Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bcd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N SER 27.A OG no hydrogen 3.030 N/A ILE 5.A N ILE 25.A O no hydrogen 2.590 N/A GLU 6.A N ILE 25.A O no hydrogen 3.317 N/A SER 7.A OG PRO 9.A O no hydrogen 2.537 N/A GLU 8.A N ILE 23.A O no hydrogen 2.988 N/A GLY 12.A N GLU 91.A O no hydrogen 2.842 N/A ALA 13.A N SER 10.A O no hydrogen 2.938 N/A SER 14.A N GLU 478.A OE1 no hydrogen 3.503 N/A VAL 15.A N LEU 93.A O no hydrogen 2.716 N/A ASN 18.A N SER 16.A OG no hydrogen 3.039 N/A LEU 19.A N SER 16.A O no hydrogen 3.027 N/A ILE 22.A N ILE 61.A O no hydrogen 3.111 N/A ILE 23.A N GLU 8.A O no hydrogen 2.817 N/A LEU 24.A N VAL 59.A O no hydrogen 2.880 N/A ILE 25.A N GLU 6.A O no hydrogen 3.106 N/A PHE 26.A N ASN 57.A O no hydrogen 2.900 N/A SER 27.A N PHE 3.A O no hydrogen 3.125 N/A SER 27.A OG SER 1.A O no hydrogen 2.820 N/A SER 27.A OG PHE 3.A O no hydrogen 3.420 N/A ASN 28.A ND2 ASP 80.A OD2 no hydrogen 2.752 N/A ILE 30.A N GLY 56.A O no hydrogen 2.580 N/A ASN 31.A N ILE 79.A O no hydrogen 2.989 N/A LYS 32.A N ILE 79.A O no hydrogen 3.016 N/A SER 34.A N GLU 77.A O no hydrogen 2.794 N/A SER 34.A OG GLU 77.A O no hydrogen 3.323 N/A GLN 35.A N GLU 77.A O no hydrogen 3.298 N/A ALA 37.A N SER 75.A O no hydrogen 2.945 N/A THR 39.A N ARG 73.A O no hydrogen 2.821 N/A THR 39.A OG1 ASP 46.A OD2 no hydrogen 2.502 N/A ASP 40.A N SER 45.A O no hydrogen 3.192 N/A LEU 41.A N ASN 71.A O no hydrogen 3.064 N/A ILE 42.A N ASP 40.A OD1 no hydrogen 3.137 N/A THR 43.A N ASP 40.A OD1 no hydrogen 3.455 N/A THR 43.A OG1 ASP 40.A OD2 no hydrogen 2.580 N/A ILE 47.A N LEU 38.A O no hydrogen 2.869 N/A GLN 48.A NE2 ASP 46.A O no hydrogen 3.075 N/A ASP 51.A N ASN 62.A O no hydrogen 2.909 N/A GLU 55.A N LYS 58.A O no hydrogen 2.934 N/A ASN 57.A ND2 PHE 26.A O no hydrogen 2.969 N/A LYS 58.A N GLU 55.A O no hydrogen 3.389 N/A VAL 59.A N LEU 24.A O no hydrogen 2.717 N/A ILE 60.A N ASN 53.A O no hydrogen 2.990 N/A ILE 61.A N ILE 22.A O no hydrogen 2.974 N/A ASN 62.A N ASP 51.A O no hydrogen 2.971 N/A ASN 63.A ND2 GLY 49.A O no hydrogen 2.792 N/A GLU 67.A N TYR 72.A OH no hydrogen 3.026 N/A THR 69.A N VAL 94.A O no hydrogen 2.914 N/A THR 69.A OG1 PRO 68.A O no hydrogen 2.857 N/A CYS 70.A N GLU 67.A O no hydrogen 3.191 N/A TYR 72.A N PHE 92.A O no hydrogen 2.755 N/A ARG 73.A N THR 39.A O no hydrogen 2.868 N/A ARG 73.A NE GLU 91.A OE2 no hydrogen 2.796 N/A ARG 73.A NH2 GLU 91.A OE2 no hydrogen 2.876 N/A LEU 74.A N ILE 90.A O no hydrogen 2.830 N/A SER 75.A N ALA 37.A O no hydrogen 2.854 N/A SER 75.A OG ALA 37.A O no hydrogen 3.551 N/A TYR 76.A N GLY 88.A O no hydrogen 2.984 N/A GLU 77.A N GLN 35.A O no hydrogen 2.843 N/A VAL 78.A N LEU 86.A O no hydrogen 2.968 N/A ILE 79.A N LYS 32.A O no hydrogen 2.845 N/A ASP 80.A N ASN 84.A O no hydrogen 2.800 N/A ILE 81.A N ASP 29.A O no hydrogen 3.197 N/A TYR 82.A N ASP 80.A OD1 no hydrogen 2.920 N/A ASP 83.A N ASP 80.A O no hydrogen 3.205 N/A ASN 84.A N ASP 80.A OD1 no hydrogen 2.787 N/A ASN 84.A ND2 ASP 80.A OD2 no hydrogen 2.710 N/A LEU 86.A N VAL 78.A O no hydrogen 2.977 N/A GLN 87.A NE2 GLU 77.A OE1 no hydrogen 3.180 N/A GLY 88.A N TYR 76.A O no hydrogen 3.323 N/A ILE 90.A N LEU 74.A O no hydrogen 3.062 N/A GLU 91.A N THR 11.A OG1 no hydrogen 3.386 N/A PHE 92.A N TYR 72.A O no hydrogen 2.879 N/A LEU 93.A N ALA 13.A O no hydrogen 3.106 N/A ASN 95.A N VAL 15.A O no hydrogen 2.685 N/A GLN 96.A NE2 VAL 584.A O no hydrogen 3.028 N/A SER 97.A N GLN 96.A OE1 no hydrogen 2.803 N/A ASN 98.A N GLN 96.A OE1 no hydrogen 3.255 N/A GLU 106.A N PRO 103.A O no hydrogen 3.033 N/A VAL 107.A N ASP 104.A O no hydrogen 3.307 N/A ASN 108.A N TYR 492.A OH no hydrogen 3.013 N/A ASN 108.A ND2 ARG 487.A O no hydrogen 2.791 N/A ASN 108.A ND2 ALA 491.A O no hydrogen 2.828 N/A THR 110.A N THR 151.A OG1 no hydrogen 2.811 N/A ILE 111.A N PRO 464.A O no hydrogen 3.096 N/A LEU 112.A N ALA 152.A O no hydrogen 3.112 N/A GLN 113.A N VAL 466.A O no hydrogen 2.882 N/A ALA 114.A N TRP 154.A O no hydrogen 2.913 N/A PHE 115.A N GLN 113.A O no hydrogen 2.972 N/A TYR 116.A OH GLU 131.A OE1 no hydrogen 2.799 N/A GLU 118.A N GLU 118.A OE2 no hydrogen 2.762 N/A THR 121.A N GLU 118.A O no hydrogen 2.734 N/A THR 121.A OG1 GLU 118.A O no hydrogen 2.586 N/A TYR 124.A OH ASP 437.A OD1 no hydrogen 3.095 N/A TYR 124.A OH ASP 437.A OD2 no hydrogen 3.051 N/A ALA 125.A N THR 121.A O no hydrogen 3.332 N/A GLU 127.A N GLU 123.A O no hydrogen 2.886 N/A HIS 128.A N TYR 124.A O no hydrogen 2.901 N/A HIS 128.A ND1 GLU 130.A OE2 no hydrogen 2.911 N/A GLU 130.A N GLU 130.A OE1 no hydrogen 2.388 N/A GLU 131.A N HIS 128.A O no hydrogen 3.204 N/A ALA 132.A N PRO 129.A O no hydrogen 3.181 N/A ASN 133.A N GLU 130.A O no hydrogen 3.431 N/A TRP 135.A N TYR 191.A O no hydrogen 3.166 N/A ASN 136.A ND2 GLU 196.A OE1 no hydrogen 3.298 N/A LEU 137.A N ASN 133.A O no hydrogen 2.991 N/A LEU 138.A N LEU 134.A O no hydrogen 2.938 N/A ALA 139.A N TRP 135.A O no hydrogen 3.289 N/A GLU 140.A N ASN 136.A O no hydrogen 3.026 N/A ARG 141.A N LEU 137.A O no hydrogen 2.896 N/A LEU 145.A N ARG 141.A O no hydrogen 2.931 N/A ALA 146.A N ALA 142.A O no hydrogen 2.947 N/A GLU 147.A N PRO 143.A O no hydrogen 2.992 N/A ALA 148.A N GLU 144.A O no hydrogen 2.948 N/A ALA 148.A N LEU 145.A O no hydrogen 2.990 N/A GLY 149.A N LEU 145.A O no hydrogen 3.265 N/A GLY 149.A N ALA 146.A O no hydrogen 3.227 N/A PHE 150.A N LEU 145.A O no hydrogen 3.283 N/A THR 151.A N THR 110.A O no hydrogen 3.023 N/A THR 151.A OG1 THR 110.A O no hydrogen 3.096 N/A ALA 152.A N THR 110.A O no hydrogen 3.247 N/A VAL 153.A N LYS 210.A O no hydrogen 2.701 N/A TRP 154.A N LEU 112.A O no hydrogen 2.864 N/A TRP 154.A NE1 ASP 214.A OD2 no hydrogen 3.046 N/A LEU 155.A N TYR 212.A O no hydrogen 3.082 N/A ASN 159.A ND2 LYS 160.A O no hydrogen 3.158 N/A LYS 160.A N ASP 177.A O no hydrogen 2.849 N/A LYS 160.A NZ ASP 177.A OD2 no hydrogen 2.940 N/A LYS 160.A NZ PHE 181.A O no hydrogen 2.849 N/A LYS 160.A NZ GLN 183.A O no hydrogen 2.988 N/A LYS 160.A NZ THR 186.A O no hydrogen 2.910 N/A LYS 160.A NZ VAL 187.A O no hydrogen 3.514 N/A MET 162.A N GLY 171.A O no hydrogen 2.894 N/A ALA 163.A N ASP 167.A OD2 no hydrogen 2.906 N/A GLY 164.A N GLY 161.A O no hydrogen 3.113 N/A HIS 166.A N ALA 163.A O no hydrogen 3.126 N/A ASP 167.A N GLY 164.A O no hydrogen 3.145 N/A GLY 169.A N ASP 167.A OD1 no hydrogen 2.681 N/A TYR 170.A OH ASP 214.A OD2 no hydrogen 2.462 N/A TYR 170.A OH HIS 432.A NE2 no hydrogen 3.291 N/A GLY 171.A N ASP 167.A OD1 no hydrogen 2.994 N/A THR 172.A N TYR 170.A O no hydrogen 2.882 N/A THR 172.A OG1 VAL 216.A O no hydrogen 3.293 N/A TYR 173.A N LYS 160.A O no hydrogen 3.208 N/A TYR 173.A OH ASP 224.A OD1 no hydrogen 2.737 N/A TYR 173.A OH ASP 224.A OD2 no hydrogen 2.957 N/A ASP 174.A N LYS 160.A O no hydrogen 3.368 N/A TRP 176.A N ASP 174.A OD1 no hydrogen 3.052 N/A TRP 176.A NE1 ASP 316.A OD1 no hydrogen 3.142 N/A ASP 177.A N ASP 174.A O no hydrogen 3.292 N/A GLY 179.A N ASP 177.A OD1 no hydrogen 2.983 N/A GLU 180.A N ASP 177.A OD1 no hydrogen 3.005 N/A PHE 181.A N ASP 177.A OD1 no hydrogen 3.382 N/A GLN 183.A N THR 186.A O no hydrogen 3.135 N/A GLN 183.A NE2 ASP 174.A OD2 no hydrogen 3.087 N/A GLN 183.A NE2 ASP 177.A OD2 no hydrogen 2.844 N/A LYS 184.A NZ GLY 222.A O no hydrogen 2.693 N/A THR 186.A N GLN 183.A O no hydrogen 3.196 N/A THR 186.A OG1 ARG 188.A O no hydrogen 2.378 N/A ARG 188.A NH2 LYS 190.A O no hydrogen 3.215 N/A THR 189.A N GLY 192.A O no hydrogen 3.148 N/A THR 189.A OG1 GLY 192.A O no hydrogen 3.317 N/A LYS 190.A NZ MET 119.A O no hydrogen 2.857 N/A TYR 191.A N THR 189.A OG1 no hydrogen 3.194 N/A TYR 191.A OH VAL 168.A O no hydrogen 2.750 N/A THR 193.A N GLU 196.A OE2 no hydrogen 3.087 N/A LYS 194.A NZ TYR 258.A OH no hydrogen 3.156 N/A GLU 196.A N THR 193.A OG1 no hydrogen 3.048 N/A LEU 197.A N THR 193.A O no hydrogen 2.968 N/A GLU 198.A N LYS 194.A O no hydrogen 2.753 N/A ASN 199.A N GLY 195.A O no hydrogen 2.840 N/A ALA 200.A N GLU 196.A O no hydrogen 2.732 N/A ILE 201.A N LEU 197.A O no hydrogen 2.874 N/A ASP 202.A N GLU 198.A O no hydrogen 3.073 N/A ALA 203.A N ASN 199.A O no hydrogen 3.094 N/A LEU 204.A N ALA 200.A O no hydrogen 3.010 N/A HIS 205.A N ILE 201.A O no hydrogen 2.972 N/A HIS 205.A NE2 ASP 331.A OD2 no hydrogen 2.528 N/A ASN 206.A N ASP 202.A O no hydrogen 2.684 N/A ASN 207.A N ALA 203.A O no hydrogen 3.120 N/A ASN 207.A N LEU 204.A O no hydrogen 2.998 N/A ASP 208.A N HIS 205.A O no hydrogen 2.905 N/A ILE 209.A N LEU 204.A O no hydrogen 2.940 N/A LYS 210.A N THR 151.A O no hydrogen 2.864 N/A VAL 211.A N ASP 331.A OD2 no hydrogen 3.182 N/A TYR 212.A N VAL 153.A O no hydrogen 2.934 N/A PHE 213.A N GLY 332.A O no hydrogen 2.806 N/A ALA 215.A N ARG 334.A O no hydrogen 2.897 N/A ASN 218.A ND2 HIS 219.A ND1 no hydrogen 2.883 N/A HIS 219.A NE2 TYR 170.A O no hydrogen 3.032 N/A ARG 220.A N ALA 304.A O no hydrogen 3.126 N/A ARG 220.A NH1 TYR 173.A O no hydrogen 2.975 N/A MET 221.A N THR 172.A O no hydrogen 2.988 N/A ASP 224.A N GLY 248.A O no hydrogen 2.758 N/A TYR 225.A N GLY 248.A O no hydrogen 2.967 N/A GLU 227.A N ALA 245.A O no hydrogen 2.803 N/A THR 228.A OG1 TYR 276.A OH no hydrogen 3.294 N/A VAL 229.A N ILE 243.A O no hydrogen 2.799 N/A LEU 231.A N GLN 241.A O no hydrogen 2.786 N/A ASP 232.A N LEU 284.A O no hydrogen 3.132 N/A ASN 234.A N ASP 232.A OD1 no hydrogen 2.873 N/A SER 235.A N ASP 232.A O no hydrogen 3.179 N/A SER 235.A OG ASP 237.A O no hydrogen 2.698 N/A ARG 236.A NE ASP 237.A OD1 no hydrogen 3.479 N/A ARG 236.A NH2 ASP 237.A OD2 no hydrogen 3.318 N/A LYS 238.A NZ GLU 279.A OE1 no hydrogen 2.367 N/A GLY 240.A N LEU 231.A O no hydrogen 3.082 N/A GLN 241.A N LYS 238.A O no hydrogen 3.060 N/A ILE 243.A N VAL 229.A O no hydrogen 2.919 N/A LYS 244.A N ASP 274.A OD1 no hydrogen 2.961 N/A LYS 244.A NZ THR 228.A OG1 no hydrogen 2.915 N/A ALA 245.A N GLU 227.A O no hydrogen 2.793 N/A THR 247.A OG1 GLU 227.A OE2 no hydrogen 2.708 N/A THR 247.A OG1 ALA 245.A O no hydrogen 3.256 N/A GLY 248.A N TYR 225.A O no hydrogen 2.911 N/A PHE 249.A N TRP 263.A O no hydrogen 2.990 N/A ASN 250.A N ASP 224.A OD2 no hydrogen 2.823 N/A PHE 251.A N ASP 224.A OD2 no hydrogen 3.079 N/A ARG 254.A N PHE 251.A O no hydrogen 3.189 N/A ARG 254.A NE ASP 174.A OD1 no hydrogen 3.466 N/A ARG 254.A NE ASP 174.A OD2 no hydrogen 2.942 N/A ARG 254.A NH1 GLU 257.A O no hydrogen 2.789 N/A ARG 254.A NH1 SER 259.A O no hydrogen 2.876 N/A ARG 254.A NH2 ASP 174.A OD1 no hydrogen 3.373 N/A ASN 255.A N PHE 251.A O no hydrogen 3.327 N/A GLU 257.A N ARG 254.A O no hydrogen 3.434 N/A TYR 258.A OH GLU 180.A OE1 no hydrogen 3.224 N/A TYR 258.A OH GLU 180.A OE2 no hydrogen 2.851 N/A SER 259.A N GLU 257.A O no hydrogen 2.765 N/A SER 259.A OG ASP 316.A OD2 no hydrogen 2.758 N/A PHE 261.A N SER 259.A OG no hydrogen 3.426 N/A TRP 263.A N PHE 249.A O no hydrogen 2.912 N/A GLY 265.A N GLU 227.A OE2 no hydrogen 2.840 N/A GLN 266.A N ASN 264.A OD1 no hydrogen 2.982 N/A CYS 267.A N ASN 264.A O no hydrogen 2.933 N/A CYS 267.A SG ASN 264.A OD1 no hydrogen 3.899 N/A PHE 268.A N GLY 265.A O no hydrogen 3.194 N/A ASP 269.A N ASP 305.A O no hydrogen 3.117 N/A THR 271.A N TYR 283.A O no hydrogen 3.181 N/A ASP 272.A N THR 271.A OG1 no hydrogen 2.631 N/A TRP 273.A NE1 ASP 275.A OD2 no hydrogen 2.811 N/A ASP 275.A N LYS 244.A O no hydrogen 3.072 N/A TYR 276.A N ASP 274.A OD1 no hydrogen 3.053 N/A SER 277.A N ASP 274.A OD2 no hydrogen 3.229 N/A SER 277.A OG ASP 274.A OD2 no hydrogen 2.494 N/A SER 277.A OG GLU 279.A OE1 no hydrogen 3.208 N/A LYS 278.A N ASP 274.A O no hydrogen 2.732 N/A LYS 278.A NZ ASP 275.A O no hydrogen 2.757 N/A GLU 279.A N ASP 274.A O no hydrogen 3.296 N/A GLY 281.A N ASP 272.A O no hydrogen 3.377 N/A LYS 282.A N ASP 237.A OD2 no hydrogen 2.880 N/A LYS 282.A NZ ASP 297.A O no hydrogen 3.539 N/A LYS 282.A NZ ASP 297.A OD1 no hydrogen 2.396 N/A TYR 283.A N THR 271.A O no hydrogen 3.050 N/A TYR 283.A OH GLU 279.A O no hydrogen 2.507 N/A LEU 284.A N SER 235.A OG no hydrogen 3.195 N/A PHE 285.A N ASP 269.A O no hydrogen 2.892 N/A ASP 286.A N LEU 230.A O no hydrogen 2.879 N/A GLU 287.A N ASP 232.A OD2 no hydrogen 3.085 N/A LYS 288.A N PHE 285.A O no hydrogen 2.808 N/A LYS 288.A NZ GLN 266.A O no hydrogen 2.579 N/A LYS 288.A NZ ASP 307.A OD2 no hydrogen 2.630 N/A ASP 291.A N ASP 299.A OD2 no hydrogen 2.892 N/A THR 293.A OG1 ASN 295.A O no hydrogen 2.715 N/A ASN 295.A ND2 GLU 298.A OE1 no hydrogen 2.717 N/A ASN 295.A ND2 GLU 298.A OE2 no hydrogen 3.197 N/A TYR 300.A OH GLY 303.A O no hydrogen 2.732 N/A GLY 303.A N ASP 272.A OD2 no hydrogen 3.369 N/A ALA 304.A N ARG 220.A O no hydrogen 2.903 N/A ASP 305.A N GLY 270.A O no hydrogen 2.681 N/A VAL 306.A N ASN 218.A O no hydrogen 3.134 N/A ASP 307.A N CYS 267.A O no hydrogen 2.985 N/A TYR 308.A N ASP 291.A OD2 no hydrogen 3.096 N/A TYR 308.A OH LEU 217.A O no hydrogen 2.749 N/A GLU 309.A N ASP 307.A OD1 no hydrogen 2.981 N/A ASN 310.A N ASP 307.A O no hydrogen 3.175 N/A ASN 310.A ND2 GLN 266.A O no hydrogen 3.242 N/A VAL 313.A N ASN 310.A OD1 no hydrogen 2.916 N/A GLN 314.A N ASN 310.A O no hydrogen 2.921 N/A ASN 315.A N GLU 311.A O no hydrogen 2.938 N/A ASP 316.A N ALA 312.A O no hydrogen 3.252 N/A VAL 317.A N VAL 313.A O no hydrogen 3.295 N/A ILE 318.A N GLN 314.A O no hydrogen 3.097 N/A ASP 319.A N ASN 315.A O no hydrogen 3.115 N/A TRP 320.A N ASP 316.A O no hydrogen 2.907 N/A TRP 320.A NE1 LEU 175.A O no hydrogen 2.632 N/A GLY 321.A N VAL 317.A O no hydrogen 3.337 N/A GLN 322.A N ILE 318.A O no hydrogen 3.117 N/A GLN 322.A NE2 ALA 352.A O no hydrogen 3.493 N/A TRP 323.A N ASP 319.A O no hydrogen 2.993 N/A ILE 324.A N TRP 320.A O no hydrogen 2.916 N/A ILE 325.A N GLY 321.A O no hydrogen 3.364 N/A ASN 326.A N GLN 322.A O no hydrogen 2.684 N/A ASN 326.A ND2 SER 356.A OG no hydrogen 2.707 N/A ASN 327.A N TRP 323.A O no hydrogen 2.898 N/A ILE 328.A N TRP 323.A O no hydrogen 2.895 N/A PHE 330.A N ILE 324.A O no hydrogen 3.032 N/A ASP 331.A N VAL 211.A O no hydrogen 2.835 N/A PHE 333.A N PHE 362.A O no hydrogen 2.776 N/A ARG 334.A N PHE 213.A O no hydrogen 2.756 N/A ARG 334.A NH1 ASP 214.A OD1 no hydrogen 2.706 N/A ARG 334.A NH1 ASP 336.A OD1 no hydrogen 3.179 N/A LEU 335.A N VAL 364.A O no hydrogen 2.808 N/A ASP 336.A N ALA 215.A O no hydrogen 3.144 N/A ALA 337.A N GLU 366.A OE1 no hydrogen 2.907 N/A VAL 338.A N GLU 366.A O no hydrogen 2.866 N/A LYS 339.A NZ TRP 368.A O no hydrogen 2.772 N/A HIS 340.A N ALA 337.A O no hydrogen 3.009 N/A HIS 340.A ND1 GLU 298.A O no hydrogen 2.735 N/A TYR 343.A N TRP 292.A O no hydrogen 3.147 N/A ARG 344.A N ASP 342.A OD1 no hydrogen 2.866 N/A ARG 344.A NE ASP 342.A OD1 no hydrogen 3.083 N/A ARG 344.A NH2 GLU 309.A OE2 no hydrogen 2.836 N/A ARG 344.A NH2 ASP 342.A OD2 no hydrogen 2.963 N/A PHE 345.A N ASP 342.A OD1 no hydrogen 3.297 N/A ILE 346.A N ASP 342.A O no hydrogen 3.217 N/A LYS 348.A N ARG 344.A O no hydrogen 3.088 N/A LYS 348.A NZ GLN 314.A OE1 no hydrogen 2.611 N/A TRP 349.A N PHE 345.A O no hydrogen 2.811 N/A TRP 349.A NE1 VAL 317.A O no hydrogen 2.871 N/A MET 350.A N ILE 346.A O no hydrogen 2.998 N/A SER 351.A N ASP 347.A O no hydrogen 2.974 N/A SER 351.A OG ASP 347.A O no hydrogen 3.109 N/A ALA 352.A N LYS 348.A O no hydrogen 2.941 N/A VAL 353.A N TRP 349.A O no hydrogen 2.909 N/A GLN 354.A N MET 350.A O no hydrogen 2.928 N/A GLN 354.A NE2 VAL 361.A O no hydrogen 2.950 N/A GLN 354.A NE2 ASP 386.A OD2 no hydrogen 2.838 N/A ASN 355.A N SER 351.A O no hydrogen 2.951 N/A SER 356.A N VAL 353.A O no hydrogen 3.014 N/A SER 356.A OG VAL 353.A O no hydrogen 2.861 N/A SER 357.A N GLN 354.A O no hydrogen 3.313 N/A ARG 359.A N SER 357.A OG no hydrogen 3.013 N/A ARG 359.A NH1 ASP 329.A OD2 no hydrogen 2.915 N/A ARG 359.A NH2 ASP 329.A O no hydrogen 3.528 N/A ARG 359.A NH2 ASP 329.A OD2 no hydrogen 2.693 N/A ARG 359.A NH2 ASP 331.A OD1 no hydrogen 3.102 N/A VAL 361.A N GLN 354.A OE1 no hydrogen 2.891 N/A VAL 364.A N PHE 333.A O no hydrogen 3.125 N/A GLY 365.A N ARG 388.A O no hydrogen 2.825 N/A GLU 366.A N LEU 335.A O no hydrogen 2.799 N/A ASP 374.A N ASP 371.A OD1 no hydrogen 3.064 N/A LEU 375.A N ASP 371.A O no hydrogen 3.191 N/A LYS 376.A N VAL 372.A O no hydrogen 2.898 N/A LYS 376.A NZ ASP 373.A OD1 no hydrogen 2.989 N/A GLY 377.A N ASP 373.A O no hydrogen 3.001 N/A PHE 378.A N ASP 374.A O no hydrogen 2.952 N/A LEU 379.A N LEU 375.A O no hydrogen 3.185 N/A ASP 380.A N LYS 376.A O no hydrogen 2.886 N/A THR 381.A N GLY 377.A O no hydrogen 2.985 N/A THR 381.A OG1 GLY 377.A O no hydrogen 2.929 N/A VAL 382.A N PHE 378.A O no hydrogen 3.071 N/A GLY 383.A N LEU 379.A O no hydrogen 3.117 N/A ASN 384.A ND2 ASP 347.A O no hydrogen 3.321 N/A ASN 384.A ND2 ASP 347.A OD2 no hydrogen 2.946 N/A ASP 386.A N ASN 384.A OD1 no hydrogen 3.119 N/A LEU 387.A N ASN 384.A O no hydrogen 3.108 N/A ARG 388.A N PHE 363.A O no hydrogen 3.124 N/A VAL 389.A N ARG 424.A O no hydrogen 2.861 N/A PHE 390.A N GLY 365.A O no hydrogen 3.256 N/A ASP 391.A N VAL 426.A O no hydrogen 2.950 N/A PHE 392.A N PHE 390.A O no hydrogen 3.011 N/A LEU 394.A N ASP 391.A OD2 no hydrogen 3.239 N/A ARG 395.A N ASP 391.A O no hydrogen 3.310 N/A ARG 395.A NE VAL 429.A O no hydrogen 3.049 N/A ARG 395.A NE ASP 430.A OD1 no hydrogen 3.241 N/A ARG 395.A NH1 ASP 430.A OD1 no hydrogen 2.728 N/A ARG 395.A NH1 VAL 443.A O no hydrogen 2.899 N/A SER 396.A N PHE 392.A O no hydrogen 3.149 N/A SER 396.A OG PRO 393.A O no hydrogen 2.951 N/A PHE 397.A N LEU 394.A O no hydrogen 2.755 N/A PHE 398.A N LEU 394.A O no hydrogen 3.349 N/A VAL 399.A N ARG 395.A O no hydrogen 2.866 N/A ASP 400.A N SER 396.A O no hydrogen 3.041 N/A MET 401.A N PHE 397.A O no hydrogen 2.879 N/A LEU 402.A N VAL 399.A O no hydrogen 3.160 N/A ASN 403.A N ASP 400.A O no hydrogen 3.400 N/A GLY 404.A N MET 401.A O no hydrogen 3.136 N/A ALA 405.A N ASP 527.A OD1 no hydrogen 2.844 N/A MET 407.A N ALA 503.A O no hydrogen 2.854 N/A ALA 408.A N ASP 502.A O no hydrogen 2.823 N/A ASP 409.A N TYR 406.A O no hydrogen 2.995 N/A LEU 410.A N MET 407.A O no hydrogen 3.101 N/A ARG 411.A N ALA 408.A O no hydrogen 3.315 N/A ARG 411.A NH1 VAL 498.A O no hydrogen 2.894 N/A ASN 412.A N ASP 409.A O no hydrogen 3.110 N/A LEU 415.A N ASP 391.A OD2 no hydrogen 2.911 N/A VAL 416.A N ASP 391.A OD1 no hydrogen 3.022 N/A ASN 417.A N GLY 414.A O no hydrogen 3.208 N/A ASN 417.A ND2 ALA 413.A O no hydrogen 2.894 N/A ASN 417.A ND2 TYR 455.A OH no hydrogen 3.128 N/A SER 418.A N LEU 415.A O no hydrogen 3.000 N/A GLY 420.A N GLU 422.A OE1 no hydrogen 3.034 N/A TYR 421.A N SER 418.A O no hydrogen 2.828 N/A TYR 421.A OH ASP 380.A OD1 no hydrogen 2.774 N/A TYR 421.A OH ASP 380.A OD2 no hydrogen 3.131 N/A GLU 422.A N GLU 422.A OE1 no hydrogen 2.865 N/A ARG 424.A N TYR 421.A O no hydrogen 3.018 N/A ARG 424.A NH2 GLY 420.A O no hydrogen 3.123 N/A ALA 425.A N GLU 422.A O no hydrogen 3.292 N/A VAL 426.A N VAL 389.A O no hydrogen 2.879 N/A THR 427.A N VAL 463.A O no hydrogen 3.056 N/A THR 427.A OG1 VAL 463.A O no hydrogen 3.353 N/A ASN 431.A N THR 434.A OG1 no hydrogen 2.787 N/A HIS 432.A ND1 GLN 113.A OE1 no hydrogen 2.933 N/A ASP 433.A N ASN 431.A OD1 no hydrogen 2.839 N/A THR 434.A N ASN 431.A OD1 no hydrogen 3.004 N/A THR 434.A OG1 ASP 430.A OD1 no hydrogen 3.008 N/A THR 434.A OG1 ASN 431.A O no hydrogen 3.369 N/A THR 434.A OG1 ASN 431.A OD1 no hydrogen 3.557 N/A ASP 435.A N ASN 431.A O no hydrogen 2.936 N/A ARG 436.A NE HIS 432.A O no hydrogen 3.011 N/A ARG 436.A NH2 HIS 432.A O no hydrogen 3.456 N/A ASP 437.A N GLU 118.A OE1 no hydrogen 2.715 N/A SER 440.A OG THR 442.A O no hydrogen 2.449 N/A THR 442.A N SER 440.A OG no hydrogen 3.375 N/A THR 442.A OG1 VAL 443.A O no hydrogen 3.516 N/A ILE 445.A N ASP 430.A OD2 no hydrogen 2.848 N/A SER 447.A OG GLU 574.A OE2 no hydrogen 2.612 N/A LYS 449.A NZ ASP 430.A OD2 no hydrogen 2.822 N/A LYS 449.A NZ ASP 470.A OD1 no hydrogen 2.860 N/A LYS 449.A NZ ASP 470.A OD2 no hydrogen 3.312 N/A GLN 451.A N GLN 451.A OE1 no hydrogen 2.986 N/A GLN 451.A NE2 SER 526.A O no hydrogen 3.368 N/A GLN 451.A NE2 SER 573.A O no hydrogen 3.537 N/A GLN 451.A NE2 GLU 574.A O no hydrogen 2.940 N/A ALA 452.A N ARG 448.A O no hydrogen 3.277 N/A TYR 453.A N LYS 449.A O no hydrogen 3.068 N/A TYR 453.A OH ASP 470.A OD2 no hydrogen 2.573 N/A ALA 454.A N TYR 450.A O no hydrogen 2.891 N/A TYR 455.A N GLN 451.A O no hydrogen 3.125 N/A TYR 455.A OH LEU 410.A O no hydrogen 2.796 N/A ILE 456.A N ALA 452.A O no hydrogen 3.137 N/A LEU 457.A N TYR 453.A O no hydrogen 2.850 N/A THR 458.A N ALA 454.A O no hydrogen 3.158 N/A THR 458.A OG1 ALA 454.A O no hydrogen 2.634 N/A THR 458.A OG1 TYR 455.A O no hydrogen 3.344 N/A ARG 459.A N ILE 456.A O no hydrogen 3.470 N/A ARG 459.A NH1 TYR 506.A OH no hydrogen 2.906 N/A ARG 459.A NH2 ASN 417.A OD1 no hydrogen 3.030 N/A ARG 459.A NH2 TYR 506.A OH no hydrogen 3.406 N/A ALA 460.A N TYR 508.A OH no hydrogen 2.912 N/A GLY 462.A N ASN 423.A OD1 no hydrogen 3.098 N/A VAL 463.A N ALA 425.A O no hydrogen 3.227 N/A THR 465.A N THR 427.A O no hydrogen 2.776 N/A THR 465.A OG1 THR 427.A O no hydrogen 3.322 N/A VAL 466.A N ILE 111.A O no hydrogen 2.823 N/A TYR 467.A N TYR 453.A OH no hydrogen 3.026 N/A TYR 467.A OH ASP 435.A O no hydrogen 3.073 N/A TRP 468.A N GLN 113.A O no hydrogen 3.009 N/A TRP 468.A NE1 GLU 131.A OE2 no hydrogen 2.959 N/A LYS 469.A NZ GLU 118.A OE2 no hydrogen 3.085 N/A LYS 469.A NZ TYR 124.A OH no hydrogen 3.288 N/A LYS 469.A NZ ASP 437.A OD1 no hydrogen 2.987 N/A TYR 471.A N TYR 467.A O no hydrogen 3.228 N/A TYR 471.A N TRP 468.A O no hydrogen 3.111 N/A TYR 471.A OH ASP 481.A OD1 no hydrogen 2.539 N/A TYR 472.A N TRP 468.A O no hydrogen 3.082 N/A ILE 473.A N LYS 469.A O no hydrogen 2.936 N/A TRP 474.A N LYS 469.A O no hydrogen 2.733 N/A TRP 474.A NE1 ASP 435.A OD2 no hydrogen 2.774 N/A MET 476.A N ASP 470.A O no hydrogen 3.315 N/A LYS 477.A NZ ASP 481.A OD2 no hydrogen 2.494 N/A GLY 479.A N MET 476.A O no hydrogen 3.057 N/A LEU 480.A N MET 476.A O no hydrogen 3.029 N/A ASP 481.A N LYS 477.A O no hydrogen 2.772 N/A LYS 482.A N GLY 479.A O no hydrogen 3.201 N/A LYS 482.A NZ GLY 12.A O no hydrogen 3.155 N/A LEU 483.A N LEU 480.A O no hydrogen 3.130 N/A LEU 484.A N LEU 480.A O no hydrogen 2.921 N/A THR 485.A N ASP 481.A O no hydrogen 2.944 N/A THR 485.A OG1 ASP 481.A O no hydrogen 3.027 N/A ALA 486.A N LYS 482.A O no hydrogen 3.135 N/A ARG 487.A N LEU 483.A O no hydrogen 3.089 N/A ARG 487.A NE HIS 109.A O no hydrogen 3.101 N/A ARG 487.A NE THR 110.A OG1 no hydrogen 2.912 N/A ARG 487.A NH1 HIS 109.A O no hydrogen 2.829 N/A ARG 487.A NH2 LEU 457.A O no hydrogen 2.974 N/A ARG 488.A N LEU 484.A O no hydrogen 2.879 N/A ARG 488.A NH2 ARG 488.A O no hydrogen 2.786 N/A TYR 489.A N THR 485.A O no hydrogen 3.182 N/A TYR 490.A N ALA 486.A O no hydrogen 2.960 N/A ALA 491.A N ALA 486.A O no hydrogen 3.052 N/A TYR 492.A N TYR 490.A O no hydrogen 2.884 N/A TYR 492.A OH ARG 488.A O no hydrogen 2.552 N/A TYR 496.A N VAL 509.A O no hydrogen 2.814 N/A ASN 500.A ND2 TRP 537.A O no hydrogen 3.312 N/A ASP 502.A N ILE 505.A O no hydrogen 3.010 N/A ASP 504.A N ASP 502.A OD1 no hydrogen 2.664 N/A ILE 505.A N ASP 502.A OD1 no hydrogen 2.861 N/A TYR 506.A N ILE 525.A O no hydrogen 3.111 N/A TYR 506.A OH GLU 497.A OE1 no hydrogen 3.392 N/A TYR 506.A OH GLU 497.A OE2 no hydrogen 2.511 N/A TYR 508.A N LEU 523.A O no hydrogen 3.059 N/A VAL 509.A N TYR 496.A O no hydrogen 2.999 N/A ARG 510.A N LEU 521.A O no hydrogen 2.919 N/A ARG 510.A NE GLY 493.A O no hydrogen 3.031 N/A ARG 510.A NH1 THR 458.A O no hydrogen 2.999 N/A ARG 510.A NH2 GLY 493.A O no hydrogen 2.827 N/A SER 511.A N PRO 494.A O no hydrogen 3.324 N/A SER 511.A OG GLY 512.A O no hydrogen 2.909 N/A GLY 512.A N TYR 492.A O no hydrogen 2.932 N/A PHE 513.A N ASP 519.A OD2 no hydrogen 2.735 N/A VAL 516.A N PHE 513.A O no hydrogen 3.422 N/A GLY 520.A N TYR 490.A O no hydrogen 2.698 N/A LEU 521.A N ARG 510.A O no hydrogen 2.801 N/A VAL 522.A N TRP 581.A O no hydrogen 2.986 N/A LEU 523.A N TYR 508.A O no hydrogen 2.935 N/A MET 524.A N SER 579.A O no hydrogen 3.149 N/A ILE 525.A N TYR 506.A O no hydrogen 2.967 N/A SER 526.A N GLY 577.A O no hydrogen 3.021 N/A SER 526.A OG ASP 504.A O no hydrogen 2.890 N/A ASP 527.A N ASP 504.A O no hydrogen 2.930 N/A GLY 528.A N SER 526.A OG no hydrogen 2.976 N/A SER 530.A OG ASN 532.A OD1 no hydrogen 2.411 N/A GLY 531.A N LYS 572.A O no hydrogen 2.825 N/A ALA 534.A N VAL 570.A O no hydrogen 2.776 N/A LYS 536.A N PHE 568.A O no hydrogen 3.049 N/A LYS 536.A NZ ASN 500.A O no hydrogen 2.804 N/A LYS 536.A NZ ASP 502.A OD2 no hydrogen 2.826 N/A ILE 538.A N GLY 566.A O no hydrogen 3.089 N/A SER 540.A N GLY 564.A O no hydrogen 2.911 N/A SER 540.A OG GLN 542.A O no hydrogen 3.357 N/A SER 540.A OG GLY 564.A O no hydrogen 2.645 N/A ARG 541.A N ASN 539.A OD1 no hydrogen 2.840 N/A ARG 541.A NH1 ASN 539.A O no hydrogen 3.362 N/A GLN 542.A N SER 540.A OG no hydrogen 3.211 N/A GLN 542.A NE2 ASP 519.A O no hydrogen 3.033 N/A ASP 544.A N ASP 561.A O no hydrogen 2.971 N/A THR 545.A N THR 560.A OG1 no hydrogen 2.937 N/A THR 545.A OG1 GLN 542.A O no hydrogen 3.362 N/A THR 545.A OG1 PRO 543.A O no hydrogen 2.832 N/A PHE 547.A N VAL 558.A O no hydrogen 2.577 N/A TYR 548.A N VAL 582.A O no hydrogen 2.852 N/A LEU 550.A N ILE 580.A O no hydrogen 3.032 N/A THR 551.A N ASP 549.A OD1 no hydrogen 2.916 N/A THR 551.A OG1 ASP 549.A OD1 no hydrogen 2.445 N/A THR 551.A OG1 ASP 549.A OD2 no hydrogen 2.984 N/A THR 551.A OG1 HIS 553.A ND1 no hydrogen 2.836 N/A GLY 552.A N ASP 549.A O no hydrogen 3.037 N/A HIS 553.A N THR 551.A OG1 no hydrogen 3.356 N/A HIS 553.A ND1 TRP 578.A O no hydrogen 2.754 N/A ILE 554.A N ASP 549.A OD2 no hydrogen 3.058 N/A LYS 555.A NZ GLY 552.A O no hydrogen 2.468 N/A LYS 555.A NZ HIS 553.A O no hydrogen 3.232 N/A HIS 557.A ND1 GLU 546.A OE2 no hydrogen 3.111 N/A VAL 558.A N PHE 547.A O no hydrogen 2.924 N/A THR 560.A N THR 545.A O no hydrogen 2.837 N/A THR 560.A OG1 GLN 542.A O no hydrogen 2.585 N/A ASP 561.A N TYR 565.A O no hydrogen 3.076 N/A GLU 563.A N ASP 561.A OD1 no hydrogen 2.907 N/A GLY 564.A N ASP 561.A O no hydrogen 2.953 N/A TYR 565.A N ASP 561.A OD1 no hydrogen 2.919 N/A GLY 566.A N ILE 538.A O no hydrogen 3.040 N/A PHE 568.A N LYS 536.A O no hydrogen 3.044 N/A LYS 569.A NZ ASN 567.A O no hydrogen 3.395 N/A LYS 569.A NZ ASN 567.A OD1 no hydrogen 3.352 N/A VAL 570.A N ALA 534.A O no hydrogen 2.855 N/A LYS 572.A N ASN 532.A O no hydrogen 2.678 N/A SER 573.A N ILE 571.A O no hydrogen 2.970 N/A LYS 576.A N SER 573.A OG no hydrogen 2.801 N/A TRP 578.A N LYS 576.A O no hydrogen 2.792 N/A SER 579.A N MET 524.A O no hydrogen 2.967 N/A SER 579.A OG ASP 549.A OD2 no hydrogen 2.794 N/A ILE 580.A N ASP 549.A OD1 no hydrogen 3.377 N/A TRP 581.A N VAL 522.A O no hydrogen 2.802 N/A TRP 581.A NE1 LYS 569.A O no hydrogen 3.070 N/A VAL 582.A N TYR 548.A O no hydrogen 2.891 N/A VAL 584.A N GLU 546.A O no hydrogen 3.066 N/A