Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jy1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 55.A OD1 no hydrogen 3.183 N/A SER 1.A OG GLU 226.A OE1 no hydrogen 3.223 N/A SER 1.A OG GLU 226.A OE2 no hydrogen 2.759 N/A SER 3.A N PHE 54.A O no hydrogen 2.867 N/A SER 3.A OG VAL 52.A O no hydrogen 2.761 N/A THR 5.A N TYR 272.A O no hydrogen 3.107 N/A TRP 6.A NE1 THR 53.A OG1 no hydrogen 2.716 N/A THR 7.A N CYS 270.A O no hydrogen 2.783 N/A THR 7.A OG1 ASN 269.A O no hydrogen 2.573 N/A THR 7.A OG1 CYS 270.A O no hydrogen 3.122 N/A ALA 9.A N THR 7.A OG1 no hydrogen 3.016 N/A THR 12.A OG1 SER 265.A OG no hydrogen 2.694 N/A SER 27.A N ASN 24.A O no hydrogen 3.186 N/A SER 27.A N ASN 24.A OD1 no hydrogen 2.791 N/A SER 27.A OG ASN 24.A O no hydrogen 2.821 N/A ASN 28.A N ASN 24.A O no hydrogen 2.959 N/A ASN 28.A N PRO 25.A O no hydrogen 3.203 N/A ASN 28.A ND2 LEU 31.A O no hydrogen 3.005 N/A LEU 31.A N SER 27.A O no hydrogen 3.274 N/A ARG 32.A N GLY 489.A O no hydrogen 3.159 N/A HIS 33.A N LEU 488.A O no hydrogen 3.193 N/A HIS 34.A N ARG 32.A O no hydrogen 2.627 N/A MET 36.A N HIS 33.A O no hydrogen 2.961 N/A VAL 37.A N HIS 34.A O no hydrogen 3.012 N/A TYR 38.A N PHE 145.A O no hydrogen 3.138 N/A ALA 39.A N SER 19.A O no hydrogen 2.963 N/A THR 40.A N GLU 143.A O no hydrogen 2.860 N/A THR 40.A OG1 LYS 141.A O no hydrogen 2.655 N/A THR 40.A OG1 GLU 143.A O no hydrogen 3.452 N/A SER 42.A N GLU 17.A OE1 no hydrogen 2.924 N/A SER 42.A N GLU 17.A OE2 no hydrogen 3.245 N/A SER 42.A OG GLU 17.A OE1 no hydrogen 2.792 N/A SER 42.A OG GLU 17.A OE2 no hydrogen 3.201 N/A ARG 43.A N THR 41.A OG1 no hydrogen 3.330 N/A SER 44.A N THR 41.A O no hydrogen 3.353 N/A SER 44.A OG THR 41.A O no hydrogen 3.538 N/A ALA 45.A N SER 42.A O no hydrogen 2.889 N/A LEU 47.A N SER 44.A O no hydrogen 2.923 N/A ARG 48.A N SER 44.A O no hydrogen 3.366 N/A GLN 49.A N ALA 45.A O no hydrogen 2.842 N/A LYS 50.A N SER 46.A O no hydrogen 3.073 N/A LYS 51.A N LEU 47.A O no hydrogen 3.317 N/A VAL 52.A N ARG 48.A O no hydrogen 2.865 N/A THR 53.A N GLN 49.A O no hydrogen 2.848 N/A THR 53.A OG1 GLN 49.A O no hydrogen 2.980 N/A ARG 56.A N SER 1.A O no hydrogen 3.166 N/A ARG 56.A NE SER 1.A O no hydrogen 2.939 N/A ARG 56.A NH1 SER 222.A O no hydrogen 2.736 N/A ARG 56.A NH1 VAL 224.A O no hydrogen 2.850 N/A ARG 56.A NH2 ARG 274.A O no hydrogen 2.747 N/A GLN 58.A NE2 ASP 228.A OD1 no hydrogen 2.995 N/A GLN 58.A NE2 ASP 228.A OD2 no hydrogen 3.490 N/A GLN 58.A NE2 TYR 342.A O no hydrogen 3.217 N/A VAL 59.A N ARG 341.A O no hydrogen 2.701 N/A TYR 64.A N ASP 61.A OD1 no hydrogen 3.054 N/A ARG 65.A N ASP 61.A O no hydrogen 3.070 N/A ARG 65.A NH2 ASP 62.A OD1 no hydrogen 2.825 N/A ASP 66.A N ASP 62.A O no hydrogen 2.700 N/A VAL 67.A N HIS 63.A O no hydrogen 3.029 N/A LEU 68.A N TYR 64.A O no hydrogen 3.004 N/A LYS 69.A N ARG 65.A O no hydrogen 3.185 N/A GLU 70.A N ASP 66.A O no hydrogen 3.151 N/A MET 71.A N VAL 67.A O no hydrogen 2.938 N/A LYS 72.A N LEU 68.A O no hydrogen 2.785 N/A ALA 73.A N LYS 69.A O no hydrogen 2.919 N/A ALA 75.A N MET 71.A O no hydrogen 2.990 N/A SER 76.A N LYS 72.A O no hydrogen 3.027 N/A SER 76.A OG LYS 72.A O no hydrogen 3.105 N/A THR 77.A N LYS 74.A O no hydrogen 3.114 N/A THR 77.A OG1 LYS 74.A O no hydrogen 2.706 N/A VAL 78.A N ALA 75.A O no hydrogen 2.987 N/A ALA 80.A N ASP 240.A O no hydrogen 3.076 N/A LYS 81.A N ASP 173.A OD2 no hydrogen 2.534 N/A LEU 83.A N MET 169.A O no hydrogen 2.965 N/A SER 84.A N GLU 87.A OE1 no hydrogen 3.322 N/A SER 84.A OG GLU 87.A OE1 no hydrogen 3.063 N/A GLU 87.A N SER 84.A OG no hydrogen 3.206 N/A ALA 88.A N SER 84.A O no hydrogen 2.846 N/A CYS 89.A N ILE 85.A O no hydrogen 2.737 N/A CYS 89.A SG ILE 85.A O no hydrogen 3.031 N/A LYS 90.A N GLU 86.A O no hydrogen 2.914 N/A LEU 91.A N ALA 88.A O no hydrogen 2.866 N/A THR 92.A N CYS 89.A O no hydrogen 3.178 N/A SER 96.A N PRO 93.A O no hydrogen 3.249 N/A SER 96.A OG ASP 555.A OD1 no hydrogen 2.729 N/A SER 96.A OG ASP 555.A OD2 no hydrogen 3.205 N/A SER 99.A N TYR 103.A O no hydrogen 3.002 N/A SER 99.A OG ASP 160.A OD1 no hydrogen 3.419 N/A SER 99.A OG ASP 160.A OD2 no hydrogen 3.015 N/A LYS 100.A N ASP 160.A OD1 no hydrogen 2.940 N/A PHE 101.A N SER 99.A OG no hydrogen 2.839 N/A TYR 103.A OH HIS 118.A ND1 no hydrogen 2.684 N/A GLY 104.A N ASP 107.A OD2 no hydrogen 2.746 N/A VAL 108.A N GLY 104.A O no hydrogen 2.948 N/A ARG 109.A N ALA 105.A O no hydrogen 2.939 N/A ARG 109.A NH1 LYS 90.A O no hydrogen 3.206 N/A ARG 109.A NH1 THR 92.A O no hydrogen 2.719 N/A ASN 110.A N LYS 106.A O no hydrogen 2.981 N/A LEU 111.A N VAL 108.A O no hydrogen 3.223 N/A SER 112.A N ASP 107.A O no hydrogen 3.170 N/A SER 112.A OG ASP 107.A O no hydrogen 3.420 N/A VAL 116.A N SER 112.A O no hydrogen 3.119 N/A ASN 117.A N SER 113.A O no hydrogen 2.919 N/A HIS 118.A N ARG 114.A O no hydrogen 3.267 N/A HIS 118.A ND1 TYR 103.A OH no hydrogen 2.684 N/A ILE 119.A N ALA 115.A O no hydrogen 3.134 N/A ARG 120.A N VAL 116.A O no hydrogen 3.135 N/A SER 121.A N ASN 117.A O no hydrogen 3.077 N/A SER 121.A OG HIS 118.A O no hydrogen 3.153 N/A VAL 122.A N HIS 118.A O no hydrogen 2.946 N/A TRP 123.A N ILE 119.A O no hydrogen 2.885 N/A TRP 123.A NE1 GLU 244.A OE1 no hydrogen 3.307 N/A GLU 124.A N ARG 120.A O no hydrogen 2.729 N/A ASP 125.A N SER 121.A O no hydrogen 2.845 N/A LEU 126.A N VAL 122.A O no hydrogen 3.218 N/A LEU 127.A N TRP 123.A O no hydrogen 3.120 N/A GLU 128.A N GLU 124.A O no hydrogen 3.136 N/A ASP 129.A N ASP 125.A O no hydrogen 2.926 N/A GLU 131.A N ASP 129.A OD1 no hydrogen 2.794 N/A THR 132.A N ASP 129.A OD1 no hydrogen 2.908 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 3.220 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 2.401 N/A ILE 134.A N ARG 255.A O no hydrogen 2.788 N/A THR 136.A OG1 PRO 261.A O no hydrogen 3.063 N/A THR 137.A N PHE 158.A O no hydrogen 2.901 N/A ILE 138.A N THR 263.A O no hydrogen 2.990 N/A MET 139.A N ILE 156.A O no hydrogen 3.032 N/A LYS 141.A N ARG 154.A O no hydrogen 2.686 N/A GLU 143.A N THR 40.A OG1 no hydrogen 2.826 N/A PHE 145.A N TYR 38.A O no hydrogen 2.881 N/A CYS 146.A SG MET 36.A O no hydrogen 3.822 N/A CYS 146.A SG VAL 147.A O no hydrogen 3.480 N/A VAL 147.A N MET 36.A O no hydrogen 2.711 N/A LYS 151.A N TYR 38.A OH no hydrogen 2.677 N/A ALA 153.A N SER 44.A OG no hydrogen 3.026 N/A ILE 156.A N MET 139.A O no hydrogen 3.114 N/A PHE 158.A N THR 137.A O no hydrogen 3.164 N/A GLY 162.A N ASP 160.A OD2 no hydrogen 3.143 N/A ARG 164.A N ASP 160.A O no hydrogen 3.011 N/A ARG 164.A NE ASP 555.A OD2 no hydrogen 2.579 N/A ARG 164.A NH1 PRO 159.A O no hydrogen 2.804 N/A ARG 164.A NH2 SER 96.A OG no hydrogen 2.649 N/A ARG 164.A NH2 ALA 97.A O no hydrogen 2.703 N/A VAL 165.A N LEU 161.A O no hydrogen 2.937 N/A CYS 166.A N GLY 162.A O no hydrogen 3.125 N/A CYS 166.A SG ILE 119.A O no hydrogen 3.536 N/A CYS 166.A SG GLY 162.A O no hydrogen 3.572 N/A GLU 167.A N VAL 163.A O no hydrogen 2.833 N/A LYS 168.A N ARG 164.A O no hydrogen 3.255 N/A LYS 168.A NZ GLY 554.A O no hydrogen 3.517 N/A LYS 168.A NZ ASP 555.A O no hydrogen 2.904 N/A MET 169.A N VAL 165.A O no hydrogen 3.308 N/A ALA 170.A N CYS 166.A O no hydrogen 3.022 N/A LEU 171.A N GLU 167.A O no hydrogen 2.604 N/A TYR 172.A N LYS 168.A O no hydrogen 2.780 N/A VAL 175.A N LEU 171.A O no hydrogen 2.873 N/A SER 176.A N TYR 172.A O no hydrogen 3.203 N/A SER 176.A OG TYR 172.A O no hydrogen 3.031 N/A SER 176.A OG TYR 551.A OH no hydrogen 2.586 N/A THR 177.A N ASP 173.A O no hydrogen 3.246 N/A THR 177.A N VAL 174.A O no hydrogen 3.403 N/A THR 177.A OG1 ASP 173.A O no hydrogen 3.288 N/A LEU 178.A N VAL 174.A O no hydrogen 3.072 N/A ALA 181.A N THR 177.A O no hydrogen 3.231 N/A VAL 182.A N LEU 178.A O no hydrogen 2.831 N/A VAL 182.A N PRO 179.A O no hydrogen 3.173 N/A MET 183.A N PRO 179.A O no hydrogen 2.774 N/A GLY 184.A N GLN 180.A O no hydrogen 2.932 N/A SER 186.A N MET 183.A O no hydrogen 3.026 N/A SER 186.A OG MET 309.A O no hydrogen 2.591 N/A TYR 187.A N GLY 184.A O no hydrogen 3.166 N/A GLY 188.A N VAL 311.A O no hydrogen 2.691 N/A GLN 190.A N TYR 187.A O no hydrogen 3.519 N/A GLN 190.A NE2 GLY 184.A O no hydrogen 2.701 N/A GLN 190.A NE2 TYR 187.A O no hydrogen 3.000 N/A TYR 191.A N GLY 188.A O no hydrogen 2.977 N/A TYR 191.A OH SER 185.A O no hydrogen 2.690 N/A SER 192.A N GLN 195.A OE1 no hydrogen 3.144 N/A SER 192.A OG GLN 195.A OE1 no hydrogen 3.236 N/A ARG 196.A N SER 192.A O no hydrogen 2.978 N/A ARG 196.A NH1 ASN 312.A OD1 no hydrogen 2.717 N/A ARG 196.A NH2 SER 361.A OG no hydrogen 2.932 N/A VAL 197.A N PRO 193.A O no hydrogen 2.957 N/A GLU 198.A N LYS 194.A O no hydrogen 2.928 N/A PHE 199.A N GLN 195.A O no hydrogen 2.776 N/A LEU 200.A N ARG 196.A O no hydrogen 2.797 N/A VAL 201.A N VAL 197.A O no hydrogen 2.892 N/A ASN 202.A N GLU 198.A O no hydrogen 2.838 N/A THR 203.A N PHE 199.A O no hydrogen 2.853 N/A THR 203.A OG1 PHE 199.A O no hydrogen 3.059 N/A TRP 204.A N LEU 200.A O no hydrogen 3.111 N/A LYS 205.A N VAL 201.A O no hydrogen 2.754 N/A SER 206.A N THR 203.A O no hydrogen 3.282 N/A SER 206.A OG THR 203.A O no hydrogen 2.794 N/A LYS 207.A N TRP 204.A O no hydrogen 3.195 N/A LYS 207.A NZ ASP 306.A O no hydrogen 3.150 N/A LYS 207.A NZ THR 308.A OG1 no hydrogen 2.672 N/A LYS 208.A N GLU 321.A OE1 no hydrogen 2.885 N/A CYS 209.A N GLU 321.A OE2 no hydrogen 3.413 N/A MET 211.A N CYS 320.A O no hydrogen 2.845 N/A GLY 212.A N GLU 353.A O no hydrogen 2.891 N/A PHE 213.A N VAL 318.A O no hydrogen 2.916 N/A TYR 215.A N LEU 316.A O no hydrogen 2.787 N/A TYR 215.A OH ALA 344.A O no hydrogen 2.845 N/A ARG 218.A N PRO 345.A O no hydrogen 3.141 N/A SER 222.A N CYS 219.A O no hydrogen 3.005 N/A SER 222.A OG VAL 52.A O no hydrogen 3.396 N/A SER 222.A OG CYS 219.A O no hydrogen 3.122 N/A THR 223.A N PHE 220.A O no hydrogen 2.857 N/A THR 223.A OG1 PHE 220.A O no hydrogen 2.348 N/A THR 223.A OG1 SER 343.A O no hydrogen 3.541 N/A VAL 224.A N ASP 221.A O no hydrogen 3.116 N/A THR 225.A N ASP 228.A OD2 no hydrogen 3.109 N/A THR 225.A OG1 GLN 58.A OE1 no hydrogen 2.870 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.972 N/A ASP 228.A N THR 225.A OG1 no hydrogen 3.176 N/A ILE 229.A N THR 225.A O no hydrogen 3.129 N/A ARG 230.A N GLU 226.A O no hydrogen 3.103 N/A ARG 230.A NH1 GLU 254.A OE2 no hydrogen 2.735 N/A VAL 231.A N SER 227.A O no hydrogen 2.815 N/A GLU 232.A N ASP 228.A O no hydrogen 2.748 N/A GLU 233.A N ILE 229.A O no hydrogen 3.099 N/A SER 234.A N ARG 230.A O no hydrogen 2.868 N/A SER 234.A OG VAL 231.A O no hydrogen 2.777 N/A ILE 235.A N VAL 231.A O no hydrogen 3.139 N/A ILE 235.A N GLU 232.A O no hydrogen 2.970 N/A TYR 236.A N GLU 232.A O no hydrogen 3.142 N/A TYR 236.A OH GLU 232.A OE1 no hydrogen 2.409 N/A GLN 237.A N GLU 233.A O no hydrogen 2.739 N/A CYS 238.A N ILE 235.A O no hydrogen 3.122 N/A CYS 238.A SG LYS 72.A O no hydrogen 3.817 N/A CYS 238.A SG SER 234.A O no hydrogen 3.518 N/A CYS 239.A N TYR 236.A O no hydrogen 2.939 N/A CYS 239.A SG TYR 236.A O no hydrogen 3.246 N/A ASP 240.A N VAL 78.A O no hydrogen 3.044 N/A ARG 246.A N ALA 242.A O no hydrogen 2.853 N/A ARG 246.A NH1 GLN 237.A O no hydrogen 2.956 N/A ARG 246.A NH1 GLN 237.A OE1 no hydrogen 2.699 N/A ARG 246.A NH2 CYS 239.A O no hydrogen 3.471 N/A GLN 247.A N PRO 243.A O no hydrogen 2.996 N/A ALA 248.A N GLU 244.A O no hydrogen 2.773 N/A ILE 249.A N ALA 245.A O no hydrogen 3.010 N/A ARG 250.A N ARG 246.A O no hydrogen 3.094 N/A ARG 250.A NE GLU 233.A OE1 no hydrogen 3.433 N/A ARG 250.A NE GLU 233.A OE2 no hydrogen 2.814 N/A ARG 250.A NH2 GLU 233.A OE1 no hydrogen 2.890 N/A ARG 250.A NH2 GLU 254.A OE2 no hydrogen 2.886 N/A SER 251.A N GLN 247.A O no hydrogen 2.738 N/A SER 251.A OG LEU 126.A O no hydrogen 2.860 N/A SER 251.A OG ASP 129.A O no hydrogen 3.433 N/A SER 251.A OG GLN 247.A O no hydrogen 3.472 N/A SER 251.A OG GLN 247.A OE1 no hydrogen 3.303 N/A LEU 252.A N ALA 248.A O no hydrogen 2.667 N/A THR 253.A N ILE 249.A O no hydrogen 3.056 N/A THR 253.A OG1 ILE 249.A O no hydrogen 2.689 N/A GLU 254.A N ARG 250.A O no hydrogen 3.265 N/A ARG 255.A N SER 251.A O no hydrogen 2.944 N/A ARG 255.A NE THR 132.A O no hydrogen 2.702 N/A ARG 255.A NH1 ASP 125.A O no hydrogen 3.050 N/A ARG 255.A NH1 ASP 125.A OD2 no hydrogen 3.132 N/A ARG 255.A NH2 ASP 125.A OD2 no hydrogen 2.645 N/A LEU 256.A N LEU 252.A O no hydrogen 3.041 N/A TYR 257.A N LEU 252.A O no hydrogen 2.997 N/A TYR 257.A OH GLU 167.A OE1 no hydrogen 3.008 N/A ILE 258.A N THR 253.A O no hydrogen 3.072 N/A GLY 259.A N LEU 256.A O no hydrogen 3.070 N/A GLY 260.A N ARG 273.A O no hydrogen 3.166 N/A LEU 262.A N GLY 271.A O no hydrogen 2.827 N/A THR 263.A N THR 136.A O no hydrogen 2.774 N/A THR 263.A OG1 ASP 135.A OD1 no hydrogen 2.604 N/A THR 263.A OG1 ASP 135.A OD2 no hydrogen 3.274 N/A ASN 264.A N GLN 268.A O no hydrogen 3.192 N/A ASN 264.A ND2 LEU 10.A O no hydrogen 2.765 N/A ASN 264.A ND2 GLN 268.A OE1 no hydrogen 3.027 N/A SER 265.A OG THR 12.A O no hydrogen 3.012 N/A SER 265.A OG THR 12.A OG1 no hydrogen 2.694 N/A SER 265.A OG PRO 13.A O no hydrogen 3.178 N/A LYS 266.A N ASN 264.A OD1 no hydrogen 2.657 N/A GLY 267.A N ASN 264.A O no hydrogen 3.121 N/A GLN 268.A N ASN 264.A OD1 no hydrogen 3.215 N/A ASN 269.A ND2 LEU 262.A O no hydrogen 3.557 N/A CYS 270.A N LEU 262.A O no hydrogen 2.896 N/A CYS 270.A SG ALA 9.A O no hydrogen 3.847 N/A CYS 270.A SG LEU 10.A O no hydrogen 3.407 N/A TYR 272.A N THR 5.A O no hydrogen 2.923 N/A ARG 273.A N GLY 260.A O no hydrogen 3.062 N/A ARG 273.A NH1 LEU 256.A O no hydrogen 3.088 N/A ARG 273.A NH1 TYR 257.A O no hydrogen 3.426 N/A ARG 273.A NH1 CYS 275.A O no hydrogen 2.819 N/A ARG 273.A NH2 LEU 256.A O no hydrogen 2.618 N/A ARG 274.A N SER 3.A O no hydrogen 2.978 N/A ARG 274.A NH1 MET 2.A O no hydrogen 3.147 N/A ARG 274.A NH2 THR 5.A OG1 no hydrogen 3.407 N/A CYS 275.A SG SER 3.A O no hydrogen 3.879 N/A CYS 275.A SG TYR 4.A OH no hydrogen 3.518 N/A CYS 275.A SG ARG 276.A O no hydrogen 3.721 N/A ARG 276.A N ASP 221.A O no hydrogen 3.330 N/A ARG 276.A NE ASN 287.A OD1 no hydrogen 2.664 N/A ARG 276.A NH1 GLU 232.A OE2 no hydrogen 2.730 N/A ARG 276.A NH2 GLU 232.A OE2 no hydrogen 3.200 N/A ARG 276.A NH2 ASN 287.A OD1 no hydrogen 3.144 N/A SER 278.A OG LEU 155.A O no hydrogen 3.448 N/A GLY 279.A N VAL 157.A O no hydrogen 2.921 N/A LEU 281.A N GLU 167.A OE1 no hydrogen 2.814 N/A THR 283.A N VAL 280.A O no hydrogen 3.297 N/A THR 283.A OG1 ALA 277.A O no hydrogen 2.693 N/A THR 283.A OG1 SER 278.A O no hydrogen 3.222 N/A THR 283.A OG1 VAL 280.A O no hydrogen 3.166 N/A CYS 285.A SG TYR 236.A OH no hydrogen 3.621 N/A GLY 286.A N THR 282.A O no hydrogen 2.707 N/A ASN 287.A N THR 283.A O no hydrogen 2.877 N/A ASN 287.A ND2 ASP 221.A OD1 no hydrogen 3.108 N/A THR 288.A N SER 284.A O no hydrogen 2.916 N/A THR 288.A OG1 SER 284.A O no hydrogen 2.842 N/A LEU 289.A N CYS 285.A O no hydrogen 2.860 N/A THR 290.A N GLY 286.A O no hydrogen 2.896 N/A THR 290.A OG1 GLY 286.A O no hydrogen 2.654 N/A CYS 291.A N ASN 287.A O no hydrogen 2.767 N/A CYS 291.A SG ASP 314.A O no hydrogen 3.838 N/A TYR 292.A N THR 288.A O no hydrogen 2.921 N/A LEU 293.A N LEU 289.A O no hydrogen 2.869 N/A LYS 294.A N THR 290.A O no hydrogen 2.991 N/A LYS 294.A NZ ASP 228.A OD2 no hydrogen 2.731 N/A LYS 294.A NZ TYR 342.A O no hydrogen 3.062 N/A LYS 294.A NZ SER 343.A O no hydrogen 3.329 N/A ALA 295.A N CYS 291.A O no hydrogen 2.983 N/A THR 296.A N TYR 292.A O no hydrogen 2.836 N/A THR 296.A OG1 TYR 292.A O no hydrogen 2.772 N/A ALA 297.A N LEU 293.A O no hydrogen 3.037 N/A ALA 298.A N LYS 294.A O no hydrogen 2.784 N/A CYS 299.A N ALA 295.A O no hydrogen 2.872 N/A ARG 300.A N ALA 297.A O no hydrogen 2.922 N/A ARG 300.A NH1 GLU 70.A OE2 no hydrogen 3.208 N/A ARG 300.A NH2 GLU 70.A OE1 no hydrogen 2.932 N/A ARG 300.A NH2 GLU 70.A OE2 no hydrogen 3.542 N/A ALA 301.A N ALA 297.A O no hydrogen 3.080 N/A ALA 302.A N ALA 298.A O no hydrogen 2.906 N/A LYS 303.A N ARG 300.A O no hydrogen 3.440 N/A LEU 304.A N CYS 299.A O no hydrogen 3.168 N/A GLN 305.A NE2 GLU 321.A O no hydrogen 3.635 N/A CYS 307.A SG LEU 304.A O no hydrogen 3.962 N/A THR 308.A N ILE 319.A O no hydrogen 3.014 N/A LEU 310.A N VAL 317.A O no hydrogen 3.166 N/A VAL 311.A N SER 186.A O no hydrogen 2.897 N/A ASN 312.A N ASP 315.A O no hydrogen 3.007 N/A GLY 313.A N THR 288.A OG1 no hydrogen 2.746 N/A ASP 315.A N ASN 312.A O no hydrogen 3.032 N/A VAL 317.A N LEU 310.A O no hydrogen 3.129 N/A VAL 318.A N PHE 213.A O no hydrogen 2.820 N/A ILE 319.A N THR 308.A O no hydrogen 3.131 N/A CYS 320.A N MET 211.A O no hydrogen 2.831 N/A CYS 320.A SG MET 211.A O no hydrogen 3.506 N/A GLU 321.A N GLN 305.A O no hydrogen 2.883 N/A SER 322.A N CYS 209.A O no hydrogen 2.761 N/A SER 322.A OG ASP 328.A OD2 no hydrogen 2.563 N/A ALA 323.A N ASP 328.A OD1 no hydrogen 2.855 N/A GLY 324.A N SER 322.A OG no hydrogen 3.308 N/A GLU 327.A N GLU 327.A OE1 no hydrogen 2.412 N/A ASP 328.A N GLY 324.A O no hydrogen 2.918 N/A ALA 329.A N THR 325.A O no hydrogen 3.162 N/A ALA 329.A N GLN 326.A O no hydrogen 3.176 N/A ALA 330.A N GLN 326.A O no hydrogen 3.119 N/A ALA 331.A N GLU 327.A O no hydrogen 2.752 N/A LEU 332.A N ASP 328.A O no hydrogen 2.891 N/A ARG 333.A N ALA 329.A O no hydrogen 3.036 N/A ALA 334.A N ALA 330.A O no hydrogen 2.906 N/A PHE 335.A N ALA 331.A O no hydrogen 2.854 N/A THR 336.A N LEU 332.A O no hydrogen 3.149 N/A THR 336.A OG1 LEU 332.A O no hydrogen 3.196 N/A GLU 337.A N ARG 333.A O no hydrogen 3.174 N/A ALA 338.A N ALA 334.A O no hydrogen 3.038 N/A MET 339.A N PHE 335.A O no hydrogen 2.901 N/A THR 340.A N THR 336.A O no hydrogen 2.821 N/A THR 340.A OG1 THR 336.A O no hydrogen 2.538 N/A ARG 341.A N GLU 337.A O no hydrogen 3.103 N/A TYR 342.A N ALA 338.A O no hydrogen 3.072 N/A TYR 342.A OH ASP 61.A OD1 no hydrogen 2.772 N/A SER 343.A N THR 340.A O no hydrogen 3.195 N/A SER 343.A OG THR 223.A O no hydrogen 2.893 N/A GLY 347.A N ASP 216.A O no hydrogen 2.717 N/A ASP 348.A N ASP 216.A OD2 no hydrogen 3.320 N/A GLN 351.A NE2 PRO 349.A O no hydrogen 3.309 N/A GLU 353.A N GLY 212.A O no hydrogen 2.634 N/A TYR 354.A OH ASP 328.A OD2 no hydrogen 2.493 N/A GLU 357.A N ASP 355.A OD1 no hydrogen 3.320 N/A LEU 358.A N ASP 355.A O no hydrogen 2.636 N/A ILE 359.A N LEU 356.A O no hydrogen 3.082 N/A SER 361.A N SER 364.A O no hydrogen 2.810 N/A CYS 362.A N ASP 315.A OD1 no hydrogen 2.972 N/A CYS 362.A N ASP 315.A OD2 no hydrogen 2.624 N/A SER 364.A N SER 361.A O no hydrogen 2.942 N/A SER 364.A OG CYS 362.A O no hydrogen 3.112 N/A ASN 365.A N THR 381.A O no hydrogen 3.143 N/A ASN 365.A ND2 VAL 366.A O no hydrogen 3.052 N/A SER 367.A N TYR 379.A O no hydrogen 3.153 N/A SER 367.A OG GLU 357.A OE2 no hydrogen 3.349 N/A SER 367.A OG TYR 379.A OH no hydrogen 3.369 N/A ALA 369.A N VAL 377.A O no hydrogen 3.148 N/A HIS 370.A N HIS 471.A O no hydrogen 2.872 N/A HIS 370.A ND1 GLY 374.A O no hydrogen 3.116 N/A ASP 371.A N LYS 375.A O no hydrogen 3.362 N/A ALA 372.A N THR 469.A OG1 no hydrogen 3.000 N/A SER 373.A OG ASP 371.A OD2 no hydrogen 3.494 N/A GLY 374.A N ASP 371.A OD1 no hydrogen 2.859 N/A LYS 375.A N ASP 371.A OD1 no hydrogen 2.858 N/A VAL 377.A N ALA 369.A O no hydrogen 2.885 N/A TYR 379.A N SER 367.A O no hydrogen 3.095 N/A TYR 379.A OH SER 367.A OG no hydrogen 3.369 N/A THR 381.A N ASN 365.A O no hydrogen 3.188 N/A THR 381.A OG1 GLU 477.A OE1 no hydrogen 3.502 N/A THR 381.A OG1 GLU 477.A OE2 no hydrogen 3.003 N/A ARG 382.A NE ASP 383.A O no hydrogen 3.003 N/A THR 385.A N ASP 383.A OD1 no hydrogen 2.711 N/A THR 385.A OG1 ASP 383.A OD1 no hydrogen 2.515 N/A LEU 388.A N PRO 384.A O no hydrogen 2.951 N/A ALA 389.A N THR 385.A O no hydrogen 2.975 N/A ARG 390.A N THR 386.A O no hydrogen 3.042 N/A ARG 390.A NE VAL 144.A O no hydrogen 2.974 N/A ARG 390.A NH2 VAL 144.A O no hydrogen 3.197 N/A ALA 391.A N PRO 387.A O no hydrogen 3.032 N/A ALA 392.A N LEU 388.A O no hydrogen 2.930 N/A TRP 393.A N ALA 389.A O no hydrogen 2.979 N/A GLU 394.A N ARG 390.A O no hydrogen 2.788 N/A THR 395.A N ALA 392.A O no hydrogen 2.714 N/A THR 395.A OG1 ALA 391.A O no hydrogen 2.606 N/A THR 395.A OG1 HIS 424.A NE2 no hydrogen 3.217 N/A ALA 396.A N ALA 392.A O no hydrogen 2.903 N/A ARG 397.A N TRP 393.A O no hydrogen 2.928 N/A ARG 397.A NH2 LYS 20.A O no hydrogen 3.300 N/A THR 399.A OG1 ILE 401.A O no hydrogen 2.981 N/A ASN 402.A N ASP 440.A O no hydrogen 2.944 N/A SER 403.A N GLU 394.A OE2 no hydrogen 3.066 N/A SER 403.A OG GLU 394.A OE1 no hydrogen 3.022 N/A SER 403.A OG GLU 394.A OE2 no hydrogen 2.677 N/A TRP 404.A N GLU 394.A OE1 no hydrogen 3.124 N/A GLY 406.A N ASN 402.A O no hydrogen 3.248 N/A ASN 407.A N SER 403.A O no hydrogen 2.659 N/A ILE 408.A N TRP 404.A O no hydrogen 2.797 N/A ILE 409.A N LEU 405.A O no hydrogen 3.224 N/A MET 410.A N GLY 406.A O no hydrogen 3.089 N/A TYR 411.A N ASN 407.A O no hydrogen 2.830 N/A TYR 411.A OH SER 364.A OG no hydrogen 2.875 N/A THR 414.A N TYR 411.A O no hydrogen 2.964 N/A THR 414.A OG1 TYR 411.A O no hydrogen 2.662 N/A TRP 416.A NE1 THR 381.A OG1 no hydrogen 3.295 N/A ALA 417.A N THR 414.A OG1 no hydrogen 3.078 N/A ARG 418.A N THR 414.A O no hydrogen 3.435 N/A ARG 418.A NH1 LEU 470.A O no hydrogen 3.077 N/A ARG 418.A NH1 TYR 473.A OH no hydrogen 3.404 N/A MET 419.A N LEU 415.A O no hydrogen 3.149 N/A ILE 420.A N TRP 416.A O no hydrogen 3.006 N/A MET 422.A N ALA 417.A O no hydrogen 2.863 N/A THR 423.A OG1 ARG 418.A O no hydrogen 3.378 N/A THR 423.A OG1 MET 419.A O no hydrogen 2.606 N/A HIS 424.A N ILE 420.A O no hydrogen 2.662 N/A HIS 424.A NE2 THR 395.A OG1 no hydrogen 3.217 N/A PHE 425.A N LEU 421.A O no hydrogen 2.977 N/A PHE 426.A N MET 422.A O no hydrogen 2.881 N/A SER 427.A N THR 423.A O no hydrogen 3.054 N/A ILE 428.A N HIS 424.A O no hydrogen 3.055 N/A LEU 429.A N PHE 425.A O no hydrogen 2.732 N/A LEU 430.A N PHE 426.A O no hydrogen 2.974 N/A ALA 431.A N SER 427.A O no hydrogen 3.049 N/A GLN 432.A N LEU 429.A O no hydrogen 3.348 N/A GLU 433.A N LEU 430.A O no hydrogen 2.769 N/A GLN 434.A N LEU 429.A O no hydrogen 2.948 N/A LEU 435.A N GLU 433.A OE1 no hydrogen 3.116 N/A LYS 437.A N GLN 434.A O no hydrogen 3.098 N/A LEU 439.A N ILE 450.A O no hydrogen 2.811 N/A CYS 441.A N TYR 448.A O no hydrogen 2.948 N/A ILE 443.A N ALA 446.A O no hydrogen 2.999 N/A TYR 444.A OH TYR 191.A O no hydrogen 2.696 N/A ALA 446.A N ILE 443.A O no hydrogen 3.004 N/A CYS 447.A N ILE 556.A O no hydrogen 3.052 N/A TYR 448.A N CYS 441.A O no hydrogen 2.787 N/A TYR 448.A OH GLY 545.A O no hydrogen 3.406 N/A ILE 450.A N LEU 439.A O no hydrogen 2.709 N/A ASP 454.A N GLU 451.A O no hydrogen 2.840 N/A LEU 455.A N PRO 452.A O no hydrogen 3.331 N/A GLN 457.A N GLN 457.A OE1 no hydrogen 2.662 N/A GLN 457.A NE2 ASP 454.A OD1 no hydrogen 2.590 N/A ILE 458.A N ASP 454.A O no hydrogen 3.129 N/A ILE 459.A N LEU 455.A O no hydrogen 2.746 N/A GLU 460.A N PRO 456.A O no hydrogen 2.890 N/A ARG 461.A N GLN 457.A O no hydrogen 2.787 N/A ARG 461.A NH1 ALA 538.A O no hydrogen 2.675 N/A ARG 461.A NH1 LEU 541.A O no hydrogen 2.851 N/A ARG 461.A NH2 LEU 541.A O no hydrogen 3.413 N/A LEU 462.A N ILE 458.A O no hydrogen 2.855 N/A HIS 463.A N ILE 459.A O no hydrogen 2.740 N/A HIS 463.A NE2 ILE 409.A O no hydrogen 2.926 N/A GLY 464.A N ILE 459.A O no hydrogen 3.144 N/A SER 466.A OG GLY 464.A O no hydrogen 3.553 N/A ALA 467.A N GLY 464.A O no hydrogen 2.717 N/A PHE 468.A N LEU 465.A O no hydrogen 2.892 N/A THR 469.A N SER 466.A O no hydrogen 2.623 N/A THR 469.A OG1 SER 466.A O no hydrogen 3.334 N/A HIS 471.A N HIS 370.A O no hydrogen 2.724 N/A TYR 473.A OH PRO 413.A O no hydrogen 2.682 N/A SER 474.A OG GLU 357.A OE2 no hydrogen 3.032 N/A GLU 477.A N SER 474.A OG no hydrogen 3.092 N/A ILE 478.A N SER 474.A O no hydrogen 3.141 N/A ASN 479.A N PRO 475.A O no hydrogen 2.987 N/A ARG 480.A N GLY 476.A O no hydrogen 3.112 N/A ARG 480.A NH1 ASN 365.A OD1 no hydrogen 3.136 N/A ARG 480.A NH2 ASN 365.A OD1 no hydrogen 2.967 N/A VAL 481.A N GLU 477.A O no hydrogen 3.137 N/A ALA 482.A N ILE 478.A O no hydrogen 2.811 N/A SER 483.A N ASN 479.A O no hydrogen 2.712 N/A CYS 484.A N ARG 480.A O no hydrogen 2.726 N/A LEU 485.A N VAL 481.A O no hydrogen 2.794 N/A ARG 486.A N ALA 482.A O no hydrogen 2.878 N/A LYS 487.A N SER 483.A O no hydrogen 2.919 N/A LYS 487.A NZ THR 385.A OG1 no hydrogen 3.389 N/A LEU 488.A N CYS 484.A O no hydrogen 3.085 N/A VAL 490.A N LEU 485.A O no hydrogen 2.804 N/A THR 495.A OG1 PRO 492.A O no hydrogen 3.544 N/A TRP 496.A N PRO 492.A O no hydrogen 3.301 N/A ARG 497.A N LEU 493.A O no hydrogen 2.800 N/A HIS 498.A N ARG 494.A O no hydrogen 3.262 N/A ARG 499.A N THR 495.A O no hydrogen 3.048 N/A ARG 499.A NH1 SER 29.A O no hydrogen 3.257 N/A ALA 500.A N TRP 496.A O no hydrogen 2.759 N/A ARG 501.A N ARG 497.A O no hydrogen 2.996 N/A SER 502.A N HIS 498.A O no hydrogen 3.420 N/A VAL 503.A N ARG 499.A O no hydrogen 3.012 N/A ARG 504.A N ALA 500.A O no hydrogen 2.615 N/A ALA 505.A N ARG 501.A O no hydrogen 3.142 N/A LYS 506.A N SER 502.A O no hydrogen 3.259 N/A LYS 506.A NZ SER 502.A O no hydrogen 3.445 N/A LEU 507.A N ARG 504.A O no hydrogen 2.741 N/A LEU 508.A N ARG 504.A O no hydrogen 2.786 N/A SER 509.A N ALA 505.A O no hydrogen 2.890 N/A GLN 510.A NE2 GLU 433.A OE2 no hydrogen 3.384 N/A ARG 513.A NH1 GLU 451.A OE1 no hydrogen 3.385 N/A THR 516.A N GLY 512.A O no hydrogen 2.936 N/A THR 516.A OG1 GLY 512.A O no hydrogen 3.353 N/A CYS 517.A N ARG 513.A O no hydrogen 2.877 N/A CYS 517.A SG ARG 513.A O no hydrogen 3.754 N/A GLY 518.A N ALA 514.A O no hydrogen 3.021 N/A ARG 519.A N ALA 515.A O no hydrogen 2.882 N/A TYR 520.A N THR 516.A O no hydrogen 2.868 N/A TYR 520.A OH THR 533.A O no hydrogen 2.692 N/A LEU 521.A N CYS 517.A O no hydrogen 2.834 N/A ASN 523.A N TYR 520.A O no hydrogen 3.467 N/A ALA 525.A N PHE 522.A O no hydrogen 2.827 N/A ILE 535.A N GLU 460.A OE1 no hydrogen 2.954 N/A ALA 538.A N ILE 535.A O no hydrogen 3.000 N/A GLN 540.A N ALA 537.A O no hydrogen 2.960 N/A GLN 540.A NE2 ALA 537.A O no hydrogen 3.692 N/A LEU 541.A N ALA 538.A O no hydrogen 2.986 N/A SER 544.A OG ASP 542.A OD1 no hydrogen 2.814 N/A SER 544.A OG ASP 542.A OD2 no hydrogen 2.931 N/A TRP 546.A N LEU 543.A O no hydrogen 3.392 N/A GLY 550.A N TYR 187.A OH no hydrogen 3.001 N/A TYR 551.A N TYR 444.A O no hydrogen 2.887 N/A TYR 551.A OH SER 176.A OG no hydrogen 2.586 N/A GLY 554.A N TYR 551.A O no hydrogen 2.539 N/A TYR 557.A N LEU 91.A O no hydrogen 2.893 N/A HIS 558.A N CYS 447.A O no hydrogen 3.162 N/A