Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9avl_Q.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 GLY 319.A O no hydrogen 3.633 N/A GLN 3.A NE2 GLU 323.A OE1 no hydrogen 3.415 N/A ARG 4.A NE PRO 1.A O no hydrogen 2.906 N/A ARG 4.A NH2 PRO 1.A O no hydrogen 2.860 N/A ALA 5.A N ILE 76.A O no hydrogen 2.940 N/A LYS 7.A N TYR 74.A O no hydrogen 2.919 N/A LYS 7.A NZ LYS 8.A O no hydrogen 3.266 N/A ASP 10.A N THR 71.A O no hydrogen 2.614 N/A ILE 11.A N THR 71.A O no hydrogen 3.434 N/A LEU 13.A N GLY 73.A O no hydrogen 3.078 N/A GLY 14.A N ALA 113.A O no hydrogen 2.694 N/A GLY 15.A N ARG 75.A O no hydrogen 3.215 N/A LEU 16.A N VAL 115.A O no hydrogen 2.895 N/A ILE 19.A N PHE 17.A O no hydrogen 3.078 N/A ILE 19.A N ASP 78.A OD2 no hydrogen 3.062 N/A HIS 20.A ND1 ASP 78.A OD1 no hydrogen 3.047 N/A HIS 20.A NE2 GLU 323.A OE2 no hydrogen 3.038 N/A PHE 21.A N ARG 41.A O no hydrogen 3.100 N/A ALA 24.A N GLU 38.A O no hydrogen 2.485 N/A GLN 28.A NE2 GLU 35.A O no hydrogen 3.229 N/A ILE 40.A N GLY 22.A O no hydrogen 3.375 N/A ARG 41.A NH1 GLU 250.A OE1 no hydrogen 2.897 N/A ARG 41.A NH1 GLU 250.A OE2 no hydrogen 3.319 N/A ARG 41.A NH2 GLU 250.A OE1 no hydrogen 3.191 N/A ASN 43.A N ILE 19.A O no hydrogen 2.825 N/A ASN 43.A ND2 PRO 18.A O no hydrogen 3.205 N/A ARG 45.A N ASN 43.A OD1 no hydrogen 3.250 N/A PHE 47.A N ASN 43.A O no hydrogen 3.399 N/A ARG 48.A N PHE 44.A O no hydrogen 2.945 N/A ARG 48.A NE PRO 348.A O no hydrogen 3.339 N/A ARG 48.A NE TYR 349.A O no hydrogen 3.322 N/A ARG 48.A NH2 PRO 348.A O no hydrogen 2.774 N/A TRP 49.A N ARG 45.A O no hydrogen 2.952 N/A LEU 50.A N GLY 46.A O no hydrogen 2.928 N/A GLN 51.A N PHE 47.A O no hydrogen 2.912 N/A GLN 51.A NE2 TYR 349.A OH no hydrogen 3.320 N/A ALA 52.A N ARG 48.A O no hydrogen 2.898 N/A MET 53.A N TRP 49.A O no hydrogen 2.998 N/A ILE 54.A N LEU 50.A O no hydrogen 2.995 N/A PHE 55.A N GLN 51.A O no hydrogen 2.824 N/A ALA 56.A N ALA 52.A O no hydrogen 2.929 N/A ILE 57.A N MET 53.A O no hydrogen 2.997 N/A GLU 58.A N ILE 54.A O no hydrogen 2.930 N/A GLU 59.A N PHE 55.A O no hydrogen 2.903 N/A ILE 60.A N ALA 56.A O no hydrogen 2.935 N/A ASN 61.A N ILE 57.A O no hydrogen 2.930 N/A ASN 61.A ND2 LEU 72.A O no hydrogen 3.278 N/A SER 62.A N GLU 58.A O no hydrogen 2.921 N/A SER 62.A OG GLU 58.A O no hydrogen 3.180 N/A SER 63.A N GLU 59.A O no hydrogen 2.949 N/A LEU 67.A N GLN 373.A OE1 no hydrogen 2.951 N/A THR 71.A N ASP 10.A OD1 no hydrogen 2.682 N/A LEU 72.A N ASN 61.A OD1 no hydrogen 2.984 N/A GLY 73.A N ILE 11.A O no hydrogen 2.737 N/A TYR 74.A N LYS 7.A O no hydrogen 2.917 N/A ARG 75.A N LEU 13.A O no hydrogen 3.207 N/A ARG 75.A NH1 SER 92.A OG no hydrogen 3.416 N/A ARG 75.A NH2 SER 92.A OG no hydrogen 3.173 N/A ILE 76.A N ALA 5.A O no hydrogen 2.868 N/A PHE 77.A N GLY 15.A O no hydrogen 3.065 N/A THR 79.A N PHE 17.A O no hydrogen 3.165 N/A CYS 80.A N ASP 78.A OD2 no hydrogen 3.088 N/A CYS 80.A SG HIS 20.A ND1 no hydrogen 3.888 N/A CYS 80.A SG ASP 78.A OD1 no hydrogen 3.376 N/A ASN 81.A ND2 PHE 21.A O no hydrogen 3.438 N/A THR 82.A N THR 79.A O no hydrogen 2.933 N/A THR 82.A OG1 CYS 80.A O no hydrogen 2.708 N/A LYS 85.A NZ VAL 37.A O no hydrogen 3.258 N/A ALA 86.A N THR 82.A O no hydrogen 3.463 N/A LEU 87.A N VAL 83.A O no hydrogen 2.871 N/A GLU 88.A N SER 84.A O no hydrogen 2.931 N/A ALA 89.A N LYS 85.A O no hydrogen 2.976 N/A THR 90.A N ALA 86.A O no hydrogen 2.851 N/A THR 90.A OG1 ALA 86.A O no hydrogen 2.402 N/A LEU 91.A N LEU 87.A O no hydrogen 2.878 N/A SER 92.A N GLU 88.A O no hydrogen 2.979 N/A PHE 93.A N ALA 89.A O no hydrogen 2.912 N/A VAL 94.A N THR 90.A O no hydrogen 3.008 N/A LYS 98.A N VAL 94.A O no hydrogen 2.756 N/A ILE 99.A N ALA 95.A O no hydrogen 2.903 N/A ASP 100.A N GLN 96.A O no hydrogen 2.920 N/A SER 101.A N ASN 97.A O no hydrogen 2.908 N/A SER 101.A OG ASN 97.A O no hydrogen 3.027 N/A SER 101.A OG LYS 98.A O no hydrogen 3.222 N/A LEU 102.A N LYS 98.A O no hydrogen 2.876 N/A ASN 103.A N ILE 99.A O no hydrogen 3.185 N/A ILE 112.A N ILE 12.A O no hydrogen 2.920 N/A VAL 114.A N PRO 136.A O no hydrogen 3.091 N/A VAL 115.A N GLY 14.A O no hydrogen 2.833 N/A GLY 116.A N VAL 138.A O no hydrogen 3.081 N/A ALA 117.A N SER 123.A OG no hydrogen 3.271 N/A THR 118.A OG1 TYR 140.A OH no hydrogen 2.640 N/A SER 123.A N GLY 119.A O no hydrogen 2.873 N/A SER 123.A OG GLY 119.A O no hydrogen 2.689 N/A SER 123.A OG SER 142.A OG no hydrogen 2.565 N/A THR 124.A N SER 120.A O no hydrogen 2.865 N/A THR 124.A OG1 SER 120.A O no hydrogen 2.553 N/A ALA 125.A N GLY 121.A O no hydrogen 2.994 N/A VAL 126.A N VAL 122.A O no hydrogen 2.967 N/A ALA 127.A N SER 123.A O no hydrogen 2.782 N/A ASN 128.A N THR 124.A O no hydrogen 2.945 N/A LEU 129.A N ALA 125.A O no hydrogen 3.094 N/A LEU 130.A N VAL 126.A O no hydrogen 2.867 N/A GLY 131.A N ALA 127.A O no hydrogen 2.824 N/A LEU 132.A N ASN 128.A O no hydrogen 3.087 N/A PHE 133.A N LEU 130.A O no hydrogen 3.030 N/A TYR 134.A N GLY 131.A O no hydrogen 3.465 N/A ILE 135.A N LEU 130.A O no hydrogen 3.109 N/A GLN 137.A N SER 155.A O no hydrogen 2.842 N/A GLN 137.A NE2 GLY 116.A O no hydrogen 2.777 N/A GLN 137.A NE2 SER 123.A O no hydrogen 3.666 N/A VAL 138.A N VAL 114.A O no hydrogen 2.939 N/A SER 139.A N LEU 157.A O no hydrogen 2.863 N/A SER 139.A OG ALA 117.A O no hydrogen 2.705 N/A SER 139.A OG SER 142.A OG no hydrogen 3.234 N/A TYR 140.A OH LEU 16.A O no hydrogen 2.745 N/A TYR 140.A OH THR 118.A OG1 no hydrogen 2.640 N/A SER 142.A OG ALA 117.A O no hydrogen 2.839 N/A SER 142.A OG THR 118.A O no hydrogen 3.223 N/A SER 142.A OG GLY 119.A O no hydrogen 3.060 N/A SER 142.A OG SER 123.A OG no hydrogen 2.565 N/A SER 142.A OG SER 139.A OG no hydrogen 3.234 N/A SER 143.A OG ASP 163.A OD1 no hydrogen 3.314 N/A SER 143.A OG ASP 163.A OD2 no hydrogen 3.033 N/A SER 144.A OG ASP 190.A O no hydrogen 2.928 N/A LEU 146.A N SER 144.A OG no hydrogen 3.220 N/A SER 148.A N ARG 145.A O no hydrogen 3.293 N/A SER 148.A OG ARG 145.A O no hydrogen 3.476 N/A SER 148.A OG ASP 425.A OD2 no hydrogen 2.865 N/A LYS 150.A NZ LEU 147.A O no hydrogen 3.181 N/A LYS 150.A NZ PHE 156.A O no hydrogen 3.052 N/A LYS 150.A NZ CYS 423.A O no hydrogen 3.139 N/A ASN 151.A N ASN 149.A OD1 no hydrogen 3.103 N/A PHE 153.A N ASN 149.A O no hydrogen 3.074 N/A LYS 154.A NZ GLY 131.A O no hydrogen 2.867 N/A SER 155.A OG ILE 135.A O no hydrogen 2.733 N/A LEU 157.A N GLN 137.A O no hydrogen 2.885 N/A ARG 158.A N GLY 424.A O no hydrogen 3.235 N/A ARG 158.A NH1 SER 142.A O no hydrogen 3.390 N/A ARG 158.A NH1 SER 144.A O no hydrogen 2.442 N/A ARG 158.A NH2 SER 144.A O no hydrogen 2.946 N/A ARG 158.A NH2 ASP 425.A OD2 no hydrogen 3.498 N/A THR 159.A N SER 139.A O no hydrogen 3.072 N/A THR 159.A OG1 SER 139.A O no hydrogen 3.394 N/A THR 159.A OG1 ASN 360.A O no hydrogen 3.092 N/A ASP 163.A N ASN 162.A OD1 no hydrogen 2.820 N/A ALA 167.A N ASP 163.A O no hydrogen 3.047 N/A THR 168.A N GLU 164.A O no hydrogen 3.011 N/A THR 168.A OG1 GLU 164.A O no hydrogen 3.310 N/A ALA 169.A N HIS 165.A O no hydrogen 2.829 N/A MET 170.A N GLN 166.A O no hydrogen 2.935 N/A ALA 171.A N ALA 167.A O no hydrogen 3.011 N/A ASP 172.A N THR 168.A O no hydrogen 2.891 N/A ILE 173.A N ALA 169.A O no hydrogen 2.874 N/A ILE 174.A N MET 170.A O no hydrogen 2.988 N/A GLU 175.A N ALA 171.A O no hydrogen 2.929 N/A TYR 176.A N ASP 172.A O no hydrogen 2.877 N/A TYR 176.A N ILE 173.A O no hydrogen 3.230 N/A PHE 177.A N ILE 173.A O no hydrogen 3.430 N/A ARG 178.A N GLU 175.A O no hydrogen 3.307 N/A TRP 179.A N ILE 174.A O no hydrogen 3.365 N/A TRP 179.A NE1 PRO 479.A O no hydrogen 3.282 N/A ASN 180.A N ASN 482.A OD1 no hydrogen 3.229 N/A TRP 181.A N SER 481.A O no hydrogen 3.026 N/A TRP 181.A NE1 THR 236.A OG1 no hydrogen 3.087 N/A VAL 182.A N CYS 209.A O no hydrogen 3.156 N/A GLY 183.A N VAL 239.A O no hydrogen 2.877 N/A THR 184.A N PHE 212.A O no hydrogen 2.969 N/A THR 184.A OG1 PHE 212.A O no hydrogen 3.413 N/A THR 184.A OG1 SER 213.A OG no hydrogen 3.109 N/A ILE 185.A N VAL 241.A O no hydrogen 2.737 N/A ALA 186.A N GLU 214.A O no hydrogen 2.999 N/A ALA 187.A N PHE 243.A O no hydrogen 2.904 N/A ASP 188.A N ILE 216.A O no hydrogen 2.783 N/A ASP 189.A N ALA 187.A O no hydrogen 2.731 N/A TYR 191.A N ASP 189.A OD2 no hydrogen 2.534 N/A TYR 191.A OH SER 269.A OG no hydrogen 3.347 N/A GLY 192.A N ASP 189.A OD2 no hydrogen 3.269 N/A ARG 193.A N ASP 189.A O no hydrogen 3.504 N/A ARG 193.A NH1 ASP 188.A OD1 no hydrogen 2.829 N/A ILE 196.A N GLY 192.A O no hydrogen 2.920 N/A GLU 197.A N ARG 193.A O no hydrogen 2.912 N/A LYS 198.A N PRO 194.A O no hydrogen 2.962 N/A PHE 199.A N GLY 195.A O no hydrogen 2.934 N/A ARG 200.A N ILE 196.A O no hydrogen 2.880 N/A ARG 200.A NE GLU 197.A OE1 no hydrogen 3.412 N/A ARG 200.A NE GLU 197.A OE2 no hydrogen 3.306 N/A ARG 200.A NH2 GLU 197.A OE2 no hydrogen 2.664 N/A GLU 201.A N GLU 197.A O no hydrogen 2.952 N/A GLU 202.A N LYS 198.A O no hydrogen 2.990 N/A ALA 203.A N PHE 199.A O no hydrogen 2.834 N/A GLU 204.A N ARG 200.A O no hydrogen 2.942 N/A GLU 205.A N GLU 201.A O no hydrogen 2.969 N/A ARG 206.A N GLU 202.A O no hydrogen 2.912 N/A ARG 206.A N ALA 203.A O no hydrogen 3.035 N/A ARG 206.A NH1 GLU 202.A OE1 no hydrogen 2.709 N/A ASP 207.A N GLU 204.A O no hydrogen 3.382 N/A ILE 208.A N ALA 203.A O no hydrogen 2.922 N/A CYS 209.A N ASN 180.A O no hydrogen 3.030 N/A ASP 211.A N VAL 182.A O no hydrogen 2.875 N/A SER 213.A OG THR 184.A OG1 no hydrogen 3.109 N/A GLU 214.A N THR 184.A O no hydrogen 3.137 N/A ILE 216.A N ALA 186.A O no hydrogen 2.863 N/A TYR 219.A N SER 217.A OG no hydrogen 3.132 N/A SER 220.A OG SER 217.A O no hydrogen 3.113 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.532 N/A ILE 225.A N ASP 221.A O no hydrogen 3.121 N/A GLN 226.A N GLU 222.A O no hydrogen 2.917 N/A GLN 226.A NE2 GLU 230.A OE2 no hydrogen 3.067 N/A HIS 227.A N GLU 223.A O no hydrogen 2.884 N/A VAL 228.A N GLU 224.A O no hydrogen 2.929 N/A VAL 229.A N ILE 225.A O no hydrogen 2.951 N/A GLU 230.A N GLN 226.A O no hydrogen 2.935 N/A VAL 231.A N HIS 227.A O no hydrogen 2.925 N/A ILE 232.A N VAL 228.A O no hydrogen 2.933 N/A GLN 233.A N VAL 229.A O no hydrogen 2.902 N/A ASN 234.A N GLU 230.A O no hydrogen 2.910 N/A SER 235.A N VAL 231.A O no hydrogen 3.330 N/A SER 235.A OG ASP 211.A OD2 no hydrogen 2.210 N/A ILE 240.A N ILE 265.A O no hydrogen 2.815 N/A VAL 241.A N GLY 183.A O no hydrogen 2.651 N/A VAL 242.A N LEU 267.A O no hydrogen 3.141 N/A PHE 243.A N ILE 185.A O no hydrogen 3.007 N/A SER 244.A OG SER 245.A O no hydrogen 3.107 N/A LEU 249.A N SER 245.A O no hydrogen 2.995 N/A LEU 249.A N GLY 246.A O no hydrogen 3.181 N/A GLU 250.A N GLY 246.A O no hydrogen 2.944 N/A ILE 253.A N LEU 249.A O no hydrogen 3.139 N/A LYS 254.A N GLU 250.A O no hydrogen 2.930 N/A GLU 255.A N PRO 251.A O no hydrogen 2.943 N/A ILE 256.A N LEU 252.A O no hydrogen 2.912 N/A VAL 257.A N ILE 253.A O no hydrogen 2.872 N/A ARG 258.A N LYS 254.A O no hydrogen 2.911 N/A ARG 259.A N GLU 255.A O no hydrogen 2.950 N/A ARG 259.A NH1 GLU 255.A OE2 no hydrogen 2.908 N/A ASN 260.A N VAL 257.A O no hydrogen 3.144 N/A ILE 261.A N ILE 256.A O no hydrogen 3.330 N/A THR 262.A OG1 ASN 260.A OD1 no hydrogen 3.231 N/A THR 262.A OG1 HIS 285.A O no hydrogen 3.325 N/A LYS 264.A NZ ILE 232.A O no hydrogen 3.546 N/A LYS 264.A NZ ALA 237.A O no hydrogen 3.137 N/A ILE 265.A N LYS 238.A O no hydrogen 2.512 N/A LEU 267.A N ILE 240.A O no hydrogen 2.942 N/A ALA 268.A N ILE 291.A O no hydrogen 2.820 N/A SER 269.A N VAL 242.A O no hydrogen 3.317 N/A SER 269.A OG TYR 191.A OH no hydrogen 3.347 N/A SER 269.A OG VAL 242.A O no hydrogen 3.422 N/A GLU 270.A N GLN 166.A OE1 no hydrogen 2.755 N/A ALA 273.A N SER 269.A O no hydrogen 3.073 N/A SER 275.A N TRP 272.A O no hydrogen 3.367 N/A ALA 279.A N SER 275.A O no hydrogen 2.979 N/A MET 280.A N ILE 278.A O no hydrogen 2.727 N/A GLN 282.A N GLN 282.A OE1 no hydrogen 2.875 N/A TYR 283.A N MET 280.A O no hydrogen 3.198 N/A VAL 286.A N TYR 283.A O no hydrogen 2.882 N/A VAL 287.A N TYR 283.A O no hydrogen 2.908 N/A GLY 288.A N PHE 284.A O no hydrogen 3.021 N/A GLY 289.A N TRP 435.A O no hydrogen 2.891 N/A THR 290.A OG1 VAL 287.A O no hydrogen 2.423 N/A ILE 291.A N TRP 266.A O no hydrogen 3.235 N/A GLY 292.A N ILE 433.A O no hydrogen 2.923 N/A ALA 294.A N SER 431.A O no hydrogen 2.889 N/A GLY 298.A N LEU 355.A O no hydrogen 3.001 N/A PHE 303.A N ILE 300.A O no hydrogen 3.235 N/A ARG 304.A NH1 ILE 350.A O no hydrogen 3.410 N/A ARG 304.A NH2 ILE 350.A O no hydrogen 2.961 N/A GLU 305.A N GLU 305.A OE1 no hydrogen 2.686 N/A LEU 307.A N PHE 303.A O no hydrogen 2.920 N/A LYS 308.A N ARG 304.A O no hydrogen 2.909 N/A LYS 309.A N GLU 305.A O no hydrogen 2.948 N/A LYS 309.A N PHE 306.A O no hydrogen 3.247 N/A HIS 311.A NE2 GLY 338.A O no hydrogen 3.213 N/A ARG 313.A N HIS 311.A ND1 no hydrogen 3.138 N/A LYS 314.A N HIS 311.A ND1 no hydrogen 3.072 N/A SER 315.A N HIS 311.A O no hydrogen 3.367 N/A SER 315.A OG HIS 311.A O no hydrogen 3.434 N/A ASN 318.A ND2 GLN 51.A OE1 no hydrogen 3.385 N/A GLY 319.A N ARG 4.A O no hydrogen 3.044 N/A PHE 320.A N ASN 318.A OD1 no hydrogen 3.081 N/A LYS 322.A NZ PRO 312.A O no hydrogen 2.795 N/A PHE 324.A N PHE 320.A O no hydrogen 2.981 N/A TRP 325.A N ALA 321.A O no hydrogen 2.897 N/A TRP 325.A NE1 GLU 340.A OE1 no hydrogen 3.076 N/A GLU 326.A N LYS 322.A O no hydrogen 2.975 N/A GLU 327.A N GLU 323.A O no hydrogen 2.901 N/A THR 328.A N PHE 324.A O no hydrogen 2.864 N/A THR 328.A OG1 PHE 324.A O no hydrogen 2.168 N/A PHE 329.A N TRP 325.A O no hydrogen 2.955 N/A CYS 331.A N GLU 326.A O no hydrogen 3.394 N/A HIS 332.A N PRO 334.A O no hydrogen 2.540 N/A THR 337.A N GLU 340.A OE2 no hydrogen 3.035 N/A THR 337.A OG1 GLU 340.A OE2 no hydrogen 2.959 N/A ASP 339.A N THR 337.A OG1 no hydrogen 3.336 N/A GLU 340.A N GLU 340.A OE1 no hydrogen 2.749 N/A SER 343.A N ASN 341.A OD1 no hydrogen 3.139 N/A SER 344.A N ASN 341.A O no hydrogen 3.286 N/A SER 344.A OG ASN 341.A O no hydrogen 2.642 N/A TYR 349.A OH LEU 307.A O no hydrogen 2.446 N/A ILE 350.A N THR 347.A O no hydrogen 3.370 N/A ASP 351.A N THR 347.A O no hydrogen 2.946 N/A ARG 356.A NH1 LEU 295.A O no hydrogen 2.386 N/A TYR 359.A OH ASN 413.A OD1 no hydrogen 3.133 N/A ASN 360.A ND2 TYR 140.A O no hydrogen 2.828 N/A VAL 361.A N ILE 357.A O no hydrogen 3.163 N/A TYR 362.A N SER 358.A O no hydrogen 2.963 N/A TYR 362.A OH GLU 59.A OE2 no hydrogen 3.236 N/A LEU 363.A N TYR 359.A O no hydrogen 2.868 N/A ALA 364.A N ASN 360.A O no hydrogen 2.907 N/A VAL 365.A N VAL 361.A O no hydrogen 3.010 N/A TYR 366.A N TYR 362.A O no hydrogen 2.965 N/A SER 367.A N LEU 363.A O no hydrogen 2.829 N/A SER 367.A OG LEU 363.A O no hydrogen 3.037 N/A SER 367.A OG ALA 364.A O no hydrogen 2.466 N/A ILE 368.A N ALA 364.A O no hydrogen 3.050 N/A ALA 369.A N VAL 365.A O no hydrogen 2.947 N/A HIS 370.A N TYR 366.A O no hydrogen 2.848 N/A HIS 370.A ND1 TYR 366.A O no hydrogen 2.975 N/A ALA 371.A N SER 367.A O no hydrogen 2.959 N/A LEU 372.A N ILE 368.A O no hydrogen 2.972 N/A GLN 373.A N ALA 369.A O no hydrogen 2.878 N/A ASP 374.A N HIS 370.A O no hydrogen 2.882 N/A ILE 375.A N ALA 371.A O no hydrogen 2.987 N/A TYR 376.A N LEU 372.A O no hydrogen 2.888 N/A THR 377.A N GLN 373.A O no hydrogen 2.525 N/A THR 377.A OG1 GLN 373.A O no hydrogen 2.840 N/A CYS 378.A SG LEU 379.A O no hydrogen 3.648 N/A ARG 382.A N LEU 379.A O no hydrogen 3.048 N/A PHE 385.A N SER 389.A O no hydrogen 3.373 N/A GLY 388.A N PHE 385.A O no hydrogen 3.043 N/A SER 389.A N THR 386.A O no hydrogen 2.959 N/A SER 389.A OG THR 386.A O no hydrogen 2.706 N/A CYS 390.A SG LEU 379.A O no hydrogen 3.372 N/A LYS 394.A N ASP 392.A OD1 no hydrogen 3.121 N/A LYS 395.A N ASP 392.A O no hydrogen 3.076 N/A GLU 397.A N GLN 400.A OE1 no hydrogen 2.644 N/A TRP 399.A NE1 GLU 397.A OE1 no hydrogen 2.375 N/A VAL 401.A N GLU 397.A O no hydrogen 3.380 N/A LEU 402.A N ALA 398.A O no hydrogen 2.897 N/A LYS 403.A N TRP 399.A O no hydrogen 2.930 N/A HIS 404.A N GLN 400.A O no hydrogen 2.976 N/A LEU 405.A N VAL 401.A O no hydrogen 2.846 N/A ARG 406.A N LEU 402.A O no hydrogen 2.878 N/A HIS 407.A N LYS 403.A O no hydrogen 3.021 N/A LEU 408.A N LEU 405.A O no hydrogen 3.288 N/A PHE 410.A N VAL 418.A O no hydrogen 2.982 N/A THR 411.A OG1 GLN 417.A OE1 no hydrogen 2.434 N/A ASN 412.A N GLU 416.A O no hydrogen 2.708 N/A ASN 412.A ND2 GLU 416.A OE1 no hydrogen 3.355 N/A ASN 413.A ND2 GLN 299.A O no hydrogen 2.964 N/A GLN 417.A NE2 ASN 409.A OD1 no hydrogen 3.318 N/A VAL 418.A N PHE 410.A O no hydrogen 2.856 N/A THR 419.A OG1 ASN 409.A OD1 no hydrogen 2.746 N/A ASP 421.A N ASP 425.A O no hydrogen 3.336 N/A GLU 422.A N GLU 422.A OE1 no hydrogen 2.781 N/A CYS 423.A SG GLU 422.A OE2 no hydrogen 3.402 N/A GLY 424.A N ASP 421.A O no hydrogen 2.910 N/A ASP 425.A N ASP 421.A OD1 no hydrogen 2.542 N/A TYR 430.A N TYR 452.A O no hydrogen 2.996 N/A SER 431.A N ALA 294.A O no hydrogen 2.904 N/A SER 431.A OG ALA 294.A O no hydrogen 3.231 N/A ILE 432.A N GLY 450.A O no hydrogen 2.883 N/A ILE 433.A N GLY 292.A O no hydrogen 2.895 N/A ASN 434.A N LYS 447.A O no hydrogen 2.687 N/A ASN 434.A ND2 GLY 289.A O no hydrogen 3.598 N/A TRP 435.A N THR 290.A O no hydrogen 3.020 N/A TRP 435.A NE1 ALA 273.A O no hydrogen 3.021 N/A HIS 436.A N VAL 445.A O no hydrogen 3.072 N/A SER 438.A N SER 443.A O no hydrogen 3.271 N/A SER 438.A OG SER 443.A O no hydrogen 3.197 N/A GLY 442.A N ASP 441.A OD1 no hydrogen 2.620 N/A SER 443.A OG ASP 441.A OD2 no hydrogen 3.567 N/A VAL 445.A N HIS 436.A O no hydrogen 2.939 N/A LYS 447.A N ASN 434.A O no hydrogen 2.970 N/A VAL 449.A N ILE 432.A O no hydrogen 2.637 N/A TYR 451.A N PHE 463.A O no hydrogen 2.894 N/A TYR 452.A N TYR 430.A O no hydrogen 2.870 N/A TYR 452.A OH ASP 172.A OD2 no hydrogen 2.422 N/A ASN 453.A N ARG 461.A O no hydrogen 2.668 N/A VAL 454.A N ASN 429.A OD1 no hydrogen 3.421 N/A TYR 455.A N ASN 453.A OD1 no hydrogen 3.209 N/A GLU 460.A N LYS 457.A O no hydrogen 3.322 N/A ARG 461.A NH1 ALA 456.A O no hydrogen 3.364 N/A PHE 463.A N TYR 451.A O no hydrogen 2.930 N/A ASN 465.A N VAL 449.A O no hydrogen 2.792 N/A GLU 467.A N ASN 465.A OD1 no hydrogen 3.324 N/A GLU 467.A N GLU 467.A OE1 no hydrogen 2.944 N/A LYS 468.A NZ GLU 448.A O no hydrogen 2.846 N/A ILE 469.A N GLU 466.A O no hydrogen 3.115 N/A SER 472.A OG TRP 471.A O no hydrogen 2.400 N/A GLY 473.A N LEU 470.A O no hydrogen 3.029 N/A PHE 474.A N TRP 471.A O no hydrogen 3.179 N/A SER 475.A N TRP 471.A O no hydrogen 2.713 N/A GLU 477.A N SER 475.A OG no hydrogen 3.375 N/A SER 481.A OG TRP 181.A O no hydrogen 2.700 N/A CYS 483.A SG SER 484.A OG no hydrogen 3.716 N/A SER 484.A OG PHE 504.A O no hydrogen 3.333 N/A CYS 487.A N ASP 519.A OD1 no hydrogen 3.128 N/A CYS 487.A SG ARG 492.A O no hydrogen 3.684 N/A CYS 487.A SG GLU 505.A O no hydrogen 3.790 N/A GLY 490.A N SER 515.A O no hydrogen 2.778 N/A ARG 492.A N VAL 507.A O no hydrogen 2.856 N/A ARG 492.A NH1 LYS 493.A O no hydrogen 3.046 N/A GLY 494.A N GLU 505.A O no hydrogen 2.843 N/A GLU 497.A N GLU 497.A OE1 no hydrogen 2.581 N/A GLU 499.A N ILE 496.A O no hydrogen 3.326 N/A CYS 502.A SG ASN 180.A O no hydrogen 3.716 N/A CYS 503.A N PRO 500.A O no hydrogen 3.048 N/A GLU 505.A N GLY 494.A O no hydrogen 2.923 N/A VAL 507.A N ARG 492.A O no hydrogen 2.929 N/A GLU 508.A N GLU 508.A OE2 no hydrogen 2.518 N/A CYS 509.A N GLY 490.A O no hydrogen 3.127 N/A CYS 509.A SG GLY 490.A O no hydrogen 3.402 N/A GLY 512.A N SER 532.A OG no hydrogen 3.184 N/A TYR 514.A N ASN 524.A O no hydrogen 2.657 N/A SER 515.A N HIS 536.A O no hydrogen 2.976 N/A GLU 517.A N ASP 516.A OD1 no hydrogen 2.690 N/A ASP 519.A N CYS 487.A O no hydrogen 3.261 N/A ASN 524.A N TYR 514.A O no hydrogen 2.444 N/A CYS 526.A SG PRO 527.A O no hydrogen 4.016 N/A TRP 531.A N ILE 540.A O no hydrogen 2.656 N/A ASN 533.A ND2 THR 537.A OG1 no hydrogen 3.301 N/A HIS 536.A N ASN 533.A O no hydrogen 3.169 N/A THR 537.A N ASN 533.A OD1 no hydrogen 3.201 N/A CYS 539.A N SER 538.A OG no hydrogen 2.607 N/A ILE 540.A N TRP 531.A O no hydrogen 2.678 N/A LYS 542.A NZ ASP 688.A O no hydrogen 3.213 N/A GLU 545.A N ILE 691.A O no hydrogen 2.988 N/A ILE 555.A N GLU 551.A O no hydrogen 2.948 N/A ALA 556.A N PRO 552.A O no hydrogen 2.947 N/A LEU 557.A N PHE 553.A O no hydrogen 2.981 N/A THR 558.A N GLY 554.A O no hydrogen 2.901 N/A THR 558.A OG1 GLY 554.A O no hydrogen 2.953 N/A LEU 559.A N ILE 555.A O no hydrogen 2.920 N/A PHE 560.A N ALA 556.A O no hydrogen 2.994 N/A ALA 561.A N LEU 557.A O no hydrogen 2.970 N/A VAL 562.A N THR 558.A O no hydrogen 2.912 N/A LEU 563.A N LEU 559.A O no hydrogen 2.932 N/A GLY 564.A N PHE 560.A O no hydrogen 2.963 N/A ILE 565.A N ALA 561.A O no hydrogen 2.972 N/A PHE 566.A N VAL 562.A O no hydrogen 2.915 N/A LEU 567.A N LEU 563.A O no hydrogen 2.949 N/A THR 568.A N GLY 564.A O no hydrogen 2.959 N/A THR 568.A OG1 GLY 564.A O no hydrogen 2.776 N/A ALA 569.A N ILE 565.A O no hydrogen 2.943 N/A PHE 570.A N PHE 566.A O no hydrogen 2.903 N/A VAL 571.A N LEU 567.A O no hydrogen 2.983 N/A LEU 572.A N THR 568.A O no hydrogen 2.934 N/A GLY 573.A N ALA 569.A O no hydrogen 2.904 N/A VAL 574.A N PHE 570.A O no hydrogen 2.939 N/A PHE 575.A N VAL 571.A O no hydrogen 2.987 N/A ILE 576.A N LEU 572.A O no hydrogen 2.887 N/A LYS 577.A N GLY 573.A O no hydrogen 2.935 N/A PHE 578.A N VAL 574.A O no hydrogen 3.192 N/A ARG 579.A NH1 ILE 576.A O no hydrogen 3.033 N/A THR 581.A OG1 PHE 578.A O no hydrogen 3.137 N/A LYS 585.A N THR 581.A O no hydrogen 3.033 N/A ALA 586.A N PRO 582.A O no hydrogen 2.903 N/A THR 587.A N ILE 583.A O no hydrogen 2.943 N/A THR 587.A OG1 ILE 583.A O no hydrogen 2.878 N/A THR 587.A OG1 VAL 584.A O no hydrogen 3.375 N/A SER 592.A N ASN 588.A O no hydrogen 3.280 N/A SER 592.A OG THR 587.A O no hydrogen 3.110 N/A TYR 593.A N ARG 589.A O no hydrogen 2.870 N/A LEU 594.A N GLU 590.A O no hydrogen 2.986 N/A LEU 595.A N LEU 591.A O no hydrogen 2.827 N/A LEU 596.A N SER 592.A O no hydrogen 2.931 N/A PHE 597.A N TYR 593.A O no hydrogen 2.914 N/A SER 598.A N LEU 594.A O no hydrogen 2.931 N/A SER 598.A OG LEU 594.A O no hydrogen 3.115 N/A LEU 599.A N LEU 595.A O no hydrogen 2.885 N/A LEU 600.A N LEU 596.A O no hydrogen 2.934 N/A CYS 601.A N PHE 597.A O no hydrogen 2.952 N/A CYS 601.A SG PHE 597.A O no hydrogen 3.305 N/A CYS 602.A N SER 598.A O no hydrogen 2.880 N/A CYS 602.A SG SER 598.A O no hydrogen 3.270 N/A PHE 603.A N LEU 599.A O no hydrogen 2.945 N/A SER 604.A N LEU 600.A O no hydrogen 2.902 N/A SER 604.A OG LEU 600.A O no hydrogen 2.860 N/A SER 605.A N CYS 601.A O no hydrogen 2.853 N/A SER 605.A OG CYS 601.A O no hydrogen 3.265 N/A SER 605.A OG CYS 602.A O no hydrogen 2.765 N/A SER 606.A N CYS 602.A O no hydrogen 3.005 N/A SER 606.A OG PHE 603.A O no hydrogen 2.290 N/A LEU 607.A N SER 604.A O no hydrogen 2.902 N/A PHE 608.A N SER 605.A O no hydrogen 3.355 N/A GLY 611.A N LEU 547.A O no hydrogen 2.867 N/A THR 617.A OG1 GLN 614.A OE1 no hydrogen 3.103 N/A CYS 618.A N GLN 614.A O no hydrogen 2.959 N/A CYS 618.A SG GLN 614.A O no hydrogen 3.136 N/A ARG 619.A N ASP 615.A O no hydrogen 2.936 N/A ARG 619.A NE PRO 678.A O no hydrogen 3.475 N/A LEU 620.A N TRP 616.A O no hydrogen 2.922 N/A LEU 620.A N THR 617.A O no hydrogen 3.161 N/A ARG 621.A N THR 617.A O no hydrogen 2.940 N/A ARG 621.A NE PHE 608.A O no hydrogen 3.249 N/A GLN 622.A NE2 GLU 697.A OE1 no hydrogen 3.303 N/A ALA 624.A N LEU 620.A O no hydrogen 3.168 N/A GLY 626.A N GLN 622.A O no hydrogen 2.957 N/A ILE 627.A N PRO 623.A O no hydrogen 2.892 N/A SER 628.A N ALA 624.A O no hydrogen 2.974 N/A SER 628.A OG ALA 624.A O no hydrogen 2.654 N/A PHE 629.A N PHE 625.A O no hydrogen 2.903 N/A VAL 630.A N GLY 626.A O no hydrogen 2.925 N/A LEU 631.A N ILE 627.A O no hydrogen 2.932 N/A CYS 632.A N SER 628.A O no hydrogen 3.002 N/A CYS 632.A SG LEU 595.A O no hydrogen 3.953 N/A CYS 632.A SG SER 628.A O no hydrogen 3.752 N/A ILE 633.A N PHE 629.A O no hydrogen 2.906 N/A SER 634.A N VAL 630.A O no hydrogen 2.857 N/A SER 634.A OG VAL 630.A O no hydrogen 2.440 N/A CYS 635.A N LEU 631.A O no hydrogen 2.994 N/A CYS 635.A SG LEU 631.A O no hydrogen 3.240 N/A ILE 636.A N CYS 632.A O no hydrogen 2.980 N/A LEU 637.A N ILE 633.A O no hydrogen 2.822 N/A VAL 638.A N SER 634.A O no hydrogen 2.925 N/A LYS 639.A N CYS 635.A O no hydrogen 2.981 N/A LYS 639.A NZ GLU 733.A OE2 no hydrogen 3.032 N/A THR 640.A N ILE 636.A O no hydrogen 3.130 N/A THR 640.A OG1 ILE 636.A O no hydrogen 2.858 N/A VAL 646.A N ARG 642.A O no hydrogen 3.213 N/A PHE 647.A N VAL 643.A O no hydrogen 2.908 N/A GLU 648.A N LEU 644.A O no hydrogen 2.908 N/A ALA 649.A N LEU 645.A O no hydrogen 2.904 N/A LYS 650.A N VAL 646.A O no hydrogen 2.914 N/A ILE 651.A N PHE 647.A O no hydrogen 3.095 N/A ILE 651.A N GLU 648.A O no hydrogen 3.205 N/A LEU 653.A N ASN 652.A OD1 no hydrogen 2.562 N/A GLN 654.A N ASN 652.A OD1 no hydrogen 3.443 N/A LEU 656.A N ASN 652.A O no hydrogen 3.396 N/A LEU 657.A N LEU 653.A O no hydrogen 2.912 N/A VAL 658.A N GLN 654.A O no hydrogen 2.994 N/A PHE 659.A N PHE 655.A O no hydrogen 2.876 N/A LEU 660.A N LEU 656.A O no hydrogen 2.889 N/A CYS 661.A N LEU 657.A O no hydrogen 3.025 N/A CYS 661.A SG LEU 657.A O no hydrogen 3.246 N/A THR 662.A N VAL 658.A O no hydrogen 2.959 N/A THR 662.A OG1 VAL 658.A O no hydrogen 3.053 N/A PHE 663.A N PHE 659.A O no hydrogen 2.809 N/A MET 664.A N LEU 660.A O no hydrogen 2.950 N/A GLN 665.A N CYS 661.A O no hydrogen 3.087 N/A GLN 665.A NE2 THR 710.A OG1 no hydrogen 3.344 N/A ILE 666.A N THR 662.A O no hydrogen 2.866 N/A VAL 667.A N PHE 663.A O no hydrogen 2.849 N/A ILE 668.A N MET 664.A O no hydrogen 3.024 N/A CYS 669.A N GLN 665.A O no hydrogen 2.933 N/A CYS 669.A SG GLN 665.A O no hydrogen 3.187 N/A VAL 670.A N ILE 666.A O no hydrogen 2.847 N/A ILE 671.A N VAL 667.A O no hydrogen 2.976 N/A TRP 672.A N ILE 668.A O no hydrogen 2.943 N/A LEU 673.A N CYS 669.A O no hydrogen 2.886 N/A TYR 674.A N VAL 670.A O no hydrogen 2.914 N/A THR 675.A N ILE 671.A O no hydrogen 2.929 N/A THR 675.A OG1 ILE 671.A O no hydrogen 2.958 N/A ALA 676.A N TRP 672.A O no hydrogen 3.253 N/A SER 679.A N HIS 696.A O no hydrogen 2.973 N/A SER 679.A OG SER 680.A O no hydrogen 3.560 N/A SER 680.A N ASP 615.A OD1 no hydrogen 2.996 N/A SER 680.A OG ASP 615.A OD1 no hydrogen 3.290 N/A ASN 683.A N PHE 692.A O no hydrogen 2.807 N/A GLN 684.A N GLU 685.A OE1 no hydrogen 3.157 N/A GLU 685.A N ASN 683.A OD1 no hydrogen 3.143 N/A ILE 690.A N GLU 687.A O no hydrogen 3.486 N/A ILE 691.A N GLU 543.A O no hydrogen 2.879 N/A PHE 692.A N ASN 683.A O no hydrogen 2.962 N/A THR 694.A N TYR 681.A O no hydrogen 2.922 N/A HIS 696.A N SER 679.A O no hydrogen 2.830 N/A MET 701.A N SER 699.A OG no hydrogen 3.340 N/A GLY 704.A N LEU 700.A O no hydrogen 2.899 N/A PHE 705.A N MET 701.A O no hydrogen 2.908 N/A LEU 706.A N ALA 702.A O no hydrogen 2.924 N/A ILE 707.A N LEU 703.A O no hydrogen 2.948 N/A GLY 708.A N GLY 704.A O no hydrogen 2.874 N/A TYR 709.A N PHE 705.A O no hydrogen 2.911 N/A THR 710.A N LEU 706.A O no hydrogen 3.034 N/A THR 710.A OG1 LEU 706.A O no hydrogen 2.825 N/A CYS 711.A N ILE 707.A O no hydrogen 2.921 N/A CYS 711.A SG ILE 707.A O no hydrogen 3.235 N/A LEU 712.A N GLY 708.A O no hydrogen 2.854 N/A LEU 713.A N TYR 709.A O no hydrogen 2.975 N/A ALA 714.A N THR 710.A O no hydrogen 2.993 N/A ALA 715.A N CYS 711.A O no hydrogen 2.870 N/A ILE 716.A N LEU 712.A O no hydrogen 2.973 N/A CYS 717.A N LEU 713.A O no hydrogen 2.989 N/A PHE 718.A N ALA 714.A O no hydrogen 2.898 N/A PHE 719.A N ALA 715.A O no hydrogen 2.900 N/A PHE 720.A N ILE 716.A O no hydrogen 3.034 N/A ALA 721.A N CYS 717.A O no hydrogen 2.931 N/A PHE 722.A N PHE 718.A O no hydrogen 2.866 N/A LYS 723.A N PHE 719.A O no hydrogen 2.956 N/A SER 724.A N PHE 720.A O no hydrogen 2.994 N/A SER 724.A OG PHE 720.A O no hydrogen 3.278 N/A ARG 725.A N PHE 722.A O no hydrogen 3.380 N/A ARG 725.A NH1 PHE 722.A O no hydrogen 3.269 N/A ASN 730.A N VAL 802.A O no hydrogen 3.204 N/A ASN 730.A ND2 GLU 733.A OE1 no hydrogen 2.724 N/A ASN 732.A N PRO 728.A O no hydrogen 3.396 N/A GLU 733.A N GLU 729.A O no hydrogen 2.975 N/A ILE 737.A N GLU 733.A O no hydrogen 2.969 N/A THR 738.A N ALA 734.A O no hydrogen 2.922 N/A THR 738.A OG1 ALA 734.A O no hydrogen 2.773 N/A PHE 739.A N LYS 735.A O no hydrogen 2.968 N/A SER 740.A N PHE 736.A O no hydrogen 2.922 N/A SER 740.A OG ILE 737.A O no hydrogen 2.696 N/A MET 741.A N ILE 737.A O no hydrogen 3.004 N/A LEU 742.A N THR 738.A O no hydrogen 2.940 N/A ILE 743.A N PHE 739.A O no hydrogen 2.945 N/A PHE 744.A N SER 740.A O no hydrogen 2.936 N/A PHE 745.A N MET 741.A O no hydrogen 2.976 N/A ILE 746.A N LEU 742.A O no hydrogen 2.912 N/A VAL 747.A N ILE 743.A O no hydrogen 2.954 N/A TRP 748.A N PHE 744.A O no hydrogen 2.981 N/A ILE 749.A N PHE 745.A O no hydrogen 2.886 N/A SER 750.A N ILE 746.A O no hydrogen 2.955 N/A SER 750.A OG ILE 746.A O no hydrogen 2.705 N/A PHE 751.A N VAL 747.A O no hydrogen 2.951 N/A ILE 752.A N ILE 749.A O no hydrogen 3.435 N/A TYR 755.A N PHE 751.A O no hydrogen 2.778 N/A ALA 756.A N ILE 752.A O no hydrogen 2.935 N/A SER 757.A N PRO 753.A O no hydrogen 2.914 N/A SER 757.A OG PRO 753.A O no hydrogen 3.509 N/A THR 758.A N ALA 754.A O no hydrogen 3.229 N/A THR 758.A OG1 ALA 754.A O no hydrogen 2.282 N/A LYS 761.A NZ GLU 551.A OE1 no hydrogen 3.329 N/A SER 764.A N LYS 761.A O no hydrogen 2.991 N/A SER 764.A OG LYS 761.A O no hydrogen 3.178 N/A VAL 766.A N PHE 762.A O no hydrogen 3.178 N/A VAL 766.A N VAL 763.A O no hydrogen 2.972 N/A VAL 768.A N SER 764.A O no hydrogen 3.300 N/A ILE 769.A N ALA 765.A O no hydrogen 3.171 N/A ALA 770.A N VAL 766.A O no hydrogen 2.977 N/A ILE 771.A N GLU 767.A O no hydrogen 2.992 N/A LEU 772.A N VAL 768.A O no hydrogen 2.874 N/A ALA 773.A N ILE 769.A O no hydrogen 2.991 N/A ALA 774.A N ALA 770.A O no hydrogen 3.038 N/A SER 775.A N ILE 771.A O no hydrogen 2.894 N/A SER 775.A OG ILE 771.A O no hydrogen 3.235 N/A PHE 776.A N LEU 772.A O no hydrogen 2.757 N/A GLY 777.A N ALA 773.A O no hydrogen 2.859 N/A LEU 778.A N ALA 774.A O no hydrogen 3.040 N/A LEU 779.A N SER 775.A O no hydrogen 3.084 N/A ALA 780.A N PHE 776.A O no hydrogen 2.988 N/A CYS 781.A N GLY 777.A O no hydrogen 2.832 N/A CYS 781.A SG GLY 777.A O no hydrogen 3.564 N/A ILE 782.A N LEU 778.A O no hydrogen 2.911 N/A ILE 782.A N LEU 779.A O no hydrogen 3.042 N/A PHE 783.A N LEU 779.A O no hydrogen 2.818 N/A PHE 783.A N ALA 780.A O no hydrogen 3.010 N/A PHE 784.A N ALA 780.A O no hydrogen 3.129 N/A LYS 786.A NZ ILE 782.A O no hydrogen 2.977 N/A ILE 787.A N PHE 783.A O no hydrogen 2.821 N/A TYR 788.A N PHE 784.A O no hydrogen 2.771 N/A ILE 789.A N ASN 785.A O no hydrogen 3.010 N/A ILE 789.A N LYS 786.A O no hydrogen 2.984 N/A ILE 790.A N LYS 786.A O no hydrogen 3.103 N/A ILE 790.A N ILE 787.A O no hydrogen 2.972 N/A LEU 791.A N ILE 787.A O no hydrogen 3.034 N/A THR 798.A N ARG 796.A O no hydrogen 2.832 N/A GLU 801.A N THR 798.A O no hydrogen 3.222 N/A VAL 802.A N ILE 799.A O no hydrogen 3.074 N/A ARG 803.A N GLU 800.A O no hydrogen 3.422 N/A