Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lu6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG CYS 58.A O no hydrogen 2.586 N/A HIS 5.A N SER 1.A O no hydrogen 3.029 N/A ARG 6.A N GLU 2.A O no hydrogen 2.805 N/A ARG 6.A NH1 ASP 251.A OD2 no hydrogen 3.134 N/A PHE 7.A N VAL 3.A O no hydrogen 3.069 N/A LYS 8.A N ALA 4.A O no hydrogen 3.068 N/A ASP 9.A N ARG 6.A O no hydrogen 2.917 N/A LEU 10.A N ARG 6.A O no hydrogen 2.954 N/A GLY 11.A N PHE 7.A O no hydrogen 2.793 N/A ASN 14.A ND2 LEU 10.A O no hydrogen 3.486 N/A PHE 15.A N GLY 11.A O no hydrogen 2.990 N/A LYS 16.A N GLU 12.A O no hydrogen 2.722 N/A LYS 16.A NZ GLU 12.A OE2 no hydrogen 2.784 N/A ALA 17.A N GLU 13.A O no hydrogen 2.848 N/A LEU 18.A N ASN 14.A O no hydrogen 2.578 N/A VAL 19.A N PHE 15.A O no hydrogen 2.869 N/A LEU 20.A N LYS 16.A O no hydrogen 3.137 N/A ILE 21.A N ALA 17.A O no hydrogen 3.063 N/A ALA 22.A N LEU 18.A O no hydrogen 2.880 N/A PHE 23.A N VAL 19.A O no hydrogen 2.983 N/A ALA 24.A N LEU 20.A O no hydrogen 2.903 N/A GLN 25.A N ILE 21.A O no hydrogen 2.855 N/A GLN 25.A NE2 HIS 142.A O no hydrogen 2.917 N/A GLN 25.A NE2 PHE 145.A O no hydrogen 3.457 N/A TYR 26.A N PHE 23.A O no hydrogen 2.664 N/A TYR 26.A OH ASN 95.A OD1 no hydrogen 2.694 N/A LEU 27.A N PHE 23.A O no hydrogen 3.031 N/A GLN 28.A NE2 ASP 103.A O no hydrogen 3.082 N/A GLN 28.A NE2 ARG 140.A O no hydrogen 3.348 N/A CYS 30.A N LEU 27.A O no hydrogen 3.307 N/A CYS 30.A SG PRO 31.A O no hydrogen 4.036 N/A CYS 30.A SG TYR 80.A OH no hydrogen 3.064 N/A HIS 35.A N PRO 31.A O no hydrogen 3.301 N/A HIS 35.A NE2 LEU 27.A O no hydrogen 3.073 N/A VAL 36.A N PHE 32.A O no hydrogen 3.049 N/A LYS 37.A N GLU 33.A O no hydrogen 3.032 N/A LEU 38.A N ASP 34.A O no hydrogen 2.938 N/A VAL 39.A N HIS 35.A O no hydrogen 2.738 N/A ASN 40.A N VAL 36.A O no hydrogen 3.146 N/A GLU 41.A N LYS 37.A O no hydrogen 3.447 N/A VAL 42.A N LEU 38.A O no hydrogen 3.067 N/A THR 43.A N VAL 39.A O no hydrogen 2.913 N/A THR 43.A OG1 VAL 39.A O no hydrogen 3.063 N/A GLU 44.A N ASN 40.A O no hydrogen 2.506 N/A PHE 45.A N GLU 41.A O no hydrogen 2.827 N/A ALA 46.A N VAL 42.A O no hydrogen 2.921 N/A LYS 47.A N THR 43.A O no hydrogen 3.368 N/A LYS 47.A NZ GLU 12.A OE2 no hydrogen 2.857 N/A THR 48.A OG1 PHE 45.A O no hydrogen 2.299 N/A CYS 49.A N PHE 45.A O no hydrogen 3.252 N/A CYS 49.A SG PHE 45.A O no hydrogen 3.512 N/A VAL 50.A N ALA 46.A O no hydrogen 2.881 N/A ALA 51.A N LYS 47.A O no hydrogen 2.714 N/A ASP 52.A N THR 48.A O no hydrogen 2.468 N/A SER 54.A N ASP 52.A OD1 no hydrogen 3.115 N/A SER 54.A OG ASP 52.A OD1 no hydrogen 3.386 N/A ALA 55.A N ASP 52.A O no hydrogen 3.053 N/A CYS 58.A N ALA 55.A O no hydrogen 3.248 N/A CYS 58.A SG ASP 52.A O no hydrogen 3.914 N/A CYS 58.A SG ALA 55.A O no hydrogen 3.865 N/A LYS 60.A NZ ASN 57.A OD1 no hydrogen 2.842 N/A SER 61.A OG THR 64.A OG1 no hydrogen 2.420 N/A THR 64.A N SER 61.A OG no hydrogen 2.885 N/A THR 64.A OG1 SER 61.A OG no hydrogen 2.420 N/A LEU 65.A N SER 61.A O no hydrogen 2.804 N/A PHE 66.A N LEU 62.A O no hydrogen 2.805 N/A GLY 67.A N HIS 63.A O no hydrogen 2.478 N/A ASP 68.A N THR 64.A O no hydrogen 2.884 N/A LYS 69.A N LEU 65.A O no hydrogen 3.231 N/A LYS 69.A NZ GLU 41.A OE1 no hydrogen 2.620 N/A LEU 70.A N PHE 66.A O no hydrogen 2.825 N/A CYS 71.A N GLY 67.A O no hydrogen 2.981 N/A THR 72.A N LYS 69.A O no hydrogen 3.087 N/A THR 72.A OG1 LYS 69.A O no hydrogen 2.323 N/A VAL 73.A N LEU 70.A O no hydrogen 3.044 N/A ALA 74.A N LEU 70.A O no hydrogen 3.309 N/A THR 75.A N CYS 71.A O no hydrogen 3.214 N/A THR 75.A OG1 CYS 71.A O no hydrogen 2.196 N/A TYR 80.A N LEU 76.A O no hydrogen 3.263 N/A CYS 87.A N ALA 84.A O no hydrogen 3.314 N/A CYS 87.A SG MET 83.A O no hydrogen 3.865 N/A ARG 94.A N GLN 90.A O no hydrogen 2.791 N/A ARG 94.A NE GLU 91.A OE2 no hydrogen 3.277 N/A ASN 95.A ND2 HIS 243.A O no hydrogen 3.293 N/A GLU 96.A N PRO 92.A O no hydrogen 3.310 N/A CYS 97.A N GLU 93.A O no hydrogen 3.004 N/A PHE 98.A N ARG 94.A O no hydrogen 3.258 N/A LEU 99.A N ASN 95.A O no hydrogen 3.106 N/A GLN 100.A N GLU 96.A O no hydrogen 2.842 N/A GLN 100.A NE2 GLU 96.A O no hydrogen 3.590 N/A HIS 101.A N CYS 97.A O no hydrogen 2.817 N/A LYS 102.A N LEU 99.A O no hydrogen 3.337 N/A LYS 102.A NZ PRO 143.A O no hydrogen 2.432 N/A ASP 103.A N GLN 28.A OE1 no hydrogen 3.272 N/A ASN 105.A N ASP 103.A OD1 no hydrogen 2.837 N/A VAL 112.A N ARG 110.A O no hydrogen 2.843 N/A ARG 113.A NH1 ASP 179.A OD1 no hydrogen 3.483 N/A GLU 115.A N GLU 115.A OE2 no hydrogen 3.107 N/A VAL 118.A N GLU 115.A O no hydrogen 3.250 N/A MET 119.A N GLU 115.A O no hydrogen 3.321 N/A CYS 120.A N VAL 116.A O no hydrogen 3.128 N/A CYS 120.A SG VAL 116.A O no hydrogen 3.116 N/A THR 121.A N ASP 117.A O no hydrogen 2.681 N/A THR 121.A OG1 ASP 117.A O no hydrogen 2.644 N/A ALA 122.A N VAL 118.A O no hydrogen 2.669 N/A PHE 123.A N MET 119.A O no hydrogen 2.649 N/A HIS 124.A N CYS 120.A O no hydrogen 3.149 N/A ASP 125.A N THR 121.A O no hydrogen 2.657 N/A ASN 126.A N ALA 122.A O no hydrogen 2.934 N/A ASN 126.A ND2 ASP 125.A O no hydrogen 3.377 N/A PHE 130.A N ASN 126.A O no hydrogen 3.255 N/A LEU 131.A N GLU 127.A O no hydrogen 2.667 N/A LYS 132.A N GLU 128.A O no hydrogen 3.173 N/A LYS 133.A N THR 129.A O no hydrogen 2.902 N/A TYR 134.A N LEU 131.A O no hydrogen 2.985 N/A LEU 135.A N LEU 131.A O no hydrogen 3.368 N/A TYR 136.A N LYS 132.A O no hydrogen 2.979 N/A TYR 136.A OH CYS 30.A O no hydrogen 3.077 N/A GLU 137.A N LYS 133.A O no hydrogen 3.017 N/A ILE 138.A N TYR 134.A O no hydrogen 3.261 N/A ALA 139.A N LEU 135.A O no hydrogen 2.869 N/A ARG 140.A N TYR 136.A O no hydrogen 3.021 N/A ARG 140.A NE GLN 28.A O no hydrogen 3.041 N/A ARG 140.A NH1 GLU 137.A OE1 no hydrogen 3.520 N/A ARG 140.A NH2 GLN 28.A O no hydrogen 3.344 N/A ARG 141.A NH1 GLU 137.A O no hydrogen 3.128 N/A ARG 141.A NH1 GLU 137.A OE1 no hydrogen 2.761 N/A ARG 141.A NH2 PRO 109.A O no hydrogen 2.965 N/A ARG 141.A NH2 GLU 137.A OE1 no hydrogen 3.231 N/A HIS 142.A N ALA 139.A O no hydrogen 2.847 N/A HIS 142.A ND1 SER 189.A OG no hydrogen 2.990 N/A PHE 145.A N HIS 142.A O no hydrogen 2.835 N/A LEU 150.A N TYR 146.A O no hydrogen 2.954 N/A LEU 151.A N ALA 147.A O no hydrogen 3.070 N/A PHE 153.A N GLU 149.A O no hydrogen 2.946 N/A ALA 154.A N LEU 150.A O no hydrogen 3.221 N/A LYS 155.A N LEU 151.A O no hydrogen 3.084 N/A ARG 156.A N PHE 152.A O no hydrogen 3.377 N/A ARG 156.A NH1 GLU 184.A OE1 no hydrogen 3.142 N/A TYR 157.A N PHE 153.A O no hydrogen 2.705 N/A LYS 158.A N ALA 154.A O no hydrogen 2.698 N/A ALA 159.A N LYS 155.A O no hydrogen 2.890 N/A ALA 160.A N ARG 156.A O no hydrogen 3.042 N/A PHE 161.A N TYR 157.A O no hydrogen 3.458 N/A THR 162.A N LYS 158.A O no hydrogen 3.174 N/A THR 162.A OG1 LYS 158.A O no hydrogen 2.974 N/A GLU 163.A N ALA 159.A O no hydrogen 2.995 N/A CYS 164.A N ALA 160.A O no hydrogen 2.765 N/A CYS 164.A SG ALA 160.A O no hydrogen 3.273 N/A CYS 165.A N PHE 161.A O no hydrogen 3.255 N/A CYS 165.A SG PHE 161.A O no hydrogen 3.054 N/A LYS 170.A NZ ASP 117.A OD1 no hydrogen 2.913 N/A ALA 171.A N ASP 169.A OD1 no hydrogen 3.047 N/A ALA 172.A N ASP 169.A OD1 no hydrogen 3.242 N/A LEU 174.A N LYS 170.A O no hydrogen 3.164 N/A LEU 175.A N ALA 171.A O no hydrogen 2.956 N/A LYS 177.A NZ GLU 163.A OE1 no hydrogen 2.525 N/A LEU 178.A N LEU 174.A O no hydrogen 2.920 N/A ASP 179.A N LEU 175.A O no hydrogen 3.116 N/A GLU 180.A N PRO 176.A O no hydrogen 2.996 N/A LEU 181.A N LYS 177.A O no hydrogen 3.106 N/A ARG 182.A N LEU 178.A O no hydrogen 2.890 N/A ASP 183.A N ASP 179.A O no hydrogen 3.102 N/A GLU 184.A N GLU 180.A O no hydrogen 3.047 N/A GLY 185.A N LEU 181.A O no hydrogen 2.688 N/A LYS 186.A N ARG 182.A O no hydrogen 2.852 N/A ALA 187.A N ASP 183.A O no hydrogen 3.118 N/A SER 189.A N GLY 185.A O no hydrogen 2.905 N/A SER 189.A OG HIS 142.A ND1 no hydrogen 2.990 N/A ALA 190.A N LYS 186.A O no hydrogen 3.062 N/A LYS 191.A N ALA 187.A O no hydrogen 2.818 N/A GLN 192.A N SER 188.A O no hydrogen 2.841 N/A ARG 193.A N SER 189.A O no hydrogen 2.905 N/A ARG 193.A NE ASP 104.A OD1 no hydrogen 3.067 N/A ARG 193.A NE ASP 104.A OD2 no hydrogen 3.105 N/A ARG 193.A NH1 ARG 193.A O no hydrogen 3.169 N/A ARG 193.A NH2 ASP 104.A OD2 no hydrogen 3.078 N/A LEU 194.A N ALA 190.A O no hydrogen 3.283 N/A LYS 195.A N GLN 192.A O no hydrogen 3.122 N/A LYS 195.A NZ HIS 238.A NE2 no hydrogen 3.306 N/A CYS 196.A N GLN 192.A O no hydrogen 3.162 N/A CYS 196.A SG GLN 192.A O no hydrogen 3.531 N/A ALA 197.A N ARG 193.A O no hydrogen 2.670 N/A SER 198.A N LEU 194.A O no hydrogen 2.837 N/A SER 198.A OG LEU 194.A O no hydrogen 2.541 N/A LEU 199.A N LYS 195.A O no hydrogen 2.842 N/A GLN 200.A N CYS 196.A O no hydrogen 2.919 N/A GLN 200.A N ALA 197.A O no hydrogen 3.217 N/A LYS 201.A N ALA 197.A O no hydrogen 3.139 N/A LYS 201.A NZ GLU 461.A OE2 no hydrogen 3.144 N/A PHE 202.A N SER 198.A O no hydrogen 3.012 N/A ALA 206.A N GLY 203.A O no hydrogen 3.233 N/A PHE 207.A N GLY 203.A O no hydrogen 3.428 N/A LYS 208.A N GLU 204.A O no hydrogen 2.463 N/A LYS 208.A NZ THR 232.A OG1 no hydrogen 2.993 N/A ALA 209.A N ARG 205.A O no hydrogen 2.927 N/A TRP 210.A N ALA 206.A O no hydrogen 3.147 N/A TRP 210.A N PHE 207.A O no hydrogen 2.855 N/A ALA 211.A N PHE 207.A O no hydrogen 2.964 N/A VAL 212.A N LYS 208.A O no hydrogen 3.108 N/A ARG 214.A N TRP 210.A O no hydrogen 3.091 N/A LEU 215.A N ALA 211.A O no hydrogen 2.590 N/A SER 216.A N VAL 212.A O no hydrogen 3.162 N/A SER 216.A OG VAL 212.A O no hydrogen 2.581 N/A GLN 217.A N ALA 213.A O no hydrogen 3.070 N/A GLN 217.A NE2 HIS 334.A O no hydrogen 3.134 N/A GLN 217.A NE2 TYR 337.A O no hydrogen 3.049 N/A ARG 218.A N ARG 214.A O no hydrogen 3.069 N/A PHE 219.A N LEU 215.A O no hydrogen 2.553 N/A LYS 221.A NZ GLU 293.A O no hydrogen 2.754 N/A ALA 222.A N PHE 219.A O no hydrogen 3.032 N/A VAL 227.A N PHE 224.A O no hydrogen 2.939 N/A SER 228.A N PHE 224.A O no hydrogen 2.958 N/A LYS 229.A N ALA 225.A O no hydrogen 3.222 N/A LYS 229.A NZ ASP 233.A OD1 no hydrogen 3.493 N/A LYS 229.A NZ ASP 233.A OD2 no hydrogen 2.740 N/A LEU 230.A N GLU 226.A O no hydrogen 3.503 N/A VAL 231.A N VAL 227.A O no hydrogen 2.724 N/A THR 232.A N SER 228.A O no hydrogen 2.778 N/A ASP 233.A N LYS 229.A O no hydrogen 3.066 N/A LEU 234.A N LEU 230.A O no hydrogen 2.891 N/A THR 235.A N VAL 231.A O no hydrogen 2.871 N/A THR 235.A OG1 VAL 231.A O no hydrogen 2.717 N/A LYS 236.A N THR 232.A O no hydrogen 3.114 N/A LYS 236.A NZ ASP 252.A OD1 no hydrogen 3.443 N/A LYS 236.A NZ ASP 252.A OD2 no hydrogen 2.912 N/A VAL 237.A N ASP 233.A O no hydrogen 3.186 N/A HIS 238.A N LEU 234.A O no hydrogen 2.840 N/A HIS 238.A ND1 GLN 192.A OE1 no hydrogen 2.954 N/A THR 239.A N THR 235.A O no hydrogen 2.750 N/A THR 239.A OG1 THR 235.A O no hydrogen 2.536 N/A GLU 240.A N LYS 236.A O no hydrogen 3.113 N/A CYS 241.A N VAL 237.A O no hydrogen 2.895 N/A CYS 242.A N HIS 238.A O no hydrogen 2.669 N/A HIS 243.A N GLU 240.A O no hydrogen 3.395 N/A HIS 243.A ND1 ASP 245.A OD1 no hydrogen 3.008 N/A HIS 243.A ND1 ASP 245.A OD2 no hydrogen 2.685 N/A GLY 244.A N CYS 241.A O no hydrogen 3.390 N/A ASP 245.A N GLU 240.A O no hydrogen 2.701 N/A GLU 248.A N GLU 248.A OE1 no hydrogen 3.110 N/A CYS 249.A N ASP 245.A O no hydrogen 3.120 N/A CYS 249.A SG VAL 237.A O no hydrogen 3.669 N/A ALA 250.A N LEU 246.A O no hydrogen 2.951 N/A ASP 251.A N LEU 247.A O no hydrogen 3.224 N/A ASP 252.A N GLU 248.A O no hydrogen 2.894 N/A ARG 253.A N CYS 249.A O no hydrogen 2.782 N/A ARG 253.A NH2 GLU 149.A OE2 no hydrogen 2.673 N/A ALA 254.A N ALA 250.A O no hydrogen 3.030 N/A ASP 255.A N ASP 251.A O no hydrogen 2.871 N/A LEU 256.A N ASP 252.A O no hydrogen 3.144 N/A ALA 257.A N ARG 253.A O no hydrogen 2.997 N/A LYS 258.A N ALA 254.A O no hydrogen 3.176 N/A TYR 259.A N ASP 255.A O no hydrogen 2.716 N/A TYR 259.A OH GLU 226.A OE1 no hydrogen 3.165 N/A TYR 259.A OH GLU 226.A OE2 no hydrogen 2.750 N/A ILE 260.A N LEU 256.A O no hydrogen 2.738 N/A CYS 261.A N ALA 257.A O no hydrogen 2.947 N/A CYS 261.A SG ALA 257.A O no hydrogen 3.149 N/A GLU 262.A N LYS 258.A O no hydrogen 3.039 N/A GLU 262.A N TYR 259.A O no hydrogen 3.255 N/A ASN 263.A N TYR 259.A O no hydrogen 3.327 N/A ASN 263.A N ILE 260.A O no hydrogen 3.225 N/A GLN 264.A NE2 CYS 261.A O no hydrogen 3.055 N/A ILE 267.A N GLN 264.A O no hydrogen 3.077 N/A SER 268.A N GLN 264.A O no hydrogen 2.720 N/A SER 268.A OG ASP 292.A OD2 no hydrogen 3.177 N/A SER 269.A N ASP 292.A OD2 no hydrogen 2.782 N/A SER 269.A OG ASP 292.A OD1 no hydrogen 2.796 N/A SER 269.A OG ASP 292.A OD2 no hydrogen 3.002 N/A LYS 270.A N SER 268.A OG no hydrogen 2.824 N/A CYS 275.A N LEU 271.A O no hydrogen 3.052 N/A LYS 277.A N CYS 274.A O no hydrogen 3.287 N/A LYS 282.A N PRO 278.A O no hydrogen 2.862 N/A SER 283.A N LEU 280.A O no hydrogen 3.289 N/A HIS 284.A ND1 GLU 149.A OE1 no hydrogen 2.614 N/A CYS 285.A N GLU 281.A O no hydrogen 2.882 N/A ILE 286.A N LYS 282.A O no hydrogen 3.274 N/A ALA 287.A N SER 283.A O no hydrogen 3.066 N/A GLU 288.A N CYS 285.A O no hydrogen 2.870 N/A VAL 289.A N ILE 286.A O no hydrogen 3.236 N/A ASP 292.A N ARG 218.A O no hydrogen 3.136 N/A GLU 293.A N ASP 292.A OD1 no hydrogen 2.474 N/A ALA 302.A N SER 300.A OG no hydrogen 2.820 N/A PHE 305.A N LEU 301.A O no hydrogen 3.119 N/A GLU 307.A N ALA 302.A O no hydrogen 3.100 N/A ASP 310.A N SER 308.A OG no hydrogen 3.199 N/A ASN 314.A N ASP 310.A O no hydrogen 3.291 N/A TYR 315.A N VAL 311.A O no hydrogen 2.591 N/A TYR 315.A OH GLU 354.A OE2 no hydrogen 2.498 N/A ALA 316.A N CYS 312.A O no hydrogen 2.651 N/A GLU 317.A N LYS 313.A O no hydrogen 2.998 N/A PHE 322.A N ALA 318.A O no hydrogen 3.180 N/A LEU 323.A N LYS 319.A O no hydrogen 2.725 N/A GLY 324.A N ASP 320.A O no hydrogen 2.635 N/A MET 325.A N VAL 321.A O no hydrogen 2.780 N/A PHE 326.A N PHE 322.A O no hydrogen 2.891 N/A LEU 327.A N LEU 323.A O no hydrogen 2.990 N/A TYR 328.A N GLY 324.A O no hydrogen 2.868 N/A TYR 328.A OH ALA 222.A O no hydrogen 2.319 N/A GLU 329.A N MET 325.A O no hydrogen 2.752 N/A TYR 330.A N PHE 326.A O no hydrogen 2.849 N/A ARG 332.A N TYR 328.A O no hydrogen 3.001 N/A ARG 332.A NE PRO 220.A O no hydrogen 3.407 N/A ARG 332.A NH2 PRO 220.A O no hydrogen 3.229 N/A HIS 334.A N ALA 331.A O no hydrogen 2.788 N/A VAL 339.A N ASP 447.A OD1 no hydrogen 3.065 N/A LEU 341.A N SER 338.A OG no hydrogen 2.892 N/A LEU 342.A N SER 338.A O no hydrogen 3.285 N/A LEU 343.A N VAL 339.A O no hydrogen 3.110 N/A ARG 344.A N VAL 340.A O no hydrogen 2.969 N/A ARG 344.A NH2 GLU 446.A OE1 no hydrogen 3.492 N/A ARG 344.A NH2 VAL 478.A O no hydrogen 3.336 N/A LEU 345.A N LEU 341.A O no hydrogen 2.705 N/A ALA 346.A N LEU 342.A O no hydrogen 2.805 N/A LYS 347.A N LEU 343.A O no hydrogen 3.178 N/A LYS 347.A NZ GLU 350.A OE2 no hydrogen 2.754 N/A THR 348.A N ARG 344.A O no hydrogen 3.310 N/A THR 348.A OG1 ARG 344.A O no hydrogen 3.290 N/A TYR 349.A N LEU 345.A O no hydrogen 3.190 N/A TYR 349.A OH PHE 305.A O no hydrogen 2.689 N/A GLU 350.A N ALA 346.A O no hydrogen 3.077 N/A THR 351.A N LYS 347.A O no hydrogen 3.069 N/A THR 351.A OG1 LYS 347.A O no hydrogen 2.827 N/A THR 351.A OG1 THR 348.A O no hydrogen 2.668 N/A THR 352.A N THR 348.A O no hydrogen 2.859 N/A THR 352.A OG1 THR 348.A O no hydrogen 2.406 N/A THR 352.A OG1 GLU 372.A OE1 no hydrogen 3.497 N/A LEU 353.A N TYR 349.A O no hydrogen 2.808 N/A GLU 354.A N THR 351.A O no hydrogen 2.937 N/A LYS 355.A N THR 351.A O no hydrogen 3.064 N/A LYS 355.A N THR 352.A O no hydrogen 3.249 N/A CYS 356.A N THR 352.A O no hydrogen 2.923 N/A CYS 356.A SG THR 352.A O no hydrogen 3.490 N/A CYS 357.A N LEU 353.A O no hydrogen 3.151 N/A ALA 359.A N CYS 356.A O no hydrogen 3.115 N/A GLU 364.A N ASP 361.A OD2 no hydrogen 3.073 N/A CYS 365.A SG PRO 362.A O no hydrogen 3.256 N/A ALA 367.A N HIS 363.A O no hydrogen 3.049 N/A LYS 368.A N CYS 365.A O no hydrogen 3.132 N/A ASP 371.A N LYS 368.A O no hydrogen 3.421 N/A LYS 374.A N ASP 371.A O no hydrogen 2.916 N/A VAL 377.A N PHE 373.A O no hydrogen 2.796 N/A GLU 378.A N LYS 374.A O no hydrogen 2.964 N/A GLU 379.A N PRO 375.A O no hydrogen 2.988 N/A ASN 382.A N GLU 378.A O no hydrogen 3.071 N/A LEU 383.A N GLU 379.A O no hydrogen 3.344 N/A ILE 384.A N PRO 380.A O no hydrogen 3.463 N/A LYS 385.A NZ GLU 438.A OE2 no hydrogen 2.603 N/A GLN 386.A N ASN 382.A O no hydrogen 3.197 N/A ASN 387.A N LEU 383.A O no hydrogen 3.165 N/A CYS 388.A N ILE 384.A O no hydrogen 3.193 N/A CYS 388.A SG ILE 384.A O no hydrogen 3.292 N/A PHE 391.A N CYS 388.A O no hydrogen 3.168 N/A GLU 392.A N CYS 388.A O no hydrogen 3.086 N/A GLN 393.A N GLU 389.A O no hydrogen 3.431 N/A GLY 395.A N PHE 391.A O no hydrogen 2.787 N/A PHE 399.A N GLY 395.A O no hydrogen 2.850 N/A GLN 400.A N GLU 396.A O no hydrogen 3.227 N/A GLN 400.A N TYR 397.A O no hydrogen 2.779 N/A ASN 401.A N TYR 397.A O no hydrogen 3.285 N/A ASN 401.A N LYS 398.A O no hydrogen 3.014 N/A ASN 401.A ND2 LYS 398.A O no hydrogen 3.301 N/A ALA 402.A N LYS 398.A O no hydrogen 3.153 N/A LEU 403.A N PHE 399.A O no hydrogen 3.372 N/A LEU 404.A N GLN 400.A O no hydrogen 2.810 N/A VAL 405.A N ASN 401.A O no hydrogen 3.076 N/A TYR 407.A N LEU 403.A O no hydrogen 2.798 N/A THR 408.A N LEU 404.A O no hydrogen 2.749 N/A THR 408.A OG1 LEU 404.A O no hydrogen 2.302 N/A LYS 409.A N VAL 405.A O no hydrogen 2.970 N/A LYS 410.A N ARG 406.A O no hydrogen 2.641 N/A LYS 410.A NZ PHE 484.A O no hydrogen 3.290 N/A VAL 411.A N TYR 407.A O no hydrogen 2.702 N/A VAL 414.A N VAL 411.A O no hydrogen 3.361 N/A SER 415.A OG THR 418.A OG1 no hydrogen 2.699 N/A THR 418.A N SER 415.A OG no hydrogen 3.376 N/A THR 418.A OG1 SER 415.A OG no hydrogen 2.699 N/A LEU 419.A N SER 415.A O no hydrogen 2.923 N/A VAL 420.A N THR 416.A O no hydrogen 2.745 N/A GLU 421.A N PRO 417.A O no hydrogen 2.898 N/A VAL 422.A N THR 418.A O no hydrogen 2.875 N/A SER 423.A N LEU 419.A O no hydrogen 3.060 N/A SER 423.A OG LEU 419.A O no hydrogen 3.030 N/A ARG 424.A N VAL 420.A O no hydrogen 3.153 N/A ASN 425.A N GLU 421.A O no hydrogen 2.971 N/A ASN 425.A ND2 GLN 455.A OE1 no hydrogen 2.721 N/A LEU 426.A N VAL 422.A O no hydrogen 2.676 N/A GLY 427.A N SER 423.A O no hydrogen 3.222 N/A LYS 428.A N ASN 425.A O no hydrogen 3.242 N/A VAL 429.A N LEU 426.A O no hydrogen 3.432 N/A GLY 430.A N GLY 427.A O no hydrogen 3.185 N/A SER 431.A N LYS 428.A O no hydrogen 3.262 N/A SER 431.A OG GLU 396.A OE1 no hydrogen 2.653 N/A LYS 432.A N LYS 428.A O no hydrogen 3.517 N/A CYS 433.A N VAL 429.A O no hydrogen 2.799 N/A CYS 434.A SG GLY 430.A O no hydrogen 3.555 N/A HIS 436.A N CYS 433.A O no hydrogen 3.341 N/A LYS 440.A N PRO 437.A O no hydrogen 2.699 N/A ARG 441.A N GLU 438.A O no hydrogen 2.939 N/A CYS 444.A N LYS 440.A O no hydrogen 3.390 N/A CYS 444.A SG LYS 432.A O no hydrogen 3.888 N/A ALA 445.A N ARG 441.A O no hydrogen 3.168 N/A GLU 446.A N MET 442.A O no hydrogen 3.084 N/A ASP 447.A N PRO 443.A O no hydrogen 2.967 N/A TYR 448.A N CYS 444.A O no hydrogen 3.131 N/A TYR 448.A OH ASN 425.A O no hydrogen 3.182 N/A LEU 449.A N ALA 445.A O no hydrogen 2.837 N/A VAL 451.A N TYR 448.A O no hydrogen 3.006 N/A VAL 452.A N TYR 448.A O no hydrogen 3.030 N/A LEU 453.A N LEU 449.A O no hydrogen 2.810 N/A GLN 455.A N VAL 451.A O no hydrogen 3.350 N/A CYS 457.A N LEU 453.A O no hydrogen 3.049 N/A CYS 457.A SG LEU 453.A O no hydrogen 3.388 N/A VAL 458.A N ASN 454.A O no hydrogen 2.817 N/A LEU 459.A N GLN 455.A O no hydrogen 3.030 N/A HIS 460.A N LEU 456.A O no hydrogen 2.843 N/A GLU 461.A N CYS 457.A O no hydrogen 2.856 N/A LYS 462.A NZ ASP 103.A OD1 no hydrogen 3.326 N/A LYS 462.A NZ ASP 103.A OD2 no hydrogen 3.478 N/A LYS 462.A NZ ASN 105.A O no hydrogen 2.744 N/A VAL 465.A N HIS 460.A NE2 no hydrogen 3.420 N/A SER 466.A N HIS 460.A NE2 no hydrogen 3.245 N/A ARG 468.A N SER 466.A OG no hydrogen 3.048 N/A ARG 468.A NH2 GLU 488.A O no hydrogen 2.728 N/A VAL 469.A N SER 466.A OG no hydrogen 3.130 N/A LYS 471.A N ARG 468.A O no hydrogen 3.049 N/A CYS 472.A N ARG 468.A O no hydrogen 3.009 N/A CYS 472.A SG ARG 468.A O no hydrogen 4.030 N/A CYS 473.A N VAL 469.A O no hydrogen 3.076 N/A CYS 473.A SG VAL 469.A O no hydrogen 2.989 N/A THR 474.A OG1 THR 470.A O no hydrogen 2.338 N/A THR 474.A OG1 LYS 471.A O no hydrogen 3.527 N/A GLU 475.A N LYS 471.A O no hydrogen 2.863 N/A ASN 479.A N SER 476.A O no hydrogen 2.941 N/A ARG 480.A NE CYS 473.A O no hydrogen 3.346 N/A ARG 480.A NH1 ASN 454.A OD1 no hydrogen 3.059 N/A ARG 480.A NH2 CYS 473.A O no hydrogen 3.031 N/A ARG 481.A NE GLU 446.A OE1 no hydrogen 3.123 N/A ARG 481.A NE GLU 446.A OE2 no hydrogen 3.107 N/A ARG 481.A NH2 GLU 379.A OE1 no hydrogen 3.268 N/A CYS 483.A N ASN 479.A O no hydrogen 3.126 N/A PHE 484.A N ARG 480.A O no hydrogen 2.874 N/A SER 485.A N ARG 481.A O no hydrogen 2.839 N/A SER 485.A OG ARG 481.A O no hydrogen 2.759 N/A ALA 486.A N CYS 483.A O no hydrogen 3.293 N/A GLU 491.A N ASP 490.A OD1 no hydrogen 2.866 N/A THR 492.A N ASP 490.A OD1 no hydrogen 3.393 N/A THR 492.A OG1 ASP 490.A OD1 no hydrogen 2.742 N/A THR 492.A OG1 ASP 490.A OD2 no hydrogen 3.107 N/A THR 502.A N ASN 499.A O no hydrogen 3.333 N/A THR 502.A OG1 ASN 499.A O no hydrogen 3.263 N/A THR 504.A OG1 ALA 500.A O no hydrogen 3.321 N/A ILE 509.A N HIS 506.A O no hydrogen 3.246 N/A THR 511.A OG1 ASP 508.A O no hydrogen 2.704 N/A GLU 516.A N SER 513.A OG no hydrogen 3.172 N/A ARG 517.A N SER 513.A O no hydrogen 2.731 N/A ARG 517.A NH1 GLU 514.A OE1 no hydrogen 3.520 N/A GLN 518.A N GLU 514.A O no hydrogen 2.718 N/A ILE 519.A N LYS 515.A O no hydrogen 2.824 N/A LYS 520.A N GLU 516.A O no hydrogen 2.925 N/A LYS 521.A N ARG 517.A O no hydrogen 2.851 N/A GLN 522.A N GLN 518.A O no hydrogen 2.813 N/A GLN 522.A NE2 ASN 401.A OD1 no hydrogen 3.539 N/A THR 523.A N ILE 519.A O no hydrogen 3.102 N/A THR 523.A OG1 ILE 519.A O no hydrogen 2.499 N/A ALA 524.A N LYS 520.A O no hydrogen 3.115 N/A LEU 525.A N LYS 521.A O no hydrogen 3.106 N/A VAL 526.A N GLN 522.A O no hydrogen 2.959 N/A GLU 527.A N THR 523.A O no hydrogen 3.150 N/A LEU 528.A N ALA 524.A O no hydrogen 2.997 N/A VAL 529.A N LEU 525.A O no hydrogen 2.925 N/A LYS 530.A N VAL 526.A O no hydrogen 2.811 N/A LYS 530.A NZ VAL 414.A O no hydrogen 3.321 N/A LYS 530.A NZ THR 416.A OG1 no hydrogen 2.799 N/A HIS 531.A N LEU 528.A O no hydrogen 3.033 N/A THR 536.A OG1 LYS 532.A O no hydrogen 2.937 N/A THR 536.A OG1 LYS 534.A O no hydrogen 2.554 N/A LYS 541.A N GLU 538.A O no hydrogen 2.374 N/A VAL 543.A N GLN 539.A O no hydrogen 3.479 N/A ASP 545.A N LYS 541.A O no hydrogen 2.432 N/A ASP 546.A N ALA 542.A O no hydrogen 2.720 N/A PHE 547.A N VAL 543.A O no hydrogen 3.047 N/A ALA 549.A N ASP 545.A O no hydrogen 2.705 N/A PHE 550.A N ASP 546.A O no hydrogen 2.803 N/A CYS 554.A N PHE 550.A O no hydrogen 3.210 N/A CYS 555.A N VAL 551.A O no hydrogen 2.845 N/A CYS 555.A SG VAL 551.A O no hydrogen 3.687 N/A LYS 556.A N GLU 552.A O no hydrogen 3.317 N/A THR 562.A N ASP 559.A OD2 no hydrogen 2.701 N/A CYS 563.A N ASP 559.A OD2 no hydrogen 3.422 N/A CYS 563.A SG ASP 559.A OD1 no hydrogen 3.554 N/A ALA 565.A N THR 562.A O no hydrogen 3.086 N/A GLU 566.A N CYS 563.A O no hydrogen 3.290 N/A GLU 567.A N CYS 563.A O no hydrogen 2.685 N/A LYS 569.A NZ PHE 564.A O no hydrogen 3.042 N/A LYS 570.A N GLU 566.A O no hydrogen 3.057 N/A LEU 571.A N GLY 568.A O no hydrogen 3.280 N/A SER 575.A OG VAL 572.A O no hydrogen 3.505 N/A