Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ocl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N GLU 54.A OE1 no hydrogen 3.440 N/A SER 2.A OG CYS 59.A O no hydrogen 3.491 N/A ALA 5.A N SER 2.A O no hydrogen 3.162 N/A HIS 6.A N SER 2.A O no hydrogen 3.156 N/A ARG 7.A N GLU 3.A O no hydrogen 2.832 N/A ARG 7.A NE GLU 3.A OE1 no hydrogen 3.169 N/A PHE 8.A N ILE 4.A O no hydrogen 2.872 N/A ASN 9.A N ALA 5.A O no hydrogen 2.735 N/A ASP 10.A N ARG 7.A O no hydrogen 3.148 N/A VAL 11.A N ARG 7.A O no hydrogen 3.058 N/A GLY 12.A N PHE 8.A O no hydrogen 3.058 N/A PHE 16.A N GLY 12.A O no hydrogen 3.069 N/A ILE 17.A N GLU 13.A O no hydrogen 2.934 N/A LEU 19.A N HIS 15.A O no hydrogen 2.850 N/A VAL 20.A N PHE 16.A O no hydrogen 3.225 N/A LEU 21.A N ILE 17.A O no hydrogen 2.761 N/A ILE 22.A N GLY 18.A O no hydrogen 2.820 N/A THR 23.A N LEU 19.A O no hydrogen 2.882 N/A THR 23.A OG1 LEU 19.A O no hydrogen 2.817 N/A PHE 24.A N VAL 20.A O no hydrogen 3.057 N/A SER 25.A N LEU 21.A O no hydrogen 2.877 N/A SER 25.A OG LEU 21.A O no hydrogen 2.846 N/A GLN 26.A N ILE 22.A O no hydrogen 2.805 N/A GLN 26.A N THR 23.A O no hydrogen 3.137 N/A TYR 27.A N THR 23.A O no hydrogen 3.017 N/A LEU 28.A N PHE 24.A O no hydrogen 3.032 N/A GLN 29.A NE2 ASP 104.A O no hydrogen 3.051 N/A GLN 29.A NE2 ARG 141.A O no hydrogen 2.499 N/A LYS 30.A NZ ASP 108.A O no hydrogen 3.257 N/A CYS 31.A N LEU 28.A O no hydrogen 3.526 N/A GLU 34.A N GLU 34.A OE2.B no hydrogen 2.528 N/A HIS 36.A N PRO 32.A O no hydrogen 3.279 N/A HIS 36.A NE2 LEU 28.A O no hydrogen 2.812 N/A ALA 37.A N TYR 33.A O no hydrogen 3.050 N/A LYS 38.A N GLU 34.A O no hydrogen 3.497 N/A LYS 38.A NZ GLU 35.A OE1 no hydrogen 3.049 N/A LEU 39.A N GLU 35.A O no hydrogen 3.312 N/A VAL 40.A N HIS 36.A O no hydrogen 2.976 N/A LYS 41.A N ALA 37.A O no hydrogen 2.899 N/A GLU 42.A N LYS 38.A O no hydrogen 2.924 N/A VAL 43.A N LEU 39.A O no hydrogen 2.991 N/A THR 44.A N VAL 40.A O no hydrogen 2.762 N/A THR 44.A OG1 VAL 40.A O no hydrogen 2.616 N/A ASP 45.A N LYS 41.A O no hydrogen 2.768 N/A ALA 47.A N VAL 43.A O no hydrogen 3.275 N/A LYS 48.A N THR 44.A O no hydrogen 3.105 N/A ALA 49.A N ASP 45.A O no hydrogen 3.006 N/A CYS 50.A N LEU 46.A O no hydrogen 2.768 N/A CYS 50.A SG LEU 46.A O no hydrogen 3.387 N/A CYS 50.A SG ALA 57.A O no hydrogen 3.421 N/A ASP 53.A N ALA 49.A O no hydrogen 3.282 N/A ALA 56.A N ASP 53.A O no hydrogen 3.343 N/A CYS 59.A SG ASP 53.A O no hydrogen 3.816 N/A CYS 59.A SG ALA 57.A O no hydrogen 3.005 N/A LYS 61.A N ASN 58.A O no hydrogen 3.044 N/A LYS 61.A NZ SER 62.A OG no hydrogen 3.036 N/A ASP 65.A N SER 62.A O no hydrogen 3.183 N/A ILE 66.A N SER 62.A O no hydrogen 3.284 N/A PHE 67.A N LEU 63.A O no hydrogen 3.080 N/A GLY 68.A N HIS 64.A O no hydrogen 3.131 N/A ASP 69.A N ASP 65.A O no hydrogen 2.987 N/A LYS 70.A N PHE 67.A O no hydrogen 3.085 N/A LYS 70.A NZ GLU 42.A OE1 no hydrogen 3.011 N/A ILE 71.A N PHE 67.A O no hydrogen 3.341 N/A CYS 72.A SG GLY 68.A O no hydrogen 3.486 N/A LEU 77.A N LEU 74.A O no hydrogen 3.343 N/A ARG 78.A N PRO 75.A O no hydrogen 2.916 N/A THR 80.A OG1 ASP 79.A OD2 no hydrogen 3.385 N/A TYR 81.A N LEU 77.A O no hydrogen 2.927 N/A CYS 87.A SG VAL 84.A O no hydrogen 3.251 N/A GLU 89.A N ALA 85.A O no hydrogen 3.377 N/A LYS 90.A N CYS 87.A O no hydrogen 3.086 N/A LYS 90.A NZ GLU 94.A OE2 no hydrogen 2.734 N/A GLU 94.A N LYS 91.A O no hydrogen 3.203 N/A ARG 95.A N LYS 91.A O no hydrogen 2.745 N/A ARG 95.A NE GLU 92.A OE2 no hydrogen 2.615 N/A ARG 95.A NH1 ASP 65.A OD1 no hydrogen 3.003 N/A ARG 95.A NH1 GLU 92.A OE2 no hydrogen 3.301 N/A ARG 95.A NH2 ASP 69.A OD1 no hydrogen 3.432 N/A CYS 98.A N ARG 95.A O no hydrogen 2.760 N/A PHE 99.A N ARG 95.A O no hydrogen 3.223 N/A LEU 100.A N ASN 96.A O no hydrogen 3.235 N/A HIS 101.A N GLU 97.A O no hydrogen 3.095 N/A HIS 101.A N CYS 98.A O no hydrogen 3.241 N/A HIS 102.A ND1 CYS 98.A O no hydrogen 2.551 N/A LYS 103.A N LEU 100.A O no hydrogen 3.423 N/A LYS 103.A NZ PRO 144.A O no hydrogen 2.884 N/A ASP 104.A N GLN 29.A OE1 no hydrogen 2.630 N/A LYS 106.A N ASP 104.A OD1 no hydrogen 2.926 N/A ARG 114.A NH1 ASP 180.A OD1 no hydrogen 2.973 N/A ARG 114.A NH2 ASP 180.A OD1 no hydrogen 2.738 N/A VAL 119.A N GLU 116.A O no hydrogen 3.169 N/A LEU 120.A N GLU 116.A O no hydrogen 2.971 N/A CYS 121.A N ALA 117.A O no hydrogen 3.023 N/A CYS 121.A SG ALA 117.A O no hydrogen 3.504 N/A LYS 122.A N ASP 118.A O no hydrogen 2.989 N/A LYS 122.A NZ ASP 126.A OD2 no hydrogen 2.722 N/A ALA 123.A N VAL 119.A O no hydrogen 2.950 N/A PHE 124.A N LEU 120.A O no hydrogen 2.963 N/A HIS 125.A N CYS 121.A O no hydrogen 2.744 N/A ASP 126.A N LYS 122.A O no hydrogen 2.850 N/A ASP 127.A N ALA 123.A O no hydrogen 3.241 N/A ALA 130.A N ASP 127.A OD1 no hydrogen 3.389 N/A PHE 131.A N ASP 127.A O no hydrogen 2.870 N/A PHE 132.A N GLU 128.A O no hydrogen 3.084 N/A GLY 133.A N LYS 129.A O no hydrogen 3.019 N/A HIS 134.A N ALA 130.A O no hydrogen 3.053 N/A HIS 134.A ND1 ALA 130.A O no hydrogen 2.777 N/A TYR 135.A N PHE 131.A O no hydrogen 3.002 N/A LEU 136.A N PHE 132.A O no hydrogen 3.158 N/A TYR 137.A N GLY 133.A O no hydrogen 2.937 N/A TYR 137.A OH CYS 31.A O no hydrogen 2.487 N/A GLU 138.A N HIS 134.A O no hydrogen 2.685 N/A VAL 139.A N TYR 135.A O no hydrogen 2.901 N/A ALA 140.A N LEU 136.A O no hydrogen 2.848 N/A ARG 141.A N TYR 137.A O no hydrogen 3.165 N/A ARG 141.A NE GLU 138.A OE1 no hydrogen 2.647 N/A ARG 141.A NH1 GLN 29.A O no hydrogen 2.837 N/A ARG 141.A NH2 GLU 138.A OE1 no hydrogen 3.190 N/A ARG 142.A N GLU 138.A O no hydrogen 3.509 N/A ARG 142.A NH1 GLU 138.A O no hydrogen 3.167 N/A ARG 142.A NH1 GLU 138.A OE1 no hydrogen 2.740 N/A ARG 142.A NH2 PRO 110.A O no hydrogen 2.876 N/A HIS 143.A N VAL 139.A O no hydrogen 2.922 N/A PHE 146.A N HIS 143.A O no hydrogen 3.095 N/A LEU 151.A N TYR 147.A O no hydrogen 2.987 N/A LEU 152.A N ALA 148.A O no hydrogen 3.207 N/A TYR 153.A N PRO 149.A O no hydrogen 3.212 N/A TYR 154.A N GLU 150.A O no hydrogen 3.015 N/A ALA 155.A N LEU 151.A O no hydrogen 2.962 N/A GLN 156.A N LEU 152.A O no hydrogen 3.092 N/A LYS 157.A N TYR 153.A O no hydrogen 2.979 N/A TYR 158.A N TYR 154.A O no hydrogen 2.761 N/A LYS 159.A N ALA 155.A O no hydrogen 2.963 N/A LYS 159.A NZ GLU 128.A OE1 no hydrogen 2.892 N/A ALA 160.A N GLN 156.A O no hydrogen 3.076 N/A ILE 161.A N LYS 157.A O no hydrogen 2.994 N/A LEU 162.A N TYR 158.A O no hydrogen 3.111 N/A THR 163.A N LYS 159.A O no hydrogen 2.936 N/A THR 163.A OG1 LYS 159.A O no hydrogen 3.154 N/A GLU 164.A N ALA 160.A O no hydrogen 3.075 N/A CYS 165.A N ILE 161.A O no hydrogen 2.912 N/A CYS 165.A SG ILE 161.A O no hydrogen 3.453 N/A CYS 166.A N LEU 162.A O no hydrogen 3.029 N/A CYS 166.A SG LEU 162.A O no hydrogen 3.334 N/A ALA 168.A N CYS 165.A O no hydrogen 3.044 N/A LYS 171.A NZ CYS 166.A O no hydrogen 2.647 N/A ALA 173.A N ASP 170.A OD1 no hydrogen 3.222 N/A LEU 175.A N LYS 171.A O no hydrogen 2.799 N/A THR 176.A N GLY 172.A O no hydrogen 2.808 N/A THR 176.A OG1 GLY 172.A O no hydrogen 3.046 N/A LYS 178.A NZ CYS 174.A O no hydrogen 3.200 N/A LEU 179.A N LEU 175.A O no hydrogen 2.778 N/A ASP 180.A N THR 176.A O no hydrogen 2.950 N/A ALA 181.A N PRO 177.A O no hydrogen 3.030 N/A LEU 182.A N LYS 178.A O no hydrogen 2.965 N/A LYS 183.A N LEU 179.A O no hydrogen 2.762 N/A GLU 184.A N ASP 180.A O no hydrogen 3.179 N/A LYS 185.A N ALA 181.A O no hydrogen 3.135 N/A ALA 186.A N LEU 182.A O no hydrogen 2.918 N/A LEU 187.A N LYS 183.A O no hydrogen 2.937 N/A ILE 188.A N GLU 184.A O no hydrogen 3.118 N/A SER 189.A N LYS 185.A O no hydrogen 2.856 N/A ALA 190.A N ALA 186.A O no hydrogen 2.697 N/A ALA 191.A N LEU 187.A O no hydrogen 2.857 N/A GLN 192.A N ILE 188.A O no hydrogen 2.765 N/A GLU 193.A N SER 189.A O no hydrogen 3.031 N/A ARG 194.A N ALA 190.A O no hydrogen 2.974 N/A ARG 194.A NE ASP 105.A OD1 no hydrogen 2.698 N/A ARG 194.A NH1 ARG 194.A O no hydrogen 3.285 N/A ARG 194.A NH2 ASP 105.A OD2 no hydrogen 2.899 N/A LEU 195.A N ALA 191.A O no hydrogen 3.297 N/A LEU 195.A N GLN 192.A O no hydrogen 3.008 N/A ARG 196.A N GLN 192.A O no hydrogen 3.098 N/A ARG 196.A NH1 GLU 193.A OE1 no hydrogen 3.137 N/A ARG 196.A NH1 TYR 288.A OH no hydrogen 3.436 N/A CYS 197.A N GLU 193.A O no hydrogen 2.955 N/A CYS 197.A SG GLU 193.A O no hydrogen 3.308 N/A CYS 197.A SG GLU 193.A OE2 no hydrogen 3.897 N/A ALA 198.A N ARG 194.A O no hydrogen 3.025 N/A SER 199.A N LEU 195.A O no hydrogen 2.886 N/A SER 199.A OG LEU 195.A O no hydrogen 2.662 N/A ILE 200.A N ARG 196.A O no hydrogen 2.942 N/A GLN 201.A N CYS 197.A O no hydrogen 2.871 N/A GLN 201.A NE2 CYS 243.A O no hydrogen 2.832 N/A LYS 202.A N ALA 198.A O no hydrogen 2.929 N/A LYS 202.A NZ GLU 462.A OE2 no hydrogen 3.061 N/A PHE 203.A N SER 199.A O no hydrogen 2.918 N/A GLY 204.A N ILE 200.A O no hydrogen 2.893 N/A ARG 206.A NE ASP 321.A OD2 no hydrogen 2.980 N/A ARG 206.A NH1 ASP 321.A OD1 no hydrogen 3.308 N/A ALA 207.A N GLY 204.A O no hydrogen 2.954 N/A TYR 208.A N ASP 205.A O no hydrogen 2.966 N/A LYS 209.A N ASP 205.A O no hydrogen 2.895 N/A ALA 210.A N ARG 206.A O no hydrogen 2.901 N/A ALA 212.A N TYR 208.A O no hydrogen 2.714 N/A LEU 213.A N LYS 209.A O no hydrogen 2.765 N/A VAL 214.A N ALA 210.A O no hydrogen 3.061 N/A ARG 215.A N TRP 211.A O no hydrogen 3.105 N/A ARG 215.A NH1 ARG 215.A O no hydrogen 2.826 N/A ARG 215.A NH1 ASN 292.A OD1 no hydrogen 3.071 N/A ARG 215.A NH2 ASN 292.A OD1 no hydrogen 3.224 N/A LEU 216.A N ALA 212.A O no hydrogen 2.865 N/A SER 217.A N LEU 213.A O no hydrogen 2.932 N/A SER 217.A OG LEU 213.A O no hydrogen 2.899 N/A GLN 218.A N VAL 214.A O no hydrogen 2.999 N/A GLN 218.A NE2 HIS 335.A O no hydrogen 2.908 N/A GLN 218.A NE2 TYR 338.A O no hydrogen 2.875 N/A ARG 219.A N ARG 215.A O no hydrogen 2.987 N/A ARG 219.A NE LEU 290.A O no hydrogen 2.971 N/A PHE 220.A N LEU 216.A O no hydrogen 2.813 N/A ALA 223.A N PHE 220.A O no hydrogen 3.035 N/A ASP 227.A N ASP 224.A O no hydrogen 2.868 N/A ILE 228.A N ASP 224.A O no hydrogen 3.075 N/A SER 229.A N PHE 225.A O no hydrogen 2.901 N/A SER 229.A OG PHE 225.A O no hydrogen 2.889 N/A LYS 230.A N THR 226.A O no hydrogen 3.074 N/A LYS 230.A NZ ASP 234.A OD2 no hydrogen 3.381 N/A ILE 231.A N ASP 227.A O no hydrogen 2.832 N/A VAL 232.A N ILE 228.A O no hydrogen 2.713 N/A THR 233.A N SER 229.A O no hydrogen 2.957 N/A THR 233.A OG1 SER 229.A O no hydrogen 2.745 N/A ASP 234.A N LYS 230.A O no hydrogen 3.103 N/A LEU 235.A N ILE 231.A O no hydrogen 3.083 N/A THR 236.A N VAL 232.A O no hydrogen 3.063 N/A THR 236.A OG1 VAL 232.A O no hydrogen 2.710 N/A LYS 237.A N THR 233.A O no hydrogen 3.301 N/A LYS 237.A NZ GLU 241.A OE2 no hydrogen 3.449 N/A LYS 237.A NZ ASP 253.A OD2 no hydrogen 3.566 N/A VAL 238.A N ASP 234.A O no hydrogen 3.047 N/A HIS 239.A N LEU 235.A O no hydrogen 2.906 N/A HIS 239.A ND1 GLU 193.A OE2 no hydrogen 2.787 N/A LYS 240.A N THR 236.A O no hydrogen 2.829 N/A LYS 240.A NZ ASP 205.A OD1 no hydrogen 3.084 N/A LYS 240.A NZ ASP 205.A OD2 no hydrogen 3.186 N/A GLU 241.A N LYS 237.A O no hydrogen 3.086 N/A CYS 242.A N VAL 238.A O no hydrogen 3.072 N/A CYS 243.A N HIS 239.A O no hydrogen 2.799 N/A CYS 243.A SG GLU 193.A OE2 no hydrogen 3.566 N/A CYS 243.A SG HIS 239.A O no hydrogen 2.969 N/A HIS 244.A N GLU 241.A O no hydrogen 3.040 N/A HIS 244.A ND1 ASP 246.A OD2 no hydrogen 3.252 N/A HIS 244.A NE2 GLU 97.A OE1 no hydrogen 2.870 N/A GLY 245.A N CYS 242.A O no hydrogen 3.109 N/A ASP 246.A N GLU 241.A O no hydrogen 2.822 N/A GLU 249.A N GLU 249.A OE1 no hydrogen 2.580 N/A CYS 250.A N ASP 246.A O no hydrogen 3.079 N/A CYS 250.A SG VAL 238.A O no hydrogen 3.553 N/A ALA 251.A N LEU 247.A O no hydrogen 2.937 N/A ASP 252.A N LEU 248.A O no hydrogen 3.138 N/A ASP 253.A N GLU 249.A O no hydrogen 2.773 N/A ARG 254.A N CYS 250.A O no hydrogen 2.809 N/A ARG 254.A NH1 GLU 150.A OE2 no hydrogen 3.482 N/A ARG 254.A NH2 GLU 150.A OE2 no hydrogen 2.698 N/A ALA 255.A N ALA 251.A O no hydrogen 2.943 N/A ASP 256.A N ASP 252.A O no hydrogen 3.100 N/A LEU 257.A N ASP 253.A O no hydrogen 3.161 N/A ALA 258.A N ARG 254.A O no hydrogen 2.974 N/A LYS 259.A N ALA 255.A O no hydrogen 2.943 N/A TYR 260.A N ASP 256.A O no hydrogen 2.750 N/A MET 261.A N LEU 257.A O no hydrogen 3.217 N/A CYS 262.A N ALA 258.A O no hydrogen 3.133 N/A CYS 262.A N LYS 259.A O no hydrogen 3.168 N/A CYS 262.A SG ALA 258.A O no hydrogen 3.578 N/A GLU 263.A N LYS 259.A O no hydrogen 3.035 N/A GLN 265.A N CYS 262.A O no hydrogen 2.958 N/A THR 267.A OG1 HIS 264.A O no hydrogen 3.536 N/A ILE 268.A N GLN 265.A O no hydrogen 3.166 N/A SER 269.A N GLN 265.A O no hydrogen 3.299 N/A HIS 271.A N SER 269.A OG no hydrogen 3.036 N/A LYS 273.A N SER 270.A O no hydrogen 3.497 N/A LYS 273.A NZ GLN 265.A OE1 no hydrogen 3.045 N/A CYS 275.A N LEU 272.A O no hydrogen 3.023 N/A CYS 276.A N LEU 272.A O no hydrogen 3.026 N/A CYS 276.A SG LEU 272.A O no hydrogen 3.292 N/A LYS 278.A N CYS 275.A O no hydrogen 3.134 N/A LYS 278.A NZ GLU 274.A O no hydrogen 3.096 N/A LYS 278.A NZ ASP 277.A OD2.A no hydrogen 2.756 N/A LYS 283.A N PRO 279.A O no hydrogen 2.877 N/A LYS 283.A NZ LYS 278.A O no hydrogen 3.100 N/A ALA 284.A N ILE 280.A O no hydrogen 2.893 N/A HIS 285.A N LEU 281.A O no hydrogen 2.836 N/A HIS 285.A ND1 GLU 150.A OE1 no hydrogen 2.784 N/A CYS 286.A N GLU 282.A O no hydrogen 2.902 N/A ILE 287.A N LYS 283.A O no hydrogen 3.015 N/A TYR 288.A N ALA 284.A O no hydrogen 2.919 N/A TYR 288.A OH GLN 192.A OE1 no hydrogen 2.572 N/A GLY 289.A N HIS 285.A O no hydrogen 3.150 N/A LEU 290.A N ILE 287.A O no hydrogen 3.061 N/A ASP 293.A N ARG 219.A O no hydrogen 2.910 N/A GLU 294.A N ASP 293.A OD1 no hydrogen 2.670 N/A THR 295.A OG1 ARG 333.A O no hydrogen 3.266 N/A GLU 304.A N ALA 301.A O no hydrogen 3.081 N/A PHE 306.A N VAL 302.A O no hydrogen 3.252 N/A VAL 307.A N ALA 303.A O no hydrogen 2.843 N/A GLU 308.A N ALA 303.A O no hydrogen 2.863 N/A ASP 309.A N GLU 304.A O no hydrogen 2.833 N/A ASP 311.A N ASP 309.A OD1 no hydrogen 2.990 N/A VAL 312.A N ASP 309.A O no hydrogen 3.364 N/A LYS 314.A NZ GLU 318.A OE2 no hydrogen 3.514 N/A ASN 315.A N ASP 311.A O no hydrogen 2.640 N/A TYR 316.A N VAL 312.A O no hydrogen 2.987 N/A GLU 317.A N CYS 313.A O no hydrogen 3.032 N/A GLU 318.A N LYS 314.A O no hydrogen 2.829 N/A ALA 319.A N ASN 315.A O no hydrogen 2.874 N/A PHE 323.A N ALA 319.A O no hydrogen 2.977 N/A LEU 324.A N LYS 320.A O no hydrogen 2.925 N/A GLY 325.A N ASP 321.A O no hydrogen 2.669 N/A LYS 326.A N LEU 322.A O no hydrogen 3.056 N/A PHE 327.A N PHE 323.A O no hydrogen 2.944 N/A LEU 328.A N LEU 324.A O no hydrogen 3.005 N/A TYR 329.A N GLY 325.A O no hydrogen 2.800 N/A TYR 329.A OH ALA 223.A O no hydrogen 2.423 N/A GLU 330.A N LYS 326.A O no hydrogen 2.918 N/A TYR 331.A N PHE 327.A O no hydrogen 2.822 N/A SER 332.A N LEU 328.A O no hydrogen 2.746 N/A SER 332.A OG LEU 328.A O no hydrogen 2.565 N/A ARG 333.A N TYR 329.A O no hydrogen 2.915 N/A ARG 333.A NE GLU 330.A OE1 no hydrogen 2.937 N/A ARG 333.A NH1 PRO 221.A O no hydrogen 2.785 N/A ARG 333.A NH2 GLU 330.A OE1 no hydrogen 2.909 N/A ARG 334.A NH1 PRO 300.A O no hydrogen 2.691 N/A ARG 334.A NH2 GLU 330.A O no hydrogen 3.058 N/A ARG 334.A NH2 GLU 330.A OE1 no hydrogen 2.666 N/A HIS 335.A N SER 332.A O no hydrogen 2.697 N/A HIS 335.A ND1 TYR 331.A O no hydrogen 3.292 N/A ASP 337.A N ASP 337.A OD1 no hydrogen 2.684 N/A TYR 338.A N HIS 335.A O no hydrogen 3.246 N/A SER 339.A OG GLU 447.A OE2 no hydrogen 2.783 N/A VAL 340.A N ASP 448.A OD1 no hydrogen 3.159 N/A VAL 340.A N ASP 448.A OD2 no hydrogen 3.422 N/A LEU 342.A N SER 339.A OG no hydrogen 3.091 N/A LEU 343.A N SER 339.A O no hydrogen 3.002 N/A LEU 344.A N VAL 340.A O no hydrogen 2.942 N/A ARG 345.A N VAL 341.A O no hydrogen 2.922 N/A ARG 345.A NH1 GLU 447.A OE1 no hydrogen 3.117 N/A ARG 345.A NH1 VAL 479.A O no hydrogen 3.106 N/A ARG 345.A NH2 GLU 447.A OE1 no hydrogen 2.732 N/A ARG 345.A NH2 GLU 447.A OE2 no hydrogen 3.074 N/A LEU 346.A N LEU 342.A O no hydrogen 2.792 N/A GLY 347.A N LEU 343.A O no hydrogen 2.864 N/A LYS 348.A N LEU 344.A O no hydrogen 2.935 N/A ALA 349.A N ARG 345.A O no hydrogen 3.038 N/A TYR 350.A N LEU 346.A O no hydrogen 2.924 N/A TYR 350.A OH PHE 306.A O no hydrogen 2.849 N/A GLU 351.A N GLY 347.A O no hydrogen 2.956 N/A ALA 352.A N LYS 348.A O no hydrogen 2.910 N/A THR 353.A N ALA 349.A O no hydrogen 3.099 N/A THR 353.A OG1 ALA 349.A O no hydrogen 2.758 N/A LEU 354.A N TYR 350.A O no hydrogen 2.998 N/A LYS 355.A N GLU 351.A O no hydrogen 2.940 N/A LYS 356.A N ALA 352.A O no hydrogen 3.124 N/A CYS 357.A N THR 353.A O no hydrogen 2.784 N/A CYS 358.A N LEU 354.A O no hydrogen 2.840 N/A ALA 359.A N LYS 356.A O no hydrogen 3.381 N/A THR 360.A N CYS 357.A O no hydrogen 2.881 N/A THR 360.A OG1 CYS 357.A O no hydrogen 2.782 N/A ALA 365.A N ASP 362.A OD1 no hydrogen 3.358 N/A CYS 366.A N PRO 363.A O no hydrogen 2.884 N/A TYR 367.A N PRO 363.A O no hydrogen 2.937 N/A TYR 367.A N HIS 364.A O no hydrogen 3.274 N/A VAL 370.A N TYR 367.A O no hydrogen 2.875 N/A GLU 373.A N LYS 369.A O no hydrogen 2.986 N/A GLU 373.A N VAL 370.A O no hydrogen 2.954 N/A PHE 374.A N LEU 371.A O no hydrogen 3.254 N/A GLN 375.A N ASP 372.A O no hydrogen 3.414 N/A GLN 375.A NE2 ASP 379.A OD2 no hydrogen 3.082 N/A VAL 378.A N PHE 374.A O no hydrogen 3.049 N/A ASP 379.A N GLN 375.A O no hydrogen 2.865 N/A GLU 380.A N PRO 376.A O no hydrogen 3.254 N/A ASN 383.A N ASP 379.A O no hydrogen 2.927 N/A LEU 384.A N GLU 380.A O no hydrogen 3.005 N/A VAL 385.A N PRO 381.A O no hydrogen 3.049 N/A LYS 386.A N LYS 382.A O no hydrogen 3.282 N/A LYS 386.A N ASN 383.A O no hydrogen 3.004 N/A LYS 386.A NZ LYS 382.A O no hydrogen 3.117 N/A GLN 387.A N ASN 383.A O no hydrogen 2.962 N/A ASN 388.A N LEU 384.A O no hydrogen 2.882 N/A ASN 388.A ND2 LEU 384.A O no hydrogen 3.370 N/A CYS 389.A N VAL 385.A O no hydrogen 2.946 N/A CYS 389.A SG VAL 385.A O no hydrogen 3.271 N/A GLU 390.A N LYS 386.A O no hydrogen 3.124 N/A LEU 391.A N GLN 387.A O no hydrogen 2.995 N/A TYR 392.A N ASN 388.A O no hydrogen 2.957 N/A TYR 392.A OH ASP 397.A OD1 no hydrogen 2.829 N/A TYR 392.A OH ASP 397.A OD2 no hydrogen 3.304 N/A GLU 393.A N CYS 389.A O no hydrogen 2.831 N/A GLN 394.A N GLU 390.A O no hydrogen 2.741 N/A LEU 395.A N LEU 391.A O no hydrogen 2.838 N/A GLY 396.A N TYR 392.A O no hydrogen 2.800 N/A PHE 400.A N GLY 396.A O no hydrogen 2.905 N/A GLN 401.A N ASP 397.A O no hydrogen 2.963 N/A ASN 402.A N TYR 398.A O no hydrogen 2.820 N/A ASN 402.A ND2 ASN 399.A OD1 no hydrogen 3.152 N/A ALA 403.A N ASN 399.A O no hydrogen 3.002 N/A LEU 404.A N PHE 400.A O no hydrogen 2.848 N/A LEU 405.A N GLN 401.A O no hydrogen 2.757 N/A VAL 406.A N ASN 402.A O no hydrogen 3.003 N/A ARG 407.A N ALA 403.A O no hydrogen 2.959 N/A TYR 408.A N LEU 404.A O no hydrogen 2.798 N/A THR 409.A N LEU 405.A O no hydrogen 2.892 N/A THR 409.A OG1 LEU 405.A O no hydrogen 2.648 N/A LYS 410.A N VAL 406.A O no hydrogen 3.023 N/A LYS 411.A N ARG 407.A O no hydrogen 2.993 N/A VAL 412.A N TYR 408.A O no hydrogen 2.968 N/A GLN 414.A NE2 ASP 491.A OD2 no hydrogen 2.828 N/A VAL 415.A N VAL 412.A O no hydrogen 3.044 N/A SER 416.A OG THR 419.A OG1 no hydrogen 3.263 N/A THR 417.A OG1 GLU 528.A OE2 no hydrogen 2.693 N/A THR 419.A OG1 SER 416.A OG no hydrogen 3.263 N/A LEU 420.A N SER 416.A O no hydrogen 2.976 N/A VAL 421.A N THR 417.A O no hydrogen 3.037 N/A GLU 422.A N PRO 418.A O no hydrogen 2.831 N/A ILE 423.A N THR 419.A O no hydrogen 2.751 N/A SER 424.A N LEU 420.A O no hydrogen 2.786 N/A SER 424.A OG LEU 420.A O no hydrogen 2.678 N/A ARG 425.A N VAL 421.A O no hydrogen 2.959 N/A ARG 425.A NH2 GLN 523.A OE1 no hydrogen 2.657 N/A SER 426.A N GLU 422.A O no hydrogen 3.037 N/A SER 426.A OG GLU 422.A O no hydrogen 3.280 N/A LEU 427.A N ILE 423.A O no hydrogen 3.108 N/A GLY 428.A N SER 424.A O no hydrogen 3.071 N/A LYS 429.A N ARG 425.A O no hydrogen 3.130 N/A LYS 429.A NZ GLU 184.A OE2 no hydrogen 2.722 N/A VAL 430.A N LEU 427.A O no hydrogen 3.059 N/A LYS 433.A N LYS 429.A O no hydrogen 2.854 N/A CYS 434.A N VAL 430.A O no hydrogen 2.899 N/A CYS 434.A N GLY 431.A O no hydrogen 3.351 N/A CYS 435.A N GLY 431.A O no hydrogen 3.021 N/A CYS 435.A SG GLY 431.A O no hydrogen 3.634 N/A LYS 436.A NZ SER 432.A O no hydrogen 2.978 N/A HIS 437.A N CYS 434.A O no hydrogen 3.252 N/A GLU 441.A N PRO 438.A O no hydrogen 2.977 N/A ARG 442.A N GLU 439.A O no hydrogen 3.375 N/A ARG 442.A NE CYS 435.A O no hydrogen 3.416 N/A ARG 442.A NE HIS 437.A O no hydrogen 3.311 N/A ARG 442.A NH2 CYS 435.A O no hydrogen 3.109 N/A CYS 445.A N GLU 441.A O no hydrogen 3.482 N/A VAL 446.A N ARG 442.A O no hydrogen 2.801 N/A GLU 447.A N LEU 443.A O no hydrogen 2.821 N/A ASP 448.A N PRO 444.A O no hydrogen 3.253 N/A TYR 449.A N VAL 446.A O no hydrogen 2.867 N/A LEU 450.A N VAL 446.A O no hydrogen 2.973 N/A SER 451.A N GLU 447.A O no hydrogen 3.112 N/A SER 451.A OG GLU 447.A O no hydrogen 3.140 N/A VAL 453.A N TYR 449.A O no hydrogen 3.059 N/A LEU 454.A N LEU 450.A O no hydrogen 2.742 N/A ASN 455.A N SER 451.A O no hydrogen 2.752 N/A ARG 456.A N VAL 452.A O no hydrogen 3.206 N/A ARG 456.A N VAL 453.A O no hydrogen 2.889 N/A ARG 456.A NE GLU 422.A OE2 no hydrogen 3.021 N/A ARG 456.A NH1 ASP 105.A O no hydrogen 3.138 N/A ARG 456.A NH2 GLU 422.A OE1 no hydrogen 3.053 N/A ARG 456.A NH2 GLU 422.A OE2 no hydrogen 3.299 N/A LEU 457.A N VAL 453.A O no hydrogen 3.118 N/A CYS 458.A N LEU 454.A O no hydrogen 2.878 N/A CYS 458.A SG LEU 454.A O no hydrogen 3.299 N/A VAL 459.A N ASN 455.A O no hydrogen 2.772 N/A LEU 460.A N ARG 456.A O no hydrogen 3.246 N/A HIS 461.A N LEU 457.A O no hydrogen 2.914 N/A GLU 462.A N CYS 458.A O no hydrogen 3.120 N/A LYS 463.A NZ ASP 104.A OD1 no hydrogen 2.926 N/A VAL 466.A N HIS 461.A NE2 no hydrogen 3.121 N/A SER 467.A N HIS 461.A NE2 no hydrogen 3.072 N/A SER 467.A OG GLN 414.A OE1 no hydrogen 3.539 N/A THR 471.A N SER 467.A O no hydrogen 3.352 N/A THR 471.A OG1 SER 467.A O no hydrogen 3.455 N/A LYS 472.A N GLU 468.A O no hydrogen 2.973 N/A LYS 472.A NZ GLU 476.A OE2 no hydrogen 3.341 N/A CYS 473.A N LYS 469.A O no hydrogen 2.983 N/A CYS 473.A SG LYS 469.A O no hydrogen 3.768 N/A CYS 474.A N VAL 470.A O no hydrogen 2.646 N/A CYS 474.A SG VAL 470.A O no hydrogen 3.297 N/A SER 475.A N THR 471.A O no hydrogen 2.851 N/A SER 475.A N LYS 472.A O no hydrogen 3.304 N/A SER 475.A OG THR 471.A O no hydrogen 2.539 N/A GLU 476.A N LYS 472.A O no hydrogen 3.120 N/A ASP 480.A N SER 477.A O no hydrogen 3.070 N/A ARG 481.A NE CYS 474.A O no hydrogen 3.366 N/A ARG 481.A NH1 ASN 455.A OD1 no hydrogen 2.907 N/A ARG 481.A NH2 CYS 474.A O no hydrogen 2.885 N/A ARG 482.A NE GLU 447.A OE1 no hydrogen 2.880 N/A ARG 482.A NH1 GLU 380.A OE1 no hydrogen 2.773 N/A ARG 482.A NH1 GLU 380.A OE2 no hydrogen 3.470 N/A ARG 482.A NH1 SER 486.A OG no hydrogen 3.035 N/A ARG 482.A NH2 GLU 380.A OE1 no hydrogen 3.480 N/A ARG 482.A NH2 GLU 380.A OE2 no hydrogen 2.656 N/A ARG 482.A NH2 GLU 447.A OE1 no hydrogen 2.919 N/A CYS 484.A N ASP 480.A O no hydrogen 2.805 N/A PHE 485.A N ARG 481.A O no hydrogen 2.848 N/A SER 486.A N ARG 482.A O no hydrogen 2.884 N/A SER 486.A OG ARG 482.A O no hydrogen 3.076 N/A ALA 487.A N PRO 483.A O no hydrogen 3.074 N/A LEU 488.A N PHE 485.A O no hydrogen 3.280 N/A ASP 491.A N LYS 410.A O no hydrogen 2.942 N/A THR 493.A N ASP 491.A OD1 no hydrogen 2.967 N/A THR 493.A OG1 ASP 491.A OD1 no hydrogen 2.584 N/A LYS 497.A N LYS 531.A O no hydrogen 3.272 N/A LYS 497.A NZ GLU 528.A OE1 no hydrogen 2.784 N/A THR 503.A N ASN 500.A O no hydrogen 3.064 N/A THR 503.A OG1 ASN 500.A O no hydrogen 2.434 N/A PHE 504.A N ALA 501.A O no hydrogen 2.972 N/A THR 505.A OG1 ALA 501.A O no hydrogen 2.744 N/A ILE 510.A N HIS 507.A O no hydrogen 3.034 N/A CYS 511.A N ALA 508.A O no hydrogen 3.075 N/A THR 512.A N ASP 509.A O no hydrogen 3.208 N/A THR 512.A OG1 ASP 509.A O no hydrogen 2.494 N/A LEU 513.A N ILE 510.A O no hydrogen 3.093 N/A GLU 517.A N PRO 514.A O no hydrogen 2.939 N/A ARG 518.A N PRO 514.A O no hydrogen 3.056 N/A LYS 519.A N GLU 515.A O no hydrogen 2.907 N/A LYS 519.A NZ GLU 515.A OE2 no hydrogen 2.754 N/A ILE 520.A N GLU 517.A O no hydrogen 3.124 N/A LYS 521.A N GLU 517.A O no hydrogen 3.188 N/A LYS 522.A N ARG 518.A O no hydrogen 2.839 N/A LYS 522.A NZ THR 549.A OG1 no hydrogen 2.926 N/A GLN 523.A N LYS 519.A O no hydrogen 2.817 N/A GLN 523.A NE2 GLN 401.A OE1 no hydrogen 3.043 N/A GLN 523.A NE2 ASN 402.A OD1 no hydrogen 3.161 N/A THR 524.A N ILE 520.A O no hydrogen 2.581 N/A THR 524.A OG1 ILE 520.A O no hydrogen 2.844 N/A ALA 525.A N LYS 521.A O no hydrogen 2.923 N/A LEU 526.A N LYS 522.A O no hydrogen 2.980 N/A VAL 527.A N GLN 523.A O no hydrogen 3.241 N/A GLU 528.A N THR 524.A O no hydrogen 3.235 N/A LEU 529.A N ALA 525.A O no hydrogen 2.941 N/A VAL 530.A N LEU 526.A O no hydrogen 2.916 N/A LYS 531.A N VAL 527.A O no hydrogen 2.884 N/A LYS 531.A NZ VAL 415.A O no hydrogen 2.766 N/A LYS 531.A NZ THR 417.A OG1 no hydrogen 2.984 N/A HIS 532.A N GLU 528.A O no hydrogen 2.947 N/A HIS 532.A ND1 LYS 497.A O no hydrogen 2.894 N/A LYS 533.A N LEU 529.A O no hydrogen 2.749 N/A HIS 535.A NE2 GLU 492.A OE1 no hydrogen 2.832 N/A HIS 535.A NE2 GLU 492.A OE2 no hydrogen 3.186 N/A ALA 536.A N LYS 533.A O no hydrogen 2.832 N/A GLN 540.A N THR 537.A OG1 no hydrogen 3.105 N/A LEU 541.A N THR 537.A O no hydrogen 2.900 N/A LYS 542.A N ASN 538.A O no hydrogen 2.996 N/A THR 543.A N ASP 539.A O no hydrogen 2.990 N/A THR 543.A OG1 ASP 539.A O no hydrogen 2.652 N/A VAL 544.A N GLN 540.A O no hydrogen 2.977 N/A VAL 545.A N LEU 541.A O no hydrogen 3.022 N/A GLY 546.A N LYS 542.A O no hydrogen 2.950 N/A GLU 547.A N THR 543.A O no hydrogen 3.104 N/A PHE 548.A N VAL 544.A O no hydrogen 3.029 N/A THR 549.A N VAL 545.A O no hydrogen 2.768 N/A THR 549.A OG1 VAL 545.A O no hydrogen 3.026 N/A ALA 550.A N GLY 546.A O no hydrogen 2.965 N/A LEU 551.A N GLU 547.A O no hydrogen 2.877 N/A LEU 552.A N PHE 548.A O no hydrogen 2.946 N/A ASP 553.A N THR 549.A O no hydrogen 2.960 N/A LYS 554.A N ALA 550.A O no hydrogen 2.983 N/A CYS 555.A N LEU 551.A O no hydrogen 2.931 N/A CYS 555.A SG LEU 551.A O no hydrogen 3.740 N/A CYS 556.A N LEU 552.A O no hydrogen 2.928 N/A SER 557.A N LYS 554.A O no hydrogen 3.371 N/A SER 557.A OG ASP 553.A O no hydrogen 3.040 N/A SER 557.A OG LYS 554.A O no hydrogen 3.410 N/A LYS 561.A NZ CYS 556.A O no hydrogen 3.555 N/A LYS 561.A NZ ALA 558.A O no hydrogen 3.174 N/A ALA 563.A N ASP 560.A OD1 no hydrogen 2.996 N/A CYS 564.A N ASP 560.A O no hydrogen 3.063 N/A PHE 565.A N LYS 561.A O no hydrogen 2.990 N/A ALA 566.A N GLU 562.A O no hydrogen 3.159 N/A VAL 567.A N ALA 563.A O no hydrogen 3.202 N/A GLU 568.A N CYS 564.A O no hydrogen 2.954 N/A GLY 569.A N PHE 565.A O no hydrogen 2.614 N/A LYS 571.A NZ GLU 568.A OE1 no hydrogen 3.168 N/A LYS 571.A NZ GLU 568.A OE2 no hydrogen 3.419 N/A LEU 572.A N GLU 568.A O no hydrogen 2.926 N/A LEU 572.A N GLY 569.A O no hydrogen 2.922 N/A VAL 573.A N GLY 569.A O no hydrogen 3.257 N/A GLU 574.A N PRO 570.A O no hydrogen 3.045 N/A SER 575.A N LYS 571.A O no hydrogen 3.213 N/A SER 575.A N LEU 572.A O no hydrogen 2.821 N/A SER 575.A OG LYS 571.A O no hydrogen 3.318 N/A SER 575.A OG LEU 572.A O no hydrogen 3.084 N/A SER 576.A N LEU 572.A O no hydrogen 2.886 N/A SER 576.A OG LEU 572.A O no hydrogen 3.011 N/A LYS 577.A N VAL 573.A O no hydrogen 3.510 N/A THR 579.A N SER 575.A O no hydrogen 2.971 N/A THR 579.A OG1 SER 575.A O no hydrogen 3.255 N/A LEU 580.A N SER 576.A O no hydrogen 2.871 N/A GLY 581.A N ALA 578.A O no hydrogen 3.251 N/A