Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7bw2_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 7.A N PRO 5.A O no hydrogen 2.915 N/A LEU 11.A N SER 8.A OG no hydrogen 3.096 N/A GLN 13.A N GLN 9.A O no hydrogen 3.006 N/A ASP 14.A N ASP 10.A O no hydrogen 2.999 N/A THR 16.A OG1 PRO 15.A O no hydrogen 2.685 N/A THR 17.A N LYS 702.A O no hydrogen 3.215 N/A TRP 21.A N ARG 18.A O no hydrogen 3.222 N/A ALA 23.A N ARG 19.A O no hydrogen 2.891 N/A ILE 24.A N ILE 20.A O no hydrogen 3.005 N/A MET 26.A N TYR 22.A O no hydrogen 2.923 N/A ALA 27.A N ALA 23.A O no hydrogen 2.976 N/A ALA 27.A N ILE 24.A O no hydrogen 3.260 N/A HIS 28.A N ALA 25.A O no hydrogen 3.289 N/A PHE 30.A N HIS 28.A O no hydrogen 3.047 N/A SER 32.A N ASP 29.A O no hydrogen 3.159 N/A SER 32.A OG ASP 29.A O no hydrogen 2.677 N/A HIS 33.A N PHE 30.A O no hydrogen 2.719 N/A MET 36.A N HIS 33.A O no hydrogen 2.982 N/A ASN 40.A N THR 37.A OG1 no hydrogen 3.277 N/A LEU 41.A N THR 37.A O no hydrogen 3.030 N/A TYR 42.A N GLU 38.A O no hydrogen 3.263 N/A GLN 43.A N GLU 39.A O no hydrogen 3.109 N/A LYS 44.A N ASN 40.A O no hydrogen 2.892 N/A ILE 45.A N LEU 41.A O no hydrogen 3.000 N/A PHE 46.A N TYR 42.A O no hydrogen 2.921 N/A ALA 47.A N GLN 43.A O no hydrogen 3.234 N/A SER 48.A N LYS 44.A O no hydrogen 2.843 N/A SER 48.A OG LYS 44.A O no hydrogen 2.839 N/A HIS 49.A N ILE 45.A O no hydrogen 2.820 N/A PHE 50.A N PHE 46.A O no hydrogen 3.264 N/A GLY 51.A N ALA 47.A O no hydrogen 3.222 N/A HIS 52.A N SER 48.A O no hydrogen 2.964 N/A LEU 53.A N HIS 49.A O no hydrogen 2.830 N/A ALA 54.A N PHE 50.A O no hydrogen 2.929 N/A ILE 55.A N GLY 51.A O no hydrogen 3.218 N/A ILE 56.A N HIS 52.A O no hydrogen 3.210 N/A PHE 57.A N LEU 53.A O no hydrogen 3.122 N/A LEU 58.A N ALA 54.A O no hydrogen 2.840 N/A TRP 59.A N ILE 55.A O no hydrogen 2.824 N/A VAL 60.A N ILE 56.A O no hydrogen 3.083 N/A SER 61.A N PHE 57.A O no hydrogen 3.017 N/A SER 61.A OG ALA 138.A O no hydrogen 2.727 N/A GLY 62.A N LEU 58.A O no hydrogen 2.982 N/A GLY 62.A N TRP 59.A O no hydrogen 3.093 N/A SER 63.A N TRP 59.A O no hydrogen 3.224 N/A SER 63.A OG TRP 59.A O no hydrogen 3.467 N/A LEU 64.A N VAL 60.A O no hydrogen 3.002 N/A PHE 65.A N SER 61.A O no hydrogen 2.934 N/A HIS 66.A N GLY 62.A O no hydrogen 2.932 N/A VAL 67.A N SER 63.A O no hydrogen 3.038 N/A ALA 68.A N LEU 64.A O no hydrogen 2.868 N/A TRP 69.A N PHE 65.A O no hydrogen 2.841 N/A GLN 70.A N HIS 66.A O no hydrogen 2.728 N/A GLU 74.A N ASN 72.A O no hydrogen 2.836 N/A VAL 77.A N PHE 73.A O no hydrogen 2.928 N/A GLN 78.A N GLU 74.A O no hydrogen 2.586 N/A ASP 79.A N GLN 75.A O no hydrogen 3.235 N/A ASN 82.A N ASP 79.A OD1 no hydrogen 2.834 N/A THR 83.A N ASP 79.A O no hydrogen 3.204 N/A THR 83.A OG1 ASP 79.A O no hydrogen 3.469 N/A ILE 86.A N TYR 120.A OH no hydrogen 2.686 N/A ALA 87.A N ASP 113.A O no hydrogen 2.650 N/A HIS 88.A ND1 ALA 89.A O no hydrogen 2.858 N/A ALA 89.A N GLN 70.A OE1 no hydrogen 2.659 N/A ILE 90.A N PRO 111.A O no hydrogen 3.026 N/A GLN 94.A N ASP 92.A OD1 no hydrogen 3.017 N/A PHE 95.A N ASP 92.A O no hydrogen 3.058 N/A VAL 100.A N GLY 96.A O no hydrogen 2.971 N/A ASP 101.A N LYS 97.A O no hydrogen 2.824 N/A ALA 102.A N ALA 98.A O no hydrogen 2.775 N/A PHE 103.A N ALA 99.A O no hydrogen 3.117 N/A THR 104.A N VAL 100.A O no hydrogen 3.169 N/A THR 104.A N ASP 101.A O no hydrogen 3.078 N/A THR 104.A OG1 VAL 100.A O no hydrogen 2.525 N/A GLN 105.A NE2 VAL 112.A O no hydrogen 3.433 N/A ALA 108.A N GLN 105.A O no hydrogen 2.842 N/A ASN 110.A ND2 PRO 111.A O no hydrogen 3.078 N/A VAL 112.A N PHE 103.A O no hydrogen 2.901 N/A ASP 113.A N HIS 88.A O no hydrogen 3.022 N/A ALA 115.A N PRO 85.A O no hydrogen 2.850 N/A TYR 120.A OH ILE 86.A O no hydrogen 2.699 N/A TRP 122.A N GLY 118.A O no hydrogen 3.069 N/A TRP 123.A N VAL 119.A O no hydrogen 2.851 N/A TYR 124.A N TYR 120.A O no hydrogen 2.898 N/A TYR 124.A OH PHE 243.A O no hydrogen 3.408 N/A THR 125.A N HIS 121.A O no hydrogen 2.987 N/A THR 125.A OG1 HIS 121.A O no hydrogen 2.710 N/A ILE 126.A N TRP 122.A O no hydrogen 3.244 N/A GLY 127.A N TYR 124.A O no hydrogen 2.894 N/A MET 128.A N TRP 123.A O no hydrogen 2.829 N/A ARG 129.A N ASP 133.A OD2 no hydrogen 2.662 N/A ARG 129.A NH1 TYR 124.A O no hydrogen 2.838 N/A ARG 129.A NH1 MET 128.A O no hydrogen 2.868 N/A THR 130.A N ASP 133.A OD2 no hydrogen 3.038 N/A ASP 133.A N THR 130.A O no hydrogen 2.793 N/A ASP 133.A N THR 130.A OG1 no hydrogen 3.279 N/A LEU 134.A N THR 130.A O no hydrogen 3.151 N/A TYR 135.A N ASN 131.A O no hydrogen 2.927 N/A GLN 136.A N GLY 132.A O no hydrogen 3.063 N/A GLY 137.A N ASP 133.A O no hydrogen 3.219 N/A ALA 138.A N LEU 134.A O no hydrogen 2.940 N/A ILE 139.A N TYR 135.A O no hydrogen 2.968 N/A PHE 140.A N GLN 136.A O no hydrogen 2.937 N/A LEU 141.A N GLY 137.A O no hydrogen 2.968 N/A LEU 142.A N ALA 138.A O no hydrogen 3.075 N/A ILE 143.A N ILE 139.A O no hydrogen 3.080 N/A LEU 144.A N PHE 140.A O no hydrogen 2.896 N/A ALA 145.A N LEU 141.A O no hydrogen 2.823 N/A SER 146.A N LEU 142.A O no hydrogen 3.139 N/A SER 146.A OG LEU 142.A O no hydrogen 2.999 N/A LEU 147.A N ILE 143.A O no hydrogen 2.890 N/A ALA 148.A N LEU 144.A O no hydrogen 2.975 N/A LEU 149.A N ALA 145.A O no hydrogen 2.858 N/A PHE 150.A N SER 146.A O no hydrogen 2.807 N/A ALA 151.A N LEU 147.A O no hydrogen 2.833 N/A GLY 152.A N ALA 148.A O no hydrogen 3.044 N/A TRP 153.A N LEU 149.A O no hydrogen 3.071 N/A LEU 154.A N PHE 150.A O no hydrogen 2.755 N/A HIS 155.A N ALA 151.A O no hydrogen 2.939 N/A HIS 155.A ND1 PHE 160.A O no hydrogen 3.100 N/A LEU 156.A N TRP 153.A O no hydrogen 3.290 N/A GLN 157.A N LEU 154.A O no hydrogen 2.934 N/A GLN 157.A NE2 TRP 153.A O no hydrogen 3.036 N/A PHE 160.A N GLN 157.A O no hydrogen 2.826 N/A SER 163.A OG SER 165.A OG no hydrogen 2.805 N/A LEU 164.A N GLU 39.A OE1 no hydrogen 3.028 N/A SER 165.A OG SER 163.A OG no hydrogen 2.805 N/A TRP 166.A N SER 163.A O no hydrogen 3.022 N/A PHE 167.A N SER 163.A O no hydrogen 3.376 N/A LYS 168.A N LEU 164.A O no hydrogen 3.131 N/A LYS 168.A N SER 165.A O no hydrogen 3.203 N/A LYS 168.A NZ TYR 42.A OH no hydrogen 3.200 N/A ASN 169.A N TRP 166.A O no hydrogen 3.432 N/A SER 172.A N ASN 169.A OD1 no hydrogen 3.056 N/A LEU 174.A N ALA 170.A O no hydrogen 3.035 N/A ASN 175.A N GLU 171.A O no hydrogen 3.140 N/A ASN 175.A ND2 TYR 290.A O no hydrogen 2.592 N/A HIS 176.A N SER 172.A O no hydrogen 3.116 N/A HIS 176.A ND1 SER 172.A O no hydrogen 2.938 N/A HIS 177.A N ARG 173.A O no hydrogen 2.735 N/A LEU 178.A N LEU 174.A O no hydrogen 2.714 N/A ALA 179.A N ASN 175.A O no hydrogen 3.027 N/A GLY 180.A N HIS 176.A O no hydrogen 2.767 N/A LEU 181.A N HIS 176.A O no hydrogen 3.068 N/A PHE 182.A N HIS 177.A O no hydrogen 2.837 N/A GLY 183.A N LEU 178.A O no hydrogen 2.849 N/A VAL 184.A N ALA 179.A O no hydrogen 2.785 N/A SER 185.A N GLY 180.A O no hydrogen 3.307 N/A SER 185.A OG LEU 181.A O no hydrogen 2.655 N/A SER 186.A N PHE 182.A O no hydrogen 2.937 N/A SER 186.A OG HIS 276.A O no hydrogen 2.820 N/A LEU 187.A N GLY 183.A O no hydrogen 2.964 N/A ALA 188.A N VAL 184.A O no hydrogen 2.845 N/A TRP 189.A N SER 185.A O no hydrogen 2.772 N/A ALA 190.A N SER 186.A O no hydrogen 2.901 N/A GLY 191.A N LEU 187.A O no hydrogen 3.038 N/A HIS 192.A N ALA 188.A O no hydrogen 3.009 N/A LEU 193.A N TRP 189.A O no hydrogen 2.786 N/A ILE 194.A N ALA 190.A O no hydrogen 2.920 N/A HIS 195.A N GLY 191.A O no hydrogen 2.908 N/A VAL 196.A N HIS 192.A O no hydrogen 2.753 N/A ALA 197.A N HIS 192.A O no hydrogen 3.319 N/A ILE 198.A N LEU 193.A O no hydrogen 2.760 N/A GLU 200.A N VAL 196.A O no hydrogen 2.620 N/A ARG 202.A N PRO 199.A O no hydrogen 2.972 N/A GLY 203.A N GLU 200.A O no hydrogen 3.256 N/A VAL 206.A N GLU 200.A OE1 no hydrogen 2.915 N/A GLY 207.A N ASN 210.A OD1 no hydrogen 2.930 N/A ASN 210.A N GLY 207.A O no hydrogen 3.056 N/A ASN 210.A ND2 HIS 205.A O no hydrogen 3.538 N/A PHE 211.A N GLY 207.A O no hydrogen 2.719 N/A SER 213.A N ASN 210.A O no hydrogen 2.691 N/A SER 213.A OG ASN 210.A O no hydrogen 3.177 N/A THR 214.A OG1 ASN 210.A O no hydrogen 3.329 N/A GLY 220.A N HIS 217.A O no hydrogen 2.970 N/A LEU 221.A N TYR 232.A OH no hydrogen 2.802 N/A PHE 225.A N ALA 222.A O no hydrogen 3.209 N/A THR 226.A N ALA 222.A O no hydrogen 3.232 N/A THR 226.A OG1 ALA 222.A O no hydrogen 3.075 N/A THR 226.A OG1 ASN 228.A OD1 no hydrogen 2.846 N/A TRP 229.A NE1 PHE 224.A O no hydrogen 3.019 N/A VAL 231.A N ASN 228.A O no hydrogen 3.306 N/A TYR 232.A N TRP 229.A O no hydrogen 3.067 N/A ALA 233.A N GLY 230.A O no hydrogen 2.970 N/A GLN 234.A N VAL 231.A O no hydrogen 3.214 N/A THR 238.A N GLY 248.A O no hydrogen 2.932 N/A THR 238.A OG1 SER 240.A OG no hydrogen 2.952 N/A THR 238.A OG1 GLY 248.A O no hydrogen 2.905 N/A SER 240.A N THR 238.A OG1 no hydrogen 3.330 N/A SER 240.A OG THR 238.A OG1 no hydrogen 2.952 N/A HIS 241.A N THR 238.A O no hydrogen 2.929 N/A HIS 241.A NE2 THR 245.A O no hydrogen 3.180 N/A VAL 242.A N GLN 247.A O no hydrogen 2.912 N/A THR 245.A N VAL 242.A O no hydrogen 2.934 N/A THR 245.A OG1 VAL 242.A O no hydrogen 2.619 N/A ALA 249.A N ALA 246.A O no hydrogen 2.997 N/A GLY 250.A N ASP 237.A OD2 no hydrogen 3.178 N/A THR 251.A OG1 ASN 235.A OD1 no hydrogen 2.685 N/A ALA 252.A N ASN 235.A O no hydrogen 2.662 N/A ILE 253.A N TYR 232.A O no hydrogen 3.032 N/A LEU 254.A N TYR 232.A O no hydrogen 3.130 N/A THR 255.A N THR 270.A O no hydrogen 3.355 N/A THR 255.A OG1 THR 270.A OG1 no hydrogen 2.531 N/A THR 255.A OG1 ASP 271.A OD1 no hydrogen 2.515 N/A LEU 257.A N ASP 271.A OD1 no hydrogen 2.995 N/A GLY 258.A N ASP 271.A OD2 no hydrogen 2.952 N/A HIS 261.A N SER 266.A O no hydrogen 2.970 N/A HIS 261.A NE2 HIS 241.A ND1 no hydrogen 3.144 N/A GLN 263.A N HIS 261.A ND1 no hydrogen 3.172 N/A THR 264.A N HIS 261.A ND1 no hydrogen 3.276 N/A THR 264.A OG1 SER 266.A OG no hydrogen 3.005 N/A GLU 265.A N HIS 261.A O no hydrogen 2.861 N/A SER 266.A OG THR 264.A OG1 no hydrogen 3.005 N/A LEU 267.A N PRO 359.A O no hydrogen 2.920 N/A THR 270.A OG1 THR 255.A OG1 no hydrogen 2.531 N/A MET 272.A N TRP 268.A O no hydrogen 3.029 N/A ALA 273.A N LEU 269.A O no hydrogen 2.826 N/A HIS 274.A N THR 270.A O no hydrogen 3.185 N/A HIS 275.A N ASP 271.A O no hydrogen 2.921 N/A HIS 276.A N MET 272.A O no hydrogen 3.214 N/A HIS 276.A ND1 MET 272.A O no hydrogen 3.074 N/A LEU 277.A N ALA 273.A O no hydrogen 3.124 N/A ALA 278.A N HIS 274.A O no hydrogen 2.933 N/A ILE 279.A N HIS 275.A O no hydrogen 2.911 N/A ALA 280.A N HIS 276.A O no hydrogen 2.786 N/A VAL 281.A N LEU 277.A O no hydrogen 3.280 N/A LEU 282.A N ALA 278.A O no hydrogen 3.225 N/A PHE 283.A N ILE 279.A O no hydrogen 3.014 N/A ILE 284.A N ALA 280.A O no hydrogen 2.899 N/A VAL 285.A N VAL 281.A O no hydrogen 3.018 N/A ALA 286.A N LEU 282.A O no hydrogen 3.028 N/A GLY 287.A N PHE 283.A O no hydrogen 2.906 N/A HIS 288.A N VAL 285.A O no hydrogen 2.918 N/A HIS 288.A ND1 ILE 284.A O no hydrogen 2.773 N/A TYR 290.A N ASN 175.A OD1 no hydrogen 3.247 N/A ARG 291.A N HIS 298.A O no hydrogen 3.504 N/A ARG 291.A NE GLY 297.A O no hydrogen 2.662 N/A ARG 291.A NH2 GLY 297.A O no hydrogen 3.475 N/A HIS 298.A N MET 289.A O no hydrogen 2.871 N/A ILE 300.A N GLU 171.A OE2 no hydrogen 2.907 N/A LYS 301.A NZ ASP 305.A OD2 no hydrogen 3.423 N/A LYS 301.A NZ GLU 327.A OE2 no hydrogen 3.373 N/A MET 303.A N SER 299.A O no hydrogen 3.237 N/A MET 304.A N ILE 300.A O no hydrogen 3.144 N/A MET 304.A N LYS 301.A O no hydrogen 3.249 N/A ASP 305.A N LYS 301.A O no hydrogen 3.049 N/A LYS 307.A NZ GLU 315.A O no hydrogen 2.600 N/A LYS 307.A NZ GLN 323.A OE1 no hydrogen 2.771 N/A PHE 309.A N THR 312.A O no hydrogen 2.762 N/A THR 312.A N PHE 309.A O no hydrogen 3.167 N/A THR 312.A OG1 PHE 309.A O no hydrogen 2.378 N/A VAL 314.A N LYS 307.A O no hydrogen 2.994 N/A GLU 315.A N ASN 319.A OD1 no hydrogen 2.992 N/A ASN 319.A N GLY 316.A O no hydrogen 2.802 N/A MET 320.A N PRO 317.A O no hydrogen 2.774 N/A HIS 322.A ND1 MET 320.A O no hydrogen 3.036 N/A GLN 323.A N GLN 323.A OE1 no hydrogen 2.891 N/A GLN 323.A NE2 LYS 407.A O no hydrogen 3.465 N/A GLY 324.A N ASP 305.A OD1 no hydrogen 3.169 N/A ILE 325.A N HIS 322.A O no hydrogen 3.093 N/A THR 328.A N GLY 324.A O no hydrogen 2.807 N/A THR 328.A OG1 GLY 324.A O no hydrogen 2.741 N/A THR 328.A OG1 ASN 406.A OD1 no hydrogen 2.762 N/A TYR 329.A N ILE 325.A O no hydrogen 2.946 N/A ASN 330.A N TYR 326.A O no hydrogen 2.868 N/A ASN 330.A ND2 LYS 168.A O no hydrogen 2.941 N/A ASN 331.A N GLU 327.A O no hydrogen 2.715 N/A SER 332.A N TYR 329.A O no hydrogen 3.429 N/A SER 332.A OG ASP 400.A OD2 no hydrogen 2.641 N/A HIS 334.A NE2 GLU 31.A OE1 no hydrogen 2.801 N/A PHE 335.A N SER 332.A OG no hydrogen 2.933 N/A GLN 336.A N SER 332.A O no hydrogen 3.241 N/A LEU 337.A N LEU 333.A O no hydrogen 2.847 N/A GLY 338.A N HIS 334.A O no hydrogen 2.891 N/A TRP 339.A N PHE 335.A O no hydrogen 2.865 N/A HIS 340.A N GLN 336.A O no hydrogen 2.773 N/A HIS 340.A NE2 TYR 329.A OH no hydrogen 3.171 N/A LEU 341.A N LEU 337.A O no hydrogen 2.888 N/A ALA 342.A N GLY 338.A O no hydrogen 3.124 N/A CYS 343.A N TRP 339.A O no hydrogen 3.146 N/A CYS 343.A SG TRP 339.A O no hydrogen 3.895 N/A LEU 344.A N HIS 340.A O no hydrogen 2.949 N/A GLY 345.A N LEU 341.A O no hydrogen 2.743 N/A VAL 346.A N ALA 342.A O no hydrogen 2.988 N/A ILE 347.A N CYS 343.A O no hydrogen 3.055 N/A THR 348.A N LEU 344.A O no hydrogen 3.007 N/A THR 348.A OG1 LEU 344.A O no hydrogen 2.582 N/A SER 349.A N GLY 345.A O no hydrogen 3.269 N/A SER 349.A OG VAL 346.A O no hydrogen 2.523 N/A LEU 350.A N VAL 346.A O no hydrogen 3.062 N/A VAL 351.A N ILE 347.A O no hydrogen 2.927 N/A ALA 352.A N THR 348.A O no hydrogen 3.125 N/A GLN 353.A N SER 349.A O no hydrogen 2.786 N/A HIS 354.A N LEU 350.A O no hydrogen 2.775 N/A MET 355.A N VAL 351.A O no hydrogen 3.056 N/A SER 357.A OG GLN 353.A O no hydrogen 3.018 N/A SER 357.A OG HIS 354.A O no hydrogen 3.549 N/A LEU 358.A N HIS 354.A O no hydrogen 2.832 N/A ALA 362.A N THR 125.A OG1 no hydrogen 3.196 N/A PHE 363.A N THR 264.A O no hydrogen 2.963 N/A ILE 364.A N TYR 361.A O no hydrogen 3.117 N/A GLN 366.A N PHE 363.A O no hydrogen 2.976 N/A ASP 367.A N ILE 364.A O no hydrogen 2.911 N/A THR 370.A OG1 ASP 367.A O no hydrogen 2.900 N/A MET 371.A N ASP 367.A O no hydrogen 3.110 N/A ALA 372.A N HIS 368.A O no hydrogen 3.039 N/A ALA 373.A N THR 369.A O no hydrogen 2.993 N/A LEU 374.A N THR 370.A O no hydrogen 2.874 N/A TYR 375.A N MET 371.A O no hydrogen 3.156 N/A THR 376.A N ALA 372.A O no hydrogen 3.081 N/A THR 376.A OG1 ALA 372.A O no hydrogen 2.833 N/A HIS 377.A N ALA 373.A O no hydrogen 2.856 N/A HIS 378.A N LEU 374.A O no hydrogen 3.264 N/A GLN 379.A N TYR 375.A O no hydrogen 3.054 N/A GLN 379.A NE2 TYR 375.A OH no hydrogen 3.283 N/A TYR 380.A N THR 376.A O no hydrogen 2.926 N/A ILE 381.A N HIS 377.A O no hydrogen 2.949 N/A ALA 382.A N HIS 378.A O no hydrogen 3.001 N/A GLY 383.A N GLN 379.A O no hydrogen 3.076 N/A PHE 384.A N TYR 380.A O no hydrogen 3.139 N/A LEU 385.A N ILE 381.A O no hydrogen 3.031 N/A MET 386.A N ALA 382.A O no hydrogen 2.918 N/A VAL 387.A N GLY 383.A O no hydrogen 3.062 N/A GLY 388.A N PHE 384.A O no hydrogen 2.941 N/A ALA 389.A N LEU 385.A O no hydrogen 2.839 N/A PHE 390.A N MET 386.A O no hydrogen 3.330 N/A ALA 391.A N VAL 387.A O no hydrogen 2.995 N/A HIS 392.A N GLY 388.A O no hydrogen 2.901 N/A HIS 392.A ND1 HIS 334.A ND1 no hydrogen 3.378 N/A GLY 393.A N ALA 389.A O no hydrogen 3.134 N/A ALA 394.A N PHE 390.A O no hydrogen 3.122 N/A ILE 395.A N ALA 391.A O no hydrogen 3.001 N/A PHE 396.A N HIS 392.A O no hydrogen 2.854 N/A LEU 397.A N GLY 393.A O no hydrogen 3.108 N/A VAL 398.A N ALA 394.A O no hydrogen 3.145 N/A VAL 398.A N ILE 395.A O no hydrogen 3.122 N/A ARG 399.A N ILE 395.A O no hydrogen 2.833 N/A ARG 399.A NH2 GLU 31.A OE1 no hydrogen 3.258 N/A ASP 400.A N PHE 396.A O no hydrogen 2.844 N/A TYR 401.A N PHE 396.A O no hydrogen 2.852 N/A GLN 405.A N ASP 402.A OD2 no hydrogen 3.166 N/A ASN 406.A N PRO 403.A O no hydrogen 2.770 N/A ASN 406.A ND2 ASP 402.A O no hydrogen 3.098 N/A GLY 408.A N ASP 412.A OD2 no hydrogen 2.907 N/A ASN 409.A N ASN 406.A O no hydrogen 2.947 N/A ASN 409.A ND2 GLN 323.A O no hydrogen 3.033 N/A ASN 409.A ND2 ASN 406.A OD1 no hydrogen 2.743 N/A VAL 410.A N PRO 321.A O no hydrogen 2.927 N/A ASP 412.A N ASN 409.A OD1 no hydrogen 3.222 N/A ARG 413.A N ASN 409.A O no hydrogen 2.802 N/A ARG 413.A NH1 GLU 315.A OE1 no hydrogen 3.061 N/A ARG 413.A NH2 GLU 315.A OE1 no hydrogen 3.147 N/A VAL 414.A N VAL 410.A O no hydrogen 2.905 N/A LEU 415.A N LEU 411.A O no hydrogen 3.105 N/A GLN 416.A N ASP 412.A O no hydrogen 2.865 N/A GLN 416.A NE2 ASP 412.A OD1 no hydrogen 2.935 N/A HIS 417.A N VAL 414.A O no hydrogen 3.064 N/A HIS 417.A ND1 ARG 413.A O no hydrogen 2.972 N/A LYS 418.A N LEU 415.A O no hydrogen 3.239 N/A LYS 418.A NZ LEU 545.A O no hydrogen 3.423 N/A LYS 418.A NZ ASP 546.A OD1 no hydrogen 2.976 N/A ALA 420.A N HIS 417.A O no hydrogen 3.010 N/A ILE 421.A N HIS 417.A O no hydrogen 3.205 N/A ILE 422.A N LYS 418.A O no hydrogen 2.891 N/A SER 423.A N GLU 419.A O no hydrogen 2.957 N/A SER 423.A OG GLU 419.A O no hydrogen 2.654 N/A SER 423.A OG ALA 420.A O no hydrogen 2.783 N/A HIS 424.A N ALA 420.A O no hydrogen 3.133 N/A LEU 425.A N ILE 421.A O no hydrogen 3.148 N/A SER 426.A N ILE 422.A O no hydrogen 2.885 N/A TRP 427.A N SER 423.A O no hydrogen 2.965 N/A VAL 428.A N HIS 424.A O no hydrogen 2.905 N/A SER 429.A N LEU 425.A O no hydrogen 3.124 N/A SER 429.A OG LEU 425.A O no hydrogen 3.001 N/A SER 429.A OG THR 535.A OG1 no hydrogen 3.385 N/A LEU 430.A N SER 426.A O no hydrogen 3.018 N/A PHE 431.A N TRP 427.A O no hydrogen 2.678 N/A LEU 432.A N VAL 428.A O no hydrogen 2.693 N/A GLY 433.A N SER 429.A O no hydrogen 2.770 N/A PHE 434.A N LEU 430.A O no hydrogen 2.925 N/A HIS 435.A N PHE 431.A O no hydrogen 3.368 N/A THR 436.A N LEU 432.A O no hydrogen 2.931 N/A THR 436.A OG1 LEU 432.A O no hydrogen 3.051 N/A LEU 437.A N GLY 433.A O no hydrogen 2.915 N/A GLY 438.A N PHE 434.A O no hydrogen 3.033 N/A LEU 439.A N HIS 435.A O no hydrogen 2.777 N/A TYR 440.A N THR 436.A O no hydrogen 3.226 N/A VAL 441.A N LEU 437.A O no hydrogen 3.014 N/A HIS 442.A N GLY 438.A O no hydrogen 2.909 N/A ASN 443.A N LEU 439.A O no hydrogen 2.874 N/A ASN 443.A ND2 ILE 456.A O no hydrogen 3.397 N/A ASN 443.A ND2 THR 620.A O no hydrogen 2.786 N/A ASP 444.A N TYR 440.A O no hydrogen 2.805 N/A VAL 445.A N VAL 441.A O no hydrogen 3.049 N/A VAL 446.A N HIS 442.A O no hydrogen 3.010 N/A VAL 447.A N ASN 443.A O no hydrogen 2.810 N/A ALA 448.A N ASP 444.A O no hydrogen 2.793 N/A PHE 449.A N VAL 445.A O no hydrogen 2.902 N/A GLY 450.A N VAL 447.A O no hydrogen 3.134 N/A THR 451.A N VAL 446.A O no hydrogen 2.986 N/A THR 451.A OG1 VAL 446.A O no hydrogen 2.748 N/A GLU 453.A N GLU 453.A OE1 no hydrogen 2.813 N/A LYS 454.A N THR 451.A O no hydrogen 3.042 N/A GLN 455.A N PRO 452.A O no hydrogen 3.131 N/A GLN 455.A NE2 PRO 452.A O no hydrogen 3.266 N/A ILE 456.A N ASN 443.A OD1 no hydrogen 2.650 N/A PHE 465.A N VAL 461.A O no hydrogen 2.750 N/A ILE 466.A N PHE 462.A O no hydrogen 3.162 N/A GLN 467.A N ALA 463.A O no hydrogen 3.016 N/A GLN 467.A NE2 LEU 516.A O no hydrogen 3.118 N/A ALA 468.A N GLN 464.A O no hydrogen 2.766 N/A ALA 469.A N PHE 465.A O no hydrogen 2.670 N/A HIS 470.A N ILE 466.A O no hydrogen 3.028 N/A HIS 470.A N GLN 467.A O no hydrogen 3.002 N/A GLY 471.A N ALA 468.A O no hydrogen 2.706 N/A LYS 472.A N GLN 467.A O no hydrogen 3.130 N/A LYS 472.A NZ PHE 515.A O no hydrogen 2.954 N/A LYS 472.A NZ THR 517.A OG1 no hydrogen 2.835 N/A TYR 475.A OH GLN 467.A OE1 no hydrogen 2.605 N/A GLY 476.A N LEU 473.A O no hydrogen 2.667 N/A ASP 478.A N SER 482.A OG no hydrogen 2.859 N/A THR 479.A OG1 ASP 478.A O no hydrogen 2.480 N/A SER 482.A N THR 479.A O no hydrogen 3.078 N/A ASP 485.A N ASN 483.A OD1 no hydrogen 2.838 N/A SER 486.A N ASN 483.A O no hydrogen 2.897 N/A THR 490.A N SER 486.A O no hydrogen 3.111 N/A THR 490.A OG1 SER 486.A O no hydrogen 3.368 N/A THR 490.A OG1 ILE 487.A O no hydrogen 2.793 N/A ALA 491.A N ILE 487.A O no hydrogen 2.612 N/A TRP 492.A N THR 490.A OG1 no hydrogen 3.397 N/A TYR 495.A N ALA 491.A O no hydrogen 2.560 N/A VAL 498.A N GLY 496.A O no hydrogen 2.957 N/A TRP 503.A N TRP 499.A O no hydrogen 3.068 N/A TRP 503.A NE1 HIS 470.A O no hydrogen 3.075 N/A LEU 504.A N LEU 500.A O no hydrogen 2.923 N/A ASP 505.A N PRO 501.A O no hydrogen 2.855 N/A ALA 506.A N GLY 502.A O no hydrogen 3.098 N/A ILE 507.A N TRP 503.A O no hydrogen 2.849 N/A ASN 508.A N LEU 504.A O no hydrogen 3.206 N/A ASN 508.A ND2 GLY 471.A O no hydrogen 3.337 N/A SER 509.A N ASP 505.A O no hydrogen 3.203 N/A SER 509.A OG ASP 505.A O no hydrogen 2.816 N/A ASN 512.A ND2 ALA 506.A O no hydrogen 2.225 N/A LEU 514.A N ASN 512.A OD1 no hydrogen 3.195 N/A ILE 518.A N TYR 475.A OH no hydrogen 3.237 N/A GLY 519.A N ASP 522.A OD1 no hydrogen 2.802 N/A PHE 523.A N GLY 519.A O no hydrogen 3.046 N/A LEU 524.A N PRO 520.A O no hydrogen 2.808 N/A VAL 525.A N GLY 521.A O no hydrogen 3.355 N/A HIS 526.A N ASP 522.A O no hydrogen 3.205 N/A HIS 526.A ND1 ASP 522.A O no hydrogen 2.977 N/A HIS 527.A N PHE 523.A O no hydrogen 3.309 N/A HIS 527.A N LEU 524.A O no hydrogen 3.025 N/A HIS 527.A ND1 PHE 523.A O no hydrogen 3.340 N/A ALA 528.A N LEU 524.A O no hydrogen 3.082 N/A ILE 529.A N VAL 525.A O no hydrogen 2.723 N/A ALA 530.A N HIS 526.A O no hydrogen 2.990 N/A LEU 531.A N HIS 527.A O no hydrogen 2.907 N/A GLY 532.A N ALA 528.A O no hydrogen 2.926 N/A LEU 533.A N ILE 529.A O no hydrogen 2.942 N/A HIS 534.A N ALA 530.A O no hydrogen 2.992 N/A HIS 534.A ND1 ALA 530.A O no hydrogen 3.178 N/A THR 535.A N LEU 531.A O no hydrogen 3.077 N/A THR 535.A OG1 LEU 531.A O no hydrogen 2.793 N/A THR 536.A N GLY 532.A O no hydrogen 3.068 N/A THR 536.A OG1 GLY 532.A O no hydrogen 2.570 N/A THR 537.A N LEU 533.A O no hydrogen 3.143 N/A THR 537.A OG1 LEU 533.A O no hydrogen 2.561 N/A LEU 538.A N HIS 534.A O no hydrogen 2.687 N/A ILE 539.A N THR 535.A O no hydrogen 2.975 N/A LEU 540.A N THR 536.A O no hydrogen 3.072 N/A VAL 541.A N THR 537.A O no hydrogen 2.772 N/A LYS 542.A N LEU 538.A O no hydrogen 2.861 N/A GLY 543.A N ILE 539.A O no hydrogen 2.925 N/A ALA 544.A N LEU 540.A O no hydrogen 3.000 N/A LEU 545.A N VAL 541.A O no hydrogen 2.796 N/A ASP 546.A N LYS 542.A O no hydrogen 3.064 N/A ALA 547.A N ALA 544.A O no hydrogen 3.128 N/A ARG 548.A NE LEU 397.A O no hydrogen 2.853 N/A SER 550.A N MET 553.A O no hydrogen 2.882 N/A MET 553.A N SER 550.A OG no hydrogen 2.908 N/A LYS 556.A N MET 553.A O no hydrogen 3.303 N/A LYS 556.A NZ ASP 546.A O no hydrogen 3.190 N/A LYS 556.A NZ ILE 576.A O no hydrogen 2.675 N/A LYS 557.A N ARG 548.A O no hydrogen 2.797 N/A ASP 558.A N ASP 555.A O no hydrogen 2.840 N/A PHE 559.A N LYS 556.A O no hydrogen 3.033 N/A GLY 560.A N LYS 556.A O no hydrogen 3.343 N/A CYS 565.A SG PRO 564.A O no hydrogen 3.201 N/A CYS 565.A SG THR 573.A O no hydrogen 3.115 N/A CYS 565.A SG CYS 574.A O no hydrogen 3.184 N/A ASP 566.A N THR 573.A O no hydrogen 3.119 N/A ARG 570.A NH2 LEU 552.A O no hydrogen 3.437 N/A GLY 572.A N GLY 569.A O no hydrogen 3.021 N/A THR 573.A OG1 ASP 566.A OD2 no hydrogen 3.062 N/A THR 573.A OG1 GLY 567.A O no hydrogen 3.461 N/A ASP 580.A N SER 577.A OG no hydrogen 3.229 N/A TYR 583.A N TRP 579.A O no hydrogen 3.175 N/A LEU 584.A N ASP 580.A O no hydrogen 2.749 N/A ALA 585.A N ALA 581.A O no hydrogen 2.782 N/A MET 586.A N PHE 582.A O no hydrogen 3.014 N/A PHE 587.A N LEU 584.A O no hydrogen 3.225 N/A MET 589.A N ALA 585.A O no hydrogen 2.777 N/A LEU 590.A N MET 586.A O no hydrogen 2.978 N/A ASN 591.A N PHE 587.A O no hydrogen 3.031 N/A THR 592.A N TRP 588.A O no hydrogen 2.899 N/A THR 592.A OG1 TRP 588.A O no hydrogen 2.739 N/A ILE 593.A N MET 589.A O no hydrogen 2.893 N/A GLY 594.A N LEU 590.A O no hydrogen 2.941 N/A TRP 595.A N ASN 591.A O no hydrogen 3.033 N/A VAL 596.A N THR 592.A O no hydrogen 2.940 N/A THR 597.A N ILE 593.A O no hydrogen 2.941 N/A THR 597.A OG1 ILE 593.A O no hydrogen 2.760 N/A THR 597.A OG1 GLY 594.A O no hydrogen 3.036 N/A PHE 598.A N GLY 594.A O no hydrogen 2.752 N/A TYR 599.A N TRP 595.A O no hydrogen 3.120 N/A TYR 599.A OH ASP 522.A OD2 no hydrogen 3.007 N/A TRP 600.A N VAL 596.A O no hydrogen 2.988 N/A HIS 601.A N THR 597.A O no hydrogen 2.957 N/A HIS 601.A ND1 TYR 629.A OH no hydrogen 2.670 N/A TRP 602.A N PHE 598.A O no hydrogen 2.935 N/A LYS 603.A N TYR 599.A O no hydrogen 3.123 N/A LYS 603.A NZ THR 517.A O no hydrogen 2.728 N/A LYS 603.A NZ ASP 522.A OD2 no hydrogen 3.062 N/A HIS 604.A N TRP 600.A O no hydrogen 3.162 N/A HIS 604.A ND1 TRP 600.A O no hydrogen 2.925 N/A LEU 605.A N HIS 601.A O no hydrogen 2.812 N/A GLY 606.A N TRP 602.A O no hydrogen 3.228 N/A VAL 607.A N LYS 603.A O no hydrogen 3.083 N/A TRP 608.A N HIS 604.A O no hydrogen 2.785 N/A GLU 609.A N LEU 605.A O no hydrogen 3.169 N/A GLY 610.A N VAL 607.A O no hydrogen 3.393 N/A ASN 611.A N GLY 606.A O no hydrogen 2.788 N/A GLN 614.A N ASN 611.A O no hydrogen 3.361 N/A ASN 616.A N VAL 612.A O no hydrogen 3.022 N/A GLU 617.A N ALA 613.A O no hydrogen 2.745 N/A SER 618.A N GLN 614.A O no hydrogen 2.805 N/A SER 618.A OG ASP 628.A OD2 no hydrogen 2.765 N/A SER 619.A N PHE 615.A O no hydrogen 2.871 N/A SER 619.A OG PHE 615.A O no hydrogen 2.723 N/A THR 620.A OG1 GLN 455.A OE1 no hydrogen 2.395 N/A LEU 622.A N ASP 444.A OD2 no hydrogen 2.260 N/A MET 623.A N ASP 444.A OD1 no hydrogen 2.679 N/A GLY 624.A N TYR 621.A O no hydrogen 3.172 N/A TRP 625.A N LEU 622.A O no hydrogen 2.966 N/A TRP 625.A NE1 SER 619.A O no hydrogen 2.822 N/A LEU 626.A N LEU 622.A O no hydrogen 3.103 N/A ARG 627.A N MET 623.A O no hydrogen 2.886 N/A ARG 627.A NE ASP 628.A OD1 no hydrogen 2.831 N/A ARG 627.A NE ASP 628.A OD2 no hydrogen 3.418 N/A ARG 627.A NH2 ASP 628.A OD1 no hydrogen 3.450 N/A ARG 627.A NH2 ASP 628.A OD2 no hydrogen 2.974 N/A ASP 628.A N GLY 624.A O no hydrogen 2.793 N/A TYR 629.A N TRP 625.A O no hydrogen 3.253 N/A TYR 629.A OH HIS 601.A ND1 no hydrogen 2.670 N/A LEU 630.A N TRP 625.A O no hydrogen 3.116 N/A TRP 631.A N LEU 626.A O no hydrogen 2.963 N/A LEU 632.A N ARG 627.A O no hydrogen 3.087 N/A ASN 633.A N TYR 629.A O no hydrogen 3.335 N/A ASN 633.A ND2 TYR 629.A O no hydrogen 2.528 N/A SER 634.A N TRP 631.A O no hydrogen 3.432 N/A SER 634.A OG LEU 630.A O no hydrogen 3.196 N/A SER 634.A OG TRP 631.A O no hydrogen 2.915 N/A SER 635.A OG LEU 632.A O no hydrogen 3.399 N/A ILE 638.A N SER 634.A O no hydrogen 2.999 N/A ASN 639.A N GLN 636.A O no hydrogen 2.730 N/A ASN 639.A ND2 SER 635.A O no hydrogen 3.381 N/A GLY 640.A N LEU 637.A O no hydrogen 2.980 N/A ASN 642.A N GLY 645.A O no hydrogen 2.894 N/A ASN 642.A ND2 ASN 639.A OD1 no hydrogen 3.298 N/A PHE 644.A N ASN 642.A OD1 no hydrogen 2.928 N/A GLY 645.A N ASN 642.A O no hydrogen 3.219 N/A GLY 645.A N ASN 642.A OD1 no hydrogen 3.106 N/A ASN 647.A N GLY 640.A O no hydrogen 2.861 N/A ASN 648.A ND2 GLN 105.A OE1 no hydrogen 3.108 N/A SER 650.A N ASN 647.A O no hydrogen 2.873 N/A SER 650.A OG ASN 647.A O no hydrogen 3.226 N/A ALA 653.A N LEU 649.A O no hydrogen 2.991 N/A TRP 654.A N SER 650.A O no hydrogen 2.957 N/A MET 655.A N VAL 651.A O no hydrogen 2.671 N/A PHE 656.A N TRP 652.A O no hydrogen 2.800 N/A LEU 657.A N ALA 653.A O no hydrogen 3.161 N/A PHE 658.A N TRP 654.A O no hydrogen 2.813 N/A GLY 659.A N MET 655.A O no hydrogen 2.761 N/A HIS 660.A N PHE 656.A O no hydrogen 3.331 N/A HIS 660.A ND1 PHE 656.A O no hydrogen 3.289 N/A LEU 661.A N LEU 657.A O no hydrogen 3.002 N/A VAL 662.A N PHE 658.A O no hydrogen 2.982 N/A TRP 663.A N GLY 659.A O no hydrogen 2.987 N/A ALA 664.A N HIS 660.A O no hydrogen 3.102 N/A THR 665.A N LEU 661.A O no hydrogen 2.927 N/A THR 665.A OG1 LEU 661.A O no hydrogen 2.718 N/A GLY 666.A N VAL 662.A O no hydrogen 3.143 N/A GLY 666.A N TRP 663.A O no hydrogen 3.036 N/A PHE 667.A N ALA 664.A O no hydrogen 3.075 N/A MET 668.A N THR 665.A O no hydrogen 3.135 N/A LEU 670.A N GLY 666.A O no hydrogen 3.114 N/A ILE 671.A N PHE 667.A O no hydrogen 2.951 N/A SER 672.A N MET 668.A O no hydrogen 3.209 N/A SER 672.A OG MET 668.A O no hydrogen 2.468 N/A TRP 673.A NE1 LEU 670.A O no hydrogen 3.058 N/A GLN 678.A N ARG 674.A O no hydrogen 3.022 N/A GLN 678.A NE2 GLU 682.A OE2 no hydrogen 3.048 N/A GLU 679.A N GLY 675.A O no hydrogen 3.221 N/A LEU 680.A N TYR 676.A O no hydrogen 3.330 N/A ILE 681.A N TRP 677.A O no hydrogen 2.810 N/A GLU 682.A N GLN 678.A O no hydrogen 3.151 N/A THR 683.A OG1 LEU 680.A O no hydrogen 2.621 N/A LEU 684.A N LEU 680.A O no hydrogen 3.238 N/A VAL 685.A N ILE 681.A O no hydrogen 2.870 N/A TRP 686.A N GLU 682.A O no hydrogen 3.021 N/A ALA 687.A N THR 683.A O no hydrogen 3.077 N/A HIS 688.A N LEU 684.A O no hydrogen 2.958 N/A GLU 689.A N VAL 685.A O no hydrogen 3.075 N/A ARG 690.A N TRP 686.A O no hydrogen 3.061 N/A ARG 690.A N ALA 687.A O no hydrogen 3.203 N/A THR 691.A N HIS 688.A O no hydrogen 3.094 N/A ALA 694.A N THR 691.A O no hydrogen 3.405 N/A ASN 695.A N THR 691.A O no hydrogen 2.707 N/A VAL 697.A N ALA 694.A O no hydrogen 3.062 N/A ALA 705.A N GLN 678.A OE1 no hydrogen 3.138 N/A SER 707.A N GLN 710.A OE1 no hydrogen 3.084 N/A SER 707.A OG TYR 22.A OH no hydrogen 2.328 N/A GLN 710.A N TYR 22.A OH no hydrogen 2.819 N/A ALA 711.A N SER 707.A O no hydrogen 3.066 N/A LEU 713.A N VAL 709.A O no hydrogen 2.984 N/A VAL 714.A N GLN 710.A O no hydrogen 2.743 N/A GLY 715.A N ALA 711.A O no hydrogen 2.706 N/A LEU 716.A N ARG 712.A O no hydrogen 2.860 N/A ALA 717.A N LEU 713.A O no hydrogen 2.855 N/A HIS 718.A N VAL 714.A O no hydrogen 2.942 N/A HIS 718.A ND1 VAL 714.A O no hydrogen 3.033 N/A PHE 719.A N GLY 715.A O no hydrogen 2.898 N/A SER 720.A N LEU 716.A O no hydrogen 2.816 N/A SER 720.A OG LEU 716.A O no hydrogen 3.024 N/A VAL 721.A N ALA 717.A O no hydrogen 2.883 N/A GLY 722.A N HIS 718.A O no hydrogen 2.902 N/A TYR 723.A N PHE 719.A O no hydrogen 2.892 N/A TYR 723.A OH LEU 590.A O no hydrogen 2.867 N/A ILE 724.A N SER 720.A O no hydrogen 3.031 N/A LEU 725.A N VAL 721.A O no hydrogen 2.930 N/A THR 726.A N GLY 722.A O no hydrogen 2.850 N/A THR 726.A OG1 GLY 722.A O no hydrogen 2.800 N/A TYR 727.A N TYR 723.A O no hydrogen 3.341 N/A TYR 727.A OH TYR 629.A OH no hydrogen 3.321 N/A ALA 728.A N ILE 724.A O no hydrogen 2.941 N/A ALA 729.A N LEU 725.A O no hydrogen 3.023 N/A PHE 730.A N THR 726.A O no hydrogen 3.239 N/A LEU 731.A N TYR 727.A O no hydrogen 2.768 N/A ILE 732.A N ALA 728.A O no hydrogen 2.934 N/A ALA 733.A N ALA 729.A O no hydrogen 2.957 N/A SER 734.A N PHE 730.A O no hydrogen 2.803 N/A SER 734.A OG PHE 730.A O no hydrogen 2.518 N/A SER 734.A OG LEU 731.A O no hydrogen 3.259 N/A THR 735.A N LEU 731.A O no hydrogen 3.365 N/A ALA 736.A N ILE 732.A O no hydrogen 2.901 N/A ALA 737.A N ALA 733.A O no hydrogen 2.891 N/A LYS 738.A N THR 735.A O no hydrogen 3.227 N/A