Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4uwh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 8.A N ASN 5.A OD1 no hydrogen 2.999 N/A THR 8.A OG1 ASN 5.A OD1 no hydrogen 3.139 N/A ARG 9.A N ASN 5.A O no hydrogen 2.878 N/A ARG 9.A NH1 PRO 4.A O no hydrogen 2.835 N/A ASP 10.A N ALA 6.A O no hydrogen 3.135 N/A GLN 11.A N ALA 7.A O no hydrogen 3.105 N/A LEU 12.A N THR 8.A O no hydrogen 2.802 N/A ASN 13.A N ARG 9.A O no hydrogen 2.964 N/A ILE 14.A N ASP 10.A O no hydrogen 3.177 N/A ILE 15.A N GLN 11.A O no hydrogen 3.382 N/A VAL 16.A N LEU 12.A O no hydrogen 2.983 N/A SER 17.A N ASN 13.A O no hydrogen 3.037 N/A SER 17.A N ILE 14.A O no hydrogen 3.196 N/A SER 17.A OG ASN 13.A O no hydrogen 3.349 N/A SER 17.A OG ILE 14.A O no hydrogen 2.691 N/A TYR 18.A N ILE 15.A O no hydrogen 3.140 N/A TYR 18.A OH GLU 28.A OE2 no hydrogen 2.635 N/A THR 21.A N GLN 524.A OE1 no hydrogen 2.942 N/A LYS 22.A N PRO 19.A O no hydrogen 3.106 N/A THR 25.A N GLU 28.A OE1 no hydrogen 3.094 N/A GLU 28.A N THR 25.A OG1 no hydrogen 3.276 N/A GLN 29.A N THR 25.A O no hydrogen 2.896 N/A GLN 29.A NE2 LEU 24.A O no hydrogen 2.871 N/A ASP 30.A N TYR 26.A O no hydrogen 2.894 N/A LEU 31.A N GLU 27.A O no hydrogen 3.148 N/A VAL 32.A N GLU 28.A O no hydrogen 2.957 N/A TRP 33.A N GLN 29.A O no hydrogen 2.855 N/A LYS 34.A N ASP 30.A O no hydrogen 2.928 N/A PHE 35.A N LEU 31.A O no hydrogen 3.237 N/A ARG 36.A N TRP 33.A O no hydrogen 3.286 N/A ARG 36.A NH1 TRP 33.A O no hydrogen 2.835 N/A LEU 39.A N PHE 35.A O no hydrogen 3.132 N/A THR 40.A OG1 TYR 37.A O no hydrogen 2.172 N/A ASN 41.A N TYR 38.A O no hydrogen 3.504 N/A ASN 41.A ND2 TYR 38.A O no hydrogen 3.167 N/A GLN 42.A N LEU 39.A O no hydrogen 2.922 N/A GLN 42.A NE2 ASN 13.A OD1 no hydrogen 3.346 N/A GLU 43.A N GLU 43.A OE1 no hydrogen 2.877 N/A ALA 45.A N GLN 42.A O no hydrogen 3.253 N/A LYS 48.A N ALA 45.A O no hydrogen 3.074 N/A LYS 48.A NZ TYR 18.A O no hydrogen 2.767 N/A PHE 49.A N ALA 45.A O no hydrogen 2.959 N/A LEU 50.A N LEU 46.A O no hydrogen 2.968 N/A LYS 51.A N LYS 48.A O no hydrogen 3.246 N/A LYS 51.A NZ THR 47.A O no hydrogen 3.510 N/A LYS 51.A NZ GLU 81.A OE2 no hydrogen 2.870 N/A CYS 52.A N PHE 49.A O no hydrogen 3.029 N/A CYS 52.A SG GLN 29.A O no hydrogen 3.824 N/A CYS 52.A SG LYS 48.A O no hydrogen 3.327 N/A VAL 53.A N LEU 50.A O no hydrogen 3.481 N/A ASN 54.A N GLU 60.A OE2 no hydrogen 2.743 N/A ASP 56.A N ASN 54.A OD1 no hydrogen 3.229 N/A LEU 57.A N ASN 54.A O no hydrogen 3.102 N/A ALA 61.A N LEU 57.A O no hydrogen 2.997 N/A LYS 62.A N PRO 58.A O no hydrogen 2.929 N/A GLN 63.A N GLN 59.A O no hydrogen 2.813 N/A ALA 64.A N GLU 60.A O no hydrogen 3.064 N/A LEU 65.A N ALA 61.A O no hydrogen 3.036 N/A GLU 66.A N LYS 62.A O no hydrogen 3.192 N/A LEU 67.A N GLN 63.A O no hydrogen 3.319 N/A LEU 68.A N ALA 64.A O no hydrogen 2.897 N/A GLY 69.A N LEU 65.A O no hydrogen 3.187 N/A LYS 70.A N LEU 67.A O no hydrogen 3.081 N/A TRP 71.A N LEU 67.A O no hydrogen 2.813 N/A TRP 71.A NE1 GLN 42.A O no hydrogen 2.718 N/A LYS 72.A N THR 40.A O no hydrogen 2.928 N/A LYS 72.A NZ GLU 43.A OE1 no hydrogen 3.192 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 3.123 N/A SER 79.A N ASP 75.A O no hydrogen 3.229 N/A SER 79.A OG VAL 76.A O no hydrogen 2.608 N/A LEU 80.A N VAL 76.A O no hydrogen 3.078 N/A GLU 81.A N GLU 77.A O no hydrogen 3.261 N/A LEU 82.A N ASP 78.A O no hydrogen 3.270 N/A LEU 83.A N LEU 80.A O no hydrogen 3.352 N/A SER 84.A N GLU 81.A O no hydrogen 3.225 N/A SER 84.A OG GLU 81.A O no hydrogen 2.677 N/A SER 84.A OG HIS 86.A ND1 no hydrogen 3.196 N/A HIS 86.A ND1 SER 84.A OG no hydrogen 3.196 N/A TYR 87.A N SER 84.A O no hydrogen 3.302 N/A VAL 92.A N ASN 89.A OD1 no hydrogen 3.242 N/A ARG 93.A N ASN 89.A O no hydrogen 3.246 N/A ARG 93.A NE GLU 122.A OE2 no hydrogen 2.703 N/A ARG 93.A NH1 SER 84.A O no hydrogen 3.089 N/A ARG 93.A NH1 TYR 87.A O no hydrogen 2.723 N/A ARG 93.A NH2 LEU 83.A O no hydrogen 2.757 N/A ARG 93.A NH2 GLU 122.A OE2 no hydrogen 3.443 N/A ARG 94.A N PRO 90.A O no hydrogen 2.930 N/A ARG 94.A NH1 LEU 152.A O no hydrogen 3.003 N/A TYR 95.A N THR 91.A O no hydrogen 3.032 N/A ALA 96.A N VAL 92.A O no hydrogen 3.202 N/A VAL 97.A N ARG 93.A O no hydrogen 3.141 N/A ALA 98.A N ARG 94.A O no hydrogen 2.918 N/A ARG 99.A N TYR 95.A O no hydrogen 3.078 N/A ARG 99.A NE MET 74.A O no hydrogen 2.803 N/A ARG 99.A NH1 ARG 99.A O no hydrogen 2.853 N/A LEU 100.A N ALA 96.A O no hydrogen 3.092 N/A ARG 101.A N VAL 97.A O no hydrogen 2.995 N/A ARG 101.A NH1 GLU 153.A OE2 no hydrogen 2.794 N/A GLN 102.A N ARG 99.A O no hydrogen 3.090 N/A ALA 103.A N LEU 100.A O no hydrogen 3.118 N/A LEU 108.A N ASP 104.A O no hydrogen 3.059 N/A LEU 109.A N ASP 105.A O no hydrogen 2.877 N/A TYR 111.A N LEU 108.A O no hydrogen 3.229 N/A LEU 112.A N LEU 109.A O no hydrogen 3.421 N/A GLN 114.A NE2 GLN 330.A OE1 no hydrogen 2.795 N/A LEU 115.A N TYR 111.A O no hydrogen 2.943 N/A VAL 116.A N LEU 112.A O no hydrogen 2.963 N/A ALA 118.A N GLN 114.A O no hydrogen 2.977 N/A LEU 119.A N VAL 116.A O no hydrogen 3.429 N/A LYS 120.A N GLN 117.A O no hydrogen 3.155 N/A LYS 120.A NZ GLN 117.A OE1 no hydrogen 3.036 N/A LYS 120.A NZ ASP 506.A O no hydrogen 2.772 N/A TYR 121.A N ALA 118.A O no hydrogen 3.092 N/A TYR 121.A OH ASP 506.A OD2 no hydrogen 2.623 N/A GLU 122.A N LEU 119.A O no hydrogen 3.182 N/A ASP 126.A N ASN 123.A OD1 no hydrogen 2.886 N/A ILE 127.A N ASN 123.A O no hydrogen 3.338 N/A LYS 128.A N PHE 124.A O no hydrogen 3.142 N/A LYS 128.A NZ GLU 196.A OE2 no hydrogen 3.325 N/A ASN 129.A N ASP 125.A O no hydrogen 2.853 N/A LEU 131.A N LYS 128.A O no hydrogen 3.200 N/A GLU 132.A N GLN 207.A OE1 no hydrogen 2.878 N/A GLU 138.A N ASN 135.A O no hydrogen 3.056 N/A ILE 139.A N SER 136.A O no hydrogen 3.075 N/A SER 141.A OG GLU 183.A OE2 no hydrogen 3.070 N/A SER 142.A N ASP 140.A OD1 no hydrogen 3.217 N/A SER 142.A OG ASP 140.A OD1 no hydrogen 2.702 N/A GLN 143.A N ASP 140.A O no hydrogen 2.830 N/A ILE 144.A N SER 141.A O no hydrogen 3.370 N/A THR 146.A OG1 SER 142.A O no hydrogen 3.439 N/A SER 147.A N ILE 144.A O no hydrogen 3.321 N/A SER 147.A OG GLN 143.A O no hydrogen 2.699 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 2.868 N/A LEU 156.A N GLU 122.A OE1 no hydrogen 3.136 N/A THR 158.A N ASP 155.A OD1 no hydrogen 3.023 N/A THR 158.A OG1 ASP 155.A OD1 no hydrogen 2.661 N/A PHE 159.A N ASP 155.A O no hydrogen 3.046 N/A LEU 160.A N LEU 156.A O no hydrogen 2.915 N/A ILE 161.A N CYS 157.A O no hydrogen 3.115 N/A SER 162.A N THR 158.A O no hydrogen 3.016 N/A ARG 163.A N PHE 159.A O no hydrogen 3.042 N/A ARG 163.A NE ASP 105.A OD1 no hydrogen 2.779 N/A ARG 163.A NH1 ARG 101.A O no hydrogen 3.117 N/A ARG 163.A NH2 ALA 103.A O no hydrogen 2.702 N/A ARG 163.A NH2 ASP 105.A OD1 no hydrogen 2.810 N/A ALA 164.A N LEU 160.A O no hydrogen 2.949 N/A CYS 165.A N ILE 161.A O no hydrogen 2.943 N/A CYS 165.A SG ILE 161.A O no hydrogen 3.347 N/A LYS 166.A N ARG 163.A O no hydrogen 3.254 N/A ASN 167.A N ALA 164.A O no hydrogen 3.174 N/A ASN 167.A ND2 ASP 105.A OD2 no hydrogen 2.844 N/A THR 169.A N ASN 167.A OD1 no hydrogen 2.935 N/A LEU 170.A N ASN 167.A OD1 no hydrogen 3.162 N/A ALA 171.A N ASN 167.A O no hydrogen 2.874 N/A ASN 172.A N SER 168.A O no hydrogen 3.014 N/A ASN 172.A ND2 PRO 275.A O no hydrogen 2.929 N/A TYR 173.A N THR 169.A O no hydrogen 3.262 N/A TYR 173.A OH LEU 276.A O no hydrogen 2.909 N/A LEU 174.A N LEU 170.A O no hydrogen 2.892 N/A TYR 175.A N ALA 171.A O no hydrogen 2.929 N/A TYR 175.A OH GLN 227.A OE1 no hydrogen 2.614 N/A TRP 176.A N ASN 172.A O no hydrogen 3.133 N/A TYR 177.A N TYR 173.A O no hydrogen 2.853 N/A VAL 178.A N LEU 174.A O no hydrogen 3.060 N/A ILE 179.A N TYR 175.A O no hydrogen 2.981 N/A VAL 180.A N TRP 176.A O no hydrogen 3.118 N/A GLU 181.A N TYR 177.A O no hydrogen 3.250 N/A CYS 182.A N VAL 178.A O no hydrogen 2.861 N/A CYS 182.A SG VAL 178.A O no hydrogen 3.371 N/A GLU 183.A N ILE 179.A O no hydrogen 2.873 N/A GLN 185.A NE2 GLU 183.A O no hydrogen 3.361 N/A ASP 186.A N ASP 184.A OD1 no hydrogen 3.090 N/A THR 187.A N ASP 184.A OD1 no hydrogen 3.278 N/A GLN 188.A N ASP 184.A O no hydrogen 2.998 N/A GLN 188.A NE2 CYS 182.A O no hydrogen 3.083 N/A GLN 189.A N GLN 185.A O no hydrogen 3.080 N/A ARG 190.A N ASP 186.A O no hydrogen 2.951 N/A ASP 191.A N THR 187.A O no hydrogen 2.922 N/A THR 194.A N ASP 191.A O no hydrogen 3.032 N/A THR 194.A OG1 ASP 191.A OD1 no hydrogen 2.698 N/A HIS 195.A N ASP 191.A O no hydrogen 3.244 N/A GLU 196.A N PRO 192.A O no hydrogen 2.898 N/A MET 197.A N LYS 193.A O no hydrogen 2.992 N/A TYR 198.A N THR 194.A O no hydrogen 3.047 N/A TYR 198.A OH VAL 116.A O no hydrogen 2.671 N/A LEU 199.A N HIS 195.A O no hydrogen 3.106 N/A ASN 200.A N GLU 196.A O no hydrogen 2.936 N/A VAL 201.A N MET 197.A O no hydrogen 2.857 N/A MET 202.A N TYR 198.A O no hydrogen 3.123 N/A ARG 203.A N LEU 199.A O no hydrogen 2.905 N/A ARG 204.A N ASN 200.A O no hydrogen 2.822 N/A ARG 204.A NH1 ILE 127.A O no hydrogen 3.039 N/A ARG 204.A NH2 THR 158.A OG1 no hydrogen 2.887 N/A PHE 205.A N VAL 201.A O no hydrogen 2.870 N/A SER 206.A N MET 202.A O no hydrogen 2.914 N/A GLN 207.A N ARG 203.A O no hydrogen 3.042 N/A GLN 207.A NE2 GLU 132.A O no hydrogen 3.172 N/A ALA 208.A N ARG 204.A O no hydrogen 2.997 N/A LEU 209.A N PHE 205.A O no hydrogen 3.052 N/A LEU 210.A N SER 206.A O no hydrogen 3.077 N/A LYS 211.A N GLN 207.A O no hydrogen 3.240 N/A LYS 211.A N ALA 208.A O no hydrogen 3.270 N/A LYS 211.A NZ GLU 132.A OE2 no hydrogen 2.797 N/A GLY 212.A N LEU 209.A O no hydrogen 3.154 N/A SER 215.A OG ASP 213.A OD1 no hydrogen 2.770 N/A VAL 216.A N ASP 213.A OD1 no hydrogen 3.342 N/A ARG 217.A N ASP 213.A O no hydrogen 2.957 N/A ARG 217.A NH1 GLY 212.A O no hydrogen 3.144 N/A VAL 218.A N LYS 214.A O no hydrogen 3.116 N/A MET 219.A N SER 215.A O no hydrogen 3.032 N/A ARG 220.A N VAL 216.A O no hydrogen 3.353 N/A ARG 220.A NH1 ILE 145.A O no hydrogen 2.781 N/A SER 221.A N ARG 217.A O no hydrogen 3.363 N/A SER 221.A OG VAL 218.A O no hydrogen 2.673 N/A LEU 222.A N VAL 218.A O no hydrogen 2.939 N/A LEU 223.A N MET 219.A O no hydrogen 2.963 N/A ALA 224.A N ARG 220.A O no hydrogen 3.050 N/A ALA 225.A N SER 221.A O no hydrogen 2.945 N/A GLN 226.A N LEU 222.A O no hydrogen 3.058 N/A GLN 226.A NE2 ASN 172.A OD1 no hydrogen 2.715 N/A GLN 227.A N LEU 223.A O no hydrogen 2.980 N/A GLN 227.A NE2 GLN 227.A O no hydrogen 3.282 N/A GLN 227.A NE2 ASP 231.A OD1 no hydrogen 2.990 N/A THR 228.A N ALA 224.A O no hydrogen 2.972 N/A THR 228.A OG1 ALA 224.A O no hydrogen 2.965 N/A PHE 229.A N ALA 225.A O no hydrogen 2.934 N/A VAL 230.A N GLN 226.A O no hydrogen 2.928 N/A ASP 231.A N GLN 227.A O no hydrogen 2.878 N/A ARG 232.A N THR 228.A O no hydrogen 3.005 N/A LEU 233.A N PHE 229.A O no hydrogen 2.921 N/A VAL 234.A N VAL 230.A O no hydrogen 2.867 N/A HIS 235.A N ASP 231.A O no hydrogen 3.099 N/A LEU 236.A N ARG 232.A O no hydrogen 2.989 N/A MET 237.A N LEU 233.A O no hydrogen 2.841 N/A LYS 238.A N VAL 234.A O no hydrogen 2.941 N/A ALA 239.A N HIS 235.A O no hydrogen 3.215 N/A VAL 240.A N LEU 236.A O no hydrogen 3.064 N/A GLN 241.A N MET 237.A O no hydrogen 2.890 N/A GLN 241.A NE2 LEU 297.A O no hydrogen 3.342 N/A GLN 241.A NE2 HIS 318.A O no hydrogen 2.916 N/A ARG 242.A N LYS 238.A O no hydrogen 3.003 N/A GLU 243.A N VAL 240.A O no hydrogen 3.231 N/A LYS 248.A NZ GLU 252.A OE2 no hydrogen 2.809 N/A LYS 249.A N ASN 246.A OD1 no hydrogen 3.085 N/A LYS 249.A NZ GLU 243.A OE2 no hydrogen 2.865 N/A LYS 249.A NZ SER 244.A O no hydrogen 3.114 N/A LYS 250.A N ASN 246.A O no hydrogen 3.076 N/A LYS 250.A NZ VAL 240.A O no hydrogen 3.290 N/A LYS 250.A NZ GLU 243.A O no hydrogen 2.788 N/A ASN 251.A N ARG 247.A O no hydrogen 2.816 N/A GLU 252.A N LYS 248.A O no hydrogen 3.013 N/A ARG 253.A N LYS 249.A O no hydrogen 3.236 N/A LEU 254.A N LYS 250.A O no hydrogen 2.907 N/A GLN 255.A N ASN 251.A O no hydrogen 2.932 N/A GLN 255.A NE2 ALA 290.A O no hydrogen 2.950 N/A ALA 256.A N GLU 252.A O no hydrogen 2.978 N/A LEU 257.A N ARG 253.A O no hydrogen 2.990 N/A LEU 258.A N LEU 254.A O no hydrogen 3.122 N/A GLY 259.A N GLN 255.A O no hydrogen 3.003 N/A ASP 260.A N LEU 257.A O no hydrogen 3.263 N/A ASN 261.A ND2 ASP 268.A O no hydrogen 3.206 N/A MET 264.A N ASP 260.A O no hydrogen 2.845 N/A ASN 265.A N ASN 261.A O no hydrogen 2.835 N/A SER 267.A N ASN 261.A OD1 no hydrogen 3.196 N/A SER 267.A OG LEU 258.A O no hydrogen 3.052 N/A SER 267.A OG ASN 261.A OD1 no hydrogen 3.395 N/A ASP 268.A N ASN 261.A OD1 no hydrogen 2.872 N/A VAL 269.A N ARG 283.A O no hydrogen 3.031 N/A ILE 272.A N ILE 282.A O no hydrogen 3.278 N/A LEU 274.A N VAL 280.A O no hydrogen 2.838 N/A GLU 277.A N LEU 274.A O no hydrogen 3.077 N/A GLN 279.A N GLN 279.A OE1 no hydrogen 2.837 N/A VAL 280.A N GLU 277.A O no hydrogen 2.991 N/A LYS 281.A NZ PRO 278.A O no hydrogen 2.780 N/A LYS 281.A NZ GLN 279.A O no hydrogen 3.506 N/A ILE 282.A N ILE 272.A O no hydrogen 2.842 N/A ARG 283.A N LYS 305.A O no hydrogen 2.742 N/A ARG 283.A NE THR 306.A O no hydrogen 3.171 N/A ARG 283.A NH2 GLU 307.A O no hydrogen 2.760 N/A ILE 285.A N LEU 266.A O no hydrogen 2.866 N/A ILE 286.A N PHE 303.A O no hydrogen 2.860 N/A ALA 290.A N PRO 287.A O no hydrogen 3.380 N/A THR 291.A N GLN 301.A O no hydrogen 3.325 N/A LEU 292.A N ASN 251.A OD1 no hydrogen 2.781 N/A PHE 293.A N PRO 299.A O no hydrogen 2.880 N/A LEU 297.A N SER 295.A OG no hydrogen 3.243 N/A MET 298.A N SER 295.A O no hydrogen 3.090 N/A ALA 300.A N PHE 316.A O no hydrogen 2.988 N/A GLN 301.A N THR 291.A O no hydrogen 2.748 N/A LEU 302.A N VAL 314.A O no hydrogen 2.887 N/A PHE 304.A N TYR 312.A O no hydrogen 3.080 N/A LYS 305.A N GLY 284.A O no hydrogen 2.785 N/A LYS 305.A NZ SER 267.A O no hydrogen 2.790 N/A THR 306.A N GLY 310.A O no hydrogen 2.954 N/A THR 306.A OG1 ASP 308.A OD1 no hydrogen 2.767 N/A GLU 307.A N LYS 281.A O no hydrogen 2.831 N/A GLY 309.A N THR 306.A O no hydrogen 3.232 N/A GLY 310.A N THR 306.A OG1 no hydrogen 2.938 N/A TYR 312.A N PHE 304.A O no hydrogen 2.847 N/A TYR 312.A OH GLU 277.A OE1 no hydrogen 2.712 N/A VAL 314.A N LEU 302.A O no hydrogen 2.790 N/A ILE 315.A N MET 363.A O no hydrogen 2.805 N/A PHE 316.A N ALA 300.A O no hydrogen 2.840 N/A LYS 317.A N GLY 361.A O no hydrogen 3.024 N/A HIS 318.A ND1 GLN 241.A OE1 no hydrogen 2.771 N/A GLY 319.A N LYS 359.A O no hydrogen 2.738 N/A ASP 320.A N LYS 359.A O no hydrogen 3.035 N/A ARG 323.A N ASP 321.A OD1 no hydrogen 3.192 N/A ARG 323.A NE ASP 321.A OD1 no hydrogen 2.997 N/A ARG 323.A NE ASP 321.A OD2 no hydrogen 3.297 N/A ARG 323.A NH1 ASP 184.A OD2 no hydrogen 2.749 N/A ARG 323.A NH2 ASP 321.A OD2 no hydrogen 2.803 N/A GLN 324.A NE2 PHE 443.A O no hydrogen 2.858 N/A GLN 324.A NE2 ASP 511.A OD2 no hydrogen 3.070 N/A GLN 326.A N LEU 322.A O no hydrogen 2.802 N/A LEU 327.A N ARG 323.A O no hydrogen 3.016 N/A ILE 328.A N GLN 324.A O no hydrogen 3.123 N/A LEU 329.A N ASP 325.A O no hydrogen 2.927 N/A GLN 330.A N GLN 326.A O no hydrogen 3.002 N/A GLN 330.A NE2 MET 110.A O no hydrogen 3.132 N/A GLN 330.A NE2 GLN 114.A OE1 no hydrogen 3.407 N/A ILE 331.A N LEU 327.A O no hydrogen 2.937 N/A ILE 332.A N ILE 328.A O no hydrogen 2.807 N/A SER 333.A N LEU 329.A O no hydrogen 2.924 N/A LEU 334.A N GLN 330.A O no hydrogen 3.011 N/A MET 335.A N ILE 331.A O no hydrogen 2.807 N/A ASP 336.A N ILE 332.A O no hydrogen 2.854 N/A LYS 337.A N SER 333.A O no hydrogen 3.051 N/A LEU 338.A N LEU 334.A O no hydrogen 2.900 N/A LEU 339.A N MET 335.A O no hydrogen 2.946 N/A ARG 340.A N ASP 336.A O no hydrogen 2.928 N/A ARG 340.A NE ASP 336.A OD1 no hydrogen 3.473 N/A ARG 340.A NE ASP 336.A OD2 no hydrogen 3.017 N/A LYS 341.A N LYS 337.A O no hydrogen 2.917 N/A GLU 342.A N LEU 338.A O no hydrogen 3.242 N/A ASN 343.A N ARG 340.A O no hydrogen 3.058 N/A LEU 344.A N LEU 339.A O no hydrogen 2.815 N/A LYS 347.A N ASP 345.A OD1 no hydrogen 3.192 N/A LYS 347.A NZ ASP 345.A O no hydrogen 3.425 N/A LYS 347.A NZ ASP 345.A OD2 no hydrogen 3.088 N/A THR 349.A N TYR 413.A OH no hydrogen 2.879 N/A TYR 351.A N THR 349.A O no hydrogen 2.913 N/A LYS 352.A N GLN 364.A OE1 no hydrogen 3.032 N/A LEU 354.A N PHE 362.A O no hydrogen 2.880 N/A ALA 355.A N GLN 326.A OE1 no hydrogen 3.032 N/A THR 356.A N HIS 360.A O no hydrogen 2.784 N/A THR 356.A OG1 HIS 360.A ND1 no hydrogen 2.751 N/A SER 357.A N HIS 360.A O no hydrogen 3.099 N/A THR 358.A OG1 GLU 183.A O no hydrogen 3.560 N/A LYS 359.A N SER 357.A OG no hydrogen 3.290 N/A HIS 360.A ND1 THR 356.A OG1 no hydrogen 2.751 N/A GLY 361.A N LYS 317.A O no hydrogen 3.182 N/A PHE 362.A N LEU 354.A O no hydrogen 2.774 N/A MET 363.A N ILE 315.A O no hydrogen 2.927 N/A GLN 364.A N LYS 352.A O no hydrogen 2.777 N/A PHE 365.A N PRO 313.A O no hydrogen 3.038 N/A SER 368.A OG ILE 366.A O no hydrogen 2.890 N/A VAL 369.A N LEU 432.A O no hydrogen 2.779 N/A VAL 371.A N LEU 430.A O no hydrogen 2.803 N/A ALA 372.A N LEU 427.A O no hydrogen 2.923 N/A VAL 374.A N PRO 370.A O no hydrogen 3.097 N/A LEU 375.A N VAL 371.A O no hydrogen 3.050 N/A ASP 376.A N ALA 372.A O no hydrogen 3.183 N/A THR 377.A N GLU 373.A O no hydrogen 2.989 N/A THR 377.A OG1 GLU 373.A O no hydrogen 2.748 N/A THR 377.A OG1 VAL 374.A O no hydrogen 3.480 N/A GLU 378.A N VAL 374.A O no hydrogen 2.817 N/A GLY 379.A N LEU 375.A O no hydrogen 2.976 N/A GLN 382.A NE2 ASN 396.A OD1 no hydrogen 3.292 N/A GLN 382.A NE2 GLY 467.A O no hydrogen 3.081 N/A ASN 383.A N SER 380.A OG no hydrogen 3.216 N/A ASN 383.A ND2 GLU 378.A O no hydrogen 2.996 N/A PHE 384.A N SER 380.A O no hydrogen 3.172 N/A PHE 385.A N ILE 381.A O no hydrogen 2.959 N/A ARG 386.A N GLN 382.A O no hydrogen 2.833 N/A ARG 386.A NH1 GLN 382.A OE1 no hydrogen 3.330 N/A ARG 386.A NH1 ASN 396.A O no hydrogen 2.772 N/A ARG 386.A NH2 ASN 383.A OD1 no hydrogen 2.822 N/A LYS 387.A N ASN 383.A O no hydrogen 3.045 N/A LYS 387.A NZ GLU 378.A OE2 no hydrogen 2.977 N/A TYR 388.A N PHE 384.A O no hydrogen 3.157 N/A ALA 389.A N PHE 385.A O no hydrogen 2.809 N/A SER 391.A N GLY 397.A O no hydrogen 3.178 N/A GLY 397.A N GLY 394.A O no hydrogen 3.344 N/A ILE 398.A N PRO 395.A O no hydrogen 3.043 N/A SER 399.A N ALA 389.A O no hydrogen 2.962 N/A MET 403.A N SER 399.A O no hydrogen 2.969 N/A ASP 404.A N ALA 400.A O no hydrogen 2.882 N/A THR 405.A N GLU 401.A O no hydrogen 3.007 N/A THR 405.A OG1 GLU 401.A O no hydrogen 2.899 N/A TYR 406.A N VAL 402.A O no hydrogen 3.006 N/A TYR 406.A OH MET 464.A O no hydrogen 2.855 N/A VAL 407.A N MET 403.A O no hydrogen 2.990 N/A LYS 408.A N ASP 404.A O no hydrogen 3.054 N/A LYS 408.A NZ ASP 404.A OD1 no hydrogen 3.500 N/A LYS 408.A NZ ASP 404.A OD2 no hydrogen 2.779 N/A SER 409.A N THR 405.A O no hydrogen 2.924 N/A SER 409.A OG THR 405.A O no hydrogen 2.854 N/A SER 409.A OG TYR 406.A O no hydrogen 3.130 N/A CYS 410.A N TYR 406.A O no hydrogen 2.897 N/A CYS 410.A SG TYR 406.A O no hydrogen 3.308 N/A ALA 411.A N VAL 407.A O no hydrogen 3.048 N/A GLY 412.A N LYS 408.A O no hydrogen 2.898 N/A TYR 413.A N SER 409.A O no hydrogen 2.981 N/A CYS 414.A N.A CYS 410.A O no hydrogen 2.945 N/A CYS 414.A N.B CYS 410.A O no hydrogen 2.952 N/A CYS 414.A SG.B CYS 410.A O no hydrogen 3.282 N/A VAL 415.A N ALA 411.A O no hydrogen 3.139 N/A ILE 416.A N GLY 412.A O no hydrogen 2.973 N/A THR 417.A N TYR 413.A O no hydrogen 2.869 N/A THR 417.A OG1 TYR 413.A O no hydrogen 2.661 N/A TYR 418.A N CYS 414.A O.B no hydrogen 3.371 N/A TYR 418.A OH LYS 526.A O no hydrogen 2.716 N/A TYR 418.A OH TYR 539.A OH no hydrogen 2.884 N/A ILE 419.A N VAL 415.A O no hydrogen 3.069 N/A LEU 420.A N ILE 416.A O no hydrogen 3.000 N/A GLY 421.A N TYR 418.A O no hydrogen 3.242 N/A VAL 422.A N THR 417.A O no hydrogen 2.963 N/A GLY 423.A N TYR 445.A O no hydrogen 2.779 N/A ASP 424.A N ASP 450.A OD1 no hydrogen 2.813 N/A ARG 425.A NE GLY 423.A O no hydrogen 2.899 N/A ARG 425.A NH1 HIS 440.A ND1 no hydrogen 3.063 N/A ARG 425.A NH1 ILE 441.A O no hydrogen 2.942 N/A ARG 425.A NH2 GLY 423.A O no hydrogen 3.552 N/A ARG 425.A NH2 ILE 441.A O no hydrogen 3.058 N/A ARG 425.A NH2 ASP 442.A O no hydrogen 2.671 N/A HIS 426.A N ASN 429.A OD1 no hydrogen 2.982 N/A ASP 428.A N HIS 426.A ND1 no hydrogen 3.241 N/A ASN 429.A N HIS 426.A O no hydrogen 3.358 N/A ASN 429.A ND2 ASP 424.A O no hydrogen 2.706 N/A LEU 431.A N PHE 439.A O no hydrogen 2.830 N/A LEU 432.A N VAL 369.A O no hydrogen 2.839 N/A THR 433.A N LYS 437.A O no hydrogen 2.917 N/A THR 433.A OG1 THR 435.A OG1 no hydrogen 2.704 N/A THR 435.A OG1 THR 433.A OG1 no hydrogen 2.704 N/A GLY 436.A N THR 433.A O no hydrogen 3.034 N/A LYS 437.A N THR 433.A OG1 no hydrogen 3.020 N/A LYS 437.A NZ LEU 348.A O no hydrogen 3.307 N/A LYS 437.A NZ THR 349.A OG1 no hydrogen 3.057 N/A LEU 438.A N SER 409.A OG no hydrogen 2.999 N/A PHE 439.A N LEU 431.A O no hydrogen 2.921 N/A ILE 441.A N ASN 429.A O no hydrogen 3.056 N/A PHE 443.A N ASP 325.A OD1 no hydrogen 2.783 N/A ILE 446.A N ASP 511.A OD2 no hydrogen 2.828 N/A LEU 447.A N LEU 420.A O no hydrogen 2.880 N/A GLY 448.A N GLY 421.A O no hydrogen 2.951 N/A ARG 449.A N ILE 446.A O no hydrogen 3.290 N/A ARG 449.A NH1 GLY 444.A O no hydrogen 3.121 N/A ARG 449.A NH1 ASP 511.A OD2 no hydrogen 3.326 N/A LYS 452.A N ASP 450.A OD2 no hydrogen 3.038 N/A LYS 459.A NZ VAL 422.A O no hydrogen 3.293 N/A LYS 459.A NZ PRO 456.A O no hydrogen 2.746 N/A MET 464.A N ASN 461.A O no hydrogen 3.201 N/A MET 464.A N ASN 461.A OD1 no hydrogen 2.983 N/A VAL 465.A N ASN 461.A O no hydrogen 3.349 N/A GLU 466.A N LYS 462.A O no hydrogen 2.912 N/A GLY 467.A N GLU 463.A O no hydrogen 3.007 N/A MET 468.A N VAL 465.A O no hydrogen 3.236 N/A GLY 469.A N GLU 466.A O no hydrogen 3.085 N/A GLY 470.A N VAL 465.A O no hydrogen 3.113 N/A THR 471.A OG1 GLN 472.A OE1 no hydrogen 3.234 N/A SER 473.A N GLY 470.A O no hydrogen 3.455 N/A SER 473.A OG MET 468.A O no hydrogen 3.463 N/A SER 473.A OG GLY 470.A O no hydrogen 2.778 N/A TYR 476.A N SER 473.A OG no hydrogen 3.144 N/A GLU 478.A N GLU 474.A O no hydrogen 3.123 N/A PHE 479.A N GLN 475.A O no hydrogen 2.904 N/A ARG 480.A N TYR 476.A O no hydrogen 3.123 N/A ARG 480.A NE GLN 541.A OE1 no hydrogen 2.776 N/A ARG 480.A NH1 ASP 545.A OD1 no hydrogen 2.700 N/A ARG 480.A NH2 GLN 541.A OE1 no hydrogen 3.103 N/A ARG 480.A NH2 ASP 545.A OD1 no hydrogen 2.959 N/A ARG 480.A NH2 ASP 545.A OD2 no hydrogen 3.037 N/A LYS 481.A N GLN 477.A O no hydrogen 3.108 N/A GLN 482.A N GLU 478.A O no hydrogen 2.896 N/A CYS 483.A N PHE 479.A O no hydrogen 2.905 N/A CYS 483.A SG ALA 411.A O no hydrogen 3.920 N/A CYS 483.A SG PHE 479.A O no hydrogen 3.358 N/A TYR 484.A N ARG 480.A O no hydrogen 3.159 N/A THR 485.A N LYS 481.A O no hydrogen 3.065 N/A THR 485.A OG1 LYS 481.A O no hydrogen 2.712 N/A ALA 486.A N GLN 482.A O no hydrogen 2.988 N/A PHE 487.A N CYS 483.A O no hydrogen 3.083 N/A LEU 488.A N TYR 484.A O no hydrogen 3.030 N/A HIS 489.A N THR 485.A O no hydrogen 3.070 N/A LEU 490.A N ALA 486.A O no hydrogen 3.003 N/A ARG 491.A N PHE 487.A O no hydrogen 3.018 N/A ARG 491.A NH1 PHE 527.A O no hydrogen 2.933 N/A ARG 491.A NH1 ARG 528.A O no hydrogen 2.801 N/A ARG 491.A NH1 LEU 531.A O no hydrogen 3.482 N/A ARG 491.A NH2 LEU 531.A O no hydrogen 3.112 N/A ARG 491.A NH2 ASP 533.A OD1 no hydrogen 2.806 N/A ARG 492.A N LEU 488.A O no hydrogen 3.335 N/A TYR 493.A N LEU 490.A O no hydrogen 3.035 N/A TYR 493.A OH GLU 342.A OE2 no hydrogen 2.644 N/A SER 494.A N ARG 491.A O no hydrogen 3.130 N/A SER 494.A OG ARG 491.A O no hydrogen 2.935 N/A ILE 497.A N TYR 493.A O no hydrogen 3.131 N/A LEU 498.A N SER 494.A O no hydrogen 2.886 N/A ASN 499.A N ASN 495.A O no hydrogen 3.026 N/A ASN 499.A ND2 GLU 77.A O no hydrogen 2.648 N/A LEU 500.A N LEU 496.A O no hydrogen 3.053 N/A PHE 501.A N ILE 497.A O no hydrogen 3.113 N/A SER 502.A N LEU 498.A O no hydrogen 2.934 N/A LEU 503.A N ASN 499.A O no hydrogen 3.306 N/A LEU 503.A N LEU 500.A O no hydrogen 3.247 N/A MET 504.A N PHE 501.A O no hydrogen 3.002 N/A ALA 507.A N MET 504.A O no hydrogen 3.104 N/A ASN 508.A ND2 ASP 184.A OD1 no hydrogen 3.361 N/A ASN 508.A ND2 ASP 184.A OD2 no hydrogen 2.898 N/A ASP 511.A N GLN 324.A OE1 no hydrogen 2.953 N/A ILE 512.A N ILE 509.A O no hydrogen 3.013 N/A ALA 513.A N ILE 509.A O no hydrogen 2.809 N/A LEU 514.A N PRO 510.A O no hydrogen 3.196 N/A GLU 515.A N ILE 512.A O no hydrogen 3.089 N/A LYS 518.A N GLU 515.A O no hydrogen 3.359 N/A LYS 518.A NZ GLU 515.A OE2 no hydrogen 2.940 N/A THR 519.A OG1 GLU 515.A O no hydrogen 2.783 N/A LYS 521.A NZ ASP 525.A OD1 no hydrogen 2.783 N/A LYS 521.A NZ ASP 525.A OD2 no hydrogen 3.330 N/A LYS 522.A N LYS 518.A O no hydrogen 3.085 N/A LYS 522.A NZ GLU 515.A OE1 no hydrogen 2.873 N/A VAL 523.A N THR 519.A O no hydrogen 3.448 N/A GLN 524.A N VAL 520.A O no hydrogen 2.863 N/A ASP 525.A N LYS 521.A O no hydrogen 2.832 N/A LYS 526.A N VAL 523.A O no hydrogen 3.134 N/A PHE 527.A N GLN 524.A O no hydrogen 3.188 N/A ARG 528.A N ASP 525.A O no hydrogen 3.239 N/A ARG 528.A NE ASP 530.A OD1 no hydrogen 2.866 N/A ARG 528.A NE ASP 530.A OD2 no hydrogen 3.440 N/A ARG 528.A NH2 ASP 530.A OD2 no hydrogen 2.784 N/A LEU 531.A N ARG 528.A O no hydrogen 3.029 N/A SER 532.A N GLU 535.A OE1 no hydrogen 2.928 N/A SER 532.A OG GLU 535.A OE1 no hydrogen 3.297 N/A GLU 535.A N SER 532.A OG no hydrogen 3.369 N/A ALA 536.A N SER 532.A O no hydrogen 2.856 N/A VAL 537.A N ASP 533.A O no hydrogen 3.108 N/A HIS 538.A N GLU 534.A O no hydrogen 3.376 N/A TYR 539.A N GLU 535.A O no hydrogen 2.900 N/A TYR 539.A OH TYR 418.A OH no hydrogen 2.884 N/A MET 540.A N ALA 536.A O no hydrogen 2.899 N/A GLN 541.A N VAL 537.A O no hydrogen 2.897 N/A SER 542.A N HIS 538.A O no hydrogen 2.903 N/A SER 542.A OG HIS 538.A O no hydrogen 3.093 N/A LEU 543.A N TYR 539.A O no hydrogen 2.940 N/A ILE 544.A N MET 540.A O no hydrogen 3.145 N/A ASP 545.A N GLN 541.A O no hydrogen 3.025 N/A GLU 546.A N SER 542.A O no hydrogen 2.998 N/A SER 547.A N LEU 543.A O no hydrogen 3.067 N/A VAL 548.A N ILE 544.A O no hydrogen 2.927 N/A HIS 549.A N ASP 545.A O no hydrogen 3.066 N/A HIS 549.A ND1 ASP 545.A O no hydrogen 2.779 N/A ALA 550.A N GLU 546.A O no hydrogen 2.901 N/A LEU 551.A N SER 547.A O no hydrogen 2.805 N/A PHE 552.A N VAL 548.A O no hydrogen 3.067 N/A ALA 553.A N HIS 549.A O no hydrogen 3.145 N/A ALA 554.A N ALA 550.A O no hydrogen 3.332 N/A