Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ejx_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A NH2 VAL 16.A O no hydrogen 2.611 N/A ARG 5.A NH2 ASP 18.A OD1 no hydrogen 2.818 N/A GLN 6.A NE2 ASP 10.A OD2 no hydrogen 3.314 N/A ALA 7.A N SER 4.A OG no hydrogen 3.197 N/A TYR 8.A N SER 4.A O no hydrogen 2.988 N/A TYR 8.A OH GLU 41.A OE2 no hydrogen 2.618 N/A ALA 9.A N ARG 5.A O no hydrogen 2.703 N/A ASP 10.A N GLN 6.A O no hydrogen 2.792 N/A MET 11.A N ALA 7.A O no hydrogen 2.832 N/A PHE 12.A N TYR 8.A O no hydrogen 2.910 N/A GLY 13.A N ALA 9.A O no hydrogen 2.891 N/A THR 15.A N ASP 18.A OD2 no hydrogen 2.755 N/A THR 15.A OG1 ASP 34.A OD2 no hydrogen 2.435 N/A THR 15.A OG1 TYR 38.A OH no hydrogen 2.732 N/A GLY 17.A N VAL 31.A O no hydrogen 3.020 N/A ASP 18.A N THR 15.A O no hydrogen 2.953 N/A LYS 19.A NZ ASP 382.A O no hydrogen 2.812 N/A VAL 20.A N ILE 29.A O no hydrogen 2.777 N/A ARG 21.A NH1 THR 25.A O no hydrogen 2.731 N/A ARG 21.A NH1 GLU 26.A OE2 no hydrogen 2.590 N/A LEU 22.A N LEU 27.A O no hydrogen 2.908 N/A ALA 23.A N PRO 425.A O no hydrogen 2.731 N/A THR 25.A N LEU 22.A O no hydrogen 3.070 N/A THR 25.A OG1 LEU 22.A O no hydrogen 2.784 N/A GLU 26.A N HIS 367.A ND1 no hydrogen 3.034 N/A LEU 27.A N THR 25.A OG1 no hydrogen 2.982 N/A TRP 28.A N ASP 384.A OD2 no hydrogen 2.904 N/A ILE 29.A N VAL 20.A O no hydrogen 2.966 N/A GLU 30.A N ASN 385.A OD1 no hydrogen 2.860 N/A VAL 31.A N ASP 18.A O no hydrogen 2.942 N/A GLU 32.A N ILE 80.A O no hydrogen 2.851 N/A ASP 34.A N ASP 33.A OD1 no hydrogen 3.124 N/A LEU 35.A N LYS 82.A O no hydrogen 2.783 N/A THR 36.A N ASP 34.A OD1 no hydrogen 3.057 N/A THR 36.A OG1 THR 37.A O no hydrogen 3.468 N/A THR 37.A OG1 ASN 106.A OD1 no hydrogen 2.662 N/A TYR 38.A OH THR 15.A OG1 no hydrogen 2.732 N/A GLY 39.A N GLU 41.A OE1 no hydrogen 2.954 N/A GLY 39.A N GLU 41.A OE2 no hydrogen 3.218 N/A GLU 40.A N THR 37.A O no hydrogen 2.794 N/A LYS 43.A NZ MET 11.A O no hydrogen 2.913 N/A LYS 48.A N GLY 45.A O no hydrogen 2.986 N/A ILE 50.A N LYS 43.A O no hydrogen 3.256 N/A ARG 51.A N VAL 49.A O no hydrogen 2.944 N/A ARG 51.A NE LYS 48.A O no hydrogen 2.693 N/A GLY 53.A N GLN 56.A O no hydrogen 2.756 N/A MET 54.A N ARG 51.A O no hydrogen 2.977 N/A GLY 55.A N VAL 49.A O no hydrogen 2.658 N/A GLN 56.A N ARG 51.A O no hydrogen 3.187 N/A GLY 57.A N ILE 111.A O no hydrogen 2.895 N/A GLN 58.A NE2 ASP 52.A OD1 no hydrogen 2.941 N/A ASP 63.A N LEU 60.A O no hydrogen 2.786 N/A CYS 64.A N ALA 61.A O no hydrogen 3.143 N/A CYS 64.A SG LEU 60.A O no hydrogen 3.574 N/A CYS 64.A SG ALA 61.A O no hydrogen 4.001 N/A VAL 65.A N PRO 110.A O no hydrogen 3.129 N/A ASP 66.A N VAL 87.A O no hydrogen 2.903 N/A LEU 67.A N VAL 87.A O no hydrogen 3.019 N/A VAL 68.A N GLU 116.A O no hydrogen 3.073 N/A LEU 69.A N ILE 85.A O no hydrogen 2.943 N/A THR 70.A N ILE 118.A O no hydrogen 2.905 N/A THR 70.A OG1 ILE 118.A O no hydrogen 3.516 N/A THR 70.A OG1 GLU 121.A OE1 no hydrogen 2.812 N/A ASN 71.A N ASP 84.A OD1 no hydrogen 2.852 N/A ASN 71.A ND2 VAL 42.A O no hydrogen 2.992 N/A ASN 71.A ND2 GLU 121.A OE1 no hydrogen 2.701 N/A ALA 72.A N ALA 83.A O no hydrogen 2.937 N/A LEU 73.A N LYS 123.A O no hydrogen 3.186 N/A ILE 74.A N VAL 81.A O no hydrogen 2.797 N/A VAL 75.A N VAL 125.A O no hydrogen 3.024 N/A ASP 76.A N GLY 79.A O no hydrogen 3.066 N/A HIS 77.A NE2 GLU 413.A OE1 no hydrogen 3.174 N/A TRP 78.A NE1 ILE 412.A O no hydrogen 3.132 N/A GLY 79.A N ASP 76.A O no hydrogen 3.258 N/A ILE 80.A N GLU 32.A OE1 no hydrogen 2.914 N/A VAL 81.A N ILE 74.A O no hydrogen 3.053 N/A LYS 82.A N ASP 33.A O no hydrogen 2.797 N/A LYS 82.A NZ PHE 12.A O no hydrogen 2.830 N/A LYS 82.A NZ PRO 14.A O no hydrogen 2.878 N/A ALA 83.A N ALA 72.A O no hydrogen 2.939 N/A ASP 84.A N GLY 96.A O no hydrogen 2.923 N/A ILE 85.A N LEU 69.A O no hydrogen 2.997 N/A GLY 86.A N ALA 94.A O no hydrogen 3.000 N/A VAL 87.A N LEU 67.A O no hydrogen 2.799 N/A LYS 88.A N ARG 91.A O no hydrogen 2.828 N/A LYS 88.A NZ ALA 62.A O no hydrogen 2.547 N/A ASP 89.A N ASP 66.A OD2 no hydrogen 2.972 N/A ARG 91.A N LYS 88.A O no hydrogen 2.910 N/A ARG 91.A NE GLY 415.A O no hydrogen 3.168 N/A ARG 91.A NH1 GLU 408.A OE1 no hydrogen 3.021 N/A ARG 91.A NH2 GLU 408.A OE1 no hydrogen 2.667 N/A ARG 91.A NH2 GLY 415.A O no hydrogen 3.097 N/A ILE 92.A N LYS 416.A O no hydrogen 2.796 N/A PHE 93.A N GLY 86.A O no hydrogen 2.867 N/A ALA 94.A N GLY 86.A O no hydrogen 3.502 N/A GLY 96.A N ASP 84.A O no hydrogen 2.933 N/A LYS 97.A N THR 108.A OG1 no hydrogen 3.095 N/A LYS 97.A NZ GLU 40.A O no hydrogen 2.534 N/A LYS 97.A NZ ALA 98.A O no hydrogen 2.966 N/A ALA 98.A N ASP 84.A OD2 no hydrogen 2.706 N/A GLY 99.A N ILE 109.A O no hydrogen 2.828 N/A ASN 100.A N GLN 104.A OE1 no hydrogen 2.884 N/A ASN 100.A ND2 MET 54.A O no hydrogen 2.937 N/A ASP 102.A N ASN 100.A OD1 no hydrogen 3.090 N/A ILE 103.A N ASN 100.A O no hydrogen 3.343 N/A GLN 104.A N ASN 100.A O no hydrogen 2.885 N/A GLN 104.A NE2 GLU 40.A O no hydrogen 3.230 N/A GLN 104.A NE2 GLU 40.A OE1 no hydrogen 3.069 N/A THR 108.A N LYS 97.A O no hydrogen 2.656 N/A ILE 109.A N LYS 97.A O no hydrogen 3.006 N/A ILE 111.A N GLY 99.A O no hydrogen 2.954 N/A GLY 112.A N THR 115.A OG1 no hydrogen 3.004 N/A THR 115.A N GLY 112.A O no hydrogen 3.090 N/A THR 115.A OG1 VAL 65.A O no hydrogen 2.696 N/A THR 115.A OG1 GLY 112.A O no hydrogen 3.408 N/A GLU 116.A N ASP 66.A O no hydrogen 2.828 N/A VAL 117.A N GLU 116.A OE2 no hydrogen 2.830 N/A ILE 118.A N VAL 68.A O no hydrogen 2.943 N/A ALA 120.A N THR 70.A O no hydrogen 2.649 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.965 N/A LYS 123.A N ALA 120.A O no hydrogen 2.738 N/A ILE 124.A N TRP 423.A O no hydrogen 2.891 N/A VAL 125.A N LEU 73.A O no hydrogen 2.936 N/A THR 126.A N VAL 421.A O no hydrogen 2.921 N/A THR 126.A OG1 ALA 127.A O no hydrogen 3.055 N/A GLY 128.A N ASP 419.A O no hydrogen 3.339 N/A GLY 129.A N GLY 149.A O no hydrogen 2.852 N/A ILE 130.A N TYR 395.A O no hydrogen 2.812 N/A ASP 131.A N THR 152.A O no hydrogen 3.028 N/A HIS 133.A N ASP 131.A OD1 no hydrogen 3.101 N/A ILE 134.A N VAL 154.A O no hydrogen 3.040 N/A HIS 135.A N SER 349.A OG.A no hydrogen 2.735 N/A HIS 135.A ND1 THR 164.A O no hydrogen 2.728 N/A TRP 136.A N GLY 156.A O no hydrogen 2.891 N/A ILE 137.A N HIS 135.A O no hydrogen 2.700 N/A GLN 140.A N GLN 140.A OE1 no hydrogen 2.831 N/A GLN 141.A N CYS 138.A O no hydrogen 3.375 N/A GLN 141.A NE2 HIS 135.A O no hydrogen 3.292 N/A GLN 141.A NE2 SER 349.A OG.A no hydrogen 2.636 N/A ALA 142.A N PRO 139.A O no hydrogen 3.028 N/A GLU 144.A N GLN 140.A O no hydrogen 3.256 N/A ALA 145.A N GLN 141.A O no hydrogen 2.889 N/A LEU 146.A N ALA 142.A O no hydrogen 2.897 N/A VAL 147.A N GLU 143.A O no hydrogen 2.816 N/A SER 148.A N GLU 144.A O no hydrogen 3.360 N/A SER 148.A N ALA 145.A O no hydrogen 3.049 N/A SER 148.A OG ALA 145.A O no hydrogen 2.849 N/A GLY 149.A N LEU 146.A O no hydrogen 2.868 N/A VAL 150.A N ALA 145.A O no hydrogen 2.935 N/A THR 151.A N GLY 129.A O no hydrogen 2.825 N/A THR 151.A OG1 GLY 129.A O no hydrogen 3.543 N/A THR 152.A N GLY 129.A O no hydrogen 3.159 N/A MET 153.A N ASN 189.A O no hydrogen 2.828 N/A VAL 154.A N ASP 131.A O no hydrogen 2.830 N/A GLY 155.A N GLY 191.A O no hydrogen 3.207 N/A GLY 156.A N ILE 134.A O no hydrogen 3.137 N/A GLY 157.A N THR 170.A OG1 no hydrogen 2.873 N/A THR 158.A N THR 164.A OG1 no hydrogen 2.792 N/A ALA 161.A N GLY 159.A O no hydrogen 2.925 N/A HIS 165.A N ALA 161.A O no hydrogen 2.855 N/A ALA 166.A N ALA 162.A O no hydrogen 3.163 N/A THR 167.A N GLY 163.A O no hydrogen 2.904 N/A THR 167.A OG1 GLY 163.A O no hydrogen 2.743 N/A CYS 169.A SG THR 167.A OG1 no hydrogen 3.255 N/A CYS 169.A SG GLY 194.A O no hydrogen 3.951 N/A THR 170.A N LEU 193.A O no hydrogen 2.982 N/A THR 170.A OG1 GLY 157.A O no hydrogen 3.000 N/A GLY 172.A N GLN 207.A OE1 no hydrogen 3.341 N/A ILE 176.A N GLY 172.A O no hydrogen 2.867 N/A SER 177.A N PRO 173.A O no hydrogen 2.899 N/A SER 177.A OG PRO 173.A O no hydrogen 2.803 N/A ARG 178.A N TRP 174.A O no hydrogen 2.973 N/A ARG 178.A NE GLN 181.A OE1 no hydrogen 2.985 N/A ARG 178.A NH1 GLN 181.A OE1 no hydrogen 2.891 N/A MET 179.A N TYR 175.A O no hydrogen 2.899 N/A LEU 180.A N ILE 176.A O no hydrogen 2.856 N/A GLN 181.A N SER 177.A O no hydrogen 3.102 N/A GLN 181.A NE2 LEU 493.A O no hydrogen 3.081 N/A ALA 182.A N ARG 178.A O no hydrogen 2.922 N/A ALA 183.A N MET 179.A O no hydrogen 2.930 N/A ASP 184.A N GLN 181.A O no hydrogen 3.249 N/A SER 185.A N ALA 182.A O no hydrogen 2.947 N/A SER 185.A OG ALA 182.A O no hydrogen 3.463 N/A LEU 186.A N ALA 183.A O no hydrogen 2.911 N/A VAL 188.A N LEU 186.A O no hydrogen 2.939 N/A ASN 189.A N THR 151.A O no hydrogen 2.766 N/A ASN 189.A ND2 THR 152.A OG1 no hydrogen 2.712 N/A ASN 189.A ND2 ASP 419.A OD2 no hydrogen 2.774 N/A ILE 190.A N LEU 477.A O no hydrogen 3.070 N/A GLY 191.A N MET 153.A O no hydrogen 3.181 N/A LEU 193.A N GLY 155.A O no hydrogen 2.855 N/A GLY 194.A N GLY 214.A O no hydrogen 3.053 N/A LYS 195.A N GLN 207.A OE1 no hydrogen 2.816 N/A ASN 197.A ND2 HIS 217.A O no hydrogen 2.931 N/A ASN 197.A ND2 GLY 221.A O no hydrogen 2.840 N/A ALA 203.A N GLN 200.A O no hydrogen 3.191 N/A LEU 204.A N PRO 201.A O no hydrogen 3.118 N/A ARG 205.A N PRO 201.A O no hydrogen 3.033 N/A ARG 205.A NE GLU 236.A OE1 no hydrogen 3.536 N/A ARG 205.A NE GLU 236.A OE2 no hydrogen 3.132 N/A ARG 205.A NH1 ASP 202.A OD1 no hydrogen 2.759 N/A ARG 205.A NH2 GLU 236.A OE1 no hydrogen 3.261 N/A GLU 206.A N ASP 202.A O no hydrogen 2.987 N/A GLN 207.A NE2 LYS 195.A O no hydrogen 2.951 N/A GLN 207.A NE2 ALA 203.A O no hydrogen 3.193 N/A VAL 208.A N LEU 204.A O no hydrogen 2.907 N/A ALA 209.A N ARG 205.A O no hydrogen 2.804 N/A ALA 210.A N GLU 206.A O no hydrogen 2.982 N/A GLY 211.A N GLN 207.A O no hydrogen 3.181 N/A GLY 211.A N VAL 208.A O no hydrogen 2.915 N/A VAL 212.A N GLN 207.A O no hydrogen 3.449 N/A ILE 213.A N LEU 192.A O no hydrogen 2.801 N/A LEU 215.A N GLN 240.A O no hydrogen 2.692 N/A HIS 217.A N ASN 197.A OD1 no hydrogen 3.293 N/A ASP 219.A N HIS 217.A ND1 no hydrogen 2.852 N/A TRP 220.A N HIS 217.A O no hydrogen 3.024 N/A TRP 220.A NE1 THR 167.A OG1 no hydrogen 2.953 N/A GLY 221.A N GLU 218.A O no hydrogen 2.928 N/A ALA 226.A N THR 223.A OG1 no hydrogen 3.220 N/A ILE 227.A N THR 223.A O no hydrogen 2.894 N/A ASP 228.A N PRO 224.A O no hydrogen 2.876 N/A CYS 229.A N ALA 225.A O no hydrogen 2.939 N/A ALA 230.A N ALA 226.A O no hydrogen 3.005 N/A LEU 231.A N ILE 227.A O no hydrogen 2.898 N/A THR 232.A N ASP 228.A O no hydrogen 3.046 N/A THR 232.A OG1 ASP 228.A O no hydrogen 3.038 N/A VAL 233.A N CYS 229.A O no hydrogen 3.019 N/A ALA 234.A N ALA 230.A O no hydrogen 2.889 N/A ASP 235.A N LEU 231.A O no hydrogen 2.822 N/A GLU 236.A N THR 232.A O no hydrogen 3.146 N/A MET 237.A N VAL 233.A O no hydrogen 2.778 N/A ILE 239.A N ALA 234.A O no hydrogen 3.451 N/A GLN 240.A N ILE 213.A O no hydrogen 3.308 N/A GLN 240.A NE2 THR 402.A O no hydrogen 2.817 N/A VAL 241.A N GLN 240.A OE1 no hydrogen 2.794 N/A ALA 242.A N LEU 215.A O no hydrogen 2.922 N/A LEU 243.A N HIS 267.A O no hydrogen 2.725 N/A HIS 244.A N ILE 216.A O no hydrogen 2.758 N/A HIS 244.A NE2 GLU 218.A OE2 no hydrogen 2.746 N/A THR 247.A N GLU 218.A OE1 no hydrogen 3.155 N/A THR 247.A OG1 GLU 218.A OE1 no hydrogen 3.427 N/A THR 247.A OG1 GLU 218.A OE2 no hydrogen 2.565 N/A THR 247.A OG1 SER 245.A O no hydrogen 3.499 N/A ASN 249.A N ASP 246.A O no hydrogen 3.014 N/A ASN 249.A ND2 ALA 279.A O no hydrogen 2.925 N/A GLU 250.A N ASP 246.A OD1 no hydrogen 3.113 N/A SER 251.A N ASP 246.A OD2 no hydrogen 2.995 N/A SER 251.A OG ASP 246.A OD2 no hydrogen 2.838 N/A PHE 253.A N ASP 256.A OD2 no hydrogen 2.548 N/A GLU 255.A N GLU 255.A OE2 no hydrogen 2.715 N/A ASP 256.A N PHE 253.A O no hydrogen 2.885 N/A THR 257.A N PHE 253.A O no hydrogen 3.242 N/A THR 257.A OG1 HIS 278.A NE2 no hydrogen 2.450 N/A LEU 258.A N VAL 254.A O no hydrogen 2.956 N/A ALA 259.A N GLU 255.A O no hydrogen 2.714 N/A ALA 260.A N ASP 256.A O no hydrogen 2.819 N/A ILE 261.A N THR 257.A O no hydrogen 2.969 N/A GLY 262.A N LEU 258.A O no hydrogen 3.256 N/A ARG 264.A N ILE 261.A O no hydrogen 2.837 N/A ARG 264.A NE ILE 261.A O no hydrogen 2.908 N/A ARG 264.A NH1 ASP 228.A OD2 no hydrogen 3.225 N/A ARG 264.A NH1 THR 232.A OG1 no hydrogen 3.200 N/A ARG 264.A NH2 ASP 228.A OD2 no hydrogen 2.734 N/A ARG 264.A NH2 ALA 260.A O no hydrogen 2.917 N/A THR 265.A OG1 ARG 506.A O no hydrogen 2.590 N/A ILE 266.A N ASN 290.A O no hydrogen 3.093 N/A HIS 267.A N VAL 241.A O no hydrogen 2.813 N/A HIS 267.A ND1 HIS 403.A NE2 no hydrogen 2.949 N/A HIS 267.A NE2 SER 294.A OG no hydrogen 2.561 N/A THR 268.A N LEU 292.A O no hydrogen 3.122 N/A THR 268.A OG1 THR 271.A OG1 no hydrogen 2.826 N/A PHE 269.A N LEU 243.A O no hydrogen 3.040 N/A HIS 270.A ND1 HIS 270.A O no hydrogen 3.038 N/A THR 271.A N SER 294.A O no hydrogen 2.905 N/A THR 271.A OG1 THR 268.A O no hydrogen 2.853 N/A THR 271.A OG1 THR 268.A OG1 no hydrogen 2.826 N/A THR 271.A OG1 SER 294.A O no hydrogen 3.024 N/A GLY 273.A N HIS 270.A O no hydrogen 2.818 N/A ALA 274.A N GLU 272.A OE1 no hydrogen 2.591 N/A GLY 276.A N GLY 273.A O no hydrogen 3.000 N/A GLY 277.A N THR 247.A OG1 no hydrogen 2.914 N/A HIS 278.A N SER 245.A OG no hydrogen 3.172 N/A HIS 278.A ND1 ASN 249.A OD1 no hydrogen 2.667 N/A HIS 278.A NE2 THR 257.A OG1 no hydrogen 2.450 N/A ALA 279.A N THR 247.A O no hydrogen 3.202 N/A ILE 282.A N HIS 278.A O no hydrogen 3.080 N/A THR 284.A N ASP 281.A O no hydrogen 3.010 N/A THR 284.A OG1 ASP 281.A O no hydrogen 2.655 N/A ALA 285.A N ILE 282.A O no hydrogen 2.941 N/A CYS 286.A N ILE 283.A O no hydrogen 3.211 N/A CYS 286.A SG ILE 283.A O no hydrogen 3.400 N/A ALA 287.A N THR 284.A O no hydrogen 3.282 N/A HIS 288.A N ALA 285.A O no hydrogen 3.060 N/A ASN 290.A ND2 ARG 264.A O no hydrogen 2.621 N/A ILE 291.A N HIS 288.A O no hydrogen 3.241 N/A LEU 292.A N ILE 266.A O no hydrogen 3.011 N/A SER 294.A N THR 268.A O no hydrogen 2.997 N/A SER 294.A OG HIS 267.A NE2 no hydrogen 2.561 N/A SER 294.A OG THR 268.A O no hydrogen 3.254 N/A SER 295.A N LEU 344.A O no hydrogen 3.085 N/A SER 295.A OG GLU 333.A OE1 no hydrogen 2.407 N/A SER 295.A OG HIS 337.A NE2 no hydrogen 2.714 N/A ASN 297.A N SER 347.A O no hydrogen 3.335 N/A ASN 297.A ND2 ARG 354.A O no hydrogen 2.926 N/A THR 299.A OG1 GLU 333.A OE1 no hydrogen 3.568 N/A THR 299.A OG1 GLU 333.A OE2 no hydrogen 2.696 N/A LEU 300.A N ASN 297.A O no hydrogen 3.008 N/A TYR 302.A N ASP 334.A OD2 no hydrogen 2.762 N/A THR 303.A N THR 306.A OG1 no hydrogen 2.784 N/A THR 303.A OG1 THR 306.A OG1 no hydrogen 3.147 N/A LEU 304.A N ALA 543.A O no hydrogen 2.707 N/A ASN 305.A N THR 303.A OG1 no hydrogen 3.359 N/A THR 306.A N THR 303.A O no hydrogen 3.147 N/A THR 306.A OG1 THR 303.A O no hydrogen 3.200 N/A THR 306.A OG1 THR 303.A OG1 no hydrogen 3.147 N/A GLU 309.A N ASN 305.A O no hydrogen 2.952 N/A HIS 310.A N THR 306.A O no hydrogen 2.983 N/A HIS 310.A ND1 THR 306.A O no hydrogen 3.042 N/A LEU 311.A N ILE 307.A O no hydrogen 2.763 N/A ASP 312.A N ASP 308.A O no hydrogen 3.092 N/A MET 313.A N GLU 309.A O no hydrogen 2.752 N/A LEU 314.A N HIS 310.A O no hydrogen 2.760 N/A MET 315.A N LEU 311.A O no hydrogen 3.010 N/A VAL 316.A N ASP 312.A O no hydrogen 2.726 N/A CYS 317.A N MET 313.A O no hydrogen 2.855 N/A CYS 317.A SG MET 313.A O no hydrogen 3.279 N/A GLU 322.A N VAL 318.A O no hydrogen 3.017 N/A SER 323.A N ALA 319.A O no hydrogen 3.027 N/A SER 323.A N PHE 320.A O no hydrogen 2.948 N/A SER 323.A OG ALA 319.A O no hydrogen 3.405 N/A SER 323.A OG PHE 320.A O no hydrogen 2.717 N/A ARG 324.A N PHE 320.A O no hydrogen 3.096 N/A ARG 324.A N ALA 321.A O no hydrogen 3.265 N/A ARG 324.A NE ALA 274.A O no hydrogen 2.703 N/A ARG 324.A NH2 ALA 274.A O no hydrogen 2.945 N/A ILE 325.A N ALA 321.A O no hydrogen 3.120 N/A ARG 326.A NE THR 329.A OG1 no hydrogen 2.993 N/A ARG 326.A NH1 SER 323.A O no hydrogen 2.718 N/A ARG 326.A NH2 GLU 272.A O no hydrogen 2.878 N/A ARG 327.A NH1 TYR 302.A OH no hydrogen 3.030 N/A GLU 328.A N GLU 328.A OE1 no hydrogen 2.827 N/A THR 329.A OG1 GLU 272.A OE2 no hydrogen 2.526 N/A THR 329.A OG1 ARG 326.A O no hydrogen 3.431 N/A ILE 330.A N ARG 326.A O no hydrogen 2.957 N/A ALA 331.A N ARG 327.A O no hydrogen 2.591 N/A ALA 332.A N GLU 328.A O no hydrogen 3.287 N/A GLU 333.A N THR 329.A O no hydrogen 3.080 N/A LEU 336.A N ALA 332.A O no hydrogen 2.972 N/A HIS 337.A N GLU 333.A O no hydrogen 2.959 N/A HIS 337.A NE2 SER 295.A OG no hydrogen 2.714 N/A ASP 338.A N ASP 334.A O no hydrogen 2.951 N/A LEU 339.A N VAL 335.A O no hydrogen 2.872 N/A GLY 340.A N HIS 337.A O no hydrogen 3.064 N/A ALA 341.A N LEU 336.A O no hydrogen 2.918 N/A PHE 342.A N LEU 336.A O no hydrogen 3.354 N/A SER 343.A N PRO 293.A O no hydrogen 3.015 N/A SER 343.A OG ASN 516.A O no hydrogen 2.719 N/A LEU 344.A N PRO 293.A O no hydrogen 3.330 N/A THR 345.A N LYS 394.A O no hydrogen 3.033 N/A THR 345.A OG1 THR 362.A OG1 no hydrogen 2.814 N/A SER 346.A OG SER 295.A O no hydrogen 2.827 N/A SER 347.A N ASP 131.A OD1 no hydrogen 2.889 N/A SER 347.A OG ASP 131.A OD2 no hydrogen 2.639 N/A SER 347.A OG HIS 133.A O no hydrogen 3.216 N/A ASP 348.A N HIS 133.A O no hydrogen 2.952 N/A SER 349.A N HIS 133.A O no hydrogen 3.319 N/A SER 349.A OG.A HIS 135.A O no hydrogen 3.203 N/A GLN 350.A N GLY 353.A O no hydrogen 3.097 N/A GLN 350.A NE2 GLN 141.A OE1 no hydrogen 2.795 N/A ALA 351.A N ASP 348.A O no hydrogen 2.901 N/A ARG 354.A N ASN 297.A OD1 no hydrogen 2.923 N/A ARG 354.A NH2 GLU 309.A OE1 no hydrogen 2.712 N/A GLU 357.A N ARG 354.A O no hydrogen 3.111 N/A ARG 361.A N GLU 357.A O no hydrogen 3.087 N/A ARG 361.A NE GLU 357.A OE2 no hydrogen 2.671 N/A ARG 361.A NH1 ASN 297.A O no hydrogen 3.436 N/A ARG 361.A NH1 LEU 300.A O no hydrogen 2.977 N/A ARG 361.A NH2 GLU 357.A OE2 no hydrogen 2.870 N/A THR 362.A N VAL 358.A O no hydrogen 3.184 N/A THR 362.A OG1 THR 345.A OG1 no hydrogen 2.814 N/A THR 362.A OG1 VAL 358.A O no hydrogen 2.784 N/A TRP 363.A N ILE 359.A O no hydrogen 2.958 N/A TRP 363.A NE1 TYR 395.A OH no hydrogen 2.923 N/A GLN 364.A N LEU 360.A O no hydrogen 2.783 N/A GLN 364.A NE2 PRO 547.A O no hydrogen 3.026 N/A VAL 365.A N ARG 361.A O no hydrogen 2.894 N/A ALA 366.A N THR 362.A O no hydrogen 3.202 N/A HIS 367.A N TRP 363.A O no hydrogen 2.935 N/A ARG 368.A N GLN 364.A O no hydrogen 2.960 N/A ARG 368.A NH2 GLU 541.A O no hydrogen 2.903 N/A MET 369.A N VAL 365.A O no hydrogen 2.886 N/A LYS 370.A N ALA 366.A O no hydrogen 2.933 N/A LYS 370.A NZ GLU 26.A O no hydrogen 2.532 N/A LYS 370.A NZ ASP 384.A OD2 no hydrogen 2.994 N/A VAL 371.A N HIS 367.A O no hydrogen 2.796 N/A GLN 372.A N ARG 368.A O no hydrogen 3.035 N/A GLN 372.A NE2 ARG 368.A O no hydrogen 2.944 N/A ARG 373.A N MET 369.A O no hydrogen 2.677 N/A GLY 374.A N LYS 370.A O no hydrogen 2.890 N/A GLU 378.A N GLU 378.A OE1 no hydrogen 2.396 N/A GLU 379.A N LEU 376.A O no hydrogen 2.886 N/A ASN 383.A N GLY 381.A O no hydrogen 3.059 N/A ASP 384.A N TRP 28.A O no hydrogen 2.730 N/A ASN 385.A ND2 GLU 30.A O no hydrogen 2.884 N/A ASN 385.A ND2 GLU 32.A OE2 no hydrogen 3.415 N/A PHE 386.A N GLU 379.A OE2 no hydrogen 2.676 N/A ARG 387.A N GLU 379.A OE1 no hydrogen 2.970 N/A ARG 387.A NE ASP 338.A OD1 no hydrogen 2.880 N/A ARG 387.A NH1 GLY 374.A O no hydrogen 2.754 N/A ARG 387.A NH2 ASP 338.A OD1 no hydrogen 3.453 N/A ARG 387.A NH2 ASP 338.A OD2 no hydrogen 2.843 N/A ARG 387.A NH2 GLY 374.A O no hydrogen 2.656 N/A VAL 388.A N ASP 384.A O no hydrogen 2.887 N/A LYS 389.A N ASN 385.A O no hydrogen 2.976 N/A LYS 389.A NZ GLU 32.A OE1 no hydrogen 3.459 N/A LYS 389.A NZ GLU 32.A OE2 no hydrogen 2.690 N/A ARG 390.A N PHE 386.A O no hydrogen 2.779 N/A ARG 390.A NE HIS 515.A O no hydrogen 2.666 N/A ARG 390.A NH1 ASP 338.A O no hydrogen 2.860 N/A ARG 390.A NH2 GLU 378.A OE2 no hydrogen 3.395 N/A ARG 390.A NH2 HIS 515.A O no hydrogen 3.149 N/A TYR 391.A N ARG 387.A O no hydrogen 2.923 N/A TYR 391.A OH ASP 338.A OD1 no hydrogen 2.714 N/A ILE 392.A N VAL 388.A O no hydrogen 2.889 N/A ALA 393.A N LYS 389.A O no hydrogen 3.206 N/A LYS 394.A N TYR 391.A O no hydrogen 3.010 N/A LYS 394.A NZ HIS 337.A ND1 no hydrogen 3.116 N/A LYS 394.A NZ HIS 337.A O no hydrogen 2.803 N/A LYS 394.A NZ ASN 516.A OD1 no hydrogen 2.572 N/A TYR 395.A N ILE 392.A O no hydrogen 3.228 N/A THR 396.A N ALA 393.A O no hydrogen 3.471 N/A THR 396.A OG1 ILE 392.A O no hydrogen 2.820 N/A ASN 398.A N ALA 393.A O no hydrogen 2.993 N/A ASN 398.A ND2 SER 343.A O no hydrogen 3.065 N/A ASN 398.A ND2 VAL 514.A O no hydrogen 3.207 N/A ALA 400.A N THR 396.A O no hydrogen 3.313 N/A LEU 401.A N ILE 397.A O no hydrogen 2.915 N/A THR 402.A N ASN 398.A O no hydrogen 2.779 N/A THR 402.A OG1 ASN 398.A O no hydrogen 2.661 N/A HIS 403.A N PRO 399.A O no hydrogen 3.105 N/A HIS 403.A NE2 HIS 267.A ND1 no hydrogen 2.949 N/A GLY 404.A N LEU 401.A O no hydrogen 3.205 N/A ILE 405.A N ALA 400.A O no hydrogen 2.900 N/A GLU 408.A N ILE 405.A O no hydrogen 3.023 N/A VAL 409.A N ILE 405.A O no hydrogen 3.098 N/A SER 411.A OG GLU 413.A OE1 no hydrogen 2.413 N/A ILE 412.A N ASP 76.A OD2 no hydrogen 2.630 N/A GLY 415.A N ILE 92.A O no hydrogen 2.790 N/A LYS 416.A N GLU 413.A O no hydrogen 3.235 N/A LYS 416.A NZ ALA 406.A O no hydrogen 2.873 N/A LYS 416.A NZ VAL 409.A O no hydrogen 2.930 N/A LYS 416.A NZ SER 411.A OG no hydrogen 2.895 N/A LEU 417.A N GLU 408.A O no hydrogen 2.743 N/A ALA 418.A N GLY 90.A O no hydrogen 2.907 N/A ASP 419.A N LEU 417.A O no hydrogen 2.917 N/A LEU 420.A N ILE 436.A O no hydrogen 3.131 N/A VAL 421.A N THR 126.A O no hydrogen 2.897 N/A VAL 422.A N THR 434.A O no hydrogen 2.786 N/A TRP 423.A N ILE 124.A O no hydrogen 2.792 N/A TRP 423.A NE1 THR 126.A OG1 no hydrogen 3.053 N/A PHE 427.A N SER 424.A O no hydrogen 2.921 N/A PHE 428.A N PRO 425.A O no hydrogen 3.309 N/A VAL 430.A N PHE 427.A O no hydrogen 2.949 N/A LYS 431.A N PHE 427.A O no hydrogen 3.207 N/A LYS 431.A NZ TYR 552.A O no hydrogen 2.706 N/A ALA 433.A N VAL 422.A O no hydrogen 2.643 N/A THR 434.A N VAL 422.A O no hydrogen 3.037 N/A VAL 435.A N ILE 443.A O no hydrogen 3.078 N/A ILE 436.A N LEU 420.A O no hydrogen 2.720 N/A LYS 437.A N MET 440.A O no hydrogen 2.672 N/A LYS 437.A NZ ASN 189.A OD1 no hydrogen 2.789 N/A LYS 437.A NZ ASP 419.A OD1 no hydrogen 2.802 N/A LYS 437.A NZ ASP 419.A OD2 no hydrogen 3.496 N/A LYS 437.A NZ CYS 475.A O no hydrogen 2.843 N/A GLY 438.A N ASP 419.A OD1 no hydrogen 2.906 N/A GLY 439.A N ALA 418.A O no hydrogen 2.958 N/A MET 440.A N LYS 437.A O no hydrogen 3.008 N/A ALA 442.A N VAL 435.A O no hydrogen 2.815 N/A ALA 444.A N ARG 462.A O no hydrogen 3.425 N/A MET 446.A N HIS 460.A O no hydrogen 2.804 N/A GLY 447.A N PRO 454.A O no hydrogen 2.740 N/A ASP 448.A N PRO 456.A O no hydrogen 2.995 N/A ASN 450.A N ASP 448.A OD1 no hydrogen 3.028 N/A ALA 451.A N ASP 448.A O no hydrogen 3.099 N/A HIS 460.A N MET 446.A O no hydrogen 3.169 N/A TYR 461.A OH PRO 432.A O no hydrogen 2.695 N/A ARG 462.A N ALA 444.A O no hydrogen 3.110 N/A ARG 462.A NE MET 446.A O no hydrogen 2.857 N/A ARG 462.A NH1 MET 446.A O no hydrogen 3.079 N/A ARG 462.A NH1 PRO 458.A O no hydrogen 2.993 N/A MET 464.A N ALA 442.A O no hydrogen 2.821 N/A GLY 466.A N ILE 441.A O no hydrogen 2.892 N/A ALA 467.A N MET 464.A O no hydrogen 2.997 N/A LEU 468.A N PHE 465.A O no hydrogen 3.302 N/A ALA 471.A N LEU 468.A O no hydrogen 2.995 N/A ARG 472.A N LEU 468.A O no hydrogen 2.924 N/A ARG 472.A NE ASP 184.A O no hydrogen 2.670 N/A ARG 472.A NH1 ALA 467.A O no hydrogen 2.862 N/A ARG 472.A NH2 ASP 184.A O no hydrogen 3.324 N/A HIS 473.A N GLY 469.A O no hydrogen 3.092 N/A HIS 474.A N SER 470.A O no hydrogen 3.177 N/A CYS 475.A N ALA 471.A O no hydrogen 3.076 N/A CYS 475.A N ARG 472.A O no hydrogen 2.979 N/A CYS 475.A SG GLY 438.A O no hydrogen 3.840 N/A CYS 475.A SG ALA 471.A O no hydrogen 3.333 N/A ARG 476.A NE LEU 186.A O no hydrogen 2.804 N/A ARG 476.A NE VAL 188.A O no hydrogen 3.096 N/A ARG 476.A NH1 THR 478.A OG1 no hydrogen 2.634 N/A ARG 476.A NH1 SER 497.A OG no hydrogen 2.734 N/A ARG 476.A NH2 VAL 188.A O no hydrogen 3.187 N/A LEU 477.A N ASN 189.A OD1 no hydrogen 3.017 N/A THR 478.A N ALA 498.A O no hydrogen 2.794 N/A PHE 479.A N ILE 190.A O no hydrogen 2.969 N/A LEU 480.A N ALA 500.A O no hydrogen 2.914 N/A SER 481.A OG VAL 208.A O no hydrogen 2.713 N/A GLN 482.A NE2 ASP 238.A OD2 no hydrogen 3.017 N/A GLN 482.A NE2 VAL 502.A O no hydrogen 2.916 N/A ALA 484.A N SER 481.A OG no hydrogen 2.978 N/A ALA 485.A N SER 481.A O no hydrogen 3.047 N/A ALA 486.A N GLN 482.A O no hydrogen 2.933 N/A ASN 487.A N ALA 483.A O no hydrogen 3.021 N/A ASN 487.A N ALA 484.A O no hydrogen 3.259 N/A GLY 488.A N ALA 485.A O no hydrogen 3.083 N/A VAL 489.A N ALA 484.A O no hydrogen 2.994 N/A GLU 491.A N GLU 491.A OE1 no hydrogen 2.641 N/A ARG 492.A N GLY 488.A O no hydrogen 2.815 N/A ARG 492.A NH1 ASN 487.A O no hydrogen 3.155 N/A ARG 492.A NH2 ASN 487.A O no hydrogen 3.130 N/A LEU 493.A N VAL 489.A O no hydrogen 2.831 N/A ASN 494.A N GLU 491.A O no hydrogen 3.053 N/A ASN 494.A ND2 ASN 494.A O no hydrogen 2.574 N/A LEU 495.A N ALA 490.A O no hydrogen 2.799 N/A ARG 496.A N ASP 184.A OD1 no hydrogen 2.799 N/A SER 497.A N ASP 184.A OD2 no hydrogen 2.972 N/A SER 497.A OG ASP 184.A OD2 no hydrogen 2.719 N/A ALA 498.A N HIS 473.A O no hydrogen 3.083 N/A ALA 500.A N THR 478.A O no hydrogen 2.983 N/A VAL 502.A N LEU 480.A O no hydrogen 3.149 N/A LYS 503.A N GLY 404.A O no hydrogen 2.964 N/A GLY 504.A N ASP 238.A OD2 no hydrogen 3.054 N/A CYS 505.A N ASP 238.A OD1 no hydrogen 2.833 N/A CYS 505.A SG ASP 238.A O no hydrogen 3.731 N/A CYS 505.A SG HIS 403.A O no hydrogen 3.512 N/A ARG 506.A NE ASP 235.A OD1 no hydrogen 2.790 N/A ARG 506.A NH1 THR 265.A O no hydrogen 3.021 N/A ARG 506.A NH1 CYS 505.A O no hydrogen 3.190 N/A ARG 506.A NH2 ASP 235.A OD1 no hydrogen 2.861 N/A ARG 506.A NH2 THR 265.A O no hydrogen 2.859 N/A GLN 509.A N ASP 512.A OD2 no hydrogen 2.869 N/A LYS 510.A N PRO 289.A O no hydrogen 2.836 N/A LYS 510.A NZ ALA 341.A O no hydrogen 2.662 N/A LYS 510.A NZ LEU 518.A O no hydrogen 2.791 N/A ASP 512.A N GLN 509.A O no hydrogen 2.916 N/A MET 513.A N LYS 510.A O no hydrogen 3.165 N/A VAL 514.A N ASN 398.A OD1 no hydrogen 2.685 N/A HIS 515.A NE2 HIS 77.A O no hydrogen 2.737 N/A ASN 516.A N MET 513.A O no hydrogen 3.122 N/A ASN 516.A ND2 ARG 390.A O no hydrogen 2.923 N/A ASN 516.A ND2 VAL 514.A O no hydrogen 2.853 N/A LEU 518.A N GLY 340.A O no hydrogen 2.855 N/A GLN 519.A NE2 ALA 287.A O no hydrogen 3.588 N/A ASN 521.A ND2 ASP 534.A OD1 no hydrogen 3.190 N/A THR 523.A N ARG 532.A O no hydrogen 2.650 N/A THR 523.A OG1 ARG 532.A O no hydrogen 3.510 N/A ASP 525.A N GLU 530.A O no hydrogen 2.924 N/A GLN 527.A N ASP 525.A OD2 no hydrogen 3.050 N/A THR 528.A N ASP 525.A OD2 no hydrogen 3.109 N/A TYR 529.A N ASP 525.A O no hydrogen 2.708 N/A GLU 530.A N THR 528.A OG1 no hydrogen 3.004 N/A ARG 532.A N THR 523.A O no hydrogen 2.924 N/A ARG 532.A NH1 GLY 535.A O no hydrogen 2.866 N/A ARG 532.A NH2 GLU 530.A OE1 no hydrogen 3.314 N/A VAL 533.A N GLU 536.A O no hydrogen 2.979 N/A ASP 534.A N ASN 521.A O no hydrogen 2.919 N/A GLU 536.A N VAL 533.A O no hydrogen 3.007 N/A ILE 538.A N VAL 531.A O no hydrogen 2.814 N/A SER 540.A OG ALA 331.A O no hydrogen 2.771 N/A GLU 541.A N GLN 372.A OE1 no hydrogen 2.906 N/A ALA 543.A N TYR 302.A O no hydrogen 2.875 N/A MET 548.A N ASP 24.A OD1 no hydrogen 2.648 N/A ARG 551.A NE ASP 24.A OD2 no hydrogen 2.711 N/A ARG 551.A NH2 ASP 24.A OD2 no hydrogen 3.098 N/A TYR 552.A N ALA 549.A O no hydrogen 3.020 N/A TYR 552.A OH ALA 426.A O no hydrogen 2.570 N/A