Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4hg6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N VAL 1.A O no hydrogen 3.001 N/A LEU 5.A N VAL 2.A O no hydrogen 3.176 N/A LEU 6.A N VAL 2.A O no hydrogen 3.365 N/A PHE 7.A N PRO 3.A O no hydrogen 3.250 N/A LEU 8.A N VAL 4.A O no hydrogen 3.293 N/A LEU 9.A N LEU 5.A O no hydrogen 2.880 N/A TRP 10.A N LEU 6.A O no hydrogen 3.060 N/A VAL 11.A N PHE 7.A O no hydrogen 2.816 N/A ALA 12.A N LEU 8.A O no hydrogen 2.717 N/A LEU 13.A N LEU 9.A O no hydrogen 2.809 N/A LEU 14.A N TRP 10.A O no hydrogen 3.279 N/A LEU 14.A N VAL 11.A O no hydrogen 3.127 N/A VAL 15.A N ALA 12.A O no hydrogen 2.978 N/A PHE 17.A N LEU 13.A O no hydrogen 3.371 N/A GLY 18.A N LEU 14.A O no hydrogen 2.556 N/A LEU 19.A N VAL 15.A O no hydrogen 3.053 N/A LEU 20.A N PRO 16.A O no hydrogen 3.111 N/A ALA 21.A N PHE 17.A O no hydrogen 3.000 N/A ALA 22.A N GLY 18.A O no hydrogen 3.180 N/A ALA 23.A N LEU 20.A O no hydrogen 2.918 N/A GLN 30.A N ALA 26.A O no hydrogen 2.925 N/A GLN 30.A NE2 ALA 438.A O no hydrogen 3.540 N/A GLY 31.A N PRO 27.A O no hydrogen 2.690 N/A LEU 32.A N SER 28.A O no hydrogen 3.109 N/A LEU 32.A N ALA 29.A O no hydrogen 2.935 N/A ILE 33.A N ALA 29.A O no hydrogen 3.326 N/A ALA 34.A N GLN 30.A O no hydrogen 3.038 N/A LEU 35.A N GLY 31.A O no hydrogen 2.993 N/A SER 36.A N LEU 32.A O no hydrogen 3.009 N/A SER 36.A OG LEU 32.A O no hydrogen 3.343 N/A ALA 37.A N ILE 33.A O no hydrogen 2.913 N/A VAL 38.A N ALA 34.A O no hydrogen 2.830 N/A VAL 39.A N LEU 35.A O no hydrogen 2.877 N/A LEU 40.A N SER 36.A O no hydrogen 2.845 N/A VAL 41.A N ALA 37.A O no hydrogen 3.012 N/A ALA 42.A N VAL 38.A O no hydrogen 3.112 N/A LEU 43.A N VAL 39.A O no hydrogen 3.030 N/A LEU 44.A N LEU 40.A O no hydrogen 2.875 N/A LEU 44.A N VAL 41.A O no hydrogen 3.195 N/A LYS 45.A N VAL 41.A O no hydrogen 2.828 N/A LYS 45.A N ALA 42.A O no hydrogen 3.286 N/A PHE 47.A N LEU 44.A O no hydrogen 2.992 N/A ALA 48.A N LYS 45.A O no hydrogen 3.082 N/A ARG 54.A N LYS 50.A O no hydrogen 3.267 N/A ARG 54.A NE ALA 48.A O no hydrogen 3.026 N/A ARG 54.A NH2 ASP 49.A O no hydrogen 2.672 N/A PHE 55.A N MET 51.A O no hydrogen 2.780 N/A LEU 56.A N VAL 52.A O no hydrogen 2.813 N/A LEU 57.A N PRO 53.A O no hydrogen 2.764 N/A LEU 58.A N ARG 54.A O no hydrogen 2.837 N/A SER 59.A N PHE 55.A O no hydrogen 2.884 N/A SER 59.A OG PHE 55.A O no hydrogen 3.374 N/A ALA 60.A N LEU 56.A O no hydrogen 2.770 N/A ALA 61.A N LEU 57.A O no hydrogen 2.892 N/A SER 62.A N LEU 58.A O no hydrogen 2.964 N/A SER 62.A OG SER 59.A O no hydrogen 2.446 N/A MET 63.A N SER 59.A O no hydrogen 3.315 N/A MET 63.A N ALA 60.A O no hydrogen 3.038 N/A LEU 64.A N ALA 61.A O no hydrogen 2.966 N/A VAL 65.A N ALA 61.A O no hydrogen 3.411 N/A MET 66.A N SER 62.A O no hydrogen 3.065 N/A ARG 67.A N MET 63.A O no hydrogen 3.330 N/A ARG 67.A NE ALA 21.A O no hydrogen 3.152 N/A ARG 67.A NH1 TYR 439.A OH no hydrogen 3.181 N/A TYR 68.A N LEU 64.A O no hydrogen 2.822 N/A TYR 68.A OH GLU 96.A OE1 no hydrogen 2.848 N/A TYR 68.A OH GLU 96.A OE2 no hydrogen 2.972 N/A TRP 69.A N VAL 65.A O no hydrogen 2.451 N/A TRP 69.A NE1 THR 97.A OG1 no hydrogen 3.268 N/A PHE 70.A N MET 66.A O no hydrogen 2.912 N/A TRP 71.A N ARG 67.A O no hydrogen 2.920 N/A ARG 72.A N TYR 68.A O no hydrogen 2.844 N/A LEU 73.A N TRP 69.A O no hydrogen 2.999 N/A PHE 74.A N PHE 70.A O no hydrogen 2.753 N/A GLU 75.A N TRP 71.A O no hydrogen 3.126 N/A THR 76.A N ARG 72.A O no hydrogen 3.288 N/A THR 76.A OG1 TRP 71.A O no hydrogen 2.712 N/A SER 85.A N ASP 83.A OD1 no hydrogen 2.762 N/A SER 85.A OG GLU 427.A O no hydrogen 2.619 N/A LEU 87.A N ASP 83.A O no hydrogen 3.208 N/A LEU 87.A N ALA 84.A O no hydrogen 3.049 N/A PHE 88.A N ALA 84.A O no hydrogen 2.872 N/A ALA 89.A N SER 85.A O no hydrogen 2.866 N/A LEU 90.A N PHE 86.A O no hydrogen 2.953 N/A LEU 91.A N LEU 87.A O no hydrogen 2.921 N/A LEU 92.A N PHE 88.A O no hydrogen 2.931 N/A PHE 93.A N ALA 89.A O no hydrogen 3.104 N/A ALA 94.A N LEU 90.A O no hydrogen 2.878 N/A VAL 95.A N LEU 91.A O no hydrogen 2.865 N/A GLU 96.A N LEU 92.A O no hydrogen 2.824 N/A THR 97.A N PHE 93.A O no hydrogen 2.639 N/A THR 97.A OG1 PHE 93.A O no hydrogen 2.366 N/A PHE 98.A N ALA 94.A O no hydrogen 2.803 N/A SER 99.A N VAL 95.A O no hydrogen 2.968 N/A SER 99.A OG VAL 95.A O no hydrogen 2.562 N/A SER 99.A OG GLU 96.A O no hydrogen 3.445 N/A ILE 100.A N GLU 96.A O no hydrogen 3.042 N/A SER 101.A N THR 97.A O no hydrogen 2.889 N/A SER 101.A OG THR 97.A O no hydrogen 2.502 N/A ILE 102.A N PHE 98.A O no hydrogen 2.985 N/A PHE 103.A N SER 99.A O no hydrogen 2.659 N/A PHE 104.A N ILE 100.A O no hydrogen 3.129 N/A LEU 105.A N SER 101.A O no hydrogen 2.843 N/A ASN 106.A N ILE 102.A O no hydrogen 2.785 N/A GLY 107.A N PHE 103.A O no hydrogen 2.842 N/A PHE 108.A N PHE 104.A O no hydrogen 2.695 N/A LEU 109.A N LEU 105.A O no hydrogen 3.060 N/A SER 110.A N ASN 106.A O no hydrogen 2.992 N/A SER 110.A OG ASN 106.A O no hydrogen 2.712 N/A ALA 111.A N PHE 108.A O no hydrogen 2.894 N/A THR 114.A OG1 ASP 298.A OD2 no hydrogen 2.483 N/A ARG 116.A NH1 ASP 298.A OD1 no hydrogen 2.381 N/A ARG 116.A NH1 TYR 347.A O no hydrogen 3.556 N/A GLN 123.A N GLU 126.A OE1 no hydrogen 3.084 N/A GLU 126.A N GLN 123.A O no hydrogen 2.625 N/A LEU 127.A N GLN 123.A O no hydrogen 3.258 N/A VAL 130.A N ARG 159.A O no hydrogen 3.336 N/A ASP 131.A N LEU 229.A O no hydrogen 3.032 N/A ILE 132.A N ARG 161.A O no hydrogen 3.127 N/A LEU 133.A N VAL 231.A O no hydrogen 2.963 N/A VAL 134.A N VAL 163.A O no hydrogen 2.587 N/A SER 136.A N LEU 165.A O no hydrogen 2.978 N/A SER 136.A OG GLU 139.A OE1 no hydrogen 3.057 N/A MET 143.A N PRO 140.A O no hydrogen 2.987 N/A LEU 144.A N PRO 140.A O no hydrogen 3.374 N/A SER 145.A N ALA 141.A O no hydrogen 3.002 N/A SER 145.A OG ALA 141.A O no hydrogen 2.986 N/A SER 145.A OG ASP 142.A O no hydrogen 2.977 N/A THR 147.A N MET 143.A O no hydrogen 3.106 N/A THR 147.A OG1 MET 143.A O no hydrogen 3.289 N/A THR 147.A OG1 ALA 235.A O no hydrogen 2.645 N/A LEU 148.A N LEU 144.A O no hydrogen 2.862 N/A ALA 149.A N SER 145.A O no hydrogen 3.118 N/A ALA 150.A N VAL 146.A O no hydrogen 2.908 N/A ALA 151.A N THR 147.A O no hydrogen 2.870 N/A LYS 152.A N LEU 148.A O no hydrogen 2.786 N/A ASN 153.A N ALA 150.A O no hydrogen 3.284 N/A MET 154.A N ALA 151.A O no hydrogen 3.229 N/A ILE 155.A N ARG 241.A O no hydrogen 2.897 N/A TYR 156.A OH PRO 128.A O no hydrogen 2.973 N/A ARG 159.A N PRO 157.A O no hydrogen 2.258 N/A ARG 159.A NH2 PRO 124.A O no hydrogen 3.384 N/A LEU 160.A N PRO 157.A O no hydrogen 3.038 N/A VAL 163.A N ILE 132.A O no hydrogen 3.005 N/A VAL 164.A N VAL 203.A O no hydrogen 3.346 N/A LEU 165.A N VAL 134.A O no hydrogen 2.310 N/A CYS 166.A N SER 205.A O no hydrogen 2.993 N/A CYS 166.A SG TYR 204.A OH no hydrogen 3.528 N/A THR 171.A N ARG 207.A O no hydrogen 2.769 N/A THR 171.A OG1 GLU 208.A O no hydrogen 2.723 N/A ASP 172.A N GLU 208.A O no hydrogen 2.762 N/A GLN 173.A NE2 TYR 137.A OH no hydrogen 3.003 N/A ARG 174.A N GLY 170.A O no hydrogen 3.275 N/A CYS 175.A N THR 171.A O no hydrogen 2.194 N/A MET 176.A N ASP 172.A O no hydrogen 2.786 N/A SER 177.A OG ARG 174.A O no hydrogen 3.333 N/A SER 177.A OG CYS 175.A O no hydrogen 3.053 N/A LYS 185.A N GLU 181.A O no hydrogen 2.901 N/A LYS 185.A NZ GLU 181.A OE1 no hydrogen 2.812 N/A ALA 186.A N LEU 182.A O no hydrogen 2.975 N/A GLN 187.A N ALA 183.A O no hydrogen 2.491 N/A GLU 188.A N GLN 184.A O no hydrogen 2.833 N/A ARG 189.A N LYS 185.A O no hydrogen 3.056 N/A ARG 189.A NH1 ASN 138.A OD1 no hydrogen 3.401 N/A ARG 190.A N ALA 186.A O no hydrogen 2.985 N/A ARG 191.A N GLN 187.A O no hydrogen 2.981 N/A GLU 192.A N GLU 188.A O no hydrogen 3.196 N/A LEU 193.A N ARG 189.A O no hydrogen 2.967 N/A GLN 194.A N ARG 190.A O no hydrogen 3.270 N/A GLN 195.A N ARG 191.A O no hydrogen 2.991 N/A LEU 196.A N GLU 192.A O no hydrogen 2.987 N/A CYS 197.A N LEU 193.A O no hydrogen 2.778 N/A CYS 197.A SG LEU 193.A O no hydrogen 3.082 N/A CYS 197.A SG VAL 203.A O no hydrogen 3.645 N/A ARG 198.A N GLN 194.A O no hydrogen 2.769 N/A GLU 199.A N GLN 195.A O no hydrogen 2.707 N/A LEU 200.A N LEU 196.A O no hydrogen 2.926 N/A LEU 200.A N CYS 197.A O no hydrogen 3.021 N/A GLY 201.A N ARG 198.A O no hydrogen 3.396 N/A VAL 202.A N CYS 197.A O no hydrogen 3.022 N/A VAL 203.A N THR 162.A O no hydrogen 3.135 N/A SER 205.A N VAL 164.A O no hydrogen 3.011 N/A THR 206.A OG1 CYS 166.A O no hydrogen 3.176 N/A THR 206.A OG1 GLY 169.A O no hydrogen 2.554 N/A THR 206.A OG1 ARG 207.A O no hydrogen 3.369 N/A ARG 207.A NH1 GLU 211.A O no hydrogen 2.492 N/A ARG 207.A NH2 ALA 213.A O no hydrogen 3.106 N/A LYS 214.A NZ ASP 234.A OD1 no hydrogen 2.869 N/A LYS 214.A NZ GLY 307.A O no hydrogen 2.952 N/A GLY 216.A N HIS 212.A O no hydrogen 3.353 N/A MET 218.A N LYS 214.A O no hydrogen 3.031 N/A SER 219.A N ALA 215.A O no hydrogen 2.756 N/A SER 219.A OG GLY 216.A O no hydrogen 2.890 N/A ALA 220.A N GLY 216.A O no hydrogen 2.695 N/A ALA 221.A N ASN 217.A O no hydrogen 3.150 N/A LEU 222.A N MET 218.A O no hydrogen 3.253 N/A LEU 222.A N SER 219.A O no hydrogen 2.989 N/A GLU 223.A N SER 219.A O no hydrogen 2.923 N/A ARG 224.A NH1 THR 206.A O no hydrogen 3.517 N/A ARG 224.A NH2 THR 206.A O no hydrogen 3.207 N/A LEU 225.A N ALA 221.A O no hydrogen 3.452 N/A LEU 229.A N THR 129.A O no hydrogen 2.986 N/A VAL 230.A N LEU 312.A O no hydrogen 2.595 N/A VAL 231.A N ASP 131.A O no hydrogen 3.061 N/A VAL 232.A N ALA 310.A O no hydrogen 3.051 N/A HIS 237.A N ASP 234.A O no hydrogen 3.116 N/A VAL 238.A N ALA 354.A O no hydrogen 2.807 N/A SER 240.A N MET 352.A O no hydrogen 3.264 N/A ARG 241.A N GLY 679.A O no hydrogen 2.996 N/A ARG 241.A NE TYR 675.A OH no hydrogen 2.985 N/A PHE 243.A N SER 240.A O no hydrogen 3.246 N/A ARG 246.A N ASP 242.A O no hydrogen 3.301 N/A THR 247.A N PHE 243.A O no hydrogen 3.139 N/A THR 247.A OG1 PHE 243.A O no hydrogen 2.825 N/A VAL 248.A N LEU 244.A O no hydrogen 2.985 N/A TYR 250.A OH PRO 117.A O no hydrogen 2.616 N/A PHE 251.A N VAL 248.A O no hydrogen 3.063 N/A VAL 260.A N VAL 311.A O no hydrogen 2.795 N/A GLN 261.A N LEU 346.A O no hydrogen 3.010 N/A GLN 261.A NE2 THR 262.A O no hydrogen 2.882 N/A GLN 261.A NE2 SER 308.A O no hydrogen 3.439 N/A THR 262.A N ALA 309.A O no hydrogen 3.212 N/A THR 262.A OG1 ALA 309.A O no hydrogen 2.325 N/A HIS 264.A NE2 SER 308.A O no hydrogen 3.146 N/A ILE 267.A N GLY 355.A O no hydrogen 3.000 N/A ASN 268.A ND2 GLN 357.A O no hydrogen 2.726 N/A ILE 272.A N ASP 270.A OD1 no hydrogen 2.669 N/A GLN 273.A N ASP 270.A OD1 no hydrogen 3.261 N/A GLN 273.A NE2 ASP 270.A OD2 no hydrogen 3.388 N/A ARG 274.A N ASP 270.A O no hydrogen 3.226 N/A ARG 274.A NE ASN 275.A OD1 no hydrogen 3.125 N/A ARG 274.A NH1 GLU 359.A O no hydrogen 2.896 N/A ARG 274.A NH2 GLU 359.A O no hydrogen 2.684 N/A ASN 275.A N PRO 271.A O no hydrogen 2.774 N/A ASN 275.A ND2 ALA 560.A O no hydrogen 2.883 N/A ASN 275.A ND2 GLU 563.A OE1 no hydrogen 3.376 N/A LEU 276.A N ILE 272.A O no hydrogen 2.908 N/A ALA 277.A N ARG 274.A O no hydrogen 3.076 N/A LEU 278.A N GLN 273.A O no hydrogen 3.395 N/A CYS 282.A N GLY 279.A O no hydrogen 3.450 N/A CYS 282.A SG PRO 283.A O no hydrogen 3.879 N/A GLU 287.A N PRO 284.A O no hydrogen 3.036 N/A TYR 290.A N ASN 286.A O no hydrogen 2.850 N/A GLY 291.A N GLU 287.A O no hydrogen 2.498 N/A LYS 292.A NZ LEU 454.A O no hydrogen 3.336 N/A ILE 293.A N MET 288.A O no hydrogen 3.389 N/A HIS 294.A N PHE 289.A O no hydrogen 2.833 N/A GLY 296.A N LYS 292.A O no hydrogen 3.024 N/A LEU 297.A N ILE 293.A O no hydrogen 2.727 N/A ASP 298.A N HIS 294.A O no hydrogen 2.934 N/A ARG 299.A N ARG 295.A O no hydrogen 3.057 N/A ARG 299.A NE ASP 112.A O no hydrogen 3.355 N/A ARG 299.A NH2 PRO 113.A O no hydrogen 2.747 N/A GLY 301.A N ASP 298.A O no hydrogen 2.412 N/A GLY 302.A N LEU 297.A O no hydrogen 2.679 N/A CYS 306.A N GLN 261.A OE1 no hydrogen 2.384 N/A CYS 306.A SG TYR 290.A OH no hydrogen 3.667 N/A CYS 306.A SG HIS 294.A NE2 no hydrogen 3.827 N/A CYS 306.A SG PHE 304.A O no hydrogen 3.895 N/A ALA 309.A N VAL 232.A O no hydrogen 2.843 N/A VAL 311.A N VAL 260.A O no hydrogen 3.199 N/A LEU 312.A N VAL 230.A O no hydrogen 2.740 N/A ARG 313.A N PHE 258.A O no hydrogen 2.818 N/A ARG 314.A N GLU 228.A O no hydrogen 2.936 N/A LEU 317.A N ARG 313.A O no hydrogen 3.373 N/A ASP 318.A N ARG 314.A O no hydrogen 2.918 N/A GLU 319.A N ARG 315.A O no hydrogen 2.932 N/A ALA 320.A N ALA 316.A O no hydrogen 3.016 N/A THR 327.A OG1 ILE 328.A O no hydrogen 2.385 N/A ILE 328.A N GLN 377.A OE1 no hydrogen 2.808 N/A ALA 332.A N ASP 331.A OD1 no hydrogen 2.846 N/A GLU 333.A N THR 329.A O no hydrogen 2.982 N/A THR 334.A N GLU 330.A O no hydrogen 3.169 N/A THR 334.A OG1 ASP 331.A O no hydrogen 3.174 N/A ALA 335.A N ASP 331.A O no hydrogen 3.031 N/A LEU 336.A N ALA 332.A O no hydrogen 3.308 N/A GLU 337.A N GLU 333.A O no hydrogen 3.147 N/A ILE 338.A N THR 334.A O no hydrogen 2.725 N/A HIS 339.A N ALA 335.A O no hydrogen 3.051 N/A HIS 339.A ND1 TYR 398.A OH no hydrogen 2.898 N/A SER 340.A N LEU 336.A O no hydrogen 2.838 N/A SER 340.A OG LEU 336.A O no hydrogen 3.534 N/A SER 340.A OG GLU 337.A O no hydrogen 2.829 N/A ARG 341.A N ILE 338.A O no hydrogen 2.856 N/A GLY 342.A N HIS 339.A O no hydrogen 2.913 N/A LYS 344.A NZ ASP 254.A OD2 no hydrogen 2.932 N/A SER 345.A OG ALA 303.A O no hydrogen 2.897 N/A SER 345.A OG HIS 339.A NE2 no hydrogen 2.457 N/A LEU 346.A N LEU 259.A O no hydrogen 3.242 N/A TYR 347.A N ASP 298.A OD1 no hydrogen 3.343 N/A TYR 347.A OH TYR 290.A O no hydrogen 2.952 N/A ILE 348.A N GLN 261.A O no hydrogen 3.118 N/A ALA 354.A N VAL 238.A O no hydrogen 2.821 N/A GLY 355.A N PHE 265.A O no hydrogen 2.663 N/A LEU 356.A N ASP 236.A O no hydrogen 3.025 N/A THR 360.A OG1 SER 363.A OG no hydrogen 2.982 N/A PHE 361.A N GLU 563.A OE2 no hydrogen 2.745 N/A SER 363.A OG THR 360.A OG1 no hydrogen 2.982 N/A PHE 364.A N THR 360.A O no hydrogen 3.257 N/A ILE 365.A N PHE 361.A O no hydrogen 2.799 N/A GLN 366.A N ALA 362.A O no hydrogen 3.012 N/A GLN 366.A NE2 ALA 492.A O no hydrogen 3.497 N/A GLN 367.A N SER 363.A O no hydrogen 3.130 N/A ARG 368.A N PHE 364.A O no hydrogen 2.960 N/A ARG 368.A NH1 GLU 285.A OE1 no hydrogen 2.735 N/A ARG 368.A NH1 GLU 285.A OE2 no hydrogen 3.269 N/A ARG 368.A NH2 GLU 285.A OE2 no hydrogen 2.793 N/A GLY 369.A N ILE 365.A O no hydrogen 2.880 N/A ARG 370.A N GLN 366.A O no hydrogen 2.999 N/A TRP 371.A N GLN 367.A O no hydrogen 2.861 N/A ALA 372.A N ARG 368.A O no hydrogen 3.009 N/A THR 373.A N GLY 369.A O no hydrogen 3.018 N/A THR 373.A OG1 GLY 369.A O no hydrogen 2.690 N/A THR 373.A OG1 ARG 370.A O no hydrogen 3.098 N/A GLY 374.A N ARG 370.A O no hydrogen 2.973 N/A MET 375.A N TRP 371.A O no hydrogen 2.902 N/A MET 376.A N ALA 372.A O no hydrogen 2.716 N/A GLN 377.A N THR 373.A O no hydrogen 2.777 N/A MET 378.A N GLY 374.A O no hydrogen 2.790 N/A LEU 379.A N MET 375.A O no hydrogen 3.010 N/A LEU 380.A N MET 376.A O no hydrogen 2.906 N/A LEU 381.A N GLN 377.A O no hydrogen 2.965 N/A PHE 386.A N ASN 383.A O no hydrogen 3.202 N/A ARG 387.A NH1 GLN 394.A O no hydrogen 3.005 N/A ARG 395.A N GLY 391.A O no hydrogen 2.429 N/A LEU 396.A N ILE 392.A O no hydrogen 2.951 N/A CYS 397.A N ALA 393.A O no hydrogen 2.805 N/A CYS 397.A SG LEU 297.A O no hydrogen 3.783 N/A CYS 397.A SG ALA 393.A O no hydrogen 3.222 N/A TYR 398.A N GLN 394.A O no hydrogen 2.998 N/A TYR 398.A OH HIS 339.A ND1 no hydrogen 2.898 N/A LEU 399.A N ARG 395.A O no hydrogen 3.097 N/A ASN 400.A N LEU 396.A O no hydrogen 2.978 N/A ASN 400.A N CYS 397.A O no hydrogen 3.143 N/A SER 401.A N CYS 397.A O no hydrogen 3.211 N/A SER 401.A OG CYS 397.A O no hydrogen 3.142 N/A SER 401.A OG ASN 400.A OD1 no hydrogen 3.519 N/A MET 402.A N TYR 398.A O no hydrogen 3.274 N/A SER 403.A N LEU 399.A O no hydrogen 3.087 N/A SER 403.A OG LEU 399.A O no hydrogen 2.714 N/A PHE 404.A N ASN 400.A O no hydrogen 3.186 N/A TRP 405.A N MET 402.A O no hydrogen 3.050 N/A PHE 406.A N SER 403.A O no hydrogen 2.946 N/A PHE 407.A N PHE 404.A O no hydrogen 2.751 N/A LEU 409.A N PHE 406.A O no hydrogen 2.945 N/A VAL 410.A N PHE 406.A O no hydrogen 3.246 N/A ARG 411.A N PHE 407.A O no hydrogen 2.745 N/A MET 412.A N PRO 408.A O no hydrogen 3.076 N/A MET 413.A N LEU 409.A O no hydrogen 2.795 N/A PHE 414.A N VAL 410.A O no hydrogen 2.980 N/A LEU 415.A N ARG 411.A O no hydrogen 2.944 N/A VAL 416.A N MET 412.A O no hydrogen 2.982 N/A ALA 417.A N MET 413.A O no hydrogen 2.770 N/A ILE 420.A N VAL 416.A O no hydrogen 3.117 N/A ILE 420.A N ALA 417.A O no hydrogen 3.108 N/A TYR 421.A N PRO 418.A O no hydrogen 2.959 N/A LEU 422.A N PRO 418.A O no hydrogen 3.471 N/A PHE 423.A N LEU 419.A O no hydrogen 2.771 N/A PHE 424.A N ILE 420.A O no hydrogen 3.173 N/A PHE 424.A N TYR 421.A O no hydrogen 3.145 N/A GLY 425.A N TYR 421.A O no hydrogen 2.479 N/A VAL 430.A N THR 76.A O no hydrogen 2.699 N/A THR 432.A N GLU 435.A OE1 no hydrogen 3.414 N/A GLU 434.A N GLU 434.A OE1 no hydrogen 2.930 N/A GLU 435.A N THR 432.A OG1 no hydrogen 3.193 N/A VAL 436.A N THR 432.A O no hydrogen 3.036 N/A LEU 437.A N PHE 433.A O no hydrogen 2.900 N/A ALA 438.A N GLU 434.A O no hydrogen 3.055 N/A TYR 439.A N GLU 435.A O no hydrogen 2.923 N/A MET 440.A N VAL 436.A O no hydrogen 2.870 N/A TYR 443.A N TYR 439.A O no hydrogen 2.990 N/A LEU 444.A N MET 440.A O no hydrogen 2.946 N/A ALA 445.A N PRO 441.A O no hydrogen 3.031 N/A VAL 446.A N GLY 442.A O no hydrogen 3.315 N/A SER 447.A N TYR 443.A O no hydrogen 3.398 N/A SER 447.A OG TYR 443.A O no hydrogen 2.769 N/A PHE 448.A N LEU 444.A O no hydrogen 3.048 N/A LEU 449.A N ALA 445.A O no hydrogen 2.822 N/A VAL 450.A N VAL 446.A O no hydrogen 2.532 N/A GLN 451.A N SER 447.A O no hydrogen 2.831 N/A ASN 452.A N PHE 448.A O no hydrogen 2.923 N/A ASN 452.A ND2 ILE 695.A O no hydrogen 3.398 N/A ALA 453.A N LEU 449.A O no hydrogen 2.823 N/A LEU 454.A N VAL 450.A O no hydrogen 2.947 N/A PHE 455.A N GLN 451.A O no hydrogen 3.025 N/A ARG 459.A N PHE 455.A O no hydrogen 3.244 N/A ARG 459.A NH1 SER 464.A OG no hydrogen 2.397 N/A ARG 459.A NH2 GLU 285.A O no hydrogen 3.188 N/A VAL 463.A N TRP 460.A O no hydrogen 3.329 N/A GLU 465.A N GLU 465.A OE1 no hydrogen 2.772 N/A VAL 466.A N LEU 462.A O no hydrogen 2.915 N/A TYR 467.A N VAL 463.A O no hydrogen 2.942 N/A TYR 467.A OH ASP 270.A OD1 no hydrogen 3.136 N/A TYR 467.A OH ASP 270.A OD2 no hydrogen 2.876 N/A GLU 468.A N SER 464.A O no hydrogen 2.867 N/A VAL 469.A N GLU 465.A O no hydrogen 3.022 N/A ALA 470.A N VAL 466.A O no hydrogen 3.126 N/A GLN 471.A N TYR 467.A O no hydrogen 3.219 N/A GLN 471.A NE2 TYR 467.A O no hydrogen 3.643 N/A ALA 472.A N VAL 469.A O no hydrogen 3.126 N/A TYR 474.A N GLN 471.A O no hydrogen 3.190 N/A TYR 474.A OH ILE 508.A O no hydrogen 2.463 N/A LEU 475.A N GLN 471.A O no hydrogen 3.100 N/A ALA 476.A N ALA 472.A O no hydrogen 3.169 N/A ILE 479.A N LEU 475.A O no hydrogen 2.909 N/A VAL 480.A N ALA 476.A O no hydrogen 2.876 N/A THR 481.A N ARG 477.A O no hydrogen 2.765 N/A THR 481.A OG1 ALA 478.A O no hydrogen 3.044 N/A THR 482.A N ALA 478.A O no hydrogen 2.936 N/A THR 482.A OG1 ALA 478.A O no hydrogen 2.659 N/A LEU 483.A N VAL 480.A O no hydrogen 3.062 N/A LEU 484.A N VAL 480.A O no hydrogen 2.770 N/A ARG 485.A N THR 481.A O no hydrogen 2.629 N/A ARG 487.A NH2 GLU 326.A OE2 no hydrogen 2.420 N/A GLU 498.A N GLU 498.A OE1 no hydrogen 2.358 N/A THR 499.A OG1 GLN 737.A O no hydrogen 3.475 N/A ILE 505.A N GLU 722.A OE2 no hydrogen 2.838 N/A SER 506.A N VAL 561.A O no hydrogen 2.792 N/A TYR 509.A N SER 506.A O no hydrogen 3.228 N/A ARG 510.A NE TYR 509.A OH no hydrogen 2.778 N/A ARG 510.A NH2 TYR 509.A OH no hydrogen 3.138 N/A LEU 513.A N TYR 509.A O no hydrogen 3.194 N/A PHE 514.A N ARG 510.A O no hydrogen 2.705 N/A THR 515.A N PRO 511.A O no hydrogen 3.021 N/A PHE 516.A N LEU 512.A O no hydrogen 2.750 N/A LEU 517.A N LEU 513.A O no hydrogen 2.844 N/A LEU 518.A N PHE 514.A O no hydrogen 2.879 N/A CYS 519.A N THR 515.A O no hydrogen 2.736 N/A CYS 519.A SG THR 515.A O no hydrogen 3.726 N/A LEU 520.A N PHE 516.A O no hydrogen 2.813 N/A SER 521.A N LEU 517.A O no hydrogen 2.829 N/A SER 521.A OG LEU 517.A O no hydrogen 3.120 N/A GLY 522.A N LEU 518.A O no hydrogen 3.056 N/A VAL 523.A N CYS 519.A O no hydrogen 3.042 N/A LEU 524.A N LEU 520.A O no hydrogen 2.831 N/A ALA 525.A N SER 521.A O no hydrogen 2.697 N/A THR 526.A N GLY 522.A O no hydrogen 2.892 N/A THR 526.A OG1 GLY 522.A O no hydrogen 3.535 N/A THR 526.A OG1 VAL 523.A O no hydrogen 2.780 N/A LEU 527.A N VAL 523.A O no hydrogen 3.041 N/A VAL 528.A N LEU 524.A O no hydrogen 3.032 N/A ARG 529.A N ALA 525.A O no hydrogen 2.947 N/A ARG 529.A NE LEU 422.A O no hydrogen 2.794 N/A ARG 529.A NH2 LEU 422.A O no hydrogen 2.515 N/A TRP 530.A N THR 526.A O no hydrogen 2.764 N/A VAL 531.A N LEU 527.A O no hydrogen 3.265 N/A ALA 532.A N VAL 528.A O no hydrogen 2.974 N/A PHE 533.A N ARG 529.A O no hydrogen 2.817 N/A ASP 536.A N PHE 533.A O no hydrogen 2.964 N/A ARG 537.A N PRO 534.A O no hydrogen 3.489 N/A LEU 540.A N ASP 536.A O no hydrogen 3.050 N/A LEU 541.A N ARG 537.A O no hydrogen 2.570 N/A VAL 542.A N SER 538.A O no hydrogen 3.494 N/A VAL 543.A N VAL 539.A O no hydrogen 2.990 N/A GLY 545.A N LEU 541.A O no hydrogen 2.933 N/A TRP 546.A N VAL 542.A O no hydrogen 3.191 N/A ALA 547.A N VAL 543.A O no hydrogen 2.956 N/A VAL 548.A N GLY 544.A O no hydrogen 2.719 N/A LEU 549.A N GLY 545.A O no hydrogen 3.074 N/A ASN 550.A N TRP 546.A O no hydrogen 2.781 N/A VAL 551.A N ALA 547.A O no hydrogen 3.036 N/A LEU 552.A N VAL 548.A O no hydrogen 3.140 N/A LEU 553.A N LEU 549.A O no hydrogen 3.186 N/A VAL 554.A N ASN 550.A O no hydrogen 2.792 N/A GLY 555.A N VAL 551.A O no hydrogen 2.565 N/A PHE 556.A N LEU 552.A O no hydrogen 2.976 N/A ALA 557.A N LEU 553.A O no hydrogen 2.854 N/A LEU 558.A N VAL 554.A O no hydrogen 2.602 N/A ARG 559.A N PHE 556.A O no hydrogen 2.976 N/A ALA 560.A N ALA 557.A O no hydrogen 2.723 N/A VAL 561.A N LEU 558.A O no hydrogen 3.151 N/A GLU 563.A N TYR 504.A O no hydrogen 2.726 N/A LYS 564.A NZ ASP 718.A OD2 no hydrogen 2.670 N/A GLN 565.A N GLU 502.A O no hydrogen 3.111 N/A ARG 568.A NH2 HIS 739.A O no hydrogen 2.456 N/A VAL 573.A N ALA 598.A O no hydrogen 2.789 N/A MET 575.A N LEU 596.A O no hydrogen 2.768 N/A VAL 577.A N VAL 595.A O no hydrogen 3.240 N/A ALA 579.A N ALA 593.A O no hydrogen 3.000 N/A GLU 580.A N GLN 628.A O no hydrogen 3.153 N/A ALA 581.A N LEU 591.A O no hydrogen 2.980 N/A GLN 582.A N GLN 626.A O no hydrogen 2.885 N/A GLY 587.A N PRO 584.A O no hydrogen 3.314 N/A ASN 588.A N GLN 582.A OE1 no hydrogen 2.641 N/A SER 590.A OG GLU 580.A OE1 no hydrogen 3.075 N/A LEU 591.A N ALA 581.A O no hydrogen 2.785 N/A ALA 593.A N ALA 579.A O no hydrogen 3.022 N/A THR 594.A N LEU 606.A O no hydrogen 2.732 N/A THR 594.A OG1 ALA 593.A O no hydrogen 2.910 N/A VAL 595.A N VAL 577.A O no hydrogen 2.877 N/A LEU 596.A N ARG 604.A O no hydrogen 2.664 N/A ALA 598.A N VAL 573.A O no hydrogen 3.052 N/A SER 599.A N GLY 602.A O no hydrogen 2.821 N/A VAL 603.A N VAL 659.A O no hydrogen 2.698 N/A ARG 604.A N ASP 597.A O no hydrogen 3.163 N/A LEU 605.A N VAL 657.A O no hydrogen 2.921 N/A LEU 606.A N THR 594.A O no hydrogen 2.724 N/A VAL 607.A N VAL 655.A O no hydrogen 2.656 N/A ARG 608.A N THR 592.A O no hydrogen 2.789 N/A GLY 622.A N ILE 645.A O no hydrogen 2.597 N/A ILE 625.A N GLY 643.A O no hydrogen 2.788 N/A GLN 626.A N GLN 582.A O no hydrogen 3.187 N/A PHE 627.A N VAL 641.A O no hydrogen 2.662 N/A GLN 628.A N GLU 580.A O no hydrogen 2.662 N/A LYS 630.A N PRO 578.A O no hydrogen 2.965 N/A PHE 631.A N GLU 638.A OE1 no hydrogen 2.952 N/A ALA 634.A N PHE 631.A O no hydrogen 3.171 N/A ARG 639.A N LEU 637.A O no hydrogen 2.785 N/A VAL 641.A N PHE 627.A O no hydrogen 2.588 N/A ARG 642.A N GLU 662.A OE2 no hydrogen 3.000 N/A GLY 643.A N ILE 625.A O no hydrogen 2.762 N/A ARG 644.A N ILE 660.A O no hydrogen 3.056 N/A ARG 646.A N GLY 658.A O no hydrogen 3.016 N/A ARG 649.A N MET 656.A O no hydrogen 2.801 N/A GLU 651.A N THR 654.A O no hydrogen 2.997 N/A THR 654.A N GLY 652.A O no hydrogen 2.842 N/A VAL 655.A N VAL 607.A O no hydrogen 2.966 N/A MET 656.A N ARG 649.A O no hydrogen 2.801 N/A VAL 657.A N LEU 605.A O no hydrogen 2.954 N/A GLY 658.A N SER 647.A O no hydrogen 2.569 N/A VAL 659.A N VAL 603.A O no hydrogen 2.732 N/A ILE 660.A N ARG 644.A O no hydrogen 2.842 N/A PHE 661.A N SER 601.A O no hydrogen 3.049 N/A GLU 662.A N ARG 642.A O no hydrogen 3.124 N/A ARG 670.A N PRO 666.A O no hydrogen 3.276 N/A GLU 671.A N ILE 667.A O no hydrogen 2.865 N/A THR 672.A N ALA 668.A O no hydrogen 3.122 N/A THR 672.A OG1 VAL 669.A O no hydrogen 3.025 N/A VAL 673.A N VAL 669.A O no hydrogen 3.033 N/A ALA 674.A N ARG 670.A O no hydrogen 3.098 N/A TYR 675.A N GLU 671.A O no hydrogen 3.118 N/A LEU 676.A N THR 672.A O no hydrogen 2.954 N/A ILE 677.A N VAL 673.A O no hydrogen 3.108 N/A PHE 678.A N ALA 674.A O no hydrogen 3.190 N/A SER 681.A OG ASP 242.A OD1 no hydrogen 3.040 N/A SER 681.A OG ASP 242.A OD2 no hydrogen 3.393 N/A ARG 685.A N SER 681.A O no hydrogen 2.954 N/A THR 686.A N ALA 682.A O no hydrogen 3.064 N/A THR 686.A OG1 ALA 682.A O no hydrogen 3.491 N/A MET 687.A N HIS 683.A O no hydrogen 3.100 N/A ARG 688.A N TRP 684.A O no hydrogen 2.785 N/A ARG 688.A NH1 ASP 349.A OD2 no hydrogen 2.888 N/A GLU 689.A N ARG 685.A O no hydrogen 2.834 N/A ALA 690.A N THR 686.A O no hydrogen 2.982 N/A THR 691.A N ARG 688.A O no hydrogen 3.232 N/A THR 691.A OG1 ARG 688.A O no hydrogen 3.143 N/A MET 692.A N GLU 689.A O no hydrogen 2.932 N/A GLY 700.A N GLY 696.A O no hydrogen 2.674 N/A MET 701.A N LEU 697.A O no hydrogen 3.192 N/A ALA 702.A N LEU 698.A O no hydrogen 2.901 N/A ARG 703.A N HIS 699.A O no hydrogen 2.670 N/A ILE 704.A N GLY 700.A O no hydrogen 2.944 N/A LEU 705.A N MET 701.A O no hydrogen 2.839 N/A TRP 706.A N ALA 702.A O no hydrogen 3.012 N/A MET 707.A N ARG 703.A O no hydrogen 2.925 N/A ALA 708.A N ILE 704.A O no hydrogen 2.754 N/A ALA 709.A N LEU 705.A O no hydrogen 2.902 N/A ALA 710.A N TRP 706.A O no hydrogen 2.709 N/A SER 711.A N MET 707.A O no hydrogen 2.872 N/A SER 711.A OG ALA 708.A O no hydrogen 2.926 N/A LEU 712.A N ALA 708.A O no hydrogen 3.336 N/A LEU 712.A N ALA 709.A O no hydrogen 2.888 N/A THR 715.A N SER 711.A O no hydrogen 3.037 N/A ALA 716.A N LEU 712.A O no hydrogen 3.105 N/A ARG 717.A N PRO 713.A O no hydrogen 2.874 N/A ASP 718.A N LYS 714.A O no hydrogen 3.055 N/A ASP 721.A N ARG 717.A O no hydrogen 3.223 N/A GLU 722.A N PHE 719.A O no hydrogen 3.231 N/A ARG 725.A N ASP 721.A O no hydrogen 3.168 N/A ARG 726.A N GLU 722.A O no hydrogen 2.674 N/A ARG 727.A N PRO 723.A O no hydrogen 3.247 N/A ARG 728.A N ALA 724.A O no hydrogen 3.187 N/A ARG 729.A N ARG 726.A O no hydrogen 3.395 N/A ARG 729.A NH2 ASN 503.A O no hydrogen 3.139 N/A HIS 730.A N ARG 726.A O no hydrogen 3.197 N/A GLU 731.A N ARG 727.A O no hydrogen 2.741 N/A GLU 732.A N ARG 728.A O no hydrogen 3.040 N/A LYS 734.A NZ SER 501.A OG no hydrogen 3.302 N/A LYS 734.A NZ GLU 502.A OE2 no hydrogen 3.513 N/A LEU 740.A N HIS 739.A ND1 no hydrogen 2.298 N/A THR 745.A OG1 PHE 661.A O no hydrogen 3.290 N/A ASP 746.A N GLY 744.A O no hydrogen 3.110 N/A