Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gmw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 PRO 1.A O no hydrogen 3.271 N/A ASN 6.A ND2 GLN 3.A OE1 no hydrogen 2.855 N/A PHE 10.A N GLU 31.A OE2 no hydrogen 3.105 N/A SER 11.A N ASP 9.A OD1 no hydrogen 2.904 N/A SER 11.A OG ASP 9.A OD1 no hydrogen 2.347 N/A LYS 13.A N PHE 10.A O no hydrogen 2.998 N/A LYS 13.A NZ.A PRO 39.A O no hydrogen 3.059 N/A LYS 13.A NZ.B PRO 39.A O no hydrogen 3.131 N/A VAL 14.A N SER 11.A O no hydrogen 3.192 N/A ILE 15.A N ILE 42.A O no hydrogen 2.869 N/A GLN 16.A NE2 ILE 44.A O no hydrogen 3.084 N/A GLN 16.A NE2 GLU 51.A OE2 no hydrogen 2.779 N/A ASP 20.A N SER 18.A OG no hydrogen 3.001 N/A SER 21.A N SER 18.A O no hydrogen 3.109 N/A SER 21.A OG SER 18.A O no hydrogen 3.012 N/A LEU 22.A N LEU 19.A O no hydrogen 3.320 N/A ARG 27.A N PRO 23.A O no hydrogen 2.957 N/A ARG 27.A NE GLU 31.A OE1 no hydrogen 2.835 N/A ARG 27.A NH1 ASP 20.A OD1 no hydrogen 2.815 N/A ARG 27.A NH2 GLU 31.A OE2 no hydrogen 3.159 N/A LYS 28.A N GLN 24.A O no hydrogen 3.094 N/A LYS 28.A NZ GLU 25.A OE2 no hydrogen 3.345 N/A PHE 29.A N GLU 25.A O no hydrogen 3.130 N/A VAL 30.A N VAL 26.A O no hydrogen 2.863 N/A GLU 31.A N ARG 27.A O no hydrogen 2.753 N/A GLY 32.A N LYS 28.A O no hydrogen 2.801 N/A ASN 33.A N PHE 29.A O no hydrogen 3.133 N/A ASN 33.A ND2 PHE 29.A O no hydrogen 3.087 N/A ALA 34.A N VAL 30.A O no hydrogen 2.744 N/A GLN 35.A N GLU 31.A O no hydrogen 2.947 N/A GLN 35.A NE2 LEU 8.A O no hydrogen 3.336 N/A LEU 36.A N GLY 32.A O no hydrogen 3.263 N/A CYS 37.A N ASN 33.A O no hydrogen 2.851 N/A CYS 37.A SG PHE 129.A O no hydrogen 3.921 N/A GLN 38.A N ALA 34.A O no hydrogen 2.912 N/A GLN 38.A NE2 GLN 35.A O no hydrogen 2.734 N/A GLU 40.A N ARG 136.A O no hydrogen 2.836 N/A TYR 41.A N ARG 136.A O no hydrogen 3.453 N/A ILE 42.A N LYS 13.A O no hydrogen 2.904 N/A HIS 43.A N MET 138.A O no hydrogen 2.890 N/A HIS 43.A NE2 GLU 51.A OE2 no hydrogen 2.852 N/A ILE 44.A N GLN 16.A O no hydrogen 2.955 N/A CYS 45.A N VAL 140.A O no hydrogen 2.922 N/A CYS 45.A SG VAL 140.A O no hydrogen 3.490 N/A ASP 46.A N GLU 51.A OE2 no hydrogen 2.959 N/A GLY 47.A N GLU 51.A OE1 no hydrogen 2.809 N/A SER 48.A N ASP 46.A OD1 no hydrogen 2.823 N/A SER 48.A OG ASP 46.A OD1 no hydrogen 2.648 N/A SER 48.A OG ASP 46.A OD2 no hydrogen 3.444 N/A GLU 51.A N SER 48.A OG no hydrogen 3.048 N/A TYR 52.A N SER 48.A O no hydrogen 3.191 N/A GLY 53.A N GLU 49.A O no hydrogen 2.838 N/A ARG 54.A N GLU 50.A O no hydrogen 3.058 N/A LEU 55.A N GLU 51.A O no hydrogen 3.039 N/A LEU 56.A N TYR 52.A O no hydrogen 2.936 N/A ALA 57.A N GLY 53.A O no hydrogen 3.075 N/A HIS 58.A N ARG 54.A O no hydrogen 2.924 N/A MET 59.A N LEU 55.A O no hydrogen 2.947 N/A GLN 60.A N LEU 56.A O no hydrogen 2.828 N/A GLU 61.A N ALA 57.A O no hydrogen 2.954 N/A GLU 62.A N HIS 58.A O no hydrogen 3.074 N/A GLY 63.A N GLN 60.A O no hydrogen 3.100 N/A VAL 64.A N MET 59.A O no hydrogen 2.847 N/A ILE 65.A N MET 59.A O no hydrogen 3.412 N/A ARG 66.A N LEU 76.A O no hydrogen 2.846 N/A ARG 66.A NE GLU 361.A OE1 no hydrogen 2.993 N/A ARG 66.A NH2 GLU 361.A OE1 no hydrogen 3.120 N/A ARG 66.A NH2 GLU 361.A OE2 no hydrogen 2.829 N/A LEU 68.A N CYS 74.A O no hydrogen 2.811 N/A LYS 70.A N GLY 365.A O no hydrogen 3.020 N/A LYS 70.A NZ ASP 364.A OD2 no hydrogen 2.833 N/A TYR 71.A N LEU 68.A O no hydrogen 3.132 N/A ASN 73.A ND2 ASN 353.A OD1 no hydrogen 2.955 N/A CYS 74.A SG ASP 72.A O no hydrogen 3.561 N/A CYS 74.A SG GLN 351.A O no hydrogen 3.721 N/A TRP 75.A N THR 354.A O no hydrogen 2.914 N/A TRP 75.A NE1 ASN 73.A OD1 no hydrogen 2.883 N/A LEU 76.A N ARG 66.A O no hydrogen 2.782 N/A ALA 77.A N PHE 356.A O no hydrogen 2.871 N/A THR 79.A N ASN 358.A OD1 no hydrogen 2.735 N/A THR 79.A OG1 ASP 80.A O no hydrogen 2.930 N/A THR 79.A OG1 ASP 83.A O no hydrogen 3.053 N/A ARG 82.A N ASP 80.A OD1 no hydrogen 2.969 N/A ARG 82.A NE ASP 80.A OD1 no hydrogen 3.175 N/A ARG 82.A NE ASP 80.A OD2 no hydrogen 3.145 N/A ARG 82.A NH2 ASP 80.A OD2 no hydrogen 2.778 N/A ASP 83.A N ASP 80.A O no hydrogen 2.949 N/A ILE 87.A N ASN 237.A OD1 no hydrogen 3.175 N/A LYS 90.A N ILE 87.A O no hydrogen 3.016 N/A THR 91.A N GLU 88.A O no hydrogen 3.086 N/A THR 91.A OG1 ILE 87.A O no hydrogen 2.697 N/A VAL 92.A N ILE 218.A O no hydrogen 2.911 N/A ILE 93.A N ARG 114.A O no hydrogen 2.957 N/A ILE 94.A N HIS 220.A O no hydrogen 2.857 N/A THR 95.A OG1 GLU 97.A O no hydrogen 2.857 N/A THR 95.A OG1 THR 101.A OG1 no hydrogen 2.669 N/A ARG 99.A NE ASP 592.A OD1 no hydrogen 3.114 N/A ARG 99.A NE ASP 592.A OD2 no hydrogen 3.324 N/A ARG 99.A NH2 ASP 592.A OD1 no hydrogen 2.827 N/A ASP 100.A N GLU 97.A O no hydrogen 3.069 N/A THR 101.A N GLN 98.A O no hydrogen 2.915 N/A THR 101.A OG1 THR 95.A OG1 no hydrogen 2.669 N/A VAL 102.A N GLN 98.A O no hydrogen 3.013 N/A LYS 106.A N ASP 587.A O no hydrogen 2.924 N/A LYS 106.A NZ GLU 586.A OE1 no hydrogen 2.832 N/A GLN 111.A N GLN 588.A OE1 no hydrogen 2.941 N/A LEU 112.A N SER 110.A OG no hydrogen 2.887 N/A TRP 115.A NE1 THR 95.A O no hydrogen 2.918 N/A MET 116.A N ILE 93.A O no hydrogen 2.936 N/A ASP 120.A N SER 117.A OG no hydrogen 2.907 N/A PHE 121.A N SER 117.A O no hydrogen 2.923 N/A GLU 122.A N GLU 118.A O no hydrogen 2.940 N/A LYS 123.A N GLU 119.A O no hydrogen 3.293 N/A ALA 124.A N ASP 120.A O no hydrogen 3.033 N/A PHE 125.A N PHE 121.A O no hydrogen 2.732 N/A ASN 126.A N GLU 122.A O no hydrogen 2.964 N/A ALA 127.A N LYS 123.A O no hydrogen 3.091 N/A ARG 128.A N PHE 125.A O no hydrogen 3.114 N/A ARG 128.A NE LEU 215.A O no hydrogen 2.844 N/A ARG 128.A NH1 ALA 124.A O no hydrogen 2.891 N/A PHE 129.A N PHE 125.A O no hydrogen 3.071 N/A GLY 131.A N LEU 36.A O no hydrogen 2.810 N/A CYS 132.A N PHE 129.A O no hydrogen 2.952 N/A CYS 132.A SG PHE 129.A O no hydrogen 3.263 N/A CYS 132.A SG SER 194.A OG no hydrogen 3.360 N/A MET 133.A N CYS 37.A O no hydrogen 2.937 N/A LYS 134.A N GLY 131.A O no hydrogen 3.218 N/A ARG 136.A N MET 133.A O no hydrogen 2.947 N/A ARG 136.A NE CYS 197.A O no hydrogen 3.015 N/A ARG 136.A NH2 CYS 197.A O no hydrogen 2.920 N/A MET 138.A N TYR 41.A O no hydrogen 2.845 N/A TYR 139.A N THR 160.A O no hydrogen 2.708 N/A VAL 140.A N HIS 43.A O no hydrogen 2.820 N/A ILE 141.A N GLU 158.A O no hydrogen 2.804 N/A PHE 143.A N GLY 156.A O no hydrogen 2.896 N/A SER 144.A N ARG 174.A O no hydrogen 2.715 N/A SER 144.A OG GLY 146.A O no hydrogen 2.828 N/A MET 145.A N LYS 154.A O no hydrogen 2.799 N/A SER 150.A N PRO 147.A O no hydrogen 2.878 N/A SER 150.A OG PRO 422.A O no hydrogen 2.635 N/A LEU 152.A N SER 150.A OG no hydrogen 2.942 N/A ALA 153.A N SER 150.A O no hydrogen 2.959 N/A LYS 154.A N MET 145.A O no hydrogen 3.008 N/A LYS 154.A NZ GLU 257.A OE1 no hydrogen 3.164 N/A GLY 156.A N PHE 143.A O no hydrogen 2.835 N/A ILE 157.A N ILE 189.A O no hydrogen 3.040 N/A GLU 158.A N ILE 141.A O no hydrogen 2.868 N/A LEU 159.A N CYS 191.A O no hydrogen 2.842 N/A THR 160.A N TYR 139.A O no hydrogen 3.113 N/A THR 160.A OG1 HIS 193.A ND1 no hydrogen 2.803 N/A SER 162.A N THR 160.A OG1 no hydrogen 3.054 N/A TYR 164.A OH THR 357.A OG1 no hydrogen 2.674 N/A VAL 165.A N SER 162.A OG no hydrogen 3.080 N/A VAL 166.A N SER 162.A O no hydrogen 3.139 N/A ALA 167.A N PRO 163.A O no hydrogen 3.001 N/A SER 168.A N TYR 164.A O no hydrogen 3.032 N/A SER 168.A OG TYR 164.A O no hydrogen 3.006 N/A MET 169.A N VAL 165.A O no hydrogen 2.832 N/A ARG 170.A N VAL 166.A O no hydrogen 2.968 N/A ARG 170.A NE GLY 47.A O no hydrogen 3.018 N/A ARG 170.A NH2 GLY 47.A O no hydrogen 3.029 N/A ILE 171.A N SER 168.A O no hydrogen 3.133 N/A MET 172.A N SER 168.A O no hydrogen 2.868 N/A THR 173.A N MET 169.A O no hydrogen 2.971 N/A THR 173.A OG1 MET 169.A O no hydrogen 2.773 N/A ARG 174.A N SER 144.A O no hydrogen 3.325 N/A ARG 174.A NH1 GLU 328.A O no hydrogen 3.016 N/A ARG 174.A NH2 GLU 420.A OE1 no hydrogen 2.907 N/A GLY 176.A N PRO 142.A O no hydrogen 3.039 N/A THR 177.A N ASP 46.A O no hydrogen 3.161 N/A THR 177.A OG1 ASP 46.A O no hydrogen 3.559 N/A VAL 179.A N GLY 176.A O no hydrogen 3.037 N/A LEU 180.A N GLY 176.A O no hydrogen 3.474 N/A GLU 181.A N THR 177.A O no hydrogen 2.979 N/A ALA 182.A N SER 178.A O no hydrogen 2.978 N/A LEU 183.A N VAL 179.A O no hydrogen 2.804 N/A GLY 184.A N LEU 180.A O no hydrogen 3.208 N/A GLY 186.A N LEU 183.A O no hydrogen 3.014 N/A ILE 189.A N ILE 155.A O no hydrogen 2.945 N/A LYS 190.A N ARG 225.A O no hydrogen 2.961 N/A CYS 191.A N ILE 157.A O no hydrogen 2.890 N/A CYS 191.A SG ILE 189.A O no hydrogen 3.655 N/A LEU 192.A N ILE 227.A O no hydrogen 2.875 N/A HIS 193.A N LEU 159.A O no hydrogen 2.731 N/A HIS 193.A ND1 THR 160.A OG1 no hydrogen 2.803 N/A HIS 193.A NE2 SER 232.A O no hydrogen 2.813 N/A SER 194.A N SER 229.A O no hydrogen 3.047 N/A SER 194.A OG ASP 161.A OD2 no hydrogen 2.929 N/A VAL 195.A N ASP 161.A OD1 no hydrogen 2.883 N/A GLY 196.A N SER 194.A OG no hydrogen 2.929 N/A CYS 197.A SG VAL 195.A O no hydrogen 3.837 N/A CYS 197.A SG CYS 211.A O no hydrogen 3.078 N/A LEU 199.A N LYS 134.A O no hydrogen 2.839 N/A ASN 207.A ND2 THR 79.A O no hydrogen 3.125 N/A TRP 209.A N VAL 206.A O no hydrogen 2.960 N/A TRP 209.A NE1 ASP 83.A OD2 no hydrogen 2.698 N/A CYS 211.A SG ASP 80.A OD2 no hydrogen 3.431 N/A CYS 211.A SG TRP 209.A O no hydrogen 3.799 N/A ASN 212.A N GLY 231.A O no hydrogen 2.740 N/A ASN 212.A ND2 GLY 196.A O no hydrogen 3.066 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.636 N/A LEU 215.A N ASN 212.A O no hydrogen 3.176 N/A THR 216.A N PRO 213.A O no hydrogen 3.194 N/A THR 216.A OG1 ASN 212.A O no hydrogen 2.933 N/A THR 216.A OG1 PRO 213.A O no hydrogen 3.325 N/A LEU 217.A N PHE 230.A O no hydrogen 2.899 N/A ILE 218.A N LYS 90.A O no hydrogen 2.741 N/A ALA 219.A N ILE 228.A O no hydrogen 2.755 N/A HIS 220.A N VAL 92.A O no hydrogen 3.029 N/A HIS 220.A ND1 VAL 92.A O no hydrogen 2.864 N/A LEU 221.A N GLU 226.A O no hydrogen 2.869 N/A ARG 224.A N LEU 221.A O no hydrogen 2.980 N/A ARG 224.A NH1 GLU 122.A OE2 no hydrogen 3.107 N/A ARG 225.A N PRO 222.A O no hydrogen 3.231 N/A ARG 225.A NH1 PRO 222.A O no hydrogen 2.804 N/A ARG 225.A NH1 GLU 256.A OE2 no hydrogen 3.175 N/A ARG 225.A NH2 GLU 256.A OE1 no hydrogen 3.002 N/A GLU 226.A N LEU 221.A O no hydrogen 3.184 N/A ILE 227.A N LYS 190.A O no hydrogen 2.772 N/A ILE 228.A N ALA 219.A O no hydrogen 2.865 N/A SER 229.A N LEU 192.A O no hydrogen 2.792 N/A SER 229.A OG ASN 237.A O no hydrogen 2.626 N/A PHE 230.A N LEU 217.A O no hydrogen 2.868 N/A GLY 231.A N SER 194.A O no hydrogen 2.817 N/A SER 232.A OG ASP 83.A OD1 no hydrogen 2.535 N/A GLY 233.A N ASP 83.A OD2 no hydrogen 2.809 N/A TYR 234.A N SER 232.A OG no hydrogen 3.005 N/A TYR 234.A OH ASN 402.A O no hydrogen 2.763 N/A ASN 237.A N TYR 234.A O no hydrogen 2.797 N/A ASN 237.A ND2 ALA 85.A O no hydrogen 3.031 N/A ASN 237.A ND2 SER 232.A OG no hydrogen 2.884 N/A SER 238.A N TYR 234.A O no hydrogen 3.115 N/A SER 238.A N GLY 235.A O no hydrogen 3.037 N/A SER 238.A OG GLY 233.A O no hydrogen 2.845 N/A LEU 239.A N GLY 235.A O no hydrogen 2.784 N/A LEU 240.A N GLU 158.A OE1 no hydrogen 3.099 N/A LYS 242.A N.A LEU 239.A O no hydrogen 3.266 N/A LYS 242.A N.B LEU 239.A O no hydrogen 3.138 N/A LYS 242.A NZ.A ASP 310.A OD2 no hydrogen 2.838 N/A LYS 242.A NZ.A GLU 328.A OE2 no hydrogen 3.084 N/A LYS 242.A NZ.B LYS 242.A O.B no hydrogen 3.029 N/A LYS 242.A NZ.B ASP 310.A OD2 no hydrogen 2.623 N/A LYS 242.A NZ.B GLU 328.A OE1 no hydrogen 2.935 N/A LYS 242.A NZ.B GLU 328.A OE2 no hydrogen 2.586 N/A LYS 243.A NZ ASP 310.A OD1 no hydrogen 3.244 N/A LYS 243.A NZ ASP 310.A OD2 no hydrogen 2.804 N/A CYS 244.A SG HIS 220.A NE2 no hydrogen 3.435 N/A CYS 244.A SG GLY 236.A O no hydrogen 3.594 N/A PHE 245.A N LEU 240.A O no hydrogen 2.935 N/A ALA 246.A N GLY 241.A O no hydrogen 2.877 N/A LEU 247.A N LYS 243.A O no hydrogen 3.014 N/A ARG 248.A N LYS 243.A O no hydrogen 3.095 N/A ARG 248.A NE PRO 473.A O no hydrogen 3.157 N/A ARG 248.A NH1 HIS 220.A NE2 no hydrogen 3.086 N/A ARG 248.A NH2 PRO 473.A O no hydrogen 3.051 N/A ILE 249.A N CYS 244.A O no hydrogen 3.006 N/A ALA 250.A N PHE 245.A O no hydrogen 2.874 N/A SER 251.A N LEU 247.A O no hydrogen 2.820 N/A SER 251.A OG LEU 247.A O no hydrogen 2.738 N/A SER 251.A OG ARG 248.A O no hydrogen 3.160 N/A ARG 252.A NH1 ASP 223.A OD1 no hydrogen 3.094 N/A ARG 252.A NH1 GLU 256.A OE2 no hydrogen 2.857 N/A ARG 252.A NH2 ASP 223.A OD1 no hydrogen 2.964 N/A ARG 252.A NH2 ASP 223.A OD2 no hydrogen 2.486 N/A LEU 253.A N ILE 249.A O no hydrogen 3.059 N/A ALA 254.A N ALA 250.A O no hydrogen 2.800 N/A LYS 255.A N SER 251.A O no hydrogen 3.018 N/A GLU 256.A N ARG 252.A O no hydrogen 2.995 N/A GLU 257.A N LEU 253.A O no hydrogen 2.796 N/A GLY 258.A N ALA 254.A O no hydrogen 2.786 N/A TRP 259.A N ALA 254.A O no hydrogen 2.923 N/A TRP 259.A NE1 GLU 257.A OE1 no hydrogen 2.812 N/A LEU 260.A N MET 314.A O no hydrogen 2.772 N/A GLU 262.A N ALA 312.A O no hydrogen 2.769 N/A HIS 263.A ND1 ALA 470.A O no hydrogen 2.828 N/A HIS 263.A NE2 ASP 310.A OD1 no hydrogen 2.910 N/A LEU 265.A N ALA 281.A O no hydrogen 2.862 N/A ILE 266.A N GLY 308.A O no hydrogen 2.962 N/A LEU 267.A N LEU 279.A O no hydrogen 2.909 N/A GLY 268.A N GLU 305.A O no hydrogen 2.761 N/A ILE 269.A N LYS 277.A O no hydrogen 2.911 N/A THR 270.A N LYS 303.A O no hydrogen 2.938 N/A ASN 271.A N LYS 275.A O no hydrogen 2.938 N/A GLY 274.A N ASN 271.A O no hydrogen 2.786 N/A LYS 275.A N ASN 271.A OD1 no hydrogen 2.879 N/A LYS 276.A NZ TYR 278.A OH no hydrogen 3.318 N/A LYS 276.A NZ GLU 305.A OE1 no hydrogen 2.892 N/A LYS 276.A NZ ASP 416.A OD2 no hydrogen 2.766 N/A LYS 277.A N ILE 269.A O no hydrogen 2.878 N/A LYS 277.A NZ GLU 428.A OE1 no hydrogen 2.685 N/A TYR 278.A OH ASP 416.A OD1 no hydrogen 2.700 N/A TYR 278.A OH ASP 416.A OD2 no hydrogen 3.369 N/A LEU 279.A N LEU 267.A O no hydrogen 2.909 N/A ALA 280.A N GLY 429.A O no hydrogen 2.984 N/A ALA 281.A N LEU 265.A O no hydrogen 2.980 N/A ALA 282.A N ILE 431.A O no hydrogen 2.861 N/A CYS 287.A SG.A SER 285.A O.A no hydrogen 3.504 N/A CYS 287.A SG.A SER 461.A O no hydrogen 2.451 N/A CYS 287.A SG.B PRO 284.A O.A no hydrogen 1.989 N/A CYS 287.A SG.B SER 285.A O.A no hydrogen 2.321 N/A CYS 287.A SG.B SER 285.A O.B no hydrogen 3.780 N/A CYS 287.A SG.B SER 461.A O no hydrogen 3.407 N/A LYS 289.A NZ.A ASP 310.A O no hydrogen 3.276 N/A LYS 289.A NZ.A ASP 310.A OD1 no hydrogen 3.426 N/A LYS 289.A NZ.B PHE 283.A O.B no hydrogen 2.921 N/A THR 290.A OG1.B ASP 309.A OD2 no hydrogen 2.641 N/A ASN 291.A ND2.B THR 342.A O no hydrogen 3.683 N/A LEU 292.A N GLY 288.A O.B no hydrogen 2.832 N/A ALA 293.A N LYS 289.A O.B no hydrogen 2.491 N/A MET 294.A N THR 290.A O.B no hydrogen 2.623 N/A MET 294.A N ASN 291.A O.B no hydrogen 3.271 N/A MET 295.A N LEU 292.A O no hydrogen 3.256 N/A THR 298.A N GLY 520.A O no hydrogen 3.263 N/A THR 298.A OG1 GLY 520.A O no hydrogen 3.218 N/A THR 298.A OG1 GLU 521.A OE1 no hydrogen 2.799 N/A THR 298.A OG1 SER 523.A OG no hydrogen 3.425 N/A LEU 299.A N SER 523.A OG no hydrogen 3.409 N/A TRP 302.A N LEU 299.A O no hydrogen 3.384 N/A LYS 303.A N THR 270.A O no hydrogen 2.979 N/A GLU 305.A N GLY 268.A O no hydrogen 2.687 N/A CYS 306.A N ILE 414.A O no hydrogen 2.782 N/A VAL 307.A N ILE 266.A O no hydrogen 2.928 N/A GLY 308.A N ILE 266.A O no hydrogen 3.212 N/A ALA 312.A N GLU 262.A O no hydrogen 2.801 N/A TRP 313.A N ILE 325.A O no hydrogen 2.986 N/A TRP 313.A NE1 ALA 246.A O no hydrogen 2.893 N/A MET 314.A N LEU 260.A O no hydrogen 2.833 N/A LYS 315.A N ARG 323.A O no hydrogen 2.825 N/A ASP 317.A N ASN 321.A O no hydrogen 2.903 N/A GLY 320.A N ASP 317.A O no hydrogen 2.840 N/A ASN 321.A N ASP 317.A OD1 no hydrogen 2.859 N/A ARG 323.A N LYS 315.A O no hydrogen 2.938 N/A ARG 323.A NE ASP 317.A OD2 no hydrogen 2.862 N/A ARG 323.A NH1 GLY 424.A O no hydrogen 3.026 N/A ALA 324.A N VAL 425.A O no hydrogen 2.842 N/A ILE 325.A N TRP 313.A O no hydrogen 2.865 N/A ASN 326.A ND2 VAL 307.A O no hydrogen 2.938 N/A GLU 328.A N ASN 326.A OD1 no hydrogen 2.925 N/A ASN 329.A N MET 172.A O no hydrogen 2.919 N/A ASN 329.A ND2 ILE 171.A O no hydrogen 3.642 N/A ASN 329.A ND2 THR 173.A O no hydrogen 3.060 N/A PHE 331.A N THR 407.A O no hydrogen 2.818 N/A GLY 333.A N PHE 405.A O no hydrogen 2.985 N/A ALA 335.A N SER 403.A O no hydrogen 2.788 N/A GLY 337.A N GLU 370.A O no hydrogen 2.821 N/A THR 338.A N ALA 335.A O no hydrogen 3.031 N/A THR 338.A OG1 VAL 334.A O no hydrogen 3.360 N/A THR 338.A OG1 ALA 335.A O no hydrogen 2.845 N/A VAL 340.A N ILE 372.A O no hydrogen 2.908 N/A THR 342.A N SER 339.A OG no hydrogen 2.788 N/A ASN 343.A N SER 339.A O no hydrogen 2.880 N/A ASN 345.A ND2 MET 294.A O no hydrogen 2.979 N/A ALA 346.A N ASN 343.A OD1 no hydrogen 3.436 N/A ILE 347.A N ASN 343.A O no hydrogen 3.302 N/A LYS 348.A N PRO 344.A O no hydrogen 2.972 N/A LYS 348.A NZ GLN 351.A OE1 no hydrogen 2.900 N/A THR 349.A N ASN 345.A O no hydrogen 3.123 N/A THR 349.A OG1 ASN 345.A O no hydrogen 2.774 N/A ILE 350.A N ALA 346.A O no hydrogen 3.356 N/A GLN 351.A N LYS 348.A O no hydrogen 3.407 N/A ASN 353.A N ASP 72.A O no hydrogen 2.929 N/A ASN 353.A ND2 GLN 411.A OE1 no hydrogen 2.912 N/A THR 354.A OG1 LYS 352.A O no hydrogen 2.897 N/A THR 354.A OG1 THR 407.A OG1 no hydrogen 2.847 N/A ILE 355.A N CYS 406.A O no hydrogen 3.097 N/A PHE 356.A N TRP 75.A O no hydrogen 2.780 N/A THR 357.A N ARG 404.A O no hydrogen 2.823 N/A THR 357.A OG1 TYR 164.A OH no hydrogen 2.674 N/A ASN 358.A N ALA 77.A O no hydrogen 2.814 N/A ASN 358.A ND2 THR 79.A OG1 no hydrogen 2.902 N/A ALA 360.A N TYR 368.A O no hydrogen 2.939 N/A GLU 361.A N THR 383.A O no hydrogen 2.827 N/A THR 362.A N GLY 366.A O no hydrogen 2.793 N/A THR 362.A OG1 ASP 364.A OD1 no hydrogen 2.498 N/A SER 363.A N THR 381.A O no hydrogen 2.950 N/A GLY 365.A N THR 362.A O no hydrogen 2.803 N/A GLY 366.A N THR 362.A OG1 no hydrogen 3.000 N/A VAL 367.A N TYR 71.A OH no hydrogen 3.213 N/A TYR 368.A N ALA 360.A O no hydrogen 2.791 N/A TYR 368.A OH GLU 374.A O no hydrogen 2.845 N/A TRP 369.A NE1 THR 338.A O no hydrogen 2.890 N/A ILE 372.A N TRP 369.A O no hydrogen 3.219 N/A VAL 380.A N ALA 377.A O no hydrogen 3.131 N/A THR 381.A N SER 363.A OG no hydrogen 3.041 N/A THR 383.A N GLU 361.A O no hydrogen 2.792 N/A SER 384.A N LYS 388.A O no hydrogen 2.842 N/A SER 384.A OG LYS 388.A O no hydrogen 3.488 N/A TRP 385.A N CYS 398.A O no hydrogen 2.769 N/A LYS 386.A N SER 384.A OG no hydrogen 3.061 N/A ASN 387.A N SER 384.A O no hydrogen 2.923 N/A TRP 390.A N ILE 382.A O no hydrogen 3.060 N/A TRP 390.A NE1 GLU 396.A O no hydrogen 2.687 N/A ARG 391.A N ASP 394.A OD2 no hydrogen 2.544 N/A ASP 394.A N ARG 391.A O no hydrogen 2.690 N/A CYS 398.A N GLU 370.A OE2 no hydrogen 2.679 N/A CYS 398.A SG GLU 370.A OE1 no hydrogen 3.517 N/A CYS 398.A SG GLU 370.A OE2 no hydrogen 3.446 N/A ALA 399.A N GLU 370.A OE1 no hydrogen 3.194 N/A HIS 400.A N ASN 358.A O no hydrogen 3.047 N/A ASN 402.A N HIS 400.A ND1 no hydrogen 2.942 N/A ASN 402.A ND2 VAL 84.A O no hydrogen 2.933 N/A SER 403.A N HIS 400.A O no hydrogen 2.931 N/A SER 403.A OG HIS 400.A O no hydrogen 2.753 N/A ARG 404.A N THR 357.A O no hydrogen 2.999 N/A ARG 404.A NE ASN 402.A O no hydrogen 3.215 N/A ARG 404.A NH1 PHE 332.A O no hydrogen 2.973 N/A ARG 404.A NH2 ASN 402.A OD1 no hydrogen 2.666 N/A PHE 405.A N GLY 333.A O no hydrogen 2.943 N/A CYS 406.A N ILE 355.A O no hydrogen 2.794 N/A CYS 406.A SG SER 168.A O no hydrogen 3.947 N/A THR 407.A N PHE 331.A O no hydrogen 2.933 N/A THR 407.A OG1 THR 349.A O no hydrogen 3.262 N/A THR 407.A OG1 THR 354.A OG1 no hydrogen 2.847 N/A ALA 409.A N ASN 329.A O no hydrogen 3.096 N/A GLN 411.A N PRO 408.A O no hydrogen 3.174 N/A GLN 411.A NE2 THR 349.A O no hydrogen 2.899 N/A GLN 411.A NE2 LYS 352.A O no hydrogen 2.834 N/A CYS 412.A N ALA 409.A O no hydrogen 3.065 N/A ILE 415.A N CYS 412.A O no hydrogen 3.099 N/A ASP 416.A N CYS 306.A O no hydrogen 2.765 N/A ALA 418.A N ASP 416.A OD1 no hydrogen 2.784 N/A TRP 419.A N ASP 416.A O no hydrogen 2.936 N/A SER 421.A N ALA 418.A O no hydrogen 3.103 N/A SER 421.A OG ALA 418.A O no hydrogen 3.546 N/A GLU 423.A N GLU 423.A OE1 no hydrogen 2.651 N/A GLY 424.A N SER 421.A O no hydrogen 3.131 N/A VAL 425.A N ALA 324.A O no hydrogen 2.791 N/A ILE 427.A N LEU 322.A O no hydrogen 2.755 N/A GLU 428.A N TYR 278.A O no hydrogen 2.920 N/A ILE 430.A N LYS 499.A O no hydrogen 2.891 N/A ILE 431.A N ALA 280.A O no hydrogen 2.820 N/A PHE 432.A N PHE 501.A O no hydrogen 2.869 N/A GLY 433.A N ALA 282.A O no hydrogen 3.225 N/A ARG 435.A N SER 461.A O no hydrogen 3.284 N/A ARG 435.A NE.A ALA 286.A O.A no hydrogen 2.949 N/A ARG 435.A NE.B ALA 286.A O.B no hydrogen 3.022 N/A ARG 435.A NH2.A ALA 286.A O.A no hydrogen 3.148 N/A ARG 435.A NH2.B ALA 286.A O.B no hydrogen 3.004 N/A ARG 436.A N ASN 504.A OD1 no hydrogen 3.118 N/A ARG 436.A NH1 GLU 577.A OE2 no hydrogen 3.157 N/A ARG 436.A NH2 GLU 577.A OE1 no hydrogen 2.797 N/A VAL 440.A N ALA 438.A O no hydrogen 2.920 N/A TYR 444.A N HIS 502.A O no hydrogen 2.908 N/A GLU 445.A N TYR 546.A O no hydrogen 2.748 N/A ALA 446.A N ILE 500.A O no hydrogen 2.931 N/A LEU 447.A N HIS 451.A ND1 no hydrogen 2.844 N/A SER 448.A OG GLN 450.A OE1 no hydrogen 3.389 N/A TRP 449.A NE1 TRP 486.A O no hydrogen 2.865 N/A HIS 451.A N SER 448.A OG no hydrogen 2.917 N/A GLY 452.A N SER 448.A O no hydrogen 2.816 N/A VAL 453.A N TRP 449.A O no hydrogen 2.908 N/A PHE 454.A N GLN 450.A O no hydrogen 3.105 N/A VAL 455.A N HIS 451.A O no hydrogen 2.902 N/A GLY 456.A N GLY 452.A O no hydrogen 3.028 N/A ALA 457.A N VAL 453.A O no hydrogen 2.925 N/A ALA 458.A N PHE 454.A O no hydrogen 2.935 N/A ALA 458.A N VAL 455.A O no hydrogen 3.228 N/A MET 459.A N GLY 456.A O no hydrogen 3.215 N/A ARG 460.A NH1 GLY 463.A O no hydrogen 3.417 N/A ARG 460.A NH2 GLU 580.A OE1.A no hydrogen 2.905 N/A SER 461.A N MET 465.A O no hydrogen 3.035 N/A SER 461.A OG GLU 462.A OE2 no hydrogen 3.555 N/A ILE 464.A N GLU 462.A OE1 no hydrogen 2.669 N/A HIS 466.A NE2 GLU 580.A OE1.B no hydrogen 2.729 N/A HIS 466.A NE2 GLU 580.A OE2.B no hydrogen 2.600 N/A ASP 467.A N MET 459.A O no hydrogen 2.864 N/A PHE 469.A N GLY 456.A O no hydrogen 2.995 N/A ALA 470.A N ASP 467.A O no hydrogen 2.880 N/A MET 471.A N PRO 468.A O no hydrogen 2.926 N/A ARG 472.A N ASP 467.A OD1 no hydrogen 2.823 N/A ARG 472.A NH1 GLU 88.A OE2 no hydrogen 2.718 N/A ARG 472.A NH1 GLN 111.A O no hydrogen 2.878 N/A ARG 472.A NH2 GLU 88.A OE1 no hydrogen 2.734 N/A ARG 472.A NH2 GLU 88.A OE2 no hydrogen 3.298 N/A PHE 474.A N MET 471.A O no hydrogen 2.737 N/A GLY 476.A N SER 251.A OG no hydrogen 2.953 N/A ASN 478.A N ASP 100.A O no hydrogen 2.979 N/A ASN 478.A ND2 ARG 99.A O no hydrogen 2.871 N/A ASN 478.A ND2 ASP 592.A OD2 no hydrogen 2.918 N/A LYS 481.A N ASN 478.A OD1 no hydrogen 3.150 N/A TYR 482.A N ASN 478.A O no hydrogen 2.919 N/A TYR 482.A OH GLU 262.A OE1 no hydrogen 2.609 N/A TYR 482.A OH GLU 262.A OE2 no hydrogen 3.395 N/A LEU 483.A N PHE 479.A O no hydrogen 2.798 N/A ALA 484.A N GLY 480.A O no hydrogen 2.995 N/A HIS 485.A N LYS 481.A O no hydrogen 2.847 N/A HIS 485.A NE2 TRP 259.A O no hydrogen 2.793 N/A TRP 486.A N TYR 482.A O no hydrogen 2.966 N/A TRP 486.A NE1 GLU 262.A OE2 no hydrogen 2.853 N/A LEU 487.A N LEU 483.A O no hydrogen 2.915 N/A SER 488.A N ALA 484.A O no hydrogen 2.900 N/A SER 488.A OG HIS 485.A O no hydrogen 2.773 N/A MET 489.A N TRP 486.A O no hydrogen 2.987 N/A ALA 490.A N LEU 487.A O no hydrogen 3.102 N/A HIS 491.A N SER 488.A O no hydrogen 3.040 N/A ARG 492.A N MET 489.A O no hydrogen 3.410 N/A ARG 492.A NH1 GLY 258.A O no hydrogen 3.111 N/A ALA 495.A N ARG 492.A O no hydrogen 3.058 N/A LYS 496.A N GLY 320.A O no hydrogen 2.821 N/A LYS 496.A NZ GLN 319.A O no hydrogen 2.647 N/A LYS 499.A N GLU 428.A O no hydrogen 3.287 N/A LYS 499.A NZ GLU 445.A OE2 no hydrogen 2.849 N/A PHE 501.A N ILE 430.A O no hydrogen 2.972 N/A HIS 502.A N TYR 444.A O no hydrogen 2.763 N/A VAL 503.A N PHE 432.A O no hydrogen 2.799 N/A ASN 504.A N LEU 442.A O no hydrogen 2.849 N/A ASN 504.A ND2 ARG 436.A O no hydrogen 2.743 N/A ASN 504.A ND2 VAL 440.A O no hydrogen 3.000 N/A PHE 506.A N ASN 504.A OD1 no hydrogen 3.090 N/A ARG 507.A NH1 LEU 566.A O no hydrogen 2.991 N/A ARG 507.A NH1 GLY 568.A O no hydrogen 3.003 N/A ARG 507.A NH2 GLY 568.A O no hydrogen 3.244 N/A LYS 508.A N PRO 437.A O no hydrogen 2.782 N/A ASP 509.A N LYS 513.A O no hydrogen 2.549 N/A ASN 511.A N ASP 509.A OD1 no hydrogen 2.947 N/A GLY 512.A N ASP 509.A O no hydrogen 3.115 N/A LYS 513.A N ASP 509.A OD1 no hydrogen 2.814 N/A LEU 515.A N ARG 507.A O no hydrogen 2.819 N/A TRP 516.A NE1 ASN 522.A OD1 no hydrogen 2.691 N/A GLU 521.A N GLY 518.A O no hydrogen 2.903 N/A ASN 522.A N PHE 519.A O no hydrogen 2.894 N/A SER 523.A N GLY 520.A O no hydrogen 3.087 N/A SER 523.A OG THR 298.A OG1 no hydrogen 3.425 N/A SER 523.A OG GLY 520.A O no hydrogen 2.894 N/A ARG 524.A N GLU 521.A O no hydrogen 2.896 N/A ARG 524.A NE GLU 521.A OE1 no hydrogen 2.623 N/A ARG 524.A NH1 ASN 554.A O no hydrogen 2.835 N/A ARG 524.A NH1 LYS 556.A O no hydrogen 2.973 N/A ARG 524.A NH2 GLU 521.A OE1 no hydrogen 2.913 N/A ARG 524.A NH2 LYS 556.A O no hydrogen 3.011 N/A LEU 526.A N ASN 522.A O no hydrogen 2.965 N/A GLU 527.A N SER 523.A O no hydrogen 2.877 N/A TRP 528.A N ARG 524.A O no hydrogen 3.352 N/A TRP 528.A NE1 SER 538.A O no hydrogen 3.051 N/A MET 529.A N VAL 525.A O no hydrogen 3.024 N/A PHE 530.A N LEU 526.A O no hydrogen 2.839 N/A GLY 531.A N GLU 527.A O no hydrogen 3.008 N/A ARG 532.A N TRP 528.A O no hydrogen 2.960 N/A ARG 532.A NE GLU 445.A OE1 no hydrogen 2.811 N/A ARG 532.A NH1 GLU 536.A O no hydrogen 2.867 N/A ARG 532.A NH2 GLU 445.A OE2 no hydrogen 3.037 N/A ILE 533.A N MET 529.A O no hydrogen 2.919 N/A GLU 534.A N PHE 530.A O no hydrogen 3.033 N/A GLY 535.A N ARG 532.A O no hydrogen 3.047 N/A GLU 536.A N GLY 531.A O no hydrogen 3.009 N/A LYS 540.A N VAL 547.A O no hydrogen 2.881 N/A LYS 540.A NZ GLU 550.A OE2.A no hydrogen 2.767 N/A THR 542.A N GLY 545.A O no hydrogen 2.971 N/A THR 542.A OG1 GLY 545.A O no hydrogen 2.795 N/A ILE 544.A N THR 542.A OG1 no hydrogen 3.176 N/A GLY 545.A N THR 542.A O no hydrogen 3.225 N/A TYR 546.A N GLU 445.A O no hydrogen 2.885 N/A VAL 547.A N LYS 540.A O no hydrogen 2.909 N/A LYS 549.A N SER 538.A O no hydrogen 3.161 N/A LYS 549.A NZ ASP 537.A O no hydrogen 2.710 N/A LYS 549.A NZ ASP 537.A OD2 no hydrogen 3.313 N/A GLU 550.A N.A GLU 550.A OE2.A no hydrogen 2.885 N/A ALA 552.A N LYS 549.A O no hydrogen 2.933 N/A LYS 556.A N ASN 554.A OD1 no hydrogen 2.877 N/A LEU 558.A N LEU 555.A O no hydrogen 3.048 N/A ASN 562.A ND2 GLU 565.A OE1 no hydrogen 2.981 N/A VAL 563.A N VAL 561.A O no hydrogen 2.778 N/A GLU 565.A N ASN 562.A OD1 no hydrogen 3.394 N/A LEU 566.A N ASN 562.A O no hydrogen 2.925 N/A PHE 567.A N VAL 563.A O no hydrogen 2.805 N/A GLY 568.A N GLU 565.A O no hydrogen 3.382 N/A LYS 571.A NZ SER 609.A O no hydrogen 3.086 N/A LYS 571.A NZ MET 611.A O no hydrogen 2.762 N/A PHE 573.A N SER 570.A OG no hydrogen 3.046 N/A TRP 574.A N SER 570.A O no hydrogen 2.924 N/A GLU 575.A N LYS 571.A O no hydrogen 2.913 N/A LYS 576.A N GLU 572.A O no hydrogen 3.406 N/A GLU 577.A N PHE 573.A O no hydrogen 2.982 N/A VAL 578.A N TRP 574.A O no hydrogen 2.967 N/A GLU 579.A N GLU 575.A O no hydrogen 3.193 N/A GLU 580.A N LYS 576.A O no hydrogen 2.883 N/A ILE 581.A N GLU 577.A O no hydrogen 2.888 N/A ASP 582.A N VAL 578.A O no hydrogen 2.953 N/A LYS 583.A N GLU 579.A O no hydrogen 2.948 N/A TYR 584.A N GLU 580.A O no hydrogen 3.066 N/A LEU 585.A N ILE 581.A O no hydrogen 2.915 N/A GLU 586.A N ASP 582.A O no hydrogen 2.988 N/A ASP 587.A N LYS 583.A O no hydrogen 3.061 N/A GLN 588.A N TYR 584.A O no hydrogen 2.867 N/A GLN 588.A NE2 ASP 587.A OD2 no hydrogen 3.070 N/A VAL 589.A N LEU 585.A O no hydrogen 2.854 N/A ASN 590.A N LEU 585.A O no hydrogen 2.897 N/A ASN 590.A ND2 ILE 104.A O no hydrogen 2.935 N/A ASN 590.A ND2 GLU 586.A O no hydrogen 3.233 N/A ASN 590.A ND2 ASP 587.A O no hydrogen 2.941 N/A ALA 591.A N ASN 590.A OD1 no hydrogen 2.872 N/A ASP 592.A N VAL 589.A O no hydrogen 2.948 N/A LEU 593.A N ASN 590.A O no hydrogen 2.846 N/A GLU 596.A N GLU 596.A OE1.B no hydrogen 2.649 N/A ILE 597.A N PRO 594.A O no hydrogen 3.008 N/A GLU 598.A N PRO 594.A O no hydrogen 3.166 N/A ARG 599.A N TYR 595.A O no hydrogen 2.776 N/A GLU 600.A N GLU 596.A O no hydrogen 2.870 N/A LEU 601.A N ILE 597.A O no hydrogen 2.947 N/A ARG 602.A N GLU 598.A O no hydrogen 2.989 N/A ALA 603.A N ARG 599.A O no hydrogen 2.909 N/A LEU 604.A N GLU 600.A O no hydrogen 2.917 N/A LYS 605.A N LEU 601.A O no hydrogen 3.024 N/A GLN 606.A N ARG 602.A O no hydrogen 2.950 N/A ARG 607.A N ALA 603.A O no hydrogen 2.880 N/A ARG 607.A NE PRO 543.A O no hydrogen 2.752 N/A ARG 607.A NH2 PRO 543.A O no hydrogen 3.334 N/A ILE 608.A N LEU 604.A O no hydrogen 2.878 N/A SER 609.A N LYS 605.A O no hydrogen 2.940 N/A SER 609.A OG GLN 606.A O no hydrogen 2.697 N/A GLN 610.A N GLN 606.A O no hydrogen 3.347 N/A GLN 610.A N ARG 607.A O no hydrogen 3.345 N/A GLN 610.A NE2 SER 609.A OG no hydrogen 3.406 N/A MET 611.A N ILE 608.A O no hydrogen 2.988 N/A