Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1yuy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N PHE 54.A O no hydrogen 3.029 N/A SER 3.A OG VAL 52.A O no hydrogen 2.657 N/A SER 3.A OG PHE 54.A O no hydrogen 3.371 N/A SER 5.A N TYR 271.A O no hydrogen 3.010 N/A TRP 6.A NE1 THR 53.A OG1 no hydrogen 2.791 N/A THR 7.A N CYS 269.A O no hydrogen 2.985 N/A THR 7.A OG1 SER 268.A O no hydrogen 2.705 N/A THR 7.A OG1 CYS 269.A O no hydrogen 3.283 N/A ALA 9.A N THR 7.A OG1 no hydrogen 3.130 N/A THR 12.A OG1 SER 264.A OG no hydrogen 2.561 N/A LYS 20.A NZ GLU 19.A OE2 no hydrogen 2.791 N/A LEU 21.A N VAL 37.A O no hydrogen 3.370 N/A ASN 28.A N ASN 24.A O no hydrogen 2.720 N/A SER 29.A N PRO 25.A O no hydrogen 3.144 N/A SER 29.A OG LEU 26.A O no hydrogen 2.753 N/A LEU 30.A N SER 27.A O no hydrogen 2.978 N/A LEU 31.A N SER 27.A O no hydrogen 3.033 N/A ARG 32.A N GLY 488.A O no hydrogen 2.928 N/A ARG 32.A NE GLY 488.A O no hydrogen 3.213 N/A TYR 33.A N LEU 487.A O no hydrogen 3.200 N/A HIS 34.A N ARG 32.A O no hydrogen 2.805 N/A HIS 34.A ND1 ARG 32.A O no hydrogen 3.139 N/A LYS 36.A N TYR 33.A O no hydrogen 2.949 N/A LYS 36.A NZ LYS 486.A O no hydrogen 2.821 N/A VAL 37.A N HIS 34.A O no hydrogen 3.134 N/A TYR 38.A N PHE 145.A O no hydrogen 3.003 N/A CYS 39.A N GLU 19.A O no hydrogen 2.984 N/A CYS 39.A SG THR 40.A O no hydrogen 3.522 N/A THR 40.A N GLU 143.A O no hydrogen 2.787 N/A THR 40.A OG1 LYS 141.A O no hydrogen 2.826 N/A THR 40.A OG1 GLU 143.A O no hydrogen 3.406 N/A SER 42.A N GLU 17.A OE1 no hydrogen 3.184 N/A SER 42.A N GLU 17.A OE2 no hydrogen 2.849 N/A SER 42.A OG GLU 17.A OE1 no hydrogen 2.972 N/A SER 42.A OG GLU 17.A OE2 no hydrogen 2.880 N/A LYS 43.A N THR 41.A OG1 no hydrogen 3.238 N/A LYS 43.A NZ GLU 19.A OE1 no hydrogen 3.507 N/A SER 44.A N THR 41.A O no hydrogen 3.187 N/A SER 44.A OG THR 41.A O no hydrogen 3.250 N/A ALA 45.A N SER 42.A O no hydrogen 3.049 N/A ARG 48.A N SER 44.A O no hydrogen 3.157 N/A ARG 48.A NE ALA 152.A O no hydrogen 3.284 N/A ARG 48.A NH2 ALA 151.A O no hydrogen 3.469 N/A ALA 49.A N ALA 45.A O no hydrogen 2.894 N/A LYS 50.A N SER 46.A O no hydrogen 3.107 N/A LYS 51.A N LEU 47.A O no hydrogen 3.224 N/A VAL 52.A N ARG 48.A O no hydrogen 3.005 N/A THR 53.A OG1 ALA 49.A O no hydrogen 2.552 N/A PHE 54.A N SER 3.A OG no hydrogen 3.031 N/A ARG 56.A N SER 1.A O no hydrogen 2.797 N/A ARG 56.A NE SER 1.A O no hydrogen 2.809 N/A ARG 56.A NH1 ARG 273.A O no hydrogen 2.702 N/A ARG 56.A NH2 SER 221.A O no hydrogen 2.815 N/A ARG 56.A NH2 VAL 223.A O no hydrogen 2.840 N/A GLN 58.A NE2 THR 224.A OG1 no hydrogen 2.828 N/A VAL 59.A N ARG 340.A O no hydrogen 2.848 N/A TYR 64.A N ASP 61.A OD2 no hydrogen 3.000 N/A ASP 65.A N ASP 61.A O no hydrogen 2.967 N/A SER 66.A N ALA 62.A O no hydrogen 2.919 N/A VAL 67.A N TYR 63.A O no hydrogen 3.211 N/A LEU 68.A N TYR 64.A O no hydrogen 2.998 N/A LYS 69.A N ASP 65.A O no hydrogen 3.069 N/A ASP 70.A N SER 66.A O no hydrogen 3.135 N/A ILE 71.A N VAL 67.A O no hydrogen 2.903 N/A LYS 72.A N LEU 68.A O no hydrogen 2.954 N/A LYS 72.A NZ SER 233.A OG no hydrogen 3.425 N/A LEU 73.A N LYS 69.A O no hydrogen 3.211 N/A ALA 74.A N ASP 70.A O no hydrogen 3.065 N/A ALA 75.A N ILE 71.A O no hydrogen 2.873 N/A SER 76.A N LYS 72.A O no hydrogen 3.163 N/A SER 76.A N LEU 73.A O no hydrogen 3.137 N/A SER 76.A OG LEU 73.A O no hydrogen 2.433 N/A LYS 77.A N ALA 74.A O no hydrogen 3.135 N/A VAL 78.A N ALA 75.A O no hydrogen 2.977 N/A ALA 80.A N SER 239.A O no hydrogen 2.995 N/A ARG 81.A N ASP 172.A OD2 no hydrogen 2.708 N/A ARG 81.A NH1 LEU 82.A O no hydrogen 3.310 N/A ARG 81.A NH1 GLU 87.A OE1 no hydrogen 2.896 N/A ARG 81.A NH2 GLU 87.A OE1 no hydrogen 3.451 N/A ARG 81.A NH2 GLU 87.A OE2 no hydrogen 2.954 N/A LEU 83.A N MET 168.A O no hydrogen 2.879 N/A THR 84.A N GLU 87.A OE1 no hydrogen 2.854 N/A THR 84.A OG1 GLU 86.A OE1 no hydrogen 2.994 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 2.486 N/A ALA 88.A N THR 84.A O no hydrogen 2.922 N/A CYS 89.A N LEU 85.A O no hydrogen 2.908 N/A CYS 89.A SG LEU 85.A O no hydrogen 3.177 N/A GLN 90.A N GLU 86.A O no hydrogen 3.012 N/A LEU 91.A N ALA 88.A O no hydrogen 3.340 N/A THR 92.A N CYS 89.A O no hydrogen 3.052 N/A THR 92.A OG1 ALA 88.A O no hydrogen 3.389 N/A THR 92.A OG1 CYS 89.A O no hydrogen 3.331 N/A SER 96.A N PRO 93.A O no hydrogen 3.018 N/A SER 96.A OG ASP 554.A OD1 no hydrogen 2.775 N/A SER 96.A OG ASP 554.A OD2 no hydrogen 3.252 N/A SER 99.A N PHE 103.A O no hydrogen 2.775 N/A SER 99.A OG ASP 159.A OD1 no hydrogen 3.315 N/A SER 99.A OG ASP 159.A OD2 no hydrogen 2.841 N/A LYS 100.A N ASP 159.A OD1 no hydrogen 3.145 N/A LYS 100.A NZ TYR 101.A OH no hydrogen 2.747 N/A TYR 101.A N SER 99.A OG no hydrogen 2.987 N/A GLY 104.A N GLU 107.A OE2 no hydrogen 2.817 N/A VAL 108.A N GLY 104.A O no hydrogen 3.120 N/A ARG 109.A N ALA 105.A O no hydrogen 2.825 N/A ARG 109.A NH1 GLN 90.A O no hydrogen 3.374 N/A SER 110.A N LYS 106.A O no hydrogen 2.982 N/A SER 110.A OG LYS 106.A O no hydrogen 2.950 N/A SER 110.A OG GLU 107.A O no hydrogen 3.320 N/A LEU 111.A N VAL 108.A O no hydrogen 2.825 N/A SER 112.A N GLU 107.A O no hydrogen 2.804 N/A SER 112.A OG GLU 107.A O no hydrogen 3.440 N/A ALA 115.A N SER 112.A OG no hydrogen 3.290 N/A VAL 116.A N SER 112.A O no hydrogen 2.908 N/A ASN 117.A N GLY 113.A O no hydrogen 2.905 N/A HIS 118.A N ARG 114.A O no hydrogen 3.105 N/A ILE 119.A N ALA 115.A O no hydrogen 3.026 N/A LYS 120.A N VAL 116.A O no hydrogen 3.063 N/A SER 121.A N ASN 117.A O no hydrogen 3.370 N/A SER 121.A OG HIS 118.A O no hydrogen 2.611 N/A VAL 122.A N HIS 118.A O no hydrogen 2.989 N/A TRP 123.A N ILE 119.A O no hydrogen 3.074 N/A TRP 123.A NE1 GLU 243.A OE1 no hydrogen 2.894 N/A LYS 124.A N LYS 120.A O no hydrogen 3.080 N/A ASP 125.A N SER 121.A O no hydrogen 2.939 N/A LEU 126.A N VAL 122.A O no hydrogen 3.046 N/A LEU 127.A N TRP 123.A O no hydrogen 3.153 N/A GLU 128.A N LYS 124.A O no hydrogen 3.186 N/A ASP 129.A N ASP 125.A O no hydrogen 2.911 N/A GLN 131.A N ASP 129.A OD2 no hydrogen 2.796 N/A THR 132.A N ASP 129.A OD2 no hydrogen 3.106 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 2.523 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 3.390 N/A ILE 134.A N ARG 254.A O no hydrogen 2.737 N/A THR 136.A N PRO 260.A O no hydrogen 3.072 N/A THR 136.A OG1 PRO 260.A O no hydrogen 3.003 N/A THR 137.A N TYR 157.A O no hydrogen 2.826 N/A ILE 138.A N PHE 262.A O no hydrogen 2.994 N/A MET 139.A N ILE 155.A O no hydrogen 2.959 N/A LYS 141.A N ARG 153.A O no hydrogen 2.808 N/A GLU 143.A N THR 40.A OG1 no hydrogen 2.840 N/A PHE 145.A N TYR 38.A O no hydrogen 2.929 N/A CYS 146.A SG LYS 36.A O no hydrogen 3.926 N/A CYS 146.A SG VAL 147.A O no hydrogen 3.756 N/A VAL 147.A N LYS 36.A O no hydrogen 2.741 N/A LYS 150.A N TYR 38.A OH no hydrogen 2.856 N/A ALA 152.A N SER 44.A OG no hydrogen 2.829 N/A ARG 153.A NH2 GLU 143.A OE1 no hydrogen 2.681 N/A ILE 155.A N MET 139.A O no hydrogen 2.892 N/A VAL 156.A N SER 277.A OG no hydrogen 3.020 N/A TYR 157.A N THR 137.A O no hydrogen 3.070 N/A GLY 161.A N ASP 159.A OD2 no hydrogen 3.210 N/A VAL 162.A N ASP 159.A O no hydrogen 2.877 N/A ARG 163.A N ASP 159.A O no hydrogen 3.071 N/A ARG 163.A NE ASP 554.A OD2 no hydrogen 2.987 N/A ARG 163.A NH1 SER 96.A OG no hydrogen 2.721 N/A ARG 163.A NH1 ALA 97.A O no hydrogen 2.831 N/A ARG 163.A NH2 PRO 158.A O no hydrogen 2.941 N/A VAL 164.A N LEU 160.A O no hydrogen 3.114 N/A CYS 165.A N GLY 161.A O no hydrogen 3.437 N/A CYS 165.A SG ILE 119.A O no hydrogen 3.636 N/A CYS 165.A SG GLY 161.A O no hydrogen 3.578 N/A GLU 166.A N VAL 162.A O no hydrogen 2.946 N/A LYS 167.A N ARG 163.A O no hydrogen 3.434 N/A LYS 167.A NZ ARG 163.A O no hydrogen 3.489 N/A LYS 167.A NZ ASP 554.A O no hydrogen 3.149 N/A LYS 167.A NZ ASP 554.A OD2 no hydrogen 3.417 N/A MET 168.A N VAL 164.A O no hydrogen 3.199 N/A ALA 169.A N CYS 165.A O no hydrogen 3.070 N/A LEU 170.A N GLU 166.A O no hydrogen 2.730 N/A TYR 171.A N LYS 167.A O no hydrogen 2.876 N/A TYR 171.A OH VAL 548.A O no hydrogen 2.940 N/A THR 174.A N LEU 170.A O no hydrogen 3.054 N/A THR 174.A OG1 TYR 171.A O no hydrogen 2.703 N/A THR 174.A OG1 GLN 175.A OE1 no hydrogen 3.251 N/A GLN 175.A N TYR 171.A O no hydrogen 3.269 N/A GLN 175.A N ASP 172.A O no hydrogen 3.100 N/A LYS 176.A N VAL 173.A O no hydrogen 3.044 N/A LYS 176.A NZ SER 79.A O no hydrogen 3.091 N/A LYS 176.A NZ ASP 172.A OD1 no hydrogen 3.402 N/A LYS 176.A NZ ASP 172.A OD2 no hydrogen 2.842 N/A LEU 177.A N VAL 173.A O no hydrogen 2.925 N/A GLN 179.A NE2 GLN 175.A O no hydrogen 3.578 N/A ALA 180.A N LYS 176.A O no hydrogen 3.143 N/A VAL 181.A N LEU 177.A O no hydrogen 3.033 N/A MET 182.A N PRO 178.A O no hydrogen 2.911 N/A GLY 183.A N GLN 179.A O no hydrogen 2.650 N/A SER 185.A N MET 182.A O no hydrogen 3.166 N/A SER 185.A OG MET 308.A O no hydrogen 2.823 N/A TYR 186.A N GLY 183.A O no hydrogen 3.136 N/A GLY 187.A N VAL 310.A O no hydrogen 2.834 N/A TYR 190.A N GLY 187.A O no hydrogen 3.171 N/A TYR 190.A OH ALA 184.A O no hydrogen 2.569 N/A GLN 194.A N SER 191.A OG no hydrogen 3.390 N/A ARG 195.A N SER 191.A O no hydrogen 2.919 N/A ARG 195.A NH1 SER 360.A OG no hydrogen 2.327 N/A VAL 196.A N PRO 192.A O no hydrogen 3.007 N/A GLU 197.A N ALA 193.A O no hydrogen 2.991 N/A PHE 198.A N GLN 194.A O no hydrogen 2.934 N/A LEU 199.A N ARG 195.A O no hydrogen 2.997 N/A LEU 200.A N VAL 196.A O no hydrogen 2.942 N/A LYS 201.A N GLU 197.A O no hydrogen 2.970 N/A ALA 202.A N PHE 198.A O no hydrogen 2.901 N/A TRP 203.A N LEU 199.A O no hydrogen 2.930 N/A ALA 204.A N LEU 200.A O no hydrogen 2.913 N/A GLU 205.A N LYS 201.A O no hydrogen 3.000 N/A LYS 206.A N TRP 203.A O no hydrogen 3.389 N/A LYS 206.A NZ GLU 205.A OE2 no hydrogen 3.435 N/A LYS 206.A NZ ALA 305.A O no hydrogen 2.572 N/A LYS 206.A NZ THR 307.A OG1 no hydrogen 2.732 N/A LYS 207.A N GLU 320.A OE1 no hydrogen 2.828 N/A ASP 208.A N GLU 320.A OE2 no hydrogen 3.111 N/A MET 210.A N SER 319.A O no hydrogen 3.019 N/A GLY 211.A N GLU 352.A O no hydrogen 2.941 N/A PHE 212.A N VAL 317.A O no hydrogen 3.051 N/A TYR 214.A N LEU 315.A O no hydrogen 3.002 N/A TYR 214.A OH ALA 343.A O no hydrogen 2.733 N/A ARG 217.A N PRO 344.A O no hydrogen 2.989 N/A SER 221.A OG VAL 52.A O no hydrogen 3.016 N/A THR 222.A N CYS 218.A O no hydrogen 3.245 N/A THR 222.A N PHE 219.A O no hydrogen 2.784 N/A THR 222.A OG1 PHE 219.A O no hydrogen 2.617 N/A VAL 223.A N ASP 220.A O no hydrogen 3.373 N/A THR 224.A N ASP 227.A OD2 no hydrogen 3.024 N/A ASP 227.A N THR 224.A OG1 no hydrogen 3.060 N/A ILE 228.A N THR 224.A O no hydrogen 3.078 N/A ARG 229.A N GLU 225.A O no hydrogen 2.968 N/A ARG 229.A NE GLU 253.A OE1 no hydrogen 2.888 N/A ARG 229.A NH2 GLU 253.A OE2 no hydrogen 2.928 N/A THR 230.A N ARG 226.A O no hydrogen 2.889 N/A THR 230.A OG1 ARG 226.A O no hydrogen 3.005 N/A GLU 231.A N ASP 227.A O no hydrogen 2.951 N/A GLU 232.A N ILE 228.A O no hydrogen 3.179 N/A SER 233.A N ARG 229.A O no hydrogen 3.097 N/A SER 233.A OG THR 230.A O no hydrogen 2.573 N/A ILE 234.A N THR 230.A O no hydrogen 3.047 N/A TYR 235.A N GLU 231.A O no hydrogen 2.925 N/A GLN 236.A N GLU 232.A O no hydrogen 2.772 N/A GLN 236.A NE2 GLU 232.A OE2 no hydrogen 3.022 N/A GLN 236.A NE2 ARG 245.A O no hydrogen 3.123 N/A ALA 237.A N ILE 234.A O no hydrogen 3.171 N/A CYS 238.A N TYR 235.A O no hydrogen 3.105 N/A CYS 238.A SG ALA 75.A O no hydrogen 3.746 N/A CYS 238.A SG ILE 234.A O no hydrogen 3.985 N/A SER 239.A N VAL 78.A O no hydrogen 2.725 N/A ARG 245.A N PRO 241.A O no hydrogen 3.107 N/A ARG 245.A NH1 CYS 238.A O no hydrogen 2.921 N/A ARG 245.A NH2 GLN 236.A O no hydrogen 2.928 N/A ARG 245.A NH2 GLN 236.A OE1 no hydrogen 2.941 N/A ARG 245.A NH2 CYS 238.A O no hydrogen 3.552 N/A THR 246.A N GLU 242.A O no hydrogen 3.073 N/A THR 246.A OG1 GLU 242.A O no hydrogen 3.177 N/A ALA 247.A N GLU 243.A O no hydrogen 3.136 N/A ILE 248.A N ALA 244.A O no hydrogen 2.788 N/A HIS 249.A N ARG 245.A O no hydrogen 3.008 N/A SER 250.A N THR 246.A O no hydrogen 2.989 N/A SER 250.A OG LEU 126.A O no hydrogen 2.994 N/A SER 250.A OG ASP 129.A O no hydrogen 2.829 N/A LEU 251.A N ALA 247.A O no hydrogen 2.852 N/A THR 252.A N ILE 248.A O no hydrogen 3.038 N/A THR 252.A OG1 ILE 248.A O no hydrogen 2.920 N/A GLU 253.A N HIS 249.A O no hydrogen 2.974 N/A ARG 254.A N SER 250.A O no hydrogen 2.834 N/A ARG 254.A NE THR 132.A O no hydrogen 2.646 N/A ARG 254.A NH1 ASP 125.A OD2 no hydrogen 2.773 N/A ARG 254.A NH1 THR 132.A O no hydrogen 3.551 N/A ARG 254.A NH2 ASP 125.A O no hydrogen 3.296 N/A ARG 254.A NH2 ASP 125.A OD2 no hydrogen 2.962 N/A ARG 254.A NH2 ASP 129.A O no hydrogen 2.752 N/A LEU 255.A N LEU 251.A O no hydrogen 2.809 N/A TYR 256.A N LEU 251.A O no hydrogen 2.911 N/A TYR 256.A OH GLU 166.A OE1 no hydrogen 2.743 N/A VAL 257.A N THR 252.A O no hydrogen 2.932 N/A GLY 258.A N LEU 255.A O no hydrogen 3.278 N/A GLY 259.A N ARG 272.A O no hydrogen 3.019 N/A MET 261.A N GLY 270.A O no hydrogen 2.811 N/A PHE 262.A N THR 136.A O no hydrogen 2.864 N/A ASN 263.A N GLN 267.A O no hydrogen 2.982 N/A ASN 263.A ND2 LEU 10.A O no hydrogen 2.952 N/A SER 264.A OG THR 12.A O no hydrogen 3.205 N/A SER 264.A OG THR 12.A OG1 no hydrogen 2.561 N/A SER 264.A OG PRO 13.A O no hydrogen 3.106 N/A LYS 265.A N ASN 263.A OD1 no hydrogen 2.896 N/A GLY 266.A N ASN 263.A O no hydrogen 3.031 N/A GLN 267.A N ASN 263.A OD1 no hydrogen 2.947 N/A CYS 269.A N MET 261.A O no hydrogen 2.795 N/A CYS 269.A SG ALA 9.A O no hydrogen 3.540 N/A GLY 270.A N MET 261.A O no hydrogen 3.310 N/A TYR 271.A N SER 5.A O no hydrogen 2.884 N/A ARG 272.A N GLY 259.A O no hydrogen 2.914 N/A ARG 272.A NH1 LEU 255.A O no hydrogen 2.745 N/A ARG 272.A NH2 LEU 255.A O no hydrogen 3.312 N/A ARG 272.A NH2 TYR 256.A O no hydrogen 3.245 N/A ARG 272.A NH2 CYS 274.A O no hydrogen 2.849 N/A ARG 273.A N SER 3.A O no hydrogen 2.900 N/A ARG 273.A NH1 GLU 225.A OE2 no hydrogen 2.878 N/A CYS 274.A SG SER 3.A O no hydrogen 3.645 N/A CYS 274.A SG ARG 275.A O no hydrogen 3.917 N/A ARG 275.A N ASP 220.A O no hydrogen 3.214 N/A ARG 275.A NE ASN 286.A OD1 no hydrogen 2.678 N/A ARG 275.A NH1 GLU 231.A OE1 no hydrogen 2.536 N/A ARG 275.A NH1 GLU 231.A OE2 no hydrogen 3.561 N/A ARG 275.A NH1 ASN 286.A OD1 no hydrogen 3.019 N/A ARG 275.A NH2 GLU 231.A OE2 no hydrogen 2.866 N/A SER 277.A OG LEU 154.A O no hydrogen 3.177 N/A GLY 278.A N VAL 156.A O no hydrogen 2.786 N/A VAL 279.A N THR 282.A OG1 no hydrogen 3.199 N/A LEU 280.A N GLU 166.A OE1 no hydrogen 2.947 N/A THR 282.A N VAL 279.A O no hydrogen 3.115 N/A THR 282.A OG1 ALA 276.A O no hydrogen 2.650 N/A THR 282.A OG1 VAL 279.A O no hydrogen 3.015 N/A GLY 285.A N THR 281.A O no hydrogen 2.745 N/A ASN 286.A N THR 282.A O no hydrogen 2.979 N/A ASN 286.A ND2 ASP 220.A OD2 no hydrogen 2.861 N/A THR 287.A N SER 283.A O no hydrogen 2.868 N/A THR 287.A OG1 SER 283.A O no hydrogen 2.794 N/A ILE 288.A N MET 284.A O no hydrogen 2.961 N/A THR 289.A N GLY 285.A O no hydrogen 2.957 N/A THR 289.A OG1 GLU 231.A OE1 no hydrogen 2.592 N/A THR 289.A OG1 GLY 285.A O no hydrogen 3.193 N/A CYS 290.A N ASN 286.A O no hydrogen 2.762 N/A TYR 291.A N THR 287.A O no hydrogen 2.887 N/A VAL 292.A N ILE 288.A O no hydrogen 2.912 N/A LYS 293.A N THR 289.A O no hydrogen 3.144 N/A LYS 293.A NZ ASP 227.A OD2 no hydrogen 2.808 N/A LYS 293.A NZ TYR 341.A O no hydrogen 2.925 N/A LYS 293.A NZ SER 342.A O no hydrogen 3.351 N/A ALA 294.A N CYS 290.A O no hydrogen 2.888 N/A LEU 295.A N TYR 291.A O no hydrogen 2.882 N/A ALA 296.A N VAL 292.A O no hydrogen 3.135 N/A ALA 297.A N LYS 293.A O no hydrogen 2.802 N/A CYS 298.A N ALA 294.A O no hydrogen 2.834 N/A CYS 298.A SG ALA 294.A O no hydrogen 3.488 N/A LYS 299.A N LEU 295.A O no hydrogen 3.181 N/A ALA 300.A N ALA 296.A O no hydrogen 2.973 N/A ALA 301.A N ALA 297.A O no hydrogen 2.905 N/A GLY 302.A N LYS 299.A O no hydrogen 3.335 N/A ILE 303.A N CYS 298.A O no hydrogen 2.941 N/A THR 307.A N ILE 318.A O no hydrogen 2.776 N/A THR 307.A OG1 GLU 205.A OE2 no hydrogen 3.547 N/A LEU 309.A N VAL 316.A O no hydrogen 3.033 N/A VAL 310.A N SER 185.A O no hydrogen 2.819 N/A CYS 311.A N ASP 314.A O no hydrogen 2.926 N/A GLY 312.A N THR 287.A OG1 no hydrogen 2.872 N/A ASP 314.A N CYS 311.A O no hydrogen 2.839 N/A VAL 316.A N LEU 309.A O no hydrogen 3.172 N/A VAL 317.A N PHE 212.A O no hydrogen 2.868 N/A ILE 318.A N THR 307.A O no hydrogen 2.968 N/A SER 319.A N MET 210.A O no hydrogen 2.885 N/A GLU 320.A N VAL 304.A O no hydrogen 2.948 N/A SER 321.A N ASP 208.A O no hydrogen 2.740 N/A SER 321.A OG ASP 327.A OD2 no hydrogen 2.607 N/A GLN 322.A N ASP 327.A OD1 no hydrogen 2.844 N/A GLY 323.A N SER 321.A OG no hydrogen 3.130 N/A ASP 327.A N GLY 323.A O no hydrogen 2.738 N/A GLU 328.A N THR 324.A O no hydrogen 3.114 N/A ARG 329.A N GLU 325.A O no hydrogen 3.093 N/A ASN 330.A N GLU 326.A O no hydrogen 2.764 N/A LEU 331.A N ASP 327.A O no hydrogen 2.905 N/A ARG 332.A N GLU 328.A O no hydrogen 3.167 N/A ALA 333.A N ARG 329.A O no hydrogen 3.084 N/A PHE 334.A N ASN 330.A O no hydrogen 2.865 N/A THR 335.A N LEU 331.A O no hydrogen 2.973 N/A THR 335.A OG1 LEU 331.A O no hydrogen 2.947 N/A GLU 336.A N ARG 332.A O no hydrogen 2.955 N/A ALA 337.A N ALA 333.A O no hydrogen 3.029 N/A MET 338.A N PHE 334.A O no hydrogen 2.916 N/A THR 339.A N THR 335.A O no hydrogen 2.841 N/A THR 339.A OG1 THR 335.A O no hydrogen 2.735 N/A ARG 340.A N GLU 336.A O no hydrogen 3.076 N/A TYR 341.A N ALA 337.A O no hydrogen 3.017 N/A TYR 341.A OH ASP 61.A OD1 no hydrogen 3.277 N/A TYR 341.A OH ASP 61.A OD2 no hydrogen 2.743 N/A SER 342.A N THR 339.A O no hydrogen 2.900 N/A SER 342.A OG THR 222.A O no hydrogen 2.631 N/A GLY 346.A N ASP 215.A O no hydrogen 2.751 N/A GLU 352.A N GLY 211.A O no hydrogen 2.723 N/A TYR 353.A OH ASP 327.A OD2 no hydrogen 2.677 N/A GLU 356.A N ASP 354.A OD1 no hydrogen 3.008 N/A LEU 357.A N ASP 354.A O no hydrogen 3.055 N/A ILE 358.A N LEU 355.A O no hydrogen 3.114 N/A SER 360.A N SER 363.A O no hydrogen 2.763 N/A CYS 361.A N ASP 314.A OD1 no hydrogen 3.096 N/A CYS 361.A N ASP 314.A OD2 no hydrogen 3.059 N/A SER 363.A N SER 360.A O no hydrogen 2.996 N/A SER 363.A OG CYS 361.A O no hydrogen 3.260 N/A SER 363.A OG TYR 410.A OH no hydrogen 2.520 N/A ASN 364.A N THR 380.A O no hydrogen 2.823 N/A ASN 364.A ND2 VAL 365.A O no hydrogen 3.196 N/A SER 366.A N TYR 378.A O no hydrogen 2.987 N/A SER 366.A OG GLU 356.A OE1 no hydrogen 2.704 N/A ALA 368.A N ARG 376.A O no hydrogen 2.923 N/A LEU 369.A N HIS 470.A O no hydrogen 2.853 N/A GLY 370.A N ARG 374.A O no hydrogen 2.760 N/A GLN 372.A NE2 ARG 374.A O no hydrogen 3.562 N/A GLY 373.A N GLY 370.A O no hydrogen 2.890 N/A ARG 376.A N ALA 368.A O no hydrogen 2.863 N/A TYR 378.A N SER 366.A O no hydrogen 3.065 N/A THR 380.A N ASN 364.A O no hydrogen 2.886 N/A THR 380.A OG1 ARG 381.A O no hydrogen 3.491 N/A THR 380.A OG1 GLU 476.A OE1 no hydrogen 2.718 N/A ARG 381.A NE ASP 382.A O no hydrogen 2.878 N/A THR 384.A N ASP 382.A OD2 no hydrogen 2.843 N/A THR 384.A OG1 ASP 382.A OD2 no hydrogen 2.573 N/A ILE 387.A N PRO 383.A O no hydrogen 2.932 N/A ALA 388.A N THR 384.A O no hydrogen 2.955 N/A ARG 389.A N THR 385.A O no hydrogen 2.856 N/A ARG 389.A NE VAL 144.A O no hydrogen 2.818 N/A ARG 389.A NH2 VAL 144.A O no hydrogen 3.332 N/A ALA 390.A N PRO 386.A O no hydrogen 2.883 N/A ALA 391.A N ILE 387.A O no hydrogen 2.979 N/A TRP 392.A N ALA 388.A O no hydrogen 3.199 N/A GLU 393.A N ARG 389.A O no hydrogen 2.892 N/A THR 394.A N ALA 391.A O no hydrogen 3.126 N/A THR 394.A OG1 ALA 390.A O no hydrogen 2.598 N/A VAL 395.A N TRP 392.A O no hydrogen 3.212 N/A ARG 396.A N TRP 392.A O no hydrogen 2.795 N/A ARG 396.A NE GLU 18.A OE1 no hydrogen 2.904 N/A ARG 396.A NH1 VAL 395.A O no hydrogen 3.204 N/A ARG 396.A NH2 GLU 18.A OE2 no hydrogen 3.295 N/A ASN 401.A N ASN 439.A O no hydrogen 3.084 N/A SER 402.A N GLU 393.A OE1 no hydrogen 2.811 N/A SER 402.A OG GLU 393.A OE1 no hydrogen 3.428 N/A SER 402.A OG GLU 393.A OE2 no hydrogen 2.721 N/A TRP 403.A N GLU 393.A OE1 no hydrogen 3.373 N/A ASN 406.A N SER 402.A O no hydrogen 2.933 N/A ILE 407.A N TRP 403.A O no hydrogen 2.931 N/A ILE 408.A N LEU 404.A O no hydrogen 3.097 N/A GLN 409.A N GLY 405.A O no hydrogen 2.893 N/A TYR 410.A N ASN 406.A O no hydrogen 2.852 N/A TYR 410.A OH SER 363.A OG no hydrogen 2.520 N/A THR 413.A N TYR 410.A O no hydrogen 2.981 N/A THR 413.A OG1 TYR 410.A O no hydrogen 2.858 N/A TRP 415.A NE1 THR 380.A OG1 no hydrogen 3.166 N/A VAL 416.A N THR 413.A OG1 no hydrogen 3.174 N/A ARG 417.A N THR 413.A O no hydrogen 3.149 N/A ARG 417.A NE TYR 472.A OH no hydrogen 3.486 N/A ARG 417.A NH1 LEU 469.A O no hydrogen 2.406 N/A ARG 417.A NH1 TYR 472.A OH no hydrogen 3.041 N/A MET 418.A N ILE 414.A O no hydrogen 2.967 N/A VAL 419.A N TRP 415.A O no hydrogen 3.049 N/A LEU 420.A N TRP 415.A O no hydrogen 3.291 N/A MET 421.A N VAL 416.A O no hydrogen 2.849 N/A THR 422.A OG1 MET 418.A O no hydrogen 2.650 N/A HIS 423.A N VAL 419.A O no hydrogen 2.856 N/A PHE 424.A N LEU 420.A O no hydrogen 2.907 N/A PHE 425.A N MET 421.A O no hydrogen 2.998 N/A SER 426.A N THR 422.A O no hydrogen 3.297 N/A ILE 427.A N HIS 423.A O no hydrogen 3.112 N/A LEU 428.A N PHE 424.A O no hydrogen 2.810 N/A MET 429.A N PHE 425.A O no hydrogen 3.074 N/A ALA 430.A N SER 426.A O no hydrogen 2.998 N/A GLN 431.A N ILE 427.A O no hydrogen 2.854 N/A GLN 431.A NE2 THR 433.A OG1 no hydrogen 2.971 N/A THR 433.A N LEU 428.A O no hydrogen 2.967 N/A GLN 436.A N THR 433.A O no hydrogen 3.121 N/A LEU 438.A N VAL 449.A O no hydrogen 2.902 N/A PHE 440.A N TYR 447.A O no hydrogen 2.919 N/A GLU 441.A N ASN 401.A O no hydrogen 3.067 N/A MET 442.A N SER 445.A O no hydrogen 2.837 N/A TYR 443.A OH TYR 190.A O no hydrogen 2.848 N/A GLY 444.A N GLU 441.A OE1 no hydrogen 3.276 N/A SER 445.A N MET 442.A O no hydrogen 3.090 N/A SER 445.A OG ILE 555.A O no hydrogen 3.414 N/A VAL 446.A N ILE 555.A O no hydrogen 3.046 N/A TYR 447.A N PHE 440.A O no hydrogen 2.750 N/A TYR 447.A OH TRP 545.A O no hydrogen 2.653 N/A SER 448.A OG ASN 439.A OD1 no hydrogen 3.174 N/A VAL 449.A N LEU 438.A O no hydrogen 3.160 N/A SER 450.A OG ASP 435.A O no hydrogen 3.326 N/A LEU 452.A N SER 450.A OG no hydrogen 3.265 N/A ASP 453.A N SER 450.A O no hydrogen 2.720 N/A LEU 454.A N PRO 451.A O no hydrogen 3.094 N/A ILE 457.A N ASP 453.A O no hydrogen 3.149 N/A ILE 458.A N LEU 454.A O no hydrogen 2.743 N/A GLU 459.A N PRO 455.A O no hydrogen 2.982 N/A ARG 460.A N ALA 456.A O no hydrogen 3.071 N/A ARG 460.A NE ALA 537.A O no hydrogen 2.964 N/A ARG 460.A NH1 ALA 537.A O no hydrogen 3.097 N/A ARG 460.A NH1 ARG 538.A O no hydrogen 3.039 N/A LEU 461.A N ILE 457.A O no hydrogen 2.985 N/A HIS 462.A N ILE 458.A O no hydrogen 2.664 N/A GLY 463.A N GLU 459.A O no hydrogen 2.743 N/A ALA 466.A N GLY 463.A O no hydrogen 3.059 N/A PHE 467.A N LEU 464.A O no hydrogen 3.007 N/A SER 468.A N ASP 465.A O no hydrogen 2.782 N/A HIS 470.A N LEU 369.A O no hydrogen 3.006 N/A TYR 472.A OH PRO 412.A O no hydrogen 2.697 N/A THR 473.A OG1 GLU 356.A OE1 no hydrogen 2.698 N/A GLU 476.A N THR 473.A OG1 no hydrogen 3.103 N/A LEU 477.A N THR 473.A O no hydrogen 2.913 N/A THR 478.A N PRO 474.A O no hydrogen 2.826 N/A THR 478.A OG1 PRO 474.A O no hydrogen 2.778 N/A ARG 479.A N HIS 475.A O no hydrogen 2.984 N/A ARG 479.A NH1 ASN 364.A OD1 no hydrogen 2.787 N/A ARG 479.A NH1 GLU 476.A OE2 no hydrogen 3.030 N/A ARG 479.A NH2 ASN 364.A OD1 no hydrogen 3.231 N/A VAL 480.A N GLU 476.A O no hydrogen 2.964 N/A ALA 481.A N LEU 477.A O no hydrogen 2.956 N/A SER 482.A N THR 478.A O no hydrogen 2.934 N/A SER 482.A OG THR 478.A O no hydrogen 2.781 N/A ALA 483.A N ARG 479.A O no hydrogen 3.097 N/A LEU 484.A N VAL 480.A O no hydrogen 3.078 N/A ARG 485.A N ALA 481.A O no hydrogen 3.040 N/A LYS 486.A N SER 482.A O no hydrogen 2.872 N/A LYS 486.A NZ THR 384.A OG1 no hydrogen 2.891 N/A LEU 487.A N ALA 483.A O no hydrogen 3.031 N/A GLY 488.A N ARG 485.A O no hydrogen 3.172 N/A ALA 489.A N LEU 484.A O no hydrogen 2.751 N/A ALA 494.A N PRO 491.A O no hydrogen 2.942 N/A TRP 495.A N PRO 491.A O no hydrogen 3.253 N/A LYS 496.A N LEU 492.A O no hydrogen 2.972 N/A SER 497.A N ARG 493.A O no hydrogen 3.273 N/A SER 497.A OG ARG 493.A O no hydrogen 3.378 N/A ARG 498.A N ALA 494.A O no hydrogen 3.063 N/A ARG 498.A NH1 SER 29.A O no hydrogen 3.443 N/A ARG 498.A NH2 SER 29.A O no hydrogen 2.868 N/A ALA 499.A N TRP 495.A O no hydrogen 2.825 N/A ARG 500.A N LYS 496.A O no hydrogen 3.310 N/A VAL 502.A N ARG 498.A O no hydrogen 3.120 N/A ARG 503.A N ALA 499.A O no hydrogen 2.811 N/A ALA 504.A N ARG 500.A O no hydrogen 3.132 N/A SER 505.A N ALA 501.A O no hydrogen 3.071 N/A SER 505.A OG ALA 501.A O no hydrogen 3.148 N/A LEU 506.A N VAL 502.A O no hydrogen 2.974 N/A ILE 507.A N ARG 503.A O no hydrogen 2.952 N/A SER 508.A N ALA 504.A O no hydrogen 2.954 N/A SER 508.A OG ALA 504.A O no hydrogen 2.949 N/A ARG 509.A N LEU 506.A O no hydrogen 3.035 N/A GLY 510.A N ILE 507.A O no hydrogen 2.916 N/A ARG 512.A NH2 ASP 453.A OD2 no hydrogen 2.870 N/A ALA 514.A N GLY 510.A O no hydrogen 3.063 N/A VAL 515.A N GLY 511.A O no hydrogen 3.343 N/A CYS 516.A N ARG 512.A O no hydrogen 3.004 N/A CYS 516.A SG PRO 451.A O no hydrogen 3.822 N/A CYS 516.A SG LEU 452.A O no hydrogen 3.769 N/A CYS 516.A SG ARG 512.A O no hydrogen 3.554 N/A GLY 517.A N ALA 513.A O no hydrogen 2.985 N/A ARG 518.A N ALA 514.A O no hydrogen 2.902 N/A TYR 519.A N VAL 515.A O no hydrogen 2.948 N/A TYR 519.A OH THR 532.A O no hydrogen 2.587 N/A LEU 520.A N CYS 516.A O no hydrogen 2.853 N/A PHE 521.A N GLY 517.A O no hydrogen 3.334 N/A ALA 524.A N PHE 521.A O no hydrogen 3.049 N/A VAL 525.A N ASN 522.A O no hydrogen 3.494 N/A LYS 528.A NZ VAL 525.A O no hydrogen 2.632 N/A THR 532.A N TYR 519.A OH no hydrogen 3.154 N/A LEU 534.A N GLU 459.A OE1 no hydrogen 3.236 N/A LEU 534.A N GLU 459.A OE2 no hydrogen 2.772 N/A ALA 537.A N LEU 534.A O no hydrogen 2.940 N/A ARG 538.A N PRO 535.A O no hydrogen 3.157 N/A LEU 540.A N ALA 537.A O no hydrogen 3.455 N/A VAL 548.A N SER 544.A O no hydrogen 2.889 N/A GLY 549.A N PHE 546.A O no hydrogen 3.057 N/A ALA 550.A N THR 547.A O no hydrogen 2.729 N/A TYR 556.A N LEU 91.A O no hydrogen 2.750 N/A TYR 556.A OH ASN 439.A OD1 no hydrogen 3.295 N/A HIS 557.A N VAL 446.A O no hydrogen 3.133 N/A SER 558.A OG HIS 557.A O no hydrogen 2.661 N/A