Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4obc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 56.A OD1 no hydrogen 3.121 N/A SER 1.A N ASP 56.A OD2 no hydrogen 3.414 N/A SER 4.A N PHE 55.A O no hydrogen 3.081 N/A SER 4.A OG VAL 53.A O no hydrogen 2.774 N/A SER 6.A N TYR 277.A O no hydrogen 2.820 N/A TRP 7.A NE1 THR 54.A OG1 no hydrogen 2.870 N/A THR 8.A N CYS 275.A O no hydrogen 3.084 N/A THR 8.A OG1 THR 274.A O no hydrogen 2.658 N/A THR 8.A OG1 CYS 275.A O no hydrogen 3.395 N/A ALA 10.A N THR 8.A OG1 no hydrogen 3.249 N/A THR 13.A OG1 SER 270.A OG no hydrogen 2.837 N/A LYS 21.A NZ HIS 35.A O no hydrogen 2.945 N/A LYS 21.A NZ VAL 38.A O no hydrogen 3.017 N/A LEU 27.A N GLU 399.A OE2 no hydrogen 2.628 N/A SER 28.A N ASN 25.A O no hydrogen 3.211 N/A SER 28.A OG GLU 399.A OE1 no hydrogen 2.781 N/A ASN 29.A N ASN 25.A O no hydrogen 2.880 N/A LEU 31.A N SER 28.A O no hydrogen 2.915 N/A LEU 32.A N SER 28.A O no hydrogen 3.213 N/A ARG 33.A N GLY 494.A O no hydrogen 2.861 N/A TYR 34.A N LEU 493.A O no hydrogen 3.008 N/A HIS 35.A N ARG 33.A O no hydrogen 3.006 N/A LYS 37.A N TYR 34.A O no hydrogen 3.040 N/A LYS 37.A NZ LYS 492.A O no hydrogen 2.921 N/A VAL 38.A N HIS 35.A O no hydrogen 2.928 N/A TYR 39.A N PHE 146.A O no hydrogen 3.050 N/A CYS 40.A SG THR 41.A O no hydrogen 3.702 N/A CYS 40.A SG GLU 144.A O no hydrogen 3.678 N/A THR 41.A N GLU 144.A O no hydrogen 2.773 N/A THR 41.A OG1 LYS 142.A O no hydrogen 2.792 N/A THR 41.A OG1 GLU 144.A O no hydrogen 3.420 N/A SER 43.A N GLU 18.A OE2 no hydrogen 3.340 N/A SER 43.A OG GLU 18.A OE1 no hydrogen 2.914 N/A SER 43.A OG GLU 18.A OE2 no hydrogen 3.461 N/A SER 45.A N THR 42.A O no hydrogen 3.102 N/A SER 45.A OG THR 42.A O no hydrogen 3.188 N/A ALA 46.A N SER 43.A O no hydrogen 2.787 N/A ARG 49.A N SER 45.A O no hydrogen 3.145 N/A ALA 50.A N ALA 46.A O no hydrogen 2.939 N/A LYS 51.A N SER 47.A O no hydrogen 2.979 N/A LYS 52.A N GLN 48.A O no hydrogen 3.381 N/A VAL 53.A N ARG 49.A O no hydrogen 3.032 N/A VAL 53.A N ALA 50.A O no hydrogen 3.222 N/A THR 54.A OG1 ALA 50.A O no hydrogen 2.563 N/A PHE 55.A N SER 4.A OG no hydrogen 3.247 N/A ARG 57.A N SER 2.A O no hydrogen 2.923 N/A ARG 57.A NE SER 2.A O no hydrogen 2.937 N/A ARG 57.A NH1 SER 227.A O no hydrogen 2.808 N/A ARG 57.A NH1 VAL 229.A O no hydrogen 2.688 N/A ARG 57.A NH2 SER 2.A OG no hydrogen 3.343 N/A ARG 57.A NH2 ARG 279.A O no hydrogen 2.869 N/A GLN 59.A NE2 ASP 233.A OD1 no hydrogen 3.121 N/A GLN 59.A NE2 ASP 233.A OD2 no hydrogen 3.343 N/A GLN 59.A NE2 TYR 347.A O no hydrogen 2.825 N/A VAL 60.A N ARG 346.A O no hydrogen 2.990 N/A TYR 65.A N ASP 62.A OD2 no hydrogen 2.975 N/A ASP 66.A N ASP 62.A O no hydrogen 2.962 N/A SER 67.A N ALA 63.A O no hydrogen 2.969 N/A VAL 68.A N HIS 64.A O no hydrogen 3.122 N/A VAL 68.A N TYR 65.A O no hydrogen 2.892 N/A LEU 69.A N TYR 65.A O no hydrogen 2.916 N/A LYS 70.A N ASP 66.A O no hydrogen 3.047 N/A ASP 71.A N SER 67.A O no hydrogen 3.255 N/A ILE 72.A N VAL 68.A O no hydrogen 2.992 N/A ILE 72.A N LEU 69.A O no hydrogen 3.206 N/A LYS 73.A N LEU 69.A O no hydrogen 2.955 N/A LYS 73.A NZ SER 239.A OG no hydrogen 2.849 N/A LEU 74.A N LYS 70.A O no hydrogen 3.017 N/A ALA 75.A N ASP 71.A O no hydrogen 3.038 N/A ALA 76.A N ILE 72.A O no hydrogen 2.780 N/A SER 77.A N LYS 73.A O no hydrogen 2.967 N/A SER 77.A OG LEU 74.A O no hydrogen 2.711 N/A LYS 78.A N ALA 75.A O no hydrogen 3.296 N/A VAL 79.A N ALA 76.A O no hydrogen 2.866 N/A ALA 81.A N SER 245.A O no hydrogen 3.022 N/A ARG 82.A N ASP 178.A OD2 no hydrogen 2.834 N/A ARG 82.A NH2 GLN 88.A OE1 no hydrogen 3.309 N/A LEU 84.A N MET 174.A O no hydrogen 3.017 N/A THR 85.A N GLN 88.A OE1 no hydrogen 2.542 N/A GLN 87.A N GLN 87.A OE1 no hydrogen 2.752 N/A GLN 88.A N THR 85.A OG1 no hydrogen 3.019 N/A ALA 89.A N THR 85.A O no hydrogen 3.120 N/A CYS 90.A N LEU 86.A O no hydrogen 2.950 N/A CYS 90.A SG LEU 86.A O no hydrogen 3.370 N/A GLN 91.A N GLN 87.A O no hydrogen 3.032 N/A LEU 92.A N ALA 89.A O no hydrogen 2.973 N/A THR 93.A N CYS 90.A O no hydrogen 3.221 N/A THR 93.A OG1 ALA 89.A O no hydrogen 3.530 N/A THR 93.A OG1 CYS 90.A O no hydrogen 2.953 N/A SER 97.A N PRO 94.A O no hydrogen 2.958 N/A SER 100.A N PHE 104.A O no hydrogen 2.830 N/A SER 100.A OG ASP 165.A OD1 no hydrogen 3.205 N/A SER 100.A OG ASP 165.A OD2 no hydrogen 3.158 N/A LYS 101.A N ASP 165.A OD1 no hydrogen 2.770 N/A TYR 102.A N SER 100.A OG no hydrogen 2.851 N/A GLY 105.A N GLU 108.A OE1 no hydrogen 3.130 N/A GLU 108.A N GLU 108.A OE1 no hydrogen 2.690 N/A VAL 109.A N GLY 105.A O no hydrogen 3.034 N/A ARG 110.A N ALA 106.A O no hydrogen 2.777 N/A ARG 110.A NH2 THR 93.A O no hydrogen 3.120 N/A SER 111.A N LYS 107.A O no hydrogen 2.972 N/A SER 111.A OG LYS 107.A O no hydrogen 3.412 N/A SER 111.A OG GLU 108.A O no hydrogen 3.109 N/A LEU 112.A N VAL 109.A O no hydrogen 3.209 N/A SER 113.A N GLU 108.A O no hydrogen 3.077 N/A VAL 117.A N SER 113.A O no hydrogen 3.094 N/A ASN 118.A N GLY 114.A O no hydrogen 2.900 N/A ASN 118.A ND2 GLY 114.A O no hydrogen 3.683 N/A HIS 119.A N ARG 115.A O no hydrogen 2.906 N/A ILE 120.A N ALA 116.A O no hydrogen 2.883 N/A LYS 121.A N VAL 117.A O no hydrogen 2.892 N/A SER 122.A N ASN 118.A O no hydrogen 3.121 N/A SER 122.A OG HIS 119.A O no hydrogen 3.148 N/A VAL 123.A N HIS 119.A O no hydrogen 3.016 N/A TRP 124.A N ILE 120.A O no hydrogen 2.896 N/A TRP 124.A NE1 GLU 249.A OE1 no hydrogen 3.178 N/A LYS 125.A N LYS 121.A O no hydrogen 3.073 N/A LYS 125.A NZ GLU 129.A OE2 no hydrogen 3.481 N/A ASP 126.A N SER 122.A O no hydrogen 2.990 N/A LEU 127.A N VAL 123.A O no hydrogen 3.136 N/A LEU 127.A N TRP 124.A O no hydrogen 3.039 N/A LEU 128.A N TRP 124.A O no hydrogen 3.052 N/A GLU 129.A N LYS 125.A O no hydrogen 2.986 N/A ASP 130.A N ASP 126.A O no hydrogen 3.008 N/A GLN 132.A N ASP 130.A OD2 no hydrogen 2.863 N/A THR 133.A N ASP 130.A OD2 no hydrogen 3.007 N/A THR 133.A OG1 ASP 130.A OD1 no hydrogen 2.360 N/A THR 133.A OG1 ASP 130.A OD2 no hydrogen 3.265 N/A ILE 135.A N ARG 260.A O no hydrogen 2.840 N/A THR 137.A N PRO 266.A O no hydrogen 3.090 N/A THR 137.A OG1 PRO 266.A O no hydrogen 3.046 N/A THR 138.A N TYR 163.A O no hydrogen 2.858 N/A ILE 139.A N PHE 268.A O no hydrogen 2.885 N/A MET 140.A N ILE 161.A O no hydrogen 2.856 N/A LYS 142.A N ARG 159.A O no hydrogen 2.911 N/A LYS 142.A NZ GLU 144.A OE2 no hydrogen 2.963 N/A ASN 143.A ND2 THR 41.A O no hydrogen 2.865 N/A GLU 144.A N THR 41.A OG1 no hydrogen 3.022 N/A PHE 146.A N TYR 39.A O no hydrogen 2.948 N/A CYS 147.A SG VAL 148.A O no hydrogen 3.616 N/A VAL 148.A N LYS 37.A O no hydrogen 2.941 N/A ASP 149.A N GLY 154.A O no hydrogen 3.065 N/A LYS 152.A N ASP 149.A O no hydrogen 3.169 N/A GLY 153.A N PRO 150.A O no hydrogen 3.357 N/A GLY 154.A N ASP 149.A O no hydrogen 2.866 N/A LYS 156.A N TYR 39.A OH no hydrogen 2.961 N/A ALA 158.A N SER 45.A OG no hydrogen 2.889 N/A ARG 159.A NE GLU 144.A OE1 no hydrogen 3.210 N/A ILE 161.A N MET 140.A O no hydrogen 2.708 N/A VAL 162.A N SER 283.A OG no hydrogen 2.986 N/A TYR 163.A N THR 138.A O no hydrogen 3.129 N/A GLY 167.A N ASP 165.A OD2 no hydrogen 3.015 N/A ARG 169.A N ASP 165.A O no hydrogen 3.141 N/A ARG 169.A NH1 SER 97.A OG no hydrogen 2.750 N/A ARG 169.A NH1 ALA 98.A O no hydrogen 2.993 N/A ARG 169.A NH2 PRO 164.A O no hydrogen 3.091 N/A VAL 170.A N LEU 166.A O no hydrogen 2.934 N/A CYS 171.A N GLY 167.A O no hydrogen 3.183 N/A CYS 171.A SG ILE 120.A O no hydrogen 3.938 N/A CYS 171.A SG GLY 167.A O no hydrogen 3.360 N/A GLU 172.A N VAL 168.A O no hydrogen 2.847 N/A LYS 173.A N ARG 169.A O no hydrogen 3.402 N/A LYS 173.A N VAL 170.A O no hydrogen 3.155 N/A MET 174.A N VAL 170.A O no hydrogen 3.302 N/A ALA 175.A N CYS 171.A O no hydrogen 3.037 N/A LEU 176.A N GLU 172.A O no hydrogen 2.717 N/A TYR 177.A N LYS 173.A O no hydrogen 2.897 N/A THR 180.A N LEU 176.A O no hydrogen 2.904 N/A THR 180.A OG1 TYR 177.A O no hydrogen 2.631 N/A GLN 181.A N TYR 177.A O no hydrogen 3.175 N/A GLN 181.A N ASP 178.A O no hydrogen 3.123 N/A LYS 182.A N ILE 179.A O no hydrogen 2.853 N/A LYS 182.A NZ SER 80.A O no hydrogen 3.032 N/A LYS 182.A NZ ASP 178.A OD2 no hydrogen 3.199 N/A LEU 183.A N ILE 179.A O no hydrogen 2.763 N/A ALA 186.A N LYS 182.A O no hydrogen 3.163 N/A ALA 186.A N LEU 183.A O no hydrogen 2.678 N/A VAL 187.A N LEU 183.A O no hydrogen 2.816 N/A MET 188.A N PRO 184.A O no hydrogen 2.894 N/A GLY 189.A N GLN 185.A O no hydrogen 2.869 N/A SER 191.A N MET 188.A O no hydrogen 3.021 N/A SER 191.A OG MET 314.A O no hydrogen 3.305 N/A TYR 192.A N GLY 189.A O no hydrogen 3.071 N/A GLY 193.A N VAL 316.A O no hydrogen 2.693 N/A TYR 196.A OH ALA 190.A O no hydrogen 2.620 N/A SER 197.A N GLN 200.A OE1 no hydrogen 2.885 N/A GLN 200.A N SER 197.A OG no hydrogen 3.310 N/A ARG 201.A N SER 197.A O no hydrogen 2.734 N/A VAL 202.A N PRO 198.A O no hydrogen 2.947 N/A GLU 203.A N ALA 199.A O no hydrogen 3.034 N/A TYR 204.A N GLN 200.A O no hydrogen 2.899 N/A TYR 204.A OH MET 314.A O no hydrogen 2.550 N/A LEU 205.A N ARG 201.A O no hydrogen 3.076 N/A LEU 206.A N VAL 202.A O no hydrogen 2.921 N/A LYS 207.A N GLU 203.A O no hydrogen 2.917 N/A ALA 208.A N TYR 204.A O no hydrogen 2.812 N/A TRP 209.A N LEU 205.A O no hydrogen 2.846 N/A ALA 210.A N LEU 206.A O no hydrogen 2.927 N/A GLU 211.A N LYS 207.A O no hydrogen 3.096 N/A GLU 211.A N ALA 208.A O no hydrogen 3.291 N/A LYS 212.A N TRP 209.A O no hydrogen 3.338 N/A LYS 212.A NZ ALA 311.A O no hydrogen 2.880 N/A LYS 212.A NZ THR 313.A OG1 no hydrogen 2.971 N/A LYS 213.A N GLU 326.A OE1 no hydrogen 2.885 N/A ASP 214.A N GLU 326.A OE2 no hydrogen 3.174 N/A MET 216.A N SER 325.A O no hydrogen 2.912 N/A GLY 217.A N GLU 358.A O no hydrogen 2.857 N/A PHE 218.A N VAL 323.A O no hydrogen 2.902 N/A SER 219.A OG THR 365.A O no hydrogen 3.236 N/A TYR 220.A N LEU 321.A O no hydrogen 2.975 N/A TYR 220.A OH ALA 349.A O no hydrogen 2.800 N/A ARG 223.A N PRO 350.A O no hydrogen 3.010 N/A SER 227.A OG VAL 53.A O no hydrogen 2.788 N/A THR 228.A N PHE 225.A O no hydrogen 2.781 N/A THR 228.A OG1 PHE 225.A O no hydrogen 2.758 N/A THR 228.A OG1 SER 348.A O no hydrogen 3.062 N/A VAL 229.A N ASP 226.A O no hydrogen 3.205 N/A THR 230.A N ASP 233.A OD2 no hydrogen 2.942 N/A THR 230.A OG1 GLN 59.A OE1 no hydrogen 2.766 N/A ASP 233.A N THR 230.A OG1 no hydrogen 3.046 N/A ILE 234.A N THR 230.A O no hydrogen 2.894 N/A ARG 235.A N GLU 231.A O no hydrogen 2.811 N/A ARG 235.A NE GLU 259.A OE1 no hydrogen 3.306 N/A ARG 235.A NE GLU 259.A OE2 no hydrogen 3.159 N/A ARG 235.A NH2 GLU 259.A OE2 no hydrogen 3.248 N/A THR 236.A N ARG 232.A O no hydrogen 2.878 N/A THR 236.A OG1 ARG 232.A O no hydrogen 2.770 N/A GLU 237.A N ASP 233.A O no hydrogen 2.719 N/A GLU 238.A N ILE 234.A O no hydrogen 2.970 N/A SER 239.A N ARG 235.A O no hydrogen 2.959 N/A ILE 240.A N THR 236.A O no hydrogen 2.975 N/A ILE 240.A N GLU 237.A O no hydrogen 2.719 N/A TYR 241.A N GLU 237.A O no hydrogen 2.921 N/A GLN 242.A N GLU 238.A O no hydrogen 2.731 N/A GLN 242.A NE2 GLU 238.A OE2 no hydrogen 3.096 N/A GLN 242.A NE2 ARG 251.A O no hydrogen 3.195 N/A ALA 243.A N ILE 240.A O no hydrogen 2.933 N/A CYS 244.A N TYR 241.A O no hydrogen 3.001 N/A CYS 244.A SG ALA 76.A O no hydrogen 3.805 N/A CYS 244.A SG TYR 241.A O no hydrogen 3.275 N/A SER 245.A N VAL 79.A O no hydrogen 2.863 N/A ARG 251.A N PRO 247.A O no hydrogen 3.260 N/A ARG 251.A NH1 CYS 244.A O no hydrogen 2.866 N/A ARG 251.A NH2 GLN 242.A O no hydrogen 2.802 N/A ARG 251.A NH2 GLN 242.A OE1 no hydrogen 2.990 N/A ARG 251.A NH2 CYS 244.A O no hydrogen 3.523 N/A THR 252.A N GLU 248.A O no hydrogen 3.034 N/A THR 252.A OG1 GLU 248.A O no hydrogen 2.957 N/A ALA 253.A N GLU 249.A O no hydrogen 2.946 N/A ILE 254.A N ALA 250.A O no hydrogen 2.703 N/A HIS 255.A N ARG 251.A O no hydrogen 2.986 N/A HIS 255.A ND1 GLU 238.A OE2 no hydrogen 2.789 N/A SER 256.A N THR 252.A O no hydrogen 3.044 N/A SER 256.A OG LEU 127.A O no hydrogen 2.857 N/A SER 256.A OG ASP 130.A O no hydrogen 2.916 N/A LEU 257.A N ALA 253.A O no hydrogen 2.908 N/A THR 258.A N ILE 254.A O no hydrogen 2.799 N/A THR 258.A OG1 GLU 238.A OE1 no hydrogen 3.447 N/A THR 258.A OG1 ILE 254.A O no hydrogen 2.922 N/A GLU 259.A N HIS 255.A O no hydrogen 2.907 N/A ARG 260.A N SER 256.A O no hydrogen 2.843 N/A ARG 260.A NE THR 133.A O no hydrogen 2.475 N/A ARG 260.A NH1 ASP 126.A OD2 no hydrogen 2.948 N/A ARG 260.A NH1 THR 133.A O no hydrogen 3.495 N/A ARG 260.A NH2 ASP 126.A O no hydrogen 2.996 N/A ARG 260.A NH2 ASP 126.A OD2 no hydrogen 3.094 N/A ARG 260.A NH2 ASP 130.A O no hydrogen 2.822 N/A LEU 261.A N LEU 257.A O no hydrogen 2.759 N/A TYR 262.A N LEU 257.A O no hydrogen 2.898 N/A TYR 262.A OH GLU 172.A OE1 no hydrogen 2.608 N/A VAL 263.A N THR 258.A O no hydrogen 2.995 N/A GLY 264.A N LEU 261.A O no hydrogen 3.286 N/A GLY 265.A N ARG 278.A O no hydrogen 3.051 N/A MET 267.A N GLY 276.A O no hydrogen 2.853 N/A PHE 268.A N THR 137.A O no hydrogen 2.825 N/A ASN 269.A N GLN 273.A O no hydrogen 3.129 N/A ASN 269.A ND2 LEU 11.A O no hydrogen 2.896 N/A ASN 269.A ND2 GLN 273.A OE1 no hydrogen 2.793 N/A SER 270.A N THR 13.A OG1 no hydrogen 3.265 N/A SER 270.A OG THR 13.A OG1 no hydrogen 2.837 N/A SER 270.A OG PRO 14.A O no hydrogen 2.933 N/A GLY 272.A N ASN 269.A O no hydrogen 3.420 N/A GLN 273.A N ASN 269.A OD1 no hydrogen 2.999 N/A CYS 275.A N MET 267.A O no hydrogen 2.736 N/A CYS 275.A SG ALA 10.A O no hydrogen 3.649 N/A CYS 275.A SG LEU 11.A O no hydrogen 4.006 N/A GLY 276.A N MET 267.A O no hydrogen 3.310 N/A TYR 277.A N SER 6.A O no hydrogen 2.870 N/A ARG 278.A N GLY 265.A O no hydrogen 2.884 N/A ARG 278.A NH1 LEU 261.A O no hydrogen 2.654 N/A ARG 278.A NH2 LEU 261.A O no hydrogen 3.319 N/A ARG 278.A NH2 TYR 262.A O no hydrogen 2.970 N/A ARG 278.A NH2 CYS 280.A O no hydrogen 2.724 N/A ARG 279.A N SER 4.A O no hydrogen 2.778 N/A ARG 279.A NH1.B GLU 231.A OE2 no hydrogen 3.348 N/A CYS 280.A SG SER 4.A O no hydrogen 3.599 N/A CYS 280.A SG ARG 281.A O no hydrogen 3.668 N/A ARG 281.A NE ASN 292.A OD1 no hydrogen 2.628 N/A ARG 281.A NH1 GLU 237.A OE1 no hydrogen 2.647 N/A ARG 281.A NH1 ASN 292.A OD1 no hydrogen 2.945 N/A ARG 281.A NH2 GLU 237.A OE1 no hydrogen 3.406 N/A ARG 281.A NH2 GLU 237.A OE2 no hydrogen 2.822 N/A SER 283.A OG LEU 160.A O no hydrogen 3.178 N/A GLY 284.A N VAL 162.A O no hydrogen 2.847 N/A VAL 285.A N THR 288.A OG1 no hydrogen 3.324 N/A LEU 286.A N GLU 172.A OE1 no hydrogen 2.752 N/A THR 288.A N VAL 285.A O no hydrogen 3.227 N/A THR 288.A OG1 ALA 282.A O no hydrogen 2.742 N/A THR 288.A OG1 SER 283.A O no hydrogen 3.348 N/A THR 288.A OG1 VAL 285.A O no hydrogen 2.912 N/A GLY 291.A N THR 287.A O no hydrogen 2.604 N/A ASN 292.A N THR 288.A O no hydrogen 2.836 N/A ASN 292.A ND2 ASP 226.A OD2 no hydrogen 2.883 N/A THR 293.A N SER 289.A O no hydrogen 3.072 N/A THR 293.A OG1 SER 289.A O no hydrogen 2.512 N/A ILE 294.A N MET 290.A O no hydrogen 2.858 N/A THR 295.A N GLY 291.A O no hydrogen 2.834 N/A THR 295.A OG1 GLU 237.A OE1 no hydrogen 2.530 N/A THR 295.A OG1 GLY 291.A O no hydrogen 3.444 N/A CYS 296.A N ASN 292.A O no hydrogen 2.899 N/A CYS 296.A SG GLY 318.A O no hydrogen 3.760 N/A TYR 297.A N THR 293.A O no hydrogen 3.013 N/A VAL 298.A N ILE 294.A O no hydrogen 2.901 N/A LYS 299.A N THR 295.A O no hydrogen 2.980 N/A LYS 299.A NZ ASP 233.A OD2 no hydrogen 3.085 N/A LYS 299.A NZ TYR 347.A O no hydrogen 2.980 N/A LYS 299.A NZ SER 348.A O no hydrogen 3.243 N/A ALA 300.A N CYS 296.A O no hydrogen 2.831 N/A LEU 301.A N TYR 297.A O no hydrogen 3.032 N/A ALA 302.A N VAL 298.A O no hydrogen 3.030 N/A ALA 303.A N LYS 299.A O no hydrogen 2.821 N/A CYS 304.A N ALA 300.A O no hydrogen 2.858 N/A CYS 304.A SG ALA 300.A O no hydrogen 3.357 N/A LYS 305.A N LEU 301.A O no hydrogen 3.141 N/A ALA 306.A N ALA 302.A O no hydrogen 2.725 N/A ALA 307.A N ALA 303.A O no hydrogen 2.935 N/A GLY 308.A N LYS 305.A O no hydrogen 3.142 N/A ILE 309.A N CYS 304.A O no hydrogen 2.875 N/A THR 313.A N ILE 324.A O no hydrogen 2.756 N/A LEU 315.A N ILE 322.A O no hydrogen 2.971 N/A VAL 316.A N SER 191.A O no hydrogen 2.911 N/A CYS 317.A N ASP 320.A O no hydrogen 3.034 N/A GLY 318.A N THR 293.A OG1 no hydrogen 2.883 N/A ASP 320.A N CYS 317.A O no hydrogen 2.952 N/A ILE 322.A N LEU 315.A O no hydrogen 3.056 N/A VAL 323.A N PHE 218.A O no hydrogen 2.939 N/A ILE 324.A N THR 313.A O no hydrogen 2.876 N/A SER 325.A N MET 216.A O no hydrogen 2.818 N/A GLU 326.A N VAL 310.A O no hydrogen 2.838 N/A SER 327.A N ASP 214.A O no hydrogen 2.739 N/A SER 327.A OG ASP 333.A OD1 no hydrogen 3.515 N/A SER 327.A OG ASP 333.A OD2 no hydrogen 2.427 N/A GLN 328.A N ASP 333.A OD1 no hydrogen 2.805 N/A GLY 329.A N SER 327.A OG no hydrogen 3.142 N/A ASP 333.A N GLY 329.A O no hydrogen 2.840 N/A GLU 334.A N THR 330.A O no hydrogen 2.953 N/A ARG 335.A N GLU 331.A O no hydrogen 3.214 N/A ASN 336.A N GLU 332.A O no hydrogen 2.710 N/A ASN 336.A ND2 GLU 332.A OE1 no hydrogen 3.138 N/A LEU 337.A N ASP 333.A O no hydrogen 3.028 N/A ARG 338.A N GLU 334.A O no hydrogen 3.180 N/A ALA 339.A N ARG 335.A O no hydrogen 2.966 N/A PHE 340.A N ASN 336.A O no hydrogen 2.758 N/A THR 341.A N LEU 337.A O no hydrogen 3.009 N/A THR 341.A OG1 LEU 337.A O no hydrogen 2.819 N/A GLU 342.A N ARG 338.A O no hydrogen 2.959 N/A ALA 343.A N ALA 339.A O no hydrogen 2.859 N/A MET 344.A N PHE 340.A O no hydrogen 2.873 N/A THR 345.A N THR 341.A O no hydrogen 2.923 N/A THR 345.A OG1 THR 341.A O no hydrogen 2.513 N/A ARG 346.A N GLU 342.A O no hydrogen 2.978 N/A TYR 347.A N ALA 343.A O no hydrogen 2.765 N/A TYR 347.A OH ASP 62.A OD1 no hydrogen 2.989 N/A TYR 347.A OH ASP 62.A OD2 no hydrogen 3.319 N/A SER 348.A N THR 345.A O no hydrogen 3.143 N/A SER 348.A OG THR 228.A O no hydrogen 2.902 N/A ALA 349.A N MET 344.A O no hydrogen 2.782 N/A GLY 352.A N ASP 221.A O no hydrogen 2.797 N/A ASP 353.A N ASP 221.A OD2 no hydrogen 3.263 N/A ARG 356.A NE GLU 358.A OE1 no hydrogen 3.349 N/A GLU 358.A N GLY 217.A O no hydrogen 2.957 N/A TYR 359.A OH ASP 333.A OD2 no hydrogen 2.543 N/A GLU 362.A N ASP 360.A OD1 no hydrogen 2.901 N/A LEU 363.A N ASP 360.A O no hydrogen 3.056 N/A ILE 364.A N LEU 361.A O no hydrogen 3.448 N/A SER 366.A N SER 369.A O no hydrogen 2.890 N/A SER 369.A N SER 366.A O no hydrogen 3.063 N/A SER 369.A OG SER 366.A O no hydrogen 3.107 N/A ASN 370.A N THR 386.A O no hydrogen 2.836 N/A ASN 370.A ND2 VAL 371.A O no hydrogen 2.920 N/A SER 372.A N TYR 384.A O no hydrogen 2.951 N/A SER 372.A OG GLU 362.A OE1 no hydrogen 2.554 N/A ALA 374.A N ARG 382.A O no hydrogen 2.874 N/A LEU 375.A N THR 477.A O no hydrogen 3.360 N/A GLY 376.A N ARG 380.A O no hydrogen 2.842 N/A ARG 380.A NH1 ASP 471.A OD2 no hydrogen 3.150 N/A ARG 380.A NH2 ASP 471.A OD1 no hydrogen 2.817 N/A ARG 381.A NH1 GLY 379.A O no hydrogen 2.995 N/A ARG 382.A N ALA 374.A O no hydrogen 2.771 N/A ARG 382.A NH1 ASP 471.A O no hydrogen 3.105 N/A ARG 382.A NH1 SER 474.A OG no hydrogen 3.056 N/A ARG 382.A NH2 SER 474.A OG no hydrogen 2.909 N/A TYR 384.A N SER 372.A O no hydrogen 3.073 N/A THR 386.A N ASN 370.A O no hydrogen 2.813 N/A THR 386.A OG1 GLU 482.A OE2 no hydrogen 2.667 N/A ARG 387.A N THR 386.A OG1 no hydrogen 2.608 N/A ARG 387.A NE ASP 388.A O no hydrogen 2.985 N/A THR 390.A N ASP 388.A OD2 no hydrogen 2.856 N/A THR 390.A OG1 ASP 388.A OD2 no hydrogen 2.581 N/A LEU 393.A N PRO 389.A O no hydrogen 2.856 N/A ALA 394.A N THR 390.A O no hydrogen 2.968 N/A ARG 395.A N THR 391.A O no hydrogen 2.805 N/A ARG 395.A NE VAL 145.A O no hydrogen 2.861 N/A ARG 395.A NH2 VAL 145.A O no hydrogen 3.075 N/A ALA 396.A N PRO 392.A O no hydrogen 2.850 N/A ALA 397.A N ALA 394.A O no hydrogen 2.939 N/A TRP 398.A N ARG 395.A O no hydrogen 3.438 N/A TRP 398.A NE1 GLU 19.A OE2 no hydrogen 2.990 N/A THR 400.A N HIS 403.A O no hydrogen 2.987 N/A THR 400.A OG1 GLU 19.A OE1 no hydrogen 2.966 N/A ARG 402.A N THR 400.A OG1 no hydrogen 3.284 N/A HIS 403.A N THR 400.A OG1 no hydrogen 2.996 N/A ILE 406.A N SER 404.A OG no hydrogen 3.390 N/A TRP 409.A N PRO 405.A O no hydrogen 3.004 N/A TRP 409.A NE1 ALA 396.A O no hydrogen 2.844 N/A LEU 410.A N ILE 406.A O no hydrogen 2.990 N/A GLY 411.A N ASN 407.A O no hydrogen 2.862 N/A ASN 412.A N SER 408.A O no hydrogen 3.177 N/A ILE 413.A N TRP 409.A O no hydrogen 2.949 N/A ILE 414.A N LEU 410.A O no hydrogen 2.901 N/A GLN 415.A N GLY 411.A O no hydrogen 2.875 N/A TYR 416.A N ASN 412.A O no hydrogen 2.837 N/A THR 419.A N TYR 416.A O no hydrogen 2.837 N/A THR 419.A OG1 TYR 416.A O no hydrogen 2.857 N/A TRP 421.A NE1 THR 386.A OG1 no hydrogen 3.304 N/A VAL 422.A N THR 419.A OG1 no hydrogen 3.119 N/A ARG 423.A N THR 419.A O no hydrogen 3.104 N/A ARG 423.A NH1 MET 475.A O no hydrogen 2.971 N/A ARG 423.A NH1 TYR 478.A OH no hydrogen 3.030 N/A MET 424.A N ILE 420.A O no hydrogen 2.936 N/A VAL 425.A N TRP 421.A O no hydrogen 2.938 N/A LEU 426.A N TRP 421.A O no hydrogen 3.173 N/A MET 427.A N VAL 422.A O no hydrogen 2.758 N/A THR 428.A OG1 MET 424.A O no hydrogen 2.680 N/A HIS 429.A N VAL 425.A O no hydrogen 2.956 N/A HIS 429.A NE2 LEU 27.A O no hydrogen 2.846 N/A PHE 430.A N LEU 426.A O no hydrogen 2.776 N/A PHE 431.A N MET 427.A O no hydrogen 2.996 N/A SER 432.A N THR 428.A O no hydrogen 3.126 N/A ILE 433.A N HIS 429.A O no hydrogen 2.989 N/A LEU 434.A N PHE 430.A O no hydrogen 3.113 N/A MET 435.A N PHE 431.A O no hydrogen 2.995 N/A VAL 436.A N SER 432.A O no hydrogen 3.201 N/A GLN 437.A N ILE 433.A O no hydrogen 3.027 N/A ASP 438.A N MET 435.A O no hydrogen 2.883 N/A THR 439.A N LEU 434.A O no hydrogen 3.031 N/A THR 439.A OG1 GLN 437.A OE1 no hydrogen 3.157 N/A GLN 442.A N THR 439.A O no hydrogen 3.192 N/A ASN 443.A ND2 SER 454.A OG no hydrogen 3.108 N/A LEU 444.A N VAL 455.A O no hydrogen 2.836 N/A ASN 445.A N ASN 407.A OD1 no hydrogen 3.058 N/A PHE 446.A N TYR 453.A O no hydrogen 2.828 N/A MET 448.A N SER 451.A O no hydrogen 2.930 N/A SER 451.A N MET 448.A O no hydrogen 3.053 N/A TYR 453.A N PHE 446.A O no hydrogen 2.964 N/A VAL 455.A N LEU 444.A O no hydrogen 2.724 N/A ASN 456.A ND2 ASP 441.A O no hydrogen 2.903 N/A ASN 456.A ND2 ASN 443.A OD1 no hydrogen 3.000 N/A LEU 458.A N ASN 456.A OD1 no hydrogen 2.978 N/A ASP 459.A N ASN 456.A O no hydrogen 2.741 N/A LEU 460.A N PRO 457.A O no hydrogen 3.242 N/A ALA 462.A N ASP 459.A O no hydrogen 2.908 N/A ILE 463.A N ASP 459.A O no hydrogen 3.179 N/A ILE 464.A N LEU 460.A O no hydrogen 2.868 N/A GLU 465.A N PRO 461.A O no hydrogen 2.972 N/A ARG 466.A N ALA 462.A O no hydrogen 2.817 N/A ARG 466.A NE LEU 546.A O no hydrogen 2.999 N/A ARG 466.A NH1 LEU 546.A O no hydrogen 3.260 N/A LEU 467.A N ILE 463.A O no hydrogen 2.856 N/A HIS 468.A N ILE 464.A O no hydrogen 2.748 N/A HIS 468.A NE2 ILE 414.A O no hydrogen 2.816 N/A GLY 469.A N GLU 465.A O no hydrogen 2.938 N/A ALA 472.A N GLY 469.A O no hydrogen 3.060 N/A PHE 473.A N LEU 470.A O no hydrogen 3.198 N/A SER 474.A N ASP 471.A O no hydrogen 2.925 N/A SER 474.A OG ASP 471.A O no hydrogen 3.534 N/A HIS 476.A N LEU 375.A O no hydrogen 2.715 N/A HIS 476.A ND1 THR 477.A OG1 no hydrogen 3.000 N/A THR 477.A N LEU 375.A O no hydrogen 3.342 N/A THR 477.A OG1 HIS 476.A ND1 no hydrogen 3.000 N/A TYR 478.A OH PRO 418.A O no hydrogen 2.658 N/A SER 479.A OG GLU 362.A OE1 no hydrogen 2.684 N/A GLU 482.A N SER 479.A OG no hydrogen 3.034 N/A LEU 483.A N SER 479.A O no hydrogen 2.750 N/A THR 484.A N HIS 480.A O no hydrogen 2.967 N/A THR 484.A OG1 HIS 480.A O no hydrogen 2.732 N/A ARG 485.A N HIS 481.A O no hydrogen 3.088 N/A ARG 485.A NH1 ASN 370.A OD1 no hydrogen 2.910 N/A ARG 485.A NH1 GLU 482.A OE1 no hydrogen 3.039 N/A VAL 486.A N GLU 482.A O no hydrogen 2.970 N/A ALA 487.A N LEU 483.A O no hydrogen 2.965 N/A SER 488.A N THR 484.A O no hydrogen 2.923 N/A ALA 489.A N ARG 485.A O no hydrogen 2.857 N/A LEU 490.A N VAL 486.A O no hydrogen 2.945 N/A ARG 491.A N ALA 487.A O no hydrogen 3.059 N/A LYS 492.A N SER 488.A O no hydrogen 2.938 N/A LYS 492.A NZ THR 390.A OG1 no hydrogen 2.986 N/A LEU 493.A N ALA 489.A O no hydrogen 3.087 N/A LEU 493.A N LEU 490.A O no hydrogen 3.220 N/A GLY 494.A N ARG 491.A O no hydrogen 3.308 N/A ALA 495.A N LEU 490.A O no hydrogen 2.933 N/A TRP 501.A N PRO 497.A O no hydrogen 3.288 N/A TRP 501.A NE1 PRO 496.A O no hydrogen 3.051 N/A LYS 502.A N LEU 498.A O no hydrogen 3.045 N/A ARG 504.A N VAL 500.A O no hydrogen 2.997 N/A ARG 504.A NH2 SER 30.A O no hydrogen 2.799 N/A ALA 505.A N TRP 501.A O no hydrogen 2.650 N/A ARG 506.A N LYS 502.A O no hydrogen 3.033 N/A ALA 507.A N SER 503.A O no hydrogen 3.257 N/A VAL 508.A N ARG 504.A O no hydrogen 3.007 N/A ARG 509.A N ALA 505.A O no hydrogen 2.733 N/A ALA 510.A N ARG 506.A O no hydrogen 3.089 N/A SER 511.A N ALA 507.A O no hydrogen 3.095 N/A SER 511.A OG ALA 507.A O no hydrogen 3.425 N/A LEU 512.A N VAL 508.A O no hydrogen 2.944 N/A ILE 513.A N ARG 509.A O no hydrogen 2.857 N/A SER 514.A N ALA 510.A O no hydrogen 2.977 N/A SER 514.A OG SER 511.A O no hydrogen 3.100 N/A ARG 515.A N LEU 512.A O no hydrogen 3.173 N/A GLY 516.A N ILE 513.A O no hydrogen 3.144 N/A ALA 520.A N GLY 516.A O no hydrogen 3.379 N/A VAL 521.A N GLY 517.A O no hydrogen 3.241 N/A CYS 522.A N LYS 518.A O no hydrogen 2.936 N/A CYS 522.A SG PRO 457.A O no hydrogen 3.982 N/A CYS 522.A SG LEU 458.A O no hydrogen 3.770 N/A CYS 522.A SG LYS 518.A O no hydrogen 3.681 N/A GLY 523.A N ALA 519.A O no hydrogen 2.950 N/A ARG 524.A N ALA 520.A O no hydrogen 3.041 N/A TYR 525.A N VAL 521.A O no hydrogen 2.873 N/A TYR 525.A OH THR 538.A O no hydrogen 2.618 N/A LEU 526.A N CYS 522.A O no hydrogen 2.895 N/A ASN 528.A ND2 LEU 535.A O no hydrogen 3.065 N/A ALA 530.A N PHE 527.A O no hydrogen 2.947 N/A LYS 534.A NZ VAL 531.A O no hydrogen 3.071 N/A LEU 535.A N ASN 528.A OD1 no hydrogen 3.201 N/A THR 538.A N TYR 525.A OH no hydrogen 3.029 N/A THR 538.A OG1 PRO 539.A O no hydrogen 3.269 N/A LEU 540.A N GLU 465.A OE1 no hydrogen 3.431 N/A LEU 540.A N GLU 465.A OE2 no hydrogen 2.852 N/A ALA 543.A N LEU 540.A O no hydrogen 3.068 N/A LEU 546.A N ALA 543.A O no hydrogen 2.982 N/A SER 549.A OG ASP 547.A OD1 no hydrogen 2.589 N/A SER 549.A OG ASP 547.A OD2 no hydrogen 3.268 N/A TRP 551.A N LEU 548.A O no hydrogen 2.682 N/A