 312.A N ASP 307.A OD1 no hydrogen 2.762 N/A ALA 314.A N TYR 296.A O no hydrogen 2.990 N/A VAL 316.A N GLN 298.A O no hydrogen 2.810 N/A GLY 318.A N ASP 300.A O no hydrogen 3.159 N/A ASP 319.A N GLN 190.A O no hydrogen 2.955 N/A SER 322.A N ASP 319.A OD2 no hydrogen 3.261 N/A SER 322.A OG ASP 319.A OD1 no hydrogen 2.617 N/A SER 322.A OG ASP 319.A OD2 no hydrogen 3.499 N/A ALA 323.A N ASP 319.A O no hydrogen 3.088 N/A VAL 324.A N ILE 320.A O no hydrogen 2.875 N/A SER 325.A N LYS 321.A O no hydrogen 3.086 N/A LEU 326.A N SER 322.A O no hydrogen 3.211 N/A LEU 327.A N ALA 323.A O no hydrogen 2.848 N/A ARG 328.A N VAL 324.A O no hydrogen 2.863 N/A ARG 328.A NE GLU 233.A OE1 no hydrogen 3.099 N/A ARG 328.A NH1 GLU 233.A OE2 no hydrogen 2.882 N/A ARG 328.A NH2 GLU 226.A OE1 no hydrogen 2.963 N/A LYS 329.A N SER 325.A O no hydrogen 3.416 N/A ALA 330.A N LEU 326.A O no hydrogen 2.921 N/A LEU 331.A N LEU 327.A O no hydrogen 2.951 N/A LEU 331.A N ARG 328.A O no hydrogen 3.212 N/A LYS 332.A N LYS 329.A O no hydrogen 3.427 N/A ALA 334.A N LEU 331.A O no hydrogen 3.168 N/A LYS 336.A NZ GLU 232.A O no hydrogen 3.484 N/A ALA 337.A N THR 234.A O no hydrogen 3.021 N/A GLU 340.A N ASP 338.A OD1 no hydrogen 3.202 N/A TRP 341.A NE1 PRO 210.A O no hydrogen 2.979 N/A THR 342.A N ASP 338.A O no hydrogen 2.991 N/A THR 342.A OG1 ASP 338.A O no hydrogen 3.405 N/A THR 342.A OG1 ALA 339.A O no hydrogen 3.481 N/A GLY 343.A N ALA 339.A O no hydrogen 2.764 N/A ALA 344.A N GLU 340.A O no hydrogen 3.135 N/A LEU 345.A N TRP 341.A O no hydrogen 3.166 N/A LYS 346.A N THR 342.A O no hydrogen 3.255 N/A ALA 347.A N GLY 343.A O no hydrogen 3.059 N/A LYS 348.A N ALA 344.A O no hydrogen 3.274 N/A VAL 349.A N LEU 345.A O no hydrogen 2.938 N/A ASP 350.A N LYS 346.A O no hydrogen 2.989 N/A GLY 351.A N ALA 347.A O no hydrogen 3.089 N/A ASN 352.A N LYS 348.A O no hydrogen 2.981 N/A ASN 352.A ND2 ALA 258.A O no hydrogen 2.686 N/A LYS 353.A N VAL 349.A O no hydrogen 2.970 N/A ALA 354.A N ASP 350.A O no hydrogen 3.037 N/A LYS 355.A N GLY 351.A O no hydrogen 3.349 N/A LEU 356.A N ASN 352.A O no hydrogen 3.151 N/A ALA 357.A N LYS 353.A O no hydrogen 3.039 N/A GLY 358.A N ALA 354.A O no hydrogen 3.323 N/A MET 360.A N LEU 356.A O no hydrogen 3.017 N/A THR 361.A N ALA 357.A O no hydrogen 3.348 N/A THR 361.A OG1 ALA 357.A O no hydrogen 3.557 N/A THR 361.A OG1 GLY 358.A O no hydrogen 3.461 N/A ALA 362.A N LYS 359.A O no hydrogen 3.321 N/A GLY 367.A N ASN 514.A O no hydrogen 2.855 N/A MET 368.A N PRO 365.A O no hydrogen 3.102 N/A MET 369.A N MET 538.A O no hydrogen 3.190 N/A ASN 370.A N ASN 373.A OD1 no hydrogen 3.165 N/A ASN 373.A ND2 ALA 362.A O no hydrogen 3.406 N/A ASN 373.A ND2 THR 364.A OG1 no hydrogen 3.037 N/A SER 374.A N ASN 370.A O no hydrogen 3.414 N/A SER 374.A OG ASN 370.A O no hydrogen 2.509 N/A LEU 375.A N TYR 371.A O no hydrogen 3.277 N/A GLY 376.A N SER 372.A O no hydrogen 2.810 N/A VAL 377.A N SER 374.A O no hydrogen 3.204 N/A ARG 379.A N LEU 375.A O no hydrogen 2.770 N/A ARG 379.A NH1 ASP 380.A OD2 no hydrogen 3.514 N/A ASP 380.A N GLY 376.A O no hydrogen 3.088 N/A PHE 381.A N VAL 377.A O no hydrogen 3.104 N/A MET 382.A N VAL 378.A O no hydrogen 2.972 N/A LEU 383.A N ARG 379.A O no hydrogen 3.045 N/A ALA 384.A N ASP 380.A O no hydrogen 3.228 N/A ASN 385.A N PHE 381.A O no hydrogen 2.697 N/A SER 389.A N PRO 439.A O no hydrogen 3.202 N/A LEU 390.A N LYS 412.A O no hydrogen 2.760 N/A VAL 391.A N ILE 441.A O no hydrogen 2.767 N/A ASN 392.A N LEU 414.A O no hydrogen 3.053 N/A ASN 392.A ND2 ALA 397.A O no hydrogen 3.054 N/A ASN 392.A ND2 VAL 443.A O no hydrogen 2.802 N/A GLU 393.A N VAL 443.A O no hydrogen 3.423 N/A ASN 396.A ND2 VAL 545.A O no hydrogen 2.855 N/A LEU 398.A N ALA 395.A O no hydrogen 2.935 N/A ASP 399.A N ALA 395.A O no hydrogen 2.941 N/A ASN 400.A N ASN 396.A O no hydrogen 3.106 N/A ASN 400.A ND2 ASN 396.A O no hydrogen 2.600 N/A THR 401.A OG1 ALA 397.A O no hydrogen 2.654 N/A ARG 402.A N LEU 398.A O no hydrogen 2.934 N/A ARG 402.A NH2 ASP 399.A OD1 no hydrogen 2.995 N/A MET 403.A N ASP 399.A O no hydrogen 3.204 N/A ILE 404.A N ASN 400.A O no hydrogen 2.979 N/A VAL 405.A N THR 401.A O no hydrogen 2.998 N/A MET 407.A N ASP 250.A OD2 no hydrogen 2.755 N/A ARG 411.A NH1 ALA 219.A O no hydrogen 2.975 N/A ARG 411.A NH1 ASP 224.A OD1 no hydrogen 3.004 N/A ARG 411.A NH1 ASP 224.A OD2 no hydrogen 3.389 N/A ARG 411.A NH2 ASP 224.A OD2 no hydrogen 3.139 N/A LYS 412.A NZ ASP 387.A OD1 no hydrogen 3.077 N/A ARG 413.A NE GLY 242.A O no hydrogen 3.175 N/A ARG 413.A NH1 ASN 392.A OD1 no hydrogen 3.200 N/A ARG 413.A NH2 ASN 392.A OD1 no hydrogen 3.058 N/A ARG 413.A NH2 ASP 415.A OD2 no hydrogen 3.320 N/A LEU 414.A N LEU 390.A O no hydrogen 2.849 N/A SER 416.A OG VAL 421.A O no hydrogen 2.968 N/A GLY 417.A N ASP 415.A OD1 no hydrogen 3.073 N/A THR 418.A N ASN 91.A OD1 no hydrogen 2.921 N/A THR 418.A OG1 ASN 91.A OD1 no hydrogen 3.371 N/A GLY 420.A N GLY 417.A O no hydrogen 3.049 N/A VAL 421.A N SER 416.A O no hydrogen 3.327 N/A GLY 423.A N GLU 393.A OE1 no hydrogen 2.784 N/A ILE 424.A N GLU 393.A OE1 no hydrogen 3.286 N/A MET 426.A N SER 452.A OG no hydrogen 3.277 N/A TYR 428.A N ILE 424.A O no hydrogen 2.938 N/A TYR 428.A OH HIS 87.A NE2 no hydrogen 2.761 N/A CYS 429.A N GLY 425.A O no hydrogen 2.959 N/A CYS 429.A SG GLY 425.A O no hydrogen 3.312 N/A VAL 430.A N MET 426.A O no hydrogen 3.152 N/A ALA 431.A N GLY 427.A O no hydrogen 3.069 N/A ALA 432.A N TYR 428.A O no hydrogen 2.810 N/A ALA 433.A N CYS 429.A O no hydrogen 3.011 N/A ALA 434.A N VAL 430.A O no hydrogen 2.895 N/A VAL 435.A N ALA 431.A O no hydrogen 2.775 N/A THR 436.A N ALA 432.A O no hydrogen 2.998 N/A THR 436.A OG1 ALA 432.A O no hydrogen 2.487 N/A THR 436.A OG1 LYS 438.A O no hydrogen 3.558 N/A GLY 437.A N ALA 433.A O no hydrogen 3.061 N/A LYS 438.A N THR 436.A OG1 no hydrogen 3.354 N/A LYS 438.A NZ ASP 387.A OD1 no hydrogen 3.291 N/A LYS 438.A NZ ASP 387.A OD2 no hydrogen 3.075 N/A VAL 440.A N PRO 465.A O no hydrogen 2.988 N/A ILE 441.A N SER 389.A O no hydrogen 2.791 N/A ALA 442.A N THR 467.A O no hydrogen 2.849 N/A VAL 443.A N VAL 391.A O no hydrogen 2.801 N/A GLU 444.A N ILE 469.A O no hydrogen 2.799 N/A GLY 445.A N GLU 393.A O no hydrogen 2.954 N/A PHE 449.A N GLY 445.A O no hydrogen 2.829 N/A GLY 450.A N ASP 446.A O no hydrogen 3.376 N/A GLY 450.A N SER 447.A O no hydrogen 3.082 N/A PHE 451.A N ALA 448.A O no hydrogen 3.088 N/A SER 452.A N PHE 449.A O no hydrogen 3.126 N/A GLU 455.A N SER 452.A O no hydrogen 3.039 N/A LEU 456.A N GLY 453.A O no hydrogen 3.112 N/A GLU 457.A N MET 454.A O no hydrogen 3.373 N/A THR 458.A OG1 GLU 455.A OE1 no hydrogen 2.781 N/A ILE 459.A N GLU 455.A O no hydrogen 3.049 N/A CYS 460.A N LEU 456.A O no hydrogen 2.922 N/A CYS 460.A SG LEU 456.A O no hydrogen 3.407 N/A ARG 461.A N GLU 457.A O no hydrogen 2.814 N/A ARG 461.A NE GLU 457.A OE1 no hydrogen 3.237 N/A ARG 461.A NE GLU 457.A OE2 no hydrogen 2.942 N/A ARG 461.A NH1 SER 46.A O no hydrogen 3.137 N/A ARG 461.A NH2 SER 46.A O no hydrogen 3.166 N/A ARG 461.A NH2 GLU 457.A OE1 no hydrogen 2.940 N/A TYR 462.A N THR 458.A O no hydrogen 3.110 N/A ASN 463.A N CYS 460.A O no hydrogen 2.828 N/A LEU 464.A N ILE 459.A O no hydrogen 3.161 N/A VAL 466.A N LEU 464.A O no hydrogen 2.801 N/A THR 467.A N VAL 440.A O no hydrogen 2.869 N/A VAL 468.A N CYS 533.A O no hydrogen 3.020 N/A ILE 469.A N ALA 442.A O no hydrogen 2.642 N/A ILE 470.A N ILE 535.A O no hydrogen 2.967 N/A MET 471.A N GLU 444.A O no hydrogen 2.795 N/A ASN 472.A N ALA 537.A O no hydrogen 2.930 N/A ASN 472.A ND2 GLY 497.A O no hydrogen 2.942 N/A ASN 472.A ND2 ASN 536.A OD1 no hydrogen 2.853 N/A ASN 473.A ND2 TYR 477.A O no hydrogen 3.164 N/A GLY 474.A N ASP 446.A OD2 no hydrogen 3.222 N/A ILE 476.A N THR 492.A O no hydrogen 2.867 N/A LYS 478.A N ILE 476.A O no hydrogen 2.771 N/A LYS 478.A NZ ASP 542.A OD1 no hydrogen 2.826 N/A LYS 478.A NZ GLY 544.A O no hydrogen 2.824 N/A GLY 479.A N PRO 541.A O no hydrogen 3.007 N/A ASN 480.A ND2 ASP 542.A OD1 no hydrogen 2.941 N/A VAL 488.A N GLN 485.A O no hydrogen 3.136 N/A THR 492.A OG1 GLU 481.A OE1 no hydrogen 2.642 N/A ARG 493.A N SER 490.A O no hydrogen 3.283 N/A LEU 494.A N GLY 474.A O no hydrogen 2.962 N/A ARG 496.A NE ASN 472.A O no hydrogen 3.168 N/A ARG 496.A NH2 GLY 367.A O no hydrogen 3.221 N/A ARG 496.A NH2 ILE 539.A O no hydrogen 2.715 N/A GLY 497.A N THR 495.A O no hydrogen 2.754 N/A ARG 498.A NE ASP 500.A OD1 no hydrogen 3.199 N/A ARG 498.A NE ASP 500.A OD2 no hydrogen 3.242 N/A ARG 498.A NH2 ASP 500.A OD2 no hydrogen 2.995 N/A MET 501.A N ARG 498.A O no hydrogen 2.992 N/A MET 502.A N ARG 498.A O no hydrogen 3.316 N/A MET 503.A N TYR 499.A O no hydrogen 3.054 N/A GLU 504.A N ASP 500.A O no hydrogen 3.039 N/A ALA 505.A N MET 501.A O no hydrogen 2.893 N/A PHE 506.A N MET 503.A O no hydrogen 3.177 N/A GLY 507.A N GLU 504.A O no hydrogen 3.077 N/A GLY 508.A N MET 503.A O no hydrogen 3.037 N/A LYS 509.A N PRO 532.A O no hydrogen 3.008 N/A LYS 509.A NZ TYR 511.A OH no hydrogen 2.968 N/A GLY 510.A N GLU 504.A OE2 no hydrogen 2.776 N/A TYR 511.A N LEU 534.A O no hydrogen 2.841 N/A ALA 513.A N ASN 536.A O no hydrogen 2.902 N/A ASN 514.A N GLU 518.A OE1 no hydrogen 2.846 N/A GLU 518.A N THR 515.A OG1 no hydrogen 3.090 N/A LEU 519.A N THR 515.A O no hydrogen 2.927 N/A LYS 520.A N PRO 516.A O no hydrogen 2.909 N/A ALA 521.A N ALA 517.A O no hydrogen 3.107 N/A ALA 522.A N GLU 518.A O no hydrogen 3.123 N/A LEU 523.A N LEU 519.A O no hydrogen 2.845 N/A GLU 524.A N LYS 520.A O no hydrogen 2.955 N/A GLU 525.A N ALA 521.A O no hydrogen 2.929 N/A ALA 526.A N ALA 522.A O no hydrogen 2.910 N/A VAL 527.A N LEU 523.A O no hydrogen 3.089 N/A ALA 528.A N GLU 524.A O no hydrogen 3.180 N/A SER 529.A N GLU 525.A O no hydrogen 2.958 N/A SER 529.A OG ALA 526.A O no hydrogen 2.709 N/A GLY 530.A N VAL 527.A O no hydrogen 3.375 N/A LYS 531.A N SER 529.A OG no hydrogen 3.311 N/A CYS 533.A N VAL 466.A O no hydrogen 2.913 N/A CYS 533.A SG ALA 526.A O no hydrogen 4.040 N/A CYS 533.A SG LYS 531.A O no hydrogen 3.419 N/A LEU 534.A N LYS 509.A O no hydrogen 2.875 N/A ILE 535.A N VAL 468.A O no hydrogen 2.686 N/A ASN 536.A N TYR 511.A O no hydrogen 2.706 N/A ASN 536.A ND2 GLY 497.A O no hydrogen 2.949 N/A ASN 536.A ND2 ASP 500.A OD1 no hydrogen 3.285 N/A ALA 537.A N ILE 470.A O no hydrogen 2.957 N/A MET 538.A N ALA 513.A O no hydrogen 3.007 N/A ILE 539.A N ASN 472.A O no hydrogen 3.095 N/A ASP 540.A N MET 369.A O no hydrogen 2.656 N/A ASP 542.A N ASP 540.A OD1 no hydrogen 2.997 N/A ALA 543.A N ASP 540.A O no hydrogen 3.022 N/A VAL 545.A N ASN 396.A OD1 no hydrogen 2.892 N/A