Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4khw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N SER 22.A O no hydrogen 3.253 N/A PHE 4.A N ILE 20.A O no hydrogen 3.302 N/A TYR 5.A OH ILE 349.A O no hydrogen 2.645 N/A LEU 6.A N ARG 18.A O no hydrogen 2.640 N/A THR 7.A N ARG 18.A O no hydrogen 3.151 N/A THR 7.A OG1 GLY 263.A O no hydrogen 3.220 N/A GLU 9.A N PHE 16.A O no hydrogen 2.827 N/A GLN 10.A NE2 GLY 12.A O no hydrogen 3.543 N/A ILE 11.A N SER 14.A O no hydrogen 2.811 N/A SER 14.A N ILE 11.A O no hydrogen 2.996 N/A SER 14.A OG GLU 30.A OE2 no hydrogen 2.710 N/A ILE 15.A N VAL 31.A O no hydrogen 2.831 N/A PHE 16.A N GLU 9.A O no hydrogen 2.908 N/A GLU 17.A N ARG 29.A O no hydrogen 3.070 N/A ARG 18.A N THR 7.A O no hydrogen 2.991 N/A ARG 18.A NE GLU 26.A OE2 no hydrogen 3.401 N/A ARG 18.A NH1 PRO 210.A O no hydrogen 2.903 N/A ARG 18.A NH1 GLY 263.A O no hydrogen 2.721 N/A ARG 18.A NH2 GLU 26.A OE2 no hydrogen 3.048 N/A ARG 18.A NH2 THR 209.A O no hydrogen 2.889 N/A ARG 18.A NH2 PRO 210.A O no hydrogen 3.551 N/A TYR 19.A N ARG 27.A O no hydrogen 3.057 N/A ILE 20.A N PHE 4.A O no hydrogen 2.943 N/A ASP 21.A N ARG 25.A O no hydrogen 2.831 N/A ASN 23.A N ASP 21.A OD1 no hydrogen 2.964 N/A GLY 24.A N ASP 21.A O no hydrogen 2.868 N/A ARG 25.A N ASP 21.A OD1 no hydrogen 2.865 N/A ARG 27.A N TYR 19.A O no hydrogen 2.722 N/A ARG 27.A NH1 ASP 21.A OD2 no hydrogen 2.800 N/A ARG 29.A N GLU 17.A O no hydrogen 2.969 N/A ARG 29.A NE GLU 17.A OE2 no hydrogen 2.689 N/A ARG 29.A NH2 GLU 17.A OE2 no hydrogen 3.168 N/A VAL 31.A N ILE 15.A O no hydrogen 2.899 N/A TYR 33.A N VAL 31.A O no hydrogen 2.839 N/A TYR 33.A OH ASP 95.A OD1 no hydrogen 2.651 N/A LEU 37.A N LYS 60.A O no hydrogen 3.131 N/A PHE 38.A N LEU 83.A O no hydrogen 2.847 N/A ALA 39.A N THR 58.A O.A no hydrogen 3.221 N/A ALA 39.A N THR 58.A O.B no hydrogen 3.162 N/A HIS 40.A NE2 ASP 51.A OD2 no hydrogen 2.868 N/A CYS 41.A N PRO 56.A O no hydrogen 3.203 N/A CYS 41.A SG PRO 42.A O no hydrogen 3.484 N/A GLN 45.A N PRO 42.A O no hydrogen 3.237 N/A THR 47.A OG1 CYS 57.A O no hydrogen 2.918 N/A TYR 49.A N THR 47.A OG1 no hydrogen 3.066 N/A ASP 51.A N LYS 55.A O no hydrogen 2.858 N/A TYR 53.A N ASP 51.A OD1 no hydrogen 2.815 N/A GLY 54.A N ASP 51.A O no hydrogen 2.989 N/A LYS 55.A N ASP 51.A OD1 no hydrogen 2.867 N/A CYS 57.A N TYR 49.A O no hydrogen 2.955 N/A CYS 57.A SG LYS 55.A O no hydrogen 3.582 N/A THR 58.A N.A ALA 39.A O no hydrogen 2.826 N/A THR 58.A N.B ALA 39.A O no hydrogen 2.813 N/A THR 58.A OG1.A ALA 39.A O no hydrogen 3.565 N/A ARG 59.A NH1 SER 36.A OG no hydrogen 3.029 N/A LYS 60.A N LEU 37.A O no hydrogen 2.711 N/A PHE 62.A N PRO 35.A O no hydrogen 3.126 N/A ARG 66.A N ASP 13.A OD1 no hydrogen 3.340 N/A ASP 67.A N ASN 64.A OD1 no hydrogen 2.974 N/A ALA 68.A N ASN 64.A O no hydrogen 3.279 N/A SER 69.A N.A MET 65.A O no hydrogen 3.038 N/A SER 69.A N.B MET 65.A O no hydrogen 3.043 N/A SER 69.A OG.A MET 65.A O no hydrogen 3.084 N/A SER 69.A OG.B ARG 66.A O no hydrogen 2.896 N/A GLN 70.A N ARG 66.A O no hydrogen 3.148 N/A TRP 71.A N ASP 67.A O no hydrogen 3.158 N/A ILE 72.A N ALA 68.A O no hydrogen 3.270 N/A LYS 73.A N SER 69.A O.A no hydrogen 3.046 N/A LYS 73.A N SER 69.A O.B no hydrogen 3.064 N/A ARG 74.A N GLN 70.A O no hydrogen 3.072 N/A MET 75.A N TRP 71.A O no hydrogen 2.923 N/A GLU 76.A N ILE 72.A O no hydrogen 3.045 N/A ASP 77.A N LYS 73.A O no hydrogen 3.086 N/A ILE 78.A N ARG 74.A O no hydrogen 2.849 N/A GLY 79.A N MET 75.A O no hydrogen 2.968 N/A LEU 80.A N MET 75.A O no hydrogen 2.838 N/A ALA 82.A N GLN 378.A OE1 no hydrogen 3.054 N/A LEU 83.A N PHE 38.A O no hydrogen 2.875 N/A GLY 84.A N ILE 376.A O no hydrogen 2.999 N/A LYS 89.A NZ ASP 87.A OD1 no hydrogen 2.829 N/A LEU 90.A N ASP 87.A O no hydrogen 3.039 N/A ALA 91.A N ASP 87.A O no hydrogen 3.408 N/A TYR 92.A N PHE 88.A O no hydrogen 2.851 N/A TYR 92.A OH GLU 17.A OE2 no hydrogen 2.414 N/A LEU 93.A N LYS 89.A O no hydrogen 3.014 N/A SER 94.A N LEU 90.A O no hydrogen 2.930 N/A SER 94.A OG ASN 367.A OD1 no hydrogen 2.527 N/A ASP 95.A N ALA 91.A O no hydrogen 2.934 N/A THR 96.A N TYR 92.A O no hydrogen 2.827 N/A THR 96.A OG1 TYR 92.A O no hydrogen 2.702 N/A TYR 97.A N LEU 93.A O no hydrogen 2.947 N/A TYR 97.A OH GLU 17.A OE1 no hydrogen 2.502 N/A TYR 99.A N TYR 97.A O no hydrogen 2.820 N/A TYR 99.A OH GLU 3.A O no hydrogen 2.691 N/A TYR 103.A OH ASP 342.A OD1 no hydrogen 2.663 N/A THR 106.A N ASP 104.A OD1 no hydrogen 3.169 N/A THR 106.A OG1 ASP 104.A OD1 no hydrogen 2.654 N/A LYS 107.A N ASP 104.A O no hydrogen 2.954 N/A ILE 108.A N HIS 105.A O no hydrogen 3.015 N/A ARG 109.A NH1 ASP 140.A OD2 no hydrogen 2.702 N/A VAL 110.A N SER 141.A OG no hydrogen 2.776 N/A ALA 111.A N ILE 212.A O no hydrogen 2.760 N/A ASN 112.A N.A TYR 139.A O no hydrogen 3.002 N/A ASN 112.A N.B TYR 139.A O no hydrogen 3.012 N/A ASN 112.A ND2.B VAL 324.A O no hydrogen 2.474 N/A PHE 113.A N THR 214.A O no hydrogen 3.189 N/A ASP 114.A N THR 137.A O no hydrogen 3.109 N/A GLU 116.A N ALA 135.A O no hydrogen 2.767 N/A THR 118.A N ASP 134.A OD2 no hydrogen 3.151 N/A THR 118.A OG1 ASP 134.A OD2 no hydrogen 2.657 N/A THR 118.A OG1 TYR 316.A OH no hydrogen 3.365 N/A SER 119.A OG ASP 121.A OD1 no hydrogen 2.965 N/A SER 119.A OG GLY 122.A O no hydrogen 2.714 N/A SER 119.A OG HIS 131.A NE2 no hydrogen 2.991 N/A SER 127.A OG GLN 128.A OE1 no hydrogen 3.134 N/A SER 127.A OG SER 255.A O no hydrogen 3.272 N/A SER 127.A OG SER 255.A OG no hydrogen 3.290 N/A GLN 128.A N GLU 125.A O no hydrogen 2.996 N/A ALA 129.A N GLU 125.A O no hydrogen 2.817 N/A HIS 131.A N TYR 225.A OH no hydrogen 2.993 N/A HIS 131.A ND1 TYR 156.A OH no hydrogen 2.713 N/A ILE 133.A N GLU 194.A OE1 no hydrogen 3.029 N/A ASP 134.A N GLU 116.A O no hydrogen 3.072 N/A ILE 136.A N PHE 149.A O no hydrogen 2.842 N/A THR 137.A N ASP 114.A O no hydrogen 3.056 N/A THR 137.A OG1 ASN 320.A OD1 no hydrogen 2.569 N/A HIS 138.A N TYR 147.A O no hydrogen 2.777 N/A HIS 138.A ND1 TYR 201.A OH no hydrogen 2.759 N/A TYR 139.A N ASN 112.A O.A no hydrogen 2.649 N/A TYR 139.A N ASN 112.A O.B no hydrogen 2.789 N/A TYR 139.A OH ASP 144.A OD2 no hydrogen 2.631 N/A ASP 140.A N ARG 145.A O no hydrogen 3.069 N/A SER 141.A N VAL 110.A O no hydrogen 2.961 N/A SER 141.A OG ILE 108.A O no hydrogen 3.457 N/A SER 141.A OG VAL 110.A O no hydrogen 3.185 N/A ASP 143.A N ASP 140.A OD1 no hydrogen 2.765 N/A ARG 145.A N ASP 140.A O no hydrogen 3.389 N/A ARG 145.A NH1 ASP 144.A O no hydrogen 3.107 N/A PHE 146.A N LYS 185.A O no hydrogen 2.677 N/A TYR 147.A N HIS 138.A O no hydrogen 2.734 N/A TYR 147.A OH ASP 143.A OD2 no hydrogen 2.528 N/A VAL 148.A N ILE 187.A O no hydrogen 2.772 N/A PHE 149.A N ILE 136.A O no hydrogen 2.616 N/A ASP 150.A N MET 189.A O no hydrogen 2.916 N/A LEU 151.A N ASP 134.A O no hydrogen 3.037 N/A LEU 152.A N PHE 191.A O no hydrogen 2.952 N/A ASN 153.A ND2 ASP 192.A O no hydrogen 2.925 N/A SER 154.A N GLY 157.A O no hydrogen 3.261 N/A TYR 156.A N SER 154.A OG no hydrogen 3.069 N/A TYR 156.A OH HIS 131.A ND1 no hydrogen 2.713 N/A GLY 157.A N SER 154.A O no hydrogen 3.055 N/A ASN 158.A ND2 ASN 153.A OD1 no hydrogen 3.035 N/A VAL 159.A N LEU 152.A O no hydrogen 2.785 N/A TRP 162.A N TYR 188.A OH no hydrogen 2.767 N/A TRP 162.A NE1 SER 318.A OG no hydrogen 2.869 N/A SER 163.A N GLN 314.A OE1 no hydrogen 2.744 N/A SER 163.A OG GLU 165.A OE1 no hydrogen 3.240 N/A ILE 166.A N SER 163.A OG no hydrogen 3.030 N/A ALA 167.A N SER 163.A O no hydrogen 2.914 N/A ALA 168.A N ILE 164.A O no hydrogen 3.198 N/A LYS 169.A N GLU 165.A O no hydrogen 3.401 N/A LYS 169.A N ILE 166.A O no hydrogen 3.158 N/A LEU 170.A N GLN 173.A OE1 no hydrogen 3.171 N/A GLN 171.A N GLU 177.A OE2 no hydrogen 3.041 N/A GLU 172.A N GLU 172.A OE2 no hydrogen 2.810 N/A GLN 173.A N LEU 170.A O no hydrogen 2.799 N/A GLY 174.A N GLN 171.A O no hydrogen 3.084 N/A GLY 175.A N LEU 170.A O no hydrogen 2.748 N/A GLU 177.A N LYS 169.A O no hydrogen 2.925 N/A VAL 178.A N ALA 167.A O no hydrogen 3.045 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.787 N/A ILE 182.A N PRO 179.A O no hydrogen 3.048 N/A ILE 183.A N SER 180.A O no hydrogen 3.368 N/A LYS 185.A N ILE 182.A O no hydrogen 2.960 N/A LYS 185.A NZ ASP 144.A OD1 no hydrogen 2.978 N/A LYS 185.A NZ ASP 144.A OD2 no hydrogen 3.486 N/A ILE 186.A N ILE 183.A O no hydrogen 3.451 N/A ILE 187.A N PHE 146.A O no hydrogen 2.686 N/A TYR 188.A OH ASP 150.A OD2 no hydrogen 2.389 N/A MET 189.A N VAL 148.A O no hydrogen 2.739 N/A PHE 191.A N ASP 150.A O no hydrogen 2.744 N/A ASN 193.A ND2 GLU 196.A OE2 no hydrogen 3.277 N/A GLU 196.A N ASN 193.A OD1 no hydrogen 3.266 N/A LEU 197.A N ASN 193.A O no hydrogen 3.287 N/A LEU 198.A N GLU 194.A O no hydrogen 2.987 N/A MET 199.A N.A LYS 195.A O no hydrogen 3.061 N/A MET 199.A N.B LYS 195.A O no hydrogen 3.041 N/A GLU 200.A N GLU 196.A O no hydrogen 3.053 N/A TYR 201.A N LEU 197.A O no hydrogen 2.800 N/A TYR 201.A OH HIS 138.A ND1 no hydrogen 2.759 N/A LEU 202.A N LEU 198.A O no hydrogen 2.821 N/A ASN 203.A N MET 199.A O.A no hydrogen 2.996 N/A ASN 203.A N MET 199.A O.B no hydrogen 2.948 N/A ASN 203.A ND2 MET 199.A O.A no hydrogen 2.379 N/A ASN 203.A ND2 MET 199.A O.B no hydrogen 2.496 N/A PHE 204.A N GLU 200.A O no hydrogen 2.760 N/A TRP 205.A N TYR 201.A O no hydrogen 2.671 N/A TRP 205.A NE1 LEU 242.A O no hydrogen 2.933 N/A GLN 206.A N LEU 202.A O no hydrogen 2.948 N/A GLN 207.A N ASN 203.A O no hydrogen 3.130 N/A LYS 208.A N PHE 204.A O no hydrogen 2.980 N/A LYS 208.A NZ ASP 143.A OD2 no hydrogen 2.775 N/A THR 209.A OG1 TRP 205.A O no hydrogen 2.839 N/A THR 209.A OG1 GLN 206.A O no hydrogen 3.195 N/A VAL 211.A N ARG 109.A O no hydrogen 2.874 N/A ILE 212.A N ARG 109.A O no hydrogen 3.043 N/A LEU 213.A N SER 265.A O no hydrogen 3.075 N/A THR 214.A N ALA 111.A O no hydrogen 2.797 N/A THR 214.A OG1 LEU 267.A O no hydrogen 2.788 N/A GLY 215.A N THR 214.A OG1 no hydrogen 2.530 N/A TRP 216.A NE1 TYR 284.A O no hydrogen 2.770 N/A GLU 219.A N ASP 268.A OD2 no hydrogen 2.995 N/A SER 220.A OG ASN 217.A O no hydrogen 3.520 N/A SER 220.A OG ASN 217.A OD1 no hydrogen 2.957 N/A PHE 221.A N ASN 217.A O no hydrogen 2.747 N/A ILE 223.A N VAL 218.A O no hydrogen 2.682 N/A TYR 225.A N PHE 221.A O no hydrogen 2.800 N/A TYR 225.A OH HIS 131.A O no hydrogen 2.466 N/A VAL 226.A N ALA 222.A O no hydrogen 2.826 N/A TYR 227.A N ILE 223.A O no hydrogen 2.863 N/A TYR 227.A OH THR 248.A OG1 no hydrogen 2.604 N/A ASN 228.A N PRO 224.A O no hydrogen 2.888 N/A ASN 228.A ND2 PRO 126.A O no hydrogen 2.982 N/A ASN 228.A ND2 PRO 224.A O no hydrogen 3.164 N/A ASN 228.A ND2 GLU 257.A OE2 no hydrogen 2.870 N/A ARG 229.A N TYR 225.A O no hydrogen 2.798 N/A ARG 229.A NE GLU 194.A OE1 no hydrogen 2.525 N/A ARG 229.A NH1 ALA 129.A O no hydrogen 2.831 N/A ARG 229.A NH2 GLU 194.A OE2 no hydrogen 2.648 N/A ILE 230.A N VAL 226.A O no hydrogen 2.962 N/A LYS 231.A N TYR 227.A O no hydrogen 2.872 N/A ASN 232.A N ASN 228.A O no hydrogen 2.751 N/A ASN 232.A ND2 GLN 128.A O no hydrogen 2.867 N/A ILE 233.A N ARG 229.A O no hydrogen 2.940 N/A PHE 234.A N ILE 230.A O no hydrogen 2.835 N/A GLY 235.A N LYS 231.A O no hydrogen 2.930 N/A THR 238.A OG1 GLY 235.A O no hydrogen 3.088 N/A ALA 239.A N GLY 235.A O no hydrogen 3.342 N/A LYS 240.A N GLU 236.A O no hydrogen 3.059 N/A ARG 241.A N THR 238.A O no hydrogen 3.016 N/A ARG 241.A NE GLN 206.A OE1 no hydrogen 2.660 N/A LEU 242.A N ALA 239.A O no hydrogen 3.223 N/A SER 243.A N LYS 240.A O no hydrogen 2.951 N/A SER 243.A OG LYS 247.A O no hydrogen 2.989 N/A SER 243.A OG PHE 262.A O no hydrogen 2.547 N/A HIS 245.A N SER 243.A OG no hydrogen 3.265 N/A ARG 246.A N SER 243.A O no hydrogen 2.788 N/A ARG 246.A NH1 SER 243.A O no hydrogen 2.733 N/A LYS 247.A N SER 243.A OG no hydrogen 3.209 N/A THR 248.A OG1 TYR 227.A OH no hydrogen 2.604 N/A ARG 249.A N THR 260.A O no hydrogen 2.899 N/A LYS 251.A N ILE 258.A O no hydrogen 3.211 N/A ILE 253.A N ARG 256.A O no hydrogen 2.760 N/A SER 255.A OG SER 127.A OG no hydrogen 3.290 N/A ILE 258.A N LYS 251.A O no hydrogen 2.938 N/A THR 260.A N ARG 249.A O no hydrogen 2.762 N/A PHE 262.A N LYS 247.A O no hydrogen 3.169 N/A GLY 263.A N GLU 9.A OE2 no hydrogen 2.848 N/A ILE 264.A N LEU 261.A O no hydrogen 3.154 N/A SER 265.A N VAL 211.A O no hydrogen 2.974 N/A SER 265.A OG GLN 352.A OE1 no hydrogen 2.612 N/A LEU 267.A N LEU 213.A O no hydrogen 2.877 N/A TYR 269.A N GLY 215.A O no hydrogen 2.840 N/A TYR 269.A OH ASP 331.A OD1 no hydrogen 2.608 N/A ILE 270.A N ASP 268.A OD1 no hydrogen 3.293 N/A ASP 271.A N ASP 268.A O no hydrogen 3.070 N/A LEU 272.A N ASP 268.A O no hydrogen 3.110 N/A TYR 273.A N TYR 269.A O no hydrogen 2.757 N/A TYR 273.A OH GLU 293.A OE2 no hydrogen 2.575 N/A LYS 274.A N ILE 270.A O no hydrogen 2.962 N/A LYS 275.A N ASP 271.A O no hydrogen 3.114 N/A LYS 275.A NZ PHE 355.A O no hydrogen 3.321 N/A PHE 276.A N LEU 272.A O no hydrogen 2.913 N/A SER 277.A N TYR 273.A O no hydrogen 2.940 N/A SER 277.A OG TYR 273.A O no hydrogen 2.635 N/A SER 277.A OG THR 279.A OG1 no hydrogen 2.861 N/A THR 279.A OG1 SER 277.A OG no hydrogen 2.861 N/A GLN 281.A N TYR 284.A OH no hydrogen 2.987 N/A GLN 281.A NE2 TYR 273.A OH no hydrogen 2.884 N/A SER 285.A N SER 283.A OG no hydrogen 3.288 N/A TYR 288.A N SER 285.A OG no hydrogen 3.027 N/A ILE 289.A N SER 285.A O no hydrogen 3.036 N/A SER 290.A N LEU 286.A O no hydrogen 2.896 N/A SER 290.A OG LEU 286.A O no hydrogen 2.769 N/A GLU 291.A N ASP 287.A O no hydrogen 3.091 N/A PHE 292.A N TYR 288.A O no hydrogen 3.053 N/A GLU 293.A N ILE 289.A O no hydrogen 2.682 N/A LEU 294.A N SER 290.A O no hydrogen 2.738 N/A ASN 295.A N.A GLU 291.A O no hydrogen 3.025 N/A ASN 295.A N.B GLU 291.A O no hydrogen 3.038 N/A LEU 299.A N ASP 287.A OD2 no hydrogen 3.488 N/A LYS 307.A N PRO 304.A O no hydrogen 2.953 N/A LEU 308.A N ILE 305.A O no hydrogen 3.224 N/A ARG 309.A NH1 GLY 157.A O no hydrogen 2.826 N/A ARG 309.A NH2 LEU 151.A O no hydrogen 2.467 N/A ARG 309.A NH2 GLY 157.A O no hydrogen 3.291 N/A SER 311.A N LYS 307.A O no hydrogen 2.925 N/A SER 311.A OG LYS 307.A O no hydrogen 2.795 N/A SER 311.A OG LEU 308.A O no hydrogen 3.440 N/A ASN 312.A N LEU 308.A O no hydrogen 2.793 N/A HIS 313.A NE2 ASP 150.A OD1 no hydrogen 2.762 N/A GLN 314.A NE2 SER 163.A O no hydrogen 2.857 N/A GLN 314.A NE2 ASP 176.A OD2 no hydrogen 3.172 N/A ARG 315.A N ASN 312.A OD1 no hydrogen 3.198 N/A ARG 315.A NE ASP 176.A OD1 no hydrogen 3.036 N/A ARG 315.A NH2 GLY 175.A O no hydrogen 2.634 N/A ARG 315.A NH2 ASP 176.A OD1 no hydrogen 3.314 N/A TYR 316.A N ASN 312.A O no hydrogen 2.949 N/A TYR 316.A OH ASP 134.A OD1 no hydrogen 2.517 N/A TYR 316.A OH ASP 134.A OD2 no hydrogen 3.233 N/A ILE 317.A N HIS 313.A O no hydrogen 3.019 N/A SER 318.A N GLN 314.A O no hydrogen 3.143 N/A SER 318.A OG ASP 176.A OD2 no hydrogen 2.825 N/A SER 318.A OG GLN 314.A O no hydrogen 3.290 N/A TYR 319.A N ARG 315.A O no hydrogen 2.698 N/A TYR 319.A OH LYS 300.A O no hydrogen 2.589 N/A ASN 320.A N TYR 316.A O no hydrogen 3.122 N/A ASN 320.A ND2 ASP 114.A O no hydrogen 3.341 N/A ASN 320.A ND2 GLU 116.A OE2 no hydrogen 3.037 N/A ILE 321.A N ILE 317.A O no hydrogen 3.012 N/A ILE 322.A N SER 318.A O no hydrogen 2.947 N/A ALA 323.A N TYR 319.A O no hydrogen 2.894 N/A VAL 324.A N ASN 320.A O no hydrogen 3.395 N/A TYR 325.A N ILE 321.A O no hydrogen 3.071 N/A TYR 325.A OH GLU 181.A OE2 no hydrogen 2.690 N/A ARG 326.A N.A ILE 322.A O no hydrogen 2.650 N/A ARG 326.A N.B ILE 322.A O no hydrogen 2.640 N/A ARG 326.A NH1.A ASP 287.A OD2 no hydrogen 3.507 N/A ARG 326.A NH1.B GLN 329.A OE1 no hydrogen 2.831 N/A ARG 326.A NH2.A GLY 297.A O no hydrogen 2.715 N/A LEU 328.A N VAL 324.A O no hydrogen 3.345 N/A GLN 329.A N TYR 325.A O no hydrogen 2.861 N/A ILE 330.A N ARG 326.A O.A no hydrogen 2.857 N/A ILE 330.A N ARG 326.A O.B no hydrogen 2.811 N/A ASP 331.A N VAL 327.A O no hydrogen 2.780 N/A ALA 332.A N LEU 328.A O no hydrogen 2.764 N/A LYS 333.A N GLN 329.A O no hydrogen 3.084 N/A LYS 333.A NZ GLU 293.A O no hydrogen 2.737 N/A LYS 333.A NZ GLU 293.A OE1 no hydrogen 2.961 N/A ARG 334.A N ILE 330.A O no hydrogen 2.721 N/A ARG 334.A NE GLU 293.A OE1 no hydrogen 2.795 N/A ARG 334.A NE GLU 293.A OE2 no hydrogen 3.425 N/A ARG 334.A NH1 SER 277.A O no hydrogen 3.323 N/A ARG 334.A NH2 GLU 293.A OE1 no hydrogen 3.538 N/A ARG 334.A NH2 GLU 293.A OE2 no hydrogen 2.863 N/A GLN 335.A N ASP 331.A O no hydrogen 2.611 N/A GLN 335.A NE2 ALA 332.A O no hydrogen 3.426 N/A PHE 336.A N TYR 269.A OH no hydrogen 3.417 N/A ILE 337.A N ASP 331.A OD1 no hydrogen 3.130 N/A LEU 339.A N GLN 335.A O no hydrogen 3.198 N/A SER 340.A N PHE 336.A O no hydrogen 2.845 N/A SER 340.A OG PHE 336.A O no hydrogen 2.907 N/A LEU 341.A N ILE 337.A O no hydrogen 2.922 N/A ASP 342.A N ASN 338.A O no hydrogen 2.917 N/A MET 343.A N LEU 339.A O no hydrogen 2.946 N/A GLY 344.A N SER 340.A O no hydrogen 2.859 N/A TYR 345.A N LEU 341.A O no hydrogen 2.925 N/A TYR 345.A OH TYR 5.A O no hydrogen 2.534 N/A TYR 346.A N ASP 342.A O no hydrogen 2.906 N/A ALA 347.A N MET 343.A O no hydrogen 2.939 N/A LYS 348.A NZ TYR 97.A O no hydrogen 3.011 N/A LYS 348.A NZ TYR 99.A O no hydrogen 3.108 N/A ILE 349.A N GLY 344.A O no hydrogen 3.216 N/A GLN 350.A NE2 VAL 8.A O no hydrogen 2.810 N/A GLN 352.A N GLN 352.A OE1 no hydrogen 2.814 N/A SER 353.A N GLN 350.A O no hydrogen 2.836 N/A VAL 354.A N ILE 351.A O no hydrogen 3.173 N/A PHE 355.A N GLN 352.A O no hydrogen 3.479 N/A SER 356.A N SER 353.A O no hydrogen 2.860 N/A LYS 359.A N SER 356.A OG no hydrogen 3.025 N/A LYS 359.A NZ ASP 87.A OD2 no hydrogen 2.634 N/A THR 360.A N SER 356.A O no hydrogen 2.778 N/A THR 360.A OG1 SER 353.A O no hydrogen 3.202 N/A THR 360.A OG1 SER 356.A O no hydrogen 2.752 N/A TRP 361.A N PRO 357.A O no hydrogen 2.700 N/A TRP 361.A NE1 LEU 558.A O no hydrogen 2.691 N/A ASP 362.A N ILE 358.A O no hydrogen 2.770 N/A ALA 363.A N LYS 359.A O no hydrogen 3.170 N/A ILE 364.A N THR 360.A O no hydrogen 3.148 N/A ILE 365.A N TRP 361.A O no hydrogen 2.848 N/A PHE 366.A N ASP 362.A O no hydrogen 2.934 N/A ASN 367.A N ALA 363.A O no hydrogen 2.855 N/A ASN 367.A ND2 ALA 363.A O no hydrogen 2.690 N/A SER 368.A N ILE 364.A O no hydrogen 2.969 N/A SER 368.A OG GLU 470.A OE1 no hydrogen 2.613 N/A LEU 369.A N ILE 365.A O no hydrogen 2.895 N/A LYS 370.A N PHE 366.A O no hydrogen 2.822 N/A LYS 370.A NZ SER 94.A O no hydrogen 3.253 N/A LYS 370.A NZ SER 94.A OG no hydrogen 3.114 N/A GLU 371.A N ASN 367.A O no hydrogen 3.177 N/A GLN 372.A N LEU 369.A O no hydrogen 3.054 N/A ASN 373.A N LYS 370.A O no hydrogen 3.131 N/A LYS 374.A N LEU 369.A O no hydrogen 2.908 N/A VAL 375.A N PHE 50.A O no hydrogen 2.704 N/A GLN 378.A N GLU 81.A OE2 no hydrogen 3.121 N/A TYR 387.A OH TYR 563.A OH no hydrogen 3.174 N/A LYS 393.A N GLY 616.A O no hydrogen 2.791 N/A LYS 393.A NZ GLU 594.A OE2 no hydrogen 3.102 N/A ASN 398.A N TRP 698.A O no hydrogen 3.240 N/A ARG 399.A NE ALA 883.A O no hydrogen 2.827 N/A ARG 399.A NH2 ALA 883.A O no hydrogen 3.027 N/A ARG 399.A NH2 LYS 884.A O no hydrogen 2.855 N/A TYR 400.A N GLY 696.A O no hydrogen 2.698 N/A TYR 400.A OH ILE 396.A O no hydrogen 2.538 N/A TYR 402.A N ASP 626.A OD1 no hydrogen 2.795 N/A TYR 402.A OH GLU 634.A OE1 no hydrogen 3.290 N/A VAL 403.A N ALA 685.A O no hydrogen 3.049 N/A MET 404.A N VAL 623.A O no hydrogen 2.890 N/A SER 405.A N ALA 683.A O no hydrogen 2.963 N/A PHE 406.A N ILE 621.A O no hydrogen 2.916 N/A ASP 407.A N ASP 680.A O no hydrogen 3.043 N/A LEU 408.A N ASP 619.A O no hydrogen 3.190 N/A THR 409.A N PHE 678.A O no hydrogen 2.857 N/A THR 409.A OG1 PHE 678.A O no hydrogen 3.370 N/A SER 414.A N SER 410.A O no hydrogen 2.818 N/A SER 414.A OG THR 409.A O no hydrogen 2.775 N/A SER 414.A OG SER 410.A O no hydrogen 2.711 N/A ILE 415.A N PHE 411.A O no hydrogen 2.827 N/A ILE 416.A N TYR 412.A O no hydrogen 2.949 N/A ARG 417.A N PRO 413.A O no hydrogen 2.967 N/A GLN 418.A N SER 414.A O no hydrogen 2.799 N/A GLN 418.A NE2 ASN 672.A OD1 no hydrogen 2.750 N/A VAL 419.A N ILE 415.A O no hydrogen 2.943 N/A ASN 420.A ND2 TYR 460.A O no hydrogen 2.948 N/A ASN 420.A ND2 ARG 463.A O no hydrogen 2.865 N/A ILE 421.A N ILE 416.A O no hydrogen 2.933 N/A SER 422.A OG GLU 424.A OE1 no hydrogen 2.586 N/A SER 422.A OG GLU 424.A OE2 no hydrogen 3.495 N/A GLU 424.A N GLU 424.A OE1 no hydrogen 2.470 N/A THR 425.A N SER 422.A O no hydrogen 3.333 N/A THR 425.A OG1 ASN 420.A O no hydrogen 2.698 N/A THR 425.A OG1 SER 422.A O no hydrogen 3.264 N/A ALA 427.A N MET 458.A O no hydrogen 2.653 N/A GLY 428.A N MET 458.A O no hydrogen 3.280 N/A THR 429.A OG1 PHE 430.A O no hydrogen 3.561 N/A THR 429.A OG1 GLY 456.A O no hydrogen 2.918 N/A PHE 430.A N GLY 456.A O no hydrogen 2.916 N/A ALA 433.A N TYR 438.A OH no hydrogen 3.041 N/A ASP 437.A N PRO 434.A O no hydrogen 2.940 N/A ILE 439.A N LEU 435.A O no hydrogen 3.058 N/A ASN 440.A N HIS 436.A O no hydrogen 2.889 N/A ALA 441.A N TYR 438.A O no hydrogen 3.167 N/A VAL 442.A N ASP 437.A O no hydrogen 2.686 N/A ALA 443.A N ASP 437.A O no hydrogen 3.027 N/A ARG 445.A NE GLU 668.A O no hydrogen 2.970 N/A ARG 445.A NH2 GLU 668.A O no hydrogen 2.807 N/A VAL 449.A N SER 447.A OG no hydrogen 2.903 N/A TYR 450.A N SER 447.A OG no hydrogen 2.743 N/A SER 451.A N TYR 459.A O no hydrogen 2.733 N/A SER 451.A OG VAL 419.A O no hydrogen 2.835 N/A CYS 452.A N MET 670.A O no hydrogen 2.949 N/A CYS 452.A SG TYR 450.A O no hydrogen 3.567 N/A SER 453.A N MET 457.A O no hydrogen 3.217 N/A SER 453.A OG ASN 455.A OD1 no hydrogen 3.139 N/A SER 453.A OG ALA 581.A O no hydrogen 2.599 N/A ASN 455.A ND2 ARG 577.A O no hydrogen 3.016 N/A GLY 456.A N SER 453.A O no hydrogen 3.058 N/A MET 457.A N ASN 455.A OD1 no hydrogen 3.075 N/A MET 458.A N GLY 428.A O no hydrogen 2.924 N/A TYR 459.A N SER 451.A O no hydrogen 2.628 N/A TYR 459.A OH ASN 578.A OD1 no hydrogen 2.768 N/A TYR 460.A N THR 425.A O no hydrogen 2.906 N/A LYS 461.A NZ ASN 671.A OD1 no hydrogen 2.588 N/A VAL 466.A N GLU 424.A OE2 no hydrogen 2.796 N/A VAL 467.A N SER 422.A OG no hydrogen 3.179 N/A THR 469.A N GLY 465.A O no hydrogen 2.757 N/A THR 469.A OG1 GLY 465.A O no hydrogen 2.822 N/A GLU 470.A N VAL 466.A O no hydrogen 3.032 N/A ILE 471.A N VAL 467.A O no hydrogen 2.976 N/A THR 472.A N PRO 468.A O no hydrogen 2.992 N/A THR 472.A OG1 PRO 468.A O no hydrogen 2.461 N/A LYS 473.A N THR 469.A O no hydrogen 3.343 N/A LYS 473.A NZ GLU 470.A OE1 no hydrogen 2.888 N/A VAL 474.A N GLU 470.A O no hydrogen 3.412 N/A PHE 475.A N ILE 471.A O no hydrogen 3.045 N/A ASN 476.A N THR 472.A O no hydrogen 3.018 N/A GLN 477.A N LYS 473.A O no hydrogen 3.427 N/A ARG 478.A N VAL 474.A O no hydrogen 2.981 N/A ARG 478.A NE GLN 552.A OE1 no hydrogen 2.797 N/A ARG 478.A NH2 GLN 552.A OE1 no hydrogen 2.879 N/A LYS 479.A N PHE 475.A O no hydrogen 2.815 N/A GLU 480.A N ASN 476.A O no hydrogen 3.043 N/A HIS 481.A N GLN 477.A O no hydrogen 3.178 N/A LYS 482.A N ARG 478.A O no hydrogen 2.970 N/A LYS 482.A NZ GLU 712.A OE1 no hydrogen 2.955 N/A GLY 483.A N LYS 479.A O no hydrogen 3.110 N/A TYR 484.A N GLU 480.A O no hydrogen 3.265 N/A TYR 484.A OH GLU 480.A OE1 no hydrogen 2.873 N/A MET 485.A N HIS 481.A O no hydrogen 2.952 N/A LEU 486.A N LYS 482.A O no hydrogen 2.838 N/A ALA 487.A N GLY 483.A O no hydrogen 3.015 N/A ALA 488.A N TYR 484.A O no hydrogen 2.970 N/A GLN 489.A N MET 485.A O no hydrogen 2.808 N/A GLN 489.A NE2 GLU 545.A OE2 no hydrogen 3.231 N/A ARG 490.A N LEU 486.A O no hydrogen 2.741 N/A ARG 490.A NE ASP 517.A OD1 no hydrogen 2.763 N/A ARG 490.A NH2 ASP 517.A OD1 no hydrogen 3.485 N/A ARG 490.A NH2 ASP 517.A OD2 no hydrogen 3.074 N/A ASN 491.A N ALA 487.A O no hydrogen 2.779 N/A ASN 491.A ND2 TYR 514.A O no hydrogen 2.991 N/A ASN 491.A ND2 PHE 516.A O no hydrogen 2.797 N/A GLY 492.A N ALA 488.A O no hydrogen 2.835 N/A GLU 493.A N GLN 489.A O no hydrogen 3.258 N/A ILE 494.A N ARG 490.A O no hydrogen 3.295 N/A ILE 495.A N ASN 491.A O no hydrogen 3.182 N/A LYS 496.A N GLY 492.A O no hydrogen 2.943 N/A LYS 496.A NZ GLU 493.A OE2 no hydrogen 3.388 N/A GLU 497.A N GLU 493.A O no hydrogen 2.786 N/A ALA 498.A N ILE 494.A O no hydrogen 3.011 N/A LEU 499.A N ILE 495.A O no hydrogen 2.949 N/A HIS 500.A N GLU 497.A O no hydrogen 3.016 N/A ASN 501.A N ALA 498.A O no hydrogen 3.223 N/A ASN 503.A N LEU 529.A O no hydrogen 3.147 N/A SER 505.A OG ASP 507.A OD2 no hydrogen 3.391 N/A ARG 515.A N ASP 513.A OD2 no hydrogen 3.158 N/A ARG 515.A NE ASP 513.A OD2 no hydrogen 3.037 N/A ARG 515.A NH2 ASP 513.A OD1 no hydrogen 2.941 N/A PHE 516.A N ASP 513.A O no hydrogen 3.170 N/A PHE 518.A N ASN 491.A OD1 no hydrogen 2.975 N/A GLU 521.A N GLU 521.A OE2 no hydrogen 2.783 N/A ILE 522.A N SER 519.A OG no hydrogen 3.370 N/A LYS 523.A N SER 519.A O no hydrogen 2.834 N/A GLU 524.A N ASP 520.A O no hydrogen 2.995 N/A LYS 525.A N GLU 521.A O no hydrogen 2.992 N/A ILE 526.A N ILE 522.A O no hydrogen 2.899 N/A LYS 527.A N LYS 523.A O no hydrogen 3.419 N/A LYS 528.A N LYS 525.A O no hydrogen 2.950 N/A LEU 529.A N ILE 526.A O no hydrogen 3.115 N/A SER 530.A N ASP 507.A OD1 no hydrogen 3.335 N/A SER 530.A N ASP 507.A OD2 no hydrogen 3.073 N/A SER 530.A OG ASP 507.A OD1 no hydrogen 2.630 N/A SER 533.A N SER 530.A OG no hydrogen 3.263 N/A SER 533.A OG ASP 507.A OD1 no hydrogen 2.603 N/A LEU 534.A N SER 530.A O no hydrogen 3.117 N/A ASN 535.A N ALA 531.A O no hydrogen 2.729 N/A GLU 536.A N LYS 532.A O no hydrogen 3.073 N/A MET 537.A N SER 533.A O no hydrogen 2.991 N/A LEU 538.A N LEU 534.A O no hydrogen 2.732 N/A PHE 539.A N ASN 535.A O no hydrogen 3.037 N/A ARG 540.A N GLU 536.A O no hydrogen 3.013 N/A ARG 540.A NE GLU 536.A OE1 no hydrogen 3.016 N/A ARG 540.A NH2 GLU 536.A OE1 no hydrogen 3.548 N/A ALA 541.A N MET 537.A O no hydrogen 2.785 N/A GLN 542.A N LEU 538.A O no hydrogen 2.963 N/A ARG 543.A N PHE 539.A O no hydrogen 2.862 N/A THR 544.A N ARG 540.A O no hydrogen 2.907 N/A THR 544.A OG1 ARG 540.A O no hydrogen 2.700 N/A GLU 545.A N ALA 541.A O no hydrogen 2.868 N/A VAL 546.A N GLN 542.A O no hydrogen 2.944 N/A ALA 547.A N ARG 543.A O no hydrogen 3.031 N/A GLY 548.A N THR 544.A O no hydrogen 2.933 N/A MET 549.A N GLU 545.A O no hydrogen 2.710 N/A THR 550.A N VAL 546.A O no hydrogen 2.877 N/A THR 550.A OG1 ARG 334.A O no hydrogen 2.653 N/A THR 550.A OG1 VAL 546.A O no hydrogen 3.303 N/A ALA 551.A N ALA 547.A O no hydrogen 3.264 N/A GLN 552.A N GLY 548.A O no hydrogen 2.931 N/A ILE 553.A N MET 549.A O no hydrogen 2.844 N/A ASN 554.A N THR 550.A O no hydrogen 3.288 N/A ASN 554.A ND2 PHE 276.A O no hydrogen 3.370 N/A ASN 554.A ND2 THR 550.A O no hydrogen 2.885 N/A ARG 555.A NE GLN 477.A OE1 no hydrogen 3.112 N/A ARG 555.A NH1 ALA 551.A O no hydrogen 2.949 N/A ARG 555.A NH2 ASP 342.A OD2 no hydrogen 3.281 N/A LYS 556.A N GLN 552.A O no hydrogen 2.915 N/A LEU 557.A N ILE 553.A O no hydrogen 2.951 N/A LEU 558.A N ASN 554.A O no hydrogen 3.009 N/A ILE 559.A N ARG 555.A O no hydrogen 3.071 N/A ASN 560.A N LYS 556.A O no hydrogen 2.990 N/A SER 561.A N LEU 557.A O no hydrogen 2.918 N/A SER 561.A OG LEU 557.A O no hydrogen 2.603 N/A LEU 562.A N LEU 558.A O no hydrogen 3.059 N/A LEU 562.A N ILE 559.A O no hydrogen 3.172 N/A TYR 563.A N ILE 559.A O no hydrogen 3.393 N/A GLY 564.A N ASN 560.A O no hydrogen 3.045 N/A ALA 565.A N SER 561.A O no hydrogen 2.655 N/A LEU 566.A N LEU 562.A O no hydrogen 3.329 N/A LEU 566.A N TYR 563.A O no hydrogen 3.006 N/A GLY 567.A N GLY 564.A O no hydrogen 2.823 N/A ASN 568.A N ALA 565.A O no hydrogen 2.792 N/A TRP 570.A N ASN 568.A OD1 no hydrogen 2.814 N/A PHE 571.A N ASN 568.A O no hydrogen 2.974 N/A ARG 572.A NE ASP 362.A OD1 no hydrogen 2.562 N/A ARG 572.A NH1 ASP 86.A OD2 no hydrogen 3.350 N/A ARG 572.A NH1 PRO 377.A O no hydrogen 3.005 N/A ARG 572.A NH2 ASP 86.A OD2 no hydrogen 3.219 N/A ARG 572.A NH2 ASP 362.A OD1 no hydrogen 3.371 N/A ARG 572.A NH2 ASP 362.A OD2 no hydrogen 2.764 N/A TYR 574.A N PHE 571.A O no hydrogen 3.081 N/A ASP 575.A N LEU 566.A O no hydrogen 2.995 N/A ARG 577.A N ASP 575.A OD2 no hydrogen 3.055 N/A ARG 577.A NE ASP 575.A OD1 no hydrogen 3.295 N/A ARG 577.A NE ASP 575.A OD2 no hydrogen 2.891 N/A ARG 577.A NH2 ASP 575.A OD1 no hydrogen 2.648 N/A ASN 578.A N ASP 575.A O no hydrogen 3.080 N/A ALA 579.A N ASP 575.A O no hydrogen 3.058 N/A THR 580.A N LEU 576.A O.A no hydrogen 2.834 N/A THR 580.A N LEU 576.A O.B no hydrogen 2.836 N/A THR 580.A OG1 LEU 576.A O.A no hydrogen 3.049 N/A THR 580.A OG1 LEU 576.A O.B no hydrogen 3.049 N/A ALA 581.A N ARG 577.A O no hydrogen 3.079 N/A ILE 582.A N ASN 578.A O no hydrogen 3.026 N/A THR 583.A N ALA 579.A O no hydrogen 3.118 N/A THR 583.A OG1 PRO 388.A O no hydrogen 2.849 N/A THR 583.A OG1 ALA 579.A O no hydrogen 3.566 N/A THR 583.A OG1 THR 580.A O no hydrogen 3.158 N/A THR 584.A N THR 580.A O no hydrogen 2.739 N/A THR 584.A OG1 THR 580.A O no hydrogen 2.513 N/A PHE 585.A N ALA 581.A O no hydrogen 3.062 N/A GLY 586.A N ILE 582.A O no hydrogen 2.871 N/A GLN 587.A N THR 583.A O no hydrogen 2.719 N/A GLN 587.A NE2 GLY 389.A O no hydrogen 2.831 N/A MET 588.A N THR 584.A O no hydrogen 2.901 N/A ALA 589.A N PHE 585.A O no hydrogen 2.729 N/A LEU 590.A N GLY 586.A O no hydrogen 3.013 N/A GLN 591.A N GLN 587.A O no hydrogen 3.224 N/A GLN 591.A NE2 GLN 587.A O no hydrogen 2.950 N/A TRP 592.A N MET 588.A O no hydrogen 2.661 N/A TRP 592.A NE1 GLY 662.A O no hydrogen 2.720 N/A ILE 593.A N ALA 589.A O no hydrogen 3.075 N/A GLU 594.A N LEU 590.A O no hydrogen 2.947 N/A ARG 595.A N GLN 591.A O no hydrogen 3.289 N/A ARG 595.A NE ILE 439.A O no hydrogen 3.081 N/A ARG 595.A NH1 GLU 599.A OE2 no hydrogen 2.899 N/A ARG 595.A NH2 ILE 439.A O no hydrogen 3.116 N/A LYS 596.A N TRP 592.A O no hydrogen 2.988 N/A LYS 596.A NZ GLU 665.A OE1 no hydrogen 2.742 N/A LYS 596.A NZ GLU 665.A OE2 no hydrogen 3.557 N/A VAL 597.A N ILE 593.A O no hydrogen 2.844 N/A ASN 598.A N GLU 594.A O no hydrogen 3.000 N/A GLU 599.A N ARG 595.A O no hydrogen 2.868 N/A TYR 600.A N LYS 596.A O no hydrogen 2.964 N/A LEU 601.A N VAL 597.A O no hydrogen 3.048 N/A ASN 602.A N ASN 598.A O no hydrogen 3.092 N/A ASN 602.A ND2 ASN 598.A O no hydrogen 2.530 N/A ASN 602.A ND2 GLU 610.A O no hydrogen 3.049 N/A GLU 603.A N GLU 599.A O no hydrogen 3.075 N/A VAL 604.A N TYR 600.A O no hydrogen 2.874 N/A CYS 605.A N LEU 601.A O no hydrogen 2.958 N/A GLY 606.A N ASN 602.A O no hydrogen 2.939 N/A GLU 610.A N ASN 602.A OD1 no hydrogen 2.918 N/A PHE 612.A N ASN 598.A OD1 no hydrogen 2.854 N/A VAL 613.A N ASN 598.A OD1 no hydrogen 3.138 N/A LEU 614.A N TYR 622.A O no hydrogen 2.832 N/A ASP 617.A N SER 620.A OG no hydrogen 3.254 N/A THR 618.A N PHE 391.A O no hydrogen 2.850 N/A THR 618.A OG1 ASP 617.A OD1 no hydrogen 2.777 N/A ASP 619.A N ASP 617.A O no hydrogen 2.584 N/A SER 620.A N ASP 617.A O no hydrogen 3.177 N/A SER 620.A OG ASP 617.A O no hydrogen 3.410 N/A ILE 621.A N PHE 406.A O no hydrogen 2.910 N/A TYR 622.A N TYR 615.A O no hydrogen 2.859 N/A VAL 623.A N MET 404.A O no hydrogen 2.615 N/A SER 624.A N PHE 612.A O no hydrogen 2.640 N/A ALA 625.A N TYR 402.A O no hydrogen 2.805 N/A ILE 629.A N ALA 625.A O no hydrogen 3.045 N/A ASP 630.A N ASP 626.A O no hydrogen 2.943 N/A LYS 631.A N LYS 627.A O no hydrogen 3.046 N/A VAL 632.A N ILE 629.A O no hydrogen 3.168 N/A GLY 633.A N ILE 629.A O no hydrogen 2.755 N/A LYS 636.A N GLY 633.A O no hydrogen 3.410 N/A PHE 637.A N GLU 634.A O no hydrogen 3.311 N/A ARG 638.A N HIS 642.A ND1 no hydrogen 2.899 N/A HIS 642.A N ASP 639.A O no hydrogen 3.045 N/A VAL 644.A N THR 640.A O no hydrogen 3.255 N/A ASP 645.A N ASN 641.A O no hydrogen 3.120 N/A PHE 646.A N HIS 642.A O no hydrogen 2.985 N/A LEU 647.A N TRP 643.A O no hydrogen 2.878 N/A ASP 648.A N VAL 644.A O no hydrogen 2.895 N/A LYS 649.A N ASP 645.A O no hydrogen 2.863 N/A PHE 650.A N PHE 646.A O no hydrogen 2.794 N/A ALA 651.A N LEU 647.A O no hydrogen 2.788 N/A ARG 652.A N ASP 648.A O no hydrogen 3.147 N/A ARG 652.A NH1 ASP 648.A OD2 no hydrogen 3.012 N/A GLU 653.A N LYS 649.A O no hydrogen 2.754 N/A ARG 654.A N PHE 650.A O no hydrogen 2.901 N/A MET 655.A N PHE 650.A O no hydrogen 3.207 N/A GLU 656.A N ALA 651.A O no hydrogen 2.854 N/A ALA 658.A N ARG 654.A O no hydrogen 3.419 N/A ILE 659.A N MET 655.A O no hydrogen 2.844 N/A ASP 660.A N GLU 656.A O no hydrogen 2.710 N/A ARG 661.A N PRO 657.A O no hydrogen 2.909 N/A GLY 662.A N ALA 658.A O no hydrogen 2.841 N/A PHE 663.A N ILE 659.A O no hydrogen 2.883 N/A ARG 664.A N ASP 660.A O no hydrogen 2.849 N/A GLU 665.A N ARG 661.A O no hydrogen 2.961 N/A MET 666.A N GLY 662.A O no hydrogen 3.245 N/A CYS 667.A N PHE 663.A O no hydrogen 2.787 N/A GLU 668.A N ARG 664.A O no hydrogen 3.275 N/A TYR 669.A N GLU 665.A O no hydrogen 2.866 N/A TYR 669.A OH ALA 443.A O no hydrogen 2.592 N/A MET 670.A N MET 666.A O no hydrogen 3.010 N/A ASN 671.A N GLU 668.A O no hydrogen 2.980 N/A ASN 671.A ND2 TYR 450.A O no hydrogen 3.080 N/A ASN 672.A N CYS 667.A O no hydrogen 2.884 N/A ASN 672.A ND2 SER 451.A OG no hydrogen 3.027 N/A ASN 672.A ND2 CYS 452.A O no hydrogen 3.096 N/A LYS 673.A N GLN 418.A O no hydrogen 2.873 N/A LYS 673.A NZ ARG 463.A O no hydrogen 3.265 N/A LYS 673.A NZ ASP 464.A OD1 no hydrogen 3.350 N/A GLN 674.A N GLN 418.A O no hydrogen 3.346 N/A LEU 676.A N GLN 418.A OE1 no hydrogen 2.847 N/A ASP 680.A N ASP 407.A O no hydrogen 3.207 N/A ARG 681.A N GLU 656.A OE2 no hydrogen 3.191 N/A ARG 681.A NH1 GLU 682.A O no hydrogen 2.770 N/A ARG 681.A NH1 ASP 710.A OD1 no hydrogen 2.816 N/A ARG 681.A NH2 ASP 648.A OD1 no hydrogen 2.921 N/A ARG 681.A NH2 ASP 710.A OD1 no hydrogen 2.847 N/A GLU 682.A N SER 405.A O no hydrogen 2.701 N/A ALA 683.A N SER 405.A OG no hydrogen 2.598 N/A ILE 684.A N ASP 710.A O no hydrogen 2.923 N/A ALA 685.A N VAL 403.A O no hydrogen 2.785 N/A GLY 686.A N ASN 707.A O no hydrogen 3.010 N/A LEU 689.A N THR 640.A OG1 no hydrogen 2.675 N/A SER 691.A N PRO 688.A O no hydrogen 3.076 N/A SER 691.A OG PRO 688.A O no hydrogen 2.557 N/A SER 691.A OG GLN 750.A O no hydrogen 3.397 N/A GLY 693.A N SER 691.A OG no hydrogen 3.339 N/A ILE 694.A N MET 748.A O no hydrogen 2.924 N/A GLY 695.A N LEU 749.A O no hydrogen 3.077 N/A GLY 696.A N ILE 694.A O no hydrogen 2.918 N/A PHE 697.A N ALA 705.A O no hydrogen 2.956 N/A TRP 698.A N ASN 398.A O no hydrogen 2.980 N/A THR 699.A N ARG 703.A O no hydrogen 2.992 N/A LYS 701.A NZ VAL 392.A O no hydrogen 3.299 N/A LYS 702.A N TYR 615.A OH no hydrogen 2.750 N/A LYS 702.A NZ ASP 617.A OD2 no hydrogen 2.699 N/A ARG 703.A N GLY 700.A O no hydrogen 3.313 N/A ARG 703.A NE THR 699.A OG1 no hydrogen 3.027 N/A ARG 703.A NH1 GLU 727.A OE1 no hydrogen 3.451 N/A ARG 703.A NH1 GLU 727.A OE2 no hydrogen 3.213 N/A ARG 703.A NH2 GLU 727.A OE1 no hydrogen 2.926 N/A ARG 703.A NH2 GLU 727.A OE2 no hydrogen 3.441 N/A TYR 704.A N MET 724.A O no hydrogen 2.977 N/A TYR 704.A OH TYR 622.A OH no hydrogen 2.659 N/A ALA 705.A N PHE 697.A O no hydrogen 2.922 N/A LEU 706.A N LYS 722.A O no hydrogen 2.863 N/A ASN 707.A N GLY 695.A O no hydrogen 2.862 N/A ASN 707.A ND2 GLY 686.A O no hydrogen 3.093 N/A VAL 708.A N LYS 720.A O no hydrogen 2.975 N/A TRP 709.A N ILE 684.A O no hydrogen 2.907 N/A TRP 709.A NE1 GLY 686.A O no hydrogen 2.650 N/A MET 711.A N THR 714.A O no hydrogen 3.050 N/A GLU 712.A N GLU 682.A O no hydrogen 2.811 N/A GLY 713.A N ASP 710.A OD1 no hydrogen 3.086 N/A THR 714.A N MET 711.A O no hydrogen 3.037 N/A THR 714.A OG1 GLN 489.A OE1 no hydrogen 2.889 N/A ARG 715.A NE ASP 710.A OD2 no hydrogen 2.707 N/A ARG 715.A NH1 ASN 641.A OD1 no hydrogen 2.701 N/A ARG 715.A NH1 ASP 645.A OD1 no hydrogen 3.093 N/A ARG 715.A NH2 ASP 645.A OD1 no hydrogen 2.732 N/A TYR 716.A N TRP 709.A O no hydrogen 3.194 N/A ALA 717.A N GLU 493.A OE1 no hydrogen 2.914 N/A LYS 720.A N VAL 708.A O no hydrogen 2.979 N/A LYS 722.A N LEU 706.A O no hydrogen 2.788 N/A MET 724.A N TYR 704.A O no hydrogen 2.802 N/A GLU 727.A N GLU 727.A OE1 no hydrogen 2.558 N/A GLN 729.A N LEU 726.A O no hydrogen 2.832 N/A GLN 729.A NE2 THR 728.A OG1 no hydrogen 2.666 N/A LYS 730.A N GLU 727.A O no hydrogen 3.093 N/A THR 733.A N LYS 730.A O no hydrogen 3.076 N/A THR 733.A OG1 GLU 727.A O no hydrogen 3.026 N/A LYS 735.A NZ GLN 738.A OE1 no hydrogen 3.265 N/A ALA 736.A N SER 774.A O no hydrogen 2.751 N/A GLN 738.A N PRO 734.A O no hydrogen 2.875 N/A GLN 738.A NE2 LYS 730.A O no hydrogen 2.629 N/A LYS 739.A N LYS 735.A O no hydrogen 3.029 N/A ALA 740.A N ALA 736.A O no hydrogen 2.854 N/A LEU 741.A N VAL 737.A O no hydrogen 2.709 N/A LYS 742.A N GLN 738.A O no hydrogen 2.818 N/A GLU 743.A N LYS 739.A O no hydrogen 3.053 N/A CYS 744.A N ALA 740.A O no hydrogen 2.847 N/A CYS 744.A SG ALA 740.A O no hydrogen 3.337 N/A ILE 745.A N LEU 741.A O no hydrogen 2.779 N/A ARG 746.A N LYS 742.A O no hydrogen 2.660 N/A ARG 746.A NE GLU 743.A OE1 no hydrogen 3.084 N/A ARG 746.A NE GLU 743.A OE2 no hydrogen 2.690 N/A ARG 746.A NH1 GLN 750.A OE1 no hydrogen 2.978 N/A ARG 746.A NH1 GLU 751.A OE2 no hydrogen 3.197 N/A ARG 746.A NH2 GLU 743.A OE1 no hydrogen 2.490 N/A ARG 746.A NH2 GLU 751.A OE2 no hydrogen 3.399 N/A ARG 747.A N GLU 743.A O no hydrogen 2.894 N/A ARG 747.A NE GLU 743.A OE1 no hydrogen 3.031 N/A ARG 747.A NH1 SER 755.A O no hydrogen 3.081 N/A ARG 747.A NH1 SER 755.A OG no hydrogen 2.821 N/A ARG 747.A NH1 GLU 758.A OE1 no hydrogen 3.299 N/A MET 748.A N CYS 744.A O no hydrogen 2.915 N/A LEU 749.A N ILE 745.A O no hydrogen 2.888 N/A GLN 750.A N ARG 746.A O no hydrogen 2.775 N/A GLN 750.A NE2 ASN 707.A OD1 no hydrogen 2.849 N/A GLU 751.A N ARG 747.A O no hydrogen 2.697 N/A GLY 752.A N ARG 747.A O no hydrogen 2.696 N/A SER 755.A OG GLU 751.A OE1 no hydrogen 2.567 N/A LEU 756.A N GLY 752.A O no hydrogen 3.169 N/A GLN 757.A N GLU 753.A O no hydrogen 2.973 N/A GLN 757.A NE2 ASP 886.A O no hydrogen 3.175 N/A GLU 758.A N GLU 754.A O no hydrogen 3.085 N/A TYR 759.A N SER 755.A O no hydrogen 3.144 N/A PHE 760.A N LEU 756.A O no hydrogen 2.865 N/A LYS 761.A N GLN 757.A O no hydrogen 3.000 N/A GLU 762.A N GLU 758.A O no hydrogen 3.268 N/A PHE 763.A N TYR 759.A O no hydrogen 2.881 N/A GLU 764.A N PHE 760.A O no hydrogen 2.886 N/A LYS 765.A N LYS 761.A O no hydrogen 3.289 N/A GLU 766.A N GLU 762.A O no hydrogen 3.188 N/A PHE 767.A N PHE 763.A O no hydrogen 2.887 N/A ARG 768.A NH1 GLU 764.A O no hydrogen 2.945 N/A GLN 769.A N GLU 766.A O no hydrogen 2.985 N/A LEU 770.A N PHE 767.A O no hydrogen 3.057 N/A TYR 772.A OH GLU 849.A OE1 no hydrogen 2.441 N/A ILE 773.A N ASN 771.A OD1 no hydrogen 2.950 N/A SER 774.A OG ASN 771.A O no hydrogen 2.544 N/A ILE 775.A N TYR 772.A O no hydrogen 3.356 N/A ALA 776.A N ILE 773.A O no hydrogen 3.168 N/A SER 777.A N VAL 828.A O no hydrogen 2.947 N/A VAL 778.A N SER 732.A O no hydrogen 2.904 N/A SER 779.A N VAL 826.A O no hydrogen 3.004 N/A SER 779.A OG SER 780.A O no hydrogen 3.225 N/A ALA 781.A N GLU 824.A O no hydrogen 2.860 N/A ASN 783.A N GLU 822.A OE2 no hydrogen 2.774 N/A ILE 784.A N GLU 822.A OE1 no hydrogen 3.191 N/A TYR 787.A N ILE 784.A O no hydrogen 3.111 N/A ASP 788.A N ALA 785.A O no hydrogen 3.162 N/A VAL 789.A N PHE 792.A O no hydrogen 2.907 N/A GLY 791.A N ASP 788.A OD2 no hydrogen 2.810 N/A PHE 792.A N VAL 789.A O no hydrogen 3.122 N/A GLY 794.A N TYR 787.A O no hydrogen 2.859 N/A CYS 797.A N GLY 794.A O no hydrogen 3.232 N/A CYS 797.A SG PRO 798.A O no hydrogen 3.481 N/A ARG 802.A N PRO 798.A O no hydrogen 2.889 N/A ARG 802.A NH1 ASP 839.A OD1 no hydrogen 2.886 N/A ARG 802.A NH1 ASP 839.A OD2 no hydrogen 3.350 N/A GLY 803.A N PHE 799.A O no hydrogen 3.103 N/A ILE 804.A N HIS 800.A O no hydrogen 3.112 N/A LEU 805.A N ILE 801.A O no hydrogen 3.055 N/A THR 806.A N ARG 802.A O no hydrogen 3.011 N/A THR 806.A OG1 ARG 802.A O no hydrogen 2.868 N/A THR 806.A OG1 CYS 841.A O no hydrogen 3.036 N/A TYR 807.A N GLY 803.A O no hydrogen 3.058 N/A TYR 807.A OH PRO 818.A O no hydrogen 2.697 N/A ASN 808.A N ILE 804.A O no hydrogen 2.792 N/A ARG 809.A N LEU 805.A O no hydrogen 2.994 N/A ARG 809.A NH1 GLY 791.A O no hydrogen 3.065 N/A ARG 809.A NH2 PHE 837.A O no hydrogen 3.347 N/A ARG 809.A NH2 ASP 839.A OD2 no hydrogen 3.534 N/A ALA 810.A N THR 806.A O no hydrogen 3.067 N/A ILE 811.A N TYR 807.A O no hydrogen 2.977 N/A ASN 814.A N ILE 811.A O no hydrogen 3.044 N/A ASN 814.A ND2 ILE 811.A O no hydrogen 3.299 N/A ALA 817.A N ASN 814.A O no hydrogen 3.157 N/A GLN 819.A NE2 ALA 817.A O no hydrogen 3.282 N/A GLY 823.A N ALA 781.A O no hydrogen 2.847 N/A GLU 824.A N VAL 821.A O no hydrogen 3.072 N/A LYS 825.A NZ ASN 280.A OD1 no hydrogen 2.652 N/A LYS 825.A NZ GLN 281.A O no hydrogen 2.916 N/A VAL 826.A N SER 779.A O no hydrogen 2.814 N/A TYR 827.A N TRP 844.A O no hydrogen 2.715 N/A VAL 828.A N SER 777.A O no hydrogen 2.662 N/A LEU 829.A N ILE 842.A O no hydrogen 2.825 N/A LEU 831.A N LYS 840.A O no hydrogen 2.789 N/A ARG 832.A N TRP 861.A O no hydrogen 2.891 N/A ARG 832.A NH1 HIS 860.A O no hydrogen 2.709 N/A ARG 832.A NH1 MET 862.A O no hydrogen 3.066 N/A ARG 832.A NH2 HIS 860.A O no hydrogen 3.075 N/A ASN 835.A N ARG 832.A O no hydrogen 3.308 N/A ASN 835.A ND2 ARG 832.A O no hydrogen 2.529 N/A ASN 835.A ND2 ASP 839.A O no hydrogen 2.938 N/A PHE 837.A N ASN 835.A OD1 no hydrogen 3.126 N/A GLY 838.A N ASN 835.A O no hydrogen 3.362 N/A LYS 840.A N ASP 839.A OD1 no hydrogen 3.031 N/A CYS 841.A SG PHE 799.A O no hydrogen 3.258 N/A ILE 842.A N LEU 829.A O no hydrogen 2.817 N/A ALA 843.A N GLY 803.A O no hydrogen 2.891 N/A TRP 844.A N TYR 827.A O no hydrogen 3.028 N/A TRP 844.A NE1 THR 848.A O no hydrogen 2.872 N/A SER 846.A N LYS 825.A O no hydrogen 2.968 N/A SER 846.A OG PRO 282.A O no hydrogen 2.612 N/A SER 846.A OG LYS 825.A O no hydrogen 3.123 N/A THR 848.A OG1 PRO 845.A O no hydrogen 2.801 N/A THR 848.A OG1 GLU 849.A O no hydrogen 3.436 N/A ILE 850.A N TYR 772.A OH no hydrogen 3.081 N/A LEU 853.A N THR 851.A OG1 no hydrogen 3.123 N/A ILE 854.A N THR 851.A O no hydrogen 3.192 N/A LYS 855.A NZ GLU 849.A OE1 no hydrogen 2.713 N/A VAL 858.A N ILE 854.A O no hydrogen 2.963 N/A LEU 859.A N LYS 855.A O no hydrogen 2.930 N/A HIS 860.A N ASP 856.A O no hydrogen 3.186 N/A TRP 861.A N ASP 857.A O no hydrogen 3.172 N/A TRP 861.A N VAL 858.A O no hydrogen 3.045 N/A ASP 863.A N PRO 830.A O no hydrogen 2.822 N/A VAL 866.A N ASP 863.A OD1 no hydrogen 3.046 N/A LEU 867.A N ASP 863.A O no hydrogen 2.817 N/A LEU 868.A N TYR 864.A O no hydrogen 2.754 N/A GLU 869.A N THR 865.A O no hydrogen 3.130 N/A LYS 870.A N VAL 866.A O no hydrogen 2.940 N/A THR 871.A N LEU 867.A O no hydrogen 3.077 N/A THR 871.A OG1 LEU 867.A O no hydrogen 3.137 N/A PHE 872.A N LEU 868.A O no hydrogen 2.718 N/A ILE 873.A N LEU 868.A O no hydrogen 2.995 N/A LYS 874.A N GLU 869.A O no hydrogen 2.936 N/A LEU 876.A N PHE 872.A O no hydrogen 3.089 N/A GLU 877.A N ILE 873.A O no hydrogen 2.692 N/A GLY 878.A N LYS 874.A O no hydrogen 3.104 N/A PHE 879.A N PRO 875.A O no hydrogen 2.898 N/A THR 880.A N LEU 876.A O no hydrogen 2.875 N/A THR 880.A OG1 LEU 876.A O no hydrogen 2.891 N/A THR 880.A OG1 GLU 877.A O no hydrogen 3.176 N/A SER 881.A N GLU 877.A O no hydrogen 2.864 N/A SER 881.A OG GLU 877.A O no hydrogen 2.988 N/A SER 881.A OG GLY 878.A O no hydrogen 3.267 N/A ALA 882.A N GLY 878.A O no hydrogen 3.206 N/A ALA 883.A N PHE 879.A O no hydrogen 2.980 N/A LYS 884.A N SER 881.A O no hydrogen 3.331 N/A LEU 885.A N THR 880.A O no hydrogen 2.787 N/A ASP 886.A N GLU 753.A OE1 no hydrogen 2.807 N/A SER 892.A N ASP 895.A OD1 no hydrogen 2.848 N/A PHE 894.A N SER 892.A OG no hydrogen 3.203 N/A ASP 895.A N SER 892.A O no hydrogen 3.227 N/A MET 896.A N LEU 893.A O no hydrogen 3.185 N/A PHE 897.A N PHE 894.A O no hydrogen 3.068 N/A