Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sks_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASN 337.A O no hydrogen 2.585 N/A PHE 6.A N ASN 315.A O no hydrogen 2.822 N/A ASP 8.A N SER 5.A O no hydrogen 2.949 N/A TYR 9.A N PHE 6.A O no hydrogen 2.985 N/A GLU 10.A N TYR 338.A OH no hydrogen 3.243 N/A TYR 11.A OH GLU 76.A OE1 no hydrogen 2.606 N/A ARG 13.A NE GLU 76.A OE1 no hydrogen 2.892 N/A ARG 13.A NH2 GLU 76.A OE1 no hydrogen 3.545 N/A ARG 13.A NH2 GLU 76.A OE2 no hydrogen 2.789 N/A GLU 18.A N ASN 15.A OD1 no hydrogen 2.684 N/A LEU 19.A N ASN 15.A O no hydrogen 3.042 N/A LYS 20.A N ILE 16.A O no hydrogen 2.924 N/A GLU 21.A N GLU 17.A O no hydrogen 3.040 N/A LYS 22.A N GLU 18.A O no hydrogen 2.877 N/A PHE 23.A N LEU 19.A O no hydrogen 2.842 N/A THR 24.A N LYS 20.A O no hydrogen 2.951 N/A THR 24.A OG1 LYS 20.A O no hydrogen 2.885 N/A VAL 25.A N GLU 21.A O no hydrogen 2.957 N/A ALA 26.A N LYS 22.A O no hydrogen 3.080 N/A LEU 27.A N PHE 23.A O no hydrogen 2.933 N/A GLU 28.A N THR 24.A O no hydrogen 3.063 N/A LYS 29.A N VAL 25.A O no hydrogen 3.076 N/A PHE 30.A N ALA 26.A O no hydrogen 2.798 N/A ASP 31.A N LEU 27.A O no hydrogen 2.954 N/A ASN 32.A N GLU 28.A O no hydrogen 3.048 N/A ALA 33.A N PHE 30.A O no hydrogen 3.251 N/A LYS 34.A N GLU 38.A OE1 no hydrogen 2.957 N/A GLU 38.A N THR 35.A OG1 no hydrogen 3.150 N/A GLN 39.A N THR 35.A O no hydrogen 3.125 N/A GLN 39.A NE2 PHE 30.A O no hydrogen 3.188 N/A LYS 40.A N VAL 36.A O no hydrogen 2.840 N/A GLN 41.A N GLU 37.A O no hydrogen 3.136 N/A VAL 42.A N GLU 38.A O no hydrogen 2.973 N/A ILE 43.A N GLN 39.A O no hydrogen 2.807 N/A HIS 44.A N LYS 40.A O no hydrogen 3.087 N/A SER 45.A N GLN 41.A O no hydrogen 3.090 N/A SER 45.A OG VAL 42.A O no hydrogen 2.643 N/A ILE 46.A N VAL 42.A O no hydrogen 2.862 N/A ASN 47.A N ILE 43.A O no hydrogen 2.815 N/A GLU 48.A N HIS 44.A O no hydrogen 2.986 N/A ILE 49.A N SER 45.A O no hydrogen 3.255 N/A ARG 50.A N ILE 46.A O no hydrogen 3.070 N/A ARG 50.A NH1 ASN 47.A OD1 no hydrogen 2.776 N/A ARG 50.A NH1 GLU 377.A OE2 no hydrogen 2.936 N/A ARG 50.A NH2 GLU 377.A OE2 no hydrogen 3.034 N/A ASN 51.A N ASN 47.A O no hydrogen 2.914 N/A ASP 52.A N GLU 48.A O no hydrogen 2.907 N/A PHE 53.A N ILE 49.A O no hydrogen 3.172 N/A GLY 54.A N ARG 50.A O no hydrogen 2.898 N/A THR 55.A N ASN 51.A O no hydrogen 2.824 N/A THR 55.A OG1 ASN 51.A O no hydrogen 2.711 N/A MET 56.A N ASP 52.A O no hydrogen 3.327 N/A GLY 57.A N PHE 53.A O no hydrogen 3.022 N/A ASN 58.A N GLY 54.A O no hydrogen 2.829 N/A ASN 58.A ND2 GLY 54.A O no hydrogen 2.900 N/A ASN 58.A ND2 GLU 336.A OE2 no hydrogen 2.918 N/A LEU 59.A N THR 55.A O no hydrogen 2.925 N/A CYS 60.A N MET 56.A O no hydrogen 2.959 N/A CYS 60.A SG TYR 73.A O no hydrogen 3.820 N/A CYS 60.A SG GLN 77.A OE1 no hydrogen 3.766 N/A TYR 61.A N GLY 57.A O no hydrogen 2.883 N/A ILE 62.A N ASN 58.A O no hydrogen 2.916 N/A ARG 63.A N LEU 59.A O no hydrogen 2.975 N/A ARG 63.A NH1 TYR 9.A O no hydrogen 3.033 N/A ARG 63.A NH1 TYR 73.A OH no hydrogen 2.935 N/A ARG 63.A NH2 PHE 6.A O no hydrogen 3.078 N/A ARG 63.A NH2 TYR 9.A O no hydrogen 2.655 N/A HIS 64.A N CYS 60.A O no hydrogen 2.772 N/A SER 65.A N TYR 61.A O no hydrogen 2.942 N/A SER 65.A OG TYR 61.A O no hydrogen 3.210 N/A SER 65.A OG ILE 62.A O no hydrogen 3.019 N/A SER 65.A OG TYR 331.A OH no hydrogen 2.581 N/A VAL 66.A N ILE 62.A O no hydrogen 2.989 N/A ASP 67.A N ARG 63.A O no hydrogen 3.279 N/A THR 68.A N GLY 325.A O no hydrogen 2.840 N/A THR 68.A OG1 GLY 325.A O no hydrogen 2.664 N/A THR 69.A N ASP 67.A OD1 no hydrogen 2.917 N/A THR 69.A OG1 ASP 67.A OD1 no hydrogen 2.518 N/A THR 69.A OG1 ASP 67.A OD2 no hydrogen 3.540 N/A ASP 70.A N ASP 67.A O no hydrogen 3.065 N/A TYR 73.A N ASP 70.A OD2 no hydrogen 2.728 N/A LYS 74.A N ASP 70.A O no hydrogen 2.934 N/A GLU 75.A N ALA 71.A O no hydrogen 3.062 N/A GLU 76.A N PHE 72.A O no hydrogen 2.957 N/A GLN 77.A N TYR 73.A O no hydrogen 2.869 N/A GLN 77.A NE2 ASP 81.A OD1 no hydrogen 2.823 N/A ASP 78.A N LYS 74.A O no hydrogen 3.036 N/A PHE 79.A N GLU 75.A O no hydrogen 3.209 N/A PHE 80.A N GLU 76.A O no hydrogen 3.083 N/A ASP 81.A N GLN 77.A O no hydrogen 2.855 N/A GLU 82.A N ASP 78.A O no hydrogen 3.045 N/A PHE 83.A N PHE 79.A O no hydrogen 2.836 N/A SER 84.A N PHE 80.A O no hydrogen 2.938 N/A SER 84.A OG PHE 80.A O no hydrogen 2.605 N/A VAL 87.A N PHE 83.A O no hydrogen 3.202 N/A GLN 88.A N SER 84.A O no hydrogen 2.869 N/A GLY 89.A N PRO 85.A O no hydrogen 3.096 N/A TYR 90.A N VAL 86.A O no hydrogen 3.363 N/A GLY 91.A N VAL 87.A O no hydrogen 2.987 N/A THR 92.A N GLN 88.A O no hydrogen 2.924 N/A THR 92.A OG1 GLN 88.A O no hydrogen 3.245 N/A LYS 93.A N GLY 89.A O no hydrogen 3.122 N/A TYR 94.A N TYR 90.A O no hydrogen 3.060 N/A TYR 95.A N GLY 91.A O no hydrogen 2.887 N/A TYR 95.A OH GLU 377.A OE2 no hydrogen 2.513 N/A ASN 96.A N THR 92.A O no hydrogen 2.805 N/A ALA 97.A N LYS 93.A O no hydrogen 3.059 N/A LEU 98.A N TYR 94.A O no hydrogen 2.937 N/A ILE 99.A N TYR 95.A O no hydrogen 2.912 N/A HIS 100.A N ASN 96.A O no hydrogen 3.256 N/A HIS 100.A ND1 ASN 96.A O no hydrogen 2.832 N/A SER 101.A N LEU 98.A O no hydrogen 3.314 N/A SER 101.A OG GLN 39.A OE1 no hydrogen 2.527 N/A PHE 103.A N SER 101.A OG no hydrogen 2.785 N/A ARG 104.A N SER 101.A O no hydrogen 2.963 N/A ARG 104.A NE GLU 108.A OE1 no hydrogen 3.191 N/A ARG 104.A NH1 ILE 99.A O no hydrogen 3.104 N/A GLU 106.A N GLU 106.A OE2 no hydrogen 2.850 N/A LEU 107.A N PHE 103.A O no hydrogen 2.968 N/A GLU 108.A N ARG 104.A O no hydrogen 2.705 N/A ALA 109.A N GLU 105.A O no hydrogen 2.766 N/A TYR 110.A N GLU 106.A O no hydrogen 2.926 N/A TYR 110.A OH GLU 374.A OE1 no hydrogen 2.645 N/A TYR 111.A N LEU 107.A O no hydrogen 2.757 N/A GLY 112.A N GLU 108.A O no hydrogen 2.782 N/A LEU 115.A N TYR 378.A OH no hydrogen 3.075 N/A ALA 117.A N LYS 113.A O no hydrogen 2.979 N/A LEU 118.A N GLN 114.A O no hydrogen 2.979 N/A ALA 119.A N LEU 115.A O no hydrogen 3.059 N/A GLU 120.A N PHE 116.A O no hydrogen 3.105 N/A CYS 121.A N ALA 117.A O no hydrogen 3.381 N/A CYS 121.A SG ALA 117.A O no hydrogen 3.373 N/A ASP 122.A N LEU 118.A O no hydrogen 2.921 N/A LEU 123.A N ALA 119.A O no hydrogen 3.043 N/A LYS 124.A N CYS 121.A O no hydrogen 2.917 N/A THR 125.A N ASP 122.A O no hydrogen 3.144 N/A THR 125.A OG1 ASP 122.A O no hydrogen 2.996 N/A TYR 126.A OH ASP 128.A OD1 no hydrogen 2.604 N/A VAL 130.A N SER 127.A O no hydrogen 3.221 N/A VAL 130.A N SER 127.A OG no hydrogen 3.322 N/A VAL 131.A N ASP 128.A O no hydrogen 3.224 N/A LEU 134.A N VAL 130.A O no hydrogen 2.836 N/A GLN 135.A N VAL 131.A O no hydrogen 2.933 N/A GLN 135.A NE2 GLU 82.A O no hydrogen 2.798 N/A LEU 136.A N LYS 132.A O no hydrogen 3.118 N/A GLU 137.A N ASP 133.A O no hydrogen 2.819 N/A ASN 138.A N LEU 134.A O no hydrogen 2.927 N/A ASN 138.A ND2 ASP 81.A O no hydrogen 2.802 N/A LYS 139.A N GLN 135.A O no hydrogen 2.907 N/A LEU 140.A N LEU 136.A O no hydrogen 2.813 N/A SER 141.A N GLU 137.A O no hydrogen 3.117 N/A SER 141.A OG GLU 137.A O no hydrogen 3.402 N/A SER 142.A N ASN 138.A O no hydrogen 3.084 N/A SER 142.A OG ASP 81.A OD1 no hydrogen 3.419 N/A SER 142.A OG ASP 81.A OD2 no hydrogen 2.671 N/A SER 142.A OG ASN 138.A O no hydrogen 3.530 N/A GLN 143.A N LYS 139.A O no hydrogen 2.969 N/A TYR 144.A N LEU 140.A O no hydrogen 3.092 N/A THR 145.A N SER 141.A O no hydrogen 3.117 N/A THR 145.A OG1 SER 141.A O no hydrogen 3.477 N/A GLN 146.A N SER 142.A O no hydrogen 2.706 N/A GLN 146.A NE2 THR 68.A O no hydrogen 2.828 N/A LEU 147.A N GLN 143.A O no hydrogen 2.910 N/A LEU 148.A N TYR 144.A O no hydrogen 3.162 N/A ALA 149.A N THR 145.A O no hydrogen 2.952 N/A SER 150.A N LEU 147.A O no hydrogen 3.118 N/A SER 150.A OG LEU 147.A O no hydrogen 2.424 N/A ILE 153.A N ARG 160.A O no hydrogen 2.833 N/A PHE 155.A N GLU 158.A O no hydrogen 2.871 N/A GLU 158.A N PHE 155.A O no hydrogen 3.441 N/A ARG 160.A N ILE 153.A O no hydrogen 2.686 N/A ARG 160.A NE PHE 155.A O no hydrogen 2.760 N/A ARG 160.A NH1 PHE 155.A O no hydrogen 3.013 N/A ARG 160.A NH1 ALA 156.A O no hydrogen 3.234 N/A THR 161.A N GLN 164.A OE1 no hydrogen 2.901 N/A SER 163.A OG ASN 346.A O no hydrogen 3.513 N/A GLN 164.A N THR 161.A OG1 no hydrogen 3.267 N/A GLN 164.A NE2 ALA 322.A O no hydrogen 3.640 N/A LEU 165.A N THR 161.A O no hydrogen 3.074 N/A LEU 165.A N LEU 162.A O no hydrogen 2.962 N/A ILE 166.A N SER 163.A O no hydrogen 3.217 N/A PHE 168.A N LEU 165.A O no hydrogen 3.048 N/A MET 169.A N LEU 165.A O no hydrogen 3.001 N/A GLN 170.A N ILE 166.A O no hydrogen 3.095 N/A GLY 171.A N PHE 168.A O no hydrogen 3.132 N/A ARG 174.A NE ASP 271.A OD1 no hydrogen 3.375 N/A ARG 174.A NE ASP 271.A OD2 no hydrogen 2.970 N/A ARG 174.A NH2 ASP 271.A OD2 no hydrogen 2.784 N/A ARG 177.A N GLU 173.A O no hydrogen 3.065 N/A ARG 177.A NE TYR 270.A O no hydrogen 3.126 N/A ARG 177.A NE ASP 271.A OD1 no hydrogen 3.123 N/A ARG 177.A NH1 GLY 171.A O no hydrogen 2.901 N/A ARG 177.A NH1 LYS 172.A O no hydrogen 2.939 N/A ARG 177.A NH2 ASP 271.A OD1 no hydrogen 2.789 N/A LYS 178.A N ARG 174.A O no hydrogen 2.961 N/A ALA 179.A N SER 175.A O no hydrogen 2.894 N/A ALA 180.A N GLU 176.A O no hydrogen 2.935 N/A SER 181.A N ARG 177.A O no hydrogen 2.986 N/A SER 181.A OG ARG 177.A O no hydrogen 2.594 N/A GLU 182.A N LYS 178.A O no hydrogen 2.847 N/A ALA 183.A N ALA 179.A O no hydrogen 3.003 N/A TYR 184.A N ALA 180.A O no hydrogen 2.975 N/A TYR 185.A N SER 181.A O no hydrogen 2.900 N/A GLY 186.A N GLU 182.A O no hydrogen 2.737 N/A PHE 187.A N ALA 183.A O no hydrogen 2.975 N/A LEU 188.A N TYR 184.A O no hydrogen 3.307 N/A ALA 189.A N TYR 185.A O no hydrogen 2.797 N/A GLU 190.A N GLY 186.A O no hydrogen 2.815 N/A ASN 191.A N PHE 187.A O no hydrogen 3.175 N/A ASN 191.A N LEU 188.A O no hydrogen 3.036 N/A ASN 191.A ND2 PHE 187.A O no hydrogen 2.758 N/A GLU 192.A N ALA 189.A O no hydrogen 3.308 N/A LEU 195.A N ASN 191.A O no hydrogen 2.892 N/A ASP 196.A N GLU 192.A O no hydrogen 2.737 N/A ARG 197.A N GLU 193.A O no hydrogen 3.010 N/A ARG 197.A NE GLU 194.A OE1 no hydrogen 3.065 N/A ARG 197.A NE GLU 194.A OE2 no hydrogen 3.118 N/A ARG 197.A NH1 GLU 201.A OE2 no hydrogen 2.806 N/A ARG 197.A NH2 GLN 143.A OE1 no hydrogen 2.863 N/A ARG 197.A NH2 GLU 194.A OE2 no hydrogen 2.514 N/A ILE 198.A N GLU 194.A O no hydrogen 3.055 N/A TYR 199.A N LEU 195.A O no hydrogen 3.075 N/A TYR 199.A OH GLN 434.A OE1 no hydrogen 3.382 N/A ASP 200.A N ASP 196.A O no hydrogen 2.955 N/A GLU 201.A N ARG 197.A O no hydrogen 2.918 N/A LEU 202.A N ILE 198.A O no hydrogen 2.859 N/A VAL 203.A N TYR 199.A O no hydrogen 3.001 N/A LYS 204.A N ASP 200.A O no hydrogen 3.122 N/A VAL 205.A N GLU 201.A O no hydrogen 2.992 N/A ARG 206.A N LEU 202.A O no hydrogen 3.016 N/A ARG 206.A NE GLU 137.A OE2 no hydrogen 2.790 N/A ARG 206.A NH1 TYR 438.A OH no hydrogen 3.035 N/A ARG 206.A NH2 GLU 137.A OE2 no hydrogen 3.466 N/A THR 207.A N VAL 203.A O no hydrogen 2.965 N/A THR 207.A OG1 VAL 203.A O no hydrogen 2.657 N/A LYS 208.A N LYS 204.A O no hydrogen 3.006 N/A LYS 208.A NZ ASP 133.A OD1 no hydrogen 3.205 N/A ILE 209.A N VAL 205.A O no hydrogen 2.854 N/A ALA 210.A N ARG 206.A O no hydrogen 3.034 N/A LYS 211.A N THR 207.A O no hydrogen 2.978 N/A SER 212.A N LYS 208.A O no hydrogen 2.963 N/A SER 212.A OG GLU 129.A OE2 no hydrogen 3.126 N/A SER 212.A OG LYS 208.A O no hydrogen 3.447 N/A LEU 213.A N ILE 209.A O no hydrogen 3.008 N/A GLY 214.A N LYS 211.A O no hydrogen 2.881 N/A PHE 215.A N ALA 210.A O no hydrogen 2.898 N/A VAL 219.A N ASN 217.A OD1 no hydrogen 2.961 N/A GLY 222.A N PHE 218.A O no hydrogen 2.774 N/A TYR 223.A N VAL 219.A O no hydrogen 3.141 N/A TYR 223.A OH HIS 435.A NE2 no hydrogen 3.080 N/A ALA 224.A N GLU 220.A O no hydrogen 3.438 N/A ARG 225.A N LEU 221.A O no hydrogen 2.974 N/A ARG 225.A NH1 GLU 137.A OE1 no hydrogen 3.497 N/A ARG 225.A NH1 GLU 137.A OE2 no hydrogen 2.746 N/A ARG 225.A NH2 GLU 137.A OE1 no hydrogen 2.830 N/A ARG 225.A NH2 GLU 137.A OE2 no hydrogen 3.561 N/A MET 226.A N GLY 222.A O no hydrogen 3.064 N/A TYR 227.A N ALA 224.A O no hydrogen 2.987 N/A TYR 227.A OH ASP 122.A OD1 no hydrogen 2.857 N/A ARG 228.A N TYR 223.A O no hydrogen 3.276 N/A TYR 231.A OH GLU 384.A OE2 no hydrogen 2.945 N/A MET 235.A N ASN 232.A OD1 no hydrogen 3.039 N/A VAL 236.A N ASN 232.A O no hydrogen 3.220 N/A ALA 237.A N ALA 233.A O no hydrogen 2.816 N/A ASN 238.A N GLU 234.A O no hydrogen 3.144 N/A TYR 239.A N MET 235.A O no hydrogen 3.060 N/A TYR 239.A OH THR 471.A OG1 no hydrogen 3.324 N/A ARG 240.A N VAL 236.A O no hydrogen 3.043 N/A ARG 240.A NE ASP 431.A OD2 no hydrogen 3.318 N/A ARG 240.A NH1 GLU 432.A OE2 no hydrogen 3.505 N/A GLN 241.A N ALA 237.A O no hydrogen 3.173 N/A GLN 241.A NE2 ASP 245.A OD1 no hydrogen 2.841 N/A GLN 241.A NE2 ASP 245.A OD2 no hydrogen 3.491 N/A GLN 242.A N ASN 238.A O no hydrogen 3.285 N/A VAL 243.A N TYR 239.A O no hydrogen 3.062 N/A LEU 244.A N ARG 240.A O no hydrogen 3.011 N/A ASP 245.A N GLN 241.A O no hydrogen 2.781 N/A TYR 246.A N GLN 242.A O no hydrogen 2.934 N/A ILE 247.A N VAL 243.A O no hydrogen 2.926 N/A VAL 248.A N VAL 243.A O no hydrogen 3.091 N/A THR 251.A N ILE 247.A O no hydrogen 2.955 N/A THR 251.A OG1 ILE 247.A O no hydrogen 3.481 N/A THR 251.A OG1 VAL 248.A O no hydrogen 2.945 N/A THR 252.A N VAL 248.A O no hydrogen 2.981 N/A THR 252.A OG1 VAL 248.A O no hydrogen 3.168 N/A GLU 253.A N PRO 249.A O no hydrogen 3.130 N/A LEU 254.A N VAL 250.A O no hydrogen 2.960 N/A ARG 255.A N THR 251.A O no hydrogen 3.025 N/A ARG 255.A NH1 GLU 272.A OE1 no hydrogen 2.872 N/A LYS 256.A N THR 252.A O no hydrogen 3.117 N/A ARG 257.A N GLU 253.A O no hydrogen 2.902 N/A ARG 257.A NE ASP 541.A OD1 no hydrogen 2.783 N/A ARG 257.A NH1 LEU 536.A O no hydrogen 3.291 N/A ARG 257.A NH2 LEU 536.A O no hydrogen 3.121 N/A ARG 257.A NH2 ASP 541.A OD1 no hydrogen 2.432 N/A GLN 258.A N LEU 254.A O no hydrogen 2.890 N/A GLN 258.A NE2 GLU 272.A O no hydrogen 2.905 N/A GLN 258.A NE2 PHE 274.A O no hydrogen 2.979 N/A GLN 259.A N ARG 255.A O no hydrogen 2.904 N/A ALA 260.A N LYS 256.A O no hydrogen 3.055 N/A ARG 261.A N ARG 257.A O no hydrogen 2.940 N/A ARG 261.A NE GLU 275.A O no hydrogen 2.900 N/A ARG 261.A NH1 ASP 541.A OD2 no hydrogen 2.720 N/A ARG 261.A NH2 GLU 275.A O no hydrogen 3.185 N/A ILE 262.A N GLN 258.A O no hydrogen 3.073 N/A GLY 263.A N ALA 260.A O no hydrogen 3.249 N/A VAL 264.A N GLN 259.A O no hydrogen 2.986 N/A ASP 271.A N ALA 268.A O no hydrogen 2.904 N/A PHE 274.A N ASP 271.A O no hydrogen 3.025 N/A GLU 275.A N ASN 280.A OD1 no hydrogen 2.903 N/A GLY 279.A N PHE 276.A O no hydrogen 2.794 N/A ASN 280.A ND2 ASN 273.A O no hydrogen 2.706 N/A THR 282.A N ASP 408.A OD2 no hydrogen 3.124 N/A LYS 284.A N PHE 404.A O no hydrogen 3.003 N/A LYS 284.A NZ THR 282.A O no hydrogen 3.022 N/A LYS 284.A NZ THR 282.A OG1 no hydrogen 2.907 N/A LYS 284.A NZ ASP 408.A OD2 no hydrogen 2.570 N/A TRP 289.A N ASP 286.A OD1 no hydrogen 3.046 N/A ILE 290.A N ASP 286.A O no hydrogen 2.890 N/A VAL 291.A N ALA 287.A O no hydrogen 2.928 N/A ASN 292.A N ASP 288.A O no hydrogen 2.858 N/A HIS 293.A N TRP 289.A O no hydrogen 3.069 N/A GLY 294.A N ILE 290.A O no hydrogen 2.834 N/A LYS 295.A N VAL 291.A O no hydrogen 2.926 N/A THR 296.A N ASN 292.A O no hydrogen 3.424 N/A THR 296.A OG1 ASN 292.A O no hydrogen 3.519 N/A MET 297.A N HIS 293.A O no hydrogen 2.824 N/A TYR 298.A N GLY 294.A O no hydrogen 2.799 N/A LYS 299.A N LYS 295.A O no hydrogen 3.071 N/A GLU 300.A N THR 296.A O no hydrogen 3.068 N/A LEU 301.A N MET 297.A O no hydrogen 2.868 N/A SER 302.A OG THR 305.A OG1 no hydrogen 3.086 N/A GLU 304.A N GLU 304.A OE1 no hydrogen 2.736 N/A THR 305.A N SER 302.A OG no hydrogen 3.135 N/A THR 305.A OG1 TYR 298.A O no hydrogen 2.560 N/A THR 305.A OG1 SER 302.A O no hydrogen 3.182 N/A THR 305.A OG1 SER 302.A OG no hydrogen 3.086 N/A ASP 306.A N SER 302.A O no hydrogen 3.022 N/A GLU 307.A N ALA 303.A O no hydrogen 3.087 N/A PHE 308.A N GLU 304.A O no hydrogen 2.952 N/A PHE 309.A N THR 305.A O no hydrogen 2.798 N/A ASN 310.A N ASP 306.A O no hydrogen 2.978 N/A ASN 310.A ND2 ASP 306.A O no hydrogen 2.915 N/A PHE 311.A N GLU 307.A O no hydrogen 2.902 N/A MET 312.A N PHE 308.A O no hydrogen 3.036 N/A LEU 313.A N PHE 309.A O no hydrogen 2.982 N/A ASP 314.A N ASN 310.A O no hydrogen 2.898 N/A ASN 315.A N PHE 311.A O no hydrogen 3.091 N/A ASN 315.A ND2 PHE 311.A O no hydrogen 2.842 N/A ASP 316.A N LEU 313.A O no hydrogen 3.176 N/A LEU 317.A N MET 312.A O no hydrogen 2.995 N/A ASP 319.A N ILE 343.A O no hydrogen 2.931 N/A ALA 322.A N PHE 347.A O no hydrogen 3.108 N/A LYS 323.A NZ ASP 319.A OD1 no hydrogen 3.145 N/A LYS 323.A NZ ASP 319.A OD2 no hydrogen 3.462 N/A LYS 324.A NZ GLU 159.A OE1 no hydrogen 2.677 N/A LYS 326.A N LYS 323.A O no hydrogen 2.999 N/A LYS 326.A NZ ASP 319.A O no hydrogen 2.959 N/A LYS 326.A NZ ASP 319.A OD1 no hydrogen 2.698 N/A LYS 326.A NZ VAL 321.A O no hydrogen 2.732 N/A LYS 326.A NZ SER 345.A O no hydrogen 2.841 N/A ALA 327.A N SER 65.A O no hydrogen 2.751 N/A TYR 331.A N PHE 344.A O no hydrogen 2.886 N/A TYR 331.A OH SER 65.A OG no hydrogen 2.581 N/A CYS 332.A SG THR 333.A O no hydrogen 3.726 N/A CYS 332.A SG PHE 342.A O no hydrogen 3.578 N/A THR 333.A N PHE 342.A O no hydrogen 3.035 N/A THR 333.A OG1 ASN 58.A OD1 no hydrogen 2.813 N/A ILE 335.A N ALA 340.A O no hydrogen 2.779 N/A GLU 336.A N GLU 336.A OE2 no hydrogen 2.694 N/A ASN 337.A N THR 55.A OG1 no hydrogen 2.791 N/A ASN 337.A ND2 ASP 52.A OD1 no hydrogen 2.820 N/A TYR 338.A N ILE 335.A O no hydrogen 3.304 N/A LYS 339.A N GLU 336.A O no hydrogen 2.880 N/A ALA 340.A N ILE 335.A O no hydrogen 3.130 N/A PHE 342.A N THR 333.A O no hydrogen 2.823 N/A ILE 343.A N LEU 317.A O no hydrogen 2.868 N/A PHE 344.A N TYR 331.A O no hydrogen 2.902 N/A SER 345.A N ASP 319.A O no hydrogen 3.018 N/A SER 345.A OG LEU 320.A O no hydrogen 2.906 N/A ASN 346.A ND2 ALA 327.A O no hydrogen 3.076 N/A ASN 346.A ND2 GLY 329.A O no hydrogen 2.701 N/A PHE 347.A N LEU 320.A O no hydrogen 2.705 N/A ASN 348.A N ASP 353.A OD1 no hydrogen 2.823 N/A ASN 348.A ND2 SER 163.A O no hydrogen 2.982 N/A GLY 349.A N ASP 353.A OD2 no hydrogen 2.966 N/A THR 350.A N ASN 348.A OD1 no hydrogen 3.197 N/A THR 350.A OG1 ASN 348.A OD1 no hydrogen 2.623 N/A ASP 353.A N THR 350.A O no hydrogen 2.904 N/A ILE 354.A N SER 351.A O no hydrogen 3.050 N/A ASP 355.A N SER 351.A O no hydrogen 3.174 N/A VAL 356.A N GLY 352.A O no hydrogen 2.944 N/A LEU 357.A N ASP 353.A O no hydrogen 3.032 N/A THR 358.A N ILE 354.A O no hydrogen 3.013 N/A THR 358.A OG1 ILE 354.A O no hydrogen 2.933 N/A THR 358.A OG1 ASP 355.A O no hydrogen 3.156 N/A HIS 359.A N ASP 355.A O no hydrogen 2.912 N/A HIS 359.A ND1 GLU 394.A OE2 no hydrogen 2.689 N/A GLU 360.A N VAL 356.A O no hydrogen 2.902 N/A ALA 361.A N LEU 357.A O no hydrogen 2.905 N/A GLY 362.A N THR 358.A O no hydrogen 3.017 N/A HIS 363.A N HIS 359.A O no hydrogen 3.296 N/A ALA 364.A N GLU 360.A O no hydrogen 2.779 N/A PHE 365.A N ALA 361.A O no hydrogen 2.712 N/A GLN 366.A N GLY 362.A O no hydrogen 3.080 N/A GLN 366.A NE2 SER 370.A OG no hydrogen 3.036 N/A GLN 366.A NE2 ASN 379.A O no hydrogen 2.944 N/A VAL 367.A N HIS 363.A O no hydrogen 2.886 N/A TYR 368.A N ALA 364.A O no hydrogen 2.855 N/A TYR 368.A OH GLU 307.A OE2 no hydrogen 2.528 N/A GLU 369.A N PHE 365.A O no hydrogen 2.920 N/A SER 370.A N VAL 367.A O no hydrogen 3.102 N/A SER 370.A OG GLN 366.A O no hydrogen 2.829 N/A SER 370.A OG CYS 499.A O no hydrogen 3.006 N/A ARG 371.A N TYR 368.A O no hydrogen 3.278 N/A ARG 371.A NE LYS 339.A O no hydrogen 2.809 N/A PHE 373.A N SER 370.A O no hydrogen 3.228 N/A GLU 377.A N GLU 377.A OE1 no hydrogen 2.721 N/A TYR 378.A N ILE 375.A O no hydrogen 3.094 N/A TYR 378.A OH TYR 111.A O no hydrogen 2.607 N/A ASN 379.A N PRO 376.A O no hydrogen 3.157 N/A ASN 379.A ND2 PRO 376.A O no hydrogen 3.286 N/A THR 382.A OG1 GLU 384.A OE1 no hydrogen 2.393 N/A ALA 385.A N GLU 384.A OE1 no hydrogen 2.787 N/A CYS 386.A N.A THR 382.A O no hydrogen 2.803 N/A CYS 386.A N.B THR 382.A O no hydrogen 2.826 N/A CYS 386.A N.B TYR 383.A O no hydrogen 3.183 N/A CYS 386.A SG.A PRO 381.A O no hydrogen 2.809 N/A CYS 386.A SG.A THR 382.A O no hydrogen 3.506 N/A CYS 386.A SG.B TYR 383.A O no hydrogen 3.128 N/A GLU 387.A N TYR 383.A O no hydrogen 3.340 N/A GLU 387.A N GLU 384.A O no hydrogen 3.020 N/A ILE 388.A N ALA 385.A O no hydrogen 3.082 N/A HIS 389.A N CYS 386.A O.A no hydrogen 3.228 N/A HIS 389.A N CYS 386.A O.B no hydrogen 3.301 N/A HIS 389.A ND1 CYS 386.A O.A no hydrogen 3.297 N/A SER 390.A OG GLU 387.A O no hydrogen 2.849 N/A SER 390.A OG GLU 387.A OE1 no hydrogen 2.960 N/A MET 391.A N GLU 387.A O no hydrogen 2.940 N/A SER 392.A N ILE 388.A O no hydrogen 2.969 N/A SER 392.A OG ILE 388.A O no hydrogen 2.801 N/A MET 393.A N HIS 389.A O no hydrogen 3.165 N/A GLU 394.A N SER 390.A O no hydrogen 3.232 N/A PHE 395.A N SER 392.A O no hydrogen 2.879 N/A PHE 396.A N SER 392.A O no hydrogen 2.930 N/A THR 397.A N MET 393.A O no hydrogen 3.125 N/A THR 397.A OG1 MET 393.A O no hydrogen 3.134 N/A THR 397.A OG1 GLU 394.A O no hydrogen 2.981 N/A TRP 398.A N PHE 395.A O no hydrogen 2.992 N/A TRP 400.A N THR 397.A O no hydrogen 2.981 N/A TRP 400.A NE1 GLU 300.A OE1 no hydrogen 2.760 N/A MET 401.A N TRP 398.A O no hydrogen 3.144 N/A LEU 403.A N TRP 400.A O no hydrogen 2.940 N/A PHE 405.A N MET 401.A O no hydrogen 2.910 N/A GLU 406.A N LYS 402.A O no hydrogen 2.826 N/A GLU 407.A N GLU 407.A OE1 no hydrogen 2.719 N/A ASP 408.A N PHE 405.A O no hydrogen 2.823 N/A ALA 409.A N GLU 406.A O no hydrogen 3.034 N/A LYS 411.A NZ THR 278.A OG1 no hydrogen 2.752 N/A LYS 411.A NZ GLY 279.A O no hydrogen 2.781 N/A TYR 412.A N ASP 408.A O no hydrogen 2.998 N/A TYR 412.A OH ASP 355.A OD1 no hydrogen 2.350 N/A TYR 413.A N ALA 409.A O no hydrogen 2.999 N/A TYR 413.A OH TRP 398.A O no hydrogen 3.060 N/A PHE 414.A N ASP 410.A O no hydrogen 3.196 N/A SER 415.A N LYS 411.A O no hydrogen 2.890 N/A SER 415.A OG GLU 275.A OE1 no hydrogen 2.709 N/A HIS 416.A N TYR 412.A O no hydrogen 2.707 N/A HIS 416.A NE2 GLU 394.A OE1 no hydrogen 2.740 N/A LEU 417.A N TYR 413.A O no hydrogen 2.978 N/A SER 418.A N PHE 414.A O no hydrogen 2.948 N/A SER 418.A OG PHE 414.A O no hydrogen 2.827 N/A SER 419.A N SER 415.A O no hydrogen 2.821 N/A SER 419.A OG SER 415.A O no hydrogen 3.224 N/A ALA 420.A N HIS 416.A O no hydrogen 2.960 N/A LEU 421.A N LEU 417.A O no hydrogen 3.097 N/A LEU 422.A N SER 418.A O no hydrogen 2.828 N/A PHE 423.A N SER 419.A O no hydrogen 3.158 N/A LEU 424.A N LEU 421.A O no hydrogen 3.014 N/A TYR 426.A N LEU 422.A O no hydrogen 3.378 N/A GLY 427.A N PHE 423.A O no hydrogen 2.785 N/A VAL 428.A N LEU 424.A O no hydrogen 3.145 N/A SER 429.A N PRO 425.A O no hydrogen 2.981 N/A SER 429.A OG PRO 425.A O no hydrogen 2.869 N/A VAL 430.A N TYR 426.A O no hydrogen 2.946 N/A ASP 431.A N GLY 427.A O no hydrogen 2.921 N/A GLU 432.A N VAL 428.A O no hydrogen 2.853 N/A TYR 433.A N SER 429.A O no hydrogen 2.818 N/A GLN 434.A N VAL 430.A O no hydrogen 2.948 N/A HIS 435.A N ASP 431.A O no hydrogen 3.044 N/A HIS 435.A ND1 ASP 431.A O no hydrogen 3.192 N/A HIS 435.A NE2 TYR 223.A OH no hydrogen 3.080 N/A TYR 436.A N GLU 432.A O no hydrogen 3.149 N/A VAL 437.A N TYR 433.A O no hydrogen 2.924 N/A TYR 438.A N GLN 434.A O no hydrogen 2.965 N/A GLU 439.A N HIS 435.A O no hydrogen 2.782 N/A ASN 440.A N VAL 437.A O no hydrogen 3.046 N/A ALA 443.A N ASN 440.A O no hydrogen 3.040 N/A GLU 447.A N SER 444.A OG no hydrogen 2.963 N/A ARG 448.A N SER 444.A O no hydrogen 2.860 N/A ARG 448.A NH1 ASP 200.A OD1 no hydrogen 2.715 N/A LYS 449.A N PRO 445.A O no hydrogen 2.873 N/A THR 450.A N GLU 446.A O no hydrogen 3.244 N/A THR 450.A OG1 GLU 446.A O no hydrogen 2.867 N/A ALA 451.A N GLU 447.A O no hydrogen 3.116 N/A TRP 452.A N ARG 448.A O no hydrogen 3.060 N/A ARG 453.A N LYS 449.A O no hydrogen 2.759 N/A ASN 454.A N THR 450.A O no hydrogen 2.934 N/A ILE 455.A N ALA 451.A O no hydrogen 3.088 N/A GLU 456.A N TRP 452.A O no hydrogen 2.816 N/A LYS 457.A N ARG 453.A O no hydrogen 2.949 N/A LYS 457.A NZ ASN 454.A OD1 no hydrogen 3.056 N/A LYS 458.A N ILE 455.A O no hydrogen 2.989 N/A TYR 459.A N ILE 455.A O no hydrogen 3.118 N/A TYR 459.A OH GLU 432.A OE2 no hydrogen 2.886 N/A LEU 460.A N GLU 456.A O no hydrogen 2.846 N/A TYR 466.A N SER 463.A O no hydrogen 2.638 N/A TYR 467.A N PRO 464.A O no hydrogen 3.042 N/A ASP 469.A N TYR 466.A O no hydrogen 2.828 N/A TYR 470.A N TYR 466.A O no hydrogen 3.423 N/A THR 471.A N TYR 467.A O no hydrogen 3.226 N/A THR 471.A N ILE 468.A O no hydrogen 3.050 N/A THR 471.A OG1 TYR 239.A OH no hydrogen 3.324 N/A THR 471.A OG1 ILE 468.A O no hydrogen 2.985 N/A LEU 472.A N ILE 468.A O no hydrogen 3.113 N/A ALA 473.A N ASP 469.A O no hydrogen 3.124 N/A GLN 474.A N TYR 470.A O no hydrogen 2.924 N/A ILE 475.A N.A THR 471.A O no hydrogen 3.145 N/A ILE 475.A N.B THR 471.A O no hydrogen 3.194 N/A CYS 476.A N LEU 472.A O no hydrogen 3.354 N/A CYS 476.A SG LEU 472.A O no hydrogen 3.637 N/A ALA 477.A N ALA 473.A O no hydrogen 2.827 N/A LEU 478.A N GLN 474.A O no hydrogen 2.956 N/A GLN 479.A N ILE 475.A O.A no hydrogen 2.995 N/A GLN 479.A N ILE 475.A O.B no hydrogen 3.188 N/A GLN 479.A NE2 ILE 475.A O.B no hydrogen 3.526 N/A GLN 479.A NE2 THR 517.A O no hydrogen 2.710 N/A PHE 480.A N CYS 476.A O no hydrogen 3.012 N/A TRP 481.A N ALA 477.A O no hydrogen 2.900 N/A LYS 482.A N LEU 478.A O no hydrogen 3.195 N/A LYS 482.A NZ ASP 486.A OD1 no hydrogen 3.414 N/A LYS 482.A NZ ASP 486.A OD2 no hydrogen 2.844 N/A LYS 482.A NZ GLU 531.A OE2 no hydrogen 3.153 N/A ARG 483.A N GLN 479.A O no hydrogen 2.888 N/A ARG 483.A NH1 ASP 494.A OD2 no hydrogen 2.828 N/A ARG 483.A NH2 ASP 494.A OD2 no hydrogen 2.680 N/A ALA 484.A N PHE 480.A O no hydrogen 2.816 N/A ARG 485.A N TRP 481.A O no hydrogen 3.156 N/A ARG 485.A NH2 GLU 531.A OE2 no hydrogen 2.925 N/A ASP 486.A N LYS 482.A O no hydrogen 2.987 N/A ASN 487.A N ARG 483.A O no hydrogen 2.861 N/A GLU 490.A N ASN 487.A OD1 no hydrogen 3.222 N/A ALA 491.A N ASN 487.A O no hydrogen 3.027 N/A TRP 492.A N ARG 488.A O no hydrogen 2.876 N/A GLU 493.A N GLN 489.A O no hydrogen 2.972 N/A ASP 494.A N GLU 490.A O no hydrogen 3.118 N/A TYR 495.A N ALA 491.A O no hydrogen 2.965 N/A TYR 495.A OH HIS 389.A O no hydrogen 2.689 N/A VAL 496.A N TRP 492.A O no hydrogen 2.949 N/A ASN 497.A N GLU 493.A O no hydrogen 3.147 N/A LEU 498.A N ASP 494.A O no hydrogen 2.950 N/A CYS 499.A N TYR 495.A O no hydrogen 3.000 N/A CYS 499.A SG TYR 495.A O no hydrogen 3.415 N/A GLN 500.A N VAL 496.A O no hydrogen 2.965 N/A GLN 500.A NE2 GLU 369.A OE1 no hydrogen 2.838 N/A GLN 501.A N LEU 498.A O no hydrogen 3.029 N/A GLN 501.A NE2 ASN 497.A O no hydrogen 2.845 N/A GLY 502.A N CYS 499.A O no hydrogen 3.233 N/A GLY 503.A N TYR 378.A O no hydrogen 2.967 N/A SER 504.A N GLN 501.A O no hydrogen 2.963 N/A SER 504.A OG GLN 501.A O no hydrogen 2.572 N/A SER 506.A N GLU 509.A OE1 no hydrogen 2.913 N/A SER 506.A OG ASP 230.A OD2 no hydrogen 2.571 N/A LEU 508.A N ASP 230.A OD2 no hydrogen 2.766 N/A LEU 510.A N SER 506.A O no hydrogen 2.855 N/A VAL 511.A N PHE 507.A O no hydrogen 2.983 N/A GLU 512.A N LEU 508.A O no hydrogen 3.157 N/A VAL 513.A N GLU 509.A O no hydrogen 2.975 N/A ALA 514.A N LEU 510.A O no hydrogen 2.993 N/A ASN 515.A N GLU 512.A O no hydrogen 2.980 N/A ASN 515.A ND2 ASP 494.A OD1 no hydrogen 3.464 N/A ASN 515.A ND2 ASP 494.A OD2 no hydrogen 3.187 N/A LEU 516.A N VAL 511.A O no hydrogen 3.006 N/A THR 517.A N GLN 479.A OE1 no hydrogen 2.791 N/A THR 517.A OG1 GLN 479.A OE1 no hydrogen 3.491 N/A PHE 520.A N SER 518.A OG no hydrogen 3.013 N/A ALA 521.A N SER 518.A O no hydrogen 2.965 N/A CYS 524.A N ALA 521.A O no hydrogen 3.033 N/A CYS 524.A SG THR 517.A O no hydrogen 3.875 N/A CYS 524.A SG SER 518.A O no hydrogen 3.554 N/A SER 527.A N GLY 523.A O no hydrogen 3.128 N/A SER 527.A OG GLY 523.A O no hydrogen 2.813 N/A VAL 528.A N CYS 524.A O no hydrogen 3.116 N/A ILE 529.A N VAL 525.A O no hydrogen 2.955 N/A THR 530.A N LYS 526.A O no hydrogen 2.913 N/A THR 530.A OG1 LYS 526.A O no hydrogen 2.966 N/A GLU 531.A N SER 527.A O no hydrogen 3.142 N/A ILE 532.A N VAL 528.A O no hydrogen 3.041 N/A GLU 533.A N ILE 529.A O no hydrogen 2.851 N/A ALA 534.A N THR 530.A O no hydrogen 2.981 N/A TRP 535.A N GLU 531.A O no hydrogen 3.021 N/A LEU 536.A N ILE 532.A O no hydrogen 2.775 N/A HIS 537.A N GLU 533.A O no hydrogen 2.822 N/A HIS 537.A NE2 GLU 253.A OE2 no hydrogen 2.907 N/A ALA 538.A N ALA 534.A O no hydrogen 3.155 N/A ALA 538.A N TRP 535.A O no hydrogen 3.318 N/A ILE 539.A N LEU 536.A O no hydrogen 3.411 N/A THR 542.A N ASP 540.A OD1 no hydrogen 3.293 N/A THR 542.A OG1 ASP 540.A OD1 no hydrogen 2.669 N/A LYS 543.A N ASP 540.A O no hydrogen 3.234 N/A LEU 544.A N ASP 541.A O no hydrogen 3.178 N/A