Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8b77_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N LEU 2.A O no hydrogen 3.417 N/A GLN 6.A NE2 ASN 146.A OD1 no hydrogen 2.998 N/A LEU 7.A N SER 3.A O no hydrogen 2.730 N/A LEU 8.A N ALA 4.A O no hydrogen 2.717 N/A ASN 9.A N GLN 5.A O no hydrogen 3.007 N/A ASN 9.A ND2 GLN 5.A OE1 no hydrogen 3.230 N/A ALA 10.A N GLN 6.A O no hydrogen 3.214 N/A SER 11.A N LEU 7.A O no hydrogen 3.214 N/A SER 11.A OG LEU 7.A O no hydrogen 2.675 N/A LYS 12.A N LEU 8.A O no hydrogen 3.164 N/A ILE 13.A N ASN 9.A O no hydrogen 3.034 N/A ASP 14.A N ALA 10.A O no hydrogen 2.944 N/A ASP 15.A N SER 11.A O no hydrogen 3.046 N/A ILE 16.A N LYS 12.A O no hydrogen 3.011 N/A ASP 17.A N ILE 13.A O no hydrogen 2.729 N/A SER 18.A N ASP 14.A O no hydrogen 2.631 N/A SER 18.A OG ASP 14.A O no hydrogen 2.968 N/A SER 18.A OG GLU 23.A OE1 no hydrogen 3.181 N/A MET 19.A N ASP 15.A O no hydrogen 2.791 N/A MET 20.A N ILE 16.A O no hydrogen 2.810 N/A MET 20.A N ASP 17.A O no hydrogen 3.169 N/A GLY 21.A N SER 18.A O no hydrogen 3.099 N/A ARG 24.A NE THR 81.A OG1 no hydrogen 2.625 N/A ARG 24.A NH2 ASP 67.A OD2 no hydrogen 2.683 N/A TYR 25.A N LYS 79.A O no hydrogen 2.729 N/A TYR 30.A N GLN 212.A OE1 no hydrogen 3.027 N/A TYR 30.A OH ARG 33.A O no hydrogen 2.853 N/A ASP 38.A N ASP 35.A O no hydrogen 2.965 N/A GLN 41.A N ASP 38.A O no hydrogen 3.162 N/A ILE 42.A N ASP 38.A O no hydrogen 3.280 N/A ARG 45.A N VAL 210.A O no hydrogen 3.370 N/A ARG 45.A NH2 ASP 72.A OD2 no hydrogen 2.887 N/A GLY 47.A N TYR 208.A O no hydrogen 2.775 N/A TRP 48.A N LEU 71.A O no hydrogen 2.918 N/A TRP 48.A NE1 GLY 205.A O no hydrogen 2.991 N/A LEU 49.A N LYS 206.A O no hydrogen 3.164 N/A THR 50.A N TYR 69.A O no hydrogen 2.875 N/A THR 50.A OG1 TYR 69.A O no hydrogen 3.425 N/A HIS 53.A N ASP 67.A O no hydrogen 3.073 N/A HIS 53.A NE2 SER 358.A O no hydrogen 2.958 N/A THR 55.A N GLY 65.A O no hydrogen 2.916 N/A VAL 57.A N ILE 63.A O no hydrogen 3.196 N/A GLN 61.A NE2 GLN 147.A OE1 no hydrogen 2.585 N/A ILE 63.A N VAL 57.A O no hydrogen 2.799 N/A SER 64.A N VAL 143.A O no hydrogen 3.169 N/A GLY 65.A N THR 55.A O no hydrogen 3.168 N/A VAL 66.A N VAL 82.A O no hydrogen 2.873 N/A ASP 67.A N HIS 53.A O no hydrogen 2.740 N/A PHE 68.A N SER 80.A O no hydrogen 2.599 N/A TYR 69.A N ASN 51.A O no hydrogen 2.745 N/A TYR 69.A OH ASP 17.A OD1 no hydrogen 3.309 N/A TYR 69.A OH ASP 17.A OD2 no hydrogen 2.427 N/A PHE 70.A N PHE 78.A O no hydrogen 2.778 N/A LEU 71.A N TRP 48.A O no hydrogen 3.077 N/A ASP 72.A N GLY 76.A O no hydrogen 2.882 N/A GLY 76.A N ASP 72.A OD1 no hydrogen 2.556 N/A SER 77.A OG GLY 21.A O no hydrogen 2.554 N/A PHE 78.A N PHE 70.A O no hydrogen 3.091 N/A LYS 79.A N GLU 23.A O no hydrogen 3.361 N/A LYS 79.A NZ ASP 14.A OD2 no hydrogen 2.980 N/A LYS 79.A NZ ASP 17.A OD2 no hydrogen 3.009 N/A LYS 79.A NZ ASP 67.A OD1 no hydrogen 2.815 N/A SER 80.A N PHE 68.A O no hydrogen 2.832 N/A SER 80.A OG TYR 25.A O no hydrogen 3.240 N/A THR 81.A OG1 ASP 67.A OD2 no hydrogen 3.018 N/A VAL 82.A N VAL 66.A O no hydrogen 3.163 N/A TYR 84.A N TYR 192.A OH no hydrogen 3.280 N/A TYR 84.A OH ASP 199.A OD2 no hydrogen 2.844 N/A TYR 87.A OH ASP 199.A OD2 no hydrogen 2.842 N/A PHE 88.A N LEU 140.A O no hydrogen 3.112 N/A PHE 89.A N ARG 186.A O no hydrogen 3.072 N/A ILE 90.A N ILE 138.A O no hydrogen 2.926 N/A ALA 91.A N ASP 184.A O no hydrogen 2.775 N/A CYS 92.A SG LEU 181.A O no hydrogen 3.921 N/A ASN 93.A N ASN 93.A OD1 no hydrogen 2.378 N/A ASN 93.A ND2 HIS 180.A O no hydrogen 3.572 N/A ARG 97.A N ASP 94.A O no hydrogen 3.322 N/A ARG 97.A NE ASP 100.A OD2 no hydrogen 3.194 N/A ARG 97.A NH1 VAL 176.A O no hydrogen 2.694 N/A VAL 101.A N ARG 97.A O no hydrogen 3.349 N/A GLU 102.A N VAL 98.A O no hydrogen 2.833 N/A GLU 103.A N ASN 99.A O no hydrogen 2.814 N/A LEU 104.A N ASP 100.A O no hydrogen 2.912 N/A VAL 105.A N VAL 101.A O no hydrogen 2.752 N/A LYS 106.A N GLU 102.A O no hydrogen 3.059 N/A LYS 106.A NZ GLU 103.A OE2 no hydrogen 2.459 N/A LYS 107.A N GLU 103.A O no hydrogen 3.201 N/A TYR 108.A N LEU 104.A O no hydrogen 2.833 N/A LEU 109.A N VAL 105.A O no hydrogen 2.827 N/A CYS 112.A N LEU 109.A O no hydrogen 2.981 N/A CYS 112.A SG LEU 109.A O no hydrogen 3.881 N/A LEU 113.A N LEU 109.A O no hydrogen 2.620 N/A LYS 114.A N SER 141.A O no hydrogen 3.109 N/A LYS 114.A NZ ASP 85.A OD2 no hydrogen 3.199 N/A SER 115.A N SER 141.A O no hydrogen 3.240 N/A ILE 119.A N LEU 137.A O no hydrogen 3.046 N/A LYS 121.A N LYS 135.A O no hydrogen 3.034 N/A LYS 121.A NZ GLU 187.A OE2 no hydrogen 3.553 N/A GLU 122.A N ASN 471.A O no hydrogen 2.625 N/A THR 125.A N ASP 123.A OD1 no hydrogen 2.884 N/A THR 125.A OG1 ASP 123.A OD1 no hydrogen 3.104 N/A THR 125.A OG1 THR 125.A O no hydrogen 2.295 N/A HIS 129.A N MET 126.A O no hydrogen 3.366 N/A HIS 129.A ND1 MET 126.A O no hydrogen 2.586 N/A HIS 129.A NE2 GLU 690.A OE1 no hydrogen 2.398 N/A LEU 133.A N ASN 128.A O no hydrogen 3.420 N/A LYS 135.A N LYS 121.A O no hydrogen 2.691 N/A LEU 137.A N ILE 119.A O no hydrogen 2.923 N/A ILE 138.A N ILE 90.A O no hydrogen 3.158 N/A LYS 139.A N GLN 117.A O no hydrogen 2.719 N/A LEU 140.A N PHE 88.A O no hydrogen 2.894 N/A SER 141.A N SER 115.A O no hydrogen 3.068 N/A PHE 142.A N PRO 86.A O no hydrogen 2.972 N/A ASN 144.A ND2 GLY 62.A O no hydrogen 2.778 N/A SER 145.A N SER 64.A OG no hydrogen 3.159 N/A ASN 146.A ND2 GLN 6.A OE1 no hydrogen 2.570 N/A GLN 147.A N ASN 144.A OD1 no hydrogen 2.826 N/A LEU 148.A N ASN 144.A O no hydrogen 3.339 N/A PHE 149.A N SER 145.A O no hydrogen 3.053 N/A GLU 150.A N ASN 146.A O no hydrogen 3.192 N/A ALA 151.A N GLN 147.A O no hydrogen 3.064 N/A ARG 152.A N LEU 148.A O no hydrogen 3.177 N/A LYS 153.A N PHE 149.A O no hydrogen 2.758 N/A LEU 154.A N GLU 150.A O no hydrogen 2.948 N/A LEU 154.A N ALA 151.A O no hydrogen 2.552 N/A ARG 156.A N ARG 152.A O no hydrogen 3.019 N/A LEU 159.A N LEU 155.A O no hydrogen 3.001 N/A GLN 160.A N ARG 156.A O no hydrogen 2.900 N/A ASP 161.A N PRO 157.A O no hydrogen 2.948 N/A ASN 162.A N ILE 158.A O no hydrogen 2.907 N/A ASN 162.A ND2 LYS 179.A O no hydrogen 2.893 N/A ALA 163.A N GLN 160.A O no hydrogen 3.056 N/A ASN 164.A N ASP 161.A O no hydrogen 3.246 N/A TYR 172.A N ASN 170.A OD1 no hydrogen 3.095 N/A HIS 180.A N ASP 177.A O no hydrogen 3.192 N/A LEU 181.A N ALA 178.A O no hydrogen 3.005 N/A ILE 182.A N LYS 179.A O no hydrogen 3.234 N/A GLU 183.A N ALA 91.A O no hydrogen 2.820 N/A ILE 185.A N ASP 184.A OD1 no hydrogen 2.572 N/A ARG 186.A N PHE 89.A O no hydrogen 3.053 N/A ARG 186.A NE LEU 474.A O no hydrogen 2.935 N/A ARG 186.A NH2 LEU 474.A O no hydrogen 2.982 N/A ASP 189.A N ASP 189.A OD1 no hydrogen 2.388 N/A TYR 192.A OH TYR 84.A O no hydrogen 2.475 N/A ARG 195.A N PRO 191.A O no hydrogen 2.716 N/A ARG 195.A NH1 ASP 199.A OD1 no hydrogen 2.959 N/A ARG 195.A NH2 GLU 187.A OE1 no hydrogen 2.505 N/A VAL 196.A N TYR 192.A O no hydrogen 2.891 N/A SER 197.A N HIS 193.A O no hydrogen 3.107 N/A SER 197.A OG ILE 202.A O no hydrogen 2.483 N/A ILE 198.A N VAL 194.A O no hydrogen 2.936 N/A ASP 199.A N ARG 195.A O no hydrogen 2.989 N/A LYS 200.A N VAL 196.A O no hydrogen 2.983 N/A ASP 201.A N ILE 198.A O no hydrogen 3.227 N/A ILE 202.A N SER 197.A O no hydrogen 3.198 N/A ARG 203.A N TYR 208.A OH no hydrogen 2.855 N/A ARG 203.A NH1 ILE 202.A O no hydrogen 3.237 N/A GLY 205.A N LEU 49.A O no hydrogen 2.749 N/A LYS 206.A NZ GLU 217.A OE2 no hydrogen 3.321 N/A TRP 207.A NE1 ALA 223.A O no hydrogen 2.630 N/A TYR 208.A N GLY 47.A O no hydrogen 2.929 N/A TYR 208.A OH ASP 201.A O no hydrogen 3.270 N/A LYS 209.A N ILE 216.A O no hydrogen 2.787 N/A LYS 209.A NZ ILE 39.A O no hydrogen 3.360 N/A LYS 209.A NZ ILE 42.A O no hydrogen 2.709 N/A VAL 210.A N ARG 45.A O no hydrogen 2.956 N/A THR 211.A N GLY 214.A O no hydrogen 2.715 N/A THR 211.A OG1 GLY 214.A O no hydrogen 3.105 N/A GLY 214.A N THR 211.A OG1 no hydrogen 3.028 N/A ILE 216.A N LYS 209.A O no hydrogen 3.049 N/A ASP 218.A N TRP 207.A O no hydrogen 2.954 N/A THR 219.A N GLU 217.A O no hydrogen 2.863 N/A LYS 221.A N ASP 218.A O no hydrogen 3.072 N/A LYS 221.A NZ GLU 73.A OE2 no hydrogen 3.245 N/A VAL 229.A N ASP 259.A OD1 no hydrogen 3.391 N/A VAL 229.A N ASP 259.A OD2 no hydrogen 3.265 N/A MET 230.A N VAL 316.A O no hydrogen 3.089 N/A ALA 231.A N MET 257.A O no hydrogen 2.959 N/A PHE 232.A N SER 318.A O no hydrogen 3.094 N/A ALA 233.A N SER 255.A O no hydrogen 2.754 N/A ALA 235.A N MET 253.A O no hydrogen 2.732 N/A THR 236.A OG1 THR 237.A O no hydrogen 2.660 N/A THR 237.A N GLN 250.A O no hydrogen 2.963 N/A THR 237.A OG1 ASP 249.A OD1 no hydrogen 2.758 N/A THR 237.A OG1 GLN 250.A O no hydrogen 3.569 N/A LYS 238.A N THR 403.A OG1 no hydrogen 3.136 N/A LYS 238.A NZ PRO 399.A O no hydrogen 2.492 N/A LEU 241.A N GLU 400.A OE1 no hydrogen 2.649 N/A LYS 242.A N PRO 239.A O no hydrogen 3.267 N/A LYS 242.A NZ LEU 1001.A O no hydrogen 2.458 N/A ASP 245.A N ASP 249.A OD2 no hydrogen 2.807 N/A ALA 247.A N ASP 245.A OD1 no hydrogen 2.714 N/A VAL 248.A N ASP 245.A O no hydrogen 3.306 N/A ASP 249.A N ASP 245.A O no hydrogen 2.714 N/A GLN 250.A N THR 237.A OG1 no hydrogen 2.896 N/A ILE 251.A N GLU 298.A OE2 no hydrogen 2.787 N/A MET 252.A N ALA 235.A O no hydrogen 2.943 N/A MET 253.A N ALA 235.A O no hydrogen 3.516 N/A ILE 254.A N ILE 265.A O no hydrogen 3.032 N/A SER 255.A N ALA 233.A O no hydrogen 2.884 N/A SER 255.A OG SER 417.A O no hydrogen 2.580 N/A TYR 256.A N PHE 263.A O no hydrogen 3.045 N/A TYR 256.A OH HIS 308.A ND1 no hydrogen 2.605 N/A MET 257.A N ALA 231.A O no hydrogen 2.759 N/A ILE 258.A N GLU 261.A O no hydrogen 2.776 N/A ASP 259.A N VAL 229.A O no hydrogen 3.011 N/A GLU 261.A N ILE 258.A O no hydrogen 3.279 N/A PHE 263.A N TYR 256.A O no hydrogen 2.828 N/A LEU 264.A N THR 291.A O no hydrogen 2.874 N/A ILE 265.A N ILE 254.A O no hydrogen 3.138 N/A THR 266.A N PHE 293.A O no hydrogen 2.865 N/A THR 266.A OG1 ASN 294.A OD1 no hydrogen 2.584 N/A ASN 267.A N MET 252.A O no hydrogen 2.813 N/A ARG 268.A N GLU 295.A O no hydrogen 2.873 N/A GLU 269.A N ASN 296.A O no hydrogen 2.970 N/A ILE 270.A N ASN 267.A O no hydrogen 2.979 N/A ILE 271.A N ASN 267.A O no hydrogen 2.622 N/A SER 272.A N ALA 406.A O no hydrogen 3.486 N/A SER 272.A OG ALA 406.A O no hydrogen 2.951 N/A ILE 275.A N ASN 294.A OD1 no hydrogen 3.016 N/A PHE 278.A N PHE 290.A O no hydrogen 3.301 N/A TYR 280.A N GLY 288.A O no hydrogen 3.084 N/A THR 281.A OG1 GLU 279.A OE2 no hydrogen 2.670 N/A TYR 286.A N LYS 283.A O no hydrogen 2.790 N/A TYR 286.A OH LEU 390.A O no hydrogen 2.584 N/A PHE 290.A N PHE 278.A O no hydrogen 3.046 N/A THR 291.A N GLY 262.A O no hydrogen 3.034 N/A PHE 293.A N LEU 264.A O no hydrogen 2.797 N/A ASN 294.A ND2 ILE 275.A O no hydrogen 2.710 N/A LEU 301.A N ASP 297.A O no hydrogen 3.091 N/A LEU 302.A N GLU 298.A O no hydrogen 3.081 N/A GLN 303.A N VAL 299.A O no hydrogen 2.773 N/A ARG 304.A N ALA 300.A O no hydrogen 2.820 N/A ARG 304.A NH2 GLU 295.A OE1 no hydrogen 2.892 N/A PHE 305.A N LEU 301.A O no hydrogen 2.892 N/A PHE 306.A N LEU 302.A O no hydrogen 2.969 N/A GLU 307.A N GLN 303.A O no hydrogen 2.904 N/A HIS 308.A N ARG 304.A O no hydrogen 3.156 N/A ILE 309.A N PHE 305.A O no hydrogen 3.072 N/A ARG 310.A N PHE 306.A O no hydrogen 3.203 N/A ARG 310.A NH1 GLU 344.A O no hydrogen 2.696 N/A ARG 310.A NH1 GLU 344.A OE1 no hydrogen 2.461 N/A ARG 310.A NH2 GLU 344.A OE1 no hydrogen 2.977 N/A ASP 311.A N GLU 307.A O no hydrogen 3.201 N/A VAL 312.A N HIS 308.A O no hydrogen 3.182 N/A ARG 313.A N ILE 309.A O no hydrogen 3.253 N/A ILE 317.A N SER 361.A O no hydrogen 2.920 N/A SER 318.A N MET 230.A O no hydrogen 2.712 N/A THR 319.A N MET 363.A O no hydrogen 3.172 N/A THR 319.A OG1 HIS 362.A NE2 no hydrogen 2.917 N/A ASN 321.A N ASP 364.A OD1 no hydrogen 2.705 N/A GLY 322.A N THR 319.A OG1 no hydrogen 3.017 N/A PHE 324.A N ASN 321.A O no hydrogen 3.388 N/A PHE 325.A N ASN 321.A O no hydrogen 3.180 N/A TRP 327.A N GLY 322.A O no hydrogen 2.839 N/A PHE 329.A N PHE 325.A O no hydrogen 3.155 N/A ILE 330.A N ASP 326.A O no hydrogen 3.069 N/A HIS 331.A N TRP 327.A O no hydrogen 2.873 N/A HIS 331.A ND1 TYR 355.A OH no hydrogen 3.014 N/A ASN 332.A N PRO 328.A O no hydrogen 3.193 N/A ASN 332.A ND2 PRO 328.A O no hydrogen 3.345 N/A ARG 333.A N PHE 329.A O no hydrogen 3.008 N/A ARG 333.A NE GLU 298.A OE2 no hydrogen 3.228 N/A ARG 333.A NH1 SER 246.A O no hydrogen 2.712 N/A ARG 333.A NH2 GLU 298.A OE1 no hydrogen 3.257 N/A SER 334.A N ILE 330.A O no hydrogen 2.990 N/A SER 334.A OG ILE 330.A O no hydrogen 3.157 N/A SER 334.A OG HIS 331.A O no hydrogen 2.487 N/A SER 334.A OG LEU 339.A O no hydrogen 3.262 N/A LYS 335.A N HIS 331.A O no hydrogen 2.758 N/A ILE 336.A N ASN 332.A O no hydrogen 2.671 N/A HIS 337.A N SER 334.A O no hydrogen 3.229 N/A GLY 338.A N LYS 335.A O no hydrogen 2.772 N/A LEU 339.A N SER 334.A O no hydrogen 2.575 N/A PHE 342.A N ASP 340.A OD1 no hydrogen 3.056 N/A ASP 343.A N ASP 340.A OD1 no hydrogen 3.491 N/A GLU 344.A N ASP 340.A O no hydrogen 2.846 N/A GLU 344.A N MET 341.A O no hydrogen 3.152 N/A ILE 345.A N MET 341.A O no hydrogen 2.794 N/A GLY 346.A N PHE 342.A O no hydrogen 2.743 N/A ALA 348.A N LYS 356.A O no hydrogen 3.304 N/A ASP 350.A N GLU 354.A O no hydrogen 2.878 N/A GLU 352.A N ASP 350.A OD1 no hydrogen 3.269 N/A GLY 353.A N ASP 350.A O no hydrogen 3.059 N/A GLU 354.A N ASP 350.A OD1 no hydrogen 3.000 N/A TYR 355.A N ASP 323.A OD1 no hydrogen 2.675 N/A TYR 355.A OH HIS 331.A ND1 no hydrogen 3.014 N/A LYS 356.A N ALA 348.A O no hydrogen 3.187 N/A SER 357.A OG CYS 360.A O no hydrogen 2.704 N/A SER 358.A OG ASP 17.A OD1 no hydrogen 2.724 N/A TYR 359.A OH ILE 345.A O no hydrogen 2.349 N/A CYS 360.A N SER 357.A OG no hydrogen 3.000 N/A CYS 360.A SG PRO 314.A O no hydrogen 3.400 N/A CYS 360.A SG SER 361.A O no hydrogen 3.503 N/A SER 361.A N THR 315.A O no hydrogen 3.066 N/A HIS 362.A N ASP 448.A OD1 no hydrogen 2.780 N/A HIS 362.A NE2 THR 319.A OG1 no hydrogen 2.917 N/A MET 363.A N ILE 317.A O no hydrogen 2.838 N/A CYS 365.A N THR 319.A O no hydrogen 2.866 N/A CYS 365.A SG SER 318.A OG no hydrogen 3.553 N/A PHE 366.A N ASP 364.A OD1 no hydrogen 2.989 N/A ARG 367.A N ASP 364.A O no hydrogen 2.958 N/A ARG 367.A NH1 GLU 354.A OE2 no hydrogen 3.425 N/A VAL 369.A N CYS 365.A O no hydrogen 3.030 N/A LYS 370.A N PHE 366.A O no hydrogen 2.843 N/A ARG 371.A N ARG 367.A O no hydrogen 3.116 N/A ARG 371.A NE ASP 372.A OD1 no hydrogen 2.754 N/A ARG 371.A NH1 THR 450.A O no hydrogen 2.731 N/A ARG 371.A NH1 LYS 453.A O no hydrogen 3.074 N/A ARG 371.A NH2 ASP 372.A OD1 no hydrogen 3.491 N/A ARG 371.A NH2 THR 450.A O no hydrogen 3.212 N/A ASP 372.A N TRP 368.A O no hydrogen 2.618 N/A SER 373.A N TRP 368.A O no hydrogen 3.147 N/A SER 373.A OG VAL 369.A O no hydrogen 2.547 N/A SER 379.A N PRO 376.A O no hydrogen 2.762 N/A GLN 380.A N GLN 377.A O no hydrogen 3.529 N/A GLN 380.A NE2 LEU 375.A O no hydrogen 3.034 N/A LYS 383.A NZ GLU 396.A OE1 no hydrogen 3.549 N/A VAL 385.A N GLY 381.A O no hydrogen 2.985 N/A THR 386.A N LEU 382.A O no hydrogen 2.875 N/A THR 386.A OG1 LEU 382.A O no hydrogen 2.512 N/A GLN 387.A N LYS 383.A O no hydrogen 2.982 N/A SER 388.A N ALA 384.A O no hydrogen 2.689 N/A LYS 389.A N VAL 385.A O no hydrogen 2.962 N/A LYS 389.A NZ SER 373.A O no hydrogen 3.307 N/A GLY 391.A N THR 386.A O no hydrogen 2.891 N/A ILE 395.A N SER 419.A OG no hydrogen 3.050 N/A GLU 400.A N ASP 398.A OD1 no hydrogen 2.618 N/A LEU 401.A N ASP 398.A O no hydrogen 2.707 N/A MET 402.A N PRO 399.A O no hydrogen 3.283 N/A THR 403.A OG1 LYS 238.A O no hydrogen 3.311 N/A ALA 406.A N THR 403.A O no hydrogen 3.288 N/A PHE 407.A N PRO 404.A O no hydrogen 2.824 N/A GLU 408.A N PRO 404.A O no hydrogen 2.958 N/A GLN 411.A NE2 GLU 415.A OE2 no hydrogen 2.523 N/A LEU 413.A N LYS 409.A O no hydrogen 3.272 N/A SER 414.A N PRO 410.A O no hydrogen 3.031 N/A SER 414.A OG PRO 410.A O no hydrogen 2.705 N/A GLU 415.A N GLN 411.A O no hydrogen 3.015 N/A TYR 416.A N HIS 412.A O no hydrogen 3.331 N/A SER 417.A N LEU 413.A O no hydrogen 2.976 N/A VAL 418.A N SER 414.A O no hydrogen 3.100 N/A SER 419.A N GLU 415.A O no hydrogen 2.761 N/A SER 419.A OG TYR 280.A OH no hydrogen 3.309 N/A ASP 420.A N TYR 416.A O no hydrogen 3.061 N/A ALA 421.A N SER 417.A O no hydrogen 3.230 N/A VAL 422.A N VAL 418.A O no hydrogen 2.906 N/A ALA 423.A N SER 419.A O no hydrogen 3.178 N/A THR 424.A N ASP 420.A O no hydrogen 3.104 N/A THR 424.A OG1 ASP 420.A O no hydrogen 2.535 N/A TYR 425.A N ALA 421.A O no hydrogen 2.861 N/A TYR 426.A N VAL 422.A O no hydrogen 3.078 N/A TYR 426.A OH PRO 287.A O no hydrogen 2.460 N/A LEU 427.A N ALA 423.A O no hydrogen 3.090 N/A TYR 428.A N THR 424.A O no hydrogen 3.025 N/A TYR 428.A OH HIS 433.A ND1 no hydrogen 2.885 N/A MET 429.A N TYR 425.A O no hydrogen 2.892 N/A LYS 430.A N TYR 426.A O no hydrogen 3.253 N/A TYR 431.A N LEU 427.A O no hydrogen 3.079 N/A TYR 431.A OH LYS 389.A O no hydrogen 2.727 N/A HIS 433.A N TYR 428.A O no hydrogen 2.747 N/A HIS 433.A ND1 TYR 428.A OH no hydrogen 2.885 N/A ILE 436.A N VAL 432.A O no hydrogen 2.800 N/A PHE 437.A N HIS 433.A O no hydrogen 3.117 N/A SER 438.A N PRO 434.A O no hydrogen 3.039 N/A SER 438.A OG PRO 434.A O no hydrogen 2.862 N/A LEU 439.A N PHE 435.A O no hydrogen 3.066 N/A CYS 440.A N ILE 436.A O no hydrogen 3.019 N/A CYS 440.A N PHE 437.A O no hydrogen 3.251 N/A CYS 440.A SG ILE 436.A O no hydrogen 3.651 N/A CYS 440.A SG LEU 445.A O no hydrogen 3.330 N/A CYS 440.A SG THR 450.A OG1 no hydrogen 2.980 N/A THR 441.A N SER 438.A O no hydrogen 3.154 N/A THR 441.A OG1 SER 438.A O no hydrogen 2.724 N/A ILE 442.A N LEU 439.A O no hydrogen 3.374 N/A ILE 443.A N LEU 439.A O no hydrogen 3.125 N/A LEU 445.A N ILE 443.A O no hydrogen 2.598 N/A ASN 446.A ND2 ASN 51.A OD1 no hydrogen 3.005 N/A GLU 449.A N ASN 446.A O no hydrogen 3.081 N/A GLU 449.A N ASN 446.A OD1 no hydrogen 3.123 N/A THR 450.A N ASN 446.A O no hydrogen 2.923 N/A THR 450.A OG1 ASN 446.A O no hydrogen 2.757 N/A LEU 451.A N PRO 447.A O no hydrogen 3.132 N/A ARG 452.A NE ASP 323.A OD2 no hydrogen 3.127 N/A ARG 452.A NE GLU 354.A OE1 no hydrogen 3.263 N/A ARG 452.A NH1 HIS 362.A O no hydrogen 2.966 N/A ARG 452.A NH1 ASP 448.A O no hydrogen 2.900 N/A ARG 452.A NH1 ASP 448.A OD1 no hydrogen 3.142 N/A ARG 452.A NH2 ASP 323.A OD2 no hydrogen 3.012 N/A ARG 452.A NH2 HIS 362.A O no hydrogen 2.549 N/A LYS 453.A N GLU 449.A O no hydrogen 3.024 N/A THR 455.A OG1 SER 753.A OG no hydrogen 2.677 N/A LEU 458.A N GLY 454.A O no hydrogen 3.011 N/A CYS 459.A N THR 455.A O no hydrogen 2.985 N/A CYS 459.A SG THR 455.A O no hydrogen 3.453 N/A CYS 459.A SG ILE 750.A O no hydrogen 3.192 N/A GLU 460.A N GLY 456.A O no hydrogen 2.975 N/A MET 461.A N THR 457.A O no hydrogen 3.013 N/A LEU 462.A N LEU 458.A O no hydrogen 3.057 N/A LEU 463.A N CYS 459.A O no hydrogen 2.909 N/A MET 464.A N GLU 460.A O no hydrogen 2.642 N/A VAL 465.A N MET 461.A O no hydrogen 2.893 N/A GLN 466.A N LEU 462.A O no hydrogen 3.292 N/A ALA 467.A N LEU 463.A O no hydrogen 2.901 N/A TYR 468.A N MET 464.A O no hydrogen 2.970 N/A GLN 469.A N VAL 465.A O no hydrogen 2.955 N/A HIS 470.A N GLN 466.A O no hydrogen 2.870 N/A ASN 471.A N TYR 468.A O no hydrogen 2.673 N/A ASN 471.A ND2 ARG 120.A O no hydrogen 3.194 N/A ILE 472.A N ALA 467.A O no hydrogen 2.598 N/A LEU 473.A N GLU 122.A O no hydrogen 2.633 N/A LEU 474.A N GLU 187.A OE2 no hydrogen 2.706 N/A ASN 476.A ND2 ILE 185.A O no hydrogen 3.009 N/A LYS 477.A NZ GLU 460.A OE2 no hydrogen 3.298 N/A LYS 477.A NZ GLY 762.A O no hydrogen 3.203 N/A HIS 478.A N SER 763.A O no hydrogen 2.815 N/A TYR 486.A N HIS 489.A O no hydrogen 2.768 N/A HIS 489.A N TYR 486.A O no hydrogen 2.747 N/A HIS 489.A ND1 SER 631.A O no hydrogen 2.773 N/A LEU 491.A N ARG 484.A O no hydrogen 2.766 N/A GLU 492.A N GLU 627.A O no hydrogen 2.551 N/A SER 493.A N GLU 627.A O no hydrogen 2.991 N/A SER 493.A OG GLU 627.A OE1 no hydrogen 2.632 N/A THR 495.A N ARG 625.A O no hydrogen 2.615 N/A THR 495.A OG1 TYR 496.A O no hydrogen 3.252 N/A TYR 496.A N THR 495.A OG1 no hydrogen 2.366 N/A TYR 496.A OH TYR 755.A OH no hydrogen 2.590 N/A VAL 497.A N ALA 623.A O no hydrogen 3.194 N/A HIS 500.A NE2 GLU 502.A OE2 no hydrogen 2.575 N/A GLU 502.A N LEU 798.A O no hydrogen 2.642 N/A SER 503.A OG ILE 889.A O no hydrogen 2.755 N/A LEU 504.A N LEU 796.A O no hydrogen 2.878 N/A GLU 505.A N LEU 796.A O no hydrogen 3.172 N/A GLY 507.A N LEU 879.A O no hydrogen 2.699 N/A VAL 508.A N GLN 1089.A OE1 no hydrogen 2.748 N/A PHE 509.A N MET 877.A O no hydrogen 3.316 N/A ARG 510.A NH2 GLY 933.A O no hydrogen 2.673 N/A SER 511.A N LYS 875.A O no hydrogen 2.590 N/A ASN 515.A N GLU 575.A O no hydrogen 2.498 N/A GLU 516.A N GLU 516.A OE2 no hydrogen 2.235 N/A PHE 517.A N ARG 573.A O no hydrogen 2.782 N/A ILE 519.A N ASN 571.A O no hydrogen 2.724 N/A ASP 520.A N ARG 791.A O no hydrogen 2.753 N/A SER 522.A OG ASP 520.A OD1 no hydrogen 2.790 N/A SER 522.A OG ASP 520.A OD2 no hydrogen 3.467 N/A ILE 524.A N ASP 520.A O no hydrogen 3.293 N/A ASP 525.A N PRO 521.A O no hydrogen 2.756 N/A GLU 526.A N SER 522.A O no hydrogen 2.936 N/A LEU 527.A N ALA 523.A O no hydrogen 2.905 N/A LEU 528.A N ILE 524.A O no hydrogen 2.949 N/A GLN 529.A N ASP 525.A O no hydrogen 3.136 N/A GLU 530.A N GLU 526.A O no hydrogen 3.050 N/A LEU 531.A N LEU 528.A O no hydrogen 3.355 N/A ALA 534.A N GLU 530.A O no hydrogen 3.346 N/A LEU 535.A N LEU 531.A O no hydrogen 3.120 N/A LYS 536.A N PRO 532.A O no hydrogen 3.226 N/A PHE 537.A N GLU 533.A O no hydrogen 2.911 N/A SER 538.A N ALA 534.A O no hydrogen 2.713 N/A GLU 540.A N LYS 536.A O no hydrogen 2.751 N/A VAL 541.A N PHE 537.A O no hydrogen 2.747 N/A GLU 542.A N PHE 537.A O no hydrogen 3.196 N/A ASN 543.A ND2 SER 538.A O no hydrogen 3.202 N/A ASN 543.A ND2 TYR 826.A O no hydrogen 3.144 N/A SER 545.A N VAL 539.A O no hydrogen 2.656 N/A SER 545.A OG ASN 543.A O no hydrogen 3.204 N/A ASP 548.A N SER 546.A OG no hydrogen 3.240 N/A LYS 549.A N SER 546.A O no hydrogen 3.421 N/A THR 551.A N THR 818.A O no hydrogen 3.138 N/A THR 551.A OG1 THR 818.A O no hydrogen 3.362 N/A PHE 553.A N THR 551.A O no hydrogen 2.846 N/A LYS 557.A N PHE 553.A O no hydrogen 2.986 N/A ILE 560.A N ILE 556.A O no hydrogen 3.187 N/A THR 561.A OG1 LYS 557.A O no hydrogen 2.798 N/A THR 561.A OG1 ASN 558.A O no hydrogen 2.980 N/A GLN 562.A N ASN 558.A O no hydrogen 2.635 N/A LYS 563.A N GLN 559.A O no hydrogen 3.514 N/A LEU 564.A N ILE 560.A O no hydrogen 2.775 N/A LEU 565.A N THR 561.A O no hydrogen 2.641 N/A GLU 566.A N GLN 562.A O no hydrogen 2.890 N/A LEU 567.A N LYS 563.A O no hydrogen 2.928 N/A LYS 568.A N LEU 565.A O no hydrogen 2.795 N/A GLU 569.A N LEU 565.A O no hydrogen 3.191 N/A ARG 573.A N PHE 517.A O no hydrogen 3.221 N/A LEU 578.A N LEU 807.A O no hydrogen 2.691 N/A TYR 580.A N CYS 805.A O no hydrogen 2.896 N/A HIS 581.A N ASP 871.A O no hydrogen 2.998 N/A HIS 581.A ND1 ASP 871.A OD2 no hydrogen 3.140 N/A VAL 582.A N ILE 803.A O no hydrogen 3.044 N/A ASP 583.A N GLU 869.A O no hydrogen 2.779 N/A VAL 584.A N ASP 801.A O no hydrogen 3.268 N/A ALA 585.A N PHE 867.A O no hydrogen 3.168 N/A ASN 590.A N SER 586.A O no hydrogen 2.659 N/A ASN 590.A ND2 ALA 585.A O no hydrogen 2.628 N/A ASN 590.A ND2 TYR 706.A OH no hydrogen 2.601 N/A ILE 591.A N MET 587.A O no hydrogen 2.649 N/A MET 592.A N TYR 588.A O no hydrogen 2.972 N/A THR 593.A N PRO 589.A O no hydrogen 2.851 N/A THR 594.A N ASN 590.A O no hydrogen 3.194 N/A THR 594.A OG1 ASN 590.A O no hydrogen 2.423 N/A THR 594.A OG1 THR 865.A OG1 no hydrogen 2.851 N/A ASN 595.A N MET 592.A O no hydrogen 3.271 N/A ASN 595.A ND2 ILE 591.A O no hydrogen 3.237 N/A LEU 597.A N MET 592.A O no hydrogen 2.888 N/A GLN 598.A NE2 SER 601.A OG no hydrogen 2.942 N/A GLN 598.A NE2 ASN 691.A O no hydrogen 2.765 N/A SER 601.A N GLN 598.A O no hydrogen 3.070 N/A SER 601.A OG CYS 687.A O no hydrogen 3.518 N/A ILE 602.A N PRO 599.A O no hydrogen 3.422 N/A LYS 603.A N ILE 685.A O no hydrogen 2.836 N/A LYS 603.A NZ ASP 600.A O no hydrogen 2.517 N/A LYS 603.A NZ GLU 690.A OE2 no hydrogen 2.467 N/A SER 610.A N ASP 607.A O no hydrogen 2.664 N/A SER 610.A OG ASP 127.A OD1 no hydrogen 2.856 N/A SER 610.A OG SER 610.A O no hydrogen 2.462 N/A CYS 611.A N CYS 608.A O no hydrogen 3.021 N/A CYS 611.A SG ASP 607.A O no hydrogen 3.600 N/A ARG 618.A N VAL 686.A O no hydrogen 3.211 N/A ARG 618.A NH1 THR 843.A O no hydrogen 3.136 N/A LEU 620.A N ALA 684.A O no hydrogen 2.877 N/A TRP 622.A N ARG 682.A O no hydrogen 3.024 N/A TRP 624.A N VAL 680.A O no hydrogen 3.046 N/A TRP 624.A NE1 GLU 494.A OE1 no hydrogen 3.232 N/A ARG 625.A N THR 495.A O no hydrogen 2.890 N/A GLY 626.A N GLU 678.A O no hydrogen 3.446 N/A GLU 627.A N SER 493.A O no hydrogen 2.453 N/A PHE 628.A N VAL 676.A O no hydrogen 3.083 N/A PHE 629.A N LEU 490.A O no hydrogen 3.166 N/A TYR 636.A N LYS 632.A O no hydrogen 3.213 N/A TYR 636.A OH GLU 483.A OE1 no hydrogen 2.611 N/A ASN 637.A N MET 633.A O no hydrogen 3.378 N/A ILE 639.A N GLU 635.A O no hydrogen 3.413 N/A LYS 640.A N TYR 636.A O no hydrogen 2.902 N/A ARG 641.A N ASN 637.A O no hydrogen 2.525 N/A ALA 642.A N MET 638.A O no hydrogen 2.792 N/A LEU 643.A N ILE 639.A O no hydrogen 2.852 N/A TYR 652.A OH GLU 483.A OE2 no hydrogen 2.773 N/A ASP 654.A N SER 651.A OG no hydrogen 3.160 N/A GLN 655.A N SER 651.A O no hydrogen 2.666 N/A VAL 656.A N TYR 652.A O no hydrogen 2.792 N/A ILE 657.A N ASP 654.A O no hydrogen 3.178 N/A ILE 659.A N GLN 655.A O no hydrogen 3.373 N/A LYS 660.A N VAL 656.A O no hydrogen 2.939 N/A LYS 661.A N ILE 657.A O no hydrogen 3.176 N/A ARG 662.A N HIS 658.A O no hydrogen 3.099 N/A LEU 663.A N ILE 659.A O no hydrogen 3.050 N/A THR 664.A N LYS 660.A O no hydrogen 3.090 N/A THR 664.A N LYS 661.A O no hydrogen 3.315 N/A THR 664.A OG1 LYS 661.A O no hydrogen 3.017 N/A TYR 666.A N ARG 662.A O no hydrogen 3.321 N/A SER 667.A N LEU 663.A O no hydrogen 2.924 N/A SER 667.A OG LEU 663.A O no hydrogen 2.917 N/A ARG 668.A N THR 664.A O no hydrogen 2.832 N/A TYR 671.A N SER 667.A O no hydrogen 3.411 N/A VAL 676.A N PHE 628.A O no hydrogen 2.742 N/A GLU 678.A N GLY 626.A O no hydrogen 3.377 N/A VAL 680.A N TRP 624.A O no hydrogen 2.828 N/A ARG 682.A N TRP 622.A O no hydrogen 2.781 N/A ALA 684.A N LEU 620.A O no hydrogen 2.792 N/A CYS 687.A N SER 601.A O no hydrogen 2.890 N/A GLN 688.A N CYS 616.A O no hydrogen 3.214 N/A GLN 688.A NE2 ASN 595.A O no hydrogen 3.270 N/A GLN 688.A NE2 VAL 686.A O no hydrogen 3.477 N/A ASN 691.A N GLU 690.A OE1 no hydrogen 3.021 N/A TYR 694.A OH PHE 754.A O no hydrogen 2.789 N/A VAL 695.A N GLN 598.A OE1 no hydrogen 2.887 N/A ASP 696.A N PRO 692.A O no hydrogen 2.816 N/A THR 697.A N PHE 693.A O no hydrogen 3.005 N/A THR 697.A OG1 PHE 693.A O no hydrogen 2.516 N/A VAL 698.A N TYR 694.A O no hydrogen 2.968 N/A LYS 699.A N VAL 695.A O no hydrogen 2.961 N/A SER 700.A N ASP 696.A O no hydrogen 2.800 N/A PHE 701.A N THR 697.A O no hydrogen 3.131 N/A ARG 702.A N VAL 698.A O no hydrogen 2.837 N/A ASP 703.A N LYS 699.A O no hydrogen 2.934 N/A ARG 704.A N SER 700.A O no hydrogen 2.795 N/A ARG 705.A N PHE 701.A O no hydrogen 2.863 N/A ARG 705.A NE GLN 744.A O no hydrogen 2.739 N/A ARG 705.A NE GLN 744.A OE1 no hydrogen 3.118 N/A ARG 705.A NH2 GLN 744.A OE1 no hydrogen 2.531 N/A TYR 706.A N ARG 702.A O no hydrogen 2.883 N/A GLU 707.A N ASP 703.A O no hydrogen 3.314 N/A LYS 709.A N ARG 705.A O no hydrogen 3.072 N/A LYS 709.A NZ GLU 869.A OE1 no hydrogen 3.025 N/A GLY 710.A N TYR 706.A O no hydrogen 2.652 N/A LEU 711.A N GLU 707.A O no hydrogen 2.792 N/A ALA 712.A N PHE 708.A O no hydrogen 2.990 N/A LYS 713.A N LYS 709.A O no hydrogen 3.100 N/A THR 714.A N GLY 710.A O no hydrogen 2.893 N/A THR 714.A OG1 GLY 710.A O no hydrogen 3.196 N/A TRP 715.A N LEU 711.A O no hydrogen 3.033 N/A LYS 716.A N ALA 712.A O no hydrogen 3.002 N/A ASN 718.A N THR 714.A O no hydrogen 3.388 N/A LEU 719.A N TRP 715.A O no hydrogen 3.303 N/A SER 720.A N LYS 716.A O no hydrogen 3.216 N/A LYS 721.A N GLY 717.A O no hydrogen 2.749 N/A ILE 722.A N ASN 718.A O no hydrogen 3.148 N/A ASP 726.A N ASP 723.A O no hydrogen 3.038 N/A LYS 727.A NZ ASP 731.A OD2 no hydrogen 2.398 N/A ARG 730.A N ASP 726.A O no hydrogen 3.473 N/A ASP 731.A N LYS 727.A O no hydrogen 2.683 N/A GLU 732.A N HIS 728.A O no hydrogen 2.874 N/A ALA 733.A N ALA 729.A O no hydrogen 2.884 N/A LYS 734.A N ARG 730.A O no hydrogen 2.730 N/A LYS 735.A N ASP 731.A O no hydrogen 2.827 N/A MET 736.A N GLU 732.A O no hydrogen 2.881 N/A ILE 737.A N ALA 733.A O no hydrogen 3.054 N/A VAL 738.A N LYS 734.A O no hydrogen 3.001 N/A LEU 739.A N LYS 735.A O no hydrogen 3.103 N/A TYR 740.A N MET 736.A O no hydrogen 2.930 N/A ASP 741.A N ILE 737.A O no hydrogen 2.863 N/A SER 742.A N VAL 738.A O no hydrogen 3.170 N/A LEU 743.A N LEU 739.A O no hydrogen 3.156 N/A GLN 744.A N TYR 740.A O no hydrogen 3.017 N/A GLN 744.A NE2 ASP 741.A OD1 no hydrogen 3.515 N/A LEU 745.A N ASP 741.A O no hydrogen 2.974 N/A ALA 746.A N SER 742.A O no hydrogen 2.802 N/A HIS 747.A N LEU 743.A O no hydrogen 3.209 N/A HIS 747.A ND1 LEU 743.A O no hydrogen 2.814 N/A LYS 748.A N LEU 745.A O no hydrogen 3.057 N/A LYS 748.A NZ TYR 374.A OH no hydrogen 3.459 N/A LEU 751.A N HIS 747.A O no hydrogen 3.001 N/A VAL 752.A N LYS 748.A O no hydrogen 2.930 N/A SER 753.A N VAL 749.A O no hydrogen 2.973 N/A SER 753.A OG THR 455.A OG1 no hydrogen 2.677 N/A SER 753.A OG VAL 749.A O no hydrogen 2.353 N/A PHE 754.A N LEU 751.A O no hydrogen 3.324 N/A TYR 755.A N VAL 752.A O no hydrogen 2.931 N/A GLY 756.A N VAL 752.A O no hydrogen 3.137 N/A TYR 757.A N SER 753.A O no hydrogen 2.675 N/A TYR 757.A OH GLU 460.A OE2 no hydrogen 2.530 N/A MET 759.A N GLY 756.A O no hydrogen 2.972 N/A ARG 760.A N TYR 757.A O no hydrogen 3.118 N/A SER 763.A N ARG 760.A O no hydrogen 3.260 N/A SER 763.A OG TYR 757.A O no hydrogen 3.223 N/A ARG 764.A N TYR 757.A OH no hydrogen 2.891 N/A ARG 764.A NH1 PRO 475.A O no hydrogen 2.796 N/A ARG 764.A NH2 ASP 189.A OD1 no hydrogen 3.100 N/A TRP 765.A N SER 763.A OG no hydrogen 3.034 N/A SER 767.A N VAL 758.A O no hydrogen 2.901 N/A SER 767.A OG GLU 769.A OE1 no hydrogen 3.462 N/A GLU 769.A N GLU 769.A OE1 no hydrogen 2.321 N/A MET 770.A N SER 767.A OG no hydrogen 2.948 N/A ALA 771.A N SER 767.A O no hydrogen 3.408 N/A GLY 772.A N MET 768.A O no hydrogen 2.984 N/A ILE 773.A N GLU 769.A O no hydrogen 3.107 N/A THR 774.A N MET 770.A O no hydrogen 3.112 N/A THR 774.A OG1 MET 770.A O no hydrogen 3.118 N/A CYS 775.A N ALA 771.A O no hydrogen 3.043 N/A CYS 775.A SG TYR 588.A OH no hydrogen 3.022 N/A CYS 775.A SG TYR 755.A OH no hydrogen 2.988 N/A CYS 775.A SG ALA 771.A O no hydrogen 3.837 N/A LEU 776.A N GLY 772.A O no hydrogen 2.851 N/A THR 777.A N ILE 773.A O no hydrogen 2.952 N/A THR 777.A OG1 ILE 773.A O no hydrogen 2.389 N/A GLY 778.A N THR 774.A O no hydrogen 3.298 N/A ALA 779.A N CYS 775.A O no hydrogen 3.059 N/A THR 780.A N LEU 776.A O no hydrogen 2.994 N/A THR 780.A OG1 LEU 776.A O no hydrogen 3.077 N/A ILE 781.A N THR 777.A O no hydrogen 2.996 N/A ILE 782.A N GLY 778.A O no hydrogen 2.977 N/A GLN 783.A N ALA 779.A O no hydrogen 2.953 N/A GLN 783.A NE2 ALA 779.A O no hydrogen 2.912 N/A MET 784.A N THR 780.A O no hydrogen 2.955 N/A ALA 785.A N ILE 781.A O no hydrogen 2.933 N/A ARG 786.A N ILE 782.A O no hydrogen 2.824 N/A ARG 786.A NH1 GLU 502.A OE2 no hydrogen 2.827 N/A ALA 787.A N GLN 783.A O no hydrogen 2.843 N/A VAL 789.A N ALA 785.A O no hydrogen 3.166 N/A GLU 790.A N ARG 786.A O no hydrogen 2.766 N/A VAL 792.A N LEU 788.A O no hydrogen 3.124 N/A ARG 794.A N ILE 806.A O no hydrogen 3.477 N/A ARG 794.A NE GLU 505.A OE2 no hydrogen 2.889 N/A ARG 794.A NH1 GLU 516.A O no hydrogen 3.149 N/A ARG 794.A NH2 GLU 505.A OE1 no hydrogen 2.580 N/A ARG 794.A NH2 GLU 505.A OE2 no hydrogen 3.201 N/A LEU 796.A N TRP 804.A O no hydrogen 2.603 N/A GLU 797.A N TRP 804.A O no hydrogen 3.282 N/A LEU 798.A N GLU 502.A O no hydrogen 2.838 N/A ASP 799.A N GLY 802.A O no hydrogen 2.988 N/A THR 800.A N HIS 500.A O no hydrogen 2.836 N/A THR 800.A OG1 ASP 799.A OD1 no hydrogen 2.800 N/A ASP 801.A N ASP 799.A O no hydrogen 2.732 N/A GLY 802.A N ASP 799.A O no hydrogen 3.179 N/A ILE 803.A N VAL 582.A O no hydrogen 3.035 N/A TRP 804.A N GLU 797.A O no hydrogen 2.713 N/A TRP 804.A NE1 TYR 893.A OH no hydrogen 2.781 N/A CYS 805.A N TYR 580.A O no hydrogen 3.030 N/A CYS 805.A SG TYR 580.A O no hydrogen 3.832 N/A ILE 806.A N ARG 794.A O no hydrogen 3.265 N/A LEU 807.A N LEU 578.A O no hydrogen 2.934 N/A LYS 809.A N LEU 576.A O no hydrogen 2.992 N/A PHE 811.A N PRO 808.A O no hydrogen 3.076 N/A TYR 815.A N LEU 827.A O no hydrogen 2.592 N/A PHE 817.A N LEU 825.A O no hydrogen 2.691 N/A THR 818.A N ASN 552.A OD1 no hydrogen 3.232 N/A LEU 819.A N LYS 823.A O no hydrogen 2.583 N/A GLU 820.A N LYS 549.A O no hydrogen 3.268 N/A GLY 822.A N LEU 819.A O no hydrogen 3.135 N/A LEU 825.A N PHE 817.A O no hydrogen 2.972 N/A LEU 827.A N TYR 815.A O no hydrogen 2.700 N/A CYS 831.A SG PHE 868.A O no hydrogen 3.008 N/A SER 832.A N SER 828.A O no hydrogen 2.914 N/A SER 832.A OG GLU 542.A OE1 no hydrogen 2.726 N/A SER 832.A OG GLU 542.A OE2 no hydrogen 3.450 N/A SER 832.A OG SER 828.A O no hydrogen 3.024 N/A MET 833.A N TYR 829.A O no hydrogen 2.685 N/A LEU 834.A N PRO 830.A O no hydrogen 3.432 N/A ASN 835.A N CYS 831.A O no hydrogen 3.061 N/A ASN 835.A ND2 GLU 542.A OE2 no hydrogen 2.539 N/A ASN 835.A ND2 PHE 868.A O no hydrogen 3.555 N/A TYR 836.A N SER 832.A O no hydrogen 3.233 N/A VAL 838.A N LEU 834.A O no hydrogen 3.230 N/A HIS 839.A N ASN 835.A O no hydrogen 2.986 N/A GLN 840.A N TYR 836.A O no hydrogen 2.723 N/A LYS 841.A N VAL 838.A O no hydrogen 3.124 N/A PHE 842.A N VAL 838.A O no hydrogen 2.434 N/A THR 843.A OG1 HIS 839.A O no hydrogen 2.504 N/A ASN 844.A N GLU 863.A O no hydrogen 2.967 N/A ASN 844.A ND2 THR 594.A O no hydrogen 3.049 N/A ASN 844.A ND2 GLN 688.A OE1 no hydrogen 2.856 N/A HIS 845.A ND1 SER 862.A OG no hydrogen 2.785 N/A GLN 846.A N ASN 844.A OD1 no hydrogen 2.924 N/A LYS 851.A N ILE 857.A O no hydrogen 2.821 N/A ASP 852.A N ILE 857.A O no hydrogen 3.214 N/A ILE 857.A N ASP 852.A O no hydrogen 3.038 N/A GLU 859.A N GLU 849.A O no hydrogen 3.010 N/A HIS 861.A N TYR 847.A O no hydrogen 2.773 N/A HIS 861.A ND1 SER 862.A O no hydrogen 3.177 N/A SER 862.A OG HIS 845.A ND1 no hydrogen 2.785 N/A GLU 863.A N ASN 844.A O no hydrogen 2.706 N/A ASN 864.A ND2 THR 843.A OG1 no hydrogen 2.660 N/A THR 865.A N THR 594.A OG1 no hydrogen 3.158 N/A THR 865.A OG1 ASN 590.A OD1 no hydrogen 3.242 N/A THR 865.A OG1 THR 593.A OG1 no hydrogen 3.135 N/A THR 865.A OG1 THR 594.A OG1 no hydrogen 2.851 N/A ILE 866.A N ASN 864.A OD1 no hydrogen 2.815 N/A PHE 868.A N ASN 835.A OD1 no hydrogen 2.666 N/A GLU 869.A N ASP 583.A O no hydrogen 2.576 N/A ASP 871.A N HIS 581.A O no hydrogen 2.915 N/A TYR 874.A N ILE 579.A O no hydrogen 2.848 N/A TYR 874.A OH ASP 871.A OD2 no hydrogen 2.661 N/A LYS 875.A N PHE 896.A O no hydrogen 2.919 N/A ALA 876.A N PHE 896.A O no hydrogen 3.421 N/A MET 877.A N PHE 509.A O no hydrogen 2.898 N/A ILE 878.A N ALA 894.A O no hydrogen 2.707 N/A LEU 879.A N GLY 507.A O no hydrogen 2.880 N/A SER 881.A N LYS 1080.A O no hydrogen 3.124 N/A SER 882.A OG GLU 884.A OE2 no hydrogen 3.190 N/A GLU 884.A N SER 882.A OG no hydrogen 3.232 N/A LYS 890.A NZ VAL 501.A O no hydrogen 3.280 N/A LYS 891.A N GLU 797.A OE2 no hydrogen 3.346 N/A LYS 891.A NZ ASP 799.A OD2 no hydrogen 2.747 N/A TYR 893.A N LYS 906.A O no hydrogen 3.209 N/A ALA 894.A N ILE 878.A O no hydrogen 3.017 N/A VAL 895.A N GLU 904.A O no hydrogen 2.791 N/A PHE 896.A N ALA 876.A O no hydrogen 2.992 N/A ASN 897.A N SER 901.A O no hydrogen 2.870 N/A ASP 899.A N ASP 899.A OD1 no hydrogen 2.638 N/A GLY 900.A N ASN 897.A O no hydrogen 2.957 N/A SER 901.A OG ASP 899.A OD1 no hydrogen 3.546 N/A ALA 903.A N VAL 895.A O no hydrogen 2.662 N/A GLU 904.A N VAL 895.A O no hydrogen 3.411 N/A LYS 906.A N TYR 893.A O no hydrogen 2.934 N/A LEU 910.A N GLN 923.A OE1 no hydrogen 3.203 N/A LYS 911.A N PHE 908.A O no hydrogen 3.153 N/A LYS 911.A NZ LEU 905.A O no hydrogen 2.733 N/A ARG 912.A N PHE 908.A O no hydrogen 3.395 N/A ARG 912.A NE GLU 915.A OE2 no hydrogen 3.219 N/A ARG 912.A NH2 GLU 915.A OE2 no hydrogen 3.518 N/A GLN 917.A N CYS 971.A O no hydrogen 3.106 N/A GLN 917.A NE2 ASN 921.A OD1 no hydrogen 2.561 N/A LYS 920.A N LEU 916.A O no hydrogen 3.252 N/A LYS 920.A NZ ARG 912.A O no hydrogen 2.621 N/A LYS 920.A NZ GLY 914.A O no hydrogen 2.683 N/A ASN 921.A N GLN 917.A O no hydrogen 2.898 N/A PHE 922.A N LEU 918.A O no hydrogen 2.783 N/A GLN 923.A N ILE 919.A O no hydrogen 2.610 N/A GLN 923.A NE2 GLU 909.A OE1 no hydrogen 3.085 N/A SER 924.A N LYS 920.A O no hydrogen 2.819 N/A ASP 925.A N PHE 922.A O no hydrogen 2.954 N/A ILE 926.A N PHE 922.A O no hydrogen 2.975 N/A PHE 927.A N GLN 923.A O no hydrogen 3.512 N/A VAL 929.A N ILE 926.A O no hydrogen 2.478 N/A PHE 930.A N PHE 927.A O no hydrogen 3.396 N/A GLU 932.A N VAL 929.A O no hydrogen 2.965 N/A THR 935.A OG1 ASP 934.A O no hydrogen 2.254 N/A CYS 939.A N THR 935.A O no hydrogen 2.507 N/A CYS 939.A SG PHE 930.A O no hydrogen 3.089 N/A CYS 939.A SG GLU 932.A O no hydrogen 3.439 N/A TYR 940.A N LEU 936.A O no hydrogen 3.185 N/A TYR 940.A OH GLN 1089.A OE1 no hydrogen 2.728 N/A SER 941.A N GLU 937.A O no hydrogen 3.219 N/A ALA 942.A N GLY 938.A O no hydrogen 3.299 N/A VAL 943.A N CYS 939.A O no hydrogen 3.227 N/A ALA 944.A N TYR 940.A O no hydrogen 3.105 N/A SER 945.A N SER 941.A O no hydrogen 2.854 N/A CYS 947.A N VAL 943.A O no hydrogen 2.893 N/A CYS 947.A SG VAL 943.A O no hydrogen 3.136 N/A ASN 948.A N ALA 944.A O no hydrogen 2.775 N/A ARG 949.A N SER 945.A O no hydrogen 3.093 N/A TRP 950.A N VAL 946.A O no hydrogen 3.164 N/A LEU 951.A N CYS 947.A O no hydrogen 2.866 N/A ASP 952.A N ASN 948.A O no hydrogen 2.721 N/A VAL 953.A N TRP 950.A O no hydrogen 3.202 N/A ASP 955.A N LEU 951.A O no hydrogen 3.066 N/A SER 956.A N ASP 952.A O no hydrogen 2.691 N/A SER 956.A OG VAL 953.A O no hydrogen 2.762 N/A HIS 957.A N LEU 954.A O no hydrogen 2.984 N/A GLY 958.A N VAL 953.A O no hydrogen 3.225 N/A LEU 959.A N SER 956.A O no hydrogen 3.099 N/A LEU 961.A N GLY 958.A O no hydrogen 3.131 N/A LEU 966.A N GLU 962.A O no hydrogen 2.789 N/A LEU 966.A N ASP 963.A O no hydrogen 3.101 N/A VAL 967.A N ASP 963.A O no hydrogen 3.265 N/A SER 968.A N GLU 964.A O no hydrogen 3.409 N/A SER 968.A OG GLU 964.A O no hydrogen 2.756 N/A LEU 969.A N LEU 966.A O no hydrogen 2.961 N/A ILE 970.A N VAL 967.A O no hydrogen 3.092 N/A CYS 971.A SG GLU 972.A O no hydrogen 3.705 N/A CYS 971.A SG TYR 1015.A O no hydrogen 3.445 N/A GLU 972.A N TYR 1015.A O no hydrogen 3.073 N/A ARG 974.A NE GLU 972.A OE2 no hydrogen 2.841 N/A ARG 974.A NH2 GLU 915.A OE1 no hydrogen 3.160 N/A MET 976.A N LEU 1011.A O no hydrogen 2.927 N/A SER 977.A OG TYR 983.A OH no hydrogen 2.946 N/A LYS 978.A N TYR 983.A OH no hydrogen 2.975 N/A THR 979.A N GLU 982.A OE2 no hydrogen 3.456 N/A THR 979.A OG1 GLU 982.A OE2 no hydrogen 2.518 N/A GLU 982.A N THR 979.A O no hydrogen 3.285 N/A TYR 983.A N LEU 980.A O no hydrogen 2.927 N/A GLN 986.A N TYR 983.A O no hydrogen 3.022 N/A THR 989.A OG1 TYR 1015.A OH no hydrogen 3.022 N/A ILE 991.A N SER 988.A OG no hydrogen 2.860 N/A THR 992.A N SER 988.A O no hydrogen 3.111 N/A THR 992.A OG1 THR 1027.A O no hydrogen 2.561 N/A THR 993.A N THR 989.A O no hydrogen 2.987 N/A THR 993.A OG1 THR 989.A O no hydrogen 2.241 N/A ALA 994.A N SER 990.A O no hydrogen 2.963 N/A ARG 995.A N ILE 991.A O no hydrogen 2.794 N/A ARG 996.A N THR 992.A O no hydrogen 2.690 N/A ARG 996.A NH2 GLU 1028.A O no hydrogen 2.379 N/A LEU 997.A N THR 993.A O no hydrogen 2.622 N/A GLY 998.A N ALA 994.A O no hydrogen 3.033 N/A PHE 1000.A N ARG 996.A O no hydrogen 3.075 N/A LEU 1001.A N LEU 997.A O no hydrogen 3.100 N/A MET 1005.A N GLY 1002.A O no hydrogen 3.088 N/A VAL 1006.A N GLU 1003.A O no hydrogen 3.186 N/A GLY 1010.A N MET 976.A O no hydrogen 2.825 N/A CYS 1013.A N ARG 974.A O no hydrogen 2.801 N/A CYS 1013.A SG SER 990.A O no hydrogen 3.331 N/A CYS 1013.A SG LEU 1011.A O no hydrogen 4.005 N/A TYR 1015.A N GLU 972.A O no hydrogen 3.015 N/A ILE 1016.A N ILE 1031.A O no hydrogen 2.820 N/A ILE 1017.A N TYR 1070.A OH no hydrogen 2.930 N/A SER 1018.A N ARG 1029.A O no hydrogen 2.976 N/A SER 1018.A OG LYS 1020.A O no hydrogen 2.886 N/A SER 1019.A N ILE 1064.A O no hydrogen 2.796 N/A SER 1019.A OG ILE 1065.A O no hydrogen 3.357 N/A LYS 1020.A NZ ASP 1053.A OD2 no hydrogen 3.081 N/A GLU 1028.A N PRO 1025.A O no hydrogen 3.286 N/A ARG 1029.A N VAL 1026.A O no hydrogen 3.105 N/A ARG 1029.A NE SER 1018.A O no hydrogen 3.022 N/A ARG 1029.A NH1 ALA 1024.A O no hydrogen 2.417 N/A ILE 1031.A N ILE 1016.A O no hydrogen 2.705 N/A VAL 1033.A N LYS 1014.A O no hydrogen 3.187 N/A ILE 1035.A N PRO 1032.A O no hydrogen 3.050 N/A SER 1037.A N ALA 1034.A O no hydrogen 3.004 N/A ALA 1038.A N ILE 1035.A O no hydrogen 2.976 N/A LYS 1043.A N ASP 1039.A O no hydrogen 2.527 N/A LYS 1043.A NZ PHE 1036.A O no hydrogen 3.416 N/A ARG 1044.A N ILE 1040.A O no hydrogen 3.056 N/A ARG 1044.A NH2 GLU 1057.A O no hydrogen 2.921 N/A SER 1045.A N PRO 1041.A O no hydrogen 3.472 N/A SER 1045.A OG PRO 1041.A O no hydrogen 2.877 N/A SER 1045.A OG ILE 1042.A O no hydrogen 3.253 N/A PHE 1046.A N ILE 1042.A O no hydrogen 3.477 N/A LEU 1047.A N LYS 1043.A O no hydrogen 2.998 N/A ARG 1048.A N ARG 1044.A O no hydrogen 2.836 N/A ARG 1048.A N SER 1045.A O no hydrogen 3.254 N/A ARG 1048.A NE LEU 1056.A O no hydrogen 2.713 N/A ARG 1048.A NH2 LEU 1056.A O no hydrogen 2.822 N/A ARG 1049.A N SER 1045.A O no hydrogen 3.265 N/A TRP 1050.A N PHE 1046.A O no hydrogen 2.842 N/A THR 1051.A N LEU 1047.A O no hydrogen 3.253 N/A THR 1051.A OG1 LEU 1047.A O no hydrogen 2.235 N/A THR 1051.A OG1 ARG 1048.A O no hydrogen 3.096 N/A LEU 1052.A N ARG 1049.A O no hydrogen 3.170 N/A ASP 1053.A N ARG 1048.A O no hydrogen 2.932 N/A ARG 1062.A NE GLY 958.A O no hydrogen 3.035 N/A ARG 1062.A NH1 ASP 963.A OD1 no hydrogen 2.736 N/A ARG 1062.A NH2 LEU 961.A O no hydrogen 2.618 N/A ARG 1062.A NH2 ASP 963.A OD1 no hydrogen 2.792 N/A THR 1063.A N ASP 1060.A O no hydrogen 2.998 N/A THR 1063.A OG1 ASP 1058.A OD2 no hydrogen 3.565 N/A ILE 1064.A N ILE 1061.A O no hydrogen 3.051 N/A ASP 1066.A N ILE 1017.A O no hydrogen 3.137 N/A TRP 1067.A NE1 ARG 1062.A O no hydrogen 2.926 N/A TYR 1069.A N ASP 1066.A O no hydrogen 2.773 N/A TYR 1069.A N ASP 1066.A OD1 no hydrogen 3.133 N/A TYR 1070.A N ASP 1066.A O no hydrogen 3.386 N/A ARG 1071.A N TRP 1067.A O no hydrogen 2.694 N/A GLU 1072.A N GLY 1068.A O no hydrogen 2.981 N/A ARG 1073.A N TYR 1069.A O no hydrogen 3.015 N/A ARG 1073.A NH1 GLU 972.A OE1 no hydrogen 3.072 N/A ARG 1073.A NH1 TYR 1069.A OH no hydrogen 2.659 N/A LEU 1074.A N TYR 1070.A O no hydrogen 2.861 N/A GLY 1075.A N ARG 1071.A O no hydrogen 2.623 N/A SER 1076.A N GLU 1072.A O no hydrogen 2.773 N/A SER 1076.A OG GLU 1072.A O no hydrogen 3.062 N/A SER 1076.A OG GLU 1072.A OE1 no hydrogen 3.234 N/A ALA 1077.A N ARG 1073.A O no hydrogen 3.186 N/A ILE 1078.A N LEU 1074.A O no hydrogen 3.175 N/A GLN 1079.A N GLY 1075.A O no hydrogen 2.907 N/A GLN 1079.A NE2 GLY 1075.A O no hydrogen 3.550 N/A LYS 1080.A N SER 1076.A O no hydrogen 2.906 N/A ILE 1081.A N ALA 1077.A O no hydrogen 2.987 N/A ILE 1082.A N ILE 1078.A O no hydrogen 2.925 N/A THR 1083.A N ILE 1078.A O no hydrogen 3.038 N/A THR 1083.A OG1 GLN 1079.A O no hydrogen 3.539 N/A ILE 1084.A N GLN 1079.A O no hydrogen 2.878 N/A ALA 1086.A N ILE 1082.A O no hydrogen 2.979 N/A ALA 1087.A N THR 1083.A O no hydrogen 2.995 N/A LEU 1088.A N ILE 1084.A O no hydrogen 3.033 N/A GLN 1089.A N PRO 1085.A O no hydrogen 2.918 N/A GLN 1089.A NE2 VAL 508.A O no hydrogen 2.588 N/A GLY 1090.A N ALA 1087.A O no hydrogen 3.078 N/A VAL 1091.A N ALA 1086.A O no hydrogen 2.745 N/A ASN 1093.A ND2 VAL 1098.A O no hydrogen 2.785 N/A ARG 1097.A NH1 ASP 952.A OD1 no hydrogen 2.361 N/A ARG 1097.A NH2 ASP 955.A OD2 no hydrogen 2.433 N/A VAL 1098.A N VAL 1095.A O no hydrogen 2.973 N/A TRP 1103.A NE1 LYS 883.A O no hydrogen 2.653 N/A LYS 1105.A N PRO 1101.A O no hydrogen 2.885 N/A LYS 1105.A NZ GLU 1099.A OE1 no hydrogen 2.562 N/A ARG 1106.A N ASP 1102.A O no hydrogen 3.013 N/A ARG 1106.A NE ASP 1102.A O no hydrogen 3.390 N/A LYS 1107.A NZ GLU 885.A OE2 no hydrogen 2.813 N/A