Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4btw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A NE2 GLN 275.A O no hydrogen 2.778 N/A ARG 14.A NH2 PRO 371.A O no hydrogen 2.478 N/A GLU 16.A N SER 13.A OG no hydrogen 3.277 N/A LEU 17.A N SER 13.A O no hydrogen 2.795 N/A THR 18.A N ARG 14.A O no hydrogen 2.695 N/A THR 18.A OG1 ARG 14.A O no hydrogen 2.799 N/A ALA 19.A N GLU 15.A O no hydrogen 2.759 N/A VAL 20.A N GLU 16.A O no hydrogen 3.122 N/A MET 21.A N LEU 17.A O no hydrogen 2.941 N/A ARG 22.A N THR 18.A O no hydrogen 2.797 N/A PHE 23.A N ALA 19.A O no hydrogen 2.969 N/A LEU 24.A N VAL 20.A O no hydrogen 3.060 N/A THR 25.A N MET 21.A O no hydrogen 2.933 N/A THR 25.A OG1 MET 21.A O no hydrogen 2.737 N/A THR 25.A OG1 ARG 22.A O no hydrogen 3.275 N/A GLN 26.A N ARG 22.A O no hydrogen 3.475 N/A ARG 27.A N PHE 23.A O no hydrogen 3.226 N/A VAL 33.A N ASN 43.A O no hydrogen 3.023 N/A ALA 36.A N ASP 34.A OD1 no hydrogen 3.094 N/A GLN 37.A N ASP 34.A O no hydrogen 3.331 N/A ALA 38.A N ALA 35.A O no hydrogen 3.130 N/A ARG 39.A N ASP 42.A OD2 no hydrogen 3.290 N/A ARG 39.A NH1 GLN 123.A OE1 no hydrogen 2.930 N/A ARG 39.A NH2 GLN 123.A OE1 no hydrogen 3.290 N/A SER 41.A OG ASP 42.A OD1 no hydrogen 3.349 N/A ASP 42.A N ARG 39.A O no hydrogen 2.855 N/A CYS 44.A N PHE 78.A O no hydrogen 3.092 N/A CYS 44.A SG VAL 33.A O no hydrogen 3.974 N/A PHE 46.A N ILE 76.A O no hydrogen 2.760 N/A SER 47.A N ILE 76.A O no hydrogen 3.387 N/A VAL 48.A N LEU 365.A O no hydrogen 3.103 N/A GLU 49.A N LEU 74.A O no hydrogen 3.138 N/A GLN 51.A N GLU 72.A O no hydrogen 3.031 N/A LYS 55.A N GLU 587.A OE2 no hydrogen 2.953 N/A LYS 55.A NZ ASP 477.A OD1 no hydrogen 3.370 N/A LYS 55.A NZ ASP 477.A OD2 no hydrogen 2.888 N/A LYS 55.A NZ ASP 479.A OD1 no hydrogen 3.247 N/A LYS 55.A NZ ASP 479.A OD2 no hydrogen 2.636 N/A LYS 55.A NZ ASP 621.A OD1 no hydrogen 2.665 N/A LYS 55.A NZ ASP 621.A OD2 no hydrogen 2.640 N/A ALA 58.A N PRO 54.A O no hydrogen 3.232 N/A LEU 59.A N LYS 55.A O no hydrogen 3.011 N/A ALA 60.A N ALA 56.A O no hydrogen 2.848 N/A HIS 61.A N ALA 57.A O no hydrogen 2.981 N/A HIS 61.A ND1 SER 66.A O no hydrogen 2.893 N/A LEU 62.A N ALA 58.A O no hydrogen 2.821 N/A ASP 63.A N LEU 59.A O no hydrogen 2.435 N/A ARG 64.A N ALA 60.A O no hydrogen 3.041 N/A SER 66.A N ALA 60.A O no hydrogen 3.250 N/A ARG 71.A NE GLU 16.A OE1 no hydrogen 3.064 N/A ARG 71.A NE GLU 16.A OE2 no hydrogen 3.552 N/A ARG 71.A NH1 ALA 10.A O no hydrogen 3.118 N/A ARG 71.A NH2 ALA 10.A O no hydrogen 3.196 N/A ARG 71.A NH2 ASP 11.A O no hydrogen 3.509 N/A ARG 71.A NH2 GLU 16.A OE2 no hydrogen 3.189 N/A ALA 73.A N VAL 92.A O no hydrogen 2.873 N/A LEU 74.A N GLU 49.A O no hydrogen 2.702 N/A ALA 75.A N LEU 90.A O no hydrogen 2.665 N/A ILE 76.A N SER 47.A O no hydrogen 2.907 N/A VAL 77.A N SER 88.A O no hydrogen 2.879 N/A PHE 78.A N CYS 44.A O no hydrogen 2.844 N/A PHE 79.A N ASN 86.A O no hydrogen 2.702 N/A GLY 80.A N ASP 42.A O no hydrogen 2.822 N/A ARG 81.A N ASN 43.A OD1 no hydrogen 2.756 N/A ARG 81.A NE GLY 31.A O no hydrogen 3.376 N/A ARG 81.A NH2 ASP 42.A OD1 no hydrogen 2.874 N/A VAL 87.A N LEU 113.A O no hydrogen 3.181 N/A SER 88.A N VAL 77.A O no hydrogen 2.804 N/A SER 88.A OG ASN 86.A OD1 no hydrogen 2.898 N/A SER 88.A OG VAL 87.A O no hydrogen 2.967 N/A SER 88.A OG ASP 103.A OD1 no hydrogen 3.392 N/A SER 88.A OG THR 105.A OG1 no hydrogen 3.262 N/A GLU 89.A N THR 105.A OG1 no hydrogen 2.594 N/A LEU 90.A N ALA 75.A O no hydrogen 2.632 N/A VAL 91.A N ARG 102.A O no hydrogen 2.730 N/A VAL 92.A N ALA 73.A O no hydrogen 2.885 N/A GLY 93.A N TYR 100.A O no hydrogen 3.195 N/A LEU 95.A N ARG 71.A O no hydrogen 3.084 N/A HIS 97.A N PRO 94.A O no hydrogen 3.197 N/A SER 99.A N GLY 93.A O no hydrogen 2.964 N/A TYR 100.A N GLY 93.A O no hydrogen 2.980 N/A TYR 100.A OH GLU 72.A OE2 no hydrogen 2.595 N/A ARG 102.A N VAL 91.A O no hydrogen 2.794 N/A ARG 102.A NH1 GLU 72.A OE2 no hydrogen 3.003 N/A VAL 104.A N GLU 89.A O no hydrogen 3.014 N/A THR 105.A OG1 GLU 89.A O no hydrogen 3.499 N/A THR 105.A OG1 ASP 103.A OD1 no hydrogen 2.945 N/A GLU 107.A N VAL 104.A O no hydrogen 3.021 N/A ARG 108.A N VAL 104.A O no hydrogen 3.063 N/A ARG 108.A NH2 GLN 51.A OE1 no hydrogen 2.783 N/A HIS 109.A N THR 105.A O no hydrogen 2.981 N/A HIS 109.A NE2 GLU 89.A OE1 no hydrogen 2.472 N/A GLY 110.A N VAL 106.A O no hydrogen 2.820 N/A TYR 115.A OH PRO 40.A O no hydrogen 3.025 N/A HIS 116.A NE2 ASP 600.A OD2 no hydrogen 2.533 N/A ARG 117.A N PRO 114.A O no hydrogen 3.168 N/A ARG 117.A NH1 THR 605.A OG1 no hydrogen 3.295 N/A ARG 118.A N TYR 115.A O no hydrogen 3.058 N/A ARG 118.A NH1 TYR 115.A O no hydrogen 3.270 N/A PHE 122.A N GLU 367.A OE1 no hydrogen 2.603 N/A GLN 123.A NE2 ALA 36.A O no hydrogen 3.497 N/A TYR 125.A N LEU 121.A O no hydrogen 3.020 N/A LEU 126.A N PHE 122.A O no hydrogen 3.004 N/A ASP 127.A N GLN 123.A O no hydrogen 2.636 N/A ILE 128.A N GLU 124.A O no hydrogen 2.809 N/A ASP 129.A N TYR 125.A O no hydrogen 2.835 N/A GLN 130.A N LEU 126.A O no hydrogen 3.063 N/A GLN 130.A N ASP 127.A O no hydrogen 3.189 N/A MET 131.A N ASP 127.A O no hydrogen 3.017 N/A ILE 132.A N ILE 128.A O no hydrogen 2.818 N/A PHE 133.A N ASP 129.A O no hydrogen 2.905 N/A ASN 134.A N GLN 130.A O no hydrogen 2.802 N/A ARG 135.A NH2 ALA 206.A O no hydrogen 3.562 N/A LEU 137.A N ILE 132.A O no hydrogen 3.108 N/A GLN 139.A NE2 ARG 135.A O no hydrogen 3.120 N/A ALA 140.A N LEU 137.A O no hydrogen 3.107 N/A SER 141.A N PRO 138.A O no hydrogen 2.717 N/A GLY 142.A N GLU 227.A OE2 no hydrogen 2.485 N/A LEU 143.A N GLU 227.A OE1 no hydrogen 3.225 N/A LEU 144.A N ALA 140.A O no hydrogen 3.268 N/A HIS 145.A N SER 141.A O no hydrogen 2.903 N/A HIS 145.A N GLY 142.A O no hydrogen 2.904 N/A HIS 146.A N GLY 142.A O no hydrogen 3.182 N/A HIS 146.A N LEU 143.A O no hydrogen 2.757 N/A CYS 147.A N LEU 143.A O no hydrogen 2.822 N/A CYS 147.A SG LEU 143.A O no hydrogen 3.430 N/A CYS 147.A SG TYR 215.A OH no hydrogen 3.339 N/A CYS 148.A N LEU 144.A O no hydrogen 3.270 N/A TYR 150.A N LEU 144.A O no hydrogen 2.853 N/A ASN 156.A ND2 GLY 154.A O no hydrogen 2.409 N/A LEU 157.A N GLY 154.A O no hydrogen 2.561 N/A THR 159.A OG1 ASP 129.A OD1 no hydrogen 2.823 N/A THR 161.A OG1 THR 162.A O no hydrogen 2.905 N/A THR 162.A OG1 TRP 175.A O no hydrogen 3.209 N/A ARG 165.A NE THR 174.A OG1 no hydrogen 2.466 N/A ARG 165.A NH2 TYR 125.A OH no hydrogen 3.462 N/A LEU 167.A N ASP 171.A OD2 no hydrogen 2.792 N/A SER 169.A OG ASP 600.A OD1 no hydrogen 3.063 N/A SER 169.A OG ASP 600.A OD2 no hydrogen 2.750 N/A GLY 170.A N ASP 600.A OD2 no hydrogen 3.344 N/A ASP 171.A N GLN 168.A O no hydrogen 3.402 N/A ARG 172.A NE GLU 124.A OE2 no hydrogen 2.664 N/A ARG 172.A NH1 ARG 118.A O no hydrogen 3.119 N/A ARG 172.A NH2 ARG 118.A O no hydrogen 3.319 N/A ARG 172.A NH2 PRO 119.A O no hydrogen 3.135 N/A ARG 172.A NH2 GLU 124.A OE1 no hydrogen 3.013 N/A ARG 172.A NH2 GLU 124.A OE2 no hydrogen 3.057 N/A ALA 173.A N ARG 165.A O no hydrogen 3.165 N/A THR 174.A N VAL 198.A O no hydrogen 2.963 N/A THR 174.A OG1 HIS 200.A NE2 no hydrogen 2.879 N/A TRP 175.A N THR 162.A OG1 no hydrogen 3.229 N/A PHE 176.A N LEU 196.A O no hydrogen 2.702 N/A GLY 177.A N MET 160.A O no hydrogen 3.172 N/A LEU 178.A N LEU 194.A O no hydrogen 3.223 N/A TYR 179.A N VAL 158.A O no hydrogen 2.910 N/A TYR 180.A N HIS 190.A O no hydrogen 2.828 N/A TYR 180.A OH ILE 240.A O no hydrogen 2.769 N/A ASN 181.A ND2 ARG 155.A O no hydrogen 3.632 N/A GLY 186.A N TYR 442.A OH no hydrogen 3.289 N/A HIS 190.A N PHE 187.A O no hydrogen 3.225 N/A HIS 190.A NE2 SER 248.A O no hydrogen 2.346 N/A VAL 192.A N LEU 178.A O no hydrogen 3.125 N/A GLU 195.A N PHE 214.A O no hydrogen 2.963 N/A LEU 196.A N PHE 176.A O no hydrogen 3.017 N/A LEU 197.A N LYS 212.A O no hydrogen 3.033 N/A VAL 198.A N THR 174.A O no hydrogen 3.064 N/A ASN 199.A N THR 209.A O no hydrogen 2.964 N/A HIS 200.A N ARG 172.A O no hydrogen 2.972 N/A HIS 200.A NE2 THR 174.A OG1 no hydrogen 2.879 N/A LYS 201.A N ASN 199.A OD1 no hydrogen 3.501 N/A LYS 201.A NZ GLY 170.A O no hydrogen 3.051 N/A ARG 207.A N ASP 204.A O no hydrogen 2.601 N/A ARG 207.A NH2 ASP 204.A OD2 no hydrogen 3.355 N/A TRP 208.A N PRO 205.A O no hydrogen 2.864 N/A TRP 208.A NE1 ALA 202.A O no hydrogen 2.708 N/A THR 209.A N ASN 199.A O no hydrogen 3.415 N/A THR 209.A OG1 ARG 207.A O no hydrogen 3.466 N/A GLN 211.A N LEU 197.A O no hydrogen 2.941 N/A VAL 213.A N TYR 220.A O no hydrogen 3.161 N/A PHE 214.A N GLU 195.A O no hydrogen 2.964 N/A TYR 215.A N ARG 218.A O no hydrogen 3.044 N/A GLN 216.A N GLY 193.A O no hydrogen 2.921 N/A GLN 216.A NE2 VAL 238.A O no hydrogen 2.759 N/A GLY 217.A N TYR 215.A O no hydrogen 2.336 N/A ARG 218.A N TYR 215.A O no hydrogen 2.780 N/A TYR 220.A N VAL 213.A O no hydrogen 3.269 N/A ASP 221.A N GLN 225.A OE1 no hydrogen 3.191 N/A LEU 226.A N SER 222.A O no hydrogen 3.310 N/A GLU 227.A N LEU 223.A O no hydrogen 3.385 N/A ALA 228.A N ALA 224.A O no hydrogen 2.983 N/A GLN 229.A N GLN 225.A O no hydrogen 3.342 N/A PHE 230.A N LEU 226.A O no hydrogen 2.601 N/A GLU 231.A N GLU 227.A O no hydrogen 2.965 N/A ALA 232.A N ALA 228.A O no hydrogen 3.262 N/A GLY 233.A N PHE 230.A O no hydrogen 3.238 N/A VAL 235.A N GLY 233.A O no hydrogen 2.841 N/A VAL 238.A N GLN 216.A OE1 no hydrogen 2.967 N/A GLY 244.A N ASN 243.A OD1 no hydrogen 2.744 N/A TRP 249.A N GLY 246.A O no hydrogen 2.919 N/A SER 250.A N GLY 246.A O no hydrogen 2.564 N/A SER 250.A OG LYS 252.A O no hydrogen 3.313 N/A VAL 255.A N SER 253.A OG no hydrogen 2.757 N/A GLN 264.A NE2 GLN 383.A OE1 no hydrogen 2.896 N/A ARG 271.A NE GLU 382.A OE1 no hydrogen 3.191 N/A ARG 271.A NE GLU 382.A OE2 no hydrogen 2.897 N/A ARG 271.A NH1 ASP 669.A OD1 no hydrogen 3.386 N/A ARG 271.A NH1 ASP 669.A OD2 no hydrogen 3.043 N/A ARG 271.A NH2 GLU 382.A OE2 no hydrogen 2.472 N/A ARG 271.A NH2 ASP 669.A OD2 no hydrogen 3.242 N/A SER 273.A N ALA 280.A O no hydrogen 2.777 N/A GLN 275.A N ARG 278.A O no hydrogen 2.825 N/A SER 277.A OG GLN 7.A OE1 no hydrogen 2.767 N/A SER 277.A OG SER 287.A OG no hydrogen 3.250 N/A ARG 278.A N GLN 275.A O no hydrogen 3.150 N/A ARG 278.A NH1 SER 287.A OG no hydrogen 3.095 N/A ARG 278.A NH2 THR 285.A OG1 no hydrogen 3.125 N/A ARG 278.A NH2 ASP 300.A O no hydrogen 3.151 N/A VAL 279.A N PHE 286.A O no hydrogen 2.825 N/A ALA 280.A N SER 273.A O no hydrogen 2.818 N/A SER 281.A N TRP 284.A O no hydrogen 2.566 N/A LEU 283.A N SER 281.A OG no hydrogen 3.156 N/A TRP 284.A N SER 281.A O no hydrogen 3.207 N/A TRP 284.A NE1 HIS 428.A O no hydrogen 3.087 N/A THR 285.A N ARG 302.A O no hydrogen 3.044 N/A PHE 286.A N VAL 279.A O no hydrogen 3.008 N/A SER 287.A N PHE 299.A O no hydrogen 2.925 N/A SER 287.A OG SER 277.A OG no hydrogen 3.250 N/A PHE 288.A N SER 277.A O no hydrogen 2.902 N/A GLY 289.A N ARG 297.A O no hydrogen 2.951 N/A LEU 290.A N ASP 11.A OD1 no hydrogen 3.303 N/A ALA 292.A N GLU 49.A OE1 no hydrogen 3.000 N/A SER 294.A OG GLY 295.A O no hydrogen 3.203 N/A SER 294.A OG LEU 314.A O no hydrogen 3.465 N/A ARG 297.A NH2 ASP 11.A OD1 no hydrogen 2.791 N/A ILE 298.A N ILE 312.A O no hydrogen 2.781 N/A PHE 299.A N SER 287.A O no hydrogen 2.762 N/A ASP 300.A N TYR 310.A O no hydrogen 2.652 N/A VAL 301.A N VAL 309.A O no hydrogen 2.882 N/A ARG 302.A N THR 285.A O no hydrogen 2.807 N/A ARG 302.A NE ASP 300.A OD1 no hydrogen 3.032 N/A ARG 302.A NH2 ASP 300.A OD1 no hydrogen 3.030 N/A PHE 303.A N GLU 306.A O no hydrogen 2.904 N/A GLN 304.A N LEU 283.A O no hydrogen 2.868 N/A GLU 306.A N PHE 303.A O no hydrogen 2.544 N/A ARG 307.A NE ASP 300.A OD1 no hydrogen 2.783 N/A ARG 307.A NH1 ASP 63.A OD2 no hydrogen 2.897 N/A ARG 307.A NH2 ASP 63.A OD1 no hydrogen 3.227 N/A ARG 307.A NH2 ASP 63.A OD2 no hydrogen 3.458 N/A ARG 307.A NH2 ASP 300.A OD1 no hydrogen 3.225 N/A LEU 308.A N VAL 301.A O no hydrogen 2.876 N/A TYR 310.A N ASP 477.A O no hydrogen 2.947 N/A ILE 312.A N ILE 298.A O no hydrogen 2.965 N/A SER 313.A N LYS 475.A O no hydrogen 3.080 N/A SER 313.A OG GLU 311.A OE2 no hydrogen 3.018 N/A GLN 315.A N HIS 473.A O no hydrogen 2.805 N/A GLN 315.A NE2 SER 313.A O no hydrogen 3.044 N/A GLN 315.A NE2 SER 313.A OG no hydrogen 3.092 N/A ALA 317.A N GLU 316.A OE1 no hydrogen 3.384 N/A LEU 318.A N SER 471.A O no hydrogen 2.987 N/A ALA 319.A N TYR 333.A O no hydrogen 3.234 N/A ILE 320.A N THR 469.A O no hydrogen 3.078 N/A TYR 321.A N THR 331.A O no hydrogen 3.121 N/A GLY 322.A N VAL 467.A O no hydrogen 2.782 N/A ASN 324.A ND2 PHE 449.A O no hydrogen 2.477 N/A ALA 327.A N GLU 195.A OE1 no hydrogen 2.945 N/A MET 329.A N SER 325.A O no hydrogen 3.003 N/A THR 330.A N ALA 327.A O no hydrogen 3.074 N/A THR 330.A OG1 PRO 326.A O no hydrogen 3.501 N/A THR 331.A N ALA 327.A O no hydrogen 3.158 N/A THR 331.A OG1 ALA 327.A O no hydrogen 2.738 N/A ARG 332.A NH1 TYR 321.A O no hydrogen 2.770 N/A ARG 332.A NH1 THR 331.A O no hydrogen 3.361 N/A TYR 333.A N ALA 319.A O no hydrogen 2.890 N/A TYR 333.A OH THR 161.A O no hydrogen 2.558 N/A ASP 335.A N ALA 317.A O no hydrogen 3.014 N/A GLY 336.A N GLU 316.A OE1 no hydrogen 2.873 N/A GLY 337.A N VAL 334.A O no hydrogen 2.874 N/A PHE 338.A N ASP 335.A O no hydrogen 3.352 N/A GLY 339.A N ASP 335.A O no hydrogen 2.986 N/A MET 340.A N PHE 293.A O no hydrogen 2.877 N/A GLY 341.A N ALA 292.A O no hydrogen 2.923 N/A LYS 342.A N ALA 292.A O no hydrogen 2.827 N/A LYS 342.A NZ GLU 367.A OE2 no hydrogen 3.204 N/A TYR 343.A N GLY 339.A O no hydrogen 3.058 N/A THR 344.A N GLY 341.A O no hydrogen 2.553 N/A THR 344.A OG1 MET 340.A O no hydrogen 2.922 N/A THR 345.A N MET 414.A O no hydrogen 3.034 N/A THR 345.A OG1 PRO 346.A O no hydrogen 3.387 N/A LEU 347.A N ASP 376.A O no hydrogen 3.362 N/A THR 348.A N ASP 352.A OD2 no hydrogen 3.110 N/A VAL 351.A N THR 348.A O no hydrogen 2.966 N/A ASP 352.A N THR 348.A O no hydrogen 3.007 N/A CYS 353.A SG ASP 352.A O no hydrogen 2.775 N/A TYR 355.A OH PRO 701.A O no hydrogen 2.578 N/A ALA 357.A N PRO 354.A O no hydrogen 3.138 N/A THR 358.A N VAL 380.A O no hydrogen 2.871 N/A TYR 359.A OH CYS 353.A O no hydrogen 3.268 N/A TRP 362.A N ILE 374.A O no hydrogen 2.913 N/A HIS 363.A ND1 THR 373.A OG1 no hydrogen 2.931 N/A PHE 364.A N LYS 372.A O no hydrogen 2.711 N/A GLU 367.A N PHE 46.A O no hydrogen 2.883 N/A SER 368.A OG ALA 370.A O no hydrogen 2.651 N/A ALA 370.A N SER 368.A OG no hydrogen 2.826 N/A LYS 372.A N PHE 364.A O no hydrogen 2.645 N/A THR 373.A OG1 HIS 363.A ND1 no hydrogen 2.931 N/A ILE 374.A N TRP 362.A O no hydrogen 3.006 N/A ASP 376.A N ASP 361.A OD1 no hydrogen 2.894 N/A PHE 378.A N VAL 360.A O no hydrogen 3.285 N/A CYS 379.A N ARG 412.A O no hydrogen 2.897 N/A CYS 379.A SG ARG 412.A O no hydrogen 3.964 N/A VAL 380.A N THR 358.A O no hydrogen 2.757 N/A PHE 381.A N VAL 410.A O no hydrogen 3.231 N/A GLU 382.A N TYR 266.A OH no hydrogen 3.031 N/A GLN 383.A N VAL 408.A O no hydrogen 2.787 N/A ASN 384.A N GLN 264.A OE1 no hydrogen 2.909 N/A GLN 385.A N GLU 406.A O no hydrogen 2.952 N/A LEU 389.A N LEU 404.A O no hydrogen 2.728 N/A ARG 390.A N LEU 404.A O no hydrogen 3.467 N/A ARG 390.A NE SER 664.A OG no hydrogen 2.641 N/A ARG 390.A NH2 SER 664.A O no hydrogen 2.899 N/A HIS 392.A N GLY 402.A O no hydrogen 2.796 N/A SER 394.A N TYR 400.A O no hydrogen 2.937 N/A SER 394.A OG SER 398.A O no hydrogen 2.399 N/A SER 398.A N LEU 396.A O no hydrogen 2.710 N/A PHE 401.A N PHE 673.A O no hydrogen 2.876 N/A GLY 402.A N HIS 392.A O no hydrogen 3.135 N/A GLY 403.A N ILE 671.A O no hydrogen 2.845 N/A LEU 404.A N ARG 390.A O no hydrogen 3.027 N/A GLU 406.A N LEU 387.A O no hydrogen 2.949 N/A LEU 409.A N PHE 427.A O no hydrogen 3.114 N/A VAL 410.A N PHE 381.A O no hydrogen 2.750 N/A VAL 411.A N THR 425.A O no hydrogen 2.930 N/A ARG 412.A N CYS 379.A O no hydrogen 3.039 N/A ARG 412.A NE ASP 424.A OD1 no hydrogen 2.680 N/A ARG 412.A NH1 ASP 352.A O no hydrogen 2.943 N/A ARG 412.A NH2 ASP 424.A OD2 no hydrogen 3.075 N/A SER 413.A N TRP 423.A O no hydrogen 3.404 N/A SER 415.A OG MET 340.A O no hydrogen 2.414 N/A THR 416.A N TYR 343.A O no hydrogen 3.069 N/A THR 416.A OG1 ASP 420.A OD1 no hydrogen 2.525 N/A ASN 419.A ND2 TYR 442.A O no hydrogen 2.889 N/A TYR 421.A N SER 415.A O no hydrogen 3.095 N/A TYR 421.A OH ASP 335.A OD2 no hydrogen 2.932 N/A TRP 423.A N SER 413.A O no hydrogen 2.955 N/A TRP 423.A NE1 SER 415.A OG no hydrogen 3.132 N/A ASP 424.A N ARG 436.A O no hydrogen 3.328 N/A THR 425.A N VAL 411.A O no hydrogen 3.199 N/A THR 425.A OG1 ASP 424.A O no hydrogen 2.946 N/A VAL 426.A N GLU 434.A O no hydrogen 2.626 N/A PHE 427.A N LEU 409.A O no hydrogen 2.824 N/A HIS 428.A N ALA 432.A O no hydrogen 2.874 N/A HIS 428.A ND1 GLU 406.A OE2 no hydrogen 2.388 N/A HIS 428.A NE2 GLU 434.A OE1 no hydrogen 2.868 N/A GLY 431.A N HIS 428.A O no hydrogen 2.979 N/A ILE 433.A N LEU 653.A O no hydrogen 2.908 N/A GLU 434.A N VAL 426.A O no hydrogen 2.822 N/A ILE 435.A N PHE 651.A O no hydrogen 3.025 N/A ARG 436.A N ASP 424.A O no hydrogen 3.356 N/A TYR 438.A N VAL 422.A O no hydrogen 2.935 N/A THR 440.A N ASP 420.A O no hydrogen 3.104 N/A THR 440.A OG1 ASP 420.A O no hydrogen 3.055 N/A TYR 442.A N ASN 419.A O no hydrogen 2.969 N/A SER 445.A OG PHE 188.A O no hydrogen 2.965 N/A SER 445.A OG LEU 189.A O no hydrogen 3.560 N/A ALA 446.A N LEU 464.A O no hydrogen 2.894 N/A LEU 448.A N HIS 462.A O no hydrogen 2.636 N/A THR 452.A OG1 GLY 450.A O no hydrogen 3.258 N/A LYS 454.A N ALA 451.A O no hydrogen 2.967 N/A TYR 455.A N THR 452.A O no hydrogen 2.519 N/A GLN 458.A NE2 SER 460.A O no hydrogen 3.532 N/A VAL 459.A N THR 463.A O no hydrogen 2.961 N/A THR 463.A N SER 460.A O no hydrogen 2.835 N/A THR 463.A OG1 LEU 189.A O no hydrogen 3.177 N/A THR 463.A OG1 SER 460.A OG no hydrogen 3.076 N/A THR 463.A OG1 GLU 461.A O no hydrogen 2.781 N/A LEU 464.A N ALA 446.A O no hydrogen 3.001 N/A GLY 465.A N ASN 457.A O no hydrogen 2.811 N/A THR 466.A OG1 SER 444.A O no hydrogen 2.933 N/A HIS 468.A N HIS 632.A O no hydrogen 2.918 N/A THR 469.A N ILE 320.A O no hydrogen 2.729 N/A HIS 470.A N PHE 630.A O no hydrogen 2.724 N/A HIS 473.A N GLU 316.A O no hydrogen 2.942 N/A PHE 474.A N VAL 626.A O no hydrogen 2.905 N/A LYS 475.A N SER 313.A O no hydrogen 3.285 N/A LYS 475.A NZ PRO 590.A O no hydrogen 2.647 N/A VAL 476.A N ALA 624.A O no hydrogen 2.788 N/A ASP 477.A N GLU 311.A O no hydrogen 3.023 N/A ASP 479.A N LEU 308.A O no hydrogen 3.092 N/A VAL 480.A N ASN 485.A OD1 no hydrogen 3.204 N/A GLU 484.A N GLU 484.A OE1 no hydrogen 2.677 N/A ASN 485.A N LYS 620.A O no hydrogen 2.724 N/A TRP 486.A N ALA 538.A O no hydrogen 2.768 N/A TRP 488.A N TYR 536.A O no hydrogen 2.923 N/A ALA 489.A N LYS 515.A O no hydrogen 2.843 N/A GLU 490.A N TYR 534.A O no hydrogen 2.663 N/A ASP 491.A N THR 513.A O no hydrogen 3.013 N/A MET 492.A N ASP 491.A OD1 no hydrogen 3.020 N/A VAL 493.A N GLN 511.A O no hydrogen 2.898 N/A VAL 495.A N ARG 509.A O no hydrogen 2.645 N/A MET 497.A N LEU 507.A O no hydrogen 2.817 N/A VAL 499.A N HIS 505.A O no hydrogen 2.831 N/A SER 502.A N VAL 499.A O no hydrogen 3.221 N/A SER 502.A OG HIS 505.A ND1 no hydrogen 2.995 N/A HIS 505.A N SER 502.A O no hydrogen 2.887 N/A HIS 505.A ND1 SER 502.A O no hydrogen 3.338 N/A LEU 507.A N MET 497.A O no hydrogen 2.722 N/A ARG 509.A N VAL 495.A O no hydrogen 2.547 N/A GLN 511.A N VAL 493.A O no hydrogen 2.747 N/A THR 513.A N ASP 491.A O no hydrogen 3.271 N/A ARG 514.A NH1 GLU 490.A OE2 no hydrogen 3.116 N/A LYS 515.A N ALA 489.A O no hydrogen 2.993 N/A LEU 517.A N VAL 487.A O no hydrogen 2.932 N/A GLU 518.A N GLN 522.A OE1 no hydrogen 2.948 N/A GLU 520.A N GLU 615.A O no hydrogen 2.769 N/A GLN 522.A N MET 519.A O no hydrogen 2.899 N/A ALA 523.A N GLU 520.A O no hydrogen 2.919 N/A ALA 524.A N GLU 521.A O no hydrogen 3.084 N/A PHE 525.A N LEU 580.A O no hydrogen 2.859 N/A VAL 527.A N ARG 577.A O no hydrogen 3.299 N/A ARG 533.A N ASP 491.A OD2 no hydrogen 3.210 N/A ARG 533.A NE ASP 491.A OD1 no hydrogen 2.717 N/A TYR 534.A N GLU 490.A O no hydrogen 2.850 N/A TYR 536.A N TRP 488.A O no hydrogen 3.023 N/A TYR 536.A OH GLU 490.A OE2 no hydrogen 2.611 N/A LEU 537.A N TYR 551.A O no hydrogen 2.853 N/A ALA 538.A N TRP 486.A O no hydrogen 2.837 N/A SER 539.A N ARG 549.A O no hydrogen 2.981 N/A HIS 541.A N SER 539.A OG no hydrogen 2.820 N/A SER 542.A OG ASN 543.A O no hydrogen 2.636 N/A ASN 543.A N HIS 547.A O no hydrogen 2.820 N/A ASN 543.A ND2 PHE 659.A O no hydrogen 2.982 N/A LYS 544.A N ASP 660.A OD1 no hydrogen 2.953 N/A TRP 545.A N ASN 543.A OD1 no hydrogen 3.265 N/A TRP 545.A NE1 ASP 660.A O no hydrogen 3.320 N/A GLY 546.A N ASN 543.A O no hydrogen 3.376 N/A HIS 547.A N ASN 543.A OD1 no hydrogen 2.982 N/A ARG 549.A N HIS 541.A O no hydrogen 3.267 N/A ARG 549.A NE PHE 658.A O no hydrogen 2.972 N/A ARG 549.A NH2 GLU 306.A OE1 no hydrogen 3.239 N/A ARG 549.A NH2 PHE 658.A O no hydrogen 3.337 N/A TYR 551.A N LEU 537.A O no hydrogen 2.733 N/A TYR 551.A OH GLY 431.A O no hydrogen 2.348 N/A ARG 552.A N ARG 654.A O no hydrogen 2.568 N/A ARG 552.A NE ARG 533.A O no hydrogen 3.340 N/A ILE 553.A N LEU 535.A O no hydrogen 2.965 N/A GLN 554.A N PHE 652.A O no hydrogen 2.920 N/A LEU 556.A N GLY 650.A O no hydrogen 2.977 N/A PHE 558.A N GLY 629.A O no hydrogen 2.923 N/A ALA 559.A N SER 557.A OG no hydrogen 3.269 N/A LEU 563.A N GLU 576.A OE1 no hydrogen 2.799 N/A ASN 566.A ND2 ASN 566.A O no hydrogen 3.070 N/A SER 567.A N PRO 564.A O no hydrogen 3.296 N/A ALA 570.A N SER 567.A O no hydrogen 2.758 N/A GLY 572.A N MET 569.A O no hydrogen 3.390 N/A PHE 573.A N ALA 570.A O no hydrogen 3.103 N/A SER 574.A OG ASP 607.A OD1 no hydrogen 2.721 N/A GLU 576.A N PHE 573.A O no hydrogen 3.084 N/A ARG 577.A N SER 574.A O no hydrogen 3.420 N/A TYR 578.A N TRP 575.A O no hydrogen 3.241 N/A GLN 579.A N PHE 525.A O no hydrogen 2.812 N/A GLN 579.A NE2 LEU 526.A O no hydrogen 2.820 N/A LEU 580.A N PHE 525.A O no hydrogen 3.465 N/A THR 583.A N VAL 623.A O no hydrogen 3.100 N/A THR 583.A OG1 VAL 623.A O no hydrogen 3.526 N/A GLN 584.A N GLU 520.A OE2 no hydrogen 2.678 N/A GLN 584.A NE2 THR 616.A O no hydrogen 3.031 N/A ARG 585.A N ASP 621.A O no hydrogen 3.050 N/A ARG 585.A NH1 ASP 477.A OD2 no hydrogen 2.990 N/A ARG 585.A NH2 GLU 587.A OE2 no hydrogen 2.894 N/A LYS 586.A NZ GLU 615.A OE2 no hydrogen 2.965 N/A GLU 588.A N GLU 588.A OE2 no hydrogen 3.022 N/A SER 591.A OG GLN 315.A OE1 no hydrogen 3.085 N/A SER 591.A OG PRO 590.A O no hydrogen 3.311 N/A SER 592.A N GLN 315.A OE1 no hydrogen 2.642 N/A SER 592.A OG HIS 473.A ND1 no hydrogen 2.578 N/A SER 593.A OG GLU 316.A OE2 no hydrogen 1.749 N/A PHE 596.A N SER 594.A OG no hydrogen 3.349 N/A ASN 597.A N SER 594.A O no hydrogen 3.009 N/A ASN 597.A ND2 GLY 572.A O no hydrogen 3.138 N/A ASN 597.A ND2 VAL 606.A O no hydrogen 2.833 N/A GLN 598.A NE2 GLN 598.A O no hydrogen 3.213 N/A ASN 599.A ND2 ARG 118.A O no hydrogen 3.230 N/A ASP 600.A N ASN 597.A O no hydrogen 3.014 N/A ALA 603.A N ASP 600.A O no hydrogen 3.174 N/A ALA 603.A N ASP 600.A OD1 no hydrogen 2.822 N/A THR 605.A N ASN 597.A OD1 no hydrogen 2.838 N/A THR 605.A OG1 PHE 596.A O no hydrogen 3.336 N/A VAL 606.A N ASN 597.A OD1 no hydrogen 3.058 N/A SER 609.A N ASP 607.A OD1 no hydrogen 3.354 N/A SER 609.A OG ASP 607.A OD1 no hydrogen 2.827 N/A ASP 610.A N ASP 607.A O no hydrogen 2.531 N/A PHE 611.A N PHE 608.A O no hydrogen 3.187 N/A ILE 612.A N SER 609.A O no hydrogen 3.417 N/A ASN 613.A N GLU 520.A OE1 no hydrogen 3.229 N/A ILE 617.A N GLU 518.A O no hydrogen 3.103 N/A ALA 618.A N THR 616.A OG1 no hydrogen 2.630 N/A LYS 620.A N ASN 485.A O no hydrogen 2.819 N/A VAL 623.A N THR 583.A O no hydrogen 3.113 N/A ALA 624.A N VAL 476.A O no hydrogen 2.580 N/A TRP 625.A N ALA 581.A O no hydrogen 2.920 N/A TRP 625.A NE1 THR 583.A OG1 no hydrogen 2.573 N/A THR 627.A N GLN 579.A O no hydrogen 2.938 N/A THR 627.A OG1 TRP 575.A O no hydrogen 2.927 N/A THR 627.A OG1 TYR 578.A O no hydrogen 2.450 N/A ALA 628.A N ALA 472.A O no hydrogen 2.957 N/A PHE 630.A N HIS 470.A O no hydrogen 2.911 N/A HIS 632.A N HIS 468.A O no hydrogen 2.717 N/A HIS 632.A ND1 HIS 468.A NE2 no hydrogen 2.795 N/A HIS 632.A NE2 ASP 638.A OD2 no hydrogen 2.768 N/A HIS 635.A N ASP 638.A OD2 no hydrogen 3.275 N/A HIS 635.A ND1 ILE 633.A O no hydrogen 2.625 N/A GLU 637.A N GLU 637.A OE1 no hydrogen 2.672 N/A ASP 638.A N HIS 635.A O no hydrogen 2.949 N/A ILE 639.A N ALA 636.A O no hydrogen 3.106 N/A THR 642.A N GLY 441.A O no hydrogen 2.974 N/A ASN 647.A N THR 644.A O no hydrogen 2.715 N/A VAL 649.A N PHE 437.A O no hydrogen 3.156 N/A PHE 651.A N ILE 435.A O no hydrogen 3.106 N/A PHE 652.A N GLN 554.A O no hydrogen 2.839 N/A LEU 653.A N ILE 433.A O no hydrogen 2.783 N/A ARG 654.A N ARG 552.A O no hydrogen 2.787 N/A TYR 656.A N GLY 550.A O no hydrogen 2.705 N/A TYR 656.A OH GLU 490.A OE1 no hydrogen 2.377 N/A SER 664.A N ASP 662.A OD1 no hydrogen 2.867 N/A SER 664.A OG ASP 662.A OD2 no hydrogen 2.546 N/A PHE 665.A N ASP 662.A O no hydrogen 2.951 N/A TYR 666.A N PRO 663.A O no hydrogen 3.003 N/A TYR 666.A OH GLU 661.A OE1 no hydrogen 3.330 N/A SER 667.A N SER 664.A O no hydrogen 3.130 N/A ASP 669.A N SER 667.A OG no hydrogen 2.964 N/A ILE 671.A N GLY 403.A O no hydrogen 2.657 N/A PHE 673.A N PHE 401.A O no hydrogen 2.859 N/A ARG 674.A N GLN 677.A OE1 no hydrogen 2.954 N/A GLY 675.A N HIS 399.A O no hydrogen 2.519 N/A GLN 677.A N ARG 674.A O no hydrogen 3.290 N/A GLY 680.A N ASP 678.A OD1 no hydrogen 2.841 N/A CYS 682.A SG GLN 692.A OE1 no hydrogen 3.632 N/A GLU 683.A N GLU 683.A OE1 no hydrogen 2.477 N/A VAL 684.A N ALA 681.A O no hydrogen 3.096 N/A ASN 685.A N ALA 681.A O no hydrogen 3.059 N/A ASN 685.A ND2 ALA 679.A O no hydrogen 3.211 N/A LEU 687.A N ASN 685.A OD1 no hydrogen 3.321 N/A ALA 688.A N ASN 685.A O no hydrogen 2.901 N/A CYS 689.A N PRO 686.A O no hydrogen 3.072 N/A CYS 689.A SG CYS 682.A O no hydrogen 3.021 N/A CYS 689.A SG ASN 685.A O no hydrogen 3.775 N/A CYS 689.A SG PRO 686.A O no hydrogen 3.461 N/A LEU 690.A N LEU 687.A O no hydrogen 3.221 N/A ALA 693.A N CYS 689.A O no hydrogen 3.280 N/A ALA 695.A N LEU 690.A O no hydrogen 3.350 N/A SER 704.A OG ALA 702.A O no hydrogen 2.938 N/A