Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5vlr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N VAL 20.A O no hydrogen 2.763 N/A VAL 6.A N PHE 18.A O no hydrogen 3.247 N/A ASP 7.A N PRO 81.A O no hydrogen 2.805 N/A PHE 8.A N LEU 16.A O no hydrogen 2.755 N/A LEU 9.A N LEU 83.A O no hydrogen 2.979 N/A LEU 10.A N VAL 14.A O no hydrogen 2.826 N/A GLY 13.A N LEU 10.A O no hydrogen 2.833 N/A VAL 14.A N THR 12.A OG1 no hydrogen 3.427 N/A TYR 15.A OH ASP 7.A OD1 no hydrogen 2.742 N/A LEU 16.A N PHE 8.A O no hydrogen 3.164 N/A PHE 18.A N VAL 6.A O no hydrogen 3.289 N/A VAL 20.A N VAL 4.A O no hydrogen 3.102 N/A ARG 22.A N GLN 2.A O no hydrogen 2.902 N/A ALA 24.A N SER 21.A O no hydrogen 3.061 N/A ASN 25.A ND2 GLN 70.A OE1 no hydrogen 3.246 N/A LEU 26.A N ARG 71.A O no hydrogen 2.862 N/A SER 27.A N GLU 69.A O no hydrogen 2.937 N/A THR 28.A N ASN 25.A OD1 no hydrogen 3.086 N/A THR 28.A OG1 ASN 25.A OD1 no hydrogen 3.187 N/A ILE 29.A N ASN 25.A O no hydrogen 3.054 N/A LYS 30.A N LEU 26.A O no hydrogen 3.019 N/A LYS 30.A NZ PRO 49.A O no hydrogen 2.923 N/A LYS 30.A NZ TYR 52.A O no hydrogen 2.774 N/A LYS 30.A NZ GLU 69.A OE1 no hydrogen 3.147 N/A LYS 30.A NZ GLU 69.A OE2 no hydrogen 2.931 N/A GLN 31.A N SER 27.A O no hydrogen 3.436 N/A LEU 32.A N THR 28.A O no hydrogen 3.178 N/A LEU 33.A N ILE 29.A O no hydrogen 2.889 N/A TRP 34.A N LYS 30.A O no hydrogen 2.868 N/A HIS 35.A N GLN 31.A O no hydrogen 2.918 N/A ARG 36.A N LEU 32.A O no hydrogen 3.144 N/A ARG 36.A N LEU 33.A O no hydrogen 3.160 N/A ALA 37.A N LEU 33.A O no hydrogen 2.752 N/A GLN 38.A N TRP 34.A O no hydrogen 3.305 N/A GLN 38.A NE2 HIS 35.A ND1 no hydrogen 3.634 N/A GLN 38.A NE2 HIS 35.A O no hydrogen 3.616 N/A TYR 39.A N ARG 36.A O no hydrogen 3.095 N/A GLU 40.A N ALA 37.A O no hydrogen 2.900 N/A MET 45.A N LEU 42.A O no hydrogen 3.309 N/A LEU 46.A N PHE 43.A O no hydrogen 3.049 N/A SER 47.A N TYR 52.A OH no hydrogen 2.888 N/A ALA 51.A N GLY 48.A O no hydrogen 2.976 N/A TYR 52.A N PRO 49.A O no hydrogen 3.229 N/A VAL 53.A N VAL 86.A O no hydrogen 3.041 N/A THR 55.A N ARG 84.A O no hydrogen 2.824 N/A CYS 56.A N GLN 64.A O no hydrogen 3.232 N/A ASN 58.A N GLU 62.A O no hydrogen 3.091 N/A GLN 59.A NE2 GLN 77.A O no hydrogen 3.099 N/A THR 60.A OG1 ASN 58.A OD1 no hydrogen 2.892 N/A ALA 61.A N ASN 58.A O no hydrogen 2.826 N/A GLU 62.A N ASN 58.A OD1 no hydrogen 3.301 N/A GLN 64.A N CYS 56.A O no hydrogen 2.756 N/A LEU 66.A N PHE 54.A O no hydrogen 2.860 N/A GLU 67.A N GLU 65.A O no hydrogen 3.014 N/A GLN 70.A N ASP 68.A OD1 no hydrogen 3.164 N/A ARG 72.A NH2 GLU 637.A OE1 no hydrogen 3.552 N/A LEU 73.A N ALA 24.A O no hydrogen 2.967 N/A CYS 74.A N ARG 22.A O no hydrogen 2.813 N/A CYS 74.A SG ASP 75.A OD1 no hydrogen 3.784 N/A VAL 76.A N ARG 72.A O no hydrogen 2.939 N/A VAL 76.A N LEU 73.A O no hydrogen 3.244 N/A GLN 77.A N LEU 73.A O no hydrogen 2.942 N/A PHE 79.A N ILE 57.A O no hydrogen 2.762 N/A VAL 82.A N LEU 80.A O no hydrogen 2.875 N/A LEU 83.A N ASP 7.A O no hydrogen 2.874 N/A ARG 84.A N THR 55.A O no hydrogen 3.081 N/A LEU 85.A N LEU 9.A O no hydrogen 3.121 N/A VAL 86.A N VAL 53.A O no hydrogen 3.058 N/A ARG 88.A N ALA 51.A O no hydrogen 3.419 N/A ARG 88.A NE GLU 50.A O no hydrogen 3.152 N/A ARG 88.A NH2 GLU 69.A OE2 no hydrogen 3.080 N/A LYS 95.A N ASP 91.A O no hydrogen 3.297 N/A ILE 97.A N VAL 93.A O no hydrogen 2.813 N/A ASN 98.A N LYS 94.A O no hydrogen 2.857 N/A SER 99.A OG LYS 95.A O no hydrogen 3.057 N/A GLN 100.A N LEU 96.A O no hydrogen 3.164 N/A ILE 101.A N ILE 97.A O no hydrogen 2.961 N/A SER 102.A N ASN 98.A O no hydrogen 3.306 N/A SER 102.A OG GLU 62.A OE1 no hydrogen 3.227 N/A SER 102.A OG ASN 98.A O no hydrogen 3.458 N/A LEU 103.A N SER 99.A O no hydrogen 3.232 N/A LEU 104.A N GLN 100.A O no hydrogen 2.936 N/A ILE 105.A N ILE 101.A O no hydrogen 2.827 N/A GLY 106.A N LEU 103.A O no hydrogen 3.237 N/A LYS 107.A N SER 102.A O no hydrogen 3.217 N/A LYS 107.A NZ GLU 111.A OE1 no hydrogen 3.247 N/A LEU 109.A N SER 102.A OG no hydrogen 3.099 N/A HIS 110.A N GLU 62.A OE2 no hydrogen 3.337 N/A HIS 110.A NE2 THR 60.A O no hydrogen 2.633 N/A GLU 111.A N GLY 108.A O no hydrogen 2.998 N/A PHE 112.A N LEU 109.A O no hydrogen 2.927 N/A ASP 113.A N LEU 109.A O no hydrogen 3.292 N/A SER 114.A N HIS 110.A O no hydrogen 2.799 N/A SER 114.A OG HIS 110.A O no hydrogen 2.724 N/A CYS 116.A N ASP 113.A O no hydrogen 3.092 N/A CYS 116.A SG ASP 113.A O no hydrogen 3.963 N/A CYS 116.A SG SER 114.A O no hydrogen 3.440 N/A GLU 119.A N ASP 117.A OD1 no hydrogen 3.001 N/A ASN 121.A N ASP 117.A O no hydrogen 3.145 N/A ASP 122.A N PRO 118.A O no hydrogen 2.671 N/A PHE 123.A N GLU 119.A O no hydrogen 3.059 N/A ARG 124.A N VAL 120.A O no hydrogen 3.080 N/A ARG 124.A NE GLU 584.A OE1 no hydrogen 2.891 N/A ARG 124.A NH1 ASP 113.A OD1 no hydrogen 3.024 N/A ARG 124.A NH2 GLU 584.A OE1 no hydrogen 3.450 N/A ARG 124.A NH2 GLU 584.A OE2 no hydrogen 3.468 N/A ALA 125.A N ASN 121.A O no hydrogen 3.020 N/A LYS 126.A N ASP 122.A O no hydrogen 3.027 N/A LYS 126.A NZ ASP 541.A OD2 no hydrogen 2.823 N/A MET 127.A N PHE 123.A O no hydrogen 2.772 N/A CYS 128.A N ARG 124.A O no hydrogen 3.040 N/A CYS 128.A SG ARG 124.A O no hydrogen 3.047 N/A CYS 128.A SG GLU 584.A OE2 no hydrogen 3.385 N/A GLN 129.A N ALA 125.A O no hydrogen 3.087 N/A PHE 130.A N LYS 126.A O no hydrogen 3.037 N/A CYS 131.A N MET 127.A O no hydrogen 3.067 N/A CYS 131.A SG MET 127.A O no hydrogen 3.075 N/A CYS 131.A SG ALA 585.A O no hydrogen 3.342 N/A GLU 132.A N CYS 128.A O no hydrogen 2.763 N/A GLU 133.A N GLN 129.A O no hydrogen 2.818 N/A ALA 134.A N PHE 130.A O no hydrogen 3.078 N/A ALA 135.A N CYS 131.A O no hydrogen 2.962 N/A ALA 136.A N GLU 132.A O no hydrogen 3.016 N/A ARG 137.A N GLU 133.A O no hydrogen 2.780 N/A ARG 138.A N ALA 134.A O no hydrogen 2.802 N/A ARG 138.A NH1 GLY 589.A O no hydrogen 2.779 N/A ARG 138.A NH2 LEU 553.A O no hydrogen 3.314 N/A ARG 138.A NH2 GLY 589.A O no hydrogen 2.848 N/A GLN 139.A N ALA 135.A O no hydrogen 2.991 N/A GLN 139.A NE2 ARG 250.A O no hydrogen 3.270 N/A GLN 139.A NE2 HIS 592.A NE2 no hydrogen 3.626 N/A GLN 140.A N ALA 136.A O no hydrogen 3.310 N/A GLN 140.A N ARG 137.A O no hydrogen 3.232 N/A ALA 145.A N GLY 142.A O no hydrogen 2.802 N/A TRP 146.A N GLY 142.A O no hydrogen 3.451 N/A LEU 147.A N TRP 143.A O no hydrogen 2.748 N/A GLN 148.A N GLU 144.A O no hydrogen 3.344 N/A TYR 149.A N ALA 145.A O no hydrogen 2.893 N/A SER 150.A N TRP 146.A O no hydrogen 2.882 N/A SER 150.A OG TRP 146.A O no hydrogen 2.755 N/A PHE 151.A N LEU 147.A O no hydrogen 3.092 N/A GLN 154.A NE2 SER 653.A OG no hydrogen 2.939 N/A GLU 156.A N GLN 222.A O no hydrogen 2.885 N/A LEU 164.A N VAL 181.A O no hydrogen 3.352 N/A VAL 166.A N PHE 179.A O no hydrogen 2.976 N/A ASN 167.A N PRO 236.A O no hydrogen 3.046 N/A ASN 167.A ND2 THR 178.A OG1 no hydrogen 3.233 N/A VAL 168.A N PHE 177.A O no hydrogen 3.111 N/A LYS 169.A NZ SER 173.A O no hydrogen 2.821 N/A SER 173.A OG GLU 175.A O no hydrogen 3.542 N/A PHE 177.A N VAL 168.A O no hydrogen 2.806 N/A PHE 179.A N VAL 166.A O no hydrogen 2.813 N/A VAL 181.A N LEU 164.A O no hydrogen 3.020 N/A SER 182.A N ASP 185.A OD2 no hydrogen 3.112 N/A THR 183.A N ASN 161.A OD1 no hydrogen 3.293 N/A ASP 185.A N SER 182.A O no hydrogen 3.140 N/A MET 191.A N LEU 188.A O no hydrogen 2.816 N/A ALA 194.A N MET 191.A O no hydrogen 2.732 N/A ARG 196.A N ALA 192.A O no hydrogen 2.905 N/A LYS 197.A N CYS 193.A O no hydrogen 2.757 N/A ALA 199.A N LEU 195.A O no hydrogen 3.445 N/A THR 200.A N ARG 196.A O no hydrogen 3.198 N/A TYR 203.A N ASP 202.A OD1 no hydrogen 2.780 N/A THR 204.A N VAL 241.A O no hydrogen 3.383 N/A LEU 205.A N LEU 214.A O no hydrogen 3.372 N/A GLN 206.A N THR 239.A O no hydrogen 3.053 N/A GLN 206.A NE2 TYR 213.A OH no hydrogen 3.220 N/A VAL 207.A N GLU 212.A O no hydrogen 2.796 N/A ASN 208.A N HIS 237.A O no hydrogen 3.254 N/A ARG 210.A N VAL 207.A O no hydrogen 3.271 N/A ARG 210.A NH2 ASP 651.A OD2 no hydrogen 3.224 N/A HIS 211.A N SER 653.A O no hydrogen 2.800 N/A LEU 214.A N LEU 205.A O no hydrogen 2.887 N/A TYR 215.A OH PHE 151.A O no hydrogen 3.172 N/A TYR 218.A N GLY 216.A O no hydrogen 2.806 N/A LEU 220.A N ASP 185.A O no hydrogen 2.858 N/A CYS 221.A N THR 183.A O no hydrogen 3.135 N/A GLN 222.A N PRO 219.A O no hydrogen 3.124 N/A PHE 223.A N LEU 220.A O no hydrogen 3.097 N/A GLN 224.A N GLN 154.A O no hydrogen 3.216 N/A GLN 224.A NE2 LEU 155.A O no hydrogen 3.573 N/A CYS 227.A N PHE 223.A O no hydrogen 2.909 N/A SER 228.A N GLN 224.A O no hydrogen 2.889 N/A SER 228.A OG GLN 224.A O no hydrogen 3.260 N/A SER 228.A OG TYR 225.A O no hydrogen 2.892 N/A CYS 229.A N TYR 225.A O no hydrogen 2.813 N/A CYS 229.A SG TYR 225.A O no hydrogen 3.261 N/A LEU 230.A N ILE 226.A O no hydrogen 2.805 N/A HIS 231.A N CYS 227.A O no hydrogen 3.227 N/A SER 232.A N SER 228.A O no hydrogen 2.844 N/A GLY 233.A N LEU 230.A O no hydrogen 3.164 N/A HIS 237.A N TYR 225.A OH no hydrogen 2.881 N/A HIS 237.A ND1 THR 235.A O no hydrogen 2.739 N/A LEU 238.A N ASN 167.A O no hydrogen 3.213 N/A THR 239.A OG1 ASN 208.A OD1 no hydrogen 2.656 N/A MET 240.A N LYS 169.A O no hydrogen 3.114 N/A VAL 241.A N THR 204.A O no hydrogen 3.376 N/A HIS 242.A ND1 SER 244.A OG no hydrogen 2.793 N/A SER 243.A OG ASP 202.A OD1 no hydrogen 2.722 N/A SER 244.A N HIS 242.A ND1 no hydrogen 3.100 N/A SER 244.A OG HIS 242.A ND1 no hydrogen 2.793 N/A SER 245.A N HIS 242.A O no hydrogen 3.045 N/A ILE 246.A N HIS 242.A O no hydrogen 3.318 N/A LEU 247.A N SER 243.A O no hydrogen 3.016 N/A ALA 248.A N SER 244.A O no hydrogen 3.166 N/A MET 249.A N SER 245.A O no hydrogen 3.345 N/A MET 249.A SD TYR 213.A OH no hydrogen 3.743 N/A ARG 250.A N ILE 246.A O no hydrogen 2.832 N/A ARG 250.A NE ASP 251.A OD1 no hydrogen 2.914 N/A ARG 250.A NH1 LEU 141.A O no hydrogen 2.980 N/A ARG 250.A NH2 ASP 251.A OD1 no hydrogen 3.355 N/A ASP 251.A N LEU 247.A O no hydrogen 3.125 N/A SER 254.A OG LEU 252.A O no hydrogen 2.814 N/A PHE 259.A N ILE 315.A O no hydrogen 2.896 N/A ILE 261.A N LEU 311.A O no hydrogen 2.781 N/A GLU 262.A N CYS 399.A O no hydrogen 2.999 N/A LEU 263.A N GLN 309.A O no hydrogen 2.910 N/A ILE 264.A N LEU 397.A O no hydrogen 3.055 N/A GLN 265.A N LEU 397.A O no hydrogen 3.162 N/A GLY 266.A N PRO 305.A O no hydrogen 2.795 N/A SER 267.A N ALA 395.A O no hydrogen 2.876 N/A LYS 268.A N GLU 304.A OE2 no hydrogen 3.263 N/A LYS 268.A NZ ASP 391.A O no hydrogen 2.929 N/A VAL 269.A N SER 303.A O no hydrogen 2.946 N/A ARG 274.A N ASP 272.A OD1 no hydrogen 3.406 N/A MET 275.A N ASP 272.A O no hydrogen 3.127 N/A LYS 276.A N VAL 333.A O no hydrogen 2.897 N/A LEU 277.A N VAL 299.A O no hydrogen 2.762 N/A VAL 278.A N TYR 331.A O no hydrogen 2.798 N/A VAL 279.A N SER 296.A OG no hydrogen 2.829 N/A GLN 280.A N ALA 329.A O no hydrogen 2.854 N/A ALA 281.A N VAL 294.A O no hydrogen 3.031 N/A GLY 282.A N CYS 327.A O no hydrogen 3.066 N/A PHE 284.A N ARG 325.A O no hydrogen 2.923 N/A HIS 285.A N GLU 288.A O no hydrogen 2.992 N/A LEU 290.A N LEU 283.A O no hydrogen 2.980 N/A CYS 291.A SG LYS 292.A O no hydrogen 3.804 N/A SER 296.A N VAL 279.A O no hydrogen 3.174 N/A SER 296.A OG VAL 279.A O no hydrogen 3.506 N/A SER 296.A OG SER 297.A O no hydrogen 3.243 N/A SER 297.A N GLN 309.A OE1 no hydrogen 2.988 N/A SER 297.A OG GLU 298.A O no hydrogen 3.360 N/A SER 297.A OG GLN 309.A OE1 no hydrogen 3.415 N/A VAL 299.A N LEU 277.A O no hydrogen 3.338 N/A CYS 302.A SG SER 300.A O no hydrogen 3.478 N/A SER 303.A OG GLU 304.A OE2 no hydrogen 2.720 N/A TRP 307.A N ILE 264.A O no hydrogen 2.776 N/A TRP 307.A NE1 SER 297.A O no hydrogen 3.164 N/A LYS 308.A N ILE 264.A O no hydrogen 2.805 N/A GLN 309.A N LEU 263.A O no hydrogen 2.956 N/A LEU 311.A N ILE 261.A O no hydrogen 2.717 N/A PHE 313.A N PHE 259.A O no hydrogen 2.981 N/A ILE 315.A N PHE 313.A O no hydrogen 2.741 N/A CYS 318.A N LEU 255.A O no hydrogen 3.096 N/A CYS 318.A SG LEU 255.A O no hydrogen 3.326 N/A CYS 318.A SG ASN 316.A O no hydrogen 3.610 N/A ASP 319.A N ASN 316.A O no hydrogen 2.710 N/A LEU 320.A N ILE 317.A O no hydrogen 3.365 N/A ARG 322.A NE ASP 355.A OD1 no hydrogen 2.733 N/A ARG 322.A NH1 ARG 322.A O no hydrogen 3.306 N/A ARG 322.A NH1 TYR 539.A OH no hydrogen 2.758 N/A ARG 322.A NH2 ASP 355.A OD1 no hydrogen 2.898 N/A ALA 324.A N PRO 321.A O no hydrogen 3.215 N/A ARG 325.A N PHE 284.A O no hydrogen 2.893 N/A ARG 325.A NH1 GLY 382.A O no hydrogen 2.777 N/A LEU 326.A N LEU 348.A O no hydrogen 2.702 N/A CYS 327.A N GLY 282.A O no hydrogen 2.985 N/A CYS 327.A SG ARG 325.A O no hydrogen 3.808 N/A PHE 328.A N ALA 346.A O no hydrogen 2.771 N/A ALA 329.A N GLN 280.A O no hydrogen 3.077 N/A LEU 330.A N ALA 344.A O no hydrogen 2.805 N/A TYR 331.A N VAL 278.A O no hydrogen 2.766 N/A TYR 331.A OH LEU 377.A O no hydrogen 3.094 N/A ALA 332.A N CYS 341.A O no hydrogen 2.913 N/A VAL 333.A N LYS 276.A O no hydrogen 2.795 N/A CYS 341.A N ALA 332.A O no hydrogen 3.392 N/A ILE 343.A N LEU 330.A O no hydrogen 2.809 N/A ALA 344.A N LEU 330.A O no hydrogen 3.437 N/A TRP 345.A N TRP 367.A O no hydrogen 2.777 N/A ALA 346.A N PHE 328.A O no hydrogen 2.892 N/A ASN 347.A ND2 ASN 379.A O no hydrogen 2.781 N/A ASN 347.A ND2 GLY 382.A O no hydrogen 2.975 N/A ASN 347.A ND2 THR 383.A O no hydrogen 3.699 N/A LEU 348.A N LEU 326.A O no hydrogen 2.707 N/A LEU 350.A N ALA 324.A O no hydrogen 2.941 N/A ASP 352.A N GLN 356.A O no hydrogen 2.798 N/A TYR 353.A OH ASP 122.A OD2 no hydrogen 2.595 N/A LYS 354.A N ASP 352.A OD1 no hydrogen 2.979 N/A ASP 355.A N ASP 352.A O no hydrogen 3.308 N/A GLN 356.A N ASP 352.A OD1 no hydrogen 2.883 N/A LEU 357.A N VAL 408.A O no hydrogen 2.929 N/A LYS 358.A N LEU 350.A O no hydrogen 3.073 N/A LYS 358.A NZ MET 349.A O no hydrogen 2.807 N/A GLY 360.A N LEU 400.A O no hydrogen 2.692 N/A ARG 362.A N ILE 398.A O no hydrogen 2.757 N/A ARG 362.A NH2 THR 359.A O no hydrogen 2.989 N/A LEU 364.A N LEU 396.A O no hydrogen 2.911 N/A MET 366.A N ALA 394.A O no hydrogen 2.867 N/A TRP 367.A N TRP 345.A O no hydrogen 2.906 N/A TRP 367.A NE1 ARG 385.A O no hydrogen 3.148 N/A SER 369.A N ILE 343.A O no hydrogen 3.001 N/A GLY 382.A N ASN 379.A O no hydrogen 3.051 N/A ARG 385.A NH1 GLU 119.A OE1 no hydrogen 3.156 N/A ARG 385.A NH1 SER 538.A O no hydrogen 3.482 N/A ARG 385.A NH2 GLU 119.A OE1 no hydrogen 3.156 N/A ASN 387.A N TYR 365.A O no hydrogen 2.979 N/A ASN 387.A ND2 MET 366.A O no hydrogen 3.080 N/A ASN 389.A N ASN 387.A OD1 no hydrogen 3.216 N/A SER 392.A N ASN 389.A OD1 no hydrogen 3.125 N/A ALA 393.A N ASN 389.A O no hydrogen 3.135 N/A ALA 395.A N SER 267.A O no hydrogen 3.374 N/A LEU 396.A N LEU 364.A O no hydrogen 3.146 N/A LEU 397.A N GLN 265.A O no hydrogen 2.726 N/A ILE 398.A N ARG 362.A O no hydrogen 2.912 N/A CYS 399.A N GLU 262.A O no hydrogen 3.019 N/A CYS 399.A SG LEU 400.A O no hydrogen 3.770 N/A LEU 400.A N GLY 360.A O no hydrogen 2.820 N/A TYR 410.A N ASP 355.A O no hydrogen 2.804 N/A ILE 416.A N ALA 412.A O no hydrogen 3.077 N/A ILE 416.A N LEU 413.A O no hydrogen 3.190 N/A LEU 417.A N LEU 413.A O no hydrogen 2.771 N/A GLU 418.A N GLU 414.A O no hydrogen 3.149 N/A GLY 420.A N ILE 416.A O no hydrogen 2.980 N/A ARG 421.A N GLU 418.A O no hydrogen 3.400 N/A GLN 427.A N THR 423.A O no hydrogen 2.877 N/A GLU 432.A N LEU 428.A O no hydrogen 2.888 N/A LEU 434.A N LEU 430.A O no hydrogen 2.826 N/A TYR 439.A N GLU 442.A OE1 no hydrogen 3.260 N/A LYS 443.A N TYR 439.A O no hydrogen 2.816 N/A LYS 443.A NZ GLU 440.A OE2 no hydrogen 3.469 N/A ASP 444.A N GLU 440.A O no hydrogen 3.481 N/A VAL 446.A N GLU 442.A O no hydrogen 3.093 N/A TRP 447.A N LYS 443.A O no hydrogen 2.995 N/A LYS 448.A N ASP 444.A O no hydrogen 2.970 N/A LEU 449.A N LEU 445.A O no hydrogen 3.142 N/A ARG 450.A N TRP 447.A O no hydrogen 3.395 N/A ARG 450.A NH1 TRP 447.A O no hydrogen 2.766 N/A GLU 452.A N LEU 449.A O no hydrogen 2.989 N/A VAL 453.A N LEU 449.A O no hydrogen 3.078 N/A GLN 454.A N ARG 450.A O no hydrogen 3.135 N/A GLN 454.A NE2 SER 485.A OG no hydrogen 3.413 N/A GLU 455.A N HIS 451.A O no hydrogen 3.080 N/A HIS 456.A N GLU 452.A O no hydrogen 2.772 N/A PHE 457.A N VAL 453.A O no hydrogen 2.762 N/A ALA 460.A N PHE 457.A O no hydrogen 2.872 N/A LEU 461.A N PRO 458.A O no hydrogen 3.347 N/A LEU 464.A N ALA 460.A O no hydrogen 3.011 N/A LEU 465.A N LEU 461.A O no hydrogen 2.910 N/A LEU 466.A N ALA 462.A O no hydrogen 3.241 N/A VAL 467.A N ARG 463.A O no hydrogen 3.297 N/A VAL 467.A N LEU 464.A O no hydrogen 3.317 N/A THR 468.A OG1 LEU 464.A O no hydrogen 2.748 N/A THR 468.A OG1 LEU 465.A O no hydrogen 3.459 N/A TRP 470.A NE1 LEU 465.A O no hydrogen 2.779 N/A ASN 471.A ND2 LEU 290.A O no hydrogen 2.979 N/A LYS 472.A N LYS 469.A O no hydrogen 3.376 N/A HIS 473.A ND1 ASP 319.A OD1 no hydrogen 3.130 N/A VAL 476.A N LYS 472.A O no hydrogen 3.130 N/A ALA 477.A N HIS 473.A O no hydrogen 3.011 N/A GLN 478.A N GLU 474.A O no hydrogen 3.190 N/A MET 479.A N ASP 475.A O no hydrogen 3.120 N/A LEU 480.A N VAL 476.A O no hydrogen 2.907 N/A TYR 481.A N ALA 477.A O no hydrogen 2.986 N/A LEU 482.A N GLN 478.A O no hydrogen 3.314 N/A LEU 483.A N MET 479.A O no hydrogen 2.826 N/A CYS 484.A N LEU 480.A O no hydrogen 3.088 N/A CYS 484.A SG LEU 480.A O no hydrogen 3.205 N/A SER 485.A N LEU 482.A O no hydrogen 3.233 N/A SER 485.A OG TYR 481.A O no hydrogen 2.952 N/A SER 485.A OG LEU 482.A O no hydrogen 3.201 N/A TRP 486.A N LEU 483.A O no hydrogen 3.124 N/A TRP 486.A NE1 PRO 458.A O no hydrogen 2.891 N/A LEU 489.A N SER 514.A OG no hydrogen 3.122 N/A ALA 494.A N PRO 490.A O no hydrogen 3.137 N/A LEU 495.A N VAL 491.A O no hydrogen 2.955 N/A LEU 497.A N ALA 494.A O no hydrogen 2.994 N/A LEU 498.A N LEU 495.A O no hydrogen 3.360 N/A PHE 502.A N ASP 499.A O no hydrogen 3.068 N/A CYS 505.A SG HIS 506.A ND1 no hydrogen 3.995 N/A HIS 506.A N ASP 504.A OD1 no hydrogen 3.125 N/A HIS 506.A ND1 ASP 504.A OD1 no hydrogen 3.033 N/A VAL 507.A N ASP 504.A O no hydrogen 2.936 N/A GLY 508.A N ASP 504.A O no hydrogen 3.179 N/A SER 509.A N CYS 505.A O no hydrogen 3.119 N/A SER 509.A OG GLU 543.A OE1 no hydrogen 3.025 N/A PHE 510.A N HIS 506.A O no hydrogen 3.156 N/A ALA 511.A N VAL 507.A O no hydrogen 2.917 N/A ILE 512.A N GLY 508.A O no hydrogen 2.998 N/A LYS 513.A N SER 509.A O no hydrogen 3.142 N/A SER 514.A N PHE 510.A O no hydrogen 3.076 N/A SER 514.A OG LEU 489.A O no hydrogen 3.136 N/A LEU 515.A N ALA 511.A O no hydrogen 3.124 N/A ARG 516.A N LYS 513.A O no hydrogen 3.421 N/A LYS 517.A NZ LEU 489.A O no hydrogen 2.730 N/A LYS 517.A NZ SER 514.A O no hydrogen 2.793 N/A LEU 518.A N LEU 515.A O no hydrogen 3.341 N/A LEU 523.A N THR 519.A O no hydrogen 3.034 N/A PHE 524.A N ASP 520.A O no hydrogen 3.029 N/A GLN 525.A N GLU 522.A O no hydrogen 3.220 N/A TYR 526.A N LEU 523.A O no hydrogen 2.893 N/A TYR 526.A OH GLU 522.A OE2 no hydrogen 3.102 N/A GLN 529.A NE2 GLN 703.A OE1 no hydrogen 3.207 N/A LEU 530.A N TYR 526.A O no hydrogen 2.975 N/A VAL 531.A N LEU 527.A O no hydrogen 2.871 N/A GLN 532.A N LEU 528.A O no hydrogen 3.226 N/A GLN 532.A NE2 GLU 569.A OE1 no hydrogen 3.315 N/A VAL 533.A N GLN 529.A O no hydrogen 3.052 N/A LEU 534.A N VAL 531.A O no hydrogen 2.999 N/A LYS 535.A N GLN 532.A O no hydrogen 3.105 N/A LYS 535.A NZ GLN 532.A OE1 no hydrogen 3.331 N/A LYS 535.A NZ GLU 569.A OE1 no hydrogen 3.110 N/A LYS 535.A NZ GLU 569.A OE2 no hydrogen 3.298 N/A TYR 536.A N VAL 533.A O no hydrogen 2.976 N/A GLU 537.A N LEU 534.A O no hydrogen 3.243 N/A TYR 539.A OH PHE 351.A O no hydrogen 2.715 N/A LEU 540.A N GLU 119.A OE2 no hydrogen 3.295 N/A CYS 542.A SG GLU 537.A OE2 no hydrogen 3.156 N/A CYS 542.A SG LEU 540.A O no hydrogen 3.999 N/A CYS 542.A SG THR 545.A OG1 no hydrogen 3.097 N/A LYS 546.A N CYS 542.A O no hydrogen 3.309 N/A PHE 547.A N GLU 543.A O no hydrogen 2.907 N/A LEU 548.A N LEU 544.A O no hydrogen 2.868 N/A LEU 549.A N THR 545.A O no hydrogen 2.891 N/A ASP 550.A N LYS 546.A O no hydrogen 2.788 N/A ARG 551.A N PHE 547.A O no hydrogen 3.090 N/A ARG 551.A NH1 LEU 518.A O no hydrogen 2.959 N/A ARG 551.A NH1 ASP 520.A OD1 no hydrogen 3.098 N/A ARG 551.A NH2 LEU 518.A O no hydrogen 2.666 N/A ALA 552.A N LEU 548.A O no hydrogen 3.153 N/A LEU 553.A N LEU 549.A O no hydrogen 3.055 N/A ALA 554.A N ASP 550.A O no hydrogen 3.069 N/A ASN 555.A N ARG 551.A O no hydrogen 2.929 N/A ASN 555.A ND2 ASP 520.A OD2 no hydrogen 2.772 N/A ARG 556.A N TYR 149.A O no hydrogen 2.800 N/A ARG 556.A NE SER 150.A O no hydrogen 3.333 N/A ARG 556.A NH2 GLN 647.A OE1 no hydrogen 3.059 N/A ILE 558.A N ASN 555.A OD1 no hydrogen 3.147 N/A GLY 559.A N ASN 555.A O no hydrogen 3.161 N/A HIS 560.A N ARG 556.A O no hydrogen 2.833 N/A HIS 560.A NE2 PRO 649.A O no hydrogen 2.648 N/A PHE 561.A N LYS 557.A O no hydrogen 3.128 N/A LEU 562.A N ILE 558.A O no hydrogen 2.765 N/A PHE 563.A N GLY 559.A O no hydrogen 2.886 N/A TRP 564.A N HIS 560.A O no hydrogen 3.143 N/A TRP 564.A NE1 GLN 600.A OE1 no hydrogen 3.105 N/A HIS 565.A N PHE 561.A O no hydrogen 2.818 N/A LEU 566.A N LEU 562.A O no hydrogen 3.066 N/A ARG 567.A N PHE 563.A O no hydrogen 2.804 N/A ARG 567.A NE LEU 104.A O no hydrogen 2.720 N/A ARG 567.A NH1 ARG 567.A O no hydrogen 3.353 N/A SER 568.A N TRP 564.A O no hydrogen 2.988 N/A SER 568.A OG TRP 564.A O no hydrogen 3.351 N/A SER 568.A OG HIS 565.A O no hydrogen 3.290 N/A GLU 569.A N LEU 566.A O no hydrogen 3.222 N/A MET 570.A N ARG 567.A O no hydrogen 2.971 N/A HIS 571.A NE2 SER 568.A O no hydrogen 2.832 N/A VAL 572.A N GLU 569.A O no hydrogen 3.100 N/A VAL 575.A N VAL 572.A O no hydrogen 3.096 N/A ALA 576.A N VAL 572.A O no hydrogen 2.999 N/A ARG 578.A NH1 TYR 539.A O no hydrogen 3.185 N/A ARG 578.A NH1 LEU 540.A O no hydrogen 3.309 N/A ARG 578.A NH2 TYR 539.A O no hydrogen 2.809 N/A PHE 579.A N VAL 575.A O no hydrogen 2.850 N/A GLY 580.A N ALA 576.A O no hydrogen 2.918 N/A LEU 581.A N LEU 577.A O no hydrogen 2.919 N/A ILE 582.A N ARG 578.A O no hydrogen 3.226 N/A LEU 583.A N PHE 579.A O no hydrogen 2.984 N/A GLU 584.A N GLY 580.A O no hydrogen 3.122 N/A ALA 585.A N LEU 581.A O no hydrogen 3.467 N/A TYR 586.A N ILE 582.A O no hydrogen 2.808 N/A CYS 587.A N LEU 583.A O no hydrogen 2.976 N/A CYS 587.A SG LEU 583.A O no hydrogen 3.031 N/A ARG 588.A N GLU 584.A O no hydrogen 2.814 N/A ARG 588.A NE GLU 584.A OE2 no hydrogen 2.983 N/A ARG 588.A NH1 ASN 98.A OD1 no hydrogen 2.941 N/A ARG 588.A NH2 GLU 584.A OE2 no hydrogen 2.819 N/A GLY 589.A N ALA 585.A O no hydrogen 3.240 N/A GLY 589.A N TYR 586.A O no hydrogen 3.222 N/A SER 590.A N CYS 587.A O no hydrogen 2.915 N/A SER 590.A OG TYR 586.A O no hydrogen 3.216 N/A HIS 593.A NE2 HIS 560.A ND1 no hydrogen 3.344 N/A MET 594.A N SER 590.A O no hydrogen 2.861 N/A LYS 595.A N HIS 592.A O no hydrogen 2.852 N/A LEU 597.A N HIS 593.A O no hydrogen 2.932 N/A MET 598.A N MET 594.A O no hydrogen 3.139 N/A LYS 599.A N LYS 595.A O no hydrogen 3.258 N/A GLN 600.A N VAL 596.A O no hydrogen 3.051 N/A GLN 600.A NE2 GLN 647.A O no hydrogen 2.812 N/A GLY 601.A N LEU 597.A O no hydrogen 3.001 N/A GLU 602.A N MET 598.A O no hydrogen 3.229 N/A ALA 603.A N LYS 599.A O no hydrogen 3.258 N/A LEU 604.A N GLN 600.A O no hydrogen 2.960 N/A SER 605.A N GLY 601.A O no hydrogen 3.039 N/A LYS 606.A N GLU 602.A O no hydrogen 3.085 N/A LEU 607.A N ALA 603.A O no hydrogen 2.968 N/A LYS 608.A N LEU 604.A O no hydrogen 3.095 N/A LYS 608.A NZ ASP 612.A OD1 no hydrogen 3.428 N/A LYS 608.A NZ ASP 612.A OD2 no hydrogen 2.871 N/A ALA 609.A N SER 605.A O no hydrogen 3.293 N/A LEU 610.A N LYS 606.A O no hydrogen 2.729 N/A ASN 611.A N LEU 607.A O no hydrogen 2.683 N/A ASP 612.A N LYS 608.A O no hydrogen 2.915 N/A PHE 613.A N ALA 609.A O no hydrogen 3.200 N/A VAL 614.A N LEU 610.A O no hydrogen 3.154 N/A LYS 615.A N ASN 611.A O no hydrogen 2.792 N/A LEU 616.A N ASP 612.A O no hydrogen 3.223 N/A SER 617.A N PHE 613.A O no hydrogen 2.735 N/A SER 617.A OG THR 626.A OG1 no hydrogen 2.849 N/A SER 618.A OG VAL 614.A O no hydrogen 2.720 N/A GLN 619.A N LEU 616.A O no hydrogen 2.833 N/A GLN 625.A N PRO 622.A O no hydrogen 3.122 N/A THR 626.A N PRO 622.A O no hydrogen 3.128 N/A THR 626.A OG1 SER 617.A O no hydrogen 2.718 N/A THR 626.A OG1 SER 617.A OG no hydrogen 2.849 N/A THR 626.A OG1 PRO 622.A O no hydrogen 3.395 N/A LYS 627.A N LYS 623.A O no hydrogen 2.885 N/A GLU 628.A N PRO 624.A O no hydrogen 3.246 N/A LEU 629.A N GLN 625.A O no hydrogen 2.776 N/A MET 630.A N LYS 627.A O no hydrogen 3.297 N/A HIS 631.A N LYS 627.A O no hydrogen 3.112 N/A HIS 631.A NE2 CYS 664.A O no hydrogen 2.724 N/A CYS 633.A SG GLN 636.A OE1 no hydrogen 3.822 N/A MET 634.A N MET 630.A O no hydrogen 3.017 N/A ARG 635.A N HIS 631.A O no hydrogen 3.198 N/A TYR 639.A OH LYS 606.A O no hydrogen 3.296 N/A LEU 640.A N GLN 636.A O no hydrogen 2.887 N/A GLU 641.A N GLU 637.A O no hydrogen 2.931 N/A ALA 642.A N ALA 638.A O no hydrogen 3.002 N/A LEU 643.A N TYR 639.A O no hydrogen 3.059 N/A SER 644.A N GLU 641.A O no hydrogen 3.336 N/A SER 644.A OG LEU 640.A O no hydrogen 3.092 N/A HIS 645.A N ALA 657.A O no hydrogen 2.764 N/A LEU 646.A N LEU 656.A O no hydrogen 2.772 N/A SER 648.A N THR 654.A O no hydrogen 2.870 N/A LEU 650.A N SER 648.A OG no hydrogen 3.182 N/A SER 653.A N ASP 651.A OD1 no hydrogen 2.997 N/A SER 653.A OG ASP 651.A OD1 no hydrogen 2.685 N/A THR 654.A N ASP 651.A O no hydrogen 3.092 N/A THR 654.A OG1 ASP 651.A OD2 no hydrogen 3.470 N/A LEU 656.A N LEU 646.A O no hydrogen 2.849 N/A CYS 660.A N MET 677.A O no hydrogen 2.828 N/A CYS 660.A SG GLU 658.A O no hydrogen 3.719 N/A CYS 660.A SG SER 679.A OG no hydrogen 3.376 N/A GLN 663.A N CYS 660.A O no hydrogen 2.921 N/A CYS 664.A N CYS 660.A O no hydrogen 3.086 N/A CYS 664.A SG CYS 660.A O no hydrogen 3.346 N/A CYS 664.A SG MET 677.A O no hydrogen 4.005 N/A THR 665.A N TRP 675.A O no hydrogen 2.878 N/A MET 667.A N PRO 673.A O no hydrogen 2.975 N/A LYS 672.A N SER 669.A O no hydrogen 3.313 N/A LEU 674.A N PHE 689.A O no hydrogen 2.934 N/A TRP 675.A N THR 665.A O no hydrogen 2.778 N/A ILE 676.A N ILE 687.A O no hydrogen 2.940 N/A TYR 678.A N VAL 685.A O no hydrogen 2.784 N/A TYR 678.A OH LEU 643.A O no hydrogen 3.075 N/A SER 679.A N GLU 658.A O no hydrogen 2.977 N/A SER 679.A OG GLU 658.A O no hydrogen 3.353 N/A SER 684.A OG TYR 678.A O no hydrogen 3.499 N/A VAL 685.A N TYR 678.A O no hydrogen 3.332 N/A ILE 687.A N ILE 676.A O no hydrogen 2.810 N/A ILE 688.A N ILE 736.A O no hydrogen 2.767 N/A PHE 689.A N LEU 674.A O no hydrogen 2.910 N/A LYS 690.A N GLY 734.A O no hydrogen 3.128 N/A LYS 690.A NZ ASP 813.A OD1 no hydrogen 3.377 N/A ASN 691.A ND2 THR 733.A OG1 no hydrogen 3.213 N/A GLY 692.A N ARG 732.A O no hydrogen 2.788 N/A ARG 696.A NE ASP 694.A OD1 no hydrogen 2.801 N/A ARG 696.A NE ASP 694.A OD2 no hydrogen 3.516 N/A ARG 696.A NH1 ALA 881.A O no hydrogen 2.792 N/A MET 699.A N LEU 695.A O no hydrogen 2.870 N/A LEU 700.A N ARG 696.A O no hydrogen 2.879 N/A THR 701.A N GLN 697.A O no hydrogen 3.071 N/A THR 701.A OG1 GLN 697.A O no hydrogen 3.139 N/A LEU 702.A N ASP 698.A O no hydrogen 2.966 N/A GLN 703.A N MET 699.A O no hydrogen 2.922 N/A GLN 703.A NE2 GLN 529.A OE1 no hydrogen 3.497 N/A MET 704.A N LEU 700.A O no hydrogen 2.972 N/A ILE 705.A N THR 701.A O no hydrogen 3.095 N/A GLN 706.A N LEU 702.A O no hydrogen 2.982 N/A LEU 707.A N GLN 703.A O no hydrogen 2.853 N/A MET 708.A N MET 704.A O no hydrogen 2.855 N/A ASP 709.A N ILE 705.A O no hydrogen 2.806 N/A VAL 710.A N GLN 706.A O no hydrogen 2.918 N/A LEU 711.A N LEU 707.A O no hydrogen 2.835 N/A TRP 712.A N MET 708.A O no hydrogen 2.768 N/A TRP 712.A NE1 ALA 860.A O no hydrogen 2.861 N/A LYS 713.A N ASP 709.A O no hydrogen 2.768 N/A LYS 713.A NZ GLU 156.A OE1 no hydrogen 3.237 N/A GLN 714.A N VAL 710.A O no hydrogen 2.814 N/A GLU 715.A N TRP 712.A O no hydrogen 2.899 N/A LEU 717.A N TRP 712.A O no hydrogen 3.255 N/A ARG 720.A N ASP 718.A OD1 no hydrogen 2.997 N/A ARG 720.A NE GLU 776.A OE2 no hydrogen 3.188 N/A ARG 720.A NH1 ASP 718.A OD1 no hydrogen 3.269 N/A ARG 720.A NH1 ASP 718.A OD2 no hydrogen 3.098 N/A THR 722.A N TYR 784.A OH no hydrogen 2.930 N/A TYR 724.A N THR 722.A O no hydrogen 2.781 N/A TYR 724.A OH HIS 811.A O no hydrogen 3.166 N/A GLY 725.A N GLU 737.A OE1 no hydrogen 3.118 N/A LEU 727.A N LEU 735.A O no hydrogen 2.793 N/A THR 729.A N THR 733.A O no hydrogen 3.038 N/A GLY 730.A N THR 733.A O no hydrogen 3.180 N/A THR 733.A N GLY 730.A O no hydrogen 3.336 N/A THR 733.A OG1 ASP 731.A O no hydrogen 2.696 N/A GLY 734.A N LYS 690.A O no hydrogen 2.975 N/A LEU 735.A N LEU 727.A O no hydrogen 3.127 N/A ILE 736.A N ILE 688.A O no hydrogen 3.063 N/A GLU 737.A N GLY 725.A O no hydrogen 2.801 N/A VAL 738.A N GLY 686.A O no hydrogen 3.223 N/A SER 742.A OG VAL 739.A O no hydrogen 3.030 N/A ASP 743.A N ILE 803.A O no hydrogen 2.833 N/A ILE 745.A N ILE 801.A O no hydrogen 2.986 N/A ALA 746.A N SER 798.A O no hydrogen 2.956 N/A ASN 747.A ND2 ASP 743.A OD1 no hydrogen 3.443 N/A ILE 748.A N THR 744.A O no hydrogen 3.139 N/A GLN 749.A N ILE 745.A O no hydrogen 3.054 N/A ASN 759.A N ASP 755.A O no hydrogen 2.741 N/A TRP 760.A N ALA 756.A O no hydrogen 3.318 N/A LEU 761.A N LEU 757.A O no hydrogen 2.835 N/A LYS 762.A N LEU 758.A O no hydrogen 2.829 N/A SER 763.A N ASN 759.A O no hydrogen 2.808 N/A SER 763.A OG TRP 760.A O no hydrogen 3.204 N/A LYS 764.A N LEU 761.A O no hydrogen 3.310 N/A ASN 765.A N LYS 762.A O no hydrogen 3.174 N/A ASN 765.A ND2 GLU 805.A O no hydrogen 2.755 N/A ALA 769.A N PRO 766.A O no hydrogen 3.381 N/A ARG 772.A N ALA 769.A O no hydrogen 3.235 N/A ALA 773.A N ALA 769.A O no hydrogen 3.167 N/A ILE 774.A N LEU 770.A O no hydrogen 3.279 N/A GLU 776.A N ARG 772.A O no hydrogen 3.036 N/A PHE 777.A N ALA 773.A O no hydrogen 2.864 N/A THR 778.A N ILE 774.A O no hydrogen 2.885 N/A THR 778.A OG1 ILE 774.A O no hydrogen 3.015 N/A LEU 779.A N GLU 775.A O no hydrogen 3.020 N/A SER 780.A N GLU 776.A O no hydrogen 2.993 N/A SER 780.A OG GLU 776.A O no hydrogen 2.664 N/A SER 780.A OG PHE 777.A O no hydrogen 3.481 N/A CYS 781.A N PHE 777.A O no hydrogen 2.828 N/A ALA 782.A N THR 778.A O no hydrogen 3.222 N/A GLY 783.A N LEU 779.A O no hydrogen 3.462 N/A TYR 784.A N SER 780.A O no hydrogen 3.109 N/A CYS 785.A N CYS 781.A O no hydrogen 2.796 N/A CYS 785.A N ALA 782.A O no hydrogen 3.091 N/A CYS 785.A SG CYS 781.A O no hydrogen 3.238 N/A CYS 785.A SG ILE 830.A O no hydrogen 3.676 N/A VAL 786.A N ALA 782.A O no hydrogen 2.933 N/A ALA 787.A N GLY 783.A O no hydrogen 2.896 N/A THR 788.A N TYR 784.A O no hydrogen 3.199 N/A THR 788.A OG1 TYR 784.A O no hydrogen 2.576 N/A THR 788.A OG1 CYS 785.A O no hydrogen 3.551 N/A TYR 789.A N CYS 785.A O no hydrogen 3.239 N/A VAL 790.A N VAL 786.A O no hydrogen 2.915 N/A LEU 791.A N ALA 787.A O no hydrogen 2.947 N/A GLY 792.A N TYR 789.A O no hydrogen 3.308 N/A ILE 793.A N THR 788.A O no hydrogen 2.791 N/A ARG 796.A NE HIS 811.A ND1 no hydrogen 3.008 N/A ARG 796.A NH2 HIS 811.A ND1 no hydrogen 3.481 N/A ARG 796.A NH2 ILE 812.A O no hydrogen 2.873 N/A HIS 797.A N ASP 795.A O no hydrogen 3.213 N/A HIS 797.A N ASN 800.A OD1 no hydrogen 2.963 N/A ASP 799.A N HIS 797.A ND1 no hydrogen 3.127 N/A ASN 800.A ND2 ASP 795.A O no hydrogen 2.757 N/A MET 802.A N PHE 810.A O no hydrogen 2.782 N/A ILE 803.A N ASP 743.A O no hydrogen 2.755 N/A ARG 804.A N GLN 808.A O no hydrogen 2.807 N/A ARG 804.A NH1 THR 722.A OG1 no hydrogen 2.809 N/A GLU 805.A N ARG 741.A O no hydrogen 2.813 N/A SER 806.A OG GLU 776.A OE1 no hydrogen 3.461 N/A SER 806.A OG GLN 808.A OE1 no hydrogen 2.822 N/A GLY 807.A N ARG 804.A O no hydrogen 2.805 N/A GLN 808.A NE2 ARG 720.A O no hydrogen 3.622 N/A LEU 809.A N SER 780.A OG no hydrogen 2.784 N/A PHE 810.A N MET 802.A O no hydrogen 2.785 N/A ILE 812.A N ASN 800.A O no hydrogen 3.018 N/A PHE 814.A N ASP 698.A OD2 no hydrogen 3.293 N/A PHE 817.A N GLU 885.A OE1 no hydrogen 2.761 N/A LEU 818.A N LEU 791.A O no hydrogen 2.723 N/A GLY 819.A N GLY 792.A O no hydrogen 3.046 N/A ASN 820.A N PHE 817.A O no hydrogen 3.198 N/A GLU 825.A N GLY 819.A O no hydrogen 3.185 N/A VAL 827.A N TYR 894.A OH no hydrogen 3.262 N/A PHE 835.A N THR 832.A O no hydrogen 2.805 N/A VAL 836.A N THR 832.A O no hydrogen 2.936 N/A HIS 837.A N TYR 833.A O no hydrogen 2.874 N/A HIS 837.A NE2 ASP 755.A OD1 no hydrogen 2.977 N/A ILE 839.A N PHE 835.A O no hydrogen 2.982 N/A GLN 840.A N VAL 836.A O no hydrogen 3.067 N/A GLN 840.A NE2 ASN 846.A O no hydrogen 3.659 N/A GLN 841.A N VAL 838.A O no hydrogen 3.099 N/A GLY 842.A N HIS 837.A O no hydrogen 3.212 N/A LYS 843.A N GLN 840.A O no hydrogen 3.377 N/A ASN 846.A ND2 GLN 840.A O no hydrogen 2.926 N/A PHE 850.A N ASN 846.A O no hydrogen 3.120 N/A GLU 851.A N SER 847.A O no hydrogen 2.875 N/A ARG 852.A N LYS 849.A O no hydrogen 2.778 N/A ARG 852.A NE TYR 856.A OH no hydrogen 3.354 N/A PHE 853.A N LYS 849.A O no hydrogen 3.157 N/A ARG 854.A N PHE 850.A O no hydrogen 3.017 N/A ARG 854.A NE GLU 851.A OE1 no hydrogen 3.021 N/A ARG 854.A NH1 ASN 917.A OD1 no hydrogen 2.904 N/A ARG 854.A NH2 GLU 851.A OE2 no hydrogen 3.370 N/A GLY 855.A N GLU 851.A O no hydrogen 3.093 N/A TYR 856.A N ARG 852.A O no hydrogen 3.090 N/A TYR 856.A OH GLU 775.A OE2 no hydrogen 2.983 N/A CYS 857.A N PHE 853.A O no hydrogen 3.132 N/A CYS 857.A SG PHE 853.A O no hydrogen 3.501 N/A GLU 858.A N ARG 854.A O no hydrogen 2.907 N/A ARG 859.A N GLY 855.A O no hydrogen 2.762 N/A ALA 860.A N TYR 856.A O no hydrogen 2.881 N/A TYR 861.A N CYS 857.A O no hydrogen 3.050 N/A TYR 861.A OH SER 898.A O no hydrogen 2.734 N/A THR 862.A N GLU 858.A O no hydrogen 3.144 N/A THR 862.A OG1 GLU 858.A O no hydrogen 2.686 N/A ILE 863.A N ARG 859.A O no hydrogen 2.968 N/A LEU 864.A N ALA 860.A O no hydrogen 3.187 N/A ARG 865.A N TYR 861.A O no hydrogen 3.246 N/A ARG 865.A NE LEU 899.A O no hydrogen 2.882 N/A ARG 865.A NE ALA 900.A O no hydrogen 3.392 N/A ARG 865.A NH2 ALA 900.A O no hydrogen 2.847 N/A ARG 866.A N THR 862.A O no hydrogen 3.385 N/A ARG 866.A NH2 GLU 905.A OE1 no hydrogen 3.481 N/A HIS 867.A N LEU 864.A O no hydrogen 3.257 N/A GLY 868.A N ARG 865.A O no hydrogen 2.911 N/A LEU 870.A N HIS 867.A O no hydrogen 3.210 N/A PHE 871.A N HIS 867.A O no hydrogen 3.451 N/A LEU 872.A N GLY 868.A O no hydrogen 3.133 N/A HIS 873.A N LEU 869.A O no hydrogen 2.850 N/A LEU 874.A N LEU 870.A O no hydrogen 2.813 N/A PHE 875.A N PHE 871.A O no hydrogen 2.993 N/A ALA 876.A N LEU 872.A O no hydrogen 2.769 N/A LEU 877.A N HIS 873.A O no hydrogen 3.089 N/A MET 878.A N LEU 874.A O no hydrogen 3.069 N/A ARG 879.A N ALA 876.A O no hydrogen 3.420 N/A ALA 880.A N LEU 877.A O no hydrogen 3.084 N/A ALA 881.A N MET 878.A O no hydrogen 2.977 N/A GLY 882.A N ARG 879.A O no hydrogen 3.481 N/A LEU 886.A N LEU 883.A O no hydrogen 3.105 N/A SER 887.A N ASP 891.A OD2 no hydrogen 2.778 N/A SER 887.A OG PRO 884.A O no hydrogen 2.980 N/A SER 887.A OG ASP 891.A OD2 no hydrogen 3.512 N/A CYS 888.A N ASP 891.A OD2 no hydrogen 2.791 N/A CYS 888.A SG ASP 891.A OD2 no hydrogen 3.302 N/A ASP 891.A N CYS 888.A O no hydrogen 3.188 N/A ILE 892.A N CYS 888.A O no hydrogen 3.466 N/A GLN 893.A N SER 889.A O no hydrogen 2.853 N/A GLN 893.A NE2 ASP 897.A OD1 no hydrogen 3.065 N/A GLN 893.A NE2 ASP 897.A OD2 no hydrogen 3.542 N/A TYR 894.A N LYS 890.A O no hydrogen 3.146 N/A TYR 894.A N ASP 891.A O no hydrogen 3.163 N/A ASP 897.A N GLN 893.A O no hydrogen 3.136 N/A SER 898.A N TYR 894.A O no hydrogen 2.775 N/A SER 898.A OG VAL 790.A O no hydrogen 2.725 N/A SER 898.A OG LEU 895.A O no hydrogen 3.506 N/A LEU 899.A N LEU 895.A O no hydrogen 2.962 N/A ALA 900.A N ASP 897.A O no hydrogen 2.838 N/A LEU 901.A N LYS 896.A O no hydrogen 2.813 N/A GLU 907.A N THR 904.A OG1 no hydrogen 3.201 N/A ALA 908.A N THR 904.A O no hydrogen 2.806 N/A LEU 909.A N GLU 905.A O no hydrogen 3.049 N/A LYS 910.A N GLU 906.A O no hydrogen 3.082 N/A HIS 911.A N GLU 907.A O no hydrogen 3.367 N/A PHE 912.A N ALA 908.A O no hydrogen 2.861 N/A ARG 913.A N LEU 909.A O no hydrogen 3.127 N/A ARG 913.A NE GLU 858.A OE1 no hydrogen 3.244 N/A ARG 913.A NE GLU 858.A OE2 no hydrogen 3.433 N/A ARG 913.A NH2 GLU 858.A OE1 no hydrogen 3.027 N/A VAL 914.A N LYS 910.A O no hydrogen 3.152 N/A LYS 915.A N HIS 911.A O no hydrogen 3.111 N/A PHE 916.A N PHE 912.A O no hydrogen 2.739 N/A ASN 917.A N ARG 913.A O no hydrogen 2.827 N/A GLU 918.A N VAL 914.A O no hydrogen 3.101 N/A ALA 919.A N LYS 915.A O no hydrogen 3.091 N/A LEU 920.A N PHE 916.A O no hydrogen 3.108 N/A ARG 921.A N ASN 917.A O no hydrogen 3.009 N/A GLU 922.A N GLU 918.A O no hydrogen 2.818 N/A SER 923.A OG LEU 831.A O no hydrogen 3.271 N/A THR 926.A N GLU 922.A O no hydrogen 3.439 N/A