Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ck9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N GLN 96.A OE1 no hydrogen 3.042 N/A SER 5.A N THR 2.A O no hydrogen 3.084 N/A PHE 6.A N GLY 3.A O no hydrogen 3.073 N/A GLN 8.A NE2 THR 105.A OG1 no hydrogen 3.007 N/A GLY 10.A N ASP 7.A OD1 no hydrogen 3.288 N/A VAL 11.A N ASP 7.A O no hydrogen 2.845 N/A PHE 12.A N GLN 8.A O no hydrogen 2.798 N/A VAL 13.A N GLN 9.A O no hydrogen 3.001 N/A LYS 14.A N GLY 10.A O no hydrogen 3.005 N/A GLY 15.A N VAL 11.A O no hydrogen 2.979 N/A GLY 15.A N PHE 12.A O no hydrogen 3.051 N/A TYR 16.A OH GLU 111.A OE1 no hydrogen 2.457 N/A ALA 17.A N VAL 13.A O no hydrogen 3.044 N/A MET 18.A N LYS 14.A O no hydrogen 3.136 N/A LEU 19.A N TYR 16.A O no hydrogen 3.140 N/A GLY 20.A N ALA 17.A O no hydrogen 2.959 N/A VAL 21.A N ALA 17.A O no hydrogen 2.893 N/A THR 22.A OG1 GLU 31.A OE2 no hydrogen 3.008 N/A GLU 33.A N ASP 30.A O no hydrogen 2.886 N/A SER 34.A N GLU 31.A O no hydrogen 3.086 N/A SER 34.A OG GLU 31.A O no hydrogen 2.683 N/A ARG 38.A NH1 GLY 32.A O no hydrogen 2.913 N/A THR 39.A N GLY 35.A O no hydrogen 3.220 N/A THR 39.A OG1 GLY 35.A O no hydrogen 2.902 N/A THR 39.A OG1 PHE 36.A O no hydrogen 3.271 N/A THR 40.A N PHE 36.A O no hydrogen 3.354 N/A THR 40.A OG1 PHE 36.A O no hydrogen 2.897 N/A THR 40.A OG1 TYR 37.A O no hydrogen 3.054 N/A PHE 41.A N TYR 37.A O no hydrogen 2.883 N/A ASN 42.A N ARG 38.A O no hydrogen 2.935 N/A CYS 43.A N THR 39.A O no hydrogen 3.228 N/A CYS 43.A SG THR 39.A O no hydrogen 3.168 N/A CYS 43.A SG ARG 75.A O no hydrogen 4.031 N/A ASN 44.A N THR 40.A O no hydrogen 3.093 N/A ASN 44.A N PHE 41.A O no hydrogen 3.009 N/A ASN 44.A ND2 CYS 43.A O no hydrogen 3.400 N/A GLU 45.A N ASN 42.A O no hydrogen 3.125 N/A LEU 46.A N ASN 42.A O no hydrogen 3.064 N/A THR 48.A N GLU 45.A O no hydrogen 2.781 N/A THR 48.A OG1 GLU 45.A O no hydrogen 2.795 N/A GLU 50.A N THR 48.A OG1 no hydrogen 3.101 N/A LEU 52.A N PHE 281.A O no hydrogen 2.857 N/A TRP 53.A NE1 ASN 58.A OD1 no hydrogen 2.869 N/A ALA 54.A N CYS 279.A O no hydrogen 2.706 N/A TRP 55.A NE1 TRP 277.A O no hydrogen 3.276 N/A TRP 55.A NE1 SER 278.A O no hydrogen 3.013 N/A GLN 56.A N ALA 54.A O no hydrogen 3.189 N/A GLN 56.A NE2 TRP 53.A O no hydrogen 2.854 N/A GLN 56.A NE2 THR 65.A OG1 no hydrogen 3.126 N/A ASN 58.A N TRP 55.A O no hydrogen 3.116 N/A GLN 59.A NE2 GLY 28.A O no hydrogen 2.857 N/A ILE 61.A N ASN 58.A O no hydrogen 3.178 N/A LEU 64.A N ASP 60.A O no hydrogen 3.247 N/A THR 65.A N ILE 61.A O no hydrogen 2.822 N/A THR 65.A OG1 ILE 61.A O no hydrogen 2.691 N/A SER 66.A N PRO 62.A O no hydrogen 3.186 N/A SER 66.A OG PRO 62.A O no hydrogen 2.925 N/A SER 66.A OG SER 68.A OG no hydrogen 3.282 N/A SER 68.A N GLN 63.A O no hydrogen 2.887 N/A SER 68.A OG SER 66.A OG no hydrogen 3.282 N/A TRP 69.A NE1 TYR 507.A OH no hydrogen 2.801 N/A SER 72.A N SER 70.A OG no hydrogen 3.280 N/A SER 72.A OG SER 70.A OG no hydrogen 2.918 N/A SER 73.A N SER 70.A O no hydrogen 2.873 N/A SER 73.A OG ASP 60.A OD2 no hydrogen 2.557 N/A SER 73.A OG THR 76.A OG1 no hydrogen 2.718 N/A GLN 74.A N GLN 74.A OE1 no hydrogen 3.122 N/A ARG 75.A N ASP 60.A OD2 no hydrogen 3.044 N/A ARG 75.A NE GLN 59.A O no hydrogen 2.921 N/A ARG 75.A NH1 GLU 33.A OE2 no hydrogen 2.849 N/A ARG 75.A NH2 GLN 59.A O no hydrogen 3.183 N/A THR 76.A N SER 73.A O no hydrogen 3.287 N/A THR 76.A N SER 73.A OG no hydrogen 3.192 N/A THR 76.A OG1 SER 73.A OG no hydrogen 2.718 N/A GLU 77.A N SER 73.A O no hydrogen 3.175 N/A TRP 78.A N GLN 74.A O no hydrogen 2.963 N/A VAL 79.A N ARG 75.A O no hydrogen 3.435 N/A TYR 80.A N THR 76.A O no hydrogen 3.121 N/A TYR 80.A OH ASP 494.A OD2 no hydrogen 2.577 N/A VAL 81.A N GLU 77.A O no hydrogen 2.793 N/A ARG 82.A N TRP 78.A O no hydrogen 2.974 N/A ARG 82.A NE SER 34.A O no hydrogen 2.746 N/A ARG 82.A NH1 ASP 86.A OD1 no hydrogen 2.873 N/A ARG 82.A NH2 SER 34.A O no hydrogen 3.350 N/A LEU 83.A N VAL 79.A O no hydrogen 2.992 N/A GLY 84.A N TYR 80.A O no hydrogen 3.062 N/A TYR 85.A N VAL 81.A O no hydrogen 2.766 N/A ASP 86.A N ARG 82.A O no hydrogen 3.007 N/A ILE 87.A N LEU 83.A O no hydrogen 3.229 N/A THR 88.A N GLY 84.A O no hydrogen 3.086 N/A THR 88.A OG1 TYR 85.A O no hydrogen 2.681 N/A GLN 89.A N TYR 85.A O no hydrogen 3.187 N/A GLN 89.A NE2 THR 88.A OG1 no hydrogen 2.985 N/A TYR 90.A N ASP 86.A O no hydrogen 3.051 N/A TYR 90.A OH GLY 15.A O no hydrogen 3.039 N/A ASN 91.A N ILE 87.A O no hydrogen 2.770 N/A ASN 91.A ND2 LYS 133.A O no hydrogen 2.882 N/A ASN 91.A ND2 HIS 135.A O no hydrogen 3.534 N/A PHE 92.A N THR 88.A O no hydrogen 2.948 N/A PHE 93.A N GLN 89.A O no hydrogen 3.108 N/A LEU 94.A N TYR 90.A O no hydrogen 2.916 N/A ASP 95.A N ASN 91.A O no hydrogen 2.799 N/A GLN 96.A N PHE 92.A O no hydrogen 2.929 N/A THR 97.A N PHE 93.A O no hydrogen 3.126 N/A THR 97.A OG1 PHE 93.A O no hydrogen 2.865 N/A THR 97.A OG1 LEU 94.A O no hydrogen 3.424 N/A GLU 98.A N ASP 95.A O no hydrogen 3.326 N/A MET 100.A N THR 97.A O no hydrogen 3.023 N/A THR 105.A N ASP 102.A OD2 no hydrogen 2.877 N/A THR 105.A OG1 ASP 102.A OD1 no hydrogen 2.611 N/A THR 105.A OG1 ASP 102.A OD2 no hydrogen 3.058 N/A LEU 106.A N ASP 102.A O no hydrogen 2.954 N/A ARG 107.A N ALA 103.A O no hydrogen 3.042 N/A ARG 107.A NE ASP 163.A O no hydrogen 3.100 N/A ARG 107.A NH2 ASP 163.A O no hydrogen 3.529 N/A GLN 108.A N GLU 104.A O no hydrogen 2.991 N/A ARG 109.A N THR 105.A O no hydrogen 2.778 N/A ARG 109.A NH1 LEU 94.A O no hydrogen 2.751 N/A ARG 109.A NH1 THR 97.A OG1 no hydrogen 2.818 N/A ARG 109.A NH2 GLU 98.A OE2 no hydrogen 2.949 N/A ALA 110.A N LEU 106.A O no hydrogen 2.948 N/A GLU 111.A N ARG 107.A O no hydrogen 3.028 N/A ILE 112.A N GLN 108.A O no hydrogen 2.803 N/A ARG 113.A N ARG 109.A O no hydrogen 2.862 N/A ARG 113.A NE GLU 156.A OE2 no hydrogen 3.195 N/A ARG 113.A NH2 GLU 156.A OE1 no hydrogen 2.610 N/A ARG 113.A NH2 GLU 159.A OE1 no hydrogen 3.335 N/A PHE 114.A N ALA 110.A O no hydrogen 2.891 N/A LEU 115.A N GLU 111.A O no hydrogen 2.840 N/A ARG 116.A N ILE 112.A O no hydrogen 2.836 N/A ARG 116.A NH1 ASN 91.A OD1 no hydrogen 2.924 N/A ARG 116.A NH1 GLU 134.A O no hydrogen 3.404 N/A ARG 116.A NH1 GLU 134.A OE1 no hydrogen 3.022 N/A ARG 116.A NH2 GLU 134.A OE1 no hydrogen 2.993 N/A ARG 116.A NH2 GLU 156.A OE2 no hydrogen 2.623 N/A ALA 117.A N ARG 113.A O no hydrogen 2.859 N/A LEU 118.A N PHE 114.A O no hydrogen 2.900 N/A HIS 119.A N LEU 115.A O no hydrogen 3.110 N/A HIS 119.A ND1 LEU 115.A O no hydrogen 2.816 N/A HIS 119.A NE2 ASP 86.A OD2 no hydrogen 2.711 N/A TYR 120.A N ARG 116.A O no hydrogen 2.910 N/A TYR 120.A OH LYS 133.A O no hydrogen 3.080 N/A TRP 121.A N ALA 117.A O no hydrogen 2.931 N/A TRP 121.A N LEU 118.A O no hydrogen 3.002 N/A TRP 121.A NE1 TYR 194.A OH no hydrogen 3.084 N/A TYR 122.A N LEU 118.A O no hydrogen 3.231 N/A PHE 123.A N HIS 119.A O no hydrogen 3.112 N/A LEU 124.A N TYR 120.A O no hydrogen 2.885 N/A ASP 125.A N TRP 121.A O no hydrogen 2.616 N/A LEU 126.A N TYR 122.A O no hydrogen 2.724 N/A PHE 127.A N PHE 123.A O no hydrogen 2.692 N/A GLY 128.A N LEU 124.A O no hydrogen 2.893 N/A LYS 129.A NZ GLU 143.A OE1 no hydrogen 3.492 N/A LYS 129.A NZ GLU 143.A OE2 no hydrogen 3.236 N/A LYS 129.A NZ SER 502.A O no hydrogen 2.771 N/A LYS 129.A NZ SER 502.A OG no hydrogen 2.951 N/A ALA 130.A N LYS 144.A O no hydrogen 2.913 N/A PHE 132.A N VAL 142.A O no hydrogen 2.615 N/A LYS 133.A N TYR 120.A OH no hydrogen 3.338 N/A LYS 133.A NZ SER 137.A OG no hydrogen 3.136 N/A LYS 133.A NZ ASP 139.A O no hydrogen 2.989 N/A HIS 135.A ND1 ASP 95.A OD1 no hydrogen 2.682 N/A PHE 136.A N ASP 95.A OD2 no hydrogen 2.597 N/A VAL 142.A N PHE 132.A O no hydrogen 2.884 N/A LYS 144.A N ALA 130.A O no hydrogen 3.189 N/A LYS 144.A NZ GLU 148.A OE1 no hydrogen 3.312 N/A GLY 146.A N GLY 128.A O no hydrogen 2.896 N/A LEU 149.A N LYS 145.A O no hydrogen 3.039 N/A TYR 150.A N GLY 146.A O no hydrogen 2.852 N/A THR 151.A N THR 147.A O no hydrogen 2.881 N/A THR 151.A OG1 THR 147.A O no hydrogen 2.761 N/A TYR 152.A N GLU 148.A O no hydrogen 3.078 N/A TYR 152.A OH GLU 134.A OE2 no hydrogen 2.667 N/A ILE 153.A N LEU 149.A O no hydrogen 3.030 N/A GLN 154.A N TYR 150.A O no hydrogen 3.115 N/A GLN 154.A NE2 TYR 150.A OH no hydrogen 3.298 N/A GLN 154.A NE2 ARG 184.A O no hydrogen 3.602 N/A ASN 155.A N THR 151.A O no hydrogen 2.947 N/A GLU 156.A N TYR 152.A O no hydrogen 2.906 N/A LEU 157.A N ILE 153.A O no hydrogen 3.023 N/A ASN 158.A N GLN 154.A O no hydrogen 2.894 N/A GLU 159.A N ASN 155.A O no hydrogen 2.897 N/A ILE 160.A N GLU 156.A O no hydrogen 3.054 N/A ASP 163.A N ILE 160.A O no hydrogen 3.176 N/A MET 164.A N GLU 161.A O no hydrogen 2.863 N/A ARG 168.A N ASP 176.A OD2 no hydrogen 3.031 N/A ARG 168.A NH1 GLU 233.A OE2 no hydrogen 2.780 N/A ARG 168.A NH2 GLU 233.A OE1 no hydrogen 3.141 N/A ARG 168.A NH2 GLU 233.A OE2 no hydrogen 3.398 N/A GLN 169.A N GLU 166.A O no hydrogen 3.031 N/A ARG 174.A N PRO 171.A O no hydrogen 2.985 N/A ARG 174.A NE GLU 111.A OE1 no hydrogen 2.814 N/A ARG 174.A NH2 GLU 111.A OE1 no hydrogen 3.431 N/A ARG 174.A NH2 GLU 111.A OE2 no hydrogen 2.748 N/A ALA 175.A N TYR 16.A OH no hydrogen 2.863 N/A LYS 177.A N TYR 165.A O no hydrogen 2.884 N/A LYS 177.A NZ GLU 166.A OE2 no hydrogen 2.663 N/A ALA 179.A N ASP 176.A O no hydrogen 3.028 N/A ALA 179.A N ASP 176.A OD1 no hydrogen 2.936 N/A ASN 180.A N ASP 176.A O no hydrogen 3.163 N/A ASN 180.A ND2 LEU 157.A O no hydrogen 2.878 N/A TRP 181.A N LYS 177.A O no hydrogen 2.708 N/A LEU 182.A N ALA 178.A O no hydrogen 2.808 N/A LEU 183.A N ALA 179.A O no hydrogen 3.022 N/A ARG 184.A N ASN 180.A O no hydrogen 3.107 N/A ARG 184.A NE GLN 154.A OE1 no hydrogen 2.823 N/A ARG 184.A NH2 GLN 154.A OE1 no hydrogen 3.501 N/A ALA 185.A N TRP 181.A O no hydrogen 2.949 N/A ARG 186.A N LEU 182.A O no hydrogen 3.004 N/A ARG 186.A NE GLU 397.A OE2 no hydrogen 2.813 N/A ARG 186.A NH2 GLU 397.A OE1 no hydrogen 2.829 N/A ARG 186.A NH2 GLU 397.A OE2 no hydrogen 3.151 N/A LEU 187.A N LEU 183.A O no hydrogen 2.907 N/A TYR 188.A N ARG 184.A O no hydrogen 2.776 N/A LEU 189.A N ALA 185.A O no hydrogen 2.906 N/A ASN 190.A N ARG 186.A O no hydrogen 3.024 N/A ASN 190.A ND2 ARG 186.A O no hydrogen 3.167 N/A ALA 191.A N TYR 188.A O no hydrogen 3.168 N/A TYR 194.A N ASN 190.A O no hydrogen 3.098 N/A TYR 194.A OH ASP 125.A OD1 no hydrogen 2.674 N/A THR 195.A N ALA 191.A O no hydrogen 2.821 N/A THR 195.A OG1 ALA 191.A O no hydrogen 2.727 N/A GLY 196.A N GLY 192.A O no hydrogen 2.923 N/A GLN 197.A N THR 195.A OG1 no hydrogen 3.136 N/A GLN 197.A NE2 THR 198.A O no hydrogen 3.190 N/A LYS 202.A N ASP 199.A O no hydrogen 3.048 N/A LYS 202.A NZ GLU 205.A OE1 no hydrogen 3.051 N/A ALA 203.A N ASP 199.A O no hydrogen 3.239 N/A GLU 204.A N TYR 200.A O no hydrogen 2.913 N/A GLU 205.A N ALA 201.A O no hydrogen 2.976 N/A TYR 206.A N LYS 202.A O no hydrogen 2.940 N/A ALA 207.A N ALA 203.A O no hydrogen 3.046 N/A SER 208.A N GLU 204.A O no hydrogen 2.914 N/A SER 208.A OG GLU 204.A O no hydrogen 3.239 N/A LYS 209.A N GLU 205.A O no hydrogen 3.092 N/A VAL 210.A N TYR 206.A O no hydrogen 3.238 N/A ILE 211.A N ALA 207.A O no hydrogen 2.890 N/A GLY 212.A N SER 208.A O no hydrogen 2.674 N/A SER 213.A N VAL 210.A O no hydrogen 2.983 N/A SER 213.A OG VAL 210.A O no hydrogen 2.622 N/A TYR 215.A N SER 213.A OG no hydrogen 3.402 N/A TYR 215.A OH ASP 176.A OD2 no hydrogen 2.595 N/A LYS 216.A N GLN 237.A O no hydrogen 2.848 N/A LYS 216.A NZ SER 213.A O no hydrogen 2.965 N/A LYS 216.A NZ TYR 215.A O no hydrogen 3.125 N/A CYS 218.A N GLU 238.A OE1 no hydrogen 2.619 N/A CYS 218.A SG ASN 220.A O no hydrogen 3.141 N/A THR 219.A N ASN 234.A OD1 no hydrogen 2.948 N/A TYR 221.A OH GLU 445.A O no hydrogen 2.748 N/A SER 222.A OG ASN 220.A OD1 no hydrogen 2.450 N/A GLU 223.A N ASN 220.A O no hydrogen 2.948 N/A LEU 224.A N TYR 221.A O no hydrogen 3.017 N/A PHE 225.A N SER 222.A O no hydrogen 2.894 N/A MET 226.A N GLU 223.A O no hydrogen 3.409 N/A ALA 227.A N TYR 373.A O no hydrogen 2.946 N/A ASN 229.A N MET 226.A O no hydrogen 3.133 N/A ASN 229.A ND2 LEU 224.A O no hydrogen 3.192 N/A ASN 229.A ND2 ASP 389.A O no hydrogen 2.760 N/A GLU 231.A N ASP 228.A O no hydrogen 2.904 N/A ASN 232.A ND2 GLU 223.A OE1 no hydrogen 2.821 N/A ASN 234.A N ASN 232.A OD1 no hydrogen 2.881 N/A ASN 234.A ND2 THR 219.A OG1 no hydrogen 2.940 N/A ASN 234.A ND2 GLU 223.A OE1 no hydrogen 2.996 N/A MET 236.A N ASN 232.A O no hydrogen 2.809 N/A GLN 237.A N GLU 233.A O no hydrogen 2.910 N/A GLN 237.A NE2 ASN 234.A O no hydrogen 3.100 N/A GLU 238.A N ALA 235.A O no hydrogen 3.018 N/A ILE 239.A N ALA 235.A O no hydrogen 3.274 N/A ILE 240.A N PHE 393.A O no hydrogen 2.800 N/A LEU 241.A N PHE 393.A O no hydrogen 3.210 N/A ILE 243.A N ILE 390.A O no hydrogen 2.825 N/A ARG 244.A NE ASP 389.A OD2 no hydrogen 2.808 N/A ARG 244.A NH2 ASP 230.A OD2 no hydrogen 3.431 N/A GLN 245.A N ASP 389.A OD1 no hydrogen 2.764 N/A GLN 245.A NE2 GLY 20.A O no hydrogen 2.906 N/A GLN 245.A NE2 ARG 244.A O no hydrogen 2.711 N/A ASP 246.A N THR 250.A O no hydrogen 2.946 N/A GLY 247.A N ASP 387.A OD1 no hydrogen 2.702 N/A VAL 248.A N ASP 246.A OD1 no hydrogen 2.706 N/A LYS 249.A N ASP 246.A OD1 no hydrogen 2.604 N/A ARG 251.A NE GLY 247.A O no hydrogen 2.939 N/A ARG 251.A NH2 GLY 247.A O no hydrogen 3.354 N/A GLY 255.A N ASN 252.A O no hydrogen 2.595 N/A SER 256.A N GLN 245.A OE1 no hydrogen 2.898 N/A SER 256.A OG THR 388.A O no hydrogen 2.918 N/A THR 257.A OG1 ASN 252.A O no hydrogen 3.550 N/A TYR 258.A N GLY 255.A O no hydrogen 2.979 N/A TYR 258.A OH ASN 42.A OD1 no hydrogen 2.565 N/A VAL 260.A N SER 256.A O no hydrogen 2.955 N/A CYS 261.A N THR 257.A O no hydrogen 2.680 N/A CYS 261.A SG THR 273.A OG1 no hydrogen 3.518 N/A CYS 261.A SG ASN 275.A O no hydrogen 3.477 N/A CYS 261.A SG THR 384.A O no hydrogen 3.881 N/A THR 263.A N VAL 260.A O no hydrogen 3.327 N/A THR 263.A OG1 LEU 259.A O no hydrogen 2.783 N/A THR 263.A OG1 VAL 260.A O no hydrogen 3.118 N/A THR 263.A OG1 ILE 367.A O no hydrogen 3.321 N/A ARG 264.A N CYS 261.A O no hydrogen 3.136 N/A ARG 264.A NH1 TRP 370.A O no hydrogen 3.205 N/A ARG 264.A NH2 TRP 370.A O no hydrogen 2.630 N/A MET 268.A N VAL 265.A O no hydrogen 3.208 N/A ARG 270.A N ASP 314.A OD2 no hydrogen 2.656 N/A ARG 270.A NH1 ASP 318.A OD2 no hydrogen 2.771 N/A ARG 270.A NH2 ASP 318.A OD1 no hydrogen 3.199 N/A THR 273.A OG1 THR 384.A O no hydrogen 2.876 N/A THR 274.A OG1 THR 384.A OG1 no hydrogen 2.793 N/A ASN 275.A N THR 273.A OG1 no hydrogen 3.145 N/A TRP 277.A N CYS 261.A O no hydrogen 3.031 N/A SER 278.A N ARG 264.A O no hydrogen 2.660 N/A SER 278.A OG TRP 277.A O no hydrogen 2.468 N/A CYS 279.A N GLY 262.A O no hydrogen 2.880 N/A CYS 279.A SG TRP 277.A O no hydrogen 3.568 N/A ILE 280.A N GLY 262.A O no hydrogen 2.754 N/A PHE 281.A N LEU 52.A O no hydrogen 3.231 N/A ALA 282.A N LEU 365.A O no hydrogen 2.945 N/A ARG 283.A NE CYS 51.A O no hydrogen 2.902 N/A ARG 283.A NH1 ASP 470.A O no hydrogen 2.925 N/A ARG 283.A NH2 LEU 46.A O no hydrogen 2.784 N/A ARG 283.A NH2 THR 65.A O no hydrogen 2.962 N/A ALA 284.A N ASP 470.A OD2 no hydrogen 2.741 N/A ALA 285.A N ASP 470.A OD1 no hydrogen 2.921 N/A MET 286.A N ARG 283.A O no hydrogen 2.967 N/A VAL 287.A N ARG 283.A O no hydrogen 3.337 N/A GLN 288.A N ALA 284.A O no hydrogen 3.003 N/A LYS 289.A N MET 286.A O no hydrogen 2.976 N/A LYS 289.A NZ ALA 285.A O no hydrogen 2.742 N/A LYS 289.A NZ TYR 467.A OH no hydrogen 2.881 N/A PHE 290.A N VAL 287.A O no hydrogen 3.066 N/A PHE 291.A N VAL 287.A O no hydrogen 3.053 N/A GLU 295.A N ASN 293.A OD1 no hydrogen 2.672 N/A ASP 296.A N ASN 293.A O no hydrogen 2.917 N/A VAL 297.A N LEU 294.A O no hydrogen 3.450 N/A VAL 304.A N PRO 301.A O no hydrogen 3.171 N/A ASP 312.A N GLN 316.A OE1 no hydrogen 2.773 N/A THR 313.A N GLN 316.A OE1 no hydrogen 3.138 N/A GLN 316.A N THR 313.A OG1 no hydrogen 3.206 N/A ILE 317.A N THR 313.A O no hydrogen 2.932 N/A ASP 318.A N ASP 314.A O no hydrogen 2.803 N/A ALA 319.A N GLU 315.A O no hydrogen 3.119 N/A PHE 320.A N GLN 316.A O no hydrogen 3.129 N/A ASP 321.A N ILE 317.A O no hydrogen 2.930 N/A ALA 322.A N ASP 318.A O no hydrogen 2.743 N/A GLU 323.A N ALA 319.A O no hydrogen 3.193 N/A HIS 324.A N PHE 320.A O no hydrogen 3.357 N/A HIS 324.A N ASP 321.A O no hydrogen 3.136 N/A GLY 325.A N ALA 322.A O no hydrogen 3.012 N/A ILE 326.A N ASP 321.A O no hydrogen 2.637 N/A ARG 327.A N ASP 330.A OD2 no hydrogen 3.062 N/A ARG 327.A NE ASP 330.A OD2 no hydrogen 2.826 N/A ARG 327.A NH2 ASP 330.A OD1 no hydrogen 3.178 N/A THR 328.A OG1 LEU 342.A O no hydrogen 2.926 N/A MET 331.A N ARG 327.A O no hydrogen 2.914 N/A ILE 332.A N THR 328.A O no hydrogen 2.886 N/A LYS 333.A N GLU 329.A O no hydrogen 3.058 N/A ALA 334.A N ASP 330.A O no hydrogen 3.114 N/A ALA 335.A N MET 331.A O no hydrogen 2.946 N/A GLY 336.A N ILE 332.A O no hydrogen 2.777 N/A GLY 336.A N LYS 333.A O no hydrogen 3.229 N/A ASP 338.A N ALA 424.A O no hydrogen 2.922 N/A ARG 339.A N ASP 337.A OD1 no hydrogen 2.711 N/A ARG 339.A NE ASP 337.A OD1 no hydrogen 2.974 N/A ARG 339.A NE ASP 337.A OD2 no hydrogen 3.306 N/A ARG 339.A NH1 GLU 441.A OE2 no hydrogen 2.592 N/A ARG 339.A NH1 GLU 445.A OE1 no hydrogen 2.850 N/A ARG 339.A NH2 ASP 337.A OD2 no hydrogen 2.797 N/A ARG 339.A NH2 GLU 441.A OE2 no hydrogen 2.633 N/A ALA 340.A N ASP 337.A O no hydrogen 3.055 N/A LEU 342.A N ALA 340.A O no hydrogen 2.714 N/A TYR 343.A N SER 366.A O no hydrogen 2.834 N/A TYR 343.A OH ASP 321.A OD2 no hydrogen 2.663 N/A SER 344.A OG PRO 298.A O no hydrogen 2.825 N/A VAL 346.A N ASP 321.A OD1 no hydrogen 2.944 N/A GLY 347.A N TYR 343.A OH no hydrogen 2.809 N/A GLY 349.A N VAL 346.A O no hydrogen 2.858 N/A ARG 350.A NH1 PRO 301.A O no hydrogen 3.205 N/A ARG 350.A NH1 VAL 304.A O no hydrogen 3.346 N/A ARG 350.A NH2 VAL 304.A O no hydrogen 2.764 N/A ARG 351.A NE SER 366.A OG no hydrogen 3.074 N/A ARG 351.A NH1 GLY 347.A O no hydrogen 3.000 N/A ARG 351.A NH1 GLY 349.A O no hydrogen 2.820 N/A ARG 351.A NH2 GLY 347.A O no hydrogen 2.908 N/A ARG 351.A NH2 SER 366.A OG no hydrogen 3.117 N/A LYS 352.A N THR 362.A O no hydrogen 3.005 N/A LYS 352.A NZ THR 355.A OG1 no hydrogen 3.382 N/A LYS 352.A NZ ASP 363.A OD1 no hydrogen 2.956 N/A GLN 354.A NE2 ASN 477.A OD1 no hydrogen 3.642 N/A THR 355.A OG1 ALA 357.A O no hydrogen 2.606 N/A ALA 357.A N THR 355.A OG1 no hydrogen 3.230 N/A SER 359.A N ASP 363.A OD2 no hydrogen 2.654 N/A SER 359.A OG ASP 363.A OD1 no hydrogen 3.172 N/A SER 359.A OG ASP 363.A OD2 no hydrogen 2.530 N/A GLY 360.A N ASP 363.A OD2 no hydrogen 2.895 N/A ASP 363.A N GLY 360.A O no hydrogen 3.110 N/A SER 366.A N TYR 343.A O no hydrogen 3.052 N/A VAL 368.A N LEU 341.A O no hydrogen 3.016 N/A LYS 369.A NZ TYR 221.A OH no hydrogen 2.718 N/A LYS 369.A NZ GLU 445.A O no hydrogen 3.314 N/A LYS 369.A NZ TYR 447.A O no hydrogen 3.030 N/A LYS 369.A NZ GLU 449.A OE2 no hydrogen 2.519 N/A TRP 370.A NE1 LEU 448.A O no hydrogen 3.131 N/A GLN 371.A N PHE 225.A O no hydrogen 2.993 N/A ARG 374.A NE ASP 376.A OD1 no hydrogen 3.069 N/A ARG 374.A NE ASP 376.A OD2 no hydrogen 3.433 N/A ARG 374.A NH1 GLU 231.A OE1 no hydrogen 2.739 N/A ARG 374.A NH2 GLU 231.A OE1 no hydrogen 2.914 N/A ARG 374.A NH2 ASP 376.A OD2 no hydrogen 2.943 N/A SER 375.A N ASP 228.A OD1 no hydrogen 2.897 N/A SER 375.A OG ASP 228.A OD2 no hydrogen 2.710 N/A GLY 377.A N ARG 374.A O no hydrogen 2.978 N/A LYS 378.A N ASP 376.A OD1 no hydrogen 2.834 N/A SER 381.A N ASP 387.A OD2 no hydrogen 2.699 N/A SER 381.A OG ASP 387.A OD1 no hydrogen 2.471 N/A SER 381.A OG ASP 387.A OD2 no hydrogen 3.469 N/A THR 384.A N HIS 382.A ND1 no hydrogen 2.728 N/A THR 384.A OG1 THR 274.A OG1 no hydrogen 2.793 N/A TYR 385.A N HIS 382.A ND1 no hydrogen 3.054 N/A THR 388.A OG1 GLN 371.A O no hydrogen 2.561 N/A ASP 389.A N ASN 229.A OD1 no hydrogen 3.034 N/A ILE 390.A N ILE 243.A O no hydrogen 3.171 N/A LEU 392.A N ILE 390.A O no hydrogen 2.869 N/A PHE 393.A N LEU 241.A O no hydrogen 3.111 N/A ARG 394.A NE GLU 449.A OE1 no hydrogen 2.975 N/A ARG 394.A NH1 GLU 238.A OE2 no hydrogen 2.815 N/A ARG 394.A NH1 GLU 445.A OE2 no hydrogen 3.035 N/A ARG 394.A NH2 GLU 445.A OE2 no hydrogen 3.091 N/A ARG 394.A NH2 GLU 449.A OE2 no hydrogen 2.984 N/A LEU 395.A N GLU 238.A O no hydrogen 3.069 N/A GLU 397.A N ARG 394.A O no hydrogen 2.974 N/A ALA 398.A N LEU 395.A O no hydrogen 2.749 N/A LEU 400.A N ALA 396.A O no hydrogen 3.189 N/A THR 401.A N GLU 397.A O no hydrogen 2.939 N/A THR 401.A OG1 GLU 397.A O no hydrogen 2.674 N/A ARG 402.A N ALA 398.A O no hydrogen 2.879 N/A ARG 402.A NE ASP 416.A OD2 no hydrogen 2.909 N/A ARG 402.A NH1 SER 208.A OG no hydrogen 2.911 N/A ARG 402.A NH2 ASP 416.A OD1 no hydrogen 2.873 N/A ALA 403.A N TYR 399.A O no hydrogen 2.765 N/A GLU 404.A N LEU 400.A O no hydrogen 2.868 N/A ALA 405.A N THR 401.A O no hydrogen 2.977 N/A ILE 406.A N ARG 402.A O no hydrogen 2.785 N/A PHE 407.A N ALA 403.A O no hydrogen 3.004 N/A ARG 408.A N GLU 404.A O no hydrogen 2.977 N/A ARG 408.A NE GLU 404.A OE1 no hydrogen 3.123 N/A GLN 409.A N ALA 405.A O no hydrogen 3.070 N/A GLN 409.A N ILE 406.A O no hydrogen 2.969 N/A GLY 410.A N PHE 407.A O no hydrogen 2.846 N/A GLY 411.A N ILE 406.A O no hydrogen 2.940 N/A THR 414.A N ASP 412.A OD1 no hydrogen 3.202 N/A THR 414.A OG1 ASP 412.A OD1 no hydrogen 2.809 N/A THR 414.A OG1 ASP 412.A OD2 no hydrogen 3.125 N/A ILE 417.A N ALA 413.A O no hydrogen 3.224 N/A ASN 418.A N THR 414.A O no hydrogen 2.884 N/A ASN 418.A ND2 VAL 430.A O no hydrogen 3.207 N/A GLU 419.A N GLY 415.A O no hydrogen 3.233 N/A GLU 419.A N ASP 416.A O no hydrogen 3.262 N/A LEU 420.A N ILE 417.A O no hydrogen 3.214 N/A ARG 421.A N ILE 417.A O no hydrogen 3.043 N/A ARG 421.A NE ARG 428.A O no hydrogen 2.913 N/A ARG 421.A NH1 GLU 441.A OE1 no hydrogen 2.797 N/A ARG 421.A NH2 ARG 428.A O no hydrogen 3.034 N/A LYS 422.A N ASN 418.A O no hydrogen 2.750 N/A ARG 423.A N GLU 419.A O no hydrogen 3.219 N/A ARG 423.A NH1 CYS 218.A O no hydrogen 2.667 N/A ARG 423.A NH1 GLU 238.A OE1 no hydrogen 2.649 N/A ARG 423.A NH2 GLU 238.A OE1 no hydrogen 3.505 N/A ARG 423.A NH2 GLU 238.A OE2 no hydrogen 3.051 N/A ARG 423.A NH2 GLU 445.A OE2 no hydrogen 3.164 N/A ALA 424.A N LEU 420.A O no hydrogen 2.981 N/A ASN 425.A N LYS 422.A O no hydrogen 2.898 N/A ASN 425.A ND2 ASP 338.A OD2 no hydrogen 2.710 N/A CYS 426.A N ARG 421.A O no hydrogen 2.760 N/A CYS 426.A SG ASP 337.A OD2 no hydrogen 3.098 N/A CYS 426.A SG ARG 421.A O no hydrogen 3.261 N/A THR 427.A N GLY 336.A O no hydrogen 3.050 N/A ARG 428.A NH1 GLU 437.A OE2 no hydrogen 2.944 N/A ARG 428.A NH2 GLU 437.A OE1 no hydrogen 3.084 N/A VAL 430.A N ASN 418.A OD1 no hydrogen 3.013 N/A GLN 431.A NE2 LYS 429.A O no hydrogen 3.097 N/A GLU 437.A N THR 434.A OG1 no hydrogen 3.054 N/A LEU 438.A N THR 434.A O no hydrogen 3.069 N/A ILE 439.A N GLU 435.A O no hydrogen 3.082 N/A ASP 440.A N GLN 436.A O no hydrogen 3.038 N/A GLU 441.A N GLU 437.A O no hydrogen 2.733 N/A TRP 442.A N LEU 438.A O no hydrogen 2.853 N/A TRP 442.A NE1 GLU 404.A OE2 no hydrogen 2.814 N/A ALA 443.A N ASP 440.A O no hydrogen 3.230 N/A ARG 444.A N ASP 440.A O no hydrogen 2.966 N/A ARG 444.A NE GLU 441.A OE1 no hydrogen 3.225 N/A ARG 444.A NH1 LYS 289.A O no hydrogen 2.717 N/A ARG 444.A NH2 GLU 437.A OE1 no hydrogen 2.832 N/A ARG 444.A NH2 GLU 441.A OE1 no hydrogen 2.867 N/A GLU 445.A N GLU 441.A O no hydrogen 2.870 N/A PHE 446.A N TRP 442.A O no hydrogen 3.075 N/A TYR 447.A N ALA 443.A O no hydrogen 2.882 N/A TYR 447.A OH ARG 339.A O no hydrogen 2.462 N/A LEU 448.A N GLU 50.A OE1 no hydrogen 2.979 N/A GLY 450.A N GLU 45.A OE2 no hydrogen 2.964 N/A ARG 451.A NE ASP 455.A OD1 no hydrogen 3.441 N/A ARG 451.A NE ASP 455.A OD2 no hydrogen 2.754 N/A ARG 451.A NH2 ASP 455.A OD1 no hydrogen 2.824 N/A ARG 452.A NE ASP 49.A OD1 no hydrogen 2.886 N/A ARG 452.A NH1 ILE 439.A O no hydrogen 2.963 N/A ARG 452.A NH2 ASP 49.A OD2 no hydrogen 3.093 N/A ARG 452.A NH2 ILE 439.A O no hydrogen 3.297 N/A ARG 453.A N ASN 44.A O no hydrogen 2.954 N/A ARG 453.A NH1 ASP 125.A O no hydrogen 3.409 N/A ARG 453.A NH1 ASP 125.A OD2 no hydrogen 2.969 N/A ARG 453.A NH2 ASP 125.A O no hydrogen 2.696 N/A ARG 453.A NH2 ASN 486.A O no hydrogen 3.053 N/A SER 454.A OG ASP 125.A OD1 no hydrogen 2.691 N/A SER 454.A OG ASP 125.A OD2 no hydrogen 3.399 N/A LEU 456.A N ARG 452.A O no hydrogen 3.092 N/A VAL 457.A N ARG 453.A O no hydrogen 2.935 N/A ARG 458.A N SER 454.A O no hydrogen 3.132 N/A ARG 458.A NE GLU 404.A OE1 no hydrogen 2.469 N/A ARG 458.A NH1 ASN 190.A OD1 no hydrogen 2.774 N/A ARG 458.A NH1 ASP 455.A OD1 no hydrogen 3.241 N/A ARG 458.A NH2 GLU 404.A OE2 no hydrogen 2.665 N/A ARG 458.A NH2 ASP 455.A OD1 no hydrogen 3.009 N/A PHE 459.A N ASP 455.A O no hydrogen 3.076 N/A GLY 460.A N VAL 457.A O no hydrogen 2.926 N/A MET 461.A N LEU 456.A O no hydrogen 2.864 N/A THR 464.A OG1 GLY 460.A O no hydrogen 2.657 N/A LYS 466.A N THR 464.A OG1 no hydrogen 3.277 N/A LYS 466.A NZ GLU 435.A OE1 no hydrogen 2.939 N/A LYS 466.A NZ GLU 435.A OE2 no hydrogen 3.029 N/A LYS 466.A NZ PHE 459.A O no hydrogen 3.102 N/A TYR 467.A OH ASP 49.A OD2 no hydrogen 2.468 N/A TRP 471.A N MET 476.A O no hydrogen 3.115 N/A LYS 472.A N TRP 469.A O no hydrogen 2.883 N/A LYS 472.A NZ MET 461.A O no hydrogen 2.858 N/A LYS 472.A NZ PHE 462.A O no hydrogen 3.031 N/A LYS 472.A NZ THR 464.A O no hydrogen 2.796 N/A LYS 472.A NZ TYR 467.A O no hydrogen 2.902 N/A GLY 474.A N TRP 471.A O no hydrogen 3.045 N/A ALA 475.A N LYS 472.A O no hydrogen 3.290 N/A GLY 478.A N ALA 475.A O no hydrogen 2.651 N/A THR 479.A N LYS 472.A O no hydrogen 2.992 N/A VAL 481.A N THR 463.A O no hydrogen 3.048 N/A TYR 485.A N ALA 482.A O no hydrogen 3.076 N/A TYR 485.A OH TRP 69.A O no hydrogen 2.627 N/A ASN 486.A N SER 483.A O no hydrogen 3.229 N/A ASN 486.A ND2 THR 463.A OG1 no hydrogen 3.026 N/A ASN 486.A ND2 SER 483.A O no hydrogen 2.720 N/A LYS 487.A N TYR 484.A O no hydrogen 3.457 N/A TYR 488.A N LEU 126.A O no hydrogen 2.786 N/A TYR 488.A OH CYS 43.A O no hydrogen 2.615 N/A ILE 490.A N GLN 503.A OE1 no hydrogen 2.802 N/A VAL 492.A N PRO 71.A O no hydrogen 2.923 N/A SER 493.A OG GLU 77.A OE2 no hydrogen 2.435 N/A ASP 494.A N PRO 491.A O no hydrogen 2.891 N/A ILE 495.A N PRO 491.A O no hydrogen 2.988 N/A ASN 496.A N VAL 492.A O no hydrogen 2.895 N/A ASN 497.A N SER 493.A O no hydrogen 3.197 N/A ASN 498.A N ASP 494.A O no hydrogen 2.798 N/A ASN 498.A ND2 PRO 141.A O no hydrogen 2.714 N/A ASN 500.A N ASN 498.A OD1 no hydrogen 2.979 N/A MET 501.A N ASN 498.A O no hydrogen 3.002 N/A SER 502.A N GLU 143.A OE2 no hydrogen 2.717 N/A SER 502.A OG GLU 143.A OE1 no hydrogen 3.238 N/A SER 502.A OG GLU 143.A OE2 no hydrogen 2.708 N/A GLN 503.A NE2 ILE 490.A O no hydrogen 2.970 N/A ASN 504.A N GLN 503.A OE1 no hydrogen 2.703 N/A ASN 504.A ND2 PHE 127.A O no hydrogen 3.015 N/A ASN 504.A ND2 TYR 488.A O no hydrogen 2.851 N/A TYR 507.A N ASN 504.A O no hydrogen 3.387 N/A TYR 507.A OH LYS 487.A O no hydrogen 2.546 N/A