Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q2c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 8.A N GLY 5.A O no hydrogen 2.936 N/A TRP 9.A N GLY 5.A O no hydrogen 3.214 N/A ARG 10.A N ALA 6.A O no hydrogen 2.979 N/A ARG 10.A N ALA 7.A O no hydrogen 3.342 N/A ASP 12.A N ARG 10.A O no hydrogen 2.776 N/A TRP 14.A N ASP 12.A OD1 no hydrogen 3.370 N/A ILE 15.A N ASP 12.A O no hydrogen 3.521 N/A TRP 17.A N GLN 88.A OE1 no hydrogen 2.919 N/A TRP 17.A NE1 GLN 88.A O no hydrogen 3.194 N/A ALA 18.A N HIS 29.A O no hydrogen 2.875 N/A LYS 19.A N HIS 29.A O no hydrogen 3.201 N/A LYS 19.A NZ SER 219.A OG no hydrogen 2.604 N/A LYS 19.A NZ GLY 383.A O no hydrogen 2.554 N/A TRP 20.A N TYR 385.A OH no hydrogen 3.199 N/A TRP 20.A NE1 GLN 95.A O no hydrogen 3.113 N/A GLY 21.A N GLY 27.A O no hydrogen 2.936 N/A TRP 28.A N ALA 228.A O no hydrogen 3.112 N/A TRP 28.A NE1 SER 230.A O no hydrogen 2.796 N/A HIS 29.A N LYS 19.A O no hydrogen 2.864 N/A HIS 29.A NE2 ASP 36.A OD2 no hydrogen 2.790 N/A LEU 31.A N PHE 16.A O no hydrogen 2.906 N/A HIS 34.A N PRO 30.A O no hydrogen 3.101 N/A HIS 34.A NE2 HIS 78.A NE2 no hydrogen 3.149 N/A HIS 34.A NE2 ASP 215.A OD2 no hydrogen 2.887 N/A ASP 36.A N CYS 33.A O no hydrogen 2.873 N/A VAL 37.A N HIS 34.A O no hydrogen 2.935 N/A ALA 39.A N LEU 35.A O no hydrogen 2.892 N/A VAL 40.A N ASP 36.A O no hydrogen 2.889 N/A THR 41.A N VAL 37.A O no hydrogen 2.949 N/A THR 41.A OG1 VAL 37.A O no hydrogen 2.804 N/A LEU 42.A N ALA 38.A O no hydrogen 2.931 N/A GLN 43.A N ALA 39.A O no hydrogen 2.923 N/A GLN 43.A NE2 GLU 250.A OE2 no hydrogen 2.368 N/A ARG 45.A N LEU 42.A O no hydrogen 2.923 N/A ARG 45.A NE GLU 68.A OE2 no hydrogen 2.615 N/A ARG 46.A N GLN 43.A O no hydrogen 2.901 N/A ARG 46.A NE GLU 250.A OE1 no hydrogen 3.352 N/A ALA 51.A N GLY 322.A O no hydrogen 3.060 N/A TRP 52.A N PRO 49.A O no hydrogen 3.103 N/A TRP 52.A NE1 SER 440.A OG no hydrogen 2.964 N/A LYS 53.A N PRO 49.A O no hydrogen 3.265 N/A LYS 53.A NZ TRP 44.A O no hydrogen 2.878 N/A ALA 54.A N ALA 50.A O no hydrogen 2.914 N/A ARG 55.A N ALA 51.A O no hydrogen 2.904 N/A ARG 55.A NH1 ASP 204.A OD1 no hydrogen 2.800 N/A ARG 55.A NH2 ASP 204.A OD1 no hydrogen 2.560 N/A ILE 56.A N TRP 52.A O no hydrogen 2.904 N/A SER 57.A N LYS 53.A O no hydrogen 2.919 N/A SER 57.A OG LYS 53.A O no hydrogen 2.737 N/A GLY 58.A N ALA 54.A O no hydrogen 2.960 N/A VAL 59.A N ARG 55.A O no hydrogen 2.887 N/A LEU 60.A N ILE 56.A O no hydrogen 2.927 N/A GLY 61.A N GLY 58.A O no hydrogen 3.202 N/A VAL 62.A N SER 57.A O no hydrogen 3.272 N/A ALA 67.A N GLY 63.A O no hydrogen 2.867 N/A GLU 68.A N GLN 64.A O no hydrogen 2.900 N/A ARG 69.A N GLU 65.A O no hydrogen 2.972 N/A ARG 69.A NH1 ASP 66.A OD1 no hydrogen 3.410 N/A TRP 70.A N ASP 66.A O no hydrogen 2.946 N/A TRP 70.A NE1 SER 194.A OG no hydrogen 3.141 N/A LEU 71.A N ALA 67.A O no hydrogen 2.925 N/A ALA 72.A N GLU 68.A O no hydrogen 2.947 N/A PHE 73.A N ARG 69.A O no hydrogen 2.928 N/A PHE 74.A N TRP 70.A O no hydrogen 2.937 N/A ALA 75.A N LEU 71.A O no hydrogen 2.975 N/A GLY 76.A N ALA 72.A O no hydrogen 2.910 N/A GLY 77.A N PHE 73.A O no hydrogen 2.883 N/A HIS 78.A N ALA 75.A O no hydrogen 3.329 N/A HIS 78.A ND1 ALA 75.A O no hydrogen 2.736 N/A ILE 80.A N GLY 77.A O no hydrogen 3.162 N/A GLY 81.A N SER 122.A OG no hydrogen 2.616 N/A LYS 82.A N ASP 79.A O no hydrogen 2.959 N/A LYS 82.A NZ ALA 18.A O no hydrogen 2.874 N/A LYS 82.A NZ ASP 79.A OD1 no hydrogen 3.003 N/A ALA 83.A N ILE 80.A O no hydrogen 3.124 N/A SER 84.A OG GLY 81.A O no hydrogen 2.719 N/A PHE 87.A N SER 84.A O no hydrogen 3.246 N/A GLN 88.A N SER 84.A O no hydrogen 3.016 N/A GLN 88.A NE2 TRP 17.A O no hydrogen 2.910 N/A GLN 88.A NE2 LYS 82.A O no hydrogen 2.769 N/A LEU 89.A N PRO 85.A O no hydrogen 2.968 N/A GLN 90.A N PHE 87.A O no hydrogen 3.075 N/A GLU 94.A N GLU 94.A OE1 no hydrogen 2.731 N/A GLN 95.A N ARG 92.A O no hydrogen 2.913 N/A GLN 95.A NE2 GLY 21.A O no hydrogen 2.770 N/A GLY 96.A N PRO 93.A O no hydrogen 3.321 N/A VAL 100.A N GLY 96.A O no hydrogen 3.518 N/A ALA 101.A N ARG 97.A O no hydrogen 2.927 N/A ARG 102.A N GLU 98.A O no hydrogen 2.900 N/A ARG 103.A N LEU 99.A O no hydrogen 2.930 N/A ARG 103.A NH1 ALA 231.A O no hydrogen 3.425 N/A ARG 103.A NH2 ALA 231.A O no hydrogen 2.729 N/A LEU 104.A N VAL 100.A O no hydrogen 2.900 N/A ARG 105.A N ALA 101.A O no hydrogen 2.908 N/A ASP 106.A N ARG 102.A O no hydrogen 2.917 N/A ALA 107.A N LEU 104.A O no hydrogen 3.073 N/A GLY 108.A N ARG 105.A O no hydrogen 3.103 N/A LEU 109.A N LEU 104.A O no hydrogen 3.131 N/A ASN 113.A N ASN 113.A OD1 no hydrogen 2.577 N/A ILE 121.A N PRO 117.A O no hydrogen 3.317 N/A SER 122.A N HIS 118.A O no hydrogen 2.878 N/A SER 122.A OG HIS 78.A O no hydrogen 3.020 N/A SER 122.A OG HIS 118.A O no hydrogen 3.084 N/A ALA 123.A N GLY 119.A O no hydrogen 2.945 N/A ASN 124.A N THR 120.A O no hydrogen 2.935 N/A ASN 124.A ND2 VAL 161.A O no hydrogen 2.797 N/A VAL 125.A N ILE 121.A O no hydrogen 2.924 N/A LEU 126.A N SER 122.A O no hydrogen 2.926 N/A GLU 127.A N ALA 123.A O no hydrogen 2.947 N/A THR 128.A OG1 VAL 125.A O no hydrogen 3.212 N/A VAL 129.A N VAL 125.A O no hydrogen 2.911 N/A LEU 130.A N LEU 126.A O no hydrogen 2.944 N/A ALA 131.A N THR 128.A O no hydrogen 3.011 N/A ASP 132.A N THR 128.A O no hydrogen 2.921 N/A VAL 133.A N VAL 129.A O no hydrogen 2.994 N/A PHE 134.A N VAL 129.A O no hydrogen 3.507 N/A GLY 135.A N ALA 131.A O no hydrogen 3.108 N/A LEU 136.A N LEU 130.A O no hydrogen 3.011 N/A SER 137.A OG SER 140.A OG no hydrogen 2.736 N/A SER 137.A OG GLU 200.A OE1 no hydrogen 2.946 N/A ARG 139.A NE GLU 200.A O no hydrogen 3.179 N/A ARG 139.A NH2 GLU 200.A O no hydrogen 3.517 N/A ARG 139.A NH2 ASN 778.A O no hydrogen 3.288 N/A SER 140.A N SER 137.A OG no hydrogen 3.309 N/A SER 140.A OG SER 137.A OG no hydrogen 2.736 N/A ALA 141.A N SER 137.A O no hydrogen 2.852 N/A ARG 142.A N GLY 138.A O no hydrogen 2.947 N/A TRP 143.A N ARG 139.A O no hydrogen 2.906 N/A TRP 143.A NE1 THR 202.A OG1 no hydrogen 3.025 N/A VAL 144.A N SER 140.A O no hydrogen 2.939 N/A ALA 145.A N ALA 141.A O no hydrogen 2.946 N/A PHE 146.A N ARG 142.A O no hydrogen 2.955 N/A ALA 147.A N TRP 143.A O no hydrogen 2.959 N/A VAL 148.A N VAL 144.A O no hydrogen 2.905 N/A GLY 149.A N ALA 145.A O no hydrogen 2.916 N/A GLY 150.A N ALA 147.A O no hydrogen 3.187 N/A HIS 151.A ND1 VAL 148.A O no hydrogen 2.942 N/A HIS 152.A NE2 HIS 118.A NE2 no hydrogen 2.909 N/A GLY 153.A N GLY 150.A O no hydrogen 3.064 N/A GLU 160.A N SER 157.A O no hydrogen 3.134 N/A VAL 161.A N TYR 158.A O no hydrogen 3.292 N/A ARG 162.A N TYR 158.A O no hydrogen 2.925 N/A ARG 163.A N ASP 159.A O no hydrogen 3.080 N/A ASP 164.A N ASP 159.A O no hydrogen 2.732 N/A GLN 168.A N ASP 166.A OD1 no hydrogen 3.025 N/A ALA 169.A N ASP 166.A O no hydrogen 3.264 N/A GLY 171.A N GLN 167.A O no hydrogen 2.686 N/A GLY 173.A N ASP 175.A OD2 no hydrogen 2.980 N/A TRP 174.A NE1 PRO 110.A O no hydrogen 2.986 N/A ALA 176.A N GLY 173.A O no hydrogen 3.038 N/A ARG 178.A N TRP 174.A O no hydrogen 2.939 N/A ARG 178.A NE ALA 83.A O no hydrogen 3.006 N/A ARG 178.A NH1 ASP 175.A OD1 no hydrogen 2.593 N/A ARG 178.A NH2 VAL 170.A O no hydrogen 2.661 N/A ARG 178.A NH2 GLY 171.A O no hydrogen 3.417 N/A GLU 179.A N ASP 175.A O no hydrogen 2.908 N/A VAL 180.A N ALA 176.A O no hydrogen 2.902 N/A LEU 181.A N ALA 177.A O no hydrogen 2.932 N/A LEU 182.A N ARG 178.A O no hydrogen 2.910 N/A CYS 183.A N GLU 179.A O no hydrogen 2.911 N/A CYS 183.A SG GLU 179.A O no hydrogen 3.244 N/A ARG 184.A N VAL 180.A O no hydrogen 2.933 N/A LEU 185.A N LEU 181.A O no hydrogen 2.948 N/A ALA 186.A N LEU 182.A O no hydrogen 2.898 N/A ASP 187.A N CYS 183.A O no hydrogen 2.881 N/A ALA 188.A N ARG 184.A O no hydrogen 2.968 N/A LEU 189.A N LEU 185.A O no hydrogen 3.091 N/A LEU 189.A N ALA 186.A O no hydrogen 3.187 N/A GLY 190.A N ASP 187.A O no hydrogen 3.149 N/A LEU 191.A N ALA 186.A O no hydrogen 2.890 N/A SER 194.A N LEU 191.A O no hydrogen 2.609 N/A SER 194.A OG ASP 66.A OD1 no hydrogen 3.088 N/A SER 194.A OG LEU 191.A O no hydrogen 2.590 N/A SER 195.A OG ASP 66.A OD2 no hydrogen 3.134 N/A ARG 196.A NE SER 194.A O no hydrogen 2.987 N/A ARG 196.A NH1 PHE 134.A O no hydrogen 2.756 N/A ARG 196.A NH2 SER 194.A O no hydrogen 2.451 N/A THR 198.A N LEU 60.A O no hydrogen 2.669 N/A VAL 199.A N SER 140.A OG no hydrogen 3.198 N/A SER 201.A OG ASP 204.A OD2 no hydrogen 2.430 N/A ALA 205.A N SER 201.A O no hydrogen 3.131 N/A PHE 206.A N THR 202.A O no hydrogen 2.941 N/A ALA 208.A N ALA 205.A O no hydrogen 3.007 N/A VAL 211.A N LEU 207.A O no hydrogen 2.947 N/A SER 212.A N ALA 208.A O no hydrogen 2.969 N/A SER 212.A OG HIS 151.A O no hydrogen 2.944 N/A SER 212.A OG ALA 208.A O no hydrogen 3.131 N/A VAL 213.A N GLY 209.A O no hydrogen 2.998 N/A ALA 214.A N LEU 210.A O no hydrogen 2.957 N/A ASP 215.A N VAL 211.A O no hydrogen 2.960 N/A TRP 216.A N SER 212.A O no hydrogen 2.960 N/A ILE 217.A N VAL 213.A O no hydrogen 2.941 N/A GLY 218.A N ALA 214.A O no hydrogen 2.941 N/A SER 219.A N TRP 216.A O no hydrogen 3.078 N/A SER 219.A OG ASP 215.A O no hydrogen 2.897 N/A GLU 221.A N GLN 382.A OE1 no hydrogen 2.802 N/A GLU 222.A N ASN 220.A OD1 no hydrogen 3.037 N/A TYR 223.A N ASN 220.A O no hydrogen 2.924 N/A PHE 224.A N ASN 220.A O no hydrogen 2.736 N/A ALA 227.A N HIS 29.A ND1 no hydrogen 2.987 N/A ALA 228.A N TRP 28.A O no hydrogen 3.040 N/A ALA 241.A N ASP 238.A OD2 no hydrogen 3.389 N/A TYR 242.A N ASP 238.A O no hydrogen 3.033 N/A TYR 242.A OH ASP 36.A OD1 no hydrogen 2.798 N/A TYR 242.A OH ASP 36.A OD2 no hydrogen 2.855 N/A LEU 243.A N ALA 239.A O no hydrogen 2.907 N/A GLU 244.A N GLU 240.A O no hydrogen 2.953 N/A ARG 245.A N ALA 241.A O no hydrogen 2.990 N/A ARG 245.A NH1 GLN 248.A OE1 no hydrogen 3.121 N/A ALA 246.A N TYR 242.A O no hydrogen 2.871 N/A GLN 248.A N ARG 245.A O no hydrogen 2.918 N/A ALA 249.A N ALA 246.A O no hydrogen 2.917 N/A ARG 251.A N ARG 247.A O no hydrogen 2.946 N/A ALA 252.A N GLN 248.A O no hydrogen 2.951 N/A SER 254.A N ARG 251.A O no hydrogen 2.929 N/A SER 254.A OG ALA 252.A O no hydrogen 2.915 N/A LEU 255.A N ALA 252.A O no hydrogen 3.010 N/A GLY 256.A N ALA 253.A O no hydrogen 3.062 N/A TRP 260.A NE1 GLY 256.A O no hydrogen 3.048 N/A ARG 261.A N GLY 259.A O no hydrogen 3.121 N/A SER 264.A OG GLY 265.A O no hydrogen 2.156 N/A SER 266.A OG GLY 265.A O no hydrogen 2.355 N/A LEU 268.A N GLU 286.A OE2 no hydrogen 2.927 N/A GLU 270.A N ARG 267.A O no hydrogen 2.983 N/A LEU 271.A N ARG 267.A O no hydrogen 3.223 N/A PHE 272.A N LEU 268.A O no hydrogen 3.125 N/A TYR 274.A OH GLU 309.A OE1 no hydrogen 2.618 N/A ILE 275.A N PHE 272.A O no hydrogen 3.296 N/A THR 279.A N GLN 282.A OE1 no hydrogen 3.010 N/A THR 279.A OG1 GLU 305.A O no hydrogen 2.822 N/A THR 280.A OG1 ALA 526.A O no hydrogen 2.538 N/A GLN 282.A NE2 GLY 306.A O no hydrogen 3.118 N/A ALA 283.A N THR 279.A O no hydrogen 2.964 N/A ALA 284.A N THR 280.A O no hydrogen 2.930 N/A ALA 285.A N VAL 281.A O no hydrogen 2.908 N/A GLU 286.A N GLN 282.A O no hydrogen 2.906 N/A GLU 287.A N ALA 283.A O no hydrogen 2.927 N/A LEU 288.A N ALA 284.A O no hydrogen 2.905 N/A ALA 289.A N ALA 285.A O no hydrogen 2.900 N/A ALA 289.A N GLU 286.A O no hydrogen 3.329 N/A GLU 291.A N LEU 288.A O no hydrogen 3.234 N/A LYS 293.A N TYR 514.A OH no hydrogen 2.855 N/A SER 294.A OG HIS 321.A ND1 no hydrogen 2.833 N/A SER 296.A OG LYS 293.A O no hydrogen 3.299 N/A ILE 297.A N ALA 515.A O no hydrogen 3.102 N/A THR 298.A N VAL 473.A O no hydrogen 2.899 N/A ILE 299.A N THR 513.A O no hydrogen 2.879 N/A ILE 300.A N VAL 475.A O no hydrogen 2.889 N/A GLU 301.A N ARG 511.A O no hydrogen 2.898 N/A ALA 302.A N SER 477.A O no hydrogen 3.362 N/A GLU 305.A N PRO 303.A O no hydrogen 3.248 N/A LYS 307.A NZ ALA 302.A O no hydrogen 3.293 N/A THR 308.A OG1 GLU 309.A OE1 no hydrogen 3.545 N/A THR 308.A OG1 GLU 309.A OE2 no hydrogen 3.537 N/A ALA 311.A N LYS 307.A O no hydrogen 2.938 N/A LEU 313.A N ALA 310.A O no hydrogen 2.978 N/A ALA 314.A N ALA 311.A O no hydrogen 2.908 N/A THR 316.A N LEU 312.A O no hydrogen 2.959 N/A THR 316.A OG1 LEU 312.A O no hydrogen 3.030 N/A PHE 317.A N LEU 313.A O no hydrogen 2.929 N/A SER 318.A N ALA 314.A O no hydrogen 2.931 N/A SER 318.A OG ASP 315.A O no hydrogen 3.059 N/A THR 319.A N ASP 315.A O no hydrogen 2.904 N/A THR 319.A OG1 ASP 315.A O no hydrogen 3.230 N/A ALA 320.A N THR 316.A O no hydrogen 2.918 N/A HIS 321.A N PHE 317.A O no hydrogen 2.940 N/A HIS 321.A ND1 SER 294.A OG no hydrogen 2.833 N/A SER 323.A OG TRP 260.A O no hydrogen 3.459 N/A CYS 325.A N PRO 413.A O no hydrogen 2.781 N/A CYS 325.A SG THR 443.A O no hydrogen 3.674 N/A TYR 326.A N THR 443.A O no hydrogen 3.086 N/A TYR 326.A OH THR 418.A O no hydrogen 2.803 N/A PHE 327.A N GLY 415.A O no hydrogen 2.936 N/A ALA 328.A N ILE 445.A O no hydrogen 2.746 N/A LEU 329.A N GLY 417.A O no hydrogen 2.784 N/A THR 333.A N SER 637.A OG no hydrogen 3.280 N/A SER 334.A OG SER 362.A OG no hydrogen 3.173 N/A ARG 339.A NH1 THR 308.A OG1 no hydrogen 2.533 N/A THR 341.A N PHE 337.A O no hydrogen 2.930 N/A THR 341.A OG1 PHE 337.A O no hydrogen 3.058 N/A ASP 342.A N GLY 338.A O no hydrogen 2.919 N/A TYR 343.A N ARG 339.A O no hydrogen 2.957 N/A TYR 343.A OH ASP 315.A OD1 no hydrogen 2.903 N/A LEU 344.A N VAL 340.A O no hydrogen 2.890 N/A ARG 345.A N THR 341.A O no hydrogen 2.978 N/A ARG 345.A NH2 ASP 342.A OD1 no hydrogen 2.870 N/A HIS 346.A N TYR 343.A O no hydrogen 3.266 N/A HIS 346.A ND1 LEU 271.A O no hydrogen 2.739 N/A ARG 347.A N LEU 344.A O no hydrogen 3.202 N/A ARG 347.A NE ASP 315.A OD1 no hydrogen 2.828 N/A ARG 347.A NH2 ASP 315.A OD2 no hydrogen 3.561 N/A TYR 348.A N LEU 344.A O no hydrogen 2.802 N/A TYR 348.A OH TYR 414.A OH no hydrogen 2.406 N/A VAL 352.A N PRO 349.A O no hydrogen 3.188 N/A VAL 353.A N GLU 350.A O no hydrogen 2.945 N/A VAL 354.A N ASP 351.A O no hydrogen 2.914 N/A VAL 355.A N VAL 352.A O no hydrogen 2.938 N/A ASN 356.A N VAL 352.A O no hydrogen 3.168 N/A VAL 358.A N VAL 355.A O no hydrogen 2.937 N/A HIS 359.A N VAL 355.A O no hydrogen 3.065 N/A GLY 360.A N ASN 356.A O no hydrogen 2.960 N/A HIS 361.A ND1 ASN 356.A O no hydrogen 2.985 N/A SER 362.A OG VAL 416.A O no hydrogen 2.947 N/A SER 365.A OG TYR 602.A OH no hydrogen 2.437 N/A SER 365.A OG GLU 606.A OE2 no hydrogen 2.885 N/A ALA 366.A N ASP 363.A OD1 no hydrogen 3.082 N/A LEU 368.A N LEU 364.A O no hydrogen 2.904 N/A GLN 369.A N SER 365.A O no hydrogen 2.950 N/A GLU 370.A N ALA 366.A O no hydrogen 2.913 N/A LEU 371.A N LEU 367.A O no hydrogen 2.907 N/A ARG 372.A N LEU 368.A O no hydrogen 2.935 N/A GLN 373.A N GLN 369.A O no hydrogen 2.964 N/A GLN 373.A NE2 LYS 374.A O no hydrogen 3.266 N/A GLU 377.A N GLY 375.A O no hydrogen 2.739 N/A GLN 382.A N SER 219.A O no hydrogen 3.150 N/A ASP 386.A N VAL 384.A O no hydrogen 2.923 N/A ALA 388.A N ASP 386.A OD1 no hydrogen 3.423 N/A LEU 394.A N ASP 391.A OD1 no hydrogen 2.844 N/A GLY 395.A N ASP 391.A O no hydrogen 3.074 N/A ALA 396.A N GLU 392.A O no hydrogen 2.881 N/A VAL 397.A N GLN 393.A O no hydrogen 2.921 N/A VAL 398.A N LEU 394.A O no hydrogen 2.983 N/A ALA 399.A N GLY 395.A O no hydrogen 2.930 N/A GLY 400.A N ALA 396.A O no hydrogen 2.885 N/A GLN 401.A N VAL 397.A O no hydrogen 3.022 N/A GLN 401.A N VAL 398.A O no hydrogen 3.366 N/A TRP 402.A N ALA 399.A O no hydrogen 3.310 N/A PHE 403.A N GLY 400.A O no hydrogen 2.812 N/A THR 404.A N GLN 401.A O no hydrogen 3.081 N/A THR 404.A OG1 GLY 400.A O no hydrogen 3.546 N/A THR 404.A OG1 GLN 401.A O no hydrogen 3.447 N/A THR 404.A OG1 SER 872.A O no hydrogen 2.952 N/A ARG 405.A N GLN 401.A O no hydrogen 2.681 N/A ARG 405.A NH2 ARG 875.A O no hydrogen 2.780 N/A ARG 408.A N ARG 405.A O no hydrogen 2.996 N/A ARG 408.A NH2 ASP 363.A O no hydrogen 3.038 N/A ALA 409.A N GLY 406.A O no hydrogen 2.995 N/A LEU 410.A N LYS 407.A O no hydrogen 2.925 N/A LEU 411.A N ARG 408.A O no hydrogen 2.974 N/A TYR 414.A OH TYR 348.A OH no hydrogen 2.406 N/A GLY 415.A N CYS 325.A O no hydrogen 3.174 N/A VAL 416.A N GLY 360.A O no hydrogen 2.778 N/A GLY 417.A N PHE 327.A O no hydrogen 3.214 N/A VAL 419.A N LEU 329.A O no hydrogen 2.736 N/A GLN 421.A N THR 418.A O no hydrogen 3.175 N/A ALA 422.A N VAL 419.A O no hydrogen 3.052 N/A LEU 423.A N VAL 419.A O no hydrogen 2.904 N/A LEU 424.A N ASP 420.A O no hydrogen 2.917 N/A ALA 425.A N ALA 422.A O no hydrogen 3.108 N/A VAL 426.A N LEU 423.A O no hydrogen 3.290 N/A LEU 427.A N LEU 424.A O no hydrogen 3.093 N/A GLN 428.A N ARG 770.A O no hydrogen 2.738 N/A GLN 428.A NE2 LYS 768.A O no hydrogen 2.560 N/A GLN 428.A NE2 TYR 771.A O no hydrogen 2.769 N/A VAL 429.A N LEU 427.A O no hydrogen 2.842 N/A LYS 430.A NZ ASP 386.A OD2 no hydrogen 2.439 N/A LYS 430.A NZ ASP 791.A OD1 no hydrogen 2.748 N/A HIS 431.A N GLY 153.A O no hydrogen 2.860 N/A HIS 431.A NE2 HIS 151.A O no hydrogen 2.870 N/A VAL 434.A N HIS 431.A O no hydrogen 3.074 N/A ARG 435.A NE GLN 421.A O no hydrogen 2.907 N/A ARG 435.A NH2 GLN 421.A O no hydrogen 3.090 N/A LEU 436.A N VAL 432.A O no hydrogen 2.953 N/A PHE 437.A N PHE 433.A O no hydrogen 2.878 N/A ALA 438.A N VAL 434.A O no hydrogen 2.900 N/A LEU 439.A N ARG 435.A O no hydrogen 2.951 N/A SER 440.A N PHE 437.A O no hydrogen 3.065 N/A SER 440.A OG PHE 437.A O no hydrogen 2.568 N/A THR 441.A OG1 ALA 438.A O no hydrogen 3.348 N/A LYS 442.A N LEU 439.A O no hydrogen 3.212 N/A LYS 442.A NZ LEU 410.A O no hydrogen 3.099 N/A LYS 442.A NZ PRO 412.A O no hydrogen 2.805 N/A LYS 442.A NZ ALA 438.A O no hydrogen 3.123 N/A THR 443.A N GLY 324.A O no hydrogen 3.262 N/A VAL 444.A N PRO 472.A O no hydrogen 2.953 N/A ILE 445.A N TYR 326.A O no hydrogen 3.048 N/A VAL 446.A N VAL 474.A O no hydrogen 2.893 N/A ASP 447.A N ALA 328.A O no hydrogen 2.835 N/A VAL 449.A N LEU 476.A O no hydrogen 2.796 N/A TYR 452.A N ASP 652.A OD2 no hydrogen 2.939 N/A ASP 453.A N HIS 450.A O no hydrogen 3.235 N/A VAL 454.A N HIS 450.A O no hydrogen 3.387 N/A TYR 455.A N ALA 451.A O no hydrogen 2.944 N/A TYR 455.A OH GLN 756.A OE1 no hydrogen 2.754 N/A THR 456.A OG1 ASP 453.A O no hydrogen 2.706 N/A HIS 460.A NE2 GLU 487.A OE1 no hydrogen 3.257 N/A ARG 461.A N THR 457.A O no hydrogen 3.015 N/A ARG 461.A NE THR 457.A OG1 no hydrogen 2.977 N/A LEU 462.A N LEU 458.A O no hydrogen 2.958 N/A LEU 463.A N LEU 459.A O no hydrogen 2.904 N/A GLU 464.A N HIS 460.A O no hydrogen 2.946 N/A TRP 465.A N ARG 461.A O no hydrogen 3.009 N/A TRP 465.A NE1 LYS 773.A O no hydrogen 2.877 N/A LEU 466.A N LEU 462.A O no hydrogen 2.873 N/A GLY 467.A N LEU 463.A O no hydrogen 2.910 N/A ALA 468.A N GLU 464.A O no hydrogen 2.967 N/A LEU 469.A N TRP 465.A O no hydrogen 3.138 N/A SER 470.A N GLY 467.A O no hydrogen 3.342 N/A VAL 471.A N LEU 466.A O no hydrogen 2.906 N/A VAL 473.A N SER 296.A O no hydrogen 3.044 N/A VAL 474.A N VAL 444.A O no hydrogen 2.892 N/A VAL 475.A N THR 298.A O no hydrogen 2.860 N/A LEU 476.A N VAL 446.A O no hydrogen 2.902 N/A SER 477.A N ILE 300.A O no hydrogen 2.939 N/A SER 477.A OG VAL 449.A O no hydrogen 2.800 N/A SER 477.A OG THR 479.A O no hydrogen 3.207 N/A THR 479.A N SER 477.A OG no hydrogen 3.184 N/A LEU 480.A N GLU 301.A OE2 no hydrogen 2.579 N/A SER 482.A N GLU 729.A OE2 no hydrogen 3.228 N/A ARG 484.A N PRO 481.A O no hydrogen 2.861 N/A ARG 484.A NE GLU 487.A OE1 no hydrogen 2.660 N/A ARG 484.A NH2 GLU 487.A OE2 no hydrogen 3.232 N/A ARG 485.A N PRO 481.A O no hydrogen 3.276 N/A ARG 485.A NH1 GLU 301.A OE2 no hydrogen 2.798 N/A ARG 486.A N SER 482.A O no hydrogen 2.918 N/A ARG 486.A NH1 SER 482.A OG no hydrogen 3.080 N/A GLU 487.A N ALA 483.A O no hydrogen 2.943 N/A LEU 488.A N ARG 484.A O no hydrogen 2.941 N/A VAL 489.A N ARG 485.A O no hydrogen 2.950 N/A LYS 490.A N ARG 486.A O no hydrogen 2.872 N/A ALA 491.A N GLU 487.A O no hydrogen 2.934 N/A TYR 492.A N LEU 488.A O no hydrogen 2.989 N/A TYR 492.A OH VAL 471.A O no hydrogen 2.509 N/A ALA 493.A N VAL 489.A O no hydrogen 2.912 N/A ARG 494.A N LYS 490.A O no hydrogen 2.871 N/A ARG 494.A NH1 GLU 464.A OE2 no hydrogen 2.641 N/A GLY 495.A N ALA 491.A O no hydrogen 2.993 N/A ALA 496.A N TYR 492.A O no hydrogen 2.905 N/A TRP 498.A N ALA 493.A O no hydrogen 3.212 N/A TYR 509.A OH ALA 478.A O no hydrogen 2.508 N/A ARG 511.A N GLU 301.A O no hydrogen 2.934 N/A ARG 511.A NH2 GLU 725.A OE2 no hydrogen 2.396 N/A ILE 512.A N ILE 523.A O no hydrogen 2.883 N/A THR 513.A N ILE 299.A O no hydrogen 2.907 N/A TYR 514.A N ARG 521.A O no hydrogen 2.896 N/A ALA 515.A N ILE 297.A O no hydrogen 2.922 N/A ALA 516.A N ASP 519.A O no hydrogen 2.552 N/A ARG 521.A N TYR 514.A O no hydrogen 2.864 N/A ARG 521.A NE ASP 519.A OD1 no hydrogen 2.698 N/A ARG 521.A NE ASP 519.A OD2 no hydrogen 3.296 N/A ARG 521.A NH2 GLU 291.A OE1 no hydrogen 2.305 N/A ARG 521.A NH2 ASP 519.A OD1 no hydrogen 2.828 N/A ILE 523.A N ILE 512.A O no hydrogen 2.912 N/A HIS 524.A ND1 GLY 508.A O no hydrogen 2.583 N/A HIS 524.A ND1 PRO 510.A O no hydrogen 3.116 N/A PHE 525.A N PRO 510.A O no hydrogen 3.242 N/A SER 528.A OG GLU 305.A OE1 no hydrogen 2.649 N/A SER 528.A OG GLU 305.A OE2 no hydrogen 3.093 N/A SER 531.A N SER 528.A O no hydrogen 2.898 N/A SER 531.A OG SER 528.A O no hydrogen 2.494 N/A ARG 532.A N GLU 529.A O no hydrogen 3.185 N/A ARG 533.A NH2 LEU 660.A O no hydrogen 2.848 N/A LYS 534.A NZ GLN 719.A OE1 no hydrogen 3.446 N/A VAL 535.A N LEU 718.A O no hydrogen 2.924 N/A ALA 536.A N PRO 677.A O no hydrogen 3.090 N/A LEU 537.A N ASP 716.A O no hydrogen 2.785 N/A ARG 538.A N LEU 679.A O no hydrogen 2.953 N/A VAL 540.A N VAL 681.A O no hydrogen 3.089 N/A SER 541.A OG GLU 544.A OE2 no hydrogen 2.603 N/A HIS 545.A N ALA 542.A O no hydrogen 3.039 N/A LEU 551.A N ALA 547.A O no hydrogen 2.620 N/A LEU 552.A N LEU 548.A O no hydrogen 2.891 N/A ALA 553.A N GLY 549.A O no hydrogen 2.909 N/A GLU 554.A N GLN 550.A O no hydrogen 2.931 N/A ALA 555.A N LEU 551.A O no hydrogen 2.941 N/A LEU 556.A N LEU 552.A O no hydrogen 2.801 N/A SER 557.A N GLU 554.A O no hydrogen 3.517 N/A SER 557.A OG GLU 554.A O no hydrogen 2.906 N/A GLY 559.A N LEU 556.A O no hydrogen 2.766 N/A GLY 560.A N HIS 624.A O no hydrogen 2.725 N/A CYS 561.A N ASP 643.A OD2 no hydrogen 2.730 N/A CYS 561.A SG PRO 623.A O no hydrogen 3.708 N/A ALA 562.A N ALA 626.A O no hydrogen 2.988 N/A ALA 563.A N LEU 644.A O no hydrogen 3.119 N/A ILE 564.A N LEU 628.A O no hydrogen 2.812 N/A ILE 565.A N VAL 645.A O no hydrogen 2.791 N/A CYS 566.A N ALA 630.A O no hydrogen 2.817 N/A ASN 567.A N ASP 647.A OD2 no hydrogen 3.199 N/A ASN 567.A ND2 LEU 648.A O no hydrogen 2.836 N/A ASN 567.A ND2 SER 696.A OG no hydrogen 3.199 N/A ARG 571.A N THR 568.A OG1 no hydrogen 3.341 N/A ARG 571.A NE ASP 647.A OD2 no hydrogen 2.707 N/A ARG 571.A NH2 ASP 647.A OD1 no hydrogen 2.628 N/A ARG 571.A NH2 ASP 647.A OD2 no hydrogen 3.048 N/A ALA 572.A N THR 568.A O no hydrogen 3.228 N/A GLN 573.A N VAL 569.A O no hydrogen 2.907 N/A GLN 573.A NE2 LEU 900.A O no hydrogen 2.903 N/A GLN 573.A NE2 ILE 902.A O no hydrogen 2.862 N/A ALA 574.A N PRO 570.A O no hydrogen 2.931 N/A LEU 575.A N ARG 571.A O no hydrogen 2.935 N/A TYR 576.A N ALA 572.A O no hydrogen 2.893 N/A TYR 576.A OH GLU 899.A OE2 no hydrogen 2.720 N/A SER 577.A N GLN 573.A O no hydrogen 2.934 N/A SER 577.A OG GLN 573.A O no hydrogen 3.052 N/A ALA 578.A N ALA 574.A O no hydrogen 2.919 N/A LEU 579.A N LEU 575.A O no hydrogen 2.928 N/A LEU 579.A N TYR 576.A O no hydrogen 3.026 N/A ARG 580.A NE GLU 899.A OE2 no hydrogen 2.585 N/A VAL 582.A N LEU 579.A O no hydrogen 3.226 N/A PHE 583.A N LEU 579.A O no hydrogen 3.224 N/A GLY 585.A N GLU 592.A OE1 no hydrogen 3.329 N/A GLY 590.A N ALA 587.A O no hydrogen 3.068 N/A GLU 592.A N GLY 585.A O no hydrogen 3.035 N/A ASP 594.A N ILE 627.A O no hydrogen 2.922 N/A LEU 595.A N ASP 594.A OD1 no hydrogen 2.833 N/A LEU 596.A N VAL 629.A O no hydrogen 2.993 N/A HIS 597.A NE2 LEU 900.A O no hydrogen 2.958 N/A ARG 599.A N HIS 597.A ND1 no hydrogen 3.035 N/A ARG 599.A NH1 ILE 902.A O no hydrogen 3.300 N/A TYR 600.A N ALA 598.A O no hydrogen 2.821 N/A TYR 600.A OH GLU 899.A O no hydrogen 2.629 N/A TYR 602.A OH SER 365.A OG no hydrogen 2.437 N/A GLU 603.A N ARG 845.A O no hydrogen 3.297 N/A ARG 605.A N PRO 601.A O no hydrogen 3.156 N/A GLU 606.A N TYR 602.A O no hydrogen 2.959 N/A VAL 607.A N GLU 603.A O no hydrogen 2.992 N/A ARG 608.A N GLU 604.A O no hydrogen 2.952 N/A ARG 608.A NE LEU 595.A O no hydrogen 2.954 N/A ARG 608.A NH1 PRO 898.A O no hydrogen 3.231 N/A GLU 609.A N ARG 605.A O no hydrogen 2.907 N/A ALA 610.A N GLU 606.A O no hydrogen 2.956 N/A ARG 611.A N VAL 607.A O no hydrogen 2.973 N/A ARG 611.A NE ASP 594.A OD2 no hydrogen 2.905 N/A ARG 611.A NH2 ASP 594.A OD1 no hydrogen 2.901 N/A ARG 611.A NH2 ASP 594.A OD2 no hydrogen 3.384 N/A THR 612.A N ARG 608.A O no hydrogen 2.954 N/A THR 612.A OG1 ARG 608.A O no hydrogen 3.218 N/A LEU 613.A N GLU 609.A O no hydrogen 2.912 N/A GLY 614.A N ALA 610.A O no hydrogen 2.937 N/A ARG 615.A N ARG 611.A O no hydrogen 2.967 N/A ARG 615.A N THR 612.A O no hydrogen 3.106 N/A ARG 615.A NE ASP 589.A OD2 no hydrogen 2.689 N/A ARG 615.A NH1 PRO 591.A O no hydrogen 3.071 N/A ARG 615.A NH1 GLU 592.A O no hydrogen 3.521 N/A ARG 615.A NH2 ASP 589.A OD1 no hydrogen 2.956 N/A ARG 615.A NH2 ASP 589.A OD2 no hydrogen 3.222 N/A ARG 615.A NH2 PRO 591.A O no hydrogen 2.938 N/A PHE 616.A N THR 612.A O no hydrogen 2.922 N/A SER 617.A N LEU 613.A O no hydrogen 3.201 N/A SER 617.A OG LEU 613.A O no hydrogen 2.444 N/A GLY 620.A N SER 617.A O no hydrogen 2.960 N/A ARG 622.A NH2 ASP 641.A O no hydrogen 2.392 N/A HIS 624.A N GLU 588.A OE1 no hydrogen 3.303 N/A HIS 624.A N GLU 588.A OE2 no hydrogen 3.378 N/A ARG 625.A NE GLU 592.A OE2 no hydrogen 2.729 N/A ARG 625.A NH2 GLU 592.A OE1 no hydrogen 2.589 N/A ARG 625.A NH2 GLU 592.A OE2 no hydrogen 3.172 N/A ALA 626.A N GLY 560.A O no hydrogen 3.404 N/A ILE 627.A N GLU 592.A O no hydrogen 2.761 N/A LEU 628.A N ALA 562.A O no hydrogen 2.872 N/A VAL 629.A N ASP 594.A O no hydrogen 2.996 N/A ALA 630.A N ILE 564.A O no hydrogen 3.024 N/A THR 631.A N LEU 596.A O no hydrogen 3.314 N/A GLN 632.A N GLN 632.A OE1 no hydrogen 2.818 N/A GLN 632.A NE2 ASN 567.A O no hydrogen 3.273 N/A ILE 634.A N THR 631.A O no hydrogen 3.319 N/A GLN 636.A NE2 HIS 450.A NE2 no hydrogen 2.856 N/A SER 637.A OG VAL 633.A O no hydrogen 2.864 N/A ASP 639.A N GLN 336.A OE1 no hydrogen 3.133 N/A ASP 641.A N PHE 616.A O no hydrogen 2.931 N/A PHE 642.A N ARG 659.A O no hydrogen 3.035 N/A LEU 644.A N CYS 561.A O no hydrogen 3.109 N/A THR 646.A N TRP 680.A O no hydrogen 2.896 N/A THR 646.A OG1 ASP 647.A O no hydrogen 2.774 N/A ASP 647.A N ILE 565.A O no hydrogen 2.986 N/A ASP 652.A N ASP 652.A OD1 no hydrogen 2.522 N/A LEU 653.A N PRO 650.A O no hydrogen 2.853 N/A VAL 654.A N PRO 650.A O no hydrogen 3.116 N/A LEU 655.A N VAL 651.A O no hydrogen 2.871 N/A GLN 656.A N ASP 652.A O no hydrogen 2.921 N/A ARG 657.A N LEU 653.A O no hydrogen 2.920 N/A ARG 657.A NE GLU 635.A OE1 no hydrogen 2.608 N/A ARG 657.A NH1 ASN 567.A OD1 no hydrogen 2.990 N/A ARG 657.A NH1 THR 646.A OG1 no hydrogen 2.691 N/A ARG 657.A NH2 ASN 567.A OD1 no hydrogen 2.881 N/A ARG 657.A NH2 GLU 635.A OE1 no hydrogen 2.904 N/A ARG 659.A N ARG 657.A O no hydrogen 3.257 N/A ARG 659.A NE ILE 634.A O no hydrogen 3.038 N/A ARG 659.A NH2 ILE 634.A O no hydrogen 3.555 N/A HIS 661.A N PHE 642.A O no hydrogen 2.931 N/A HIS 661.A NE2 ASP 643.A O no hydrogen 2.965 N/A HIS 663.A N ASP 641.A OD2 no hydrogen 2.719 N/A HIS 666.A N HIS 663.A O no hydrogen 3.108 N/A HIS 666.A ND1 ASP 641.A OD2 no hydrogen 2.889 N/A ASP 667.A N PRO 664.A O no hydrogen 2.897 N/A ARG 670.A N ASP 667.A O no hydrogen 3.159 N/A ARG 670.A NE ASP 643.A OD1 no hydrogen 2.827 N/A ARG 670.A NH2 ASP 641.A OD1 no hydrogen 2.648 N/A ARG 670.A NH2 HIS 663.A O no hydrogen 3.554 N/A ARG 673.A NE ARG 673.A O no hydrogen 3.076 N/A LEU 674.A N PRO 671.A O no hydrogen 2.892 N/A ARG 675.A NH1 ASP 667.A O no hydrogen 2.359 N/A ARG 675.A NH1 ARG 670.A O no hydrogen 3.542 N/A LEU 679.A N ALA 536.A O no hydrogen 2.836 N/A TRP 680.A NE1 GLU 678.A OE2 no hydrogen 2.977 N/A VAL 681.A N ARG 538.A O no hydrogen 2.919 N/A VAL 682.A N THR 646.A O no hydrogen 2.895 N/A SER 683.A N VAL 540.A O no hydrogen 2.735 N/A SER 683.A OG PRO 684.A O no hydrogen 3.107 N/A ILE 691.A N GLN 685.A O no hydrogen 2.855 N/A SER 696.A N ASP 693.A OD1 no hydrogen 2.833 N/A SER 696.A OG ASP 693.A OD1 no hydrogen 2.735 N/A SER 696.A OG ASP 693.A OD2 no hydrogen 2.831 N/A ALA 697.A N ASP 693.A O no hydrogen 3.001 N/A SER 698.A N ARG 694.A O no hydrogen 2.907 N/A SER 698.A OG ARG 694.A O no hydrogen 3.258 N/A SER 698.A OG GLY 695.A O no hydrogen 2.594 N/A VAL 699.A N GLY 695.A O no hydrogen 2.937 N/A TYR 700.A N SER 696.A O no hydrogen 2.851 N/A ASP 701.A N TYR 452.A OH no hydrogen 2.806 N/A HIS 703.A ND1 THR 752.A OG1 no hydrogen 2.934 N/A THR 704.A N ASP 701.A OD2 no hydrogen 3.024 N/A THR 704.A OG1 ASP 701.A OD2 no hydrogen 3.010 N/A LEU 705.A N ASP 701.A O no hydrogen 3.131 N/A LEU 706.A N GLU 702.A O no hydrogen 2.922 N/A ARG 707.A N HIS 703.A O no hydrogen 2.897 N/A SER 708.A N THR 704.A O no hydrogen 2.923 N/A SER 708.A OG ALA 649.A O no hydrogen 3.348 N/A SER 708.A OG THR 704.A O no hydrogen 2.830 N/A TRP 709.A N LEU 705.A O no hydrogen 2.918 N/A LEU 710.A N LEU 706.A O no hydrogen 2.894 N/A ALA 711.A N ARG 707.A O no hydrogen 2.930 N/A LEU 712.A N SER 708.A O no hydrogen 2.941 N/A LEU 712.A N TRP 709.A O no hydrogen 3.325 N/A ARG 713.A N TRP 709.A O no hydrogen 2.881 N/A ARG 713.A NH1 GLN 739.A OE1 no hydrogen 2.291 N/A ARG 715.A N LEU 712.A O no hydrogen 3.143 N/A ARG 715.A NH1 ASP 723.A OD2 no hydrogen 3.140 N/A ARG 715.A NH2 ASP 723.A OD2 no hydrogen 3.557 N/A LEU 718.A N VAL 535.A O no hydrogen 2.888 N/A GLN 719.A N ASP 723.A OD2 no hydrogen 2.724 N/A GLN 719.A NE2 LEU 720.A O no hydrogen 2.996 N/A LEU 720.A N ARG 533.A O no hydrogen 3.064 N/A GLU 722.A N GLU 722.A OE2 no hydrogen 2.611 N/A ASP 723.A N GLN 719.A O no hydrogen 2.863 N/A ILE 724.A N PRO 721.A O no hydrogen 3.027 N/A GLU 726.A N GLU 722.A O no hydrogen 2.942 N/A LEU 727.A N ASP 723.A O no hydrogen 2.887 N/A VAL 728.A N ILE 724.A O no hydrogen 3.028 N/A GLU 729.A N GLU 725.A O no hydrogen 2.896 N/A GLN 730.A N GLU 726.A O no hydrogen 2.901 N/A VAL 731.A N LEU 727.A O no hydrogen 2.928 N/A TYR 732.A N VAL 728.A O no hydrogen 3.215 N/A TYR 732.A OH ASP 652.A OD1 no hydrogen 2.537 N/A SER 733.A OG GLU 729.A OE2 no hydrogen 3.171 N/A ASP 734.A N TYR 732.A O no hydrogen 2.841 N/A SER 742.A N ASP 688.A OD2 no hydrogen 2.854 N/A SER 742.A OG ASP 688.A OD1 no hydrogen 2.373 N/A SER 742.A OG ASP 688.A OD2 no hydrogen 2.847 N/A LEU 745.A N SER 742.A OG no hydrogen 3.320 N/A ARG 746.A N SER 742.A O no hydrogen 3.247 N/A SER 747.A N GLU 743.A O no hydrogen 2.892 N/A LEU 748.A N GLU 744.A O no hydrogen 2.909 N/A TRP 749.A N LEU 745.A O no hydrogen 2.926 N/A GLU 750.A N ARG 746.A O no hydrogen 2.933 N/A ARG 751.A N SER 747.A O no hydrogen 2.908 N/A ARG 751.A NH1 SER 747.A OG no hydrogen 2.814 N/A THR 752.A N LEU 748.A O no hydrogen 2.942 N/A THR 752.A OG1 HIS 703.A ND1 no hydrogen 2.934 N/A THR 752.A OG1 LEU 748.A O no hydrogen 2.663 N/A THR 752.A OG1 TRP 749.A O no hydrogen 3.042 N/A PHE 753.A N TRP 749.A O no hydrogen 2.934 N/A LYS 754.A N GLU 750.A O no hydrogen 2.919 N/A ALA 755.A N ARG 751.A O no hydrogen 2.952 N/A GLN 756.A N THR 752.A O no hydrogen 2.945 N/A GLN 756.A NE2 ASP 701.A OD2 no hydrogen 2.767 N/A GLN 757.A N PHE 753.A O no hydrogen 2.935 N/A GLN 757.A NE2 GLN 756.A OE1 no hydrogen 2.847 N/A LYS 758.A N LYS 754.A O no hydrogen 2.900 N/A VAL 759.A N ALA 755.A O no hydrogen 2.977 N/A LEU 760.A N GLN 756.A O no hydrogen 2.991 N/A ARG 761.A N GLN 757.A O no hydrogen 2.883 N/A GLU 762.A N LYS 758.A O no hydrogen 2.943 N/A ASP 763.A N VAL 759.A O no hydrogen 2.953 N/A SER 764.A N LEU 760.A O no hydrogen 2.964 N/A SER 764.A OG ARG 761.A O no hydrogen 2.608 N/A LEU 765.A N ARG 761.A O no hydrogen 2.944 N/A GLN 766.A N GLU 762.A O no hydrogen 3.142 N/A ALA 767.A N SER 764.A O no hydrogen 3.410 N/A TYR 769.A N GLN 766.A O no hydrogen 3.105 N/A ARG 770.A N ALA 767.A O no hydrogen 3.142 N/A ARG 770.A NH1 ASP 763.A OD1 no hydrogen 2.773 N/A TYR 771.A N ALA 767.A O no hydrogen 2.937 N/A TYR 771.A OH ASP 763.A OD1 no hydrogen 3.199 N/A TYR 771.A OH ASP 763.A OD2 no hydrogen 3.069 N/A ILE 772.A N VAL 426.A O no hydrogen 2.790 N/A LYS 773.A N ILE 783.A O no hydrogen 3.120 N/A LYS 773.A NZ GLY 782.A O no hydrogen 3.107 N/A TYR 777.A N GLY 774.A O no hydrogen 3.120 N/A SER 779.A OG TRP 781.A O no hydrogen 2.870 N/A THR 785.A N GLN 428.A OE1 no hydrogen 2.915 N/A ASP 791.A N ALA 388.A O no hydrogen 3.219 N/A ALA 798.A N LEU 795.A O no hydrogen 3.302 N/A GLN 800.A N LEU 795.A O no hydrogen 3.472 N/A GLN 800.A NE2 GLU 807.A O no hydrogen 3.118 N/A ALA 801.A N ALA 798.A O no hydrogen 3.068 N/A LEU 802.A N ALA 798.A O no hydrogen 3.148 N/A THR 803.A N LEU 799.A O no hydrogen 3.149 N/A THR 803.A OG1 LEU 799.A O no hydrogen 2.604 N/A THR 803.A OG1 GLN 800.A O no hydrogen 3.451 N/A ARG 804.A N ALA 801.A O no hydrogen 2.840 N/A LEU 805.A N GLN 800.A O no hydrogen 2.577 N/A ALA 806.A N GLN 800.A O no hydrogen 3.298 N/A GLU 807.A N GLU 807.A OE1 no hydrogen 2.694 N/A VAL 810.A N ILE 850.A O no hydrogen 2.924 N/A ALA 812.A N VAL 848.A O no hydrogen 2.905 N/A VAL 813.A N ARG 878.A O no hydrogen 2.889 N/A CYS 814.A N ARG 846.A O no hydrogen 2.993 N/A CYS 814.A SG ARG 846.A O no hydrogen 3.649 N/A LEU 815.A N LEU 880.A O no hydrogen 2.901 N/A VAL 816.A N CYS 823.A O no hydrogen 2.870 N/A ALA 817.A N PHE 882.A O no hydrogen 2.860 N/A CYS 823.A N VAL 816.A O no hydrogen 2.860 N/A CYS 823.A SG GLY 821.A O no hydrogen 3.730 N/A CYS 823.A SG GLY 827.A O no hydrogen 3.918 N/A LEU 824.A N THR 828.A O no hydrogen 2.968 N/A VAL 830.A N PRO 822.A O no hydrogen 2.856 N/A ASP 833.A N ASP 831.A OD1 no hydrogen 3.303 N/A THR 834.A OG1 ASP 831.A OD2 no hydrogen 2.337 N/A GLU 841.A N ALA 838.A O no hydrogen 2.937 N/A ARG 842.A N ALA 839.A O no hydrogen 2.986 N/A LEU 844.A N ALA 840.A O no hydrogen 2.902 N/A ARG 845.A N GLU 841.A O no hydrogen 3.007 N/A ARG 845.A NE GLU 603.A OE2 no hydrogen 3.431 N/A ARG 845.A NH1 GLU 841.A OE1 no hydrogen 3.301 N/A ARG 846.A N LEU 843.A O no hydrogen 2.894 N/A ARG 846.A NE CYS 814.A O no hydrogen 3.065 N/A ARG 846.A NH1 GLU 603.A OE1 no hydrogen 2.750 N/A SER 847.A N LEU 844.A O no hydrogen 3.123 N/A SER 847.A OG LEU 844.A O no hydrogen 2.488 N/A VAL 848.A N ALA 812.A O no hydrogen 2.876 N/A ILE 850.A N VAL 810.A O no hydrogen 2.915 N/A THR 851.A OG1 PRO 808.A O no hydrogen 2.938 N/A ARG 854.A N ASP 852.A OD1 no hydrogen 3.010 N/A ARG 854.A NE ASP 852.A OD1 no hydrogen 2.834 N/A ARG 854.A NH2 ASP 852.A OD2 no hydrogen 2.994 N/A LEU 859.A N VAL 855.A O no hydrogen 3.011 N/A LEU 860.A N LEU 856.A O no hydrogen 3.106 N/A ASP 861.A N ASP 857.A O no hydrogen 3.040 N/A VAL 862.A N LEU 859.A O no hydrogen 3.137 N/A GLY 867.A N LEU 832.A O no hydrogen 2.826 N/A GLU 869.A N PRO 865.A O no hydrogen 3.114 N/A ARG 870.A NH1 ASP 391.A OD1 no hydrogen 3.223 N/A ARG 870.A NH1 ASP 391.A OD2 no hydrogen 3.192 N/A ARG 870.A NH1 GLN 393.A OE1 no hydrogen 2.527 N/A ARG 870.A NH2 ASP 391.A OD2 no hydrogen 2.721 N/A SER 871.A N TRP 868.A O no hydrogen 3.007 N/A SER 872.A OG VAL 397.A O no hydrogen 2.741 N/A LEU 874.A N SER 871.A OG no hydrogen 3.030 N/A ARG 875.A N SER 871.A O no hydrogen 2.899 N/A ARG 875.A NE GLU 869.A O no hydrogen 2.884 N/A ARG 875.A NH2 GLU 869.A O no hydrogen 3.173 N/A TYR 877.A N LEU 874.A O no hydrogen 3.235 N/A ARG 878.A N SER 811.A O no hydrogen 2.941 N/A ARG 878.A NE VAL 862.A O no hydrogen 2.737 N/A ARG 878.A NH1 GLY 876.A O no hydrogen 2.838 N/A ARG 878.A NH2 LEU 860.A O no hydrogen 3.334 N/A LEU 880.A N VAL 813.A O no hydrogen 2.873 N/A PHE 882.A N LEU 815.A O no hydrogen 2.885 N/A ASP 883.A N ARG 887.A O no hydrogen 2.807 N/A SER 885.A N ASP 883.A OD1 no hydrogen 3.015 N/A GLY 886.A N ASP 883.A O no hydrogen 2.954 N/A ARG 887.A N ASP 883.A OD1 no hydrogen 2.812 N/A ALA 888.A N VAL 894.A O no hydrogen 2.877 N/A TRP 892.A N VAL 889.A O no hydrogen 3.021 N/A ILE 893.A N GLU 905.A O no hydrogen 2.891 N/A VAL 894.A N ALA 888.A O no hydrogen 2.896 N/A ARG 895.A N VAL 903.A O no hydrogen 2.889 N/A ARG 895.A NH1 ASP 897.A OD2 no hydrogen 2.713 N/A ILE 896.A N GLY 886.A O no hydrogen 2.851 N/A ASP 897.A N GLY 901.A O no hydrogen 2.923 N/A GLU 899.A N ASP 897.A OD1 no hydrogen 2.863 N/A LEU 900.A N ASP 897.A OD1 no hydrogen 2.781 N/A GLY 901.A N ASP 897.A O no hydrogen 2.785 N/A ILE 902.A N ARG 599.A O no hydrogen 3.042 N/A VAL 903.A N ARG 895.A O no hydrogen 2.865 N/A GLU 905.A N ILE 893.A O no hydrogen 2.920 N/A