*HEADER    CELL ADHESION                           09-APR-18   6CZT              
*TITLE     CS-ROSETTA DETERMINED STRUCTURES OF THE N-TERMINAL DOMAIN OF ALGF FROM
*TITLE    2 P. AERUGINOSA                                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ALGINATE BIOSYNTHESIS PROTEIN ALGF;                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 30-216;                                           
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA (STRAIN ATCC 15692 / DSM 
*SOURCE   3 22644 / CIP 104116 / JCM 14847 / LMG 12228 / 1C / PRS 101 / PAO1);   
*SOURCE   4 ORGANISM_TAXID: 208964;                                              
*SOURCE   5 STRAIN: ATCC 15692 / DSM 22644 / CIP 104116 / JCM 14847 / LMG 12228  
*SOURCE   6 / 1C / PRS 101 / PAO1;                                               
*SOURCE   7 GENE: ALGF, PA3550;                                                  
*SOURCE   8 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   9 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE  10 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) CODONPLUS;                       
*SOURCE  11 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  12 EXPRESSION_SYSTEM_PLASMID: PET24B                                    
*KEYWDS    CARBOHYDRATE ACETYLATION, EPS EXPORT, CELL ADHESION                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    S.TAMMAM,P.L.HOWELL                                                   
*REVDAT   1   17-APR-19 6CZT    0                                                
# Restraints file 1: xeasy.prot
   1 999.000 0.000 N      30
   2  53.231 0.000 CA     30
   3   4.827 0.000 HA     30
   4 999.000 0.000 CB     30
   5 999.000 0.000 HB2    30
   6 999.000 0.000 HB3    30
   7 999.000 0.000 QB     30
   8 999.000 0.000 CG     30
   9 999.000 0.000 HG2    30
  10 999.000 0.000 HG3    30
  11 999.000 0.000 QG     30
  12 999.000 0.000 SD     30
  13 999.000 0.000 QE     30
  14 999.000 0.000 CE     30
  15 999.000 0.000 HE1    30
  16 999.000 0.000 HE2    30
  17 999.000 0.000 HE3    30
  18 172.770 0.000 C      30
  19 120.927 0.000 N      31
  20   8.209 0.000 HN     31
  21  56.546 0.017 CA     31
  22   4.318 0.005 HA     31
  23  30.381 0.021 CB     31
  24   2.037 0.005 HB2    31
  25   1.939 0.007 HB3    31
  26 999.000 0.000 QB     31
  27  36.276 0.054 CG     31
  28 999.000 0.000 HG2    31
  29 999.000 0.000 HG3    31
  30   2.249 0.002 QG     31
  31 999.000 0.000 CD     31
  32 999.000 0.000 OE1    31
  33 999.000 0.000 OE2    31
  34 176.656 0.000 C      31
  35 110.568 0.012 N      32
  36   8.541 0.004 HN     32
  37  45.308 0.000 CA     32
  38   3.945 0.005 HA1    32
  39   3.909 0.000 HA2    32
  40 999.000 0.000 QA     32
  41 173.757 0.000 C      32
  42 123.441 0.012 N      33
  43   8.140 0.006 HN     33
  44  52.481 0.006 CA     33
  45   4.259 0.013 HA     33
  46   1.308 0.009 QB     33
  47  19.474 0.000 CB     33
  48 999.000 0.000 HB1    33
  49 999.000 0.000 HB2    33
  50 999.000 0.000 HB3    33
  51 177.599 0.000 C      33
  52 120.893 0.005 N      34
  53   8.138 0.003 HN     34
  54  55.275 0.005 CA     34
  55   4.218 0.006 HA     34
  56  42.354 0.006 CB     34
  57   1.448 0.004 HB2    34
  58   1.334 0.002 HB3    34
  59 999.000 0.000 QB     34
  60  27.334 0.000 CG     34
  61   1.447 0.014 HG     34
  62   0.826 0.006 QD1    34
  63   0.777 0.004 QD2    34
  64  24.967 0.043 CD1    34
  65 999.000 0.000 HD11   34
  66 999.000 0.000 HD12   34
  67 999.000 0.000 HD13   34
  68  23.705 0.058 CD2    34
  69 999.000 0.000 HD21   34
  70 999.000 0.000 HD22   34
  71 999.000 0.000 HD23   34
  72 999.000 0.000 QQD    34
  73 176.888 0.000 C      34
  74 119.454 0.038 N      35
  75   8.038 0.002 HN     35
  76  57.319 0.004 CA     35
  77   4.629 0.003 HA     35
  78  39.054 0.010 CB     35
  79   3.107 0.004 HB2    35
  80   2.889 0.006 HB3    35
  81 999.000 0.000 QB     35
  82   7.083 0.001 QD     35
  83   6.776 0.000 QE     35
  84 999.000 0.000 QR     35
  85 999.000 0.000 CG     35
  86 133.280 0.004 CD1    35
  87 999.000 0.000 HD1    35
  88 118.150 0.000 CE1    35
  89 999.000 0.000 HE1    35
  90 999.000 0.000 CZ     35
  91 999.000 0.000 CE2    35
  92 999.000 0.000 HE2    35
  93 999.000 0.000 CD2    35
  94 999.000 0.000 HD2    35
  95 999.000 0.000 OH     35
  96 999.000 0.000 HH     35
  97 175.888 0.000 C      35
  98 110.044 0.008 N      36
  99   8.097 0.002 HN     36
 100  44.622 0.012 CA     36
 101 999.000 0.000 HA1    36
 102 999.000 0.000 HA2    36
 103   4.067 0.007 QA     36
 104 175.884 0.000 C      36
 105 999.000 0.000 N      37
 106  49.881 0.028 CD     37
 107  63.122 0.057 CA     37
 108   4.455 0.008 HA     37
 109  32.316 0.047 CB     37
 110   2.356 0.005 HB2    37
 111   2.002 0.012 HB3    37
 112 999.000 0.000 QB     37
 113  27.442 0.011 CG     37
 114 999.000 0.000 HG2    37
 115 999.000 0.000 HG3    37
 116   2.078 0.005 QG     37
 117   3.644 0.011 HD2    37
 118   3.607 0.010 HD3    37
 119 999.000 0.000 QD     37
 120 176.828 0.000 C      37
 121 120.514 0.012 N      38
 122   8.432 0.002 HN     38
 123  54.915 0.047 CA     38
 124   4.263 0.002 HA     38
 125  29.766 0.013 CB     38
 126   1.993 0.007 HB2    38
 127   1.881 0.002 HB3    38
 128 999.000 0.000 QB     38
 129  33.849 0.004 CG     38
 130 999.000 0.000 HG2    38
 131 999.000 0.000 HG3    38
 132   2.328 0.007 QG     38
 133 179.860 0.000 CD     38
 134 999.000 0.000 OE1    38
 135 110.550 0.042 NE2    38
 136   7.794 0.004 HE21   38
 137   7.014 0.003 HE22   38
 138 999.000 0.000 QE2    38
 139 175.138 0.000 C      38
 140 127.209 0.040 N      39
 141   8.201 0.003 HN     39
 142  49.912 0.018 CA     39
 143   3.174 0.013 HA     39
 144   0.835 0.008 QB     39
 145  19.140 0.039 CB     39
 146 999.000 0.000 HB1    39
 147 999.000 0.000 HB2    39
 148 999.000 0.000 HB3    39
 149 175.138 0.000 C      39
 150 999.000 0.000 N      40
 151  51.006 0.041 CD     40
 152  62.197 0.034 CA     40
 153   4.259 0.007 HA     40
 154  32.121 0.050 CB     40
 155   1.563 0.012 HB2    40
 156   2.227 0.007 HB3    40
 157 999.000 0.000 QB     40
 158  27.557 0.025 CG     40
 159   1.872 0.006 HG2    40
 160   1.793 0.009 HG3    40
 161 999.000 0.000 QG     40
 162   2.823 0.008 HD2    40
 163   3.286 0.008 HD3    40
 164 999.000 0.000 QD     40
 165 999.000 0.000 C      40
 166 999.000 0.000 N      41
 167 999.000 0.000 HN     41
 168  58.005 0.043 CA     41
 169   4.075 0.004 HA     41
 170  32.077 0.000 CB     41
 171   1.773 0.012 HB2    41
 172   1.774 0.012 HB3    41
 173 999.000 0.000 QB     41
 174  24.831 0.050 CG     41
 175   1.523 0.008 HG2    41
 176   1.430 0.008 HG3    41
 177 999.000 0.000 QG     41
 178  28.967 0.017 CD     41
 179 999.000 0.000 HD2    41
 180 999.000 0.000 HD3    41
 181   1.676 0.004 QD     41
 182  41.839 0.074 CE     41
 183   2.975 0.006 HE2    41
 184   2.901 0.013 HE3    41
 185 999.000 0.000 QE     41
 186 999.000 0.000 NZ     41
 187 999.000 0.000 HZ1    41
 188 999.000 0.000 HZ2    41
 189 999.000 0.000 HZ3    41
 190 999.000 0.000 QZ     41
 191 177.322 0.000 C      41
 192 114.990 0.029 N      42
 193   8.990 0.006 HN     42
 194  45.224 0.031 CA     42
 195   4.159 0.007 HA1    42
 196   3.699 0.012 HA2    42
 197 999.000 0.000 QA     42
 198 173.944 0.000 C      42
 199 113.585 0.025 N      43
 200   7.349 0.004 HN     43
 201  61.331 0.034 CA     43
 202   4.089 0.009 HA     43
 203  64.406 0.024 CB     43
 204   3.506 0.008 HB2    43
 205   3.177 0.008 HB3    43
 206 999.000 0.000 QB     43
 207 999.000 0.000 OG     43
 208 999.000 0.000 HG     43
 209 173.668 0.000 C      43
 210 124.859 0.017 N      44
 211   8.669 0.002 HN     44
 212  50.573 0.015 CA     44
 213   4.987 0.013 HA     44
 214   1.342 0.008 QB     44
 215  21.841 0.030 CB     44
 216 999.000 0.000 HB1    44
 217 999.000 0.000 HB2    44
 218 999.000 0.000 HB3    44
 219 175.564 0.000 C      44
 220 115.268 0.027 N      45
 221   8.584 0.006 HN     45
 222  56.556 0.019 CA     45
 223   5.376 0.009 HA     45
 224  43.704 0.028 CB     45
 225   2.307 0.010 HB2    45
 226   1.943 0.013 HB3    45
 227 999.000 0.000 QB     45
 228   6.304 0.008 QD     45
 229   6.987 0.008 QE     45
 230 999.000 0.000 QR     45
 231 999.000 0.000 CG     45
 232 999.000 0.000 CD1    45
 233 999.000 0.000 HD1    45
 234 999.000 0.000 CE1    45
 235 999.000 0.000 HE1    45
 236 129.040 0.000 CZ     45
 237   6.911 0.001 HZ     45
 238 130.970 0.035 CE2    45
 239 999.000 0.000 HE2    45
 240 131.539 0.065 CD2    45
 241 999.000 0.000 HD2    45
 242 175.856 0.000 C      45
 243 118.269 0.037 N      46
 244   9.168 0.005 HN     46
 245  59.181 0.065 CA     46
 246   5.747 0.009 HA     46
 247  36.149 0.009 CB     46
 248   1.752 0.007 HB     46
 249   0.794 0.009 QG1    46
 250   0.746 0.008 QG2    46
 251  21.423 0.042 CG1    46
 252 999.000 0.000 HG11   46
 253 999.000 0.000 HG12   46
 254 999.000 0.000 HG13   46
 255  21.629 0.033 CG2    46
 256 999.000 0.000 HG21   46
 257 999.000 0.000 HG22   46
 258 999.000 0.000 HG23   46
 259 999.000 0.000 QQG    46
 260 173.156 0.000 C      46
 261 122.361 0.043 N      47
 262   8.640 0.005 HN     47
 263  53.360 0.032 CA     47
 264   5.647 0.007 HA     47
 265  33.919 0.080 CB     47
 266   1.529 0.007 HB2    47
 267   1.782 0.012 HB3    47
 268 999.000 0.000 QB     47
 269 999.000 0.000 CG     47
 270   1.204 0.011 HG2    47
 271   1.384 0.007 HG3    47
 272 999.000 0.000 QG     47
 273  44.878 0.000 CD     47
 274   2.674 0.013 HD2    47
 275 999.000 0.000 HD3    47
 276 999.000 0.000 QD     47
 277  86.047 0.033 NE     47
 278   7.730 0.007 HE     47
 279 999.000 0.000 CZ     47
 280 999.000 0.000 NH1    47
 281 999.000 0.000 HH11   47
 282 999.000 0.000 HH12   47
 283 999.000 0.000 NH2    47
 284 999.000 0.000 HH21   47
 285 999.000 0.000 HH22   47
 286 999.000 0.000 QH2    47
 287 174.957 0.000 C      47
 288 127.463 0.057 N      48
 289   8.290 0.009 HN     48
 290  49.642 0.006 CA     48
 291   5.490 0.008 HA     48
 292   1.149 0.007 QB     48
 293  23.092 0.055 CB     48
 294 999.000 0.000 HB1    48
 295 999.000 0.000 HB2    48
 296 999.000 0.000 HB3    48
 297 175.271 0.000 C      48
 298 119.893 0.020 N      49
 299   8.777 0.006 HN     49
 300  55.954 0.046 CA     49
 301   4.947 0.010 HA     49
 302  40.523 0.033 CB     49
 303   2.327 0.009 HB2    49
 304   1.934 0.013 HB3    49
 305 999.000 0.000 QB     49
 306   6.466 0.011 QD     49
 307   6.220 0.013 QE     49
 308 999.000 0.000 QR     49
 309 999.000 0.000 CG     49
 310 999.000 0.000 CD1    49
 311 999.000 0.000 HD1    49
 312 999.000 0.000 CE1    49
 313 999.000 0.000 HE1    49
 314 999.000 0.000 CZ     49
 315 116.978 0.003 CE2    49
 316 999.000 0.000 HE2    49
 317 132.534 0.046 CD2    49
 318 999.000 0.000 HD2    49
 319 999.000 0.000 OH     49
 320 999.000 0.000 HH     49
 321 171.969 0.000 C      49
 322 125.670 0.044 N      50
 323   8.121 0.003 HN     50
 324  49.756 0.014 CA     50
 325   4.367 0.010 HA     50
 326  39.552 0.016 CB     50
 327   1.835 0.007 HB2    50
 328   3.396 0.009 HB3    50
 329 999.000 0.000 QB     50
 330 176.533 0.000 CG     50
 331 999.000 0.000 OD1    50
 332 113.217 0.054 ND2    50
 333   7.684 0.008 HD21   50
 334   6.335 0.003 HD22   50
 335 999.000 0.000 QD2    50
 336 172.008 0.000 C      50
 337 124.710 0.036 N      51
 338   7.702 0.007 HN     51
 339  51.416 0.043 CA     51
 340   4.252 0.011 HA     51
 341   1.284 0.007 QB     51
 342  17.857 0.065 CB     51
 343 999.000 0.000 HB1    51
 344 999.000 0.000 HB2    51
 345 999.000 0.000 HB3    51
 346 177.287 0.000 C      51
 347 105.597 0.033 N      52
 348   7.688 0.006 HN     52
 349  44.226 0.006 CA     52
 350   4.093 0.013 HA1    52
 351   3.705 0.008 HA2    52
 352 999.000 0.000 QA     52
 353 171.542 0.000 C      52
 354 110.820 0.018 N      53
 355   7.878 0.004 HN     53
 356  52.833 0.052 CA     53
 357   4.778 0.010 HA     53
 358  39.652 0.015 CB     53
 359   2.791 0.009 HB2    53
 360   2.737 0.006 HB3    53
 361 999.000 0.000 QB     53
 362 177.542 0.000 CG     53
 363 999.000 0.000 OD1    53
 364 112.231 0.055 ND2    53
 365   6.825 0.004 HD21   53
 366   7.536 0.004 HD22   53
 367 999.000 0.000 QD2    53
 368 175.070 0.000 C      53
 369 113.815 0.051 N      54
 370   7.701 0.007 HN     54
 371  56.466 0.016 CA     54
 372   4.621 0.006 HA     54
 373  65.198 0.017 CB     54
 374   3.758 0.006 HB2    54
 375   3.753 0.009 HB3    54
 376 999.000 0.000 QB     54
 377 999.000 0.000 OG     54
 378 999.000 0.000 HG     54
 379 172.892 0.000 C      54
 380 123.690 0.041 N      55
 381   9.084 0.009 HN     55
 382  58.320 0.004 CA     55
 383   4.014 0.006 HA     55
 384  30.098 0.016 CB     55
 385   1.878 0.010 HB2    55
 386   1.781 0.007 HB3    55
 387 999.000 0.000 QB     55
 388  37.085 0.023 CG     55
 389   2.308 0.007 HG2    55
 390   2.085 0.009 HG3    55
 391 999.000 0.000 QG     55
 392 999.000 0.000 CD     55
 393 999.000 0.000 OE1    55
 394 999.000 0.000 OE2    55
 395 174.870 0.000 C      55
 396 123.855 0.023 N      56
 397   8.078 0.007 HN     56
 398  53.855 0.061 CA     56
 399   4.595 0.004 HA     56
 400  47.006 0.052 CB     56
 401   1.213 0.012 HB2    56
 402   1.557 0.008 HB3    56
 403 999.000 0.000 QB     56
 404  27.054 0.054 CG     56
 405   0.525 0.009 HG     56
 406   0.525 0.009 QD1    56
 407   0.739 0.011 QD2    56
 408  27.057 0.053 CD1    56
 409 999.000 0.000 HD11   56
 410 999.000 0.000 HD12   56
 411 999.000 0.000 HD13   56
 412  23.358 0.050 CD2    56
 413 999.000 0.000 HD21   56
 414 999.000 0.000 HD22   56
 415 999.000 0.000 HD23   56
 416 999.000 0.000 QQD    56
 417 173.291 0.000 C      56
 418 123.122 0.042 N      57
 419   8.096 0.003 HN     57
 420  53.001 0.045 CA     57
 421   5.407 0.012 HA     57
 422  42.732 0.028 CB     57
 423   2.622 0.005 HB2    57
 424   2.435 0.007 HB3    57
 425 999.000 0.000 QB     57
 426 999.000 0.000 CG     57
 427 999.000 0.000 OD1    57
 428 999.000 0.000 OD2    57
 429 175.374 0.000 C      57
 430 122.678 0.029 N      58
 431   8.549 0.010 HN     58
 432  59.630 0.006 CA     58
 433   5.123 0.008 HA     58
 434  35.204 0.016 CB     58
 435   2.035 0.005 HB     58
 436   0.858 0.010 QG1    58
 437   0.763 0.011 QG2    58
 438  22.810 0.045 CG1    58
 439 999.000 0.000 HG11   58
 440 999.000 0.000 HG12   58
 441 999.000 0.000 HG13   58
 442  22.154 0.045 CG2    58
 443 999.000 0.000 HG21   58
 444 999.000 0.000 HG22   58
 445 999.000 0.000 HG23   58
 446 999.000 0.000 QQG    58
 447 174.508 0.000 C      58
 448 120.510 0.038 N      59
 449   9.031 0.006 HN     59
 450  57.009 0.029 CA     59
 451   5.119 0.008 HA     59
 452  65.747 0.052 CB     59
 453   3.696 0.009 HB2    59
 454   3.760 0.011 HB3    59
 455 999.000 0.000 QB     59
 456 999.000 0.000 OG     59
 457 999.000 0.000 HG     59
 458 173.100 0.000 C      59
 459 122.436 0.051 N      60
 460   8.571 0.004 HN     60
 461  61.101 0.071 CA     60
 462   3.918 0.007 HA     60
 463  32.272 0.065 CB     60
 464   1.627 0.011 HB     60
 465   0.177 0.009 QG1    60
 466   0.437 0.009 QG2    60
 467  21.084 0.022 CG1    60
 468 999.000 0.000 HG11   60
 469 999.000 0.000 HG12   60
 470 999.000 0.000 HG13   60
 471  20.764 0.036 CG2    60
 472 999.000 0.000 HG21   60
 473 999.000 0.000 HG22   60
 474 999.000 0.000 HG23   60
 475 999.000 0.000 QQG    60
 476 174.674 0.000 C      60
 477 115.605 0.018 N      61
 478   8.655 0.003 HN     61
 479  47.339 0.000 CA     61
 480   3.770 0.014 HA1    61
 481   3.907 0.007 HA2    61
 482 999.000 0.000 QA     61
 483 174.674 0.000 C      61
 484 999.000 0.000 N      62
 485 999.000 0.000 HN     62
 486  58.418 0.000 CA     62
 487   4.410 0.005 HA     62
 488  63.084 0.056 CB     62
 489   4.057 0.005 HB2    62
 490   3.876 0.004 HB3    62
 491 999.000 0.000 QB     62
 492 999.000 0.000 OG     62
 493 999.000 0.000 HG     62
 494 173.984 0.000 C      62
 495 121.504 0.051 N      63
 496   8.079 0.006 HN     63
 497  63.102 0.056 CA     63
 498   4.255 0.007 HA     63
 499  69.232 0.059 CB     63
 500   3.997 0.007 HB     63
 501   0.868 0.006 QG2    63
 502 999.000 0.000 OG1    63
 503   0.861 0.012 HG1    63
 504  21.096 0.035 CG2    63
 505 999.000 0.000 HG21   63
 506 999.000 0.000 HG22   63
 507 999.000 0.000 HG23   63
 508 172.781 0.000 C      63
 509 122.042 0.040 N      64
 510   8.597 0.011 HN     64
 511  57.247 0.094 CA     64
 512   4.889 0.010 HA     64
 513  65.193 0.022 CB     64
 514   3.691 0.008 HB2    64
 515   3.757 0.010 HB3    64
 516 999.000 0.000 QB     64
 517 999.000 0.000 OG     64
 518 999.000 0.000 HG     64
 519 172.566 0.000 C      64
 520 127.305 0.013 N      65
 521   9.014 0.008 HN     65
 522  53.556 0.040 CA     65
 523   4.575 0.008 HA     65
 524  41.387 0.033 CB     65
 525   1.686 0.011 HB2    65
 526   1.242 0.011 HB3    65
 527 999.000 0.000 QB     65
 528  26.969 0.048 CG     65
 529   1.387 0.010 HG     65
 530   0.695 0.008 QD1    65
 531   0.865 0.007 QD2    65
 532  25.515 0.054 CD1    65
 533 999.000 0.000 HD11   65
 534 999.000 0.000 HD12   65
 535 999.000 0.000 HD13   65
 536  24.527 0.073 CD2    65
 537 999.000 0.000 HD21   65
 538 999.000 0.000 HD22   65
 539 999.000 0.000 HD23   65
 540 999.000 0.000 QQD    65
 541 174.079 0.000 C      65
 542 118.176 0.021 N      66
 543   8.147 0.004 HN     66
 544  52.502 0.048 CA     66
 545   5.195 0.011 HA     66
 546  40.760 0.027 CB     66
 547   2.704 0.008 HB2    66
 548   2.512 0.007 HB3    66
 549 999.000 0.000 QB     66
 550 176.251 0.000 CG     66
 551 999.000 0.000 OD1    66
 552 109.711 0.039 ND2    66
 553   7.384 0.003 HD21   66
 554   6.584 0.002 HD22   66
 555 999.000 0.000 QD2    66
 556 175.350 0.000 C      66
 557 118.525 0.032 N      67
 558   9.090 0.005 HN     67
 559  54.726 0.023 CA     67
 560   4.016 0.006 HA     67
 561  39.641 0.047 CB     67
 562   2.712 0.009 HB2    67
 563   2.565 0.008 HB3    67
 564 999.000 0.000 QB     67
 565 999.000 0.000 CG     67
 566 999.000 0.000 OD1    67
 567 999.000 0.000 OD2    67
 568 175.397 0.000 C      67
 569 121.570 0.025 N      68
 570   9.189 0.006 HN     68
 571  63.403 0.026 CA     68
 572   3.710 0.006 HA     68
 573  31.215 0.063 CB     68
 574   1.922 0.010 HB     68
 575   0.766 0.009 QG1    68
 576   0.743 0.012 QG2    68
 577  22.594 0.061 CG1    68
 578 999.000 0.000 HG11   68
 579 999.000 0.000 HG12   68
 580 999.000 0.000 HG13   68
 581  21.314 0.041 CG2    68
 582 999.000 0.000 HG21   68
 583 999.000 0.000 HG22   68
 584 999.000 0.000 HG23   68
 585 999.000 0.000 QQG    68
 586 176.929 0.000 C      68
 587 133.181 0.021 N      69
 588   8.541 0.008 HN     69
 589  51.476 0.063 CA     69
 590   4.254 0.007 HA     69
 591   1.351 0.004 QB     69
 592  18.099 0.066 CB     69
 593 999.000 0.000 HB1    69
 594 999.000 0.000 HB2    69
 595 999.000 0.000 HB3    69
 596 176.929 0.000 C      69
 597 999.000 0.000 N      70
 598  50.659 0.011 CD     70
 599  64.067 0.012 CA     70
 600   3.981 0.010 HA     70
 601  32.092 0.036 CB     70
 602   1.781 0.009 HB2    70
 603   2.091 0.012 HB3    70
 604 999.000 0.000 QB     70
 605  27.806 0.056 CG     70
 606   1.287 0.009 HG2    70
 607   1.978 0.009 HG3    70
 608 999.000 0.000 QG     70
 609   3.330 0.010 HD2    70
 610   3.534 0.009 HD3    70
 611 999.000 0.000 QD     70
 612 177.576 0.000 C      70
 613 122.803 0.037 N      71
 614   8.274 0.006 HN     71
 615  56.840 0.019 CA     71
 616   4.334 0.010 HA     71
 617  38.629 0.020 CB     71
 618   2.104 0.012 HB2    71
 619   1.733 0.011 HB3    71
 620 999.000 0.000 QB     71
 621  27.360 0.043 CG     71
 622   1.470 0.007 HG     71
 623   0.884 0.007 QD1    71
 624   0.800 0.009 QD2    71
 625  25.613 0.030 CD1    71
 626 999.000 0.000 HD11   71
 627 999.000 0.000 HD12   71
 628 999.000 0.000 HD13   71
 629  22.776 0.073 CD2    71
 630 999.000 0.000 HD21   71
 631 999.000 0.000 HD22   71
 632 999.000 0.000 HD23   71
 633 999.000 0.000 QQD    71
 634 176.299 0.000 C      71
 635 109.430 0.035 N      72
 636   8.514 0.008 HN     72
 637  43.886 0.010 CA     72
 638   4.606 0.010 HA1    72
 639   3.608 0.011 HA2    72
 640 999.000 0.000 QA     72
 641 171.268 0.000 C      72
 642 108.857 0.013 N      73
 643   8.310 0.002 HN     73
 644  56.417 0.045 CA     73
 645   5.644 0.008 HA     73
 646  67.665 0.057 CB     73
 647   3.762 0.013 HB2    73
 648   3.877 0.010 HB3    73
 649 999.000 0.000 QB     73
 650 999.000 0.000 OG     73
 651 999.000 0.000 HG     73
 652 174.787 0.000 C      73
 653 116.653 0.017 N      74
 654   8.638 0.006 HN     74
 655  56.816 0.038 CA     74
 656   4.926 0.010 HA     74
 657  67.602 0.035 CB     74
 658   3.708 0.013 HB2    74
 659   3.704 0.010 HB3    74
 660 999.000 0.000 QB     74
 661 999.000 0.000 OG     74
 662 999.000 0.000 HG     74
 663 174.335 0.000 C      74
 664 117.290 0.059 N      75
 665   8.771 0.005 HN     75
 666  52.841 0.053 CA     75
 667   4.811 0.008 HA     75
 668  41.446 0.054 CB     75
 669   2.705 0.008 HB2    75
 670   2.606 0.009 HB3    75
 671 999.000 0.000 QB     75
 672 999.000 0.000 CG     75
 673 999.000 0.000 OD1    75
 674 999.000 0.000 OD2    75
 675 178.136 0.000 C      75
 676 119.401 0.018 N      76
 677   9.338 0.005 HN     76
 678  58.942 0.000 CA     76
 679   4.741 0.008 HA     76
 680  41.414 0.054 CB     76
 681   3.106 0.012 HB2    76
 682   2.980 0.009 HB3    76
 683 999.000 0.000 QB     76
 684   7.195 0.013 QD     76
 685   7.441 0.005 QE     76
 686 999.000 0.000 QR     76
 687 999.000 0.000 CG     76
 688 132.249 0.000 CD1    76
 689 999.000 0.000 HD1    76
 690 132.088 0.025 CE1    76
 691 999.000 0.000 HE1    76
 692 129.031 0.000 CZ     76
 693   6.957 0.003 HZ     76
 694 999.000 0.000 CE2    76
 695 999.000 0.000 HE2    76
 696 999.000 0.000 CD2    76
 697 999.000 0.000 HD2    76
 698 176.883 0.000 C      76
 699 122.964 0.016 N      77
 700   9.194 0.010 HN     77
 701  55.376 0.010 CA     77
 702   4.742 0.012 HA     77
 703  35.799 0.013 CB     77
 704   1.743 0.010 HB2    77
 705   1.405 0.007 HB3    77
 706 999.000 0.000 QB     77
 707  26.384 0.060 CG     77
 708 999.000 0.000 HG2    77
 709 999.000 0.000 HG3    77
 710   1.405 0.009 QG     77
 711  29.527 0.029 CD     77
 712   1.647 0.010 HD2    77
 713   1.544 0.011 HD3    77
 714 999.000 0.000 QD     77
 715  42.135 0.063 CE     77
 716   3.029 0.009 HE2    77
 717   2.979 0.006 HE3    77
 718 999.000 0.000 QE     77
 719 999.000 0.000 NZ     77
 720 999.000 0.000 HZ1    77
 721 999.000 0.000 HZ2    77
 722 999.000 0.000 HZ3    77
 723 999.000 0.000 QZ     77
 724 175.125 0.000 C      77
 725 116.858 0.023 N      78
 726   7.163 0.007 HN     78
 727  54.030 0.025 CA     78
 728   5.506 0.011 HA     78
 729  41.230 0.023 CB     78
 730   2.516 0.007 HB2    78
 731   2.453 0.011 HB3    78
 732 999.000 0.000 QB     78
 733   7.056 0.009 QD     78
 734   7.333 0.015 QE     78
 735 999.000 0.000 QR     78
 736 999.000 0.000 CG     78
 737 132.739 0.070 CD1    78
 738 999.000 0.000 HD1    78
 739 131.435 0.024 CE1    78
 740 999.000 0.000 HE1    78
 741 130.192 0.000 CZ     78
 742   7.237 0.014 HZ     78
 743 999.000 0.000 CE2    78
 744 999.000 0.000 HE2    78
 745 999.000 0.000 CD2    78
 746 999.000 0.000 HD2    78
 747 174.393 0.000 C      78
 748 121.025 0.023 N      79
 749   8.799 0.005 HN     79
 750  54.538 0.037 CA     79
 751   4.624 0.007 HA     79
 752  40.659 0.023 CB     79
 753   1.581 0.007 HB2    79
 754   1.518 0.009 HB3    79
 755 999.000 0.000 QB     79
 756  26.875 0.043 CG     79
 757   1.389 0.006 HG     79
 758   0.478 0.011 QD1    79
 759   0.162 0.007 QD2    79
 760  25.532 0.052 CD1    79
 761 999.000 0.000 HD11   79
 762 999.000 0.000 HD12   79
 763 999.000 0.000 HD13   79
 764  26.901 0.011 CD2    79
 765 999.000 0.000 HD21   79
 766 999.000 0.000 HD22   79
 767 999.000 0.000 HD23   79
 768 999.000 0.000 QQD    79
 769 174.393 0.000 C      79
 770 999.000 0.000 N      80
 771  49.840 0.037 CD     80
 772  61.685 0.017 CA     80
 773   4.532 0.009 HA     80
 774  30.427 0.051 CB     80
 775   2.394 0.006 HB2    80
 776   1.713 0.008 HB3    80
 777 999.000 0.000 QB     80
 778 999.000 0.000 CG     80
 779 999.000 0.000 HG2    80
 780 999.000 0.000 HG3    80
 781 999.000 0.000 QG     80
 782   3.740 0.012 HD2    80
 783   3.556 0.008 HD3    80
 784 999.000 0.000 QD     80
 785 999.000 0.000 C      80
 786 999.000 0.000 N      81
 787  50.662 0.035 CD     81
 788  62.983 0.052 CA     81
 789   4.252 0.009 HA     81
 790  32.120 0.025 CB     81
 791   1.781 0.009 HB2    81
 792   2.079 0.010 HB3    81
 793 999.000 0.000 QB     81
 794  27.869 0.051 CG     81
 795   2.123 0.008 HG2    81
 796   1.984 0.007 HG3    81
 797 999.000 0.000 QG     81
 798   3.563 0.011 HD2    81
 799   3.327 0.011 HD3    81
 800 999.000 0.000 QD     81
 801 175.364 0.000 C      81
 802 107.059 0.024 N      82
 803   8.476 0.002 HN     82
 804  44.246 0.015 CA     82
 805   4.123 0.011 HA1    82
 806   3.709 0.008 HA2    82
 807 999.000 0.000 QA     82
 808 171.590 0.000 C      82
 809 115.746 0.039 N      83
 810   8.010 0.003 HN     83
 811  57.518 0.042 CA     83
 812   5.239 0.006 HA     83
 813  63.523 0.046 CB     83
 814   3.720 0.008 HB2    83
 815   3.544 0.011 HB3    83
 816 999.000 0.000 QB     83
 817 999.000 0.000 OG     83
 818 999.000 0.000 HG     83
 819 173.495 0.000 C      83
 820 120.903 0.033 N      84
 821   8.741 0.004 HN     84
 822  56.315 0.019 CA     84
 823   4.790 0.015 HA     84
 824  44.213 0.041 CB     84
 825   2.851 0.010 HB2    84
 826   2.098 0.008 HB3    84
 827 999.000 0.000 QB     84
 828   6.743 0.006 QD     84
 829   6.621 0.003 QE     84
 830 999.000 0.000 QR     84
 831 999.000 0.000 CG     84
 832 133.319 0.037 CD1    84
 833 999.000 0.000 HD1    84
 834 117.286 0.000 CE1    84
 835 999.000 0.000 HE1    84
 836 999.000 0.000 CZ     84
 837 999.000 0.000 CE2    84
 838 999.000 0.000 HE2    84
 839 999.000 0.000 CD2    84
 840 999.000 0.000 HD2    84
 841 999.000 0.000 OH     84
 842 999.000 0.000 HH     84
 843 175.463 0.000 C      84
 844 118.877 0.041 N      85
 845   9.040 0.004 HN     85
 846  62.836 0.067 CA     85
 847   4.519 0.008 HA     85
 848  68.394 0.054 CB     85
 849   4.003 0.006 HB     85
 850   1.031 0.006 QG2    85
 851 999.000 0.000 OG1    85
 852 999.000 0.000 HG1    85
 853  22.222 0.043 CG2    85
 854 999.000 0.000 HG21   85
 855 999.000 0.000 HG22   85
 856 999.000 0.000 HG23   85
 857 174.237 0.000 C      85
 858 130.936 0.021 N      86
 859   9.103 0.006 HN     86
 860  50.749 0.043 CA     86
 861   4.798 0.012 HA     86
 862   1.222 0.009 QB     86
 863  20.467 0.032 CB     86
 864 999.000 0.000 HB1    86
 865 999.000 0.000 HB2    86
 866 999.000 0.000 HB3    86
 867 175.311 0.000 C      86
 868 123.370 0.052 N      87
 869   9.068 0.010 HN     87
 870  54.527 0.029 CA     87
 871   4.644 0.008 HA     87
 872  28.930 0.015 CB     87
 873   2.101 0.006 HB2    87
 874   1.915 0.010 HB3    87
 875 999.000 0.000 QB     87
 876  33.029 0.072 CG     87
 877 999.000 0.000 HG2    87
 878 999.000 0.000 HG3    87
 879   2.236 0.010 QG     87
 880 180.027 0.000 CD     87
 881 999.000 0.000 OE1    87
 882 111.205 0.028 NE2    87
 883   6.556 0.003 HE21   87
 884   7.299 0.004 HE22   87
 885 999.000 0.000 QE2    87
 886 174.526 0.000 C      87
 887 127.008 0.034 N      88
 888   8.909 0.008 HN     88
 889  60.180 0.043 CA     88
 890   4.261 0.007 HA     88
 891  31.105 0.002 CB     88
 892   2.032 0.009 HB     88
 893   0.728 0.012 QG1    88
 894   0.762 0.009 QG2    88
 895  21.104 0.046 CG1    88
 896 999.000 0.000 HG11   88
 897 999.000 0.000 HG12   88
 898 999.000 0.000 HG13   88
 899  22.147 0.048 CG2    88
 900 999.000 0.000 HG21   88
 901 999.000 0.000 HG22   88
 902 999.000 0.000 HG23   88
 903 999.000 0.000 QQG    88
 904 175.776 0.000 C      88
 905 118.064 0.021 N      89
 906   8.645 0.006 HN     89
 907  47.567 0.046 CA     89
 908   3.991 0.010 HA1    89
 909   3.992 0.011 HA2    89
 910 999.000 0.000 QA     89
 911 175.081 0.000 C      89
 912 125.774 0.044 N      90
 913   9.051 0.012 HN     90
 914  56.129 0.062 CA     90
 915   4.323 0.006 HA     90
 916  28.946 0.011 CB     90
 917   2.363 0.006 HB2    90
 918   1.918 0.003 HB3    90
 919 999.000 0.000 QB     90
 920  34.218 0.015 CG     90
 921   2.365 0.009 HG2    90
 922   2.369 0.008 HG3    90
 923 999.000 0.000 QG     90
 924 180.515 0.000 CD     90
 925 999.000 0.000 OE1    90
 926 113.409 0.017 NE2    90
 927   7.471 0.003 HE21   90
 928   6.826 0.004 HE22   90
 929 999.000 0.000 QE2    90
 930 175.461 0.000 C      90
 931 118.051 0.014 N      91
 932   7.673 0.002 HN     91
 933  54.998 0.000 CA     91
 934   4.662 0.009 HA     91
 935  32.918 0.046 CB     91
 936   2.003 0.007 HB2    91
 937   2.113 0.014 HB3    91
 938 999.000 0.000 QB     91
 939  34.873 0.029 CG     91
 940 999.000 0.000 HG2    91
 941 999.000 0.000 HG3    91
 942   2.335 0.012 QG     91
 943 180.277 0.000 CD     91
 944 999.000 0.000 OE1    91
 945 113.568 0.021 NE2    91
 946   7.056 0.001 HE21   91
 947   7.695 0.006 HE22   91
 948 999.000 0.000 QE2    91
 949 173.927 0.000 C      91
 950 117.181 0.030 N      92
 951   8.612 0.008 HN     92
 952  56.999 0.026 CA     92
 953   5.327 0.007 HA     92
 954  65.261 0.030 CB     92
 955   3.674 0.012 HB2    92
 956   3.676 0.012 HB3    92
 957 999.000 0.000 QB     92
 958 999.000 0.000 OG     92
 959 999.000 0.000 HG     92
 960 173.779 0.000 C      92
 961 123.349 0.014 N      93
 962   8.958 0.007 HN     93
 963  52.595 0.030 CA     93
 964   4.952 0.007 HA     93
 965  46.041 0.046 CB     93
 966   1.616 0.008 HB2    93
 967   1.269 0.009 HB3    93
 968 999.000 0.000 QB     93
 969  26.798 0.072 CG     93
 970   1.278 0.009 HG     93
 971   0.563 0.008 QD1    93
 972   0.893 0.009 QD2    93
 973  26.232 0.029 CD1    93
 974 999.000 0.000 HD11   93
 975 999.000 0.000 HD12   93
 976 999.000 0.000 HD13   93
 977  24.055 0.045 CD2    93
 978 999.000 0.000 HD21   93
 979 999.000 0.000 HD22   93
 980 999.000 0.000 HD23   93
 981 999.000 0.000 QQD    93
 982 173.779 0.000 C      93
 983 999.000 0.000 N      94
 984  51.317 0.027 CD     94
 985  62.776 0.052 CA     94
 986   5.002 0.010 HA     94
 987  31.762 0.030 CB     94
 988   2.329 0.009 HB2    94
 989   1.944 0.015 HB3    94
 990 999.000 0.000 QB     94
 991  27.762 0.045 CG     94
 992   1.960 0.010 HG2    94
 993   2.184 0.008 HG3    94
 994 999.000 0.000 QG     94
 995   3.763 0.009 HD2    94
 996   3.860 0.012 HD3    94
 997 999.000 0.000 QD     94
 998 176.866 0.000 C      94
 999 115.469 0.025 N      95
1000   9.101 0.005 HN     95
1001  58.915 0.055 CA     95
1002   4.727 0.013 HA     95
1003  36.168 0.043 CB     95
1004   1.849 0.008 HB     95
1005   0.833 0.010 QG1    95
1006   0.720 0.011 QG2    95
1007  23.629 0.044 CG1    95
1008 999.000 0.000 HG11   95
1009 999.000 0.000 HG12   95
1010 999.000 0.000 HG13   95
1011  19.852 0.030 CG2    95
1012 999.000 0.000 HG21   95
1013 999.000 0.000 HG22   95
1014 999.000 0.000 HG23   95
1015 999.000 0.000 QQG    95
1016 173.708 0.000 C      95
1017 125.032 0.020 N      96
1018   7.852 0.004 HN     96
1019  55.505 0.049 CA     96
1020   4.747 0.012 HA     96
1021  33.859 0.031 CB     96
1022   1.674 0.009 HB2    96
1023   1.530 0.010 HB3    96
1024 999.000 0.000 QB     96
1025  25.156 0.039 CG     96
1026   1.168 0.007 HG2    96
1027   1.134 0.006 HG3    96
1028 999.000 0.000 QG     96
1029  28.829 0.050 CD     96
1030   1.673 0.010 HD2    96
1031   1.540 0.012 HD3    96
1032 999.000 0.000 QD     96
1033  41.820 0.040 CE     96
1034   2.893 0.009 HE2    96
1035   2.929 0.005 HE3    96
1036 999.000 0.000 QE     96
1037 999.000 0.000 NZ     96
1038 999.000 0.000 HZ1    96
1039 999.000 0.000 HZ2    96
1040 999.000 0.000 HZ3    96
1041 999.000 0.000 QZ     96
1042 173.769 0.000 C      96
1043 124.291 0.027 N      97
1044   8.791 0.003 HN     97
1045  52.530 0.052 CA     97
1046   4.388 0.008 HA     97
1047  42.403 0.042 CB     97
1048   1.139 0.012 HB2    97
1049   1.796 0.011 HB3    97
1050 999.000 0.000 QB     97
1051  27.356 0.056 CG     97
1052   1.434 0.012 HG     97
1053   0.539 0.010 QD1    97
1054  -0.040 0.007 QD2    97
1055  27.233 0.036 CD1    97
1056 999.000 0.000 HD11   97
1057 999.000 0.000 HD12   97
1058 999.000 0.000 HD13   97
1059  22.500 0.026 CD2    97
1060 999.000 0.000 HD21   97
1061 999.000 0.000 HD22   97
1062 999.000 0.000 HD23   97
1063 999.000 0.000 QQD    97
1064 176.102 0.000 C      97
1065 126.305 0.033 N      98
1066   8.879 0.006 HN     98
1067  52.750 0.037 CA     98
1068   5.045 0.011 HA     98
1069  40.290 0.025 CB     98
1070   2.615 0.011 HB2    98
1071   2.704 0.004 HB3    98
1072 999.000 0.000 QB     98
1073 999.000 0.000 CG     98
1074 999.000 0.000 OD1    98
1075 999.000 0.000 OD2    98
1076 176.102 0.000 C      98
1077 999.000 0.000 N      99
1078  50.388 0.026 CD     99
1079  63.307 0.045 CA     99
1080   4.263 0.009 HA     99
1081  32.412 0.031 CB     99
1082 999.000 0.000 HB2    99
1083 999.000 0.000 HB3    99
1084   2.368 0.010 QB     99
1085  27.569 0.000 CG     99
1086 999.000 0.000 HG2    99
1087 999.000 0.000 HG3    99
1088   1.842 0.013 QG     99
1089   3.673 0.010 HD2    99
1090   3.802 0.004 HD3    99
1091 999.000 0.000 QD     99
1092 178.365 0.000 C      99
1093 118.986 0.029 N     100
1094   7.723 0.004 HN    100
1095  55.634 0.008 CA    100
1096   4.485 0.006 HA    100
1097  39.993 0.015 CB    100
1098   2.985 0.009 HB2   100
1099   2.757 0.007 HB3   100
1100 999.000 0.000 QB    100
1101 999.000 0.000 CG    100
1102 999.000 0.000 OD1   100
1103 999.000 0.000 OD2   100
1104 174.388 0.000 C     100
1105 112.417 0.030 N     101
1106   7.100 0.007 HN    101
1107  58.728 0.019 CA    101
1108   4.847 0.008 HA    101
1109  66.266 0.000 CB    101
1110   4.036 0.009 HB2   101
1111   3.664 0.010 HB3   101
1112 999.000 0.000 QB    101
1113 999.000 0.000 OG    101
1114 999.000 0.000 HG    101
1115 170.479 0.000 C     101
1116 122.245 0.062 N     102
1117   8.602 0.005 HN    102
1118  56.503 0.017 CA    102
1119   5.232 0.010 HA    102
1120  40.621 0.006 CB    102
1121   3.063 0.010 HB2   102
1122   2.209 0.014 HB3   102
1123 999.000 0.000 QB    102
1124   5.847 0.015 QD    102
1125   5.817 0.014 QE    102
1126 999.000 0.000 QR    102
1127 999.000 0.000 CG    102
1128 132.051 0.011 CD1   102
1129 999.000 0.000 HD1   102
1130 117.497 0.011 CE1   102
1131 999.000 0.000 HE1   102
1132 999.000 0.000 CZ    102
1133 999.000 0.000 CE2   102
1134 999.000 0.000 HE2   102
1135 999.000 0.000 CD2   102
1136 999.000 0.000 HD2   102
1137 999.000 0.000 OH    102
1138 999.000 0.000 HH    102
1139 176.044 0.000 C     102
1140 117.741 0.024 N     103
1141   8.942 0.006 HN    103
1142  57.138 0.009 CA    103
1143   5.382 0.008 HA    103
1144  44.867 0.037 CB    103
1145   2.932 0.007 HB2   103
1146   2.764 0.010 HB3   103
1147 999.000 0.000 QB    103
1148   7.016 0.010 QD    103
1149   7.188 0.010 QE    103
1150 999.000 0.000 QR    103
1151 999.000 0.000 CG    103
1152 999.000 0.000 CD1   103
1153 999.000 0.000 HD1   103
1154 999.000 0.000 CE1   103
1155 999.000 0.000 HE1   103
1156 999.000 0.000 CZ    103
1157 115.223 0.000 CE2   103
1158 999.000 0.000 HE2   103
1159 132.000 0.010 CD2   103
1160 999.000 0.000 HD2   103
1161 999.000 0.000 OH    103
1162 999.000 0.000 HH    103
1163 174.500 0.000 C     103
1164 119.901 0.009 N     104
1165   9.809 0.004 HN    104
1166  60.834 0.032 CA    104
1167   4.706 0.010 HA    104
1168  70.834 0.007 CB    104
1169   4.249 0.007 HB    104
1170   0.762 0.008 QG2   104
1171 999.000 0.000 OG1   104
1172 999.000 0.000 HG1   104
1173  23.889 0.048 CG2   104
1174 999.000 0.000 HG21  104
1175 999.000 0.000 HG22  104
1176 999.000 0.000 HG23  104
1177 174.129 0.000 C     104
1178 129.229 0.025 N     105
1179   9.462 0.010 HN    105
1180  53.895 0.030 CA    105
1181   5.035 0.007 HA    105
1182  43.230 0.038 CB    105
1183   1.517 0.009 HB2   105
1184   1.202 0.012 HB3   105
1185 999.000 0.000 QB    105
1186  27.588 0.064 CG    105
1187   1.421 0.010 HG    105
1188   0.646 0.009 QD1   105
1189   0.561 0.009 QD2   105
1190  25.713 0.058 CD1   105
1191 999.000 0.000 HD11  105
1192 999.000 0.000 HD12  105
1193 999.000 0.000 HD13  105
1194  26.242 0.039 CD2   105
1195 999.000 0.000 HD21  105
1196 999.000 0.000 HD22  105
1197 999.000 0.000 HD23  105
1198 999.000 0.000 QQD   105
1199 174.692 0.000 C     105
1200 123.990 0.064 N     106
1201   9.163 0.005 HN    106
1202  61.247 0.053 CA    106
1203   4.777 0.010 HA    106
1204  34.740 0.033 CB    106
1205   1.898 0.011 HB    106
1206   1.057 0.011 QG1   106
1207   0.762 0.005 QG2   106
1208  23.605 0.047 CG1   106
1209 999.000 0.000 HG11  106
1210 999.000 0.000 HG12  106
1211 999.000 0.000 HG13  106
1212  20.625 0.046 CG2   106
1213 999.000 0.000 HG21  106
1214 999.000 0.000 HG22  106
1215 999.000 0.000 HG23  106
1216 999.000 0.000 QQG   106
1217 176.128 0.000 C     106
1218 119.570 0.028 N     107
1219   7.790 0.005 HN    107
1220  55.409 0.010 CA    107
1221   4.633 0.006 HA    107
1222  64.783 0.015 CB    107
1223   3.513 0.008 HB2   107
1224   3.234 0.005 HB3   107
1225 999.000 0.000 QB    107
1226 999.000 0.000 OG    107
1227 999.000 0.000 HG    107
1228 173.183 0.000 C     107
1229 124.319 0.027 N     108
1230   8.953 0.006 HN    108
1231  52.298 0.024 CA    108
1232   4.776 0.007 HA    108
1233  30.533 0.031 CB    108
1234   1.719 0.010 HB2   108
1235   1.950 0.011 HB3   108
1236 999.000 0.000 QB    108
1237  33.088 0.041 CG    108
1238   2.241 0.006 HG2   108
1239   2.111 0.008 HG3   108
1240 999.000 0.000 QG    108
1241 179.485 0.000 CD    108
1242 999.000 0.000 OE1   108
1243 111.670 0.036 NE2   108
1244   7.261 0.002 HE21  108
1245   7.383 0.006 HE22  108
1246 999.000 0.000 QE2   108
1247 173.183 0.000 C     108
1248 999.000 0.000 N     109
1249  50.665 0.030 CD    109
1250  63.480 0.024 CA    109
1251   4.315 0.011 HA    109
1252  31.490 0.046 CB    109
1253   2.249 0.008 HB2   109
1254   1.913 0.005 HB3   109
1255 999.000 0.000 QB    109
1256  27.902 0.075 CG    109
1257 999.000 0.000 HG2   109
1258 999.000 0.000 HG3   109
1259   2.112 0.011 QG    109
1260   3.322 0.006 HD2   109
1261   3.569 0.007 HD3   109
1262 999.000 0.000 QD    109
1263 999.000 0.000 C     109
1264 999.000 0.000 N     110
1265 999.000 0.000 HN    110
1266 999.000 0.000 CA    110
1267 999.000 0.000 HA1   110
1268 999.000 0.000 HA2   110
1269   4.268 0.000 QA    110
1270 999.000 0.000 C     110
1271 999.000 0.000 N     111
1272 999.000 0.000 HN    111
1273  43.968 0.068 CA    111
1274   4.486 0.010 HA1   111
1275   3.618 0.004 HA2   111
1276 999.000 0.000 QA    111
1277 172.908 0.000 C     111
1278 121.676 0.031 N     112
1279   8.462 0.002 HN    112
1280  54.491 0.062 CA    112
1281   4.629 0.008 HA    112
1282  32.238 0.043 CB    112
1283   1.900 0.009 HB2   112
1284   1.723 0.009 HB3   112
1285 999.000 0.000 QB    112
1286  25.085 0.061 CG    112
1287 999.000 0.000 HG2   112
1288 999.000 0.000 HG3   112
1289   1.571 0.010 QG    112
1290  28.931 0.000 CD    112
1291   2.100 0.006 HD2   112
1292   2.170 0.000 HD3   112
1293 999.000 0.000 QD    112
1294 999.000 0.000 CE    112
1295 999.000 0.000 HE2   112
1296 999.000 0.000 HE3   112
1297 999.000 0.000 QE    112
1298 999.000 0.000 NZ    112
1299 999.000 0.000 HZ1   112
1300 999.000 0.000 HZ2   112
1301 999.000 0.000 HZ3   112
1302 999.000 0.000 QZ    112
1303 999.000 0.000 C     112
1304 999.000 0.000 N     113
1305  49.924 0.052 CD    113
1306  62.451 0.056 CA    113
1307   5.086 0.009 HA    113
1308  32.217 0.030 CB    113
1309   2.176 0.009 HB2   113
1310   1.717 0.010 HB3   113
1311 999.000 0.000 QB    113
1312  27.872 0.052 CG    113
1313   1.873 0.010 HG2   113
1314   1.831 0.007 HG3   113
1315 999.000 0.000 QG    113
1316 999.000 0.000 HD2   113
1317 999.000 0.000 HD3   113
1318   3.720 0.007 QD    113
1319 174.578 0.000 C     113
1320 114.988 0.008 N     114
1321   8.022 0.002 HN    114
1322  54.643 0.047 CA    114
1323   4.666 0.005 HA    114
1324  34.145 0.056 CB    114
1325   1.753 0.011 HB2   114
1326   1.996 0.011 HB3   114
1327 999.000 0.000 QB    114
1328  34.201 0.026 CG    114
1329   2.263 0.008 HG2   114
1330   2.298 0.007 HG3   114
1331 999.000 0.000 QG    114
1332 180.637 0.000 CD    114
1333 999.000 0.000 OE1   114
1334 112.829 0.018 NE2   114
1335   6.830 0.002 HE21  114
1336   7.570 0.001 HE22  114
1337 999.000 0.000 QE2   114
1338 173.088 0.000 C     114
1339 125.764 0.013 N     115
1340   8.895 0.006 HN    115
1341  54.345 0.015 CA    115
1342   4.738 0.014 HA    115
1343  43.468 0.028 CB    115
1344   2.093 0.009 HB2   115
1345   1.136 0.011 HB3   115
1346 999.000 0.000 QB    115
1347  26.324 0.042 CG    115
1348   0.672 0.008 HG    115
1349   0.670 0.009 QD1   115
1350   0.610 0.008 QD2   115
1351  26.295 0.038 CD1   115
1352 999.000 0.000 HD11  115
1353 999.000 0.000 HD12  115
1354 999.000 0.000 HD13  115
1355  24.291 0.025 CD2   115
1356 999.000 0.000 HD21  115
1357 999.000 0.000 HD22  115
1358 999.000 0.000 HD23  115
1359 999.000 0.000 QQD   115
1360 175.335 0.000 C     115
1361 131.224 0.034 N     116
1362   9.509 0.007 HN    116
1363  61.679 0.056 CA    116
1364   4.435 0.012 HA    116
1365  33.656 0.014 CB    116
1366   2.411 0.007 HB    116
1367   1.036 0.008 QG1   116
1368   0.902 0.013 QG2   116
1369  22.632 0.042 CG1   116
1370 999.000 0.000 HG11  116
1371 999.000 0.000 HG12  116
1372 999.000 0.000 HG13  116
1373  22.474 0.043 CG2   116
1374 999.000 0.000 HG21  116
1375 999.000 0.000 HG22  116
1376 999.000 0.000 HG23  116
1377 999.000 0.000 QQG   116
1378 175.453 0.000 C     116
1379 130.469 0.012 N     117
1380   8.926 0.007 HN    117
1381  53.002 0.054 CA    117
1382   4.328 0.009 HA    117
1383   1.434 0.006 QB    117
1384  19.197 0.053 CB    117
1385 999.000 0.000 HB1   117
1386 999.000 0.000 HB2   117
1387 999.000 0.000 HB3   117
1388 177.022 0.000 C     117
1389 120.762 0.035 N     118
1390   7.995 0.004 HN    118
1391  51.198 0.034 CA    118
1392   4.788 0.011 HA    118
1393  29.974 0.000 CB    118
1394 999.000 0.000 HB2   118
1395 999.000 0.000 HB3   118
1396   2.744 0.012 QB    118
1397 999.000 0.000 CG    118
1398 999.000 0.000 HG2   118
1399 999.000 0.000 HG3   118
1400 999.000 0.000 QG    118
1401 999.000 0.000 CD    118
1402 999.000 0.000 OE1   118
1403 999.000 0.000 OE2   118
1404 177.022 0.000 C     118
1405 999.000 0.000 N     119
1406  49.580 0.029 CD    119
1407 999.000 0.000 CA    119
1408   4.507 0.015 HA    119
1409  32.404 0.018 CB    119
1410 999.000 0.000 HB2   119
1411 999.000 0.000 HB3   119
1412   2.369 0.014 QB    119
1413  27.727 0.020 CG    119
1414 999.000 0.000 HG2   119
1415 999.000 0.000 HG3   119
1416   1.692 0.010 QG    119
1417   3.391 0.011 HD2   119
1418   2.741 0.008 HD3   119
1419 999.000 0.000 QD    119
1420 999.000 0.000 C     119
1421 999.000 0.000 N     120
1422  50.491 0.019 CD    120
1423  62.788 0.042 CA    120
1424   4.170 0.007 HA    120
1425  32.776 0.023 CB    120
1426   1.682 0.010 HB2   120
1427   1.980 0.009 HB3   120
1428 999.000 0.000 QB    120
1429 999.000 0.000 CG    120
1430 999.000 0.000 HG2   120
1431 999.000 0.000 HG3   120
1432 999.000 0.000 QG    120
1433   3.646 0.011 HD2   120
1434   3.773 0.006 HD3   120
1435 999.000 0.000 QD    120
1436 999.000 0.000 C     120
1437 115.446 0.038 N     121
1438   8.504 0.006 HN    121
1439  56.501 0.017 CA    121
1440   4.723 0.004 HA    121
1441  41.642 0.032 CB    121
1442   2.714 0.005 HB2   121
1443   2.535 0.010 HB3   121
1444 999.000 0.000 QB    121
1445   6.753 0.000 QD    121
1446   7.199 0.005 QE    121
1447 999.000 0.000 QR    121
1448 999.000 0.000 CG    121
1449 130.301 0.000 CD1   121
1450 999.000 0.000 HD1   121
1451 131.954 0.000 CE1   121
1452 999.000 0.000 HE1   121
1453 999.000 0.000 CZ    121
1454 999.000 0.000 HZ    121
1455 999.000 0.000 CE2   121
1456 999.000 0.000 HE2   121
1457 999.000 0.000 CD2   121
1458 999.000 0.000 HD2   121
1459 999.000 0.000 C     121
1460 118.067 0.000 N     122
1461   7.674 0.000 HN    122
1462  55.174 0.005 CA    122
1463   4.171 0.002 HA    122
1464  33.299 0.024 CB    122
1465   1.441 0.007 HB2   122
1466   1.720 0.010 HB3   122
1467 999.000 0.000 QB    122
1468  24.701 0.039 CG    122
1469   1.133 0.012 HG2   122
1470   1.134 0.012 HG3   122
1471 999.000 0.000 QG    122
1472  28.829 0.059 CD    122
1473 999.000 0.000 HD2   122
1474 999.000 0.000 HD3   122
1475   1.538 0.010 QD    122
1476  41.713 0.009 CE    122
1477 999.000 0.000 HE2   122
1478 999.000 0.000 HE3   122
1479   2.837 0.007 QE    122
1480 999.000 0.000 NZ    122
1481 999.000 0.000 HZ1   122
1482 999.000 0.000 HZ2   122
1483 999.000 0.000 HZ3   122
1484 999.000 0.000 QZ    122
1485 174.857 0.000 C     122
1486 118.763 0.027 N     123
1487   6.093 0.004 HN    123
1488  52.829 0.013 CA    123
1489   4.304 0.009 HA    123
1490  39.509 0.004 CB    123
1491   2.508 0.002 HB2   123
1492   2.184 0.003 HB3   123
1493 999.000 0.000 QB    123
1494 177.092 0.000 CG    123
1495 999.000 0.000 OD1   123
1496 114.051 0.031 ND2   123
1497   7.872 0.007 HD21  123
1498   6.911 0.003 HD22  123
1499 999.000 0.000 QD2   123
1500 174.421 0.000 C     123
1501 121.249 0.043 N     124
1502   8.287 0.010 HN    124
1503  56.647 0.004 CA    124
1504   4.018 0.007 HA    124
1505  32.653 0.068 CB    124
1506   1.835 0.006 HB2   124
1507   1.890 0.008 HB3   124
1508 999.000 0.000 QB    124
1509  25.064 0.058 CG    124
1510   1.276 0.008 HG2   124
1511   1.337 0.009 HG3   124
1512 999.000 0.000 QG    124
1513  28.712 0.013 CD    124
1514 999.000 0.000 HD2   124
1515 999.000 0.000 HD3   124
1516   1.545 0.005 QD    124
1517  41.845 0.025 CE    124
1518 999.000 0.000 HE2   124
1519 999.000 0.000 HE3   124
1520   2.880 0.012 QE    124
1521 999.000 0.000 NZ    124
1522 999.000 0.000 HZ1   124
1523 999.000 0.000 HZ2   124
1524 999.000 0.000 HZ3   124
1525 999.000 0.000 QZ    124
1526 176.526 0.000 C     124
1527 114.943 0.011 N     125
1528   8.269 0.002 HN    125
1529  56.305 0.024 CA    125
1530   4.394 0.008 HA    125
1531  30.457 0.049 CB    125
1532   2.212 0.008 HB2   125
1533   1.983 0.007 HB3   125
1534 999.000 0.000 QB    125
1535  33.854 0.041 CG    125
1536   2.345 0.008 HG2   125
1537   2.271 0.010 HG3   125
1538 999.000 0.000 QG    125
1539 180.107 0.000 CD    125
1540 999.000 0.000 OE1   125
1541 112.147 0.021 NE2   125
1542   6.816 0.009 HE21  125
1543   7.497 0.006 HE22  125
1544 999.000 0.000 QE2   125
1545 175.903 0.000 C     125
1546 117.842 0.024 N     126
1547   7.334 0.007 HN    126
1548  53.786 0.060 CA    126
1549   4.586 0.007 HA    126
1550  35.759 0.042 CB    126
1551   2.165 0.006 HB2   126
1552   1.573 0.012 HB3   126
1553 999.000 0.000 QB    126
1554  25.366 0.055 CG    126
1555   1.540 0.012 HG2   126
1556   1.258 0.005 HG3   126
1557 999.000 0.000 QG    126
1558  28.719 0.094 CD    126
1559 999.000 0.000 HD2   126
1560 999.000 0.000 HD3   126
1561   1.444 0.005 QD    126
1562  42.029 0.000 CE    126
1563 999.000 0.000 HE2   126
1564 999.000 0.000 HE3   126
1565   2.893 0.004 QE    126
1566 999.000 0.000 NZ    126
1567 999.000 0.000 HZ1   126
1568 999.000 0.000 HZ2   126
1569 999.000 0.000 HZ3   126
1570 999.000 0.000 QZ    126
1571 174.078 0.000 C     126
1572 122.728 0.025 N     127
1573   8.746 0.009 HN    127
1574  50.654 0.032 CA    127
1575   4.952 0.011 HA    127
1576   1.210 0.010 QB    127
1577  23.920 0.071 CB    127
1578 999.000 0.000 HB1   127
1579 999.000 0.000 HB2   127
1580 999.000 0.000 HB3   127
1581 174.689 0.000 C     127
1582 121.230 0.031 N     128
1583   8.208 0.006 HN    128
1584  53.485 0.000 CA    128
1585   4.634 0.014 HA    128
1586  44.625 0.016 CB    128
1587   0.963 0.011 HB2   128
1588  -0.699 0.008 HB3   128
1589 999.000 0.000 QB    128
1590  25.950 0.073 CG    128
1591   0.447 0.010 HG    128
1592   0.828 0.011 QD1   128
1593   0.518 0.009 QD2   128
1594  22.547 0.069 CD1   128
1595 999.000 0.000 HD11  128
1596 999.000 0.000 HD12  128
1597 999.000 0.000 HD13  128
1598  24.312 0.056 CD2   128
1599 999.000 0.000 HD21  128
1600 999.000 0.000 HD22  128
1601 999.000 0.000 HD23  128
1602 999.000 0.000 QQD   128
1603 175.094 0.000 C     128
1604 124.872 0.030 N     129
1605   8.295 0.005 HN    129
1606  59.797 0.042 CA    129
1607   4.804 0.009 HA    129
1608  33.513 0.047 CB    129
1609   1.745 0.011 HB    129
1610   0.783 0.009 QG1   129
1611   0.837 0.010 QG2   129
1612  22.347 0.006 CG1   129
1613 999.000 0.000 HG11  129
1614 999.000 0.000 HG12  129
1615 999.000 0.000 HG13  129
1616  22.478 0.049 CG2   129
1617 999.000 0.000 HG21  129
1618 999.000 0.000 HG22  129
1619 999.000 0.000 HG23  129
1620 999.000 0.000 QQG   129
1621 172.668 0.000 C     129
1622 128.132 0.028 N     130
1623   8.490 0.007 HN    130
1624  52.798 0.040 CA    130
1625   5.485 0.008 HA    130
1626  33.956 0.033 CB    130
1627   1.780 0.009 HB2   130
1628   1.558 0.011 HB3   130
1629 999.000 0.000 QB    130
1630  26.679 0.037 CG    130
1631   1.097 0.015 HG2   130
1632   1.800 0.013 HG3   130
1633 999.000 0.000 QG    130
1634  43.120 0.024 CD    130
1635   2.986 0.013 HD2   130
1636   3.092 0.009 HD3   130
1637 999.000 0.000 QD    130
1638  85.963 0.060 NE    130
1639   9.642 0.006 HE    130
1640 999.000 0.000 CZ    130
1641 999.000 0.000 NH1   130
1642 999.000 0.000 HH11  130
1643 999.000 0.000 HH12  130
1644 999.000 0.000 NH2   130
1645 999.000 0.000 HH21  130
1646 999.000 0.000 HH22  130
1647 999.000 0.000 QH2   130
1648 175.553 0.000 C     130
1649 126.448 0.016 N     131
1650   9.406 0.007 HN    131
1651  61.002 0.055 CA    131
1652   4.478 0.007 HA    131
1653  33.649 0.023 CB    131
1654   1.987 0.007 HB    131
1655   0.819 0.011 QG1   131
1656   0.691 0.013 QG2   131
1657  22.513 0.054 CG1   131
1658 999.000 0.000 HG11  131
1659 999.000 0.000 HG12  131
1660 999.000 0.000 HG13  131
1661  20.141 0.049 CG2   131
1662 999.000 0.000 HG21  131
1663 999.000 0.000 HG22  131
1664 999.000 0.000 HG23  131
1665 999.000 0.000 QQG   131
1666 175.552 0.000 C     131
1667 127.553 0.053 N     132
1668   8.666 0.004 HN    132
1669  54.797 0.039 CA    132
1670   4.549 0.009 HA    132
1671  27.048 0.000 CB    132
1672   1.770 0.000 HB2   132
1673 999.000 0.000 HB3   132
1674 999.000 0.000 QB    132
1675  30.710 0.000 CG    132
1676   2.993 0.000 HG2   132
1677 999.000 0.000 HG3   132
1678 999.000 0.000 QG    132
1679 999.000 0.000 CD    132
1680 999.000 0.000 OE1   132
1681 107.994 0.054 NE2   132
1682   6.993 0.006 HE21  132
1683   5.857 0.013 HE22  132
1684 999.000 0.000 QE2   132
1685 173.309 0.000 C     132
1686 119.558 0.039 N     133
1687   8.345 0.005 HN    133
1688  51.812 0.024 CA    133
1689   4.687 0.012 HA    133
1690  38.625 0.051 CB    133
1691   3.505 0.009 HB2   133
1692   1.961 0.013 HB3   133
1693 999.000 0.000 QB    133
1694 176.104 0.000 CG    133
1695 999.000 0.000 OD1   133
1696 113.593 0.059 ND2   133
1697   6.509 0.007 HD21  133
1698   7.940 0.006 HD22  133
1699 999.000 0.000 QD2   133
1700 173.931 0.000 C     133
1701 127.534 0.028 N     134
1702   8.723 0.007 HN    134
1703  54.396 0.054 CA    134
1704   4.682 0.008 HA    134
1705  40.775 0.025 CB    134
1706   2.106 0.012 HB2   134
1707   1.751 0.008 HB3   134
1708 999.000 0.000 QB    134
1709  28.893 0.019 CG    134
1710   1.750 0.003 HG    134
1711   0.966 0.007 QD1   134
1712   0.880 0.010 QD2   134
1713  25.836 0.046 CD1   134
1714 999.000 0.000 HD11  134
1715 999.000 0.000 HD12  134
1716 999.000 0.000 HD13  134
1717  24.750 0.050 CD2   134
1718 999.000 0.000 HD21  134
1719 999.000 0.000 HD22  134
1720 999.000 0.000 HD23  134
1721 999.000 0.000 QQD   134
1722 176.833 0.000 C     134
1723 120.492 0.030 N     135
1724   8.227 0.005 HN    135
1725  58.060 0.067 CA    135
1726   4.826 0.009 HA    135
1727  66.357 0.038 CB    135
1728   4.040 0.007 HB2   135
1729   3.375 0.012 HB3   135
1730 999.000 0.000 QB    135
1731 999.000 0.000 OG    135
1732 999.000 0.000 HG    135
1733 172.659 0.000 C     135
1734 132.747 0.021 N     136
1735   7.989 0.007 HN    136
1736  45.201 0.035 CA    136
1737   3.694 0.009 HA1   136
1738   4.379 0.012 HA2   136
1739 999.000 0.000 QA    136
1740 175.333 0.000 C     136
1741 118.625 0.023 N     137
1742   8.379 0.008 HN    137
1743  57.925 0.000 CA    137
1744   4.632 0.005 HA    137
1745  65.177 0.022 CB    137
1746   3.387 0.010 HB2   137
1747   3.690 0.013 HB3   137
1748 999.000 0.000 QB    137
1749 999.000 0.000 OG    137
1750 999.000 0.000 HG    137
1751 171.342 0.000 C     137
1752 124.644 0.032 N     138
1753   8.695 0.004 HN    138
1754  55.744 0.029 CA    138
1755   4.573 0.007 HA    138
1756  32.347 0.046 CB    138
1757   1.536 0.009 HB2   138
1758   1.742 0.011 HB3   138
1759 999.000 0.000 QB    138
1760  24.528 0.049 CG    138
1761   1.060 0.006 HG2   138
1762   0.950 0.011 HG3   138
1763 999.000 0.000 QG    138
1764 999.000 0.000 CD    138
1765 999.000 0.000 HD2   138
1766 999.000 0.000 HD3   138
1767 999.000 0.000 QD    138
1768  40.995 0.022 CE    138
1769 999.000 0.000 HE2   138
1770 999.000 0.000 HE3   138
1771   2.838 0.006 QE    138
1772 999.000 0.000 NZ    138
1773 999.000 0.000 HZ1   138
1774 999.000 0.000 HZ2   138
1775 999.000 0.000 HZ3   138
1776 999.000 0.000 QZ    138
1777 176.268 0.000 C     138
1778 125.493 0.020 N     139
1779   7.905 0.006 HN    139
1780  53.902 0.011 CA    139
1781   5.193 0.008 HA    139
1782  46.978 0.000 CB    139
1783   1.308 0.010 HB2   139
1784   1.307 0.010 HB3   139
1785 999.000 0.000 QB    139
1786  27.263 0.000 CG    139
1787   1.430 0.000 HG    139
1788   0.662 0.008 QD1   139
1789   0.671 0.007 QD2   139
1790  27.137 0.054 CD1   139
1791 999.000 0.000 HD11  139
1792 999.000 0.000 HD12  139
1793 999.000 0.000 HD13  139
1794  22.838 0.058 CD2   139
1795 999.000 0.000 HD21  139
1796 999.000 0.000 HD22  139
1797 999.000 0.000 HD23  139
1798 999.000 0.000 QQD   139
1799 175.514 0.000 C     139
1800 116.367 0.022 N     140
1801   9.031 0.008 HN    140
1802  61.319 0.054 CA    140
1803   4.949 0.013 HA    140
1804  73.289 0.061 CB    140
1805   3.933 0.009 HB    140
1806   1.145 0.006 QG2   140
1807 999.000 0.000 OG1   140
1808 999.000 0.000 HG1   140
1809  22.499 0.050 CG2   140
1810 999.000 0.000 HG21  140
1811 999.000 0.000 HG22  140
1812 999.000 0.000 HG23  140
1813 172.174 0.000 C     140
1814 129.855 0.025 N     141
1815   9.560 0.005 HN    141
1816  53.335 0.035 CA    141
1817   5.140 0.013 HA    141
1818  45.864 0.032 CB    141
1819   1.943 0.011 HB2   141
1820   1.087 0.008 HB3   141
1821 999.000 0.000 QB    141
1822  26.979 0.016 CG    141
1823   1.409 0.011 HG    141
1824   0.805 0.007 QD1   141
1825   0.809 0.011 QD2   141
1826  25.568 0.050 CD1   141
1827 999.000 0.000 HD11  141
1828 999.000 0.000 HD12  141
1829 999.000 0.000 HD13  141
1830  23.728 0.070 CD2   141
1831 999.000 0.000 HD21  141
1832 999.000 0.000 HD22  141
1833 999.000 0.000 HD23  141
1834 999.000 0.000 QQD   141
1835 174.796 0.000 C     141
1836 126.478 0.030 N     142
1837   9.156 0.005 HN    142
1838  55.164 0.026 CA    142
1839   5.372 0.011 HA    142
1840  37.640 0.029 CB    142
1841   1.616 0.008 HB2   142
1842   1.675 0.010 HB3   142
1843 999.000 0.000 QB    142
1844  28.742 0.037 CG    142
1845   0.580 0.007 HG2   142
1846  -0.036 0.006 HG3   142
1847 999.000 0.000 QG    142
1848  27.322 0.033 CD    142
1849 999.000 0.000 HD2   142
1850 999.000 0.000 HD3   142
1851   1.455 0.013 QD    142
1852  41.522 0.009 CE    142
1853 999.000 0.000 HE2   142
1854 999.000 0.000 HE3   142
1855   2.124 0.005 QE    142
1856 999.000 0.000 NZ    142
1857 999.000 0.000 HZ1   142
1858 999.000 0.000 HZ2   142
1859 999.000 0.000 HZ3   142
1860 999.000 0.000 QZ    142
1861 176.512 0.000 C     142
1862 109.413 0.051 N     143
1863   8.340 0.007 HN    143
1864  63.417 0.041 CA    143
1865   4.440 0.010 HA    143
1866  69.119 0.043 CB    143
1867   4.724 0.013 HB    143
1868   1.189 0.011 QG2   143
1869 999.000 0.000 OG1   143
1870 999.000 0.000 HG1   143
1871  23.799 0.035 CG2   143
1872 999.000 0.000 HG21  143
1873 999.000 0.000 HG22  143
1874 999.000 0.000 HG23  143
1875 176.984 0.000 C     143
1876 123.679 0.040 N     144
1877   8.263 0.005 HN    144
1878  55.406 0.027 CA    144
1879   3.956 0.007 HA    144
1880   1.298 0.008 QB    144
1881  18.048 0.056 CB    144
1882 999.000 0.000 HB1   144
1883 999.000 0.000 HB2   144
1884 999.000 0.000 HB3   144
1885 177.610 0.000 C     144
1886 113.872 0.049 N     145
1887   7.848 0.010 HN    145
1888  53.570 0.056 CA    145
1889   4.395 0.011 HA    145
1890  40.083 0.012 CB    145
1891   2.999 0.008 HB2   145
1892   2.689 0.006 HB3   145
1893 999.000 0.000 QB    145
1894 999.000 0.000 CG    145
1895 999.000 0.000 OD1   145
1896 999.000 0.000 OD2   145
1897 177.437 0.000 C     145
1898 108.862 0.021 N     146
1899   8.674 0.002 HN    146
1900  45.723 0.016 CA    146
1901   4.012 0.008 HA1   146
1902   3.244 0.009 HA2   146
1903 999.000 0.000 QA    146
1904 174.727 0.000 C     146
1905 118.330 0.035 N     147
1906   8.100 0.003 HN    147
1907  58.261 0.056 CA    147
1908   4.013 0.004 HA    147
1909  33.286 0.018 CB    147
1910   1.708 0.010 HB2   147
1911   1.705 0.013 HB3   147
1912 999.000 0.000 QB    147
1913  28.767 0.060 CG    147
1914   1.543 0.009 HG2   147
1915   1.541 0.008 HG3   147
1916 999.000 0.000 QG    147
1917  25.319 0.045 CD    147
1918   1.220 0.014 HD2   147
1919   1.176 0.003 HD3   147
1920 999.000 0.000 QD    147
1921  41.836 0.040 CE    147
1922 999.000 0.000 HE2   147
1923 999.000 0.000 HE3   147
1924   2.893 0.007 QE    147
1925 999.000 0.000 NZ    147
1926 999.000 0.000 HZ1   147
1927 999.000 0.000 HZ2   147
1928 999.000 0.000 HZ3   147
1929 999.000 0.000 QZ    147
1930 176.982 0.000 C     147
1931 113.507 0.009 N     148
1932   7.219 0.007 HN    148
1933  61.641 0.041 CA    148
1934   4.424 0.007 HA    148
1935  70.372 0.035 CB    148
1936   4.108 0.003 HB    148
1937   1.073 0.007 QG2   148
1938 999.000 0.000 OG1   148
1939 999.000 0.000 HG1   148
1940  21.443 0.054 CG2   148
1941 999.000 0.000 HG21  148
1942 999.000 0.000 HG22  148
1943 999.000 0.000 HG23  148
1944 177.765 0.000 C     148
1945 126.176 0.030 N     149
1946   8.746 0.008 HN    149
1947  55.229 0.024 CA    149
1948   4.479 0.007 HA    149
1949  41.360 0.043 CB    149
1950   2.476 0.011 HB2   149
1951   2.034 0.010 HB3   149
1952 999.000 0.000 QB    149
1953 999.000 0.000 CG    149
1954 999.000 0.000 OD1   149
1955 999.000 0.000 OD2   149
1956 175.173 0.000 C     149
1957 124.478 0.027 N     150
1958   9.000 0.004 HN    150
1959  64.574 0.026 CA    150
1960   3.945 0.010 HA    150
1961  32.638 0.061 CB    150
1962   1.609 0.008 HB    150
1963 999.000 0.000 QG1   150
1964 999.000 0.000 QG2   150
1965  21.318 0.048 CG1   150
1966 999.000 0.000 HG11  150
1967 999.000 0.000 HG12  150
1968 999.000 0.000 HG13  150
1969  21.310 0.048 CG2   150
1970 999.000 0.000 HG21  150
1971 999.000 0.000 HG22  150
1972 999.000 0.000 HG23  150
1973   0.809 0.009 QQG   150
1974 175.549 0.000 C     150
1975 115.605 0.016 N     151
1976   7.620 0.003 HN    151
1977  61.821 0.016 CA    151
1978   4.216 0.008 HA    151
1979  34.652 0.017 CB    151
1980   1.782 0.007 HB    151
1981   0.751 0.011 QG1   151
1982   0.749 0.011 QG2   151
1983  22.069 0.040 CG1   151
1984 999.000 0.000 HG11  151
1985 999.000 0.000 HG12  151
1986 999.000 0.000 HG13  151
1987  21.566 0.055 CG2   151
1988 999.000 0.000 HG21  151
1989 999.000 0.000 HG22  151
1990 999.000 0.000 HG23  151
1991 999.000 0.000 QQG   151
1992 174.098 0.000 C     151
1993 128.009 0.014 N     152
1994   8.978 0.006 HN    152
1995  55.739 0.040 CA    152
1996   4.552 0.008 HA    152
1997  35.803 0.007 CB    152
1998   1.715 0.008 HB2   152
1999   1.455 0.007 HB3   152
2000 999.000 0.000 QB    152
2001  25.035 0.047 CG    152
2002   1.222 0.006 HG2   152
2003   1.181 0.008 HG3   152
2004 999.000 0.000 QG    152
2005  29.217 0.040 CD    152
2006 999.000 0.000 HD2   152
2007 999.000 0.000 HD3   152
2008   1.538 0.007 QD    152
2009  41.787 0.034 CE    152
2010 999.000 0.000 HE2   152
2011 999.000 0.000 HE3   152
2012   2.888 0.008 QE    152
2013 999.000 0.000 NZ    152
2014 999.000 0.000 HZ1   152
2015 999.000 0.000 HZ2   152
2016 999.000 0.000 HZ3   152
2017 999.000 0.000 QZ    152
2018 174.824 0.000 C     152
2019 122.843 0.008 N     153
2020   8.355 0.008 HN    153
2021  55.450 0.019 CA    153
2022   3.740 0.007 HA    153
2023  39.387 0.039 CB    153
2024   2.595 0.007 HB2   153
2025   2.519 0.004 HB3   153
2026 999.000 0.000 QB    153
2027 999.000 0.000 CG    153
2028 999.000 0.000 OD1   153
2029 999.000 0.000 OD2   153
2030 174.212 0.000 C     153
2031 121.232 0.024 N     154
2032   9.296 0.003 HN    154
2033  62.068 0.001 CA    154
2034   3.874 0.008 HA    154
2035  31.084 0.072 CB    154
2036   1.899 0.014 HB    154
2037   0.771 0.011 QG1   154
2038   0.718 0.009 QG2   154
2039  22.641 0.026 CG1   154
2040 999.000 0.000 HG11  154
2041 999.000 0.000 HG12  154
2042 999.000 0.000 HG13  154
2043  22.269 0.040 CG2   154
2044 999.000 0.000 HG21  154
2045 999.000 0.000 HG22  154
2046 999.000 0.000 HG23  154
2047 999.000 0.000 QQG   154
2048 177.189 0.000 C     154
2049 117.420 0.029 N     155
2050   8.756 0.010 HN    155
2051  44.760 0.022 CA    155
2052   3.793 0.010 HA1   155
2053   3.946 0.009 HA2   155
2054 999.000 0.000 QA    155
2055 177.189 0.000 C     155
2056 999.000 0.000 N     156
2057  50.094 0.041 CD    156
2058  63.807 0.052 CA    156
2059   4.051 0.007 HA    156
2060  33.034 0.026 CB    156
2061   2.425 0.007 HB2   156
2062   1.802 0.007 HB3   156
2063 999.000 0.000 QB    156
2064  27.487 0.039 CG    156
2065   1.922 0.009 HG2   156
2066   1.579 0.009 HG3   156
2067 999.000 0.000 QG    156
2068   3.457 0.007 HD2   156
2069   3.147 0.009 HD3   156
2070 999.000 0.000 QD    156
2071 177.632 0.000 C     156
2072 118.922 0.035 N     157
2073   8.109 0.008 HN    157
2074  56.082 0.005 CA    157
2075   4.056 0.004 HA    157
2076  25.445 0.002 CB    157
2077   2.209 0.008 HB2   157
2078   2.323 0.008 HB3   157
2079 999.000 0.000 QB    157
2080  33.462 0.050 CG    157
2081   2.416 0.007 HG2   157
2082   2.280 0.013 HG3   157
2083 999.000 0.000 QG    157
2084 180.544 0.000 CD    157
2085 999.000 0.000 OE1   157
2086 111.753 0.029 NE2   157
2087   7.369 0.008 HE21  157
2088   6.798 0.002 HE22  157
2089 999.000 0.000 QE2   157
2090 174.807 0.000 C     157
2091 112.567 0.012 N     158
2092   7.882 0.003 HN    158
2093  56.833 0.034 CA    158
2094   4.950 0.012 HA    158
2095  65.196 0.027 CB    158
2096   3.730 0.009 HB2   158
2097   3.781 0.011 HB3   158
2098 999.000 0.000 QB    158
2099 999.000 0.000 OG    158
2100 999.000 0.000 HG    158
2101 172.202 0.000 C     158
2102 116.376 0.027 N     159
2103   8.109 0.005 HN    159
2104  54.084 0.008 CA    159
2105   6.011 0.011 HA    159
2106  33.434 0.040 CB    159
2107   2.826 0.015 HB2   159
2108   3.010 0.014 HB3   159
2109 999.000 0.000 QB    159
2110 999.000 0.000 CG    159
2111 999.000 0.000 ND1   159
2112 120.695 0.057 CD2   159
2113 999.000 0.000 HD1   159
2114 999.000 0.000 CE1   159
2115 999.000 0.000 NE2   159
2116   6.929 0.017 HD2   159
2117 999.000 0.000 HE1   159
2118 999.000 0.000 C     159
2119 106.528 0.018 N     160
2120   8.099 0.005 HN    160
2121  45.610 0.046 CA    160
2122   4.247 0.010 HA1   160
2123   3.508 0.011 HA2   160
2124 999.000 0.000 QA    160
2125 170.847 0.000 C     160
2126 122.191 0.037 N     161
2127   8.471 0.004 HN    161
2128  53.349 0.025 CA    161
2129   5.648 0.008 HA    161
2130  45.255 0.013 CB    161
2131   2.519 0.012 HB2   161
2132   2.582 0.008 HB3   161
2133 999.000 0.000 QB    161
2134 999.000 0.000 CG    161
2135 999.000 0.000 OD1   161
2136 999.000 0.000 OD2   161
2137 176.417 0.000 C     161
2138 119.735 0.035 N     162
2139   8.751 0.009 HN    162
2140  55.052 0.035 CA    162
2141   4.426 0.010 HA    162
2142  34.252 0.028 CB    162
2143   1.777 0.007 HB2   162
2144   1.470 0.007 HB3   162
2145 999.000 0.000 QB    162
2146  26.801 0.028 CG    162
2147   1.535 0.013 HG2   162
2148   1.646 0.008 HG3   162
2149 999.000 0.000 QG    162
2150  42.577 0.019 CD    162
2151   3.336 0.005 HD2   162
2152   3.479 0.005 HD3   162
2153 999.000 0.000 QD    162
2154 999.000 0.000 NE    162
2155 999.000 0.000 HE    162
2156 999.000 0.000 CZ    162
2157 999.000 0.000 NH1   162
2158 999.000 0.000 HH11  162
2159 999.000 0.000 HH12  162
2160 999.000 0.000 NH2   162
2161 999.000 0.000 HH21  162
2162 999.000 0.000 HH22  162
2163 999.000 0.000 QH2   162
2164 174.136 0.000 C     162
2165 128.516 0.016 N     163
2166   8.717 0.009 HN    163
2167  55.999 0.010 CA    163
2168   4.961 0.010 HA    163
2169  30.912 0.047 CB    163
2170   2.003 0.006 HB2   163
2171   1.870 0.006 HB3   163
2172 999.000 0.000 QB    163
2173  37.557 0.029 CG    163
2174   2.411 0.008 HG2   163
2175   2.170 0.010 HG3   163
2176 999.000 0.000 QG    163
2177 999.000 0.000 CD    163
2178 999.000 0.000 OE1   163
2179 999.000 0.000 OE2   163
2180 176.482 0.000 C     163
2181 122.983 0.024 N     164
2182   9.049 0.010 HN    164
2183  59.578 0.000 CA    164
2184   4.639 0.010 HA    164
2185  43.196 0.012 CB    164
2186   1.664 0.007 HB    164
2187   0.752 0.011 QG2   164
2188  17.083 0.061 CG2   164
2189 999.000 0.000 HG21  164
2190 999.000 0.000 HG22  164
2191 999.000 0.000 HG23  164
2192  26.459 0.037 CG1   164
2193   1.013 0.006 HG12  164
2194   1.323 0.007 HG13  164
2195 999.000 0.000 QG1   164
2196   0.657 0.005 QD1   164
2197  13.947 0.034 CD1   164
2198 999.000 0.000 HD11  164
2199 999.000 0.000 HD12  164
2200 999.000 0.000 HD13  164
2201 173.799 0.000 C     164
2202 122.173 0.032 N     165
2203   8.182 0.009 HN    165
2204  52.031 0.021 CA    165
2205   4.862 0.007 HA    165
2206  37.175 0.034 CB    165
2207   2.622 0.011 HB2   165
2208   2.741 0.010 HB3   165
2209 999.000 0.000 QB    165
2210 176.297 0.000 CG    165
2211 999.000 0.000 OD1   165
2212 113.592 0.035 ND2   165
2213   7.616 0.005 HD21  165
2214   7.146 0.007 HD22  165
2215 999.000 0.000 QD2   165
2216 173.799 0.000 C     165
2217 999.000 0.000 N     166
2218  50.276 0.037 CD    166
2219  63.632 0.030 CA    166
2220   4.089 0.010 HA    166
2221  30.241 0.021 CB    166
2222   1.668 0.010 HB2   166
2223   2.106 0.009 HB3   166
2224 999.000 0.000 QB    166
2225  28.238 0.049 CG    166
2226 999.000 0.000 HG2   166
2227 999.000 0.000 HG3   166
2228   2.110 0.009 QG    166
2229 999.000 0.000 HD2   166
2230 999.000 0.000 HD3   166
2231   3.703 0.008 QD    166
2232 174.527 0.000 C     166
2233 120.539 0.037 N     167
2234   7.507 0.003 HN    167
2235  59.696 0.045 CA    167
2236   4.455 0.005 HA    167
2237  35.312 0.002 CB    167
2238   2.223 0.010 HB    167
2239   0.734 0.011 QG1   167
2240   0.757 0.007 QG2   167
2241  21.340 0.074 CG1   167
2242 999.000 0.000 HG11  167
2243 999.000 0.000 HG12  167
2244 999.000 0.000 HG13  167
2245  18.818 0.066 CG2   167
2246 999.000 0.000 HG21  167
2247 999.000 0.000 HG22  167
2248 999.000 0.000 HG23  167
2249 999.000 0.000 QQG   167
2250 173.756 0.000 C     167
2251 121.958 0.009 N     168
2252   7.883 0.002 HN    168
2253  55.961 0.042 CA    168
2254   4.968 0.009 HA    168
2255  32.562 0.063 CB    168
2256   1.656 0.007 HB2   168
2257   1.557 0.011 HB3   168
2258 999.000 0.000 QB    168
2259  24.633 0.015 CG    168
2260   1.027 0.007 HG2   168
2261   1.101 0.007 HG3   168
2262 999.000 0.000 QG    168
2263  29.533 0.007 CD    168
2264 999.000 0.000 HD2   168
2265 999.000 0.000 HD3   168
2266   1.544 0.010 QD    168
2267  41.964 0.000 CE    168
2268 999.000 0.000 HE2   168
2269 999.000 0.000 HE3   168
2270 999.000 0.000 QE    168
2271 999.000 0.000 NZ    168
2272 999.000 0.000 HZ1   168
2273 999.000 0.000 HZ2   168
2274 999.000 0.000 HZ3   168
2275 999.000 0.000 QZ    168
2276 176.408 0.000 C     168
2277 121.851 0.041 N     169
2278   8.752 0.005 HN    169
2279  59.522 0.069 CA    169
2280   4.657 0.006 HA    169
2281  35.157 0.032 CB    169
2282   1.817 0.007 HB    169
2283   0.751 0.009 QG1   169
2284   0.780 0.008 QG2   169
2285  21.500 0.056 CG1   169
2286 999.000 0.000 HG11  169
2287 999.000 0.000 HG12  169
2288 999.000 0.000 HG13  169
2289  19.941 0.039 CG2   169
2290 999.000 0.000 HG21  169
2291 999.000 0.000 HG22  169
2292 999.000 0.000 HG23  169
2293 999.000 0.000 QQG   169
2294 173.720 0.000 C     169
2295 124.542 0.034 N     170
2296   8.591 0.004 HN    170
2297  52.711 0.014 CA    170
2298   5.056 0.009 HA    170
2299  39.362 0.039 CB    170
2300 999.000 0.000 HB2   170
2301 999.000 0.000 HB3   170
2302   2.705 0.008 QB    170
2303 176.787 0.000 CG    170
2304 999.000 0.000 OD1   170
2305 111.685 0.040 ND2   170
2306   7.529 0.004 HD21  170
2307   6.746 0.004 HD22  170
2308 999.000 0.000 QD2   170
2309 173.845 0.000 C     170
2310 125.029 0.034 N     171
2311   9.118 0.006 HN    171
2312  53.496 0.088 CA    171
2313   5.119 0.013 HA    171
2314  45.301 0.056 CB    171
2315   1.963 0.011 HB2   171
2316   1.719 0.010 HB3   171
2317 999.000 0.000 QB    171
2318  27.457 0.033 CG    171
2319   1.568 0.009 HG    171
2320   0.781 0.015 QD1   171
2321   0.972 0.007 QD2   171
2322  26.721 0.041 CD1   171
2323 999.000 0.000 HD11  171
2324 999.000 0.000 HD12  171
2325 999.000 0.000 HD13  171
2326  26.612 0.062 CD2   171
2327 999.000 0.000 HD21  171
2328 999.000 0.000 HD22  171
2329 999.000 0.000 HD23  171
2330 999.000 0.000 QQD   171
2331 175.057 0.000 C     171
2332 120.839 0.014 N     172
2333   9.349 0.007 HN    172
2334  51.782 0.018 CA    172
2335   4.793 0.010 HA    172
2336   1.512 0.009 QB    172
2337  24.257 0.064 CB    172
2338 999.000 0.000 HB1   172
2339 999.000 0.000 HB2   172
2340 999.000 0.000 HB3   172
2341 174.246 0.000 C     172
2342 121.462 0.024 N     173
2343   8.480 0.006 HN    173
2344  53.325 0.042 CA    173
2345   5.092 0.011 HA    173
2346  46.266 0.056 CB    173
2347   1.089 0.009 HB2   173
2348   1.628 0.010 HB3   173
2349 999.000 0.000 QB    173
2350  26.464 0.020 CG    173
2351   1.408 0.009 HG    173
2352   0.688 0.009 QD1   173
2353   0.815 0.008 QD2   173
2354  25.663 0.067 CD1   173
2355 999.000 0.000 HD11  173
2356 999.000 0.000 HD12  173
2357 999.000 0.000 HD13  173
2358  23.740 0.072 CD2   173
2359 999.000 0.000 HD21  173
2360 999.000 0.000 HD22  173
2361 999.000 0.000 HD23  173
2362 999.000 0.000 QQD   173
2363 174.688 0.000 C     173
2364 126.714 0.015 N     174
2365   9.739 0.005 HN    174
2366  57.058 0.043 CA    174
2367   4.995 0.012 HA    174
2368  42.739 0.016 CB    174
2369   3.041 0.007 HB2   174
2370   2.833 0.010 HB3   174
2371 999.000 0.000 QB    174
2372   6.932 0.010 QD    174
2373   7.189 0.008 QE    174
2374 999.000 0.000 QR    174
2375 999.000 0.000 CG    174
2376 131.415 0.076 CD1   174
2377 999.000 0.000 HD1   174
2378 129.565 0.000 CE1   174
2379 999.000 0.000 HE1   174
2380 125.034 0.000 CZ    174
2381   6.908 0.009 HZ    174
2382 999.000 0.000 CE2   174
2383 999.000 0.000 HE2   174
2384 999.000 0.000 CD2   174
2385 999.000 0.000 HD2   174
2386 173.591 0.000 C     174
2387 121.534 0.037 N     175
2388   8.874 0.004 HN    175
2389  52.079 0.045 CA    175
2390   4.932 0.008 HA    175
2391  41.487 0.026 CB    175
2392   2.688 0.009 HB2   175
2393   2.246 0.005 HB3   175
2394 999.000 0.000 QB    175
2395 999.000 0.000 CG    175
2396 999.000 0.000 OD1   175
2397 999.000 0.000 OD2   175
2398 177.229 0.000 C     175
2399 113.944 0.015 N     176
2400   8.640 0.004 HN    176
2401  46.941 0.038 CA    176
2402   4.080 0.004 HA1   176
2403   3.652 0.006 HA2   176
2404 999.000 0.000 QA    176
2405 177.229 0.000 C     176
2406 121.605 0.040 N     177
2407   8.987 0.011 HN    177
2408  58.462 0.001 CA    177
2409   4.487 0.007 HA    177
2410  63.744 0.018 CB    177
2411   3.878 0.004 HB2   177
2412   4.010 0.005 HB3   177
2413 999.000 0.000 QB    177
2414 999.000 0.000 OG    177
2415 999.000 0.000 HG    177
2416 174.024 0.000 C     177
2417 123.594 0.042 N     178
2418   8.097 0.008 HN    178
2419  55.026 0.028 CA    178
2420   4.443 0.010 HA    178
2421  34.065 0.035 CB    178
2422   1.886 0.009 HB2   178
2423   1.815 0.007 HB3   178
2424 999.000 0.000 QB    178
2425  24.495 0.069 CG    178
2426   1.362 0.010 HG2   178
2427   1.272 0.005 HG3   178
2428 999.000 0.000 QG    178
2429  28.971 0.015 CD    178
2430 999.000 0.000 HD2   178
2431 999.000 0.000 HD3   178
2432   1.636 0.006 QD    178
2433  41.800 0.031 CE    178
2434 999.000 0.000 HE2   178
2435 999.000 0.000 HE3   178
2436   2.928 0.005 QE    178
2437 999.000 0.000 NZ    178
2438 999.000 0.000 HZ1   178
2439 999.000 0.000 HZ2   178
2440 999.000 0.000 HZ3   178
2441 999.000 0.000 QZ    178
2442 174.600 0.000 C     178
2443 127.762 0.052 N     179
2444   8.667 0.006 HN    179
2445  57.595 0.000 CA    179
2446 999.000 0.000 HA    179
2447  31.323 0.010 CB    179
2448   1.020 0.005 HB2   179
2449   1.419 0.007 HB3   179
2450 999.000 0.000 QB    179
2451  25.162 0.010 CG    179
2452   0.415 0.008 HG2   179
2453   0.722 0.008 HG3   179
2454 999.000 0.000 QG    179
2455  27.899 0.024 CD    179
2456 999.000 0.000 HD2   179
2457 999.000 0.000 HD3   179
2458   2.784 0.009 QD    179
2459 999.000 0.000 CE    179
2460 999.000 0.000 HE2   179
2461 999.000 0.000 HE3   179
2462 999.000 0.000 QE    179
2463 999.000 0.000 NZ    179
2464 999.000 0.000 HZ1   179
2465 999.000 0.000 HZ2   179
2466 999.000 0.000 HZ3   179
2467 999.000 0.000 QZ    179
2468 176.423 0.000 C     179
2469 126.156 0.011 N     180
2470   9.045 0.008 HN    180
2471  62.843 0.009 CA    180
2472   4.069 0.009 HA    180
2473  33.037 0.031 CB    180
2474   1.736 0.010 HB    180
2475   0.824 0.011 QG1   180
2476   0.666 0.009 QG2   180
2477  21.633 0.045 CG1   180
2478 999.000 0.000 HG11  180
2479 999.000 0.000 HG12  180
2480 999.000 0.000 HG13  180
2481  20.780 0.038 CG2   180
2482 999.000 0.000 HG21  180
2483 999.000 0.000 HG22  180
2484 999.000 0.000 HG23  180
2485 999.000 0.000 QQG   180
2486 176.326 0.000 C     180
2487 110.074 0.019 N     181
2488   7.145 0.008 HN    181
2489  58.466 0.044 CA    181
2490   4.451 0.008 HA    181
2491  65.579 0.036 CB    181
2492   3.699 0.008 HB2   181
2493   3.406 0.008 HB3   181
2494 999.000 0.000 QB    181
2495 999.000 0.000 OG    181
2496 999.000 0.000 HG    181
2497 174.088 0.000 C     181
2498 126.451 0.036 N     182
2499   8.739 0.005 HN    182
2500  55.572 0.022 CA    182
2501   4.865 0.011 HA    182
2502  41.388 0.042 CB    182
2503   2.474 0.009 HB2   182
2504   2.715 0.005 HB3   182
2505 999.000 0.000 QB    182
2506 999.000 0.000 CG    182
2507 999.000 0.000 OD1   182
2508 999.000 0.000 OD2   182
2509 175.750 0.000 C     182
2510 121.465 0.048 N     183
2511   8.165 0.005 HN    183
2512  53.329 0.017 CA    183
2513   4.658 0.008 HA    183
2514  42.999 0.032 CB    183
2515   1.883 0.008 HB2   183
2516   1.511 0.009 HB3   183
2517 999.000 0.000 QB    183
2518  27.435 0.019 CG    183
2519   1.395 0.013 HG    183
2520   0.515 0.009 QD1   183
2521   0.557 0.009 QD2   183
2522  27.872 0.037 CD1   183
2523 999.000 0.000 HD11  183
2524 999.000 0.000 HD12  183
2525 999.000 0.000 HD13  183
2526  23.553 0.042 CD2   183
2527 999.000 0.000 HD21  183
2528 999.000 0.000 HD22  183
2529 999.000 0.000 HD23  183
2530 999.000 0.000 QQD   183
2531 177.003 0.000 C     183
2532 122.957 0.041 N     184
2533   8.891 0.002 HN    184
2534  55.309 0.027 CA    184
2535   4.539 0.005 HA    184
2536  32.029 0.044 CB    184
2537   1.893 0.009 HB2   184
2538   2.044 0.012 HB3   184
2539 999.000 0.000 QB    184
2540  29.126 0.040 CG    184
2541   1.866 0.010 HG2   184
2542   1.864 0.009 HG3   184
2543 999.000 0.000 QG    184
2544  25.461 0.076 CD    184
2545   1.720 0.003 HD2   184
2546   1.780 0.007 HD3   184
2547 999.000 0.000 QD    184
2548  41.997 0.028 CE    184
2549 999.000 0.000 HE2   184
2550 999.000 0.000 HE3   184
2551   3.110 0.009 QE    184
2552 999.000 0.000 NZ    184
2553 999.000 0.000 HZ1   184
2554 999.000 0.000 HZ2   184
2555 999.000 0.000 HZ3   184
2556 999.000 0.000 QZ    184
2557 177.003 0.000 C     184
2558 999.000 0.000 N     185
2559  50.750 0.032 CD    185
2560  63.348 0.030 CA    185
2561   4.663 0.006 HA    185
2562  32.208 0.041 CB    185
2563   2.208 0.009 HB2   185
2564   1.668 0.009 HB3   185
2565 999.000 0.000 QB    185
2566  27.697 0.020 CG    185
2567   2.064 0.008 HG2   185
2568   2.063 0.007 HG3   185
2569 999.000 0.000 QG    185
2570   3.971 0.010 HD2   185
2571   3.669 0.006 HD3   185
2572 999.000 0.000 QD    185
2573 175.460 0.000 C     185
2574 118.867 0.032 N     186
2575   7.686 0.006 HN    186
2576  59.317 0.028 CA    186
2577   4.227 0.005 HA    186
2578  35.180 0.001 CB    186
2579   0.751 0.008 HB    186
2580   0.004 0.005 QG1   186
2581  -0.271 0.005 QG2   186
2582  20.593 0.056 CG1   186
2583 999.000 0.000 HG11  186
2584 999.000 0.000 HG12  186
2585 999.000 0.000 HG13  186
2586  19.210 0.054 CG2   186
2587 999.000 0.000 HG21  186
2588 999.000 0.000 HG22  186
2589 999.000 0.000 HG23  186
2590 999.000 0.000 QQG   186
2591 172.439 0.000 C     186
2592 121.648 0.027 N     187
2593   8.465 0.004 HN    187
2594  61.943 0.032 CA    187
2595   4.329 0.013 HA    187
2596  68.814 0.069 CB    187
2597   3.798 0.003 HB    187
2598   0.919 0.007 QG2   187
2599 999.000 0.000 OG1   187
2600 999.000 0.000 HG1   187
2601  21.709 0.060 CG2   187
2602 999.000 0.000 HG21  187
2603 999.000 0.000 HG22  187
2604 999.000 0.000 HG23  187
2605 173.294 0.000 C     187
2606 127.441 0.045 N     188
2607   7.650 0.007 HN    188
2608  54.132 0.018 CA    188
2609   4.331 0.008 HA    188
2610  43.049 0.054 CB    188
2611   1.535 0.013 HB2   188
2612   1.234 0.013 HB3   188
2613 999.000 0.000 QB    188
2614  27.752 0.063 CG    188
2615   1.418 0.009 HG    188
2616   0.652 0.008 QD1   188
2617   0.489 0.007 QD2   188
2618  26.729 0.054 CD1   188
2619 999.000 0.000 HD11  188
2620 999.000 0.000 HD12  188
2621 999.000 0.000 HD13  188
2622  25.546 0.052 CD2   188
2623 999.000 0.000 HD21  188
2624 999.000 0.000 HD22  188
2625 999.000 0.000 HD23  188
2626 999.000 0.000 QQD   188
2627 174.470 0.000 C     188
2628 124.328 0.026 N     189
2629   8.553 0.006 HN    189
2630  49.772 0.039 CA    189
2631   4.489 0.008 HA    189
2632   1.254 0.008 QB    189
2633  21.146 0.043 CB    189
2634 999.000 0.000 HB1   189
2635 999.000 0.000 HB2   189
2636 999.000 0.000 HB3   189
2637 176.788 0.000 C     189
2638 118.848 0.024 N     190
2639   8.419 0.003 HN    190
2640  58.189 0.004 CA    190
2641   3.424 0.008 HA    190
2642  29.847 0.038 CB    190
2643   1.760 0.006 HB2   190
2644   1.646 0.009 HB3   190
2645 999.000 0.000 QB    190
2646  27.832 0.048 CG    190
2647   1.564 0.011 HG2   190
2648   1.614 0.008 HG3   190
2649 999.000 0.000 QG    190
2650  43.509 0.005 CD    190
2651 999.000 0.000 HD2   190
2652 999.000 0.000 HD3   190
2653   3.230 0.005 QD    190
2654 999.000 0.000 NE    190
2655 999.000 0.000 HE    190
2656 999.000 0.000 CZ    190
2657 999.000 0.000 NH1   190
2658 999.000 0.000 HH11  190
2659 999.000 0.000 HH12  190
2660 999.000 0.000 NH2   190
2661 999.000 0.000 HH21  190
2662 999.000 0.000 HH22  190
2663 999.000 0.000 QH2   190
2664 177.438 0.000 C     190
2665 112.700 0.026 N     191
2666   8.688 0.005 HN    191
2667  46.044 0.000 CA    191
2668   4.112 0.016 HA1   191
2669   4.031 0.012 HA2   191
2670 999.000 0.000 QA    191
2671 173.270 0.000 C     191
2672 120.869 0.025 N     192
2673   7.869 0.003 HN    192
2674  55.713 0.035 CA    192
2675   4.442 0.008 HA    192
2676  32.529 0.047 CB    192
2677   2.079 0.007 HB2   192
2678   1.825 0.006 HB3   192
2679 999.000 0.000 QB    192
2680  36.573 0.037 CG    192
2681   2.234 0.008 HG2   192
2682   2.080 0.008 HG3   192
2683 999.000 0.000 QG    192
2684 999.000 0.000 CD    192
2685 999.000 0.000 OE1   192
2686 999.000 0.000 OE2   192
2687 174.391 0.000 C     192
2688 121.232 0.034 N     193
2689   8.292 0.005 HN    193
2690  60.440 0.028 CA    193
2691   4.709 0.011 HA    193
2692  33.438 0.007 CB    193
2693   1.928 0.007 HB    193
2694   0.825 0.009 QG1   193
2695   0.706 0.008 QG2   193
2696  22.538 0.063 CG1   193
2697 999.000 0.000 HG11  193
2698 999.000 0.000 HG12  193
2699 999.000 0.000 HG13  193
2700  21.216 0.041 CG2   193
2701 999.000 0.000 HG21  193
2702 999.000 0.000 HG22  193
2703 999.000 0.000 HG23  193
2704 999.000 0.000 QQG   193
2705 176.908 0.000 C     193
2706 130.453 0.017 N     194
2707   8.981 0.005 HN    194
2708  61.902 0.031 CA    194
2709   4.349 0.009 HA    194
2710  33.514 0.063 CB    194
2711   1.752 0.010 HB    194
2712   0.849 0.009 QG1   194
2713   0.748 0.007 QG2   194
2714  22.474 0.048 CG1   194
2715 999.000 0.000 HG11  194
2716 999.000 0.000 HG12  194
2717 999.000 0.000 HG13  194
2718  22.210 0.036 CG2   194
2719 999.000 0.000 HG21  194
2720 999.000 0.000 HG22  194
2721 999.000 0.000 HG23  194
2722 999.000 0.000 QQG   194
2723 173.841 0.000 C     194
2724 121.453 0.053 N     195
2725   8.234 0.007 HN    195
2726  55.397 0.028 CA    195
2727   5.842 0.009 HA    195
2728  30.198 0.047 CB    195
2729   2.586 0.009 HB2   195
2730   3.101 0.009 HB3   195
2731 999.000 0.000 QB    195
2732 999.000 0.000 SG    195
2733 999.000 0.000 HG    195
2734 173.419 0.000 C     195
2735 127.867 0.025 N     196
2736   9.906 0.003 HN    196
2737  52.966 0.035 CA    196
2738   4.581 0.010 HA    196
2739  41.692 0.026 CB    196
2740   0.950 0.006 HB2   196
2741   1.629 0.010 HB3   196
2742 999.000 0.000 QB    196
2743  27.903 0.036 CG    196
2744   0.348 0.007 HG    196
2745   0.661 0.013 QD1   196
2746  -0.653 0.006 QD2   196
2747  27.052 0.057 CD1   196
2748 999.000 0.000 HD11  196
2749 999.000 0.000 HD12  196
2750 999.000 0.000 HD13  196
2751  21.832 0.034 CD2   196
2752 999.000 0.000 HD21  196
2753 999.000 0.000 HD22  196
2754 999.000 0.000 HD23  196
2755 999.000 0.000 QQD   196
2756 175.809 0.000 C     196
2757 129.672 0.033 N     197
2758   9.041 0.010 HN    197
2759  58.509 0.058 CA    197
2760   4.674 0.009 HA    197
2761  40.972 0.030 CB    197
2762   2.443 0.009 HB2   197
2763   2.367 0.014 HB3   197
2764 999.000 0.000 QB    197
2765   6.625 0.010 QD    197
2766   6.412 0.009 QE    197
2767 999.000 0.000 QR    197
2768 999.000 0.000 CG    197
2769 999.000 0.000 CD1   197
2770 999.000 0.000 HD1   197
2771 999.000 0.000 CE1   197
2772 999.000 0.000 HE1   197
2773 999.000 0.000 CZ    197
2774 117.033 0.029 CE2   197
2775 999.000 0.000 HE2   197
2776 131.923 0.048 CD2   197
2777 999.000 0.000 HD2   197
2778 999.000 0.000 OH    197
2779 999.000 0.000 HH    197
2780 176.104 0.000 C     197
2781 121.515 0.026 N     198
2782   8.247 0.006 HN    198
2783  61.155 0.035 CA    198
2784   4.637 0.008 HA    198
2785  32.895 0.019 CB    198
2786   2.001 0.006 HB    198
2787   0.673 0.008 QG1   198
2788   0.520 0.006 QG2   198
2789  22.822 0.040 CG1   198
2790 999.000 0.000 HG11  198
2791 999.000 0.000 HG12  198
2792 999.000 0.000 HG13  198
2793  20.305 0.069 CG2   198
2794 999.000 0.000 HG21  198
2795 999.000 0.000 HG22  198
2796 999.000 0.000 HG23  198
2797 999.000 0.000 QQG   198
2798 174.661 0.000 C     198
2799 114.726 0.019 N     199
2800   7.363 0.002 HN    199
2801  58.802 0.027 CA    199
2802   4.566 0.011 HA    199
2803  70.775 0.040 CB    199
2804   4.404 0.009 HB    199
2805   1.206 0.012 QG2   199
2806 999.000 0.000 OG1   199
2807 999.000 0.000 HG1   199
2808  22.196 0.027 CG2   199
2809 999.000 0.000 HG21  199
2810 999.000 0.000 HG22  199
2811 999.000 0.000 HG23  199
2812 173.576 0.000 C     199
2813 106.923 0.017 N     200
2814   8.788 0.007 HN    200
2815  44.773 0.038 CA    200
2816   4.436 0.010 HA1   200
2817   4.141 0.007 HA2   200
2818 999.000 0.000 QA    200
2819 173.226 0.000 C     200
2820 113.184 0.038 N     201
2821   7.686 0.004 HN    201
2822  56.813 0.014 CA    201
2823   4.914 0.010 HA    201
2824  67.539 0.022 CB    201
2825   3.708 0.010 HB2   201
2826   4.517 0.011 HB3   201
2827 999.000 0.000 QB    201
2828 999.000 0.000 OG    201
2829 999.000 0.000 HG    201
2830 173.226 0.000 C     201
2831 999.000 0.000 N     202
2832 999.000 0.000 HN    202
2833  45.655 0.045 CA    202
2834   3.812 0.007 HA1   202
2835   4.006 0.004 HA2   202
2836 999.000 0.000 QA    202
2837 173.965 0.000 C     202
2838 106.761 0.007 N     203
2839   7.650 0.001 HN    203
2840  45.020 0.000 CA    203
2841   3.747 0.013 HA1   203
2842   4.044 0.013 HA2   203
2843 999.000 0.000 QA    203
2844 173.832 0.000 C     203
2845 121.554 0.012 N     204
2846   7.724 0.003 HN    204
2847  54.710 0.030 CA    204
2848   4.552 0.008 HA    204
2849  32.997 0.002 CB    204
2850   1.874 0.009 HB2   204
2851   1.748 0.009 HB3   204
2852 999.000 0.000 QB    204
2853  24.617 0.073 CG    204
2854 999.000 0.000 HG2   204
2855 999.000 0.000 HG3   204
2856   1.362 0.011 QG    204
2857  28.929 0.053 CD    204
2858   1.647 0.009 HD2   204
2859   1.651 0.007 HD3   204
2860 999.000 0.000 QD    204
2861  42.151 0.041 CE    204
2862   3.033 0.009 HE2   204
2863   2.975 0.010 HE3   204
2864 999.000 0.000 QE    204
2865 999.000 0.000 NZ    204
2866 999.000 0.000 HZ1   204
2867 999.000 0.000 HZ2   204
2868 999.000 0.000 HZ3   204
2869 999.000 0.000 QZ    204
2870 175.516 0.000 C     204
2871 122.967 0.035 N     205
2872   8.191 0.006 HN    205
2873  54.370 0.038 CA    205
2874   4.726 0.012 HA    205
2875  44.054 0.036 CB    205
2876   0.903 0.009 HB2   205
2877   1.575 0.014 HB3   205
2878 999.000 0.000 QB    205
2879  26.934 0.033 CG    205
2880   1.533 0.012 HG    205
2881   0.726 0.010 QD1   205
2882   0.652 0.010 QD2   205
2883  26.255 0.014 CD1   205
2884 999.000 0.000 HD11  205
2885 999.000 0.000 HD12  205
2886 999.000 0.000 HD13  205
2887  23.415 0.050 CD2   205
2888 999.000 0.000 HD21  205
2889 999.000 0.000 HD22  205
2890 999.000 0.000 HD23  205
2891 999.000 0.000 QQD   205
2892 176.851 0.000 C     205
2893 125.200 0.022 N     206
2894   8.841 0.003 HN    206
2895  49.164 0.012 CA    206
2896   4.921 0.009 HA    206
2897   1.202 0.010 QB    206
2898  19.483 0.042 CB    206
2899 999.000 0.000 HB1   206
2900 999.000 0.000 HB2   206
2901 999.000 0.000 HB3   206
2902 176.851 0.000 C     206
2903 999.000 0.000 N     207
2904  49.828 0.035 CD    207
2905  60.178 0.042 CA    207
2906   5.231 0.007 HA    207
2907  32.141 0.050 CB    207
2908   1.547 0.009 HB2   207
2909   1.639 0.008 HB3   207
2910 999.000 0.000 QB    207
2911  27.081 0.025 CG    207
2912 999.000 0.000 HG2   207
2913 999.000 0.000 HG3   207
2914   2.162 0.008 QG    207
2915   3.733 0.011 HD2   207
2916   3.411 0.009 HD3   207
2917 999.000 0.000 QD    207
2918 176.022 0.000 C     207
2919 128.613 0.014 N     208
2920   9.061 0.007 HN    208
2921  61.458 0.058 CA    208
2922   4.067 0.007 HA    208
2923  37.606 0.020 CB    208
2924   1.926 0.008 HB    208
2925   0.876 0.012 QG1   208
2926   1.031 0.007 QG2   208
2927  22.406 0.049 CG1   208
2928 999.000 0.000 HG11  208
2929 999.000 0.000 HG12  208
2930 999.000 0.000 HG13  208
2931  21.457 0.047 CG2   208
2932 999.000 0.000 HG21  208
2933 999.000 0.000 HG22  208
2934 999.000 0.000 HG23  208
2935 999.000 0.000 QQG   208
2936 175.403 0.000 C     208
2937 126.012 0.022 N     209
2938   8.534 0.003 HN    209
2939  56.713 0.040 CA    209
2940   5.285 0.007 HA    209
2941  30.646 0.033 CB    209
2942   3.155 0.008 HB2   209
2943   2.803 0.007 HB3   209
2944 999.000 0.000 QB    209
2945 999.000 0.000 CG    209
2946 127.590 0.000 CD1   209
2947 999.000 0.000 CD2   209
2948 121.364 0.029 CE3   209
2949 999.000 0.000 CE2   209
2950 127.520 0.030 NE1   209
2951   7.121 0.010 HD1   209
2952   7.363 0.013 HE3   209
2953 122.050 0.000 CZ3   209
2954 115.198 0.002 CZ2   209
2955  10.105 0.003 HE1   209
2956   6.633 0.010 HZ3   209
2957 122.206 0.041 CH2   209
2958   7.379 0.008 HZ2   209
2959   6.714 0.005 HH2   209
2960 176.699 0.000 C     209
2961 127.659 0.020 N     210
2962  10.163 0.004 HN    210
2963  62.663 0.034 CA    210
2964   4.157 0.011 HA    210
2965  33.641 0.054 CB    210
2966   1.815 0.006 HB    210
2967   0.129 0.006 QG1   210
2968   0.566 0.006 QG2   210
2969  21.518 0.034 CG1   210
2970 999.000 0.000 HG11  210
2971 999.000 0.000 HG12  210
2972 999.000 0.000 HG13  210
2973  19.245 0.049 CG2   210
2974 999.000 0.000 HG21  210
2975 999.000 0.000 HG22  210
2976 999.000 0.000 HG23  210
2977 999.000 0.000 QQG   210
2978 174.905 0.000 C     210
2979 129.212 0.021 N     211
2980   8.647 0.005 HN    211
2981  54.340 0.033 CA    211
2982   4.860 0.012 HA    211
2983  36.511 0.035 CB    211
2984   1.683 0.005 HB2   211
2985   1.855 0.010 HB3   211
2986 999.000 0.000 QB    211
2987  24.539 0.044 CG    211
2988 999.000 0.000 HG2   211
2989 999.000 0.000 HG3   211
2990   1.402 0.009 QG    211
2991  29.537 0.011 CD    211
2992 999.000 0.000 HD2   211
2993 999.000 0.000 HD3   211
2994   1.546 0.009 QD    211
2995  41.469 0.049 CE    211
2996   2.844 0.007 HE2   211
2997   2.890 0.009 HE3   211
2998 999.000 0.000 QE    211
2999 999.000 0.000 NZ    211
3000 999.000 0.000 HZ1   211
3001 999.000 0.000 HZ2   211
3002 999.000 0.000 HZ3   211
3003 999.000 0.000 QZ    211
3004 174.692 0.000 C     211
3005 123.764 0.056 N     212
3006   9.164 0.003 HN    212
3007  54.868 0.057 CA    212
3008   4.769 0.010 HA    212
3009  30.300 0.007 CB    212
3010   2.031 0.010 HB2   212
3011   1.743 0.015 HB3   212
3012 999.000 0.000 QB    212
3013  20.788 0.000 CG    212
3014 999.000 0.000 HG2   212
3015 999.000 0.000 HG3   212
3016   1.037 0.001 QG    212
3017  44.055 0.009 CD    212
3018   3.379 0.003 HD2   212
3019   3.499 0.005 HD3   212
3020 999.000 0.000 QD    212
3021 999.000 0.000 NE    212
3022 999.000 0.000 HE    212
3023 999.000 0.000 CZ    212
3024 999.000 0.000 NH1   212
3025 999.000 0.000 HH11  212
3026 999.000 0.000 HH12  212
3027 999.000 0.000 NH2   212
3028 999.000 0.000 HH21  212
3029 999.000 0.000 HH22  212
3030 999.000 0.000 QH2   212
3031 174.692 0.000 C     212
3032 999.000 0.000 N     213
3033  50.110 0.018 CD    213
3034  62.799 0.053 CA    213
3035   4.510 0.003 HA    213
3036  31.769 0.025 CB    213
3037   2.330 0.004 HB2   213
3038   1.955 0.013 HB3   213
3039 999.000 0.000 QB    213
3040  27.875 0.010 CG    213
3041   2.146 0.008 HG2   213
3042   2.144 0.009 HG3   213
3043 999.000 0.000 QG    213
3044   3.757 0.005 HD2   213
3045   3.463 0.011 HD3   213
3046 999.000 0.000 QD    213
3047 176.277 0.000 C     213
3048 120.082 0.010 N     214
3049   8.149 0.002 HN    214
3050  61.584 0.070 CA    214
3051   4.135 0.010 HA    214
3052  33.202 0.015 CB    214
3053   2.032 0.007 HB    214
3054   0.889 0.012 QG1   214
3055   0.892 0.012 QG2   214
3056  21.427 0.005 CG1   214
3057 999.000 0.000 HG11  214
3058 999.000 0.000 HG12  214
3059 999.000 0.000 HG13  214
3060  20.538 0.029 CG2   214
3061 999.000 0.000 HG21  214
3062 999.000 0.000 HG22  214
3063 999.000 0.000 HG23  214
3064 999.000 0.000 QQG   214
3065 176.201 0.000 C     214
3066 125.722 0.012 N     215
3067   8.423 0.008 HN    215
3068  56.348 0.034 CA    215
3069   4.273 0.004 HA    215
3070  32.987 0.016 CB    215
3071   1.804 0.007 HB2   215
3072   1.746 0.010 HB3   215
3073 999.000 0.000 QB    215
3074  24.824 0.048 CG    215
3075 999.000 0.000 HG2   215
3076 999.000 0.000 HG3   215
3077   1.422 0.010 QG    215
3078  28.952 0.073 CD    215
3079 999.000 0.000 HD2   215
3080 999.000 0.000 HD3   215
3081   1.667 0.011 QD    215
3082  41.841 0.032 CE    215
3083 999.000 0.000 HE2   215
3084 999.000 0.000 HE3   215
3085   2.974 0.006 QE    215
3086 999.000 0.000 NZ    215
3087 999.000 0.000 HZ1   215
3088 999.000 0.000 HZ2   215
3089 999.000 0.000 HZ3   215
3090 999.000 0.000 QZ    215
3091 176.246 0.000 C     215
3092 125.502 0.012 N     216
3093   8.381 0.004 HN    216
3094  52.590 0.021 CA    216
3095   4.262 0.004 HA    216
3096   1.353 0.009 QB    216
3097  19.407 0.000 CB    216
3098 999.000 0.000 HB1   216
3099 999.000 0.000 HB2   216
3100 999.000 0.000 HB3   216
3101 177.369 0.000 C     216
3102 119.376 0.030 N     217
3103   8.284 0.002 HN    217
3104  54.265 0.034 CA    217
3105   4.555 0.005 HA    217
3106  40.999 0.027 CB    217
3107   2.617 0.008 HB2   217
3108   2.704 0.005 HB3   217
3109 999.000 0.000 QB    217
3110 999.000 0.000 CG    217
3111 999.000 0.000 OD1   217
3112 999.000 0.000 OD2   217
3113 176.367 0.000 C     217
3114 121.780 0.045 N     218
3115   8.086 0.004 HN    218
3116  55.335 0.004 CA    218
3117   4.249 0.006 HA    218
3118  42.262 0.003 CB    218
3119   1.525 0.003 HB2   218
3120   1.601 0.005 HB3   218
3121 999.000 0.000 QB    218
3122  27.102 0.021 CG    218
3123   1.599 0.011 HG    218
3124   0.882 0.011 QD1   218
3125   0.824 0.004 QD2   218
3126  25.233 0.008 CD1   218
3127 999.000 0.000 HD11  218
3128 999.000 0.000 HD12  218
3129 999.000 0.000 HD13  218
3130  23.605 0.036 CD2   218
3131 999.000 0.000 HD21  218
3132 999.000 0.000 HD22  218
3133 999.000 0.000 HD23  218
3134 999.000 0.000 QQD   218
3135 177.535 0.000 C     218
3136 120.262 0.060 N     219
3137   8.218 0.002 HN    219
3138  56.689 0.005 CA    219
3139   4.128 0.010 HA    219
3140  30.146 0.010 CB    219
3141 999.000 0.000 HB2   219
3142 999.000 0.000 HB3   219
3143   1.857 0.008 QB    219
3144  36.276 0.009 CG    219
3145   2.176 0.001 HG2   219
3146   2.095 0.008 HG3   219
3147 999.000 0.000 QG    219
3148 999.000 0.000 CD    219
3149 999.000 0.000 OE1   219
3150 999.000 0.000 OE2   219
3151 176.266 0.000 C     219
3152 119.284 0.025 N     220
3153   8.148 0.005 HN    220
3154  55.977 0.000 CA    220
3155   4.530 0.011 HA    220
3156  30.395 0.009 CB    220
3157   3.019 0.007 HB2   220
3158   2.956 0.002 HB3   220
3159 999.000 0.000 QB    220
3160 999.000 0.000 CG    220
3161 999.000 0.000 ND1   220
3162 119.615 0.000 CD2   220
3163 999.000 0.000 HD1   220
3164 999.000 0.000 CE1   220
3165 999.000 0.000 NE2   220
3166   0.264 0.000 HD2   220
3167 999.000 0.000 HE1   220
3168 999.000 0.000 C     220
3169 125.487 0.013 N     221
3170   8.025 0.001 HN    221
3171  57.407 0.000 CA    221
3172   4.770 0.000 HA    221
3173  46.978 0.000 CB    221
3174 999.000 0.000 HB2   221
3175 999.000 0.000 HB3   221
3176   3.010 0.000 QB    221
3177 999.000 0.000 CG    221
3178 999.000 0.000 ND1   221
3179 119.959 0.000 CD2   221
3180 999.000 0.000 HD1   221
3181 999.000 0.000 CE1   221
3182 999.000 0.000 NE2   221
3183   7.000 0.000 HD2   221
3184 999.000 0.000 HE1   221
3185 999.000 0.000 C     221
3186 126.000 0.000 N     222
3187   8.012 0.000 HN    222
3188  57.290 0.016 CA    222
3189   4.387 0.001 HA    222
3190  30.518 0.003 CB    222
3191   3.160 0.003 HB2   222
3192   3.015 0.001 HB3   222
3193 999.000 0.000 QB    222
3194 999.000 0.000 CG    222
3195 999.000 0.000 ND1   222
3196 999.000 0.000 CD2   222
3197 999.000 0.000 HD1   222
3198 999.000 0.000 CE1   222
3199 999.000 0.000 NE2   222
3200 999.000 0.000 HD2   222
3201 999.000 0.000 HE1   222
3202 999.000 0.000 C     222
3203 999.000 0.000 N     223
3204 999.000 0.000 HN    223
3205 999.000 0.000 CA    223
3206 999.000 0.000 HA    223
3207 999.000 0.000 CB    223
3208 999.000 0.000 HB2   223
3209 999.000 0.000 HB3   223
3210 999.000 0.000 QB    223
3211 999.000 0.000 CG    223
3212 999.000 0.000 ND1   223
3213 999.000 0.000 CD2   223
3214 999.000 0.000 HD1   223
3215 999.000 0.000 CE1   223
3216 999.000 0.000 NE2   223
3217 999.000 0.000 HD2   223
3218 999.000 0.000 HE1   223
3219 999.000 0.000 C     223
3220 999.000 0.000 N     224
3221 999.000 0.000 HN    224
3222 999.000 0.000 CA    224
3223 999.000 0.000 HA    224
3224 999.000 0.000 CB    224
3225 999.000 0.000 HB2   224
3226 999.000 0.000 HB3   224
3227 999.000 0.000 QB    224
3228 999.000 0.000 CG    224
3229 999.000 0.000 ND1   224
3230 999.000 0.000 CD2   224
3231 999.000 0.000 HD1   224
3232 999.000 0.000 CE1   224
3233 999.000 0.000 NE2   224
3234 999.000 0.000 HD2   224
3235 999.000 0.000 HE1   224
3236 999.000 0.000 C     224
3237 999.000 0.000 N     225
3238 999.000 0.000 HN    225
3239 999.000 0.000 CA    225
3240 999.000 0.000 HA    225
3241 999.000 0.000 CB    225
3242 999.000 0.000 HB2   225
3243 999.000 0.000 HB3   225
3244 999.000 0.000 QB    225
3245 999.000 0.000 CG    225
3246 999.000 0.000 ND1   225
3247 999.000 0.000 CD2   225
3248 999.000 0.000 HD1   225
3249 999.000 0.000 CE1   225
3250 999.000 0.000 NE2   225
3251 999.000 0.000 HD2   225
3252 999.000 0.000 HE1   225
3253 999.000 0.000 C     225
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    GLN  38          1H        GLN  38  -0.642  -0.555  -0.978
    2    HA   GLN  38           HA       GLN  38   1.503  -0.496   0.018
    3    HB2  GLN  38          1HB       GLN  38   1.321  -1.301  -2.284
    4    HB3  GLN  38          2HB       GLN  38   1.352   0.343  -2.905
    5    HG2  GLN  38          1HG       GLN  38   3.496  -0.641  -3.245
    6    HG3  GLN  38          2HG       GLN  38   3.653   0.600  -1.969
    7   HE21  GLN  38          1HE2      GLN  38   5.138  -1.595   0.247
    8   HE22  GLN  38          2HE2      GLN  38   4.934   0.014  -0.361
    9    H    ALA  39           H        ALA  39   2.648   0.775   1.266
   10    HA   ALA  39           HA       ALA  39   2.664   3.649   0.952
   11    HB1  ALA  39          1HB       ALA  39   4.298   3.603   2.809
   12    HB2  ALA  39          2HB       ALA  39   2.872   2.599   3.161
   13    HB3  ALA  39          3HB       ALA  39   4.399   1.833   2.666
   14    HA   PRO  40           HA       PRO  40   5.958   4.052  -1.840
   15    HB2  PRO  40          1HB       PRO  40   6.747   6.631  -1.319
   16    HB3  PRO  40          2HB       PRO  40   5.215   6.257  -2.118
   17    HG2  PRO  40          1HG       PRO  40   5.739   6.854   0.825
   18    HG3  PRO  40          2HG       PRO  40   4.495   7.539  -0.225
   19    HD2  PRO  40          1HD       PRO  40   3.940   5.468   1.454
   20    HD3  PRO  40          2HD       PRO  40   3.164   5.591  -0.175
   21    H    LYS  41           H        LYS  41   8.180   3.810  -1.920
   22    HA   LYS  41           HA       LYS  41   9.530   3.012   0.475
   23    HB2  LYS  41          1HB       LYS  41  10.078   2.148  -1.799
   24    HB3  LYS  41          2HB       LYS  41  10.705   3.730  -2.242
   25    HG2  LYS  41          1HG       LYS  41  12.483   3.544  -0.593
   26    HG3  LYS  41          2HG       LYS  41  11.814   2.017   0.001
   27    HD2  LYS  41          1HD       LYS  41  12.222   0.954  -2.166
   28    HD3  LYS  41          2HD       LYS  41  12.790   2.487  -2.840
   29    HE2  LYS  41          1HE       LYS  41  14.690   1.075  -2.231
   30    HE3  LYS  41          2HE       LYS  41  14.652   2.515  -1.210
   31    HZ1  LYS  41          1HZ       LYS  41  15.080   0.544   0.062
   32    HZ2  LYS  41          2HZ       LYS  41  13.634   1.195   0.514
   33    HZ3  LYS  41          3HZ       LYS  41  13.672  -0.152  -0.438
   34    H    GLY  42           H        GLY  42  10.802   4.030   1.872
   35    HA2  GLY  42          1HA       GLY  42  12.394   5.827   2.393
   36    HA3  GLY  42          2HA       GLY  42  11.526   6.874   1.287
   37    H    SER  43           H        SER  43   8.940   5.585   2.408
   38    HA   SER  43           HA       SER  43   8.432   7.633   4.387
   39    HB2  SER  43          1HB       SER  43   6.213   6.686   4.509
   40    HB3  SER  43          2HB       SER  43   6.711   6.746   2.825
   41    HG   SER  43           HG       SER  43   6.988   4.643   2.789
   42    H    ALA  44           H        ALA  44   7.510   7.165   6.539
   43    HA   ALA  44           HA       ALA  44   8.638   4.735   7.801
   44    HB1  ALA  44          1HB       ALA  44   9.672   6.075   9.605
   45    HB2  ALA  44          2HB       ALA  44  10.401   6.429   8.020
   46    HB3  ALA  44          3HB       ALA  44   9.235   7.566   8.738
   47    H    PHE  45           H        PHE  45   7.744   4.198   9.827
   48    HA   PHE  45           HA       PHE  45   5.093   5.512  10.262
   49    HB2  PHE  45          1HB       PHE  45   5.831   2.566  10.475
   50    HB3  PHE  45          2HB       PHE  45   4.288   3.241  10.973
   51    HD1  PHE  45           HD1      PHE  45   6.508   2.712   8.052
   52    HD2  PHE  45           HD2      PHE  45   2.571   3.653   9.414
   53    HE1  PHE  45           HE1      PHE  45   5.648   2.439   5.750
   54    HE2  PHE  45           HE2      PHE  45   1.706   3.379   7.114
   55    HZ   PHE  45           HZ       PHE  45   3.247   2.773   5.281
   56    H    VAL  46           H        VAL  46   4.331   5.725  12.349
   57    HA   VAL  46           HA       VAL  46   6.017   4.722  14.561
   58    HB   VAL  46           HB       VAL  46   6.907   6.985  14.055
   59   HG11  VAL  46          1HG1      VAL  46   5.504   8.963  14.382
   60   HG12  VAL  46          2HG1      VAL  46   4.924   7.951  13.040
   61   HG13  VAL  46          3HG1      VAL  46   4.083   7.917  14.608
   62   HG21  VAL  46          1HG2      VAL  46   6.638   7.922  16.329
   63   HG22  VAL  46          2HG2      VAL  46   5.254   6.838  16.609
   64   HG23  VAL  46          3HG2      VAL  46   6.884   6.161  16.384
   65    H    ARG  47           H        ARG  47   4.855   4.074  16.259
   66    HA   ARG  47           HA       ARG  47   1.932   4.596  16.178
   67    HB2  ARG  47          1HB       ARG  47   2.558   2.255  16.294
   68    HB3  ARG  47          2HB       ARG  47   3.592   2.549  17.684
   69    HG2  ARG  47          1HG       ARG  47   1.730   2.939  19.113
   70    HG3  ARG  47          2HG       ARG  47   0.606   3.020  17.735
   71    HD2  ARG  47          1HD       ARG  47   2.218   0.583  18.439
   72    HD3  ARG  47          2HD       ARG  47   0.568   0.894  19.027
   73    HE   ARG  47           HE       ARG  47   0.499   1.181  16.252
   74   HH11  ARG  47          1HH1      ARG  47   1.196  -1.346  18.589
   75   HH12  ARG  47          2HH1      ARG  47   0.657  -2.639  17.540
   76   HH21  ARG  47          1HH2      ARG  47  -0.197  -0.505  14.900
   77   HH22  ARG  47          2HH2      ARG  47  -0.132  -2.163  15.452
   78    H    ALA  48           H        ALA  48   1.120   6.139  17.404
   79    HA   ALA  48           HA       ALA  48   2.575   7.064  19.786
   80    HB1  ALA  48          1HB       ALA  48   0.762   8.740  19.942
   81    HB2  ALA  48          2HB       ALA  48   1.503   8.719  18.324
   82    HB3  ALA  48          3HB       ALA  48  -0.078   7.947  18.589
   83    H    TYR  49           H        TYR  49   2.517   5.404  21.246
   84    HA   TYR  49           HA       TYR  49  -0.090   4.193  21.912
   85    HB2  TYR  49          1HB       TYR  49   1.884   2.729  21.695
   86    HB3  TYR  49          2HB       TYR  49   2.717   3.633  22.952
   87    HD1  TYR  49           HD1      TYR  49  -0.165   1.402  22.272
   88    HD2  TYR  49           HD2      TYR  49   2.340   3.207  25.250
   89    HE1  TYR  49           HE1      TYR  49  -1.128  -0.093  23.989
   90    HE2  TYR  49           HE2      TYR  49   1.378   1.712  26.966
   91    HH   TYR  49           HH       TYR  49  -1.131  -0.669  26.135
   92    H    ASN  50           H        ASN  50  -1.354   4.812  23.492
   93    HA   ASN  50           HA       ASN  50  -0.315   6.833  25.399
   94    HB2  ASN  50          1HB       ASN  50  -2.402   7.313  24.136
   95    HB3  ASN  50          2HB       ASN  50  -3.160   5.912  24.880
   96   HD21  ASN  50          1HD2      ASN  50  -4.121   8.947  26.766
   97   HD22  ASN  50          2HD2      ASN  50  -4.257   8.408  25.125
   98    H    ALA  51           H        ALA  51   0.693   5.950  27.060
   99    HA   ALA  51           HA       ALA  51  -0.362   3.452  28.223
  100    HB1  ALA  51          1HB       ALA  51   1.711   3.485  29.574
  101    HB2  ALA  51          2HB       ALA  51   2.056   3.622  27.834
  102    HB3  ALA  51          3HB       ALA  51   2.133   5.064  28.873
  103    H    GLY  52           H        GLY  52  -1.174   6.567  28.522
  104    HA2  GLY  52          1HA       GLY  52  -1.368   6.555  31.498
  105    HA3  GLY  52          2HA       GLY  52  -1.546   7.961  30.467
  106    H    ASN  53           H        ASN  53  -3.490   8.034  32.042
  107    HA   ASN  53           HA       ASN  53  -5.752   6.439  30.909
  108    HB2  ASN  53          1HB       ASN  53  -5.363   7.626  33.675
  109    HB3  ASN  53          2HB       ASN  53  -6.880   6.940  33.108
  110   HD21  ASN  53          1HD2      ASN  53  -4.190   4.570  34.743
  111   HD22  ASN  53          2HD2      ASN  53  -4.275   6.291  34.916
  112    H    SER  54           H        SER  54  -4.626   8.952  29.859
  113    HA   SER  54           HA       SER  54  -7.226  10.316  29.638
  114    HB2  SER  54          1HB       SER  54  -6.370  12.510  30.169
  115    HB3  SER  54          2HB       SER  54  -6.076  11.445  31.534
  116    HG   SER  54           HG       SER  54  -4.297  12.399  29.601
  117    H    GLU  55           H        GLU  55  -7.343  11.794  27.854
  118    HA   GLU  55           HA       GLU  55  -6.022  10.817  25.526
  119    HB2  GLU  55          1HB       GLU  55  -7.534  13.411  26.024
  120    HB3  GLU  55          2HB       GLU  55  -6.988  12.889  24.437
  121    HG2  GLU  55          1HG       GLU  55  -9.162  12.176  24.423
  122    HG3  GLU  55          2HG       GLU  55  -8.334  10.717  24.960
  123    H    LEU  56           H        LEU  56  -4.251  11.397  24.434
  124    HA   LEU  56           HA       LEU  56  -2.609  13.581  25.643
  125    HB2  LEU  56          1HB       LEU  56  -1.692  11.093  24.158
  126    HB3  LEU  56          2HB       LEU  56  -0.637  12.351  24.809
  127    HG   LEU  56           HG       LEU  56  -2.403  10.490  26.440
  128   HD11  LEU  56          1HD1      LEU  56  -0.264   9.525  27.158
  129   HD12  LEU  56          2HD1      LEU  56  -0.501   9.365  25.402
  130   HD13  LEU  56          3HD1      LEU  56   0.601  10.608  26.042
  131   HD21  LEU  56          1HD2      LEU  56  -1.232  11.499  28.368
  132   HD22  LEU  56          2HD2      LEU  56  -0.380  12.611  27.270
  133   HD23  LEU  56          3HD2      LEU  56  -2.146  12.727  27.461
  134    H    ASP  57           H        ASP  57  -1.668  15.094  24.359
  135    HA   ASP  57           HA       ASP  57  -2.819  15.338  21.662
  136    HB2  ASP  57          1HB       ASP  57  -2.773  17.295  23.188
  137    HB3  ASP  57          2HB       ASP  57  -1.016  17.222  23.237
  138    H    VAL  58           H        VAL  58  -1.868  14.272  20.072
  139    HA   VAL  58           HA       VAL  58   1.039  13.748  20.233
  140    HB   VAL  58           HB       VAL  58  -1.071  12.706  18.295
  141   HG11  VAL  58          1HG1      VAL  58   0.621  11.057  17.659
  142   HG12  VAL  58          2HG1      VAL  58   1.141  12.719  17.296
  143   HG13  VAL  58          3HG1      VAL  58   1.805  11.868  18.711
  144   HG21  VAL  58          1HG2      VAL  58  -0.864  10.612  19.598
  145   HG22  VAL  58          2HG2      VAL  58   0.271  11.417  20.708
  146   HG23  VAL  58          3HG2      VAL  58  -1.423  11.955  20.623
  147    H    SER  59           H        SER  59   2.514  14.777  19.066
  148    HA   SER  59           HA       SER  59   1.869  15.727  16.377
  149    HB2  SER  59          1HB       SER  59   1.132  17.642  17.714
  150    HB3  SER  59          2HB       SER  59   2.673  17.682  18.557
  151    HG   SER  59           HG       SER  59   2.638  17.752  15.780
  152    H    VAL  60           H        VAL  60   3.501  15.102  15.172
  153    HA   VAL  60           HA       VAL  60   6.164  14.797  16.478
  154    HB   VAL  60           HB       VAL  60   5.034  13.500  13.960
  155   HG11  VAL  60          1HG1      VAL  60   7.057  12.124  13.991
  156   HG12  VAL  60          2HG1      VAL  60   7.428  13.850  13.770
  157   HG13  VAL  60          3HG1      VAL  60   7.685  13.081  15.354
  158   HG21  VAL  60          1HG2      VAL  60   5.080  11.437  15.325
  159   HG22  VAL  60          2HG2      VAL  60   5.642  12.379  16.726
  160   HG23  VAL  60          3HG2      VAL  60   4.020  12.667  16.052
  161    H    GLY  61           H        GLY  61   7.652  16.253  16.029
  162    HA2  GLY  61          1HA       GLY  61   9.026  17.644  14.759
  163    HA3  GLY  61          2HA       GLY  61   8.205  17.095  13.310
  164    H    SER  62           H        SER  62   7.009  18.552  12.262
  165    HA   SER  62           HA       SER  62   5.969  20.884  13.820
  166    HB2  SER  62          1HB       SER  62   6.091  22.164  11.736
  167    HB3  SER  62          2HB       SER  62   7.666  21.517  12.166
  168    HG   SER  62           HG       SER  62   5.916  20.120  10.491
  169    H    THR  63           H        THR  63   4.928  18.053  12.825
  170    HA   THR  63           HA       THR  63   2.465  19.059  11.483
  171    HB   THR  63           HB       THR  63   3.582  16.230  11.694
  172    HG1  THR  63           HG1      THR  63   4.593  16.802   9.937
  173   HG21  THR  63          1HG2      THR  63   1.780  15.642  10.121
  174   HG22  THR  63          2HG2      THR  63   1.112  16.260  11.650
  175   HG23  THR  63          3HG2      THR  63   1.152  17.303  10.210
  176    H    SER  64           H        SER  64   0.649  19.236  12.568
  177    HA   SER  64           HA       SER  64   0.383  18.077  15.242
  178    HB2  SER  64          1HB       SER  64  -0.563  20.266  14.827
  179    HB3  SER  64          2HB       SER  64  -1.507  19.661  13.475
  180    HG   SER  64           HG       SER  64  -1.966  18.167  15.616
  181    H    LEU  65           H        LEU  65  -0.474  16.194  15.765
  182    HA   LEU  65           HA       LEU  65  -1.841  14.674  13.585
  183    HB2  LEU  65          1HB       LEU  65  -0.209  13.621  15.924
  184    HB3  LEU  65          2HB       LEU  65  -0.993  12.636  14.685
  185    HG   LEU  65           HG       LEU  65   1.265  14.606  14.176
  186   HD11  LEU  65          1HD1      LEU  65   2.632  12.590  13.871
  187   HD12  LEU  65          2HD1      LEU  65   1.983  12.700  15.524
  188   HD13  LEU  65          3HD1      LEU  65   1.249  11.579  14.352
  189   HD21  LEU  65          1HD2      LEU  65   1.313  13.527  11.953
  190   HD22  LEU  65          2HD2      LEU  65  -0.090  12.530  12.406
  191   HD23  LEU  65          3HD2      LEU  65  -0.264  14.295  12.258
  192    H    ASN  66           H        ASN  66  -3.080  12.708  14.657
  193    HA   ASN  66           HA       ASN  66  -5.259  14.029  16.068
  194    HB2  ASN  66          1HB       ASN  66  -4.851  11.157  15.173
  195    HB3  ASN  66          2HB       ASN  66  -6.319  11.750  15.938
  196   HD21  ASN  66          1HD2      ASN  66  -6.392  11.842  12.133
  197   HD22  ASN  66          2HD2      ASN  66  -5.784  10.652  13.234
  198    H    ASP  67           H        ASP  67  -6.095  13.610  18.076
  199    HA   ASP  67           HA       ASP  67  -4.168  12.925  20.112
  200    HB2  ASP  67          1HB       ASP  67  -7.177  13.369  20.226
  201    HB3  ASP  67          2HB       ASP  67  -6.179  13.091  21.646
  202    H    VAL  68           H        VAL  68  -4.314  11.237  21.671
  203    HA   VAL  68           HA       VAL  68  -5.504   8.753  20.508
  204    HB   VAL  68           HB       VAL  68  -3.017   9.075  22.243
  205   HG11  VAL  68          1HG1      VAL  68  -2.692   6.677  21.886
  206   HG12  VAL  68          2HG1      VAL  68  -4.198   7.020  22.770
  207   HG13  VAL  68          3HG1      VAL  68  -4.256   6.591  21.043
  208   HG21  VAL  68          1HG2      VAL  68  -1.829   8.296  20.217
  209   HG22  VAL  68          2HG2      VAL  68  -3.371   8.267  19.327
  210   HG23  VAL  68          3HG2      VAL  68  -2.706   9.814  19.906
  211    H    ALA  69           H        ALA  69  -6.794   7.511  21.735
  212    HA   ALA  69           HA       ALA  69  -7.916   8.749  24.089
  213    HB1  ALA  69          1HB       ALA  69  -9.383   6.758  24.150
  214    HB2  ALA  69          2HB       ALA  69  -9.306   7.473  22.522
  215    HB3  ALA  69          3HB       ALA  69  -8.385   5.996  22.889
  216    HA   PRO  70           HA       PRO  70  -5.783   7.095  27.460
  217    HB2  PRO  70          1HB       PRO  70  -8.441   5.923  28.372
  218    HB3  PRO  70          2HB       PRO  70  -7.270   6.870  29.298
  219    HG2  PRO  70          1HG       PRO  70  -9.449   8.102  28.403
  220    HG3  PRO  70          2HG       PRO  70  -7.891   8.921  28.257
  221    HD2  PRO  70          1HD       PRO  70  -9.471   7.411  26.140
  222    HD3  PRO  70          2HD       PRO  70  -8.568   8.971  25.992
  223    H    LEU  71           H        LEU  71  -4.590   5.283  27.718
  224    HA   LEU  71           HA       LEU  71  -3.828   3.136  27.364
  225    HB2  LEU  71          1HB       LEU  71  -6.733   2.433  27.917
  226    HB3  LEU  71          2HB       LEU  71  -5.358   1.330  28.025
  227    HG   LEU  71           HG       LEU  71  -5.830   3.751  29.800
  228   HD11  LEU  71          1HD1      LEU  71  -6.251   2.068  31.537
  229   HD12  LEU  71          2HD1      LEU  71  -7.418   1.939  30.199
  230   HD13  LEU  71          3HD1      LEU  71  -6.077   0.775  30.325
  231   HD21  LEU  71          1HD2      LEU  71  -3.912   2.853  31.074
  232   HD22  LEU  71          2HD2      LEU  71  -3.704   1.570  29.856
  233   HD23  LEU  71          3HD2      LEU  71  -3.435   3.273  29.411
  234    H    GLY  72           H        GLY  72  -4.703   4.601  25.025
  235    HA2  GLY  72          1HA       GLY  72  -5.406   2.265  23.278
  236    HA3  GLY  72          2HA       GLY  72  -5.973   3.892  22.955
  237    H    SER  73           H        SER  73  -4.919   3.493  20.844
  238    HA   SER  73           HA       SER  73  -2.323   4.797  20.820
  239    HB2  SER  73          1HB       SER  73  -1.060   3.053  19.739
  240    HB3  SER  73          2HB       SER  73  -1.691   2.423  21.254
  241    HG   SER  73           HG       SER  73  -2.820   2.081  18.697
  242    H    SER  74           H        SER  74  -1.605   5.351  18.674
  243    HA   SER  74           HA       SER  74  -3.507   4.789  16.479
  244    HB2  SER  74          1HB       SER  74  -4.329   6.876  17.482
  245    HB3  SER  74          2HB       SER  74  -2.730   7.592  17.348
  246    HG   SER  74           HG       SER  74  -2.959   7.014  15.043
  247    H    ASP  75           H        ASP  75  -2.504   4.395  14.632
  248    HA   ASP  75           HA       ASP  75   0.421   4.723  14.556
  249    HB2  ASP  75          1HB       ASP  75  -1.560   3.352  12.702
  250    HB3  ASP  75          2HB       ASP  75   0.159   3.467  12.353
  251    H    PHE  76           H        PHE  76   1.531   6.156  13.401
  252    HA   PHE  76           HA       PHE  76   0.050   7.700  11.317
  253    HB2  PHE  76          1HB       PHE  76   2.109   8.808  13.268
  254    HB3  PHE  76          2HB       PHE  76   1.357   9.705  11.958
  255    HD1  PHE  76           HD1      PHE  76   1.054   8.578  15.358
  256    HD2  PHE  76           HD2      PHE  76  -1.138  10.095  12.020
  257    HE1  PHE  76           HE1      PHE  76  -0.792   9.227  16.868
  258    HE2  PHE  76           HE2      PHE  76  -2.985  10.748  13.527
  259    HZ   PHE  76           HZ       PHE  76  -2.812  10.312  15.952
  260    H    LYS  77           H        LYS  77   1.462   8.723   9.706
  261    HA   LYS  77           HA       LYS  77   4.051   7.325   9.337
  262    HB2  LYS  77          1HB       LYS  77   3.489   6.614   7.077
  263    HB3  LYS  77          2HB       LYS  77   2.337   5.922   8.210
  264    HG2  LYS  77          1HG       LYS  77   0.702   7.690   7.601
  265    HG3  LYS  77          2HG       LYS  77   1.859   8.321   6.420
  266    HD2  LYS  77          1HD       LYS  77   1.856   6.122   5.262
  267    HD3  LYS  77          2HD       LYS  77   0.662   5.525   6.425
  268    HE2  LYS  77          1HE       LYS  77  -0.913   7.299   5.707
  269    HE3  LYS  77          2HE       LYS  77   0.273   7.874   4.533
  270    HZ1  LYS  77          1HZ       LYS  77  -1.337   6.433   3.524
  271    HZ2  LYS  77          2HZ       LYS  77   0.155   5.735   3.452
  272    HZ3  LYS  77          3HZ       LYS  77  -0.955   5.198   4.547
  273    H    PHE  78           H        PHE  78   5.532   8.376   8.058
  274    HA   PHE  78           HA       PHE  78   4.646  10.960   6.860
  275    HB2  PHE  78          1HB       PHE  78   7.147  10.495   8.533
  276    HB3  PHE  78          2HB       PHE  78   6.846  11.942   7.584
  277    HD1  PHE  78           HD1      PHE  78   5.955  10.070  10.590
  278    HD2  PHE  78           HD2      PHE  78   5.121  13.541   8.243
  279    HE1  PHE  78           HE1      PHE  78   4.731  11.061  12.495
  280    HE2  PHE  78           HE2      PHE  78   3.898  14.538  10.147
  281    HZ   PHE  78           HZ       PHE  78   3.702  13.296  12.274
  282    H    LEU  79           H        LEU  79   5.505  11.479   4.921
  283    HA   LEU  79           HA       LEU  79   6.760   9.358   3.413
  284    HB2  LEU  79          1HB       LEU  79   5.219  10.924   2.352
  285    HB3  LEU  79          2HB       LEU  79   6.265  12.285   2.765
  286    HG   LEU  79           HG       LEU  79   8.006  11.400   1.241
  287   HD11  LEU  79          1HD1      LEU  79   7.456   9.536  -0.259
  288   HD12  LEU  79          2HD1      LEU  79   7.466   9.027   1.446
  289   HD13  LEU  79          3HD1      LEU  79   5.920   9.294   0.606
  290   HD21  LEU  79          1HD2      LEU  79   6.783  11.881  -0.852
  291   HD22  LEU  79          2HD2      LEU  79   5.236  11.671   0.004
  292   HD23  LEU  79          3HD2      LEU  79   6.317  13.016   0.438
  293    HA   PRO  80           HA       PRO  80  10.611  12.040   3.671
  294    HB2  PRO  80          1HB       PRO  80  10.739  14.318   5.107
  295    HB3  PRO  80          2HB       PRO  80   9.898  14.297   3.552
  296    HG2  PRO  80          1HG       PRO  80   8.726  14.088   6.361
  297    HG3  PRO  80          2HG       PRO  80   8.212  15.140   5.038
  298    HD2  PRO  80          1HD       PRO  80   7.015  12.707   5.572
  299    HD3  PRO  80          2HD       PRO  80   7.085  13.428   3.914
  300    HA   PRO  81           HA       PRO  81  11.542  10.092   7.606
  301    HB2  PRO  81          1HB       PRO  81  13.965   9.062   6.923
  302    HB3  PRO  81          2HB       PRO  81  12.465   8.353   6.311
  303    HG2  PRO  81          1HG       PRO  81  14.345  10.324   4.942
  304    HG3  PRO  81          2HG       PRO  81  13.660   8.833   4.288
  305    HD2  PRO  81          1HD       PRO  81  12.545  11.293   3.796
  306    HD3  PRO  81          2HD       PRO  81  11.550   9.786   3.911
  307    H    GLY  82           H        GLY  82  13.302  10.385   9.207
  308    HA2  GLY  82          1HA       GLY  82  15.577  11.747   9.296
  309    HA3  GLY  82          2HA       GLY  82  14.503  13.101   9.001
  310    H    SER  83           H        SER  83  15.667  13.585  11.175
  311    HA   SER  83           HA       SER  83  14.476  12.240  13.498
  312    HB2  SER  83          1HB       SER  83  16.793  12.927  13.640
  313    HB3  SER  83          2HB       SER  83  16.384  14.581  13.215
  314    HG   SER  83           HG       SER  83  14.857  14.070  15.188
  315    H    TYR  84           H        TYR  84  12.691  12.811  14.507
  316    HA   TYR  84           HA       TYR  84  11.740  15.623  14.208
  317    HB2  TYR  84          1HB       TYR  84  10.023  13.111  14.060
  318    HB3  TYR  84          2HB       TYR  84   9.406  14.757  14.102
  319    HD1  TYR  84           HD1      TYR  84  10.785  12.124  12.053
  320    HD2  TYR  84           HD2      TYR  84   9.928  16.325  12.205
  321    HE1  TYR  84           HE1      TYR  84  10.945  12.246   9.589
  322    HE2  TYR  84           HE2      TYR  84  10.088  16.447   9.743
  323    HH   TYR  84           HH       TYR  84  10.493  13.551   7.779
  324    H    THR  85           H        THR  85  10.424  16.424  15.902
  325    HA   THR  85           HA       THR  85  10.988  15.143  18.501
  326    HB   THR  85           HB       THR  85   9.624  17.788  17.835
  327    HG1  THR  85           HG1      THR  85  11.654  18.607  18.625
  328   HG21  THR  85          1HG2      THR  85   9.917  18.277  20.231
  329   HG22  THR  85          2HG2      THR  85   8.876  16.852  19.996
  330   HG23  THR  85          3HG2      THR  85  10.572  16.643  20.489
  331    H    ALA  86           H        ALA  86   9.715  13.436  18.869
  332    HA   ALA  86           HA       ALA  86   6.915  13.491  17.990
  333    HB1  ALA  86          1HB       ALA  86   6.874  11.150  18.787
  334    HB2  ALA  86          2HB       ALA  86   8.235  11.446  17.680
  335    HB3  ALA  86          3HB       ALA  86   8.518  11.350  19.434
  336    H    GLN  87           H        GLN  87   6.119  15.172  19.316
  337    HA   GLN  87           HA       GLN  87   6.056  14.770  22.212
  338    HB2  GLN  87          1HB       GLN  87   6.065  17.045  21.210
  339    HB3  GLN  87          2HB       GLN  87   4.516  16.717  20.448
  340    HG2  GLN  87          1HG       GLN  87   3.441  16.516  22.617
  341    HG3  GLN  87          2HG       GLN  87   5.013  16.748  23.432
  342   HE21  GLN  87          1HE2      GLN  87   3.509  20.025  23.651
  343   HE22  GLN  87          2HE2      GLN  87   3.423  18.461  24.389
  344    H    VAL  88           H        VAL  88   4.720  13.523  23.287
  345    HA   VAL  88           HA       VAL  88   2.017  13.036  22.114
  346    HB   VAL  88           HB       VAL  88   3.685  11.032  23.692
  347   HG11  VAL  88          1HG1      VAL  88   1.917   9.445  23.105
  348   HG12  VAL  88          2HG1      VAL  88   1.302  10.796  24.086
  349   HG13  VAL  88          3HG1      VAL  88   0.997  10.758  22.332
  350   HG21  VAL  88          1HG2      VAL  88   3.817   9.801  21.549
  351   HG22  VAL  88          2HG2      VAL  88   2.960  11.130  20.735
  352   HG23  VAL  88          3HG2      VAL  88   4.580  11.403  21.419
  353    H    GLY  89           H        GLY  89   1.253  14.791  23.391
  354    HA2  GLY  89          1HA       GLY  89   0.059  15.553  25.233
  355    HA3  GLY  89          2HA       GLY  89   0.206  13.953  25.934
  356    H    GLN  90           H        GLN  90   1.529  13.670  27.640
  357    HA   GLN  90           HA       GLN  90   2.881  16.073  28.667
  358    HB2  GLN  90          1HB       GLN  90   2.467  13.322  29.905
  359    HB3  GLN  90          2HB       GLN  90   3.180  14.702  30.729
  360    HG2  GLN  90          1HG       GLN  90   0.358  14.562  29.644
  361    HG3  GLN  90          2HG       GLN  90   0.850  14.386  31.352
  362   HE21  GLN  90          1HE2      GLN  90  -0.112  17.967  30.036
  363   HE22  GLN  90          2HE2      GLN  90  -0.644  16.446  29.398
  364    H    GLN  91           H        GLN  91   3.706  13.352  26.832
  365    HA   GLN  91           HA       GLN  91   6.551  13.522  27.714
  366    HB2  GLN  91          1HB       GLN  91   5.145  11.364  26.087
  367    HB3  GLN  91          2HB       GLN  91   6.839  11.346  26.557
  368    HG2  GLN  91          1HG       GLN  91   4.507  11.340  28.484
  369    HG3  GLN  91          2HG       GLN  91   5.444   9.908  27.970
  370   HE21  GLN  91          1HE2      GLN  91   6.619  11.926  31.157
  371   HE22  GLN  91          2HE2      GLN  91   5.023  11.911  30.483
  372    H    SER  92           H        SER  92   8.221  13.528  26.124
  373    HA   SER  92           HA       SER  92   7.499  14.004  23.330
  374    HB2  SER  92          1HB       SER  92   7.187  16.246  24.255
  375    HB3  SER  92          2HB       SER  92   8.778  16.194  24.998
  376    HG   SER  92           HG       SER  92   9.271  15.605  22.591
  377    H    LEU  93           H        LEU  93   8.876  12.785  22.265
  378    HA   LEU  93           HA       LEU  93  11.675  12.608  23.297
  379    HB2  LEU  93          1HB       LEU  93   9.893  10.429  22.165
  380    HB3  LEU  93          2HB       LEU  93  11.640  10.251  22.352
  381    HG   LEU  93           HG       LEU  93  11.075  10.911  24.878
  382   HD11  LEU  93          1HD1      LEU  93   8.922   9.946  25.557
  383   HD12  LEU  93          2HD1      LEU  93   8.706  11.323  24.450
  384   HD13  LEU  93          3HD1      LEU  93   8.513   9.659  23.849
  385   HD21  LEU  93          1HD2      LEU  93  10.953   8.486  25.343
  386   HD22  LEU  93          2HD2      LEU  93  10.572   8.177  23.632
  387   HD23  LEU  93          3HD2      LEU  93  12.163   8.836  24.084
  388    HA   PRO  94           HA       PRO  94  12.736  13.788  19.224
  389    HB2  PRO  94          1HB       PRO  94  15.428  13.365  19.298
  390    HB3  PRO  94          2HB       PRO  94  14.673  14.651  20.246
  391    HG2  PRO  94          1HG       PRO  94  15.494  11.853  21.136
  392    HG3  PRO  94          2HG       PRO  94  15.832  13.395  21.928
  393    HD2  PRO  94          1HD       PRO  94  13.738  11.802  22.692
  394    HD3  PRO  94          2HD       PRO  94  13.656  13.607  22.788
  395    H    VAL  95           H        VAL  95  11.416  11.716  18.701
  396    HA   VAL  95           HA       VAL  95  12.892   9.265  18.224
  397    HB   VAL  95           HB       VAL  95  10.122  10.147  17.304
  398   HG11  VAL  95          1HG1      VAL  95   9.700   7.770  16.910
  399   HG12  VAL  95          2HG1      VAL  95  10.998   8.397  15.869
  400   HG13  VAL  95          3HG1      VAL  95  11.398   7.405  17.291
  401   HG21  VAL  95          1HG2      VAL  95   9.348   8.722  19.173
  402   HG22  VAL  95          2HG2      VAL  95  11.038   8.394  19.622
  403   HG23  VAL  95          3HG2      VAL  95  10.385  10.044  19.760
  404    H    LYS  96           H        LYS  96  14.289   8.994  16.633
  405    HA   LYS  96           HA       LYS  96  14.046  10.519  14.135
  406    HB2  LYS  96          1HB       LYS  96  16.270  10.049  15.167
  407    HB3  LYS  96          2HB       LYS  96  16.008   8.328  14.923
  408    HG2  LYS  96          1HG       LYS  96  15.974   8.645  12.495
  409    HG3  LYS  96          2HG       LYS  96  16.158  10.392  12.706
  410    HD2  LYS  96          1HD       LYS  96  18.334  10.026  13.831
  411    HD3  LYS  96          2HD       LYS  96  18.150   8.280  13.612
  412    HE2  LYS  96          1HE       LYS  96  18.087   8.607  11.152
  413    HE3  LYS  96          2HE       LYS  96  18.304  10.343  11.384
  414    HZ1  LYS  96          1HZ       LYS  96  20.369   9.252  10.900
  415    HZ2  LYS  96          2HZ       LYS  96  20.417   9.881  12.424
  416    HZ3  LYS  96          3HZ       LYS  96  20.214   8.259  12.207
  417    H    LEU  97           H        LEU  97  13.100   9.897  12.334
  418    HA   LEU  97           HA       LEU  97  12.016   7.121  12.270
  419    HB2  LEU  97          1HB       LEU  97  11.148   9.598  10.737
  420    HB3  LEU  97          2HB       LEU  97  10.375   8.011  10.658
  421    HG   LEU  97           HG       LEU  97  10.495   9.803  13.111
  422   HD11  LEU  97          1HD1      LEU  97   8.089  10.072  12.708
  423   HD12  LEU  97          2HD1      LEU  97   9.056  10.683  11.346
  424   HD13  LEU  97          3HD1      LEU  97   8.230   9.111  11.218
  425   HD21  LEU  97          1HD2      LEU  97   8.937   8.140  14.067
  426   HD22  LEU  97          2HD2      LEU  97   9.090   7.150  12.595
  427   HD23  LEU  97          3HD2      LEU  97  10.498   7.391  13.655
  428    H    ASP  98           H        ASP  98  13.717   5.993  11.395
  429    HA   ASP  98           HA       ASP  98  15.029   6.790   8.950
  430    HB2  ASP  98          1HB       ASP  98  14.780   4.125  10.390
  431    HB3  ASP  98          2HB       ASP  98  15.689   4.315   8.897
  432    HA   PRO  99           HA       PRO  99  12.070   5.717   5.995
  433    HB2  PRO  99          1HB       PRO  99  13.672   5.014   3.854
  434    HB3  PRO  99          2HB       PRO  99  13.472   6.685   4.400
  435    HG2  PRO  99          1HG       PRO  99  15.692   4.707   5.072
  436    HG3  PRO  99          2HG       PRO  99  15.844   6.390   4.556
  437    HD2  PRO  99          1HD       PRO  99  16.001   5.735   7.180
  438    HD3  PRO  99          2HD       PRO  99  15.171   7.255   6.654
  439    H    ASP 100           H        ASP 100  10.944   3.945   5.212
  440    HA   ASP 100           HA       ASP 100  10.297   1.745   5.039
  441    HB2  ASP 100          1HB       ASP 100  13.279   1.248   4.670
  442    HB3  ASP 100          2HB       ASP 100  11.999   0.101   4.298
  443    H    SER 101           H        SER 101  10.427   2.651   7.604
  444    HA   SER 101           HA       SER 101  11.042   0.170   9.063
  445    HB2  SER 101          1HB       SER 101  13.166   1.384   9.176
  446    HB3  SER 101          2HB       SER 101  12.344   2.822   9.760
  447    HG   SER 101           HG       SER 101  11.684   1.643  11.555
  448    H    TYR 102           H        TYR 102   9.847  -0.110  10.898
  449    HA   TYR 102           HA       TYR 102   7.789   1.981  11.404
  450    HB2  TYR 102          1HB       TYR 102   7.870  -0.972  12.141
  451    HB3  TYR 102          2HB       TYR 102   6.589   0.134  12.617
  452    HD1  TYR 102           HD1      TYR 102   8.368  -1.113   9.569
  453    HD2  TYR 102           HD2      TYR 102   4.722   0.376  11.273
  454    HE1  TYR 102           HE1      TYR 102   7.189  -1.563   7.443
  455    HE2  TYR 102           HE2      TYR 102   3.545  -0.074   9.148
  456    HH   TYR 102           HH       TYR 102   3.717  -0.832   7.073
  457    H    TYR 103           H        TYR 103   7.292   2.695  13.470
  458    HA   TYR 103           HA       TYR 103   9.203   1.898  15.615
  459    HB2  TYR 103          1HB       TYR 103   8.374   4.734  14.884
  460    HB3  TYR 103          2HB       TYR 103   9.196   4.304  16.377
  461    HD1  TYR 103           HD1      TYR 103   9.523   4.504  12.705
  462    HD2  TYR 103           HD2      TYR 103  11.537   3.812  16.429
  463    HE1  TYR 103           HE1      TYR 103  11.706   4.713  11.563
  464    HE2  TYR 103           HE2      TYR 103  13.720   4.022  15.288
  465    HH   TYR 103           HH       TYR 103  14.765   4.395  13.371
  466    H    THR 104           H        THR 104   8.400   1.748  17.654
  467    HA   THR 104           HA       THR 104   5.559   2.600  18.025
  468    HB   THR 104           HB       THR 104   6.961   0.210  19.301
  469    HG1  THR 104           HG1      THR 104   6.150  -0.808  17.645
  470   HG21  THR 104          1HG2      THR 104   4.755  -0.254  20.296
  471   HG22  THR 104          2HG2      THR 104   5.379   1.322  20.839
  472   HG23  THR 104          3HG2      THR 104   4.115   1.248  19.590
  473    H    LEU 105           H        LEU 105   5.315   4.196  19.393
  474    HA   LEU 105           HA       LEU 105   7.508   4.679  21.362
  475    HB2  LEU 105          1HB       LEU 105   7.256   6.441  19.664
  476    HB3  LEU 105          2HB       LEU 105   5.551   6.625  20.088
  477    HG   LEU 105           HG       LEU 105   6.239   7.388  22.366
  478   HD11  LEU 105          1HD1      LEU 105   8.593   7.976  22.741
  479   HD12  LEU 105          2HD1      LEU 105   8.385   6.229  22.476
  480   HD13  LEU 105          3HD1      LEU 105   9.022   7.257  21.171
  481   HD21  LEU 105          1HD2      LEU 105   7.048   9.597  21.605
  482   HD22  LEU 105          2HD2      LEU 105   7.456   8.901  20.018
  483   HD23  LEU 105          3HD2      LEU 105   5.757   8.988  20.542
  484    H    VAL 106           H        VAL 106   6.970   3.955  23.303
  485    HA   VAL 106           HA       VAL 106   4.194   4.098  24.251
  486    HB   VAL 106           HB       VAL 106   6.764   3.251  25.656
  487   HG11  VAL 106          1HG1      VAL 106   5.293   2.269  27.346
  488   HG12  VAL 106          2HG1      VAL 106   5.113   4.036  27.252
  489   HG13  VAL 106          3HG1      VAL 106   3.880   2.976  26.528
  490   HG21  VAL 106          1HG2      VAL 106   5.875   0.967  25.316
  491   HG22  VAL 106          2HG2      VAL 106   4.486   1.640  24.432
  492   HG23  VAL 106          3HG2      VAL 106   6.128   1.797  23.763
  493    H    SER 107           H        SER 107   3.383   5.953  24.935
  494    HA   SER 107           HA       SER 107   5.184   7.841  26.377
  495    HB2  SER 107          1HB       SER 107   4.072   8.824  24.459
  496    HB3  SER 107          2HB       SER 107   2.507   8.248  25.011
  497    HG   SER 107           HG       SER 107   2.657  10.299  25.640
  498    H    GLN 108           H        GLN 108   5.174   7.523  28.489
  499    HA   GLN 108           HA       GLN 108   2.539   7.001  29.799
  500    HB2  GLN 108          1HB       GLN 108   4.236   5.188  30.079
  501    HB3  GLN 108          2HB       GLN 108   5.329   6.344  30.824
  502    HG2  GLN 108          1HG       GLN 108   3.762   6.690  32.662
  503    HG3  GLN 108          2HG       GLN 108   2.610   5.562  31.894
  504   HE21  GLN 108          1HE2      GLN 108   3.924   2.992  33.827
  505   HE22  GLN 108          2HE2      GLN 108   2.546   3.918  33.332
  506    HA   PRO 109           HA       PRO 109   3.214  11.243  31.048
  507    HB2  PRO 109          1HB       PRO 109   0.541  10.587  32.337
  508    HB3  PRO 109          2HB       PRO 109   1.012  12.026  31.425
  509    HG2  PRO 109          1HG       PRO 109  -0.485  10.196  30.204
  510    HG3  PRO 109          2HG       PRO 109   0.865  10.917  29.323
  511    HD2  PRO 109          1HD       PRO 109   0.720   8.222  30.738
  512    HD3  PRO 109          2HD       PRO 109   1.422   8.622  29.119
  513    H    GLY 110           H        GLY 110   4.598  11.498  32.698
  514    HA2  GLY 110          1HA       GLY 110   5.214  11.759  34.944
  515    HA3  GLY 110          2HA       GLY 110   3.712  10.999  35.435
  516    H    GLY 111           H        GLY 111   5.378   9.210  33.054
  517    HA2  GLY 111          1HA       GLY 111   6.614   7.455  35.148
  518    HA3  GLY 111          2HA       GLY 111   5.670   6.793  33.826
  519    H    LYS 112           H        LYS 112   7.093   5.730  32.576
  520    HA   LYS 112           HA       LYS 112   9.441   7.272  31.568
  521    HB2  LYS 112          1HB       LYS 112  10.206   5.645  33.276
  522    HB3  LYS 112          2HB       LYS 112   9.429   4.340  32.390
  523    HG2  LYS 112          1HG       LYS 112  10.940   4.710  30.485
  524    HG3  LYS 112          2HG       LYS 112  11.710   6.047  31.352
  525    HD2  LYS 112          1HD       LYS 112  12.410   4.500  33.140
  526    HD3  LYS 112          2HD       LYS 112  11.611   3.160  32.306
  527    HE2  LYS 112          1HE       LYS 112  13.110   3.478  30.362
  528    HE3  LYS 112          2HE       LYS 112  13.909   4.813  31.195
  529    HZ1  LYS 112          1HZ       LYS 112  15.126   2.774  31.426
  530    HZ2  LYS 112          2HZ       LYS 112  14.581   3.268  32.904
  531    HZ3  LYS 112          3HZ       LYS 112  13.836   2.021  32.124
  532    HA   PRO 113           HA       PRO 113   7.476   5.966  27.834
  533    HB2  PRO 113          1HB       PRO 113   8.856   7.594  26.131
  534    HB3  PRO 113          2HB       PRO 113   7.604   8.228  27.207
  535    HG2  PRO 113          1HG       PRO 113  10.628   8.205  27.599
  536    HG3  PRO 113          2HG       PRO 113   9.508   9.555  27.808
  537    HD2  PRO 113          1HD       PRO 113  10.353   8.042  29.926
  538    HD3  PRO 113          2HD       PRO 113   8.695   8.763  29.867
  539    H    GLN 114           H        GLN 114   8.179   4.867  25.866
  540    HA   GLN 114           HA       GLN 114  10.994   3.961  25.805
  541    HB2  GLN 114          1HB       GLN 114   9.889   2.310  27.252
  542    HB3  GLN 114          2HB       GLN 114   8.627   2.063  26.054
  543    HG2  GLN 114          1HG       GLN 114  10.138   0.238  25.908
  544    HG3  GLN 114          2HG       GLN 114  10.395   1.256  24.464
  545   HE21  GLN 114          1HE2      GLN 114  13.792   1.555  25.021
  546   HE22  GLN 114          2HE2      GLN 114  12.447   1.531  23.929
  547    H    LEU 115           H        LEU 115  11.690   4.201  23.818
  548    HA   LEU 115           HA       LEU 115   9.769   3.962  21.571
  549    HB2  LEU 115          1HB       LEU 115  11.218   5.922  21.567
  550    HB3  LEU 115          2HB       LEU 115  12.656   4.904  21.696
  551    HG   LEU 115           HG       LEU 115  12.080   3.944  19.431
  552   HD11  LEU 115          1HD1      LEU 115  10.491   5.203  18.048
  553   HD12  LEU 115          2HD1      LEU 115   9.693   4.460  19.455
  554   HD13  LEU 115          3HD1      LEU 115  10.058   6.203  19.454
  555   HD21  LEU 115          1HD2      LEU 115  12.882   5.944  18.222
  556   HD22  LEU 115          2HD2      LEU 115  12.483   6.957  19.631
  557   HD23  LEU 115          3HD2      LEU 115  13.763   5.726  19.752
  558    H    VAL 116           H        VAL 116   9.652   2.255  20.289
  559    HA   VAL 116           HA       VAL 116  11.900   0.286  20.400
  560    HB   VAL 116           HB       VAL 116   8.934  -0.242  19.924
  561   HG11  VAL 116          1HG1      VAL 116   9.556  -2.608  19.972
  562   HG12  VAL 116          2HG1      VAL 116  10.333  -1.741  18.626
  563   HG13  VAL 116          3HG1      VAL 116  11.273  -2.153  20.081
  564   HG21  VAL 116          1HG2      VAL 116   9.060  -1.423  22.095
  565   HG22  VAL 116          2HG2      VAL 116  10.761  -0.926  22.264
  566   HG23  VAL 116          3HG2      VAL 116   9.470   0.300  22.275
  567    H    ALA 117           H        ALA 117  12.999   0.088  18.584
  568    HA   ALA 117           HA       ALA 117  11.878   1.088  16.063
  569    HB1  ALA 117          1HB       ALA 117  14.103   0.528  15.136
  570    HB2  ALA 117          2HB       ALA 117  14.232   1.532  16.601
  571    HB3  ALA 117          3HB       ALA 117  14.554  -0.215  16.688
  572    H    GLU 118           H        GLU 118  11.236  -0.056  14.331
  573    HA   GLU 118           HA       GLU 118  11.415  -3.019  14.473
  574    HB2  GLU 118          1HB       GLU 118   8.819  -1.491  14.019
  575    HB3  GLU 118          2HB       GLU 118   9.014  -3.235  13.910
  576    HG2  GLU 118          1HG       GLU 118   9.585  -3.336  16.293
  577    HG3  GLU 118          2HG       GLU 118   9.432  -1.585  16.412
  578    HA   PRO 119           HA       PRO 119  12.520  -1.224  10.355
  579    HB2  PRO 119          1HB       PRO 119  14.199  -3.752  10.579
  580    HB3  PRO 119          2HB       PRO 119  14.632  -2.192   9.869
  581    HG2  PRO 119          1HG       PRO 119  15.560  -2.764  12.293
  582    HG3  PRO 119          2HG       PRO 119  14.919  -1.146  11.991
  583    HD2  PRO 119          1HD       PRO 119  13.587  -3.512  13.368
  584    HD3  PRO 119          2HD       PRO 119  13.575  -1.764  13.837
  Start of MODEL    2
    1    H    GLN  38          1H        GLN  38  -0.488  -0.872   5.410
    2    HA   GLN  38           HA       GLN  38   1.168   0.429   6.487
    3    HB2  GLN  38          1HB       GLN  38   2.106  -0.920   3.923
    4    HB3  GLN  38          2HB       GLN  38   3.124  -0.537   5.303
    5    HG2  GLN  38          1HG       GLN  38   0.754  -2.416   5.366
    6    HG3  GLN  38          2HG       GLN  38   2.469  -2.898   5.229
    7   HE21  GLN  38          1HE2      GLN  38   0.823  -2.435   8.821
    8   HE22  GLN  38          2HE2      GLN  38  -0.048  -2.632   7.336
    9    H    ALA  39           H        ALA  39   3.336   1.536   5.837
   10    HA   ALA  39           HA       ALA  39   2.577   4.046   4.568
   11    HB1  ALA  39          1HB       ALA  39   4.878   4.750   5.144
   12    HB2  ALA  39          2HB       ALA  39   4.040   4.031   6.539
   13    HB3  ALA  39          3HB       ALA  39   5.252   3.085   5.647
   14    HA   PRO  40           HA       PRO  40   3.843   3.375   0.458
   15    HB2  PRO  40          1HB       PRO  40   5.135   6.110   0.722
   16    HB3  PRO  40          2HB       PRO  40   4.036   5.516  -0.529
   17    HG2  PRO  40          1HG       PRO  40   3.060   7.128   1.354
   18    HG3  PRO  40          2HG       PRO  40   2.116   5.718   0.862
   19    HD2  PRO  40          1HD       PRO  40   3.897   6.077   3.307
   20    HD3  PRO  40          2HD       PRO  40   2.259   5.318   3.193
   21    H    LYS  41           H        LYS  41   5.722   2.881  -0.753
   22    HA   LYS  41           HA       LYS  41   7.964   1.960   0.708
   23    HB2  LYS  41          1HB       LYS  41   7.336   1.096  -1.521
   24    HB3  LYS  41          2HB       LYS  41   7.753   2.640  -2.253
   25    HG2  LYS  41          1HG       LYS  41   9.558   1.153  -2.670
   26    HG3  LYS  41          2HG       LYS  41  10.117   2.300  -1.444
   27    HD2  LYS  41          1HD       LYS  41   9.615   0.637   0.328
   28    HD3  LYS  41          2HD       LYS  41   9.086  -0.511  -0.910
   29    HE2  LYS  41          1HE       LYS  41  11.357  -1.052  -0.314
   30    HE3  LYS  41          2HE       LYS  41  11.372  -0.367  -1.941
   31    HZ1  LYS  41          1HZ       LYS  41  13.113   0.540  -0.586
   32    HZ2  LYS  41          2HZ       LYS  41  12.043   1.730  -0.989
   33    HZ3  LYS  41          3HZ       LYS  41  12.031   1.091   0.531
   34    H    GLY  42           H        GLY  42   9.526   2.994   1.684
   35    HA2  GLY  42          1HA       GLY  42  11.463   4.465   1.541
   36    HA3  GLY  42          2HA       GLY  42  10.561   5.516   0.464
   37    H    SER  43           H        SER  43   8.175   4.906   2.427
   38    HA   SER  43           HA       SER  43   8.734   7.288   4.087
   39    HB2  SER  43          1HB       SER  43   6.645   7.275   2.856
   40    HB3  SER  43          2HB       SER  43   6.203   5.712   3.526
   41    HG   SER  43           HG       SER  43   6.283   6.704   5.589
   42    H    ALA  44           H        ALA  44   8.795   7.339   6.271
   43    HA   ALA  44           HA       ALA  44   9.220   4.825   7.666
   44    HB1  ALA  44          1HB       ALA  44   9.540   6.262   9.653
   45    HB2  ALA  44          2HB       ALA  44  10.498   6.832   8.267
   46    HB3  ALA  44          3HB       ALA  44   8.994   7.670   8.713
   47    H    PHE  45           H        PHE  45   8.018   3.917   9.319
   48    HA   PHE  45           HA       PHE  45   5.144   4.744   9.288
   49    HB2  PHE  45          1HB       PHE  45   5.605   2.529   8.230
   50    HB3  PHE  45          2HB       PHE  45   6.312   1.968   9.736
   51    HD1  PHE  45           HD1      PHE  45   3.309   2.359   7.849
   52    HD2  PHE  45           HD2      PHE  45   4.824   1.952  11.823
   53    HE1  PHE  45           HE1      PHE  45   1.075   1.637   8.624
   54    HE2  PHE  45           HE2      PHE  45   2.591   1.228  12.601
   55    HZ   PHE  45           HZ       PHE  45   0.716   1.072  11.001
   56    H    VAL  46           H        VAL  46   4.600   5.749  11.085
   57    HA   VAL  46           HA       VAL  46   5.888   4.850  13.631
   58    HB   VAL  46           HB       VAL  46   4.815   7.611  12.906
   59   HG11  VAL  46          1HG1      VAL  46   5.804   8.319  15.029
   60   HG12  VAL  46          2HG1      VAL  46   4.523   7.108  15.263
   61   HG13  VAL  46          3HG1      VAL  46   6.233   6.632  15.392
   62   HG21  VAL  46          1HG2      VAL  46   7.196   8.280  12.975
   63   HG22  VAL  46          2HG2      VAL  46   7.661   6.588  13.270
   64   HG23  VAL  46          3HG2      VAL  46   6.910   7.048  11.724
   65    H    ARG  47           H        ARG  47   4.616   4.045  15.150
   66    HA   ARG  47           HA       ARG  47   1.701   4.698  15.018
   67    HB2  ARG  47          1HB       ARG  47   2.054   2.362  14.435
   68    HB3  ARG  47          2HB       ARG  47   3.053   2.112  15.859
   69    HG2  ARG  47          1HG       ARG  47   1.191   2.301  17.325
   70    HG3  ARG  47          2HG       ARG  47   0.143   2.915  16.022
   71    HD2  ARG  47          1HD       ARG  47   1.435   0.205  15.962
   72    HD3  ARG  47          2HD       ARG  47  -0.172   0.517  16.658
   73    HE   ARG  47           HE       ARG  47  -0.220   1.626  14.115
   74   HH11  ARG  47          1HH1      ARG  47   0.300  -1.555  15.510
   75   HH12  ARG  47          2HH1      ARG  47  -0.342  -2.406  14.123
   76   HH21  ARG  47          1HH2      ARG  47  -1.052   0.511  12.321
   77   HH22  ARG  47          2HH2      ARG  47  -1.108  -1.237  12.317
   78    H    ALA  48           H        ALA  48   1.210   6.062  16.588
   79    HA   ALA  48           HA       ALA  48   2.662   5.998  19.137
   80    HB1  ALA  48          1HB       ALA  48   1.206   7.908  19.733
   81    HB2  ALA  48          2HB       ALA  48   2.015   8.158  18.167
   82    HB3  ALA  48          3HB       ALA  48   0.303   7.681  18.218
   83    H    TYR  49           H        TYR  49   1.691   5.718  21.187
   84    HA   TYR  49           HA       TYR  49  -0.861   4.191  21.162
   85    HB2  TYR  49          1HB       TYR  49   0.926   2.508  21.094
   86    HB3  TYR  49          2HB       TYR  49   1.734   3.269  22.458
   87    HD1  TYR  49           HD1      TYR  49  -1.519   1.693  21.498
   88    HD2  TYR  49           HD2      TYR  49   1.301   2.546  24.617
   89    HE1  TYR  49           HE1      TYR  49  -2.811   0.272  23.054
   90    HE2  TYR  49           HE2      TYR  49   0.009   1.124  26.173
   91    HH   TYR  49           HH       TYR  49  -2.972  -0.510  25.128
   92    H    ASN  50           H        ASN  50  -2.211   4.675  22.746
   93    HA   ASN  50           HA       ASN  50  -1.273   6.617  24.780
   94    HB2  ASN  50          1HB       ASN  50  -3.318   7.117  23.466
   95    HB3  ASN  50          2HB       ASN  50  -4.079   5.668  24.108
   96   HD21  ASN  50          1HD2      ASN  50  -5.261   8.484  26.131
   97   HD22  ASN  50          2HD2      ASN  50  -5.370   7.959  24.485
   98    H    ALA  51           H        ALA  51  -0.226   5.578  26.354
   99    HA   ALA  51           HA       ALA  51  -1.388   3.089  27.437
  100    HB1  ALA  51          1HB       ALA  51   0.707   2.960  28.746
  101    HB2  ALA  51          2HB       ALA  51   1.028   3.148  27.006
  102    HB3  ALA  51          3HB       ALA  51   1.201   4.541  28.097
  103    H    GLY  52           H        GLY  52  -2.135   6.170  27.849
  104    HA2  GLY  52          1HA       GLY  52  -2.109   6.197  30.821
  105    HA3  GLY  52          2HA       GLY  52  -2.480   7.557  29.777
  106    H    ASN  53           H        ASN  53  -4.330   7.782  31.278
  107    HA   ASN  53           HA       ASN  53  -6.599   6.053  30.385
  108    HB2  ASN  53          1HB       ASN  53  -6.054   7.157  33.160
  109    HB3  ASN  53          2HB       ASN  53  -7.590   6.456  32.666
  110   HD21  ASN  53          1HD2      ASN  53  -4.621   4.114  33.918
  111   HD22  ASN  53          2HD2      ASN  53  -4.647   5.840  34.072
  112    H    SER  54           H        SER  54  -5.702   8.497  29.194
  113    HA   SER  54           HA       SER  54  -8.265   9.891  29.253
  114    HB2  SER  54          1HB       SER  54  -7.460  12.048  29.908
  115    HB3  SER  54          2HB       SER  54  -6.997  10.909  31.165
  116    HG   SER  54           HG       SER  54  -5.418  11.970  29.098
  117    H    GLU  55           H        GLU  55  -7.969  12.019  27.831
  118    HA   GLU  55           HA       GLU  55  -7.349  11.184  25.214
  119    HB2  GLU  55          1HB       GLU  55  -8.778  13.141  25.768
  120    HB3  GLU  55          2HB       GLU  55  -7.363  14.019  26.326
  121    HG2  GLU  55          1HG       GLU  55  -6.406  13.917  24.057
  122    HG3  GLU  55          2HG       GLU  55  -7.835  13.049  23.500
  123    H    LEU  56           H        LEU  56  -5.547  10.882  24.128
  124    HA   LEU  56           HA       LEU  56  -2.987  11.295  25.391
  125    HB2  LEU  56          1HB       LEU  56  -3.525   9.451  23.780
  126    HB3  LEU  56          2HB       LEU  56  -3.600  10.650  22.485
  127    HG   LEU  56           HG       LEU  56  -1.193  11.194  22.914
  128   HD11  LEU  56          1HD1      LEU  56   0.116   9.651  24.304
  129   HD12  LEU  56          2HD1      LEU  56  -1.109  10.519  25.259
  130   HD13  LEU  56          3HD1      LEU  56  -1.382   8.822  24.793
  131   HD21  LEU  56          1HD2      LEU  56  -0.341   9.110  21.895
  132   HD22  LEU  56          2HD2      LEU  56  -1.845   8.272  22.351
  133   HD23  LEU  56          3HD2      LEU  56  -1.888   9.595  21.161
  134    H    ASP  57           H        ASP  57  -1.723  13.011  25.409
  135    HA   ASP  57           HA       ASP  57  -2.187  15.107  23.330
  136    HB2  ASP  57          1HB       ASP  57  -2.641  15.841  25.666
  137    HB3  ASP  57          2HB       ASP  57  -0.999  15.408  26.119
  138    H    VAL  58           H        VAL  58  -0.823  13.974  21.850
  139    HA   VAL  58           HA       VAL  58   2.063  14.419  22.449
  140    HB   VAL  58           HB       VAL  58   0.850  11.928  21.176
  141   HG11  VAL  58          1HG1      VAL  58   3.150  11.112  21.006
  142   HG12  VAL  58          2HG1      VAL  58   2.888  12.574  20.025
  143   HG13  VAL  58          3HG1      VAL  58   3.750  12.687  21.579
  144   HG21  VAL  58          1HG2      VAL  58   1.879  10.780  23.110
  145   HG22  VAL  58          2HG2      VAL  58   2.433  12.347  23.745
  146   HG23  VAL  58          3HG2      VAL  58   0.691  11.994  23.640
  147    H    SER  59           H        SER  59   3.190  15.358  20.862
  148    HA   SER  59           HA       SER  59   1.838  15.640  18.212
  149    HB2  SER  59          1HB       SER  59   2.226  17.762  19.406
  150    HB3  SER  59          2HB       SER  59   3.940  17.395  19.527
  151    HG   SER  59           HG       SER  59   4.135  17.519  17.369
  152    H    VAL  60           H        VAL  60   2.645  14.487  16.615
  153    HA   VAL  60           HA       VAL  60   5.369  13.337  17.013
  154    HB   VAL  60           HB       VAL  60   3.044  12.309  15.328
  155   HG11  VAL  60          1HG1      VAL  60   4.385  10.276  15.098
  156   HG12  VAL  60          2HG1      VAL  60   5.197  11.693  14.390
  157   HG13  VAL  60          3HG1      VAL  60   5.724  11.062  15.969
  158   HG21  VAL  60          1HG2      VAL  60   2.889  10.550  17.060
  159   HG22  VAL  60          2HG2      VAL  60   4.179  11.352  17.988
  160   HG23  VAL  60          3HG2      VAL  60   2.612  12.164  17.755
  161    H    GLY  61           H        GLY  61   6.742  14.701  16.001
  162    HA2  GLY  61          1HA       GLY  61   7.935  15.499  14.174
  163    HA3  GLY  61          2HA       GLY  61   6.912  14.523  13.137
  164    H    SER  62           H        SER  62   5.484  15.527  11.848
  165    HA   SER  62           HA       SER  62   5.189  18.467  12.213
  166    HB2  SER  62          1HB       SER  62   4.632  18.534   9.848
  167    HB3  SER  62          2HB       SER  62   6.151  17.680  10.080
  168    HG   SER  62           HG       SER  62   3.710  16.318  10.030
  169    H    THR  63           H        THR  63   3.539  15.653  12.850
  170    HA   THR  63           HA       THR  63   0.895  16.993  12.452
  171    HB   THR  63           HB       THR  63   1.526  14.015  12.280
  172    HG1  THR  63           HG1      THR  63   0.355  15.416  10.176
  173   HG21  THR  63          1HG2      THR  63  -0.846  13.787  11.652
  174   HG22  THR  63          2HG2      THR  63  -0.683  14.465  13.290
  175   HG23  THR  63          3HG2      THR  63  -1.088  15.529  11.923
  176    H    SER  64           H        SER  64   0.058  17.609  14.299
  177    HA   SER  64           HA       SER  64   0.802  16.326  16.815
  178    HB2  SER  64          1HB       SER  64  -1.241  18.473  16.156
  179    HB3  SER  64          2HB       SER  64  -0.840  17.945  17.783
  180    HG   SER  64           HG       SER  64   1.410  18.405  17.030
  181    H    LEU  65           H        LEU  65  -0.491  15.139  18.188
  182    HA   LEU  65           HA       LEU  65  -2.831  13.871  16.826
  183    HB2  LEU  65          1HB       LEU  65  -0.915  12.350  17.041
  184    HB3  LEU  65          2HB       LEU  65  -0.835  12.665  18.778
  185    HG   LEU  65           HG       LEU  65  -3.097  11.622  19.027
  186   HD11  LEU  65          1HD1      LEU  65  -3.991  10.324  17.146
  187   HD12  LEU  65          2HD1      LEU  65  -3.920  12.061  16.771
  188   HD13  LEU  65          3HD1      LEU  65  -2.700  10.953  16.096
  189   HD21  LEU  65          1HD2      LEU  65  -2.284   9.313  18.684
  190   HD22  LEU  65          2HD2      LEU  65  -0.967   9.928  17.656
  191   HD23  LEU  65          3HD2      LEU  65  -1.012  10.341  19.387
  192    H    ASN  66           H        ASN  66  -4.690  14.418  17.702
  193    HA   ASN  66           HA       ASN  66  -4.842  14.552  20.678
  194    HB2  ASN  66          1HB       ASN  66  -6.086  16.491  18.702
  195    HB3  ASN  66          2HB       ASN  66  -6.505  16.413  20.407
  196   HD21  ASN  66          1HD2      ASN  66  -3.392  18.575  19.220
  197   HD22  ASN  66          2HD2      ASN  66  -4.613  17.933  18.173
  198    H    ASP  67           H        ASP  67  -7.181  14.532  21.425
  199    HA   ASP  67           HA       ASP  67  -9.110  13.289  21.623
  200    HB2  ASP  67          1HB       ASP  67  -9.599  14.761  19.566
  201    HB3  ASP  67          2HB       ASP  67  -9.245  13.344  18.590
  202    H    VAL  68           H        VAL  68  -7.154  11.662  22.063
  203    HA   VAL  68           HA       VAL  68  -7.861   9.229  20.475
  204    HB   VAL  68           HB       VAL  68  -5.220   9.870  21.859
  205   HG11  VAL  68          1HG1      VAL  68  -4.425   7.777  20.873
  206   HG12  VAL  68          2HG1      VAL  68  -5.761   7.508  22.018
  207   HG13  VAL  68          3HG1      VAL  68  -6.063   7.442  20.264
  208   HG21  VAL  68          1HG2      VAL  68  -4.316   9.877  19.555
  209   HG22  VAL  68          2HG2      VAL  68  -5.954   9.611  18.913
  210   HG23  VAL  68          3HG2      VAL  68  -5.565  11.127  19.760
  211    H    ALA  69           H        ALA  69  -8.830   7.665  21.562
  212    HA   ALA  69           HA       ALA  69  -9.402   7.993  24.368
  213    HB1  ALA  69          1HB       ALA  69 -10.568   5.823  24.145
  214    HB2  ALA  69          2HB       ALA  69 -11.006   6.945  22.834
  215    HB3  ALA  69          3HB       ALA  69  -9.861   5.619  22.525
  216    HA   PRO  70           HA       PRO  70  -6.207   5.943  26.470
  217    HB2  PRO  70          1HB       PRO  70  -8.424   4.288  27.740
  218    HB3  PRO  70          2HB       PRO  70  -7.080   5.129  28.523
  219    HG2  PRO  70          1HG       PRO  70  -9.483   6.265  28.598
  220    HG3  PRO  70          2HG       PRO  70  -8.079   7.275  28.248
  221    HD2  PRO  70          1HD       PRO  70 -10.132   6.111  26.327
  222    HD3  PRO  70          2HD       PRO  70  -9.395   7.763  26.344
  223    H    LEU  71           H        LEU  71  -4.920   4.234  25.988
  224    HA   LEU  71           HA       LEU  71  -4.218   2.205  25.154
  225    HB2  LEU  71          1HB       LEU  71  -7.112   1.315  25.384
  226    HB3  LEU  71          2HB       LEU  71  -5.685   0.279  25.267
  227    HG   LEU  71           HG       LEU  71  -6.410   2.068  27.614
  228   HD11  LEU  71          1HD1      LEU  71  -6.748  -0.067  28.779
  229   HD12  LEU  71          2HD1      LEU  71  -7.843   0.103  27.386
  230   HD13  LEU  71          3HD1      LEU  71  -6.409  -0.944  27.269
  231   HD21  LEU  71          1HD2      LEU  71  -4.472   0.990  28.707
  232   HD22  LEU  71          2HD2      LEU  71  -4.100   0.126  27.195
  233   HD23  LEU  71          3HD2      LEU  71  -3.969   1.900  27.262
  234    H    GLY  72           H        GLY  72  -5.567   4.406  23.505
  235    HA2  GLY  72          1HA       GLY  72  -6.309   2.862  21.086
  236    HA3  GLY  72          2HA       GLY  72  -6.399   4.603  21.277
  237    H    SER  73           H        SER  73  -5.352   4.471  19.096
  238    HA   SER  73           HA       SER  73  -2.487   4.876  19.336
  239    HB2  SER  73          1HB       SER  73  -1.746   3.093  17.901
  240    HB3  SER  73          2HB       SER  73  -2.636   2.388  19.240
  241    HG   SER  73           HG       SER  73  -3.575   2.908  16.640
  242    H    SER  74           H        SER  74  -1.487   5.352  17.179
  243    HA   SER  74           HA       SER  74  -3.349   5.998  15.010
  244    HB2  SER  74          1HB       SER  74  -3.594   7.964  16.458
  245    HB3  SER  74          2HB       SER  74  -1.852   8.186  16.490
  246    HG   SER  74           HG       SER  74  -1.950   8.389  14.213
  247    H    ASP  75           H        ASP  75  -2.389   6.008  13.061
  248    HA   ASP  75           HA       ASP  75   0.524   5.409  13.073
  249    HB2  ASP  75          1HB       ASP  75  -1.648   4.899  11.002
  250    HB3  ASP  75          2HB       ASP  75   0.059   4.581  10.725
  251    H    PHE  76           H        PHE  76   1.989   6.470  11.800
  252    HA   PHE  76           HA       PHE  76   0.975   8.897  10.384
  253    HB2  PHE  76          1HB       PHE  76   3.498   8.740  12.081
  254    HB3  PHE  76          2HB       PHE  76   2.940  10.144  11.185
  255    HD1  PHE  76           HD1      PHE  76   2.365   8.018  14.119
  256    HD2  PHE  76           HD2      PHE  76   1.099  11.493  11.980
  257    HE1  PHE  76           HE1      PHE  76   1.063   8.754  16.089
  258    HE2  PHE  76           HE2      PHE  76  -0.201  12.233  13.948
  259    HZ   PHE  76           HZ       PHE  76  -0.220  10.862  16.003
  260    H    LYS  77           H        LYS  77   2.177   9.609   8.603
  261    HA   LYS  77           HA       LYS  77   4.121   7.590   7.562
  262    HB2  LYS  77          1HB       LYS  77   1.969   9.096   6.023
  263    HB3  LYS  77          2HB       LYS  77   3.228   8.122   5.277
  264    HG2  LYS  77          1HG       LYS  77   2.364   6.106   6.319
  265    HG3  LYS  77          2HG       LYS  77   1.175   7.046   7.230
  266    HD2  LYS  77          1HD       LYS  77   0.118   7.774   5.122
  267    HD3  LYS  77          2HD       LYS  77   1.319   6.861   4.198
  268    HE2  LYS  77          1HE       LYS  77   0.535   4.762   5.199
  269    HE3  LYS  77          2HE       LYS  77  -0.619   5.646   6.201
  270    HZ1  LYS  77          1HZ       LYS  77  -1.658   4.730   4.258
  271    HZ2  LYS  77          2HZ       LYS  77  -1.712   6.378   4.194
  272    HZ3  LYS  77          3HZ       LYS  77  -0.635   5.550   3.258
  273    H    PHE  78           H        PHE  78   6.062   8.370   7.271
  274    HA   PHE  78           HA       PHE  78   6.314  11.259   6.543
  275    HB2  PHE  78          1HB       PHE  78   8.097   9.599   8.368
  276    HB3  PHE  78          2HB       PHE  78   8.511  11.202   7.779
  277    HD1  PHE  78           HD1      PHE  78   6.347   9.281  10.025
  278    HD2  PHE  78           HD2      PHE  78   7.377  13.178   8.610
  279    HE1  PHE  78           HE1      PHE  78   5.132  10.291  11.927
  280    HE2  PHE  78           HE2      PHE  78   6.166  14.191  10.512
  281    HZ   PHE  78           HZ       PHE  78   5.042  12.746  12.170
  282    H    LEU  79           H        LEU  79   6.541  10.999   4.368
  283    HA   LEU  79           HA       LEU  79   8.107   8.988   3.107
  284    HB2  LEU  79          1HB       LEU  79   6.440  10.288   1.893
  285    HB3  LEU  79          2HB       LEU  79   7.342  11.779   2.181
  286    HG   LEU  79           HG       LEU  79   9.192  10.909   0.766
  287   HD11  LEU  79          1HD1      LEU  79   8.807   8.895  -0.584
  288   HD12  LEU  79          2HD1      LEU  79   8.829   8.526   1.155
  289   HD13  LEU  79          3HD1      LEU  79   7.280   8.607   0.282
  290   HD21  LEU  79          1HD2      LEU  79   7.969  11.127  -1.371
  291   HD22  LEU  79          2HD2      LEU  79   6.429  10.870  -0.517
  292   HD23  LEU  79          3HD2      LEU  79   7.400  12.325  -0.183
  293    HA   PRO  80           HA       PRO  80  11.703  12.047   3.138
  294    HB2  PRO  80          1HB       PRO  80  11.588  14.403   4.457
  295    HB3  PRO  80          2HB       PRO  80  10.820  14.227   2.874
  296    HG2  PRO  80          1HG       PRO  80   9.549  14.056   5.642
  297    HG3  PRO  80          2HG       PRO  80   9.009  15.000   4.251
  298    HD2  PRO  80          1HD       PRO  80   7.969  12.524   4.844
  299    HD3  PRO  80          2HD       PRO  80   8.100  13.143   3.150
  300    HA   PRO  81           HA       PRO  81  12.654  10.329   7.148
  301    HB2  PRO  81          1HB       PRO  81  15.220   9.570   6.617
  302    HB3  PRO  81          2HB       PRO  81  13.840   8.695   5.943
  303    HG2  PRO  81          1HG       PRO  81  15.558  10.851   4.638
  304    HG3  PRO  81          2HG       PRO  81  15.080   9.285   3.976
  305    HD2  PRO  81          1HD       PRO  81  13.722  11.585   3.371
  306    HD3  PRO  81          2HD       PRO  81  12.887   9.984   3.497
  307    H    GLY  82           H        GLY  82  14.360  10.753   8.825
  308    HA2  GLY  82          1HA       GLY  82  16.390  12.467   9.035
  309    HA3  GLY  82          2HA       GLY  82  15.103  13.630   8.780
  310    H    SER  83           H        SER  83  16.088  14.214  11.001
  311    HA   SER  83           HA       SER  83  15.135  12.561  13.230
  312    HB2  SER  83          1HB       SER  83  17.249  13.712  13.480
  313    HB3  SER  83          2HB       SER  83  16.514  15.259  13.091
  314    HG   SER  83           HG       SER  83  15.064  14.470  14.975
  315    H    TYR  84           H        TYR  84  13.163  12.625  14.016
  316    HA   TYR  84           HA       TYR  84  11.685  15.219  13.870
  317    HB2  TYR  84          1HB       TYR  84  10.613  12.383  13.608
  318    HB3  TYR  84          2HB       TYR  84   9.589  13.791  13.854
  319    HD1  TYR  84           HD1      TYR  84  11.969  12.175  11.523
  320    HD2  TYR  84           HD2      TYR  84   9.055  15.275  12.077
  321    HE1  TYR  84           HE1      TYR  84  11.927  12.572   9.083
  322    HE2  TYR  84           HE2      TYR  84   9.012  15.671   9.637
  323    HH   TYR  84           HH       TYR  84  10.758  13.586   7.405
  324    H    THR  85           H        THR  85  10.455  15.845  15.615
  325    HA   THR  85           HA       THR  85  11.221  14.485  18.150
  326    HB   THR  85           HB       THR  85  10.145  17.295  17.661
  327    HG1  THR  85           HG1      THR  85  12.238  17.910  18.037
  328   HG21  THR  85          1HG2      THR  85  10.642  17.657  20.047
  329   HG22  THR  85          2HG2      THR  85   9.422  16.379  19.839
  330   HG23  THR  85          3HG2      THR  85  11.107  15.948  20.214
  331    H    ALA  86           H        ALA  86   9.812  13.284  19.189
  332    HA   ALA  86           HA       ALA  86   6.918  13.755  18.700
  333    HB1  ALA  86          1HB       ALA  86   6.589  11.561  19.793
  334    HB2  ALA  86          2HB       ALA  86   7.690  11.445  18.400
  335    HB3  ALA  86          3HB       ALA  86   8.344  11.436  20.054
  336    H    GLN  87           H        GLN  87   6.273  15.394  19.956
  337    HA   GLN  87           HA       GLN  87   7.408  15.766  22.619
  338    HB2  GLN  87          1HB       GLN  87   6.824  17.680  21.117
  339    HB3  GLN  87          2HB       GLN  87   5.127  17.241  21.243
  340    HG2  GLN  87          1HG       GLN  87   5.524  19.046  22.730
  341    HG3  GLN  87          2HG       GLN  87   5.296  17.580  23.724
  342   HE21  GLN  87          1HE2      GLN  87   8.150  18.431  25.514
  343   HE22  GLN  87          2HE2      GLN  87   6.454  18.074  25.514
  344    H    VAL  88           H        VAL  88   6.754  14.793  24.381
  345    HA   VAL  88           HA       VAL  88   3.905  13.891  24.503
  346    HB   VAL  88           HB       VAL  88   6.331  12.583  25.806
  347   HG11  VAL  88          1HG1      VAL  88   4.777  10.771  26.344
  348   HG12  VAL  88          2HG1      VAL  88   4.297  12.307  27.104
  349   HG13  VAL  88          3HG1      VAL  88   3.435  11.720  25.661
  350   HG21  VAL  88          1HG2      VAL  88   5.951  10.775  24.159
  351   HG22  VAL  88          2HG2      VAL  88   4.650  11.731  23.411
  352   HG23  VAL  88          3HG2      VAL  88   6.331  12.314  23.349
  353    H    GLY  89           H        GLY  89   3.441  15.997  25.433
  354    HA2  GLY  89          1HA       GLY  89   2.892  17.270  27.301
  355    HA3  GLY  89          2HA       GLY  89   3.461  15.959  28.317
  356    H    GLN  90           H        GLN  90   5.244  16.306  29.487
  357    HA   GLN  90           HA       GLN  90   6.896  18.685  28.865
  358    HB2  GLN  90          1HB       GLN  90   6.874  16.849  31.294
  359    HB3  GLN  90          2HB       GLN  90   7.879  18.280  31.119
  360    HG2  GLN  90          1HG       GLN  90   4.855  18.247  31.159
  361    HG3  GLN  90          2HG       GLN  90   5.929  18.716  32.506
  362   HE21  GLN  90          1HE2      GLN  90   4.661  21.519  30.053
  363   HE22  GLN  90          2HE2      GLN  90   3.889  20.006  30.393
  364    H    GLN  91           H        GLN  91   6.875  15.450  28.115
  365    HA   GLN  91           HA       GLN  91   9.857  15.352  27.982
  366    HB2  GLN  91          1HB       GLN  91   7.849  13.066  27.829
  367    HB3  GLN  91          2HB       GLN  91   9.598  12.902  27.757
  368    HG2  GLN  91          1HG       GLN  91   8.052  13.997  30.117
  369    HG3  GLN  91          2HG       GLN  91   8.685  12.333  29.959
  370   HE21  GLN  91          1HE2      GLN  91  10.962  15.070  31.647
  371   HE22  GLN  91          2HE2      GLN  91   9.233  15.080  31.545
  372    H    SER  92           H        SER  92  10.653  13.973  26.090
  373    HA   SER  92           HA       SER  92   8.975  14.017  23.700
  374    HB2  SER  92          1HB       SER  92  10.358  15.492  22.385
  375    HB3  SER  92          2HB       SER  92   9.818  16.356  23.817
  376    HG   SER  92           HG       SER  92  12.115  16.414  23.160
  377    H    LEU  93           H        LEU  93   9.926  12.935  21.896
  378    HA   LEU  93           HA       LEU  93  12.253  11.232  22.685
  379    HB2  LEU  93          1HB       LEU  93   9.882  10.553  20.909
  380    HB3  LEU  93          2HB       LEU  93  11.282   9.508  21.167
  381    HG   LEU  93           HG       LEU  93   9.384  10.392  23.369
  382   HD11  LEU  93          1HD1      LEU  93   8.472   8.119  23.207
  383   HD12  LEU  93          2HD1      LEU  93   8.225   9.035  21.703
  384   HD13  LEU  93          3HD1      LEU  93   9.507   7.804  21.794
  385   HD21  LEU  93          1HD2      LEU  93  10.496   8.575  24.622
  386   HD22  LEU  93          2HD2      LEU  93  11.561   8.265  23.228
  387   HD23  LEU  93          3HD2      LEU  93  11.670   9.809  24.107
  388    HA   PRO  94           HA       PRO  94  14.106  12.982  19.098
  389    HB2  PRO  94          1HB       PRO  94  16.488  11.673  19.181
  390    HB3  PRO  94          2HB       PRO  94  16.078  12.899  20.387
  391    HG2  PRO  94          1HG       PRO  94  15.859   9.866  20.596
  392    HG3  PRO  94          2HG       PRO  94  16.570  10.993  21.755
  393    HD2  PRO  94          1HD       PRO  94  13.995  10.064  22.001
  394    HD3  PRO  94          2HD       PRO  94  14.490  11.710  22.566
  395    H    VAL  95           H        VAL  95  12.332  11.759  17.917
  396    HA   VAL  95           HA       VAL  95  12.851   8.970  17.226
  397    HB   VAL  95           HB       VAL  95  10.672  10.841  16.207
  398   HG11  VAL  95          1HG1      VAL  95   9.451   8.773  15.738
  399   HG12  VAL  95          2HG1      VAL  95  10.976   8.868  14.824
  400   HG13  VAL  95          3HG1      VAL  95  10.862   7.822  16.260
  401   HG21  VAL  95          1HG2      VAL  95   9.273   9.824  17.978
  402   HG22  VAL  95          2HG2      VAL  95  10.684   8.913  18.567
  403   HG23  VAL  95          3HG2      VAL  95  10.665  10.689  18.674
  404    H    LYS  96           H        LYS  96  14.886   9.312  16.097
  405    HA   LYS  96           HA       LYS  96  14.943  10.603  13.528
  406    HB2  LYS  96          1HB       LYS  96  16.995  10.006  14.773
  407    HB3  LYS  96          2HB       LYS  96  16.614   8.298  14.608
  408    HG2  LYS  96          1HG       LYS  96  16.876   8.434  12.183
  409    HG3  LYS  96          2HG       LYS  96  17.163  10.177  12.292
  410    HD2  LYS  96          1HD       LYS  96  19.173   9.755  13.680
  411    HD3  LYS  96          2HD       LYS  96  18.887   8.013  13.556
  412    HE2  LYS  96          1HE       LYS  96  19.251   9.791  11.126
  413    HE3  LYS  96          2HE       LYS  96  20.600   8.992  11.938
  414    HZ1  LYS  96          1HZ       LYS  96  19.789   7.703  10.104
  415    HZ2  LYS  96          2HZ       LYS  96  19.535   6.885  11.514
  416    HZ3  LYS  96          3HZ       LYS  96  18.275   7.630  10.752
  417    H    LEU  97           H        LEU  97  13.780  10.118  11.826
  418    HA   LEU  97           HA       LEU  97  12.633   7.391  11.637
  419    HB2  LEU  97          1HB       LEU  97  11.972   9.982  10.195
  420    HB3  LEU  97          2HB       LEU  97  11.166   8.440   9.892
  421    HG   LEU  97           HG       LEU  97  11.098  10.045  12.471
  422   HD11  LEU  97          1HD1      LEU  97   8.714  10.264  11.924
  423   HD12  LEU  97          2HD1      LEU  97   9.748  10.966  10.656
  424   HD13  LEU  97          3HD1      LEU  97   8.982   9.380  10.404
  425   HD21  LEU  97          1HD2      LEU  97   9.534   8.294  13.246
  426   HD22  LEU  97          2HD2      LEU  97   9.812   7.380  11.744
  427   HD23  LEU  97          3HD2      LEU  97  11.141   7.610  12.904
  428    H    ASP  98           H        ASP  98  13.690   5.945  10.480
  429    HA   ASP  98           HA       ASP  98  15.121   6.842   8.031
  430    HB2  ASP  98          1HB       ASP  98  15.135   4.187   9.520
  431    HB3  ASP  98          2HB       ASP  98  15.992   4.474   8.013
  432    HA   PRO  99           HA       PRO  99  12.093   5.580   5.236
  433    HB2  PRO  99          1HB       PRO  99  14.327   4.095   3.803
  434    HB3  PRO  99          2HB       PRO  99  13.147   5.233   3.141
  435    HG2  PRO  99          1HG       PRO  99  15.617   6.107   3.591
  436    HG3  PRO  99          2HG       PRO  99  14.255   7.133   4.053
  437    HD2  PRO  99          1HD       PRO  99  15.975   5.325   5.798
  438    HD3  PRO  99          2HD       PRO  99  15.377   6.998   6.134
  439    H    ASP 100           H        ASP 100  10.627   3.979   5.396
  440    HA   ASP 100           HA       ASP 100   9.700   1.876   5.488
  441    HB2  ASP 100          1HB       ASP 100  12.470   1.001   4.574
  442    HB3  ASP 100          2HB       ASP 100  11.060  -0.048   4.635
  443    H    SER 101           H        SER 101  11.306   3.095   7.765
  444    HA   SER 101           HA       SER 101  11.726   0.586   9.318
  445    HB2  SER 101          1HB       SER 101  13.576   2.186   9.384
  446    HB3  SER 101          2HB       SER 101  12.492   3.463   9.914
  447    HG   SER 101           HG       SER 101  12.757   1.043  11.301
  448    H    TYR 102           H        TYR 102  10.734   0.269  11.321
  449    HA   TYR 102           HA       TYR 102   8.133   1.717  11.526
  450    HB2  TYR 102          1HB       TYR 102   8.976  -1.085  12.345
  451    HB3  TYR 102          2HB       TYR 102   7.472  -0.354  12.889
  452    HD1  TYR 102           HD1      TYR 102   9.375  -1.295   9.826
  453    HD2  TYR 102           HD2      TYR 102   5.552  -0.400  11.555
  454    HE1  TYR 102           HE1      TYR 102   8.262  -2.035   7.748
  455    HE2  TYR 102           HE2      TYR 102   4.438  -1.140   9.476
  456    HH   TYR 102           HH       TYR 102   4.709  -1.950   7.433
  457    H    TYR 103           H        TYR 103   7.443   2.630  13.377
  458    HA   TYR 103           HA       TYR 103   9.274   2.485  15.724
  459    HB2  TYR 103          1HB       TYR 103   8.135   5.047  14.532
  460    HB3  TYR 103          2HB       TYR 103   9.048   4.937  16.030
  461    HD1  TYR 103           HD1      TYR 103   9.241   4.587  12.354
  462    HD2  TYR 103           HD2      TYR 103  11.425   4.770  16.042
  463    HE1  TYR 103           HE1      TYR 103  11.348   4.871  11.093
  464    HE2  TYR 103           HE2      TYR 103  13.532   5.054  14.782
  465    HH   TYR 103           HH       TYR 103  14.230   5.880  12.528
  466    H    THR 104           H        THR 104   8.342   2.534  17.695
  467    HA   THR 104           HA       THR 104   5.393   3.020  17.762
  468    HB   THR 104           HB       THR 104   7.008   1.101  19.496
  469    HG1  THR 104           HG1      THR 104   5.474   0.839  17.181
  470   HG21  THR 104          1HG2      THR 104   4.815   0.462  20.419
  471   HG22  THR 104          2HG2      THR 104   5.160   2.181  20.729
  472   HG23  THR 104          3HG2      THR 104   4.030   1.720  19.436
  473    H    LEU 105           H        LEU 105   4.702   4.607  19.000
  474    HA   LEU 105           HA       LEU 105   6.659   5.800  20.912
  475    HB2  LEU 105          1HB       LEU 105   4.262   7.112  19.586
  476    HB3  LEU 105          2HB       LEU 105   5.461   7.905  20.612
  477    HG   LEU 105           HG       LEU 105   6.005   6.696  17.877
  478   HD11  LEU 105          1HD1      LEU 105   6.238   9.037  17.172
  479   HD12  LEU 105          2HD1      LEU 105   4.600   8.691  17.774
  480   HD13  LEU 105          3HD1      LEU 105   5.757   9.574  18.798
  481   HD21  LEU 105          1HD2      LEU 105   8.201   7.802  18.134
  482   HD22  LEU 105          2HD2      LEU 105   7.748   8.323  19.774
  483   HD23  LEU 105          3HD2      LEU 105   7.941   6.592  19.412
  484    H    VAL 106           H        VAL 106   6.231   4.778  22.798
  485    HA   VAL 106           HA       VAL 106   3.416   4.450  23.640
  486    HB   VAL 106           HB       VAL 106   6.014   3.558  24.964
  487   HG11  VAL 106          1HG1      VAL 106   4.582   2.142  26.354
  488   HG12  VAL 106          2HG1      VAL 106   4.239   3.872  26.590
  489   HG13  VAL 106          3HG1      VAL 106   3.141   2.871  25.610
  490   HG21  VAL 106          1HG2      VAL 106   5.360   1.316  24.147
  491   HG22  VAL 106          2HG2      VAL 106   3.945   2.027  23.334
  492   HG23  VAL 106          3HG2      VAL 106   5.588   2.452  22.797
  493    H    SER 107           H        SER 107   2.459   6.083  24.628
  494    HA   SER 107           HA       SER 107   4.109   7.897  26.316
  495    HB2  SER 107          1HB       SER 107   2.807   9.012  24.600
  496    HB3  SER 107          2HB       SER 107   1.341   8.194  25.112
  497    HG   SER 107           HG       SER 107   2.286   9.278  27.246
  498    H    GLN 108           H        GLN 108   4.254   7.202  28.338
  499    HA   GLN 108           HA       GLN 108   1.741   6.251  29.650
  500    HB2  GLN 108          1HB       GLN 108   3.375   4.459  29.577
  501    HB3  GLN 108          2HB       GLN 108   4.643   5.514  30.185
  502    HG2  GLN 108          1HG       GLN 108   3.925   4.082  31.953
  503    HG3  GLN 108          2HG       GLN 108   3.366   5.739  32.317
  504   HE21  GLN 108          1HE2      GLN 108   0.056   4.808  32.677
  505   HE22  GLN 108          2HE2      GLN 108   1.340   5.928  32.990
  506    HA   PRO 109           HA       PRO 109   2.239  10.174  31.754
  507    HB2  PRO 109          1HB       PRO 109  -0.241   8.996  33.055
  508    HB3  PRO 109          2HB       PRO 109   0.032  10.642  32.471
  509    HG2  PRO 109          1HG       PRO 109  -1.436   9.001  30.977
  510    HG3  PRO 109          2HG       PRO 109  -0.236  10.027  30.186
  511    HD2  PRO 109          1HD       PRO 109  -0.043   7.082  30.935
  512    HD3  PRO 109          2HD       PRO 109   0.471   7.905  29.409
  513    H    GLY 110           H        GLY 110   3.174  10.596  33.713
  514    HA2  GLY 110          1HA       GLY 110   3.514  10.148  36.078
  515    HA3  GLY 110          2HA       GLY 110   3.172   8.453  35.790
  516    H    GLY 111           H        GLY 111   4.865   8.730  33.219
  517    HA2  GLY 111          1HA       GLY 111   7.579   8.951  34.429
  518    HA3  GLY 111          2HA       GLY 111   7.132   7.442  33.656
  519    H    LYS 112           H        LYS 112   8.803   7.722  32.108
  520    HA   LYS 112           HA       LYS 112   8.403   9.961  30.184
  521    HB2  LYS 112          1HB       LYS 112  10.750   8.069  30.600
  522    HB3  LYS 112          2HB       LYS 112  10.665   9.273  29.322
  523    HG2  LYS 112          1HG       LYS 112  10.513  11.061  31.042
  524    HG3  LYS 112          2HG       LYS 112  10.673   9.829  32.302
  525    HD2  LYS 112          1HD       LYS 112  12.869   9.164  31.380
  526    HD3  LYS 112          2HD       LYS 112  12.710  10.389  30.114
  527    HE2  LYS 112          1HE       LYS 112  12.632  12.164  31.830
  528    HE3  LYS 112          2HE       LYS 112  12.772  10.947  33.103
  529    HZ1  LYS 112          1HZ       LYS 112  14.880  11.944  32.599
  530    HZ2  LYS 112          2HZ       LYS 112  14.915  10.342  32.208
  531    HZ3  LYS 112          3HZ       LYS 112  14.785  11.478  31.020
  532    HA   PRO 113           HA       PRO 113   6.750   7.274  27.207
  533    HB2  PRO 113          1HB       PRO 113   7.418   8.583  24.884
  534    HB3  PRO 113          2HB       PRO 113   6.197   9.204  26.003
  535    HG2  PRO 113          1HG       PRO 113   9.142   9.961  25.775
  536    HG3  PRO 113          2HG       PRO 113   7.742  11.033  25.873
  537    HD2  PRO 113          1HD       PRO 113   9.219  10.449  28.081
  538    HD3  PRO 113          2HD       PRO 113   7.425  10.660  28.183
  539    H    GLN 114           H        GLN 114   7.334   5.701  25.614
  540    HA   GLN 114           HA       GLN 114  10.260   5.110  25.614
  541    HB2  GLN 114          1HB       GLN 114   7.940   3.180  25.208
  542    HB3  GLN 114          2HB       GLN 114   9.642   2.757  25.339
  543    HG2  GLN 114          1HG       GLN 114   8.015   4.054  27.535
  544    HG3  GLN 114          2HG       GLN 114   8.370   2.309  27.395
  545   HE21  GLN 114          1HE2      GLN 114  10.899   4.685  29.332
  546   HE22  GLN 114          2HE2      GLN 114   9.246   5.055  28.970
  547    H    LEU 115           H        LEU 115  11.330   4.571  23.769
  548    HA   LEU 115           HA       LEU 115   9.778   4.909  21.235
  549    HB2  LEU 115          1HB       LEU 115  11.230   6.826  21.582
  550    HB3  LEU 115          2HB       LEU 115  12.614   5.774  21.899
  551    HG   LEU 115           HG       LEU 115  12.562   4.999  19.551
  552   HD11  LEU 115          1HD1      LEU 115  11.095   6.129  17.939
  553   HD12  LEU 115          2HD1      LEU 115  10.163   5.237  19.163
  554   HD13  LEU 115          3HD1      LEU 115  10.308   7.008  19.271
  555   HD21  LEU 115          1HD2      LEU 115  13.313   7.132  18.553
  556   HD22  LEU 115          2HD2      LEU 115  12.557   8.027  19.894
  557   HD23  LEU 115          3HD2      LEU 115  13.936   6.947  20.210
  558    H    VAL 116           H        VAL 116   9.545   3.001  20.306
  559    HA   VAL 116           HA       VAL 116  11.861   1.120  20.367
  560    HB   VAL 116           HB       VAL 116   8.920   0.567  19.784
  561   HG11  VAL 116          1HG1      VAL 116   9.561  -1.793  19.867
  562   HG12  VAL 116          2HG1      VAL 116  10.384  -0.924  18.549
  563   HG13  VAL 116          3HG1      VAL 116  11.268  -1.322  20.043
  564   HG21  VAL 116          1HG2      VAL 116   8.970  -0.604  21.963
  565   HG22  VAL 116          2HG2      VAL 116  10.657  -0.089  22.199
  566   HG23  VAL 116          3HG2      VAL 116   9.355   1.123  22.152
  567    H    ALA 117           H        ALA 117  13.042   1.016  18.597
  568    HA   ALA 117           HA       ALA 117  11.752   1.764  16.013
  569    HB1  ALA 117          1HB       ALA 117  14.036   2.302  15.228
  570    HB2  ALA 117          2HB       ALA 117  13.592   3.250  16.668
  571    HB3  ALA 117          3HB       ALA 117  14.681   1.853  16.823
  572    H    GLU 118           H        GLU 118  11.776   0.430  14.307
  573    HA   GLU 118           HA       GLU 118  13.321  -2.112  14.596
  574    HB2  GLU 118          1HB       GLU 118  10.909  -2.528  14.973
  575    HB3  GLU 118          2HB       GLU 118  10.526  -1.773  13.431
  576    HG2  GLU 118          1HG       GLU 118  11.747  -3.528  12.243
  577    HG3  GLU 118          2HG       GLU 118  12.198  -4.272  13.775
  578    HA   PRO 119           HA       PRO 119  15.196  -0.603  10.890
  579    HB2  PRO 119          1HB       PRO 119  16.014  -3.535  10.848
  580    HB3  PRO 119          2HB       PRO 119  17.006  -2.102  10.553
  581    HG2  PRO 119          1HG       PRO 119  17.198  -3.290  12.922
  582    HG3  PRO 119          2HG       PRO 119  17.115  -1.527  12.863
  583    HD2  PRO 119          1HD       PRO 119  14.914  -3.532  13.498
  584    HD3  PRO 119          2HD       PRO 119  15.289  -1.956  14.304
  Start of MODEL    3
    1    H    GLN  38          1H        GLN  38  -1.024  -0.806   0.214
    2    HA   GLN  38           HA       GLN  38   1.144  -0.402   1.069
    3    HB2  GLN  38          1HB       GLN  38   0.942  -1.699  -0.993
    4    HB3  GLN  38          2HB       GLN  38   0.836  -0.230  -1.954
    5    HG2  GLN  38          1HG       GLN  38   3.032  -1.128  -2.180
    6    HG3  GLN  38          2HG       GLN  38   3.144   0.365  -1.206
    7   HE21  GLN  38          1HE2      GLN  38   4.850  -1.206   1.356
    8   HE22  GLN  38          2HE2      GLN  38   4.509   0.220   0.434
    9    H    ALA  39           H        ALA  39   2.226   1.183   1.968
   10    HA   ALA  39           HA       ALA  39   2.049   3.910   1.003
   11    HB1  ALA  39          1HB       ALA  39   3.685   4.394   2.795
   12    HB2  ALA  39          2HB       ALA  39   2.322   3.419   3.392
   13    HB3  ALA  39          3HB       ALA  39   3.892   2.649   3.067
   14    HA   PRO  40           HA       PRO  40   5.224   4.114  -1.951
   15    HB2  PRO  40          1HB       PRO  40   6.030   6.654  -0.488
   16    HB3  PRO  40          2HB       PRO  40   5.751   6.408  -2.216
   17    HG2  PRO  40          1HG       PRO  40   3.852   7.612  -0.796
   18    HG3  PRO  40          2HG       PRO  40   3.382   6.385  -1.976
   19    HD2  PRO  40          1HD       PRO  40   3.670   6.128   1.046
   20    HD3  PRO  40          2HD       PRO  40   2.368   5.484  -0.035
   21    H    LYS  41           H        LYS  41   7.328   3.440  -2.104
   22    HA   LYS  41           HA       LYS  41   8.620   2.326   0.151
   23    HB2  LYS  41          1HB       LYS  41   9.050   1.597  -2.171
   24    HB3  LYS  41          2HB       LYS  41   9.812   3.140  -2.530
   25    HG2  LYS  41          1HG       LYS  41  11.566   1.593  -2.179
   26    HG3  LYS  41          2HG       LYS  41  11.514   2.604  -0.728
   27    HD2  LYS  41          1HD       LYS  41  10.254   0.868   0.469
   28    HD3  LYS  41          2HD       LYS  41  10.222  -0.136  -0.989
   29    HE2  LYS  41          1HE       LYS  41  12.688  -0.269  -0.959
   30    HE3  LYS  41          2HE       LYS  41  12.731   0.743   0.487
   31    HZ1  LYS  41          1HZ       LYS  41  12.898  -1.574   1.027
   32    HZ2  LYS  41          2HZ       LYS  41  11.498  -0.960   1.644
   33    HZ3  LYS  41          3HZ       LYS  41  11.459  -1.906   0.293
   34    H    GLY  42           H        GLY  42   9.715   3.156   1.759
   35    HA2  GLY  42          1HA       GLY  42  11.665   4.553   2.415
   36    HA3  GLY  42          2HA       GLY  42  11.058   5.803   1.345
   37    H    SER  43           H        SER  43   8.224   5.061   2.243
   38    HA   SER  43           HA       SER  43   7.965   7.112   4.212
   39    HB2  SER  43          1HB       SER  43   6.139   6.528   2.711
   40    HB3  SER  43          2HB       SER  43   6.066   4.900   3.368
   41    HG   SER  43           HG       SER  43   5.722   5.996   5.434
   42    H    ALA  44           H        ALA  44   8.080   7.122   6.349
   43    HA   ALA  44           HA       ALA  44   8.256   4.476   7.720
   44    HB1  ALA  44          1HB       ALA  44   9.645   5.614   9.422
   45    HB2  ALA  44          2HB       ALA  44  10.373   5.716   7.801
   46    HB3  ALA  44          3HB       ALA  44   9.534   7.125   8.490
   47    H    PHE  45           H        PHE  45   7.257   4.188   9.708
   48    HA   PHE  45           HA       PHE  45   5.161   6.230  10.317
   49    HB2  PHE  45          1HB       PHE  45   4.863   3.202  10.222
   50    HB3  PHE  45          2HB       PHE  45   3.655   4.292  10.885
   51    HD1  PHE  45           HD1      PHE  45   5.320   3.147   7.818
   52    HD2  PHE  45           HD2      PHE  45   2.280   5.661   9.455
   53    HE1  PHE  45           HE1      PHE  45   4.345   3.433   5.564
   54    HE2  PHE  45           HE2      PHE  45   1.300   5.947   7.204
   55    HZ   PHE  45           HZ       PHE  45   2.335   4.833   5.257
   56    H    VAL  46           H        VAL  46   4.832   6.733  12.401
   57    HA   VAL  46           HA       VAL  46   6.225   5.045  14.439
   58    HB   VAL  46           HB       VAL  46   5.522   8.009  14.585
   59   HG11  VAL  46          1HG1      VAL  46   6.827   7.998  16.655
   60   HG12  VAL  46          2HG1      VAL  46   5.407   6.931  16.758
   61   HG13  VAL  46          3HG1      VAL  46   7.028   6.235  16.518
   62   HG21  VAL  46          1HG2      VAL  46   7.972   8.342  14.480
   63   HG22  VAL  46          2HG2      VAL  46   8.199   6.589  14.272
   64   HG23  VAL  46          3HG2      VAL  46   7.368   7.535  13.013
   65    H    ARG  47           H        ARG  47   4.846   3.800  15.494
   66    HA   ARG  47           HA       ARG  47   2.003   4.572  15.621
   67    HB2  ARG  47          1HB       ARG  47   2.576   2.279  14.959
   68    HB3  ARG  47          2HB       ARG  47   3.441   2.034  16.468
   69    HG2  ARG  47          1HG       ARG  47   1.472   1.966  17.736
   70    HG3  ARG  47          2HG       ARG  47   0.509   2.736  16.451
   71    HD2  ARG  47          1HD       ARG  47   1.800   0.027  16.230
   72    HD3  ARG  47          2HD       ARG  47   0.111   0.315  16.712
   73    HE   ARG  47           HE       ARG  47   0.487   1.667  14.304
   74   HH11  ARG  47          1HH1      ARG  47   0.634  -1.644  15.467
   75   HH12  ARG  47          2HH1      ARG  47   0.162  -2.337  13.930
   76   HH21  ARG  47          1HH2      ARG  47  -0.122   0.757  12.316
   77   HH22  ARG  47          2HH2      ARG  47  -0.265  -0.978  12.146
   78    H    ALA  48           H        ALA  48   1.532   5.980  17.183
   79    HA   ALA  48           HA       ALA  48   2.863   5.845  19.784
   80    HB1  ALA  48          1HB       ALA  48   1.404   7.760  20.356
   81    HB2  ALA  48          2HB       ALA  48   2.268   8.022  18.821
   82    HB3  ALA  48          3HB       ALA  48   0.550   7.559  18.808
   83    H    TYR  49           H        TYR  49   1.979   5.309  21.745
   84    HA   TYR  49           HA       TYR  49  -0.676   3.942  21.629
   85    HB2  TYR  49          1HB       TYR  49   1.068   2.230  21.732
   86    HB3  TYR  49          2HB       TYR  49   1.834   3.036  23.093
   87    HD1  TYR  49           HD1      TYR  49  -1.377   1.430  22.062
   88    HD2  TYR  49           HD2      TYR  49   1.276   2.459  25.272
   89    HE1  TYR  49           HE1      TYR  49  -2.754   0.101  23.625
   90    HE2  TYR  49           HE2      TYR  49  -0.101   1.129  26.836
   91    HH   TYR  49           HH       TYR  49  -3.049  -0.526  25.740
   92    H    ASN  50           H        ASN  50  -2.127   4.576  23.047
   93    HA   ASN  50           HA       ASN  50  -1.340   6.624  25.011
   94    HB2  ASN  50          1HB       ASN  50  -3.359   6.912  23.591
   95    HB3  ASN  50          2HB       ASN  50  -4.076   5.491  24.340
   96   HD21  ASN  50          1HD2      ASN  50  -5.193   8.698  25.974
   97   HD22  ASN  50          2HD2      ASN  50  -5.070   8.198  24.320
   98    H    ALA  51           H        ALA  51  -0.259   5.702  26.656
   99    HA   ALA  51           HA       ALA  51  -1.392   3.279  27.907
  100    HB1  ALA  51          1HB       ALA  51   0.702   3.268  29.225
  101    HB2  ALA  51          2HB       ALA  51   1.024   3.337  27.476
  102    HB3  ALA  51          3HB       ALA  51   1.177   4.806  28.468
  103    H    GLY  52           H        GLY  52  -2.278   6.306  28.087
  104    HA2  GLY  52          1HA       GLY  52  -2.245   6.586  31.046
  105    HA3  GLY  52          2HA       GLY  52  -2.709   7.825  29.896
  106    H    ASN  53           H        ASN  53  -4.526   7.954  31.528
  107    HA   ASN  53           HA       ASN  53  -6.624   5.907  30.964
  108    HB2  ASN  53          1HB       ASN  53  -6.293   7.845  33.275
  109    HB3  ASN  53          2HB       ASN  53  -7.732   6.867  33.016
  110   HD21  ASN  53          1HD2      ASN  53  -4.956   5.319  35.217
  111   HD22  ASN  53          2HD2      ASN  53  -5.398   6.984  35.034
  112    H    SER  54           H        SER  54  -5.672   8.597  29.605
  113    HA   SER  54           HA       SER  54  -8.360   9.294  28.710
  114    HB2  SER  54          1HB       SER  54  -8.366  11.586  29.407
  115    HB3  SER  54          2HB       SER  54  -8.095  10.602  30.836
  116    HG   SER  54           HG       SER  54  -6.291  12.145  29.363
  117    H    GLU  55           H        GLU  55  -8.166  11.356  27.233
  118    HA   GLU  55           HA       GLU  55  -6.321  10.794  25.146
  119    HB2  GLU  55          1HB       GLU  55  -8.446  12.074  24.866
  120    HB3  GLU  55          2HB       GLU  55  -7.744  13.417  25.757
  121    HG2  GLU  55          1HG       GLU  55  -6.018  13.670  24.023
  122    HG3  GLU  55          2HG       GLU  55  -6.715  12.320  23.131
  123    H    LEU  56           H        LEU  56  -4.267  11.262  24.820
  124    HA   LEU  56           HA       LEU  56  -2.967  13.081  26.800
  125    HB2  LEU  56          1HB       LEU  56  -1.751  10.787  25.221
  126    HB3  LEU  56          2HB       LEU  56  -0.919  11.782  26.419
  127    HG   LEU  56           HG       LEU  56  -3.216   9.873  26.980
  128   HD11  LEU  56          1HD1      LEU  56  -1.491   8.557  28.129
  129   HD12  LEU  56          2HD1      LEU  56  -1.134   8.741  26.395
  130   HD13  LEU  56          3HD1      LEU  56  -0.252   9.716  27.595
  131   HD21  LEU  56          1HD2      LEU  56  -2.712  10.382  29.345
  132   HD22  LEU  56          2HD2      LEU  56  -1.489  11.568  28.830
  133   HD23  LEU  56          3HD2      LEU  56  -3.208  11.848  28.467
  134    H    ASP  57           H        ASP  57  -1.407  14.543  26.140
  135    HA   ASP  57           HA       ASP  57  -1.802  15.553  23.431
  136    HB2  ASP  57          1HB       ASP  57  -1.547  17.042  25.436
  137    HB3  ASP  57          2HB       ASP  57   0.120  16.504  25.593
  138    H    VAL  58           H        VAL  58  -0.992  13.860  22.139
  139    HA   VAL  58           HA       VAL  58   1.982  13.575  22.242
  140    HB   VAL  58           HB       VAL  58  -0.105  11.617  21.188
  141   HG11  VAL  58          1HG1      VAL  58   1.778  10.085  20.876
  142   HG12  VAL  58          2HG1      VAL  58   1.931  11.544  19.867
  143   HG13  VAL  58          3HG1      VAL  58   2.906  11.377  21.347
  144   HG21  VAL  58          1HG2      VAL  58   0.644  10.209  23.079
  145   HG22  VAL  58          2HG2      VAL  58   1.733  11.511  23.615
  146   HG23  VAL  58          3HG2      VAL  58  -0.030  11.752  23.654
  147    H    SER  59           H        SER  59   3.090  14.366  20.592
  148    HA   SER  59           HA       SER  59   1.984  14.103  17.875
  149    HB2  SER  59          1HB       SER  59   2.321  16.412  17.272
  150    HB3  SER  59          2HB       SER  59   1.245  16.351  18.660
  151    HG   SER  59           HG       SER  59   3.950  17.041  18.526
  152    H    VAL  60           H        VAL  60   3.570  14.380  16.205
  153    HA   VAL  60           HA       VAL  60   6.372  14.160  17.209
  154    HB   VAL  60           HB       VAL  60   5.093  12.434  15.046
  155   HG11  VAL  60          1HG1      VAL  60   7.226  11.234  15.046
  156   HG12  VAL  60          2HG1      VAL  60   7.420  12.937  14.568
  157   HG13  VAL  60          3HG1      VAL  60   7.888  12.412  16.204
  158   HG21  VAL  60          1HG2      VAL  60   5.449  10.586  16.652
  159   HG22  VAL  60          2HG2      VAL  60   6.052  11.751  17.856
  160   HG23  VAL  60          3HG2      VAL  60   4.354  11.819  17.322
  161    H    GLY  61           H        GLY  61   7.680  15.577  16.299
  162    HA2  GLY  61          1HA       GLY  61   8.650  16.960  14.708
  163    HA3  GLY  61          2HA       GLY  61   7.795  16.052  13.475
  164    H    SER  62           H        SER  62   6.302  17.116  12.337
  165    HA   SER  62           HA       SER  62   5.088  19.555  13.570
  166    HB2  SER  62          1HB       SER  62   4.821  20.413  11.295
  167    HB3  SER  62          2HB       SER  62   6.507  20.054  11.631
  168    HG   SER  62           HG       SER  62   4.840  18.128  10.491
  169    H    THR  63           H        THR  63   4.393  16.458  13.168
  170    HA   THR  63           HA       THR  63   1.678  16.875  12.028
  171    HB   THR  63           HB       THR  63   3.173  14.300  12.692
  172    HG1  THR  63           HG1      THR  63   3.542  14.208  10.530
  173   HG21  THR  63          1HG2      THR  63   1.326  13.192  11.495
  174   HG22  THR  63          2HG2      THR  63   0.725  14.062  12.927
  175   HG23  THR  63          3HG2      THR  63   0.504  14.758  11.304
  176    H    SER  64           H        SER  64   0.020  17.186  13.306
  177    HA   SER  64           HA       SER  64   0.343  16.726  16.198
  178    HB2  SER  64          1HB       SER  64  -1.673  18.021  16.439
  179    HB3  SER  64          2HB       SER  64  -0.623  18.842  15.295
  180    HG   SER  64           HG       SER  64  -2.914  18.544  14.772
  181    H    LEU  65           H        LEU  65  -1.620  15.892  17.404
  182    HA   LEU  65           HA       LEU  65  -3.285  13.964  15.975
  183    HB2  LEU  65          1HB       LEU  65  -1.271  12.624  16.217
  184    HB3  LEU  65          2HB       LEU  65  -1.158  13.031  17.932
  185    HG   LEU  65           HG       LEU  65  -3.349  11.808  18.273
  186   HD11  LEU  65          1HD1      LEU  65  -4.043  10.253  16.506
  187   HD12  LEU  65          2HD1      LEU  65  -4.158  11.947  15.974
  188   HD13  LEU  65          3HD1      LEU  65  -2.805  10.931  15.423
  189   HD21  LEU  65          1HD2      LEU  65  -2.274   9.585  18.156
  190   HD22  LEU  65          2HD2      LEU  65  -1.009  10.252  17.096
  191   HD23  LEU  65          3HD2      LEU  65  -1.145  10.810  18.781
  192    H    ASN  66           H        ASN  66  -5.176  13.667  16.971
  193    HA   ASN  66           HA       ASN  66  -5.380  14.036  19.886
  194    HB2  ASN  66          1HB       ASN  66  -7.161  15.709  19.727
  195    HB3  ASN  66          2HB       ASN  66  -5.653  16.323  19.060
  196   HD21  ASN  66          1HD2      ASN  66  -7.464  17.404  16.307
  197   HD22  ASN  66          2HD2      ASN  66  -6.475  17.801  17.673
  198    H    ASP  67           H        ASP  67  -7.882  13.911  20.453
  199    HA   ASP  67           HA       ASP  67  -9.693  12.498  20.585
  200    HB2  ASP  67          1HB       ASP  67  -9.971  13.473  18.198
  201    HB3  ASP  67          2HB       ASP  67  -9.349  11.930  17.626
  202    H    VAL  68           H        VAL  68  -7.316  11.386  21.363
  203    HA   VAL  68           HA       VAL  68  -7.387   8.637  20.209
  204    HB   VAL  68           HB       VAL  68  -5.265   9.980  21.939
  205   HG11  VAL  68          1HG1      VAL  68  -3.895   8.020  21.416
  206   HG12  VAL  68          2HG1      VAL  68  -5.363   7.585  22.323
  207   HG13  VAL  68          3HG1      VAL  68  -5.276   7.282  20.571
  208   HG21  VAL  68          1HG2      VAL  68  -3.919   9.954  19.862
  209   HG22  VAL  68          2HG2      VAL  68  -5.306   9.279  18.973
  210   HG23  VAL  68          3HG2      VAL  68  -5.399  10.920  19.657
  211    H    ALA  69           H        ALA  69  -8.433   7.139  21.302
  212    HA   ALA  69           HA       ALA  69  -9.383   7.660  23.994
  213    HB1  ALA  69          1HB       ALA  69 -10.415   5.420  23.804
  214    HB2  ALA  69          2HB       ALA  69 -10.761   6.429  22.379
  215    HB3  ALA  69          3HB       ALA  69  -9.528   5.150  22.286
  216    HA   PRO  70           HA       PRO  70  -6.309   5.934  26.534
  217    HB2  PRO  70          1HB       PRO  70  -8.587   4.345  27.774
  218    HB3  PRO  70          2HB       PRO  70  -7.340   5.310  28.576
  219    HG2  PRO  70          1HG       PRO  70  -9.772   6.357  28.331
  220    HG3  PRO  70          2HG       PRO  70  -8.371   7.379  28.000
  221    HD2  PRO  70          1HD       PRO  70 -10.208   5.950  26.038
  222    HD3  PRO  70          2HD       PRO  70  -9.534   7.626  25.954
  223    H    LEU  71           H        LEU  71  -4.942   4.256  26.246
  224    HA   LEU  71           HA       LEU  71  -4.127   2.179  25.677
  225    HB2  LEU  71          1HB       LEU  71  -6.992   1.200  25.907
  226    HB3  LEU  71          2HB       LEU  71  -5.525   0.216  25.957
  227    HG   LEU  71           HG       LEU  71  -6.404   2.229  28.058
  228   HD11  LEU  71          1HD1      LEU  71  -6.706   0.229  29.448
  229   HD12  LEU  71          2HD1      LEU  71  -7.753   0.194  28.010
  230   HD13  LEU  71          3HD1      LEU  71  -6.279  -0.800  28.060
  231   HD21  LEU  71          1HD2      LEU  71  -4.470   1.363  29.330
  232   HD22  LEU  71          2HD2      LEU  71  -4.010   0.349  27.941
  233   HD23  LEU  71          3HD2      LEU  71  -3.946   2.123  27.808
  234    H    GLY  72           H        GLY  72  -5.527   4.112  23.736
  235    HA2  GLY  72          1HA       GLY  72  -5.992   2.239  21.475
  236    HA3  GLY  72          2HA       GLY  72  -6.293   3.967  21.467
  237    H    SER  73           H        SER  73  -5.110   3.744  19.367
  238    HA   SER  73           HA       SER  73  -2.318   4.502  19.740
  239    HB2  SER  73          1HB       SER  73  -1.333   2.748  18.410
  240    HB3  SER  73          2HB       SER  73  -2.199   2.016  19.751
  241    HG   SER  73           HG       SER  73  -3.101   2.326  17.103
  242    H    SER  74           H        SER  74  -1.293   5.186  17.733
  243    HA   SER  74           HA       SER  74  -2.917   5.379  15.325
  244    HB2  SER  74          1HB       SER  74  -3.909   7.193  16.650
  245    HB3  SER  74          2HB       SER  74  -2.318   7.886  16.929
  246    HG   SER  74           HG       SER  74  -2.109   8.197  14.733
  247    H    ASP  75           H        ASP  75  -1.738   5.869  13.520
  248    HA   ASP  75           HA       ASP  75   1.187   5.738  13.971
  249    HB2  ASP  75          1HB       ASP  75  -0.510   5.267  11.489
  250    HB3  ASP  75          2HB       ASP  75   1.246   5.177  11.513
  251    H    PHE  76           H        PHE  76   2.524   7.375  13.615
  252    HA   PHE  76           HA       PHE  76   1.539   9.762  12.173
  253    HB2  PHE  76          1HB       PHE  76   4.118   9.160  13.665
  254    HB3  PHE  76          2HB       PHE  76   3.856  10.647  12.767
  255    HD1  PHE  76           HD1      PHE  76   2.902   8.702  15.724
  256    HD2  PHE  76           HD2      PHE  76   2.316  12.340  13.561
  257    HE1  PHE  76           HE1      PHE  76   1.795   9.696  17.699
  258    HE2  PHE  76           HE2      PHE  76   1.212  13.338  15.535
  259    HZ   PHE  76           HZ       PHE  76   0.950  12.014  17.604
  260    H    LYS  77           H        LYS  77   1.844  10.085  10.091
  261    HA   LYS  77           HA       LYS  77   3.558   8.140   8.651
  262    HB2  LYS  77          1HB       LYS  77   1.195   8.371   7.942
  263    HB3  LYS  77          2HB       LYS  77   1.450  10.080   7.620
  264    HG2  LYS  77          1HG       LYS  77   3.061   9.525   5.849
  265    HG3  LYS  77          2HG       LYS  77   2.847   7.801   6.188
  266    HD2  LYS  77          1HD       LYS  77   0.448   7.983   5.614
  267    HD3  LYS  77          2HD       LYS  77   0.657   9.709   5.286
  268    HE2  LYS  77          1HE       LYS  77   2.304   9.151   3.506
  269    HE3  LYS  77          2HE       LYS  77   2.035   7.433   3.814
  270    HZ1  LYS  77          1HZ       LYS  77   0.731   8.215   1.976
  271    HZ2  LYS  77          2HZ       LYS  77  -0.264   7.744   3.204
  272    HZ3  LYS  77          3HZ       LYS  77  -0.013   9.349   2.915
  273    H    PHE  78           H        PHE  78   5.549   8.683   8.184
  274    HA   PHE  78           HA       PHE  78   6.025  11.477   7.236
  275    HB2  PHE  78          1HB       PHE  78   7.914   9.732   8.865
  276    HB3  PHE  78          2HB       PHE  78   8.331  11.287   8.166
  277    HD1  PHE  78           HD1      PHE  78   6.881   9.587  10.959
  278    HD2  PHE  78           HD2      PHE  78   7.022  13.340   8.923
  279    HE1  PHE  78           HE1      PHE  78   6.050  10.720  12.993
  280    HE2  PHE  78           HE2      PHE  78   6.194  14.477  10.956
  281    HZ   PHE  78           HZ       PHE  78   5.706  13.165  12.992
  282    H    LEU  79           H        LEU  79   5.830  10.991   5.079
  283    HA   LEU  79           HA       LEU  79   7.028   8.818   3.732
  284    HB2  LEU  79          1HB       LEU  79   5.404  10.238   2.637
  285    HB3  LEU  79          2HB       LEU  79   6.447  11.653   2.812
  286    HG   LEU  79           HG       LEU  79   8.072  10.626   1.236
  287   HD11  LEU  79          1HD1      LEU  79   7.402   8.633  -0.032
  288   HD12  LEU  79          2HD1      LEU  79   7.568   8.283   1.704
  289   HD13  LEU  79          3HD1      LEU  79   5.952   8.474   0.985
  290   HD21  LEU  79          1HD2      LEU  79   6.662  10.914  -0.775
  291   HD22  LEU  79          2HD2      LEU  79   5.200  10.786   0.232
  292   HD23  LEU  79          3HD2      LEU  79   6.307  12.165   0.441
  293    HA   PRO  80           HA       PRO  80  10.968  11.382   3.277
  294    HB2  PRO  80          1HB       PRO  80  11.268  13.805   4.421
  295    HB3  PRO  80          2HB       PRO  80  10.336  13.639   2.927
  296    HG2  PRO  80          1HG       PRO  80   9.324  13.810   5.800
  297    HG3  PRO  80          2HG       PRO  80   8.777  14.727   4.393
  298    HD2  PRO  80          1HD       PRO  80   7.510  12.436   5.269
  299    HD3  PRO  80          2HD       PRO  80   7.524  12.949   3.533
  300    HA   PRO  81           HA       PRO  81  12.126   9.805   7.282
  301    HB2  PRO  81          1HB       PRO  81  14.663   9.017   6.641
  302    HB3  PRO  81          2HB       PRO  81  13.244   8.126   6.077
  303    HG2  PRO  81          1HG       PRO  81  14.891  10.225   4.603
  304    HG3  PRO  81          2HG       PRO  81  14.368   8.641   4.022
  305    HD2  PRO  81          1HD       PRO  81  12.989  10.921   3.411
  306    HD3  PRO  81          2HD       PRO  81  12.151   9.337   3.658
  307    H    GLY  82           H        GLY  82  13.874  10.274   8.879
  308    HA2  GLY  82          1HA       GLY  82  15.926  11.946   9.013
  309    HA3  GLY  82          2HA       GLY  82  14.680  13.134   8.677
  310    H    SER  83           H        SER  83  15.598  13.873  10.846
  311    HA   SER  83           HA       SER  83  14.731  12.290  13.169
  312    HB2  SER  83          1HB       SER  83  16.883  13.394  13.292
  313    HB3  SER  83          2HB       SER  83  16.167  14.948  12.895
  314    HG   SER  83           HG       SER  83  14.819  14.504  14.821
  315    H    TYR  84           H        TYR  84  12.883  12.510  14.208
  316    HA   TYR  84           HA       TYR  84  11.516  15.158  14.086
  317    HB2  TYR  84          1HB       TYR  84  10.163  12.434  13.918
  318    HB3  TYR  84          2HB       TYR  84   9.331  13.978  14.040
  319    HD1  TYR  84           HD1      TYR  84  11.212  11.722  11.859
  320    HD2  TYR  84           HD2      TYR  84   9.284  15.543  12.162
  321    HE1  TYR  84           HE1      TYR  84  11.235  11.929   9.397
  322    HE2  TYR  84           HE2      TYR  84   9.307  15.749   9.699
  323    HH   TYR  84           HH       TYR  84  10.450  13.111   7.642
  324    H    THR  85           H        THR  85  10.389  15.802  15.903
  325    HA   THR  85           HA       THR  85  11.389  14.468  18.358
  326    HB   THR  85           HB       THR  85  10.153  17.227  17.958
  327    HG1  THR  85           HG1      THR  85  12.343  17.869  18.373
  328   HG21  THR  85          1HG2      THR  85  10.896  17.642  20.270
  329   HG22  THR  85          2HG2      THR  85   9.715  16.312  20.211
  330   HG23  THR  85          3HG2      THR  85  11.448  15.956  20.400
  331    H    ALA  86           H        ALA  86  10.130  13.068  19.329
  332    HA   ALA  86           HA       ALA  86   7.224  13.169  18.961
  333    HB1  ALA  86          1HB       ALA  86   7.225  11.111  20.333
  334    HB2  ALA  86          2HB       ALA  86   8.373  11.001  18.978
  335    HB3  ALA  86          3HB       ALA  86   8.968  11.316  20.625
  336    H    GLN  87           H        GLN  87   6.473  14.995  19.940
  337    HA   GLN  87           HA       GLN  87   7.147  15.587  22.718
  338    HB2  GLN  87          1HB       GLN  87   6.621  17.395  21.112
  339    HB3  GLN  87          2HB       GLN  87   5.002  16.746  20.893
  340    HG2  GLN  87          1HG       GLN  87   4.840  18.597  22.362
  341    HG3  GLN  87          2HG       GLN  87   4.602  17.125  23.346
  342   HE21  GLN  87          1HE2      GLN  87   6.909  18.314  25.649
  343   HE22  GLN  87          2HE2      GLN  87   5.326  17.694  25.315
  344    H    VAL  88           H        VAL  88   6.323  14.655  24.430
  345    HA   VAL  88           HA       VAL  88   3.523  13.636  24.270
  346    HB   VAL  88           HB       VAL  88   5.888  12.211  25.564
  347   HG11  VAL  88          1HG1      VAL  88   4.290  10.417  26.027
  348   HG12  VAL  88          2HG1      VAL  88   3.851  11.930  26.855
  349   HG13  VAL  88          3HG1      VAL  88   2.971  11.428  25.391
  350   HG21  VAL  88          1HG2      VAL  88   5.460  10.486  23.841
  351   HG22  VAL  88          2HG2      VAL  88   4.182  11.506  23.139
  352   HG23  VAL  88          3HG2      VAL  88   5.877  12.049  23.098
  353    H    GLY  89           H        GLY  89   2.528  15.136  25.497
  354    HA2  GLY  89          1HA       GLY  89   1.871  16.241  27.429
  355    HA3  GLY  89          2HA       GLY  89   2.852  15.111  28.344
  356    H    GLN  90           H        GLN  90   4.396  16.040  29.516
  357    HA   GLN  90           HA       GLN  90   5.437  18.689  28.679
  358    HB2  GLN  90          1HB       GLN  90   5.764  17.153  31.289
  359    HB3  GLN  90          2HB       GLN  90   6.407  18.758  30.974
  360    HG2  GLN  90          1HG       GLN  90   3.476  18.006  30.983
  361    HG3  GLN  90          2HG       GLN  90   4.360  18.850  32.286
  362   HE21  GLN  90          1HE2      GLN  90   2.551  21.013  29.544
  363   HE22  GLN  90          2HE2      GLN  90   2.145  19.402  30.038
  364    H    GLN  91           H        GLN  91   6.193  15.523  28.179
  365    HA   GLN  91           HA       GLN  91   9.130  16.067  28.221
  366    HB2  GLN  91          1HB       GLN  91   7.683  13.389  28.154
  367    HB3  GLN  91          2HB       GLN  91   9.425  13.616  28.210
  368    HG2  GLN  91          1HG       GLN  91   7.470  14.469  30.356
  369    HG3  GLN  91          2HG       GLN  91   8.517  13.022  30.390
  370   HE21  GLN  91          1HE2      GLN  91   9.882  16.295  32.045
  371   HE22  GLN  91          2HE2      GLN  91   8.229  15.800  31.879
  372    H    SER  92           H        SER  92  10.357  14.838  26.499
  373    HA   SER  92           HA       SER  92   8.862  14.396  24.004
  374    HB2  SER  92          1HB       SER  92  10.123  15.989  22.696
  375    HB3  SER  92          2HB       SER  92   9.329  16.837  24.014
  376    HG   SER  92           HG       SER  92  11.476  17.441  23.765
  377    H    LEU  93           H        LEU  93  10.067  13.320  22.384
  378    HA   LEU  93           HA       LEU  93  12.785  12.416  23.137
  379    HB2  LEU  93          1HB       LEU  93  11.291  10.726  24.099
  380    HB3  LEU  93          2HB       LEU  93  10.468  10.539  22.548
  381    HG   LEU  93           HG       LEU  93  12.587   9.660  21.566
  382   HD11  LEU  93          1HD1      LEU  93  14.418   9.048  23.082
  383   HD12  LEU  93          2HD1      LEU  93  14.149  10.807  23.053
  384   HD13  LEU  93          3HD1      LEU  93  13.567   9.839  24.429
  385   HD21  LEU  93          1HD2      LEU  93  12.481   7.489  22.740
  386   HD22  LEU  93          2HD2      LEU  93  11.602   8.258  24.084
  387   HD23  LEU  93          3HD2      LEU  93  10.851   8.153  22.474
  388    HA   PRO  94           HA       PRO  94  12.824  13.248  18.756
  389    HB2  PRO  94          1HB       PRO  94  15.529  13.612  18.537
  390    HB3  PRO  94          2HB       PRO  94  14.470  14.857  19.213
  391    HG2  PRO  94          1HG       PRO  94  16.152  12.778  20.678
  392    HG3  PRO  94          2HG       PRO  94  16.047  14.514  20.986
  393    HD2  PRO  94          1HD       PRO  94  14.592  12.719  22.438
  394    HD3  PRO  94          2HD       PRO  94  13.941  14.356  22.030
  395    H    VAL  95           H        VAL  95  13.254  11.917  17.012
  396    HA   VAL  95           HA       VAL  95  15.029   9.586  17.359
  397    HB   VAL  95           HB       VAL  95  12.841   8.791  18.208
  398   HG11  VAL  95          1HG1      VAL  95  10.901   8.666  16.723
  399   HG12  VAL  95          2HG1      VAL  95  11.393  10.348  17.036
  400   HG13  VAL  95          3HG1      VAL  95  11.793   9.577  15.481
  401   HG21  VAL  95          1HG2      VAL  95  12.598   6.858  16.683
  402   HG22  VAL  95          2HG2      VAL  95  13.548   7.716  15.447
  403   HG23  VAL  95          3HG2      VAL  95  14.312   7.233  16.980
  404    H    LYS  96           H        LYS  96  16.054   9.078  15.528
  405    HA   LYS  96           HA       LYS  96  15.271  10.420  13.030
  406    HB2  LYS  96          1HB       LYS  96  17.668  10.214  13.697
  407    HB3  LYS  96          2HB       LYS  96  17.537   8.463  13.589
  408    HG2  LYS  96          1HG       LYS  96  17.070   8.619  11.187
  409    HG3  LYS  96          2HG       LYS  96  17.132  10.385  11.279
  410    HD2  LYS  96          1HD       LYS  96  19.485  10.268  12.029
  411    HD3  LYS  96          2HD       LYS  96  19.424   8.502  11.948
  412    HE2  LYS  96          1HE       LYS  96  18.941   8.632   9.522
  413    HE3  LYS  96          2HE       LYS  96  19.015  10.395   9.604
  414    HZ1  LYS  96          1HZ       LYS  96  21.075   9.459   8.847
  415    HZ2  LYS  96          2HZ       LYS  96  21.304  10.208  10.299
  416    HZ3  LYS  96          3HZ       LYS  96  21.235   8.562  10.222
  417    H    LEU  97           H        LEU  97  14.001   9.614  11.539
  418    HA   LEU  97           HA       LEU  97  13.125   6.802  11.846
  419    HB2  LEU  97          1HB       LEU  97  12.012   8.963  10.025
  420    HB3  LEU  97          2HB       LEU  97  11.259   7.416  10.425
  421    HG   LEU  97           HG       LEU  97  11.676   9.770  12.298
  422   HD11  LEU  97          1HD1      LEU  97   9.221   9.815  12.303
  423   HD12  LEU  97          2HD1      LEU  97   9.879  10.056  10.668
  424   HD13  LEU  97          3HD1      LEU  97   9.193   8.479  11.130
  425   HD21  LEU  97          1HD2      LEU  97  10.465   8.381  13.946
  426   HD22  LEU  97          2HD2      LEU  97  10.455   7.023  12.795
  427   HD23  LEU  97          3HD2      LEU  97  11.996   7.613  13.462
  428    H    ASP  98           H        ASP  98  14.186   5.310  10.757
  429    HA   ASP  98           HA       ASP  98  15.740   5.899   8.392
  430    HB2  ASP  98          1HB       ASP  98  14.890   3.302   9.718
  431    HB3  ASP  98          2HB       ASP  98  15.869   3.344   8.259
  432    HA   PRO  99           HA       PRO  99  12.841   5.677   5.164
  433    HB2  PRO  99          1HB       PRO  99  14.923   3.890   3.846
  434    HB3  PRO  99          2HB       PRO  99  14.069   5.283   3.171
  435    HG2  PRO  99          1HG       PRO  99  16.578   5.625   3.980
  436    HG3  PRO  99          2HG       PRO  99  15.381   6.857   4.388
  437    HD2  PRO  99          1HD       PRO  99  16.505   4.624   6.125
  438    HD3  PRO  99          2HD       PRO  99  16.175   6.350   6.558
  439    H    ASP 100           H        ASP 100  11.088   4.406   5.008
  440    HA   ASP 100           HA       ASP 100   9.719   2.556   5.080
  441    HB2  ASP 100          1HB       ASP 100  11.227   2.056   3.053
  442    HB3  ASP 100          2HB       ASP 100  12.115   0.964   4.106
  443    H    SER 101           H        SER 101  10.218   3.027   7.514
  444    HA   SER 101           HA       SER 101  10.693   0.355   8.692
  445    HB2  SER 101          1HB       SER 101  12.200   1.172  10.381
  446    HB3  SER 101          2HB       SER 101  12.861   1.585   8.806
  447    HG   SER 101           HG       SER 101  12.267   3.634   9.062
  448    H    TYR 102           H        TYR 102  10.044   0.287  11.012
  449    HA   TYR 102           HA       TYR 102   7.832   2.231  11.525
  450    HB2  TYR 102          1HB       TYR 102   7.870  -0.767  12.065
  451    HB3  TYR 102          2HB       TYR 102   6.615   0.331  12.623
  452    HD1  TYR 102           HD1      TYR 102   8.146  -1.240   9.655
  453    HD2  TYR 102           HD2      TYR 102   4.925   1.170  11.147
  454    HE1  TYR 102           HE1      TYR 102   6.934  -1.537   7.521
  455    HE2  TYR 102           HE2      TYR 102   3.714   0.873   9.014
  456    HH   TYR 102           HH       TYR 102   5.128  -0.996   6.341
  457    H    TYR 103           H        TYR 103   7.459   2.886  13.609
  458    HA   TYR 103           HA       TYR 103   9.353   1.866  15.674
  459    HB2  TYR 103          1HB       TYR 103   8.645   4.787  15.177
  460    HB3  TYR 103          2HB       TYR 103   9.568   4.192  16.549
  461    HD1  TYR 103           HD1      TYR 103   9.583   4.596  12.868
  462    HD2  TYR 103           HD2      TYR 103  11.879   3.679  16.374
  463    HE1  TYR 103           HE1      TYR 103  11.668   4.796  11.555
  464    HE2  TYR 103           HE2      TYR 103  13.964   3.880  15.061
  465    HH   TYR 103           HH       TYR 103  14.857   4.413  13.096
  466    H    THR 104           H        THR 104   8.592   1.686  17.727
  467    HA   THR 104           HA       THR 104   5.672   2.196  18.053
  468    HB   THR 104           HB       THR 104   7.530   0.326  19.583
  469    HG1  THR 104           HG1      THR 104   6.871  -1.082  18.158
  470   HG21  THR 104          1HG2      THR 104   5.477  -0.439  20.712
  471   HG22  THR 104          2HG2      THR 104   5.779   1.283  21.040
  472   HG23  THR 104          3HG2      THR 104   4.539   0.807  19.859
  473    H    LEU 105           H        LEU 105   5.063   3.869  19.197
  474    HA   LEU 105           HA       LEU 105   7.002   4.981  21.181
  475    HB2  LEU 105          1HB       LEU 105   6.589   6.502  19.319
  476    HB3  LEU 105          2HB       LEU 105   4.843   6.358  19.543
  477    HG   LEU 105           HG       LEU 105   5.121   7.435  21.807
  478   HD11  LEU 105          1HD1      LEU 105   7.226   8.618  22.246
  479   HD12  LEU 105          2HD1      LEU 105   7.467   6.858  22.159
  480   HD13  LEU 105          3HD1      LEU 105   7.939   7.891  20.788
  481   HD21  LEU 105          1HD2      LEU 105   5.431   9.697  20.861
  482   HD22  LEU 105          2HD2      LEU 105   6.121   8.985  19.383
  483   HD23  LEU 105          3HD2      LEU 105   4.414   8.694  19.799
  484    H    VAL 106           H        VAL 106   6.478   4.769  23.228
  485    HA   VAL 106           HA       VAL 106   3.630   4.204  23.893
  486    HB   VAL 106           HB       VAL 106   6.165   3.711  25.513
  487   HG11  VAL 106          1HG1      VAL 106   4.717   2.413  26.998
  488   HG12  VAL 106          2HG1      VAL 106   4.246   4.128  26.941
  489   HG13  VAL 106          3HG1      VAL 106   3.297   2.914  26.050
  490   HG21  VAL 106          1HG2      VAL 106   5.723   1.330  25.005
  491   HG22  VAL 106          2HG2      VAL 106   4.338   1.805  23.993
  492   HG23  VAL 106          3HG2      VAL 106   5.990   2.268  23.516
  493    H    SER 107           H        SER 107   2.506   5.898  24.547
  494    HA   SER 107           HA       SER 107   3.876   8.124  25.930
  495    HB2  SER 107          1HB       SER 107   2.299   8.686  24.157
  496    HB3  SER 107          2HB       SER 107   1.025   7.771  24.950
  497    HG   SER 107           HG       SER 107   1.912   9.346  26.766
  498    H    GLN 108           H        GLN 108   4.334   7.516  27.978
  499    HA   GLN 108           HA       GLN 108   2.037   6.542  29.625
  500    HB2  GLN 108          1HB       GLN 108   3.801   4.871  29.527
  501    HB3  GLN 108          2HB       GLN 108   5.027   6.066  29.926
  502    HG2  GLN 108          1HG       GLN 108   4.580   4.731  31.858
  503    HG3  GLN 108          2HG       GLN 108   3.945   6.376  32.147
  504   HE21  GLN 108          1HE2      GLN 108   0.765   5.267  32.924
  505   HE22  GLN 108          2HE2      GLN 108   2.000   6.477  33.037
  506    HA   PRO 109           HA       PRO 109   2.411  10.653  31.338
  507    HB2  PRO 109          1HB       PRO 109   0.214   9.414  33.030
  508    HB3  PRO 109          2HB       PRO 109   0.267  11.009  32.269
  509    HG2  PRO 109          1HG       PRO 109  -1.204   9.110  31.120
  510    HG3  PRO 109          2HG       PRO 109  -0.203  10.147  30.100
  511    HD2  PRO 109          1HD       PRO 109   0.350   7.318  31.086
  512    HD3  PRO 109          2HD       PRO 109   0.605   8.020  29.438
  513    H    GLY 110           H        GLY 110   3.419  11.375  33.194
  514    HA2  GLY 110          1HA       GLY 110   4.154  11.267  35.453
  515    HA3  GLY 110          2HA       GLY 110   3.700   9.574  35.523
  516    H    GLY 111           H        GLY 111   5.480  10.647  32.742
  517    HA2  GLY 111          1HA       GLY 111   8.152  10.469  33.668
  518    HA3  GLY 111          2HA       GLY 111   7.665   8.847  33.213
  519    H    LYS 112           H        LYS 112   9.510   9.300  31.657
  520    HA   LYS 112           HA       LYS 112   8.765  10.974  29.347
  521    HB2  LYS 112          1HB       LYS 112  11.219   9.272  29.932
  522    HB3  LYS 112          2HB       LYS 112  10.997  10.204  28.458
  523    HG2  LYS 112          1HG       LYS 112  10.885  12.284  29.800
  524    HG3  LYS 112          2HG       LYS 112  11.150  11.333  31.267
  525    HD2  LYS 112          1HD       LYS 112  13.320  10.550  30.369
  526    HD3  LYS 112          2HD       LYS 112  13.054  11.501  28.901
  527    HE2  LYS 112          1HE       LYS 112  13.001  13.572  30.246
  528    HE3  LYS 112          2HE       LYS 112  13.249  12.630  31.718
  529    HZ1  LYS 112          1HZ       LYS 112  15.290  13.563  30.912
  530    HZ2  LYS 112          2HZ       LYS 112  15.363  11.917  30.834
  531    HZ3  LYS 112          3HZ       LYS 112  15.131  12.798  29.460
  532    HA   PRO 113           HA       PRO 113   7.018   7.780  27.017
  533    HB2  PRO 113          1HB       PRO 113   7.514   8.647  24.451
  534    HB3  PRO 113          2HB       PRO 113   6.349   9.444  25.516
  535    HG2  PRO 113          1HG       PRO 113   9.255  10.185  24.970
  536    HG3  PRO 113          2HG       PRO 113   7.838  11.239  24.960
  537    HD2  PRO 113          1HD       PRO 113   9.453  11.094  27.139
  538    HD3  PRO 113          2HD       PRO 113   7.662  11.279  27.317
  539    H    GLN 114           H        GLN 114   7.538   5.883  25.886
  540    HA   GLN 114           HA       GLN 114  10.462   5.403  25.543
  541    HB2  GLN 114          1HB       GLN 114   8.235   3.358  25.896
  542    HB3  GLN 114          2HB       GLN 114   9.961   3.026  25.847
  543    HG2  GLN 114          1HG       GLN 114   8.570   4.683  27.962
  544    HG3  GLN 114          2HG       GLN 114   9.053   2.971  28.121
  545   HE21  GLN 114          1HE2      GLN 114  11.613   5.845  29.116
  546   HE22  GLN 114          2HE2      GLN 114   9.900   6.038  28.947
  547    H    LEU 115           H        LEU 115  11.241   4.270  23.749
  548    HA   LEU 115           HA       LEU 115   9.381   4.079  21.442
  549    HB2  LEU 115          1HB       LEU 115  10.398   6.346  21.406
  550    HB3  LEU 115          2HB       LEU 115  12.005   5.613  21.401
  551    HG   LEU 115           HG       LEU 115  10.146   4.802  19.208
  552   HD11  LEU 115          1HD1      LEU 115  10.671   6.831  17.929
  553   HD12  LEU 115          2HD1      LEU 115   9.718   7.199  19.386
  554   HD13  LEU 115          3HD1      LEU 115  11.467   7.526  19.360
  555   HD21  LEU 115          1HD2      LEU 115  12.269   4.895  17.947
  556   HD22  LEU 115          2HD2      LEU 115  13.091   5.565  19.377
  557   HD23  LEU 115          3HD2      LEU 115  12.442   3.908  19.417
  558    H    VAL 116           H        VAL 116   9.712   2.341  20.233
  559    HA   VAL 116           HA       VAL 116  12.366   0.982  20.463
  560    HB   VAL 116           HB       VAL 116   9.616  -0.305  20.177
  561   HG11  VAL 116          1HG1      VAL 116  10.810  -2.432  20.368
  562   HG12  VAL 116          2HG1      VAL 116  11.301  -1.521  18.922
  563   HG13  VAL 116          3HG1      VAL 116  12.362  -1.562  20.350
  564   HG21  VAL 116          1HG2      VAL 116  10.106  -1.227  22.420
  565   HG22  VAL 116          2HG2      VAL 116  11.633  -0.314  22.461
  566   HG23  VAL 116          3HG2      VAL 116  10.078   0.551  22.448
  567    H    ALA 117           H        ALA 117  13.417   0.642  18.628
  568    HA   ALA 117           HA       ALA 117  12.190   1.445  16.108
  569    HB1  ALA 117          1HB       ALA 117  14.408   0.925  15.145
  570    HB2  ALA 117          2HB       ALA 117  14.540   1.975  16.576
  571    HB3  ALA 117          3HB       ALA 117  14.917   0.242  16.707
  572    H    GLU 118           H        GLU 118  11.479   0.234  14.465
  573    HA   GLU 118           HA       GLU 118  11.885  -2.706  14.604
  574    HB2  GLU 118          1HB       GLU 118   9.168  -1.373  14.249
  575    HB3  GLU 118          2HB       GLU 118   9.484  -3.097  14.118
  576    HG2  GLU 118          1HG       GLU 118  10.180  -3.143  16.485
  577    HG3  GLU 118          2HG       GLU 118   9.838  -1.420  16.613
  578    HA   PRO 119           HA       PRO 119  12.731  -0.886  10.444
  579    HB2  PRO 119          1HB       PRO 119  14.527  -3.338  10.606
  580    HB3  PRO 119          2HB       PRO 119  14.864  -1.761   9.881
  581    HG2  PRO 119          1HG       PRO 119  15.905  -2.290  12.268
  582    HG3  PRO 119          2HG       PRO 119  15.184  -0.702  11.991
  583    HD2  PRO 119          1HD       PRO 119  14.007  -3.121  13.417
  584    HD3  PRO 119          2HD       PRO 119  13.937  -1.375  13.885
  Start of MODEL    4
    1    H    GLN  38          1H        GLN  38   0.206  -0.314   4.722
    2    HA   GLN  38           HA       GLN  38   2.538   0.067   4.629
    3    HB2  GLN  38          1HB       GLN  38   1.489  -1.104   2.757
    4    HB3  GLN  38          2HB       GLN  38   1.009   0.420   2.021
    5    HG2  GLN  38          1HG       GLN  38   2.903  -0.424   0.848
    6    HG3  GLN  38          2HG       GLN  38   3.428   1.003   1.785
    7   HE21  GLN  38          1HE2      GLN  38   6.027  -0.709   3.288
    8   HE22  GLN  38          2HE2      GLN  38   5.357   0.769   2.679
    9    H    ALA  39           H        ALA  39   3.925   1.603   5.085
   10    HA   ALA  39           HA       ALA  39   3.408   4.382   4.436
   11    HB1  ALA  39          1HB       ALA  39   5.646   4.775   5.415
   12    HB2  ALA  39          2HB       ALA  39   4.635   3.757   6.468
   13    HB3  ALA  39          3HB       ALA  39   5.916   3.018   5.482
   14    HA   PRO  40           HA       PRO  40   5.116   4.825   0.460
   15    HB2  PRO  40          1HB       PRO  40   6.573   7.200   1.675
   16    HB3  PRO  40          2HB       PRO  40   5.627   7.124   0.186
   17    HG2  PRO  40          1HG       PRO  40   4.506   8.221   2.333
   18    HG3  PRO  40          2HG       PRO  40   3.544   7.120   1.340
   19    HD2  PRO  40          1HD       PRO  40   4.970   6.577   3.974
   20    HD3  PRO  40          2HD       PRO  40   3.326   6.048   3.436
   21    H    LYS  41           H        LYS  41   7.019   4.323  -0.638
   22    HA   LYS  41           HA       LYS  41   8.888   2.746   0.802
   23    HB2  LYS  41          1HB       LYS  41   8.356   2.437  -1.608
   24    HB3  LYS  41          2HB       LYS  41   9.164   3.954  -1.980
   25    HG2  LYS  41          1HG       LYS  41  10.692   2.230  -2.519
   26    HG3  LYS  41          2HG       LYS  41  11.281   2.951  -1.015
   27    HD2  LYS  41          1HD       LYS  41  10.227   1.124   0.279
   28    HD3  LYS  41          2HD       LYS  41   9.627   0.407  -1.224
   29    HE2  LYS  41          1HE       LYS  41  11.627  -0.772  -0.607
   30    HE3  LYS  41          2HE       LYS  41  12.012   0.223  -2.013
   31    HZ1  LYS  41          1HZ       LYS  41  13.704   0.371  -0.338
   32    HZ2  LYS  41          2HZ       LYS  41  12.981   1.842  -0.529
   33    HZ3  LYS  41          3HZ       LYS  41  12.624   0.909   0.785
   34    H    GLY  42           H        GLY  42  10.431   3.333   2.123
   35    HA2  GLY  42          1HA       GLY  42  12.643   4.236   2.401
   36    HA3  GLY  42          2HA       GLY  42  12.266   5.505   1.251
   37    H    SER  43           H        SER  43   9.578   5.222   3.153
   38    HA   SER  43           HA       SER  43  10.487   7.501   4.847
   39    HB2  SER  43          1HB       SER  43   8.231   8.251   4.875
   40    HB3  SER  43          2HB       SER  43   8.588   7.828   3.209
   41    HG   SER  43           HG       SER  43   7.691   5.734   3.748
   42    H    ALA  44           H        ALA  44   8.811   7.662   6.833
   43    HA   ALA  44           HA       ALA  44   8.609   4.974   8.087
   44    HB1  ALA  44          1HB       ALA  44   9.479   5.893  10.212
   45    HB2  ALA  44          2HB       ALA  44  10.691   5.978   8.914
   46    HB3  ALA  44          3HB       ALA  44   9.806   7.442   9.400
   47    H    PHE  45           H        PHE  45   7.121   4.822   9.843
   48    HA   PHE  45           HA       PHE  45   5.092   7.010   9.848
   49    HB2  PHE  45          1HB       PHE  45   4.330   5.202   8.339
   50    HB3  PHE  45          2HB       PHE  45   4.529   4.027   9.631
   51    HD1  PHE  45           HD1      PHE  45   2.764   7.250   8.936
   52    HD2  PHE  45           HD2      PHE  45   2.703   3.465  10.915
   53    HE1  PHE  45           HE1      PHE  45   0.448   7.681   9.686
   54    HE2  PHE  45           HE2      PHE  45   0.386   3.891  11.665
   55    HZ   PHE  45           HZ       PHE  45  -0.741   6.003  11.052
   56    H    VAL  46           H        VAL  46   4.292   7.558  11.775
   57    HA   VAL  46           HA       VAL  46   5.180   5.892  14.094
   58    HB   VAL  46           HB       VAL  46   4.931   8.928  13.943
   59   HG11  VAL  46          1HG1      VAL  46   5.947   8.909  16.168
   60   HG12  VAL  46          2HG1      VAL  46   4.377   8.072  16.147
   61   HG13  VAL  46          3HG1      VAL  46   5.888   7.131  16.180
   62   HG21  VAL  46          1HG2      VAL  46   7.396   8.893  14.154
   63   HG22  VAL  46          2HG2      VAL  46   7.375   7.114  14.098
   64   HG23  VAL  46          3HG2      VAL  46   6.865   8.057  12.676
   65    H    ARG  47           H        ARG  47   3.595   5.106  15.298
   66    HA   ARG  47           HA       ARG  47   0.980   6.519  15.332
   67    HB2  ARG  47          1HB       ARG  47   1.808   3.796  16.389
   68    HB3  ARG  47          2HB       ARG  47   0.203   4.486  16.577
   69    HG2  ARG  47          1HG       ARG  47  -0.039   4.549  14.110
   70    HG3  ARG  47          2HG       ARG  47   1.554   3.770  13.965
   71    HD2  ARG  47          1HD       ARG  47   0.763   1.847  15.158
   72    HD3  ARG  47          2HD       ARG  47  -0.808   2.632  15.442
   73    HE   ARG  47           HE       ARG  47  -1.402   2.254  13.226
   74   HH11  ARG  47          1HH1      ARG  47   1.919   1.275  13.811
   75   HH12  ARG  47          2HH1      ARG  47   2.051   0.377  12.314
   76   HH21  ARG  47          1HH2      ARG  47  -1.221   1.085  11.287
   77   HH22  ARG  47          2HH2      ARG  47   0.274   0.270  10.886
   78    H    ALA  48           H        ALA  48  -0.121   6.247  17.615
   79    HA   ALA  48           HA       ALA  48   1.770   6.812  19.802
   80    HB1  ALA  48          1HB       ALA  48   0.669   8.953  20.375
   81    HB2  ALA  48          2HB       ALA  48   1.449   9.020  18.776
   82    HB3  ALA  48          3HB       ALA  48  -0.315   8.833  18.898
   83    H    TYR  49           H        TYR  49   0.850   6.723  21.888
   84    HA   TYR  49           HA       TYR  49  -2.018   6.439  22.213
   85    HB2  TYR  49          1HB       TYR  49  -1.487   4.145  21.469
   86    HB3  TYR  49          2HB       TYR  49  -0.260   4.007  22.721
   87    HD1  TYR  49           HD1      TYR  49  -3.907   4.805  22.359
   88    HD2  TYR  49           HD2      TYR  49  -0.814   2.978  24.705
   89    HE1  TYR  49           HE1      TYR  49  -5.607   3.946  23.931
   90    HE2  TYR  49           HE2      TYR  49  -2.515   2.118  26.279
   91    HH   TYR  49           HH       TYR  49  -5.968   2.838  25.827
   92    H    ASN  50           H        ASN  50  -2.392   7.635  23.914
   93    HA   ASN  50           HA       ASN  50  -0.429   8.161  25.949
   94    HB2  ASN  50          1HB       ASN  50  -2.296   9.701  25.367
   95    HB3  ASN  50          2HB       ASN  50  -3.439   8.547  26.042
   96   HD21  ASN  50          1HD2      ASN  50  -2.874  10.985  28.677
   97   HD22  ASN  50          2HD2      ASN  50  -3.625  10.894  27.121
   98    H    ALA  51           H        ALA  51   0.349   6.668  27.233
   99    HA   ALA  51           HA       ALA  51  -1.611   4.833  28.540
  100    HB1  ALA  51          1HB       ALA  51   0.168   3.114  28.583
  101    HB2  ALA  51          2HB       ALA  51  -0.243   3.596  26.920
  102    HB3  ALA  51          3HB       ALA  51   1.240   4.211  27.684
  103    H    GLY  52           H        GLY  52  -0.516   7.470  29.360
  104    HA2  GLY  52          1HA       GLY  52   1.193   6.739  31.676
  105    HA3  GLY  52          2HA       GLY  52   0.855   8.364  31.112
  106    H    ASN  53           H        ASN  53   0.352   8.921  33.312
  107    HA   ASN  53           HA       ASN  53  -2.321   7.907  34.194
  108    HB2  ASN  53          1HB       ASN  53  -1.661   8.437  36.478
  109    HB3  ASN  53          2HB       ASN  53  -0.509   7.324  35.754
  110   HD21  ASN  53          1HD2      ASN  53   1.354   9.951  37.562
  111   HD22  ASN  53          2HD2      ASN  53   0.165   8.762  37.969
  112    H    SER  54           H        SER  54  -1.788  10.044  32.273
  113    HA   SER  54           HA       SER  54  -3.565  12.019  33.445
  114    HB2  SER  54          1HB       SER  54  -2.101  13.930  33.339
  115    HB3  SER  54          2HB       SER  54  -1.362  12.721  34.377
  116    HG   SER  54           HG       SER  54  -0.439  13.827  32.170
  117    H    GLU  55           H        GLU  55  -4.152  13.722  31.913
  118    HA   GLU  55           HA       GLU  55  -4.186  12.653  29.175
  119    HB2  GLU  55          1HB       GLU  55  -6.244  13.595  30.210
  120    HB3  GLU  55          2HB       GLU  55  -5.459  15.161  30.344
  121    HG2  GLU  55          1HG       GLU  55  -5.279  15.293  27.900
  122    HG3  GLU  55          2HG       GLU  55  -6.036  13.709  27.753
  123    H    LEU  56           H        LEU  56  -3.020  13.319  27.509
  124    HA   LEU  56           HA       LEU  56  -1.784  15.969  27.474
  125    HB2  LEU  56          1HB       LEU  56   0.529  15.086  27.244
  126    HB3  LEU  56          2HB       LEU  56  -0.152  14.839  28.853
  127    HG   LEU  56           HG       LEU  56  -0.733  12.447  27.988
  128   HD11  LEU  56          1HD1      LEU  56   0.803  11.636  26.253
  129   HD12  LEU  56          2HD1      LEU  56  -0.282  12.901  25.630
  130   HD13  LEU  56          3HD1      LEU  56   1.411  13.291  26.018
  131   HD21  LEU  56          1HD2      LEU  56   1.521  11.687  28.658
  132   HD22  LEU  56          2HD2      LEU  56   2.141  13.342  28.456
  133   HD23  LEU  56          3HD2      LEU  56   0.941  12.989  29.724
  134    H    ASP  57           H        ASP  57  -0.566  16.365  25.473
  135    HA   ASP  57           HA       ASP  57  -1.824  14.848  23.247
  136    HB2  ASP  57          1HB       ASP  57  -0.428  17.552  23.334
  137    HB3  ASP  57          2HB       ASP  57  -1.005  16.793  21.855
  138    H    VAL  58           H        VAL  58  -0.659  14.023  21.521
  139    HA   VAL  58           HA       VAL  58   2.290  13.834  21.953
  140    HB   VAL  58           HB       VAL  58   0.426  11.618  21.001
  141   HG11  VAL  58          1HG1      VAL  58   2.424  10.206  21.018
  142   HG12  VAL  58          2HG1      VAL  58   2.565  11.546  19.855
  143   HG13  VAL  58          3HG1      VAL  58   3.421  11.624  21.412
  144   HG21  VAL  58          1HG2      VAL  58   1.106  10.496  23.098
  145   HG22  VAL  58          2HG2      VAL  58   2.058  11.930  23.554
  146   HG23  VAL  58          3HG2      VAL  58   0.286  12.041  23.431
  147    H    SER  59           H        SER  59   3.548  14.205  20.234
  148    HA   SER  59           HA       SER  59   2.487  13.885  17.516
  149    HB2  SER  59          1HB       SER  59   2.875  16.158  16.815
  150    HB3  SER  59          2HB       SER  59   1.771  16.180  18.181
  151    HG   SER  59           HG       SER  59   4.333  17.089  17.942
  152    H    VAL  60           H        VAL  60   4.167  14.344  15.856
  153    HA   VAL  60           HA       VAL  60   6.937  14.420  16.874
  154    HB   VAL  60           HB       VAL  60   6.380  12.006  16.832
  155   HG11  VAL  60          1HG1      VAL  60   5.863  10.887  14.719
  156   HG12  VAL  60          2HG1      VAL  60   4.603  12.057  15.178
  157   HG13  VAL  60          3HG1      VAL  60   5.777  12.465  13.904
  158   HG21  VAL  60          1HG2      VAL  60   8.228  11.290  15.348
  159   HG22  VAL  60          2HG2      VAL  60   8.212  12.884  14.559
  160   HG23  VAL  60          3HG2      VAL  60   8.673  12.744  16.272
  161    H    GLY  61           H        GLY  61   8.201  15.605  15.605
  162    HA2  GLY  61          1HA       GLY  61   8.922  16.847  13.782
  163    HA3  GLY  61          2HA       GLY  61   8.100  15.687  12.756
  164    H    SER  62           H        SER  62   6.523  16.491  11.523
  165    HA   SER  62           HA       SER  62   4.981  18.828  12.569
  166    HB2  SER  62          1HB       SER  62   4.455  19.354  10.243
  167    HB3  SER  62          2HB       SER  62   6.193  19.287  10.482
  168    HG   SER  62           HG       SER  62   5.825  16.961   9.856
  169    H    THR  63           H        THR  63   4.753  15.682  12.701
  170    HA   THR  63           HA       THR  63   2.012  15.434  11.584
  171    HB   THR  63           HB       THR  63   3.907  13.331  12.721
  172    HG1  THR  63           HG1      THR  63   3.451  12.765  10.282
  173   HG21  THR  63          1HG2      THR  63   2.263  11.704  11.874
  174   HG22  THR  63          2HG2      THR  63   1.540  12.751  13.117
  175   HG23  THR  63          3HG2      THR  63   1.185  13.036  11.398
  176    H    SER  64           H        SER  64   0.348  15.869  12.825
  177    HA   SER  64           HA       SER  64   0.532  15.717  15.743
  178    HB2  SER  64          1HB       SER  64  -0.839  17.451  14.751
  179    HB3  SER  64          2HB       SER  64  -1.767  16.268  13.842
  180    HG   SER  64           HG       SER  64  -1.961  15.413  16.208
  181    H    LEU  65           H        LEU  65   0.173  14.005  16.952
  182    HA   LEU  65           HA       LEU  65  -1.078  11.632  15.645
  183    HB2  LEU  65          1HB       LEU  65   0.740  11.745  18.076
  184    HB3  LEU  65          2HB       LEU  65   0.136  10.285  17.285
  185    HG   LEU  65           HG       LEU  65   2.024  12.303  16.017
  186   HD11  LEU  65          1HD1      LEU  65   3.720  10.555  16.333
  187   HD12  LEU  65          2HD1      LEU  65   3.057  11.119  17.885
  188   HD13  LEU  65          3HD1      LEU  65   2.531   9.560  17.206
  189   HD21  LEU  65          1HD2      LEU  65   2.261  10.552  14.289
  190   HD22  LEU  65          2HD2      LEU  65   1.053   9.553  15.132
  191   HD23  LEU  65          3HD2      LEU  65   0.576  11.107  14.407
  192    H    ASN  66           H        ASN  66  -2.195  10.120  17.189
  193    HA   ASN  66           HA       ASN  66  -3.288  11.371  19.614
  194    HB2  ASN  66          1HB       ASN  66  -5.620  11.029  18.998
  195    HB3  ASN  66          2HB       ASN  66  -4.848  12.138  17.870
  196   HD21  ASN  66          1HD2      ASN  66  -6.163  10.293  15.255
  197   HD22  ASN  66          2HD2      ASN  66  -6.003  11.815  16.067
  198    H    ASP  67           H        ASP  67  -5.043   9.746  20.542
  199    HA   ASP  67           HA       ASP  67  -3.455   7.476  21.269
  200    HB2  ASP  67          1HB       ASP  67  -6.378   8.157  21.761
  201    HB3  ASP  67          2HB       ASP  67  -5.599   6.731  22.432
  202    H    VAL  68           H        VAL  68  -3.090   5.709  20.147
  203    HA   VAL  68           HA       VAL  68  -5.252   4.688  18.365
  204    HB   VAL  68           HB       VAL  68  -2.288   3.978  18.472
  205   HG11  VAL  68          1HG1      VAL  68  -2.718   2.732  16.409
  206   HG12  VAL  68          2HG1      VAL  68  -3.638   2.078  17.787
  207   HG13  VAL  68          3HG1      VAL  68  -4.457   3.078  16.563
  208   HG21  VAL  68          1HG2      VAL  68  -2.198   5.154  16.297
  209   HG22  VAL  68          2HG2      VAL  68  -3.919   5.578  16.456
  210   HG23  VAL  68          3HG2      VAL  68  -2.729   6.246  17.598
  211    H    ALA  69           H        ALA  69  -6.454   3.081  19.079
  212    HA   ALA  69           HA       ALA  69  -5.997   1.843  21.602
  213    HB1  ALA  69          1HB       ALA  69  -7.880   0.365  20.982
  214    HB2  ALA  69          2HB       ALA  69  -8.235   2.071  20.624
  215    HB3  ALA  69          3HB       ALA  69  -7.786   0.961  19.309
  216    HA   PRO  70           HA       PRO  70  -3.153  -1.369  20.920
  217    HB2  PRO  70          1HB       PRO  70  -5.149  -3.003  22.541
  218    HB3  PRO  70          2HB       PRO  70  -3.396  -2.888  22.733
  219    HG2  PRO  70          1HG       PRO  70  -4.927  -1.505  24.406
  220    HG3  PRO  70          2HG       PRO  70  -3.503  -0.720  23.719
  221    HD2  PRO  70          1HD       PRO  70  -6.422  -0.452  22.903
  222    HD3  PRO  70          2HD       PRO  70  -5.155   0.831  23.050
  223    H    LEU  71           H        LEU  71  -2.906  -2.819  19.300
  224    HA   LEU  71           HA       LEU  71  -3.415  -4.239  17.560
  225    HB2  LEU  71          1HB       LEU  71  -6.028  -4.737  19.028
  226    HB3  LEU  71          2HB       LEU  71  -5.324  -5.743  17.761
  227    HG   LEU  71           HG       LEU  71  -4.163  -5.314  20.535
  228   HD11  LEU  71          1HD1      LEU  71  -4.794  -7.663  20.873
  229   HD12  LEU  71          2HD1      LEU  71  -6.212  -6.644  20.536
  230   HD13  LEU  71          3HD1      LEU  71  -5.548  -7.693  19.261
  231   HD21  LEU  71          1HD2      LEU  71  -2.574  -7.081  19.854
  232   HD22  LEU  71          2HD2      LEU  71  -3.296  -7.102  18.227
  233   HD23  LEU  71          3HD2      LEU  71  -2.436  -5.654  18.799
  234    H    GLY  72           H        GLY  72  -4.385  -1.362  17.752
  235    HA2  GLY  72          1HA       GLY  72  -6.274  -1.559  15.430
  236    HA3  GLY  72          2HA       GLY  72  -6.387  -0.286  16.633
  237    H    SER  73           H        SER  73  -6.210   1.075  14.652
  238    HA   SER  73           HA       SER  73  -3.517   2.096  14.405
  239    HB2  SER  73          1HB       SER  73  -3.353   0.158  12.881
  240    HB3  SER  73          2HB       SER  73  -4.739   0.745  11.976
  241    HG   SER  73           HG       SER  73  -3.619   2.424  11.279
  242    H    SER  74           H        SER  74  -3.408   4.092  13.340
  243    HA   SER  74           HA       SER  74  -5.931   5.156  12.207
  244    HB2  SER  74          1HB       SER  74  -6.032   5.762  14.575
  245    HB3  SER  74          2HB       SER  74  -4.415   6.443  14.500
  246    HG   SER  74           HG       SER  74  -5.165   7.927  12.997
  247    H    ASP  75           H        ASP  75  -5.672   6.725  10.680
  248    HA   ASP  75           HA       ASP  75  -3.105   6.687   9.365
  249    HB2  ASP  75          1HB       ASP  75  -5.652   8.263   8.837
  250    HB3  ASP  75          2HB       ASP  75  -4.229   8.353   7.805
  251    H    PHE  76           H        PHE  76  -1.419   7.976   9.565
  252    HA   PHE  76           HA       PHE  76  -1.898  10.757  10.535
  253    HB2  PHE  76          1HB       PHE  76   0.439   8.977  11.331
  254    HB3  PHE  76          2HB       PHE  76   0.227  10.660  11.788
  255    HD1  PHE  76           HD1      PHE  76  -0.113   7.406  12.904
  256    HD2  PHE  76           HD2      PHE  76  -2.204  11.130  12.889
  257    HE1  PHE  76           HE1      PHE  76  -1.379   6.700  14.907
  258    HE2  PHE  76           HE2      PHE  76  -3.472  10.429  14.893
  259    HZ   PHE  76           HZ       PHE  76  -3.059   8.212  15.900
  260    H    LYS  77           H        LYS  77  -0.172  12.274   9.956
  261    HA   LYS  77           HA       LYS  77   0.618  12.065   7.219
  262    HB2  LYS  77          1HB       LYS  77   0.342  14.226   8.376
  263    HB3  LYS  77          2HB       LYS  77   1.699  13.854   9.431
  264    HG2  LYS  77          1HG       LYS  77   3.200  13.815   7.448
  265    HG3  LYS  77          2HG       LYS  77   1.826  14.270   6.431
  266    HD2  LYS  77          1HD       LYS  77   1.536  16.344   7.742
  267    HD3  LYS  77          2HD       LYS  77   2.904  15.889   8.767
  268    HE2  LYS  77          1HE       LYS  77   4.369  15.880   6.741
  269    HE3  LYS  77          2HE       LYS  77   2.999  16.438   5.777
  270    HZ1  LYS  77          1HZ       LYS  77   4.396  18.248   6.459
  271    HZ2  LYS  77          2HZ       LYS  77   2.908  18.402   7.155
  272    HZ3  LYS  77          3HZ       LYS  77   4.189  17.881   8.052
  273    H    PHE  78           H        PHE  78   2.212  11.050   6.259
  274    HA   PHE  78           HA       PHE  78   4.139   9.546   7.837
  275    HB2  PHE  78          1HB       PHE  78   3.843   9.957   4.837
  276    HB3  PHE  78          2HB       PHE  78   5.030   8.889   5.569
  277    HD1  PHE  78           HD1      PHE  78   1.506   9.375   4.759
  278    HD2  PHE  78           HD2      PHE  78   4.336   6.834   6.707
  279    HE1  PHE  78           HE1      PHE  78  -0.163   7.550   4.799
  280    HE2  PHE  78           HE2      PHE  78   2.671   5.006   6.746
  281    HZ   PHE  78           HZ       PHE  78   0.421   5.367   5.793
  282    H    LEU  79           H        LEU  79   6.348   9.787   7.953
  283    HA   LEU  79           HA       LEU  79   7.336  12.491   7.144
  284    HB2  LEU  79          1HB       LEU  79   7.981  10.892   9.647
  285    HB3  LEU  79          2HB       LEU  79   8.786  12.390   9.176
  286    HG   LEU  79           HG       LEU  79   5.829  12.130   9.835
  287   HD11  LEU  79          1HD1      LEU  79   6.432  13.314  11.899
  288   HD12  LEU  79          2HD1      LEU  79   7.251  11.740  11.781
  289   HD13  LEU  79          3HD1      LEU  79   8.150  13.238  11.441
  290   HD21  LEU  79          1HD2      LEU  79   5.906  14.601   9.807
  291   HD22  LEU  79          2HD2      LEU  79   7.616  14.543   9.321
  292   HD23  LEU  79          3HD2      LEU  79   6.357  13.929   8.222
  293    HA   PRO  80           HA       PRO  80  10.627  10.418   5.030
  294    HB2  PRO  80          1HB       PRO  80  12.130  12.930   5.788
  295    HB3  PRO  80          2HB       PRO  80  11.932  12.184   4.195
  296    HG2  PRO  80          1HG       PRO  80  10.519  14.376   4.766
  297    HG3  PRO  80          2HG       PRO  80   9.738  13.048   3.904
  298    HD2  PRO  80          1HD       PRO  80   9.629  13.725   6.879
  299    HD3  PRO  80          2HD       PRO  80   8.268  13.307   5.760
  300    HA   PRO  81           HA       PRO  81  13.134   8.922   8.335
  301    HB2  PRO  81          1HB       PRO  81  15.461   8.232   7.046
  302    HB3  PRO  81          2HB       PRO  81  13.957   7.327   6.830
  303    HG2  PRO  81          1HG       PRO  81  15.137   9.519   5.072
  304    HG3  PRO  81          2HG       PRO  81  14.492   7.950   4.579
  305    HD2  PRO  81          1HD       PRO  81  12.978  10.212   4.433
  306    HD3  PRO  81          2HD       PRO  81  12.245   8.611   4.862
  307    H    GLY  82           H        GLY  82  14.850   9.514   9.730
  308    HA2  GLY  82          1HA       GLY  82  17.002  11.032   9.682
  309    HA3  GLY  82          2HA       GLY  82  15.851  12.286   9.258
  310    H    SER  83           H        SER  83  16.461  13.396  11.202
  311    HA   SER  83           HA       SER  83  15.569  12.092  13.727
  312    HB2  SER  83          1HB       SER  83  17.860  12.912  13.760
  313    HB3  SER  83          2HB       SER  83  17.343  14.499  13.211
  314    HG   SER  83           HG       SER  83  15.874  14.113  15.225
  315    H    TYR  84           H        TYR  84  13.514  12.470  14.176
  316    HA   TYR  84           HA       TYR  84  12.535  15.277  13.861
  317    HB2  TYR  84          1HB       TYR  84  11.039  12.661  13.447
  318    HB3  TYR  84          2HB       TYR  84  10.239  14.220  13.596
  319    HD1  TYR  84           HD1      TYR  84  12.746  12.350  11.570
  320    HD2  TYR  84           HD2      TYR  84   9.993  15.635  11.747
  321    HE1  TYR  84           HE1      TYR  84  13.050  12.737   9.149
  322    HE2  TYR  84           HE2      TYR  84  10.296  16.022   9.326
  323    HH   TYR  84           HH       TYR  84  12.555  14.050   7.419
  324    H    THR  85           H        THR  85  12.473  16.189  15.775
  325    HA   THR  85           HA       THR  85  12.298  14.742  18.236
  326    HB   THR  85           HB       THR  85  11.708  17.684  17.697
  327    HG1  THR  85           HG1      THR  85  13.918  17.887  18.404
  328   HG21  THR  85          1HG2      THR  85  12.228  17.970  20.088
  329   HG22  THR  85          2HG2      THR  85  10.829  16.892  19.867
  330   HG23  THR  85          3HG2      THR  85  12.425  16.210  20.260
  331    H    ALA  86           H        ALA  86  10.660  13.941  19.332
  332    HA   ALA  86           HA       ALA  86   7.914  14.689  18.464
  333    HB1  ALA  86          1HB       ALA  86   7.202  12.626  19.631
  334    HB2  ALA  86          2HB       ALA  86   8.431  12.291  18.385
  335    HB3  ALA  86          3HB       ALA  86   8.889  12.322  20.103
  336    H    GLN  87           H        GLN  87   6.238  14.820  20.144
  337    HA   GLN  87           HA       GLN  87   7.326  15.873  22.716
  338    HB2  GLN  87          1HB       GLN  87   6.684  17.772  21.259
  339    HB3  GLN  87          2HB       GLN  87   5.076  17.092  21.066
  340    HG2  GLN  87          1HG       GLN  87   4.642  17.369  23.455
  341    HG3  GLN  87          2HG       GLN  87   6.288  18.027  23.676
  342   HE21  GLN  87          1HE2      GLN  87   3.835  20.828  23.415
  343   HE22  GLN  87          2HE2      GLN  87   4.005  19.443  24.439
  344    H    VAL  88           H        VAL  88   6.450  15.054  24.483
  345    HA   VAL  88           HA       VAL  88   3.689  13.931  24.268
  346    HB   VAL  88           HB       VAL  88   6.003  12.792  25.895
  347   HG11  VAL  88          1HG1      VAL  88   4.446  10.993  26.469
  348   HG12  VAL  88          2HG1      VAL  88   3.887  12.575  27.065
  349   HG13  VAL  88          3HG1      VAL  88   3.141  11.854  25.618
  350   HG21  VAL  88          1HG2      VAL  88   5.776  10.849  24.379
  351   HG22  VAL  88          2HG2      VAL  88   4.515  11.712  23.466
  352   HG23  VAL  88          3HG2      VAL  88   6.186  12.326  23.475
  353    H    GLY  89           H        GLY  89   2.512  15.466  25.253
  354    HA2  GLY  89          1HA       GLY  89   1.712  16.826  26.957
  355    HA3  GLY  89          2HA       GLY  89   2.748  15.958  28.074
  356    H    GLN  90           H        GLN  90   4.256  17.143  29.045
  357    HA   GLN  90           HA       GLN  90   5.137  19.668  27.744
  358    HB2  GLN  90          1HB       GLN  90   5.479  18.690  30.608
  359    HB3  GLN  90          2HB       GLN  90   6.037  20.239  29.996
  360    HG2  GLN  90          1HG       GLN  90   3.155  19.327  30.107
  361    HG3  GLN  90          2HG       GLN  90   3.955  20.457  31.235
  362   HE21  GLN  90          1HE2      GLN  90   2.092  21.952  28.119
  363   HE22  GLN  90          2HE2      GLN  90   1.758  20.452  28.921
  364    H    GLN  91           H        GLN  91   6.063  16.552  27.733
  365    HA   GLN  91           HA       GLN  91   8.971  17.186  27.935
  366    HB2  GLN  91          1HB       GLN  91   7.562  14.487  27.965
  367    HB3  GLN  91          2HB       GLN  91   9.296  14.733  28.106
  368    HG2  GLN  91          1HG       GLN  91   7.236  15.778  30.060
  369    HG3  GLN  91          2HG       GLN  91   8.213  14.297  30.265
  370   HE21  GLN  91          1HE2      GLN  91   9.620  17.714  31.650
  371   HE22  GLN  91          2HE2      GLN  91   7.957  17.330  31.350
  372    H    SER  92           H        SER  92  10.346  15.789  26.430
  373    HA   SER  92           HA       SER  92   9.079  15.441  23.776
  374    HB2  SER  92          1HB       SER  92  10.733  16.812  22.653
  375    HB3  SER  92          2HB       SER  92   9.884  17.780  23.847
  376    HG   SER  92           HG       SER  92  12.381  17.571  23.626
  377    H    LEU  93           H        LEU  93  10.416  14.288  22.249
  378    HA   LEU  93           HA       LEU  93  12.798  12.936  23.292
  379    HB2  LEU  93          1HB       LEU  93  10.991  11.588  24.271
  380    HB3  LEU  93          2HB       LEU  93  10.250  11.395  22.679
  381    HG   LEU  93           HG       LEU  93  12.308  10.151  21.943
  382   HD11  LEU  93          1HD1      LEU  93  13.835   9.341  23.684
  383   HD12  LEU  93          2HD1      LEU  93  13.871  11.115  23.554
  384   HD13  LEU  93          3HD1      LEU  93  12.990  10.339  24.890
  385   HD21  LEU  93          1HD2      LEU  93  11.713   8.098  23.183
  386   HD22  LEU  93          2HD2      LEU  93  10.836   9.077  24.384
  387   HD23  LEU  93          3HD2      LEU  93  10.257   9.001  22.702
  388    HA   PRO  94           HA       PRO  94  13.532  13.500  18.930
  389    HB2  PRO  94          1HB       PRO  94  15.973  11.922  19.817
  390    HB3  PRO  94          2HB       PRO  94  15.891  13.363  18.794
  391    HG2  PRO  94          1HG       PRO  94  16.650  13.666  21.322
  392    HG3  PRO  94          2HG       PRO  94  15.509  14.825  20.634
  393    HD2  PRO  94          1HD       PRO  94  14.957  12.431  22.437
  394    HD3  PRO  94          2HD       PRO  94  14.273  14.104  22.524
  395    H    VAL  95           H        VAL  95  12.665  12.178  17.452
  396    HA   VAL  95           HA       VAL  95  12.799   9.232  17.919
  397    HB   VAL  95           HB       VAL  95  10.895  10.859  16.179
  398   HG11  VAL  95          1HG1      VAL  95   9.688   8.754  15.875
  399   HG12  VAL  95          2HG1      VAL  95  11.337   8.678  15.211
  400   HG13  VAL  95          3HG1      VAL  95  10.965   7.892  16.765
  401   HG21  VAL  95          1HG2      VAL  95   9.204  10.172  17.850
  402   HG22  VAL  95          2HG2      VAL  95  10.473   9.361  18.800
  403   HG23  VAL  95          3HG2      VAL  95  10.501  11.131  18.603
  404    H    LYS  96           H        LYS  96  14.349   8.251  16.822
  405    HA   LYS  96           HA       LYS  96  15.353   9.332  14.294
  406    HB2  LYS  96          1HB       LYS  96  16.850   8.196  15.930
  407    HB3  LYS  96          2HB       LYS  96  15.961   6.697  15.694
  408    HG2  LYS  96          1HG       LYS  96  16.688   6.545  13.395
  409    HG3  LYS  96          2HG       LYS  96  17.422   8.153  13.474
  410    HD2  LYS  96          1HD       LYS  96  18.963   7.318  15.260
  411    HD3  LYS  96          2HD       LYS  96  18.271   5.702  15.060
  412    HE2  LYS  96          1HE       LYS  96  19.494   7.238  12.751
  413    HE3  LYS  96          2HE       LYS  96  20.450   6.192  13.803
  414    HZ1  LYS  96          1HZ       LYS  96  19.702   5.038  11.853
  415    HZ2  LYS  96          2HZ       LYS  96  19.015   4.368  13.195
  416    HZ3  LYS  96          3HZ       LYS  96  18.122   5.346  12.210
  417    H    LEU  97           H        LEU  97  14.407   9.066  12.424
  418    HA   LEU  97           HA       LEU  97  12.578   6.742  12.087
  419    HB2  LEU  97          1HB       LEU  97  12.803   9.326  10.504
  420    HB3  LEU  97          2HB       LEU  97  11.636   8.037  10.195
  421    HG   LEU  97           HG       LEU  97  11.761   9.810  12.659
  422   HD11  LEU  97          1HD1      LEU  97   9.603  10.626  11.822
  423   HD12  LEU  97          2HD1      LEU  97  10.913  10.914  10.651
  424   HD13  LEU  97          3HD1      LEU  97   9.763   9.581  10.391
  425   HD21  LEU  97          1HD2      LEU  97   9.702   8.622  13.330
  426   HD22  LEU  97          2HD2      LEU  97   9.861   7.546  11.919
  427   HD23  LEU  97          3HD2      LEU  97  11.079   7.500  13.218
  428    H    ASP  98           H        ASP  98  13.426   5.046  11.119
  429    HA   ASP  98           HA       ASP  98  15.516   5.443   9.053
  430    HB2  ASP  98          1HB       ASP  98  14.432   2.941  10.406
  431    HB3  ASP  98          2HB       ASP  98  15.633   2.917   9.124
  432    HA   PRO  99           HA       PRO  99  12.920   5.004   5.587
  433    HB2  PRO  99          1HB       PRO  99  15.031   3.034   4.631
  434    HB3  PRO  99          2HB       PRO  99  14.315   4.401   3.767
  435    HG2  PRO  99          1HG       PRO  99  16.752   4.702   4.784
  436    HG3  PRO  99          2HG       PRO  99  15.586   6.013   4.973
  437    HD2  PRO  99          1HD       PRO  99  16.422   3.887   6.986
  438    HD3  PRO  99          2HD       PRO  99  16.158   5.659   7.242
  439    H    ASP 100           H        ASP 100  11.180   3.741   5.227
  440    HA   ASP 100           HA       ASP 100   9.736   1.949   5.335
  441    HB2  ASP 100          1HB       ASP 100  12.301   0.374   4.863
  442    HB3  ASP 100          2HB       ASP 100  10.676  -0.276   4.705
  443    H    SER 101           H        SER 101   9.938   2.800   7.738
  444    HA   SER 101           HA       SER 101   9.995   0.318   9.342
  445    HB2  SER 101          1HB       SER 101  11.356   1.243  11.091
  446    HB3  SER 101          2HB       SER 101  12.248   1.375   9.583
  447    HG   SER 101           HG       SER 101  11.742   3.490   9.457
  448    H    TYR 102           H        TYR 102   8.958   0.574  11.451
  449    HA   TYR 102           HA       TYR 102   7.007   2.832  11.462
  450    HB2  TYR 102          1HB       TYR 102   6.366  -0.090  12.034
  451    HB3  TYR 102          2HB       TYR 102   5.241   1.253  12.165
  452    HD1  TYR 102           HD1      TYR 102   7.269  -0.741   9.790
  453    HD2  TYR 102           HD2      TYR 102   4.120   2.132  10.271
  454    HE1  TYR 102           HE1      TYR 102   6.642  -1.029   7.417
  455    HE2  TYR 102           HE2      TYR 102   3.494   1.845   7.898
  456    HH   TYR 102           HH       TYR 102   5.228  -0.448   5.803
  457    H    TYR 103           H        TYR 103   6.357   3.613  13.420
  458    HA   TYR 103           HA       TYR 103   7.697   2.435  15.809
  459    HB2  TYR 103          1HB       TYR 103   7.632   5.407  15.149
  460    HB3  TYR 103          2HB       TYR 103   8.354   4.669  16.573
  461    HD1  TYR 103           HD1      TYR 103   8.682   5.201  12.948
  462    HD2  TYR 103           HD2      TYR 103  10.483   3.531  16.467
  463    HE1  TYR 103           HE1      TYR 103  10.829   4.981  11.747
  464    HE2  TYR 103           HE2      TYR 103  12.630   3.314  15.265
  465    HH   TYR 103           HH       TYR 103  13.729   3.699  13.378
  466    H    THR 104           H        THR 104   6.713   2.833  17.809
  467    HA   THR 104           HA       THR 104   4.119   4.306  17.685
  468    HB   THR 104           HB       THR 104   4.670   1.782  19.305
  469    HG1  THR 104           HG1      THR 104   3.609   0.760  17.758
  470   HG21  THR 104          1HG2      THR 104   2.292   1.951  19.915
  471   HG22  THR 104          2HG2      THR 104   3.191   3.385  20.467
  472   HG23  THR 104          3HG2      THR 104   2.165   3.482  19.017
  473    H    LEU 105           H        LEU 105   4.098   6.019  18.929
  474    HA   LEU 105           HA       LEU 105   6.082   6.157  21.149
  475    HB2  LEU 105          1HB       LEU 105   6.297   7.906  19.454
  476    HB3  LEU 105          2HB       LEU 105   4.594   8.337  19.640
  477    HG   LEU 105           HG       LEU 105   5.073   9.065  21.982
  478   HD11  LEU 105          1HD1      LEU 105   7.415   9.331  22.666
  479   HD12  LEU 105          2HD1      LEU 105   7.000   7.623  22.395
  480   HD13  LEU 105          3HD1      LEU 105   7.943   8.513  21.177
  481   HD21  LEU 105          1HD2      LEU 105   6.280  11.117  21.314
  482   HD22  LEU 105          2HD2      LEU 105   6.793  10.326  19.805
  483   HD23  LEU 105          3HD2      LEU 105   5.068  10.660  20.093
  484    H    VAL 106           H        VAL 106   5.332   5.734  23.094
  485    HA   VAL 106           HA       VAL 106   2.482   6.434  23.671
  486    HB   VAL 106           HB       VAL 106   2.446   4.527  25.229
  487   HG11  VAL 106          1HG1      VAL 106   2.544   2.708  23.596
  488   HG12  VAL 106          2HG1      VAL 106   1.746   4.155  22.934
  489   HG13  VAL 106          3HG1      VAL 106   3.420   3.767  22.467
  490   HG21  VAL 106          1HG2      VAL 106   4.344   2.943  25.286
  491   HG22  VAL 106          2HG2      VAL 106   5.273   4.017  24.212
  492   HG23  VAL 106          3HG2      VAL 106   4.835   4.556  25.853
  493    H    SER 107           H        SER 107   1.973   6.977  25.880
  494    HA   SER 107           HA       SER 107   4.134   8.584  27.092
  495    HB2  SER 107          1HB       SER 107   2.402   9.633  28.372
  496    HB3  SER 107          2HB       SER 107   1.834   9.509  26.714
  497    HG   SER 107           HG       SER 107   0.243   8.849  28.058
  498    H    GLN 108           H        GLN 108   4.573   8.538  29.370
  499    HA   GLN 108           HA       GLN 108   3.804   5.971  30.694
  500    HB2  GLN 108          1HB       GLN 108   6.456   7.452  30.920
  501    HB3  GLN 108          2HB       GLN 108   5.997   6.053  31.884
  502    HG2  GLN 108          1HG       GLN 108   6.163   6.021  28.865
  503    HG3  GLN 108          2HG       GLN 108   7.502   5.567  29.955
  504   HE21  GLN 108          1HE2      GLN 108   5.107   2.720  28.802
  505   HE22  GLN 108          2HE2      GLN 108   5.571   4.147  27.941
  506    HA   PRO 109           HA       PRO 109   2.111   8.110  34.069
  507    HB2  PRO 109          1HB       PRO 109   4.059   6.484  35.760
  508    HB3  PRO 109          2HB       PRO 109   2.332   6.759  36.018
  509    HG2  PRO 109          1HG       PRO 109   3.079   4.435  34.977
  510    HG3  PRO 109          2HG       PRO 109   1.689   5.267  34.272
  511    HD2  PRO 109          1HD       PRO 109   4.558   5.137  33.269
  512    HD3  PRO 109          2HD       PRO 109   3.014   5.039  32.331
  513    H    GLY 110           H        GLY 110   2.562  10.091  34.871
  514    HA2  GLY 110          1HA       GLY 110   4.020  11.711  35.958
  515    HA3  GLY 110          2HA       GLY 110   5.415  10.839  35.347
  516    H    GLY 111           H        GLY 111   3.525  10.640  32.772
  517    HA2  GLY 111          1HA       GLY 111   3.016  11.995  30.915
  518    HA3  GLY 111          2HA       GLY 111   3.615  13.399  31.778
  519    H    LYS 112           H        LYS 112   5.215  10.279  31.066
  520    HA   LYS 112           HA       LYS 112   7.454  11.855  29.874
  521    HB2  LYS 112          1HB       LYS 112   7.472   9.140  31.249
  522    HB3  LYS 112          2HB       LYS 112   8.871   9.882  30.488
  523    HG2  LYS 112          1HG       LYS 112   8.755  11.758  32.083
  524    HG3  LYS 112          2HG       LYS 112   7.343  11.016  32.848
  525    HD2  LYS 112          1HD       LYS 112   8.704   9.013  33.392
  526    HD3  LYS 112          2HD       LYS 112  10.113   9.779  32.648
  527    HE2  LYS 112          1HE       LYS 112   9.979  11.623  34.287
  528    HE3  LYS 112          2HE       LYS 112   8.563  10.871  35.025
  529    HZ1  LYS 112          1HZ       LYS 112  10.563  10.356  36.219
  530    HZ2  LYS 112          2HZ       LYS 112   9.931   8.977  35.574
  531    HZ3  LYS 112          3HZ       LYS 112  11.252   9.682  34.884
  532    HA   PRO 113           HA       PRO 113   6.692   9.853  26.101
  533    HB2  PRO 113          1HB       PRO 113   9.036  10.342  24.787
  534    HB3  PRO 113          2HB       PRO 113   7.906  11.643  25.183
  535    HG2  PRO 113          1HG       PRO 113  10.412  10.766  26.680
  536    HG3  PRO 113          2HG       PRO 113   9.928  12.402  26.220
  537    HD2  PRO 113          1HD       PRO 113   9.454  11.409  28.726
  538    HD3  PRO 113          2HD       PRO 113   8.322  12.573  27.928
  539    H    GLN 114           H        GLN 114   7.161   7.938  24.948
  540    HA   GLN 114           HA       GLN 114   9.560   6.390  25.646
  541    HB2  GLN 114          1HB       GLN 114   7.983   5.655  27.379
  542    HB3  GLN 114          2HB       GLN 114   6.757   5.322  26.165
  543    HG2  GLN 114          1HG       GLN 114   7.755   3.262  26.868
  544    HG3  GLN 114          2HG       GLN 114   8.243   3.593  25.181
  545   HE21  GLN 114          1HE2      GLN 114  11.605   3.220  25.888
  546   HE22  GLN 114          2HE2      GLN 114  10.282   3.086  24.776
  547    H    LEU 115           H        LEU 115  10.371   6.078  23.699
  548    HA   LEU 115           HA       LEU 115   8.536   5.634  21.423
  549    HB2  LEU 115          1HB       LEU 115  10.329   7.279  21.155
  550    HB3  LEU 115          2HB       LEU 115  11.543   6.061  21.557
  551    HG   LEU 115           HG       LEU 115  10.868   4.802  19.484
  552   HD11  LEU 115          1HD1      LEU 115   9.545   6.006  17.801
  553   HD12  LEU 115          2HD1      LEU 115   8.603   5.695  19.279
  554   HD13  LEU 115          3HD1      LEU 115   9.260   7.319  18.967
  555   HD21  LEU 115          1HD2      LEU 115  12.024   6.367  17.962
  556   HD22  LEU 115          2HD2      LEU 115  11.773   7.688  19.128
  557   HD23  LEU 115          3HD2      LEU 115  12.821   6.313  19.552
  558    H    VAL 116           H        VAL 116   7.975   3.664  20.852
  559    HA   VAL 116           HA       VAL 116  10.007   1.492  21.165
  560    HB   VAL 116           HB       VAL 116   6.972   1.250  21.327
  561   HG11  VAL 116          1HG1      VAL 116   7.401  -1.079  21.941
  562   HG12  VAL 116          2HG1      VAL 116   7.989  -0.702  20.304
  563   HG13  VAL 116          3HG1      VAL 116   9.140  -0.832  21.656
  564   HG21  VAL 116          1HG2      VAL 116   7.394   0.674  23.696
  565   HG22  VAL 116          2HG2      VAL 116   9.130   0.980  23.459
  566   HG23  VAL 116          3HG2      VAL 116   7.964   2.317  23.323
  567    H    ALA 117           H        ALA 117  10.813   1.015  19.244
  568    HA   ALA 117           HA       ALA 117   9.453   1.495  16.766
  569    HB1  ALA 117          1HB       ALA 117  11.294   0.184  15.761
  570    HB2  ALA 117          2HB       ALA 117  11.901   1.394  16.917
  571    HB3  ALA 117          3HB       ALA 117  11.813  -0.319  17.386
  572    H    GLU 118           H        GLU 118   8.057   0.349  15.633
  573    HA   GLU 118           HA       GLU 118   7.742  -2.541  16.235
  574    HB2  GLU 118          1HB       GLU 118   5.498  -0.488  16.349
  575    HB3  GLU 118          2HB       GLU 118   5.235  -2.225  16.280
  576    HG2  GLU 118          1HG       GLU 118   6.481  -2.480  18.404
  577    HG3  GLU 118          2HG       GLU 118   6.684  -0.732  18.477
  578    HA   PRO 119           HA       PRO 119   7.828  -1.492  11.723
  579    HB2  PRO 119          1HB       PRO 119   9.133  -4.232  11.904
  580    HB3  PRO 119          2HB       PRO 119   9.549  -2.871  10.854
  581    HG2  PRO 119          1HG       PRO 119  11.065  -3.314  12.994
  582    HG3  PRO 119          2HG       PRO 119  10.597  -1.652  12.614
  583    HD2  PRO 119          1HD       PRO 119   9.408  -3.558  14.671
  584    HD3  PRO 119          2HD       PRO 119   9.792  -1.799  14.836
  Start of MODEL    5
    1    H    GLN  38          1H        GLN  38  -1.656   1.521  -0.061
    2    HA   GLN  38           HA       GLN  38  -0.686   2.636   1.786
    3    HB2  GLN  38          1HB       GLN  38   1.181   0.728   0.319
    4    HB3  GLN  38          2HB       GLN  38   1.301   1.148   2.022
    5    HG2  GLN  38          1HG       GLN  38  -1.053  -0.239   0.719
    6    HG3  GLN  38          2HG       GLN  38   0.233  -1.021   1.681
    7   HE21  GLN  38          1HE2      GLN  38  -3.021   0.170   3.533
    8   HE22  GLN  38          2HE2      GLN  38  -2.870  -0.272   1.864
    9    H    ALA  39           H        ALA  39   1.671   3.160   2.558
   10    HA   ALA  39           HA       ALA  39   2.413   5.595   1.197
   11    HB1  ALA  39          1HB       ALA  39   4.206   5.720   2.896
   12    HB2  ALA  39          2HB       ALA  39   2.625   5.361   3.631
   13    HB3  ALA  39          3HB       ALA  39   3.822   4.061   3.413
   14    HA   PRO  40           HA       PRO  40   5.226   4.272  -1.809
   15    HB2  PRO  40          1HB       PRO  40   6.918   6.600  -0.828
   16    HB3  PRO  40          2HB       PRO  40   6.446   6.190  -2.481
   17    HG2  PRO  40          1HG       PRO  40   5.145   8.157  -1.252
   18    HG3  PRO  40          2HG       PRO  40   4.219   6.983  -2.191
   19    HD2  PRO  40          1HD       PRO  40   4.632   7.131   0.820
   20    HD3  PRO  40          2HD       PRO  40   3.121   6.773  -0.106
   21    H    LYS  41           H        LYS  41   6.962   2.906  -1.896
   22    HA   LYS  41           HA       LYS  41   8.208   1.951   0.483
   23    HB2  LYS  41          1HB       LYS  41   8.009   0.639  -1.624
   24    HB3  LYS  41          2HB       LYS  41   9.164   1.713  -2.399
   25    HG2  LYS  41          1HG       LYS  41  10.915   1.003  -0.841
   26    HG3  LYS  41          2HG       LYS  41   9.758  -0.028   0.011
   27    HD2  LYS  41          1HD       LYS  41   9.402  -1.345  -2.051
   28    HD3  LYS  41          2HD       LYS  41  10.554  -0.312  -2.911
   29    HE2  LYS  41          1HE       LYS  41  12.342  -1.001  -1.344
   30    HE3  LYS  41          2HE       LYS  41  11.195  -2.033  -0.486
   31    HZ1  LYS  41          1HZ       LYS  41  12.497  -3.272  -2.054
   32    HZ2  LYS  41          2HZ       LYS  41  10.910  -3.296  -2.505
   33    HZ3  LYS  41          3HZ       LYS  41  11.982  -2.331  -3.306
   34    H    GLY  42           H        GLY  42   9.937   2.523   1.604
   35    HA2  GLY  42          1HA       GLY  42  12.111   3.543   1.866
   36    HA3  GLY  42          2HA       GLY  42  11.809   4.533   0.450
   37    H    SER  43           H        SER  43   8.966   4.495   2.156
   38    HA   SER  43           HA       SER  43   9.518   7.097   3.424
   39    HB2  SER  43          1HB       SER  43   7.131   7.191   3.811
   40    HB3  SER  43          2HB       SER  43   7.430   6.716   2.146
   41    HG   SER  43           HG       SER  43   6.841   4.722   2.565
   42    H    ALA  44           H        ALA  44   8.780   7.527   5.637
   43    HA   ALA  44           HA       ALA  44   9.579   5.268   7.392
   44    HB1  ALA  44          1HB       ALA  44   9.919   7.010   9.116
   45    HB2  ALA  44          2HB       ALA  44  10.860   7.347   7.644
   46    HB3  ALA  44          3HB       ALA  44   9.359   8.247   7.965
   47    H    PHE  45           H        PHE  45   8.403   4.652   9.197
   48    HA   PHE  45           HA       PHE  45   5.559   5.580   9.176
   49    HB2  PHE  45          1HB       PHE  45   6.622   2.799   9.819
   50    HB3  PHE  45          2HB       PHE  45   4.941   3.296   9.925
   51    HD1  PHE  45           HD1      PHE  45   7.712   2.497   7.658
   52    HD2  PHE  45           HD2      PHE  45   3.597   3.614   7.939
   53    HE1  PHE  45           HE1      PHE  45   7.383   1.882   5.286
   54    HE2  PHE  45           HE2      PHE  45   3.266   2.999   5.568
   55    HZ   PHE  45           HZ       PHE  45   5.161   2.132   4.240
   56    H    VAL  46           H        VAL  46   4.598   6.073  11.071
   57    HA   VAL  46           HA       VAL  46   6.001   5.479  13.601
   58    HB   VAL  46           HB       VAL  46   6.941   7.660  12.763
   59   HG11  VAL  46          1HG1      VAL  46   5.507   9.643  12.760
   60   HG12  VAL  46          2HG1      VAL  46   5.000   8.451  11.541
   61   HG13  VAL  46          3HG1      VAL  46   4.087   8.615  13.060
   62   HG21  VAL  46          1HG2      VAL  46   6.558   8.887  14.877
   63   HG22  VAL  46          2HG2      VAL  46   5.173   7.829  15.238
   64   HG23  VAL  46          3HG2      VAL  46   6.817   7.153  15.178
   65    H    ARG  47           H        ARG  47   4.681   5.420  15.371
   66    HA   ARG  47           HA       ARG  47   1.904   6.413  15.082
   67    HB2  ARG  47          1HB       ARG  47   0.939   4.330  15.879
   68    HB3  ARG  47          2HB       ARG  47   1.843   4.037  14.400
   69    HG2  ARG  47          1HG       ARG  47   3.716   3.133  15.716
   70    HG3  ARG  47          2HG       ARG  47   2.791   3.419  17.210
   71    HD2  ARG  47          1HD       ARG  47   1.073   1.906  16.468
   72    HD3  ARG  47          2HD       ARG  47   1.920   1.667  14.923
   73    HE   ARG  47           HE       ARG  47   3.699   1.049  17.027
   74   HH11  ARG  47          1HH1      ARG  47   0.745  -0.166  15.563
   75   HH12  ARG  47          2HH1      ARG  47   1.068  -1.831  15.992
   76   HH21  ARG  47          1HH2      ARG  47   4.108  -1.116  17.577
   77   HH22  ARG  47          2HH2      ARG  47   2.972  -2.370  17.133
   78    H    ALA  48           H        ALA  48   0.832   6.819  17.039
   79    HA   ALA  48           HA       ALA  48   2.618   6.984  19.393
   80    HB1  ALA  48          1HB       ALA  48   0.808   8.346  20.384
   81    HB2  ALA  48          2HB       ALA  48   1.327   8.987  18.807
   82    HB3  ALA  48          3HB       ALA  48  -0.187   8.063  18.936
   83    H    TYR  49           H        TYR  49   2.014   6.205  21.455
   84    HA   TYR  49           HA       TYR  49  -0.216   4.235  21.474
   85    HB2  TYR  49          1HB       TYR  49   1.841   2.931  21.160
   86    HB3  TYR  49          2HB       TYR  49   2.600   3.743  22.520
   87    HD1  TYR  49           HD1      TYR  49  -0.360   1.628  21.657
   88    HD2  TYR  49           HD2      TYR  49   2.474   2.826  24.647
   89    HE1  TYR  49           HE1      TYR  49  -1.235  -0.108  23.182
   90    HE2  TYR  49           HE2      TYR  49   1.600   1.089  26.173
   91    HH   TYR  49           HH       TYR  49  -1.077  -1.039  25.195
   92    H    ASN  50           H        ASN  50  -1.506   4.342  23.176
   93    HA   ASN  50           HA       ASN  50  -0.739   6.316  25.273
   94    HB2  ASN  50          1HB       ASN  50  -2.768   6.831  23.965
   95    HB3  ASN  50          2HB       ASN  50  -3.476   5.295  24.446
   96   HD21  ASN  50          1HD2      ASN  50  -4.739   8.026  26.636
   97   HD22  ASN  50          2HD2      ASN  50  -4.687   7.753  24.926
   98    H    ALA  51           H        ALA  51   0.432   5.073  26.664
   99    HA   ALA  51           HA       ALA  51  -0.709   2.609  27.741
  100    HB1  ALA  51          1HB       ALA  51   1.265   2.636  29.230
  101    HB2  ALA  51          2HB       ALA  51   1.723   2.855  27.526
  102    HB3  ALA  51          3HB       ALA  51   1.691   4.254  28.624
  103    H    GLY  52           H        GLY  52  -2.764   3.757  28.290
  104    HA2  GLY  52          1HA       GLY  52  -3.084   3.964  31.070
  105    HA3  GLY  52          2HA       GLY  52  -2.805   5.605  30.515
  106    H    ASN  53           H        ASN  53  -5.136   5.418  31.600
  107    HA   ASN  53           HA       ASN  53  -7.140   4.539  29.587
  108    HB2  ASN  53          1HB       ASN  53  -7.385   5.243  32.528
  109    HB3  ASN  53          2HB       ASN  53  -8.757   4.881  31.491
  110   HD21  ASN  53          1HD2      ASN  53  -7.317   1.880  33.371
  111   HD22  ASN  53          2HD2      ASN  53  -7.541   3.522  33.874
  112    H    SER  54           H        SER  54  -5.517   7.305  30.504
  113    HA   SER  54           HA       SER  54  -7.799   9.070  29.777
  114    HB2  SER  54          1HB       SER  54  -6.583   9.710  31.782
  115    HB3  SER  54          2HB       SER  54  -5.051   9.660  30.922
  116    HG   SER  54           HG       SER  54  -6.010  11.255  29.506
  117    H    GLU  55           H        GLU  55  -7.914  10.162  27.920
  118    HA   GLU  55           HA       GLU  55  -6.248   9.497  25.709
  119    HB2  GLU  55          1HB       GLU  55  -8.120  11.852  26.164
  120    HB3  GLU  55          2HB       GLU  55  -7.345  11.507  24.625
  121    HG2  GLU  55          1HG       GLU  55  -9.371  10.517  24.301
  122    HG3  GLU  55          2HG       GLU  55  -8.452   9.146  24.913
  123    H    LEU  56           H        LEU  56  -4.569  10.502  24.701
  124    HA   LEU  56           HA       LEU  56  -3.267  12.683  26.274
  125    HB2  LEU  56          1HB       LEU  56  -1.948  10.280  24.961
  126    HB3  LEU  56          2HB       LEU  56  -1.084  11.630  25.704
  127    HG   LEU  56           HG       LEU  56  -2.938   9.732  27.189
  128   HD11  LEU  56          1HD1      LEU  56  -0.864   8.799  28.113
  129   HD12  LEU  56          2HD1      LEU  56  -0.949   8.592  26.348
  130   HD13  LEU  56          3HD1      LEU  56   0.088   9.859  27.048
  131   HD21  LEU  56          1HD2      LEU  56  -1.942  10.799  29.183
  132   HD22  LEU  56          2HD2      LEU  56  -1.002  11.887  28.134
  133   HD23  LEU  56          3HD2      LEU  56  -2.779  11.997  28.168
  134    H    ASP  57           H        ASP  57  -2.227  14.281  25.162
  135    HA   ASP  57           HA       ASP  57  -2.512  14.193  22.196
  136    HB2  ASP  57          1HB       ASP  57  -2.154  16.551  24.090
  137    HB3  ASP  57          2HB       ASP  57  -2.179  16.681  22.336
  138    H    VAL  58           H        VAL  58  -0.760  13.529  21.186
  139    HA   VAL  58           HA       VAL  58   1.874  14.547  22.155
  140    HB   VAL  58           HB       VAL  58   2.893  12.376  21.620
  141   HG11  VAL  58          1HG1      VAL  58   1.928  11.042  23.430
  142   HG12  VAL  58          2HG1      VAL  58   2.121  12.750  23.891
  143   HG13  VAL  58          3HG1      VAL  58   0.512  12.119  23.468
  144   HG21  VAL  58          1HG2      VAL  58   1.460  10.434  21.072
  145   HG22  VAL  58          2HG2      VAL  58   0.034  11.498  21.032
  146   HG23  VAL  58          3HG2      VAL  58   1.330  11.702  19.829
  147    H    SER  59           H        SER  59   3.604  14.315  20.471
  148    HA   SER  59           HA       SER  59   2.608  14.305  17.692
  149    HB2  SER  59          1HB       SER  59   3.541  16.475  17.160
  150    HB3  SER  59          2HB       SER  59   2.365  16.650  18.454
  151    HG   SER  59           HG       SER  59   4.895  17.325  18.419
  152    H    VAL  60           H        VAL  60   4.282  14.177  16.105
  153    HA   VAL  60           HA       VAL  60   6.983  13.566  17.230
  154    HB   VAL  60           HB       VAL  60   5.652  12.174  14.867
  155   HG11  VAL  60          1HG1      VAL  60   7.586  10.678  14.954
  156   HG12  VAL  60          2HG1      VAL  60   8.059  12.361  14.621
  157   HG13  VAL  60          3HG1      VAL  60   8.297  11.674  16.246
  158   HG21  VAL  60          1HG2      VAL  60   5.597  10.198  16.355
  159   HG22  VAL  60          2HG2      VAL  60   6.241  11.185  17.688
  160   HG23  VAL  60          3HG2      VAL  60   4.629  11.532  17.022
  161    H    GLY  61           H        GLY  61   7.654  15.694  16.792
  162    HA2  GLY  61          1HA       GLY  61   8.670  17.322  15.479
  163    HA3  GLY  61          2HA       GLY  61   8.684  16.177  14.151
  164    H    SER  62           H        SER  62   7.439  16.618  12.443
  165    HA   SER  62           HA       SER  62   5.538  18.852  12.602
  166    HB2  SER  62          1HB       SER  62   5.427  18.676  10.200
  167    HB3  SER  62          2HB       SER  62   7.113  18.578  10.690
  168    HG   SER  62           HG       SER  62   5.497  16.315  10.318
  169    H    THR  63           H        THR  63   5.433  15.495  13.013
  170    HA   THR  63           HA       THR  63   2.730  15.149  11.915
  171    HB   THR  63           HB       THR  63   4.510  13.248  13.503
  172    HG1  THR  63           HG1      THR  63   5.420  13.172  11.585
  173   HG21  THR  63          1HG2      THR  63   2.929  11.509  12.764
  174   HG22  THR  63          2HG2      THR  63   2.109  12.726  13.771
  175   HG23  THR  63          3HG2      THR  63   1.909  12.752  12.004
  176    H    SER  64           H        SER  64   0.900  15.449  12.948
  177    HA   SER  64           HA       SER  64   1.020  15.862  15.896
  178    HB2  SER  64          1HB       SER  64   0.117  17.744  14.665
  179    HB3  SER  64          2HB       SER  64  -1.010  16.707  13.807
  180    HG   SER  64           HG       SER  64  -1.225  16.337  16.437
  181    H    LEU  65           H        LEU  65   0.367  14.292  17.166
  182    HA   LEU  65           HA       LEU  65  -1.762  12.458  16.148
  183    HB2  LEU  65          1HB       LEU  65   0.625  11.736  17.883
  184    HB3  LEU  65          2HB       LEU  65  -0.674  10.636  17.414
  185    HG   LEU  65           HG       LEU  65   1.221  11.967  15.449
  186   HD11  LEU  65          1HD1      LEU  65   2.319   9.774  15.341
  187   HD12  LEU  65          2HD1      LEU  65   2.434  10.488  16.968
  188   HD13  LEU  65          3HD1      LEU  65   1.266   9.183  16.648
  189   HD21  LEU  65          1HD2      LEU  65   0.314  10.259  13.910
  190   HD22  LEU  65          2HD2      LEU  65  -0.768   9.674  15.197
  191   HD23  LEU  65          3HD2      LEU  65  -0.980  11.311  14.533
  192    H    ASN  66           H        ASN  66  -3.072  14.183  17.266
  193    HA   ASN  66           HA       ASN  66  -2.815  14.172  20.214
  194    HB2  ASN  66          1HB       ASN  66  -4.518  15.842  18.336
  195    HB3  ASN  66          2HB       ASN  66  -4.514  16.005  20.087
  196   HD21  ASN  66          1HD2      ASN  66  -2.105  18.334  18.252
  197   HD22  ASN  66          2HD2      ASN  66  -3.707  17.821  17.843
  198    H    ASP  67           H        ASP  67  -4.671  13.960  21.593
  199    HA   ASP  67           HA       ASP  67  -6.444  12.723  22.385
  200    HB2  ASP  67          1HB       ASP  67  -7.569  14.282  20.674
  201    HB3  ASP  67          2HB       ASP  67  -7.595  12.904  19.580
  202    H    VAL  68           H        VAL  68  -4.508  11.057  22.107
  203    HA   VAL  68           HA       VAL  68  -5.184   8.850  20.303
  204    HB   VAL  68           HB       VAL  68  -3.174   9.006  22.592
  205   HG11  VAL  68          1HG1      VAL  68  -2.148   7.045  21.549
  206   HG12  VAL  68          2HG1      VAL  68  -3.808   6.716  22.098
  207   HG13  VAL  68          3HG1      VAL  68  -3.478   6.978  20.368
  208   HG21  VAL  68          1HG2      VAL  68  -1.517   9.318  20.780
  209   HG22  VAL  68          2HG2      VAL  68  -2.833   9.326  19.581
  210   HG23  VAL  68          3HG2      VAL  68  -2.720  10.631  20.786
  211    H    ALA  69           H        ALA  69  -6.302   7.048  20.755
  212    HA   ALA  69           HA       ALA  69  -8.208   7.244  22.859
  213    HB1  ALA  69          1HB       ALA  69  -8.922   4.987  22.140
  214    HB2  ALA  69          2HB       ALA  69  -8.672   6.073  20.753
  215    HB3  ALA  69          3HB       ALA  69  -7.449   4.844  21.153
  216    HA   PRO  70           HA       PRO  70  -6.328   5.574  26.394
  217    HB2  PRO  70          1HB       PRO  70  -8.942   4.046  26.686
  218    HB3  PRO  70          2HB       PRO  70  -8.081   5.015  27.888
  219    HG2  PRO  70          1HG       PRO  70 -10.208   6.086  26.707
  220    HG3  PRO  70          2HG       PRO  70  -8.765   7.082  26.920
  221    HD2  PRO  70          1HD       PRO  70  -9.735   5.618  24.432
  222    HD3  PRO  70          2HD       PRO  70  -9.055   7.287  24.577
  223    H    LEU  71           H        LEU  71  -4.950   3.905  26.603
  224    HA   LEU  71           HA       LEU  71  -3.843   1.954  26.063
  225    HB2  LEU  71          1HB       LEU  71  -6.656   0.809  26.200
  226    HB3  LEU  71          2HB       LEU  71  -5.155  -0.115  26.312
  227    HG   LEU  71           HG       LEU  71  -6.107   1.957  28.323
  228   HD11  LEU  71          1HD1      LEU  71  -6.463   0.009  29.773
  229   HD12  LEU  71          2HD1      LEU  71  -7.475  -0.065  28.312
  230   HD13  LEU  71          3HD1      LEU  71  -6.013  -1.071  28.432
  231   HD21  LEU  71          1HD2      LEU  71  -4.213   1.117  29.670
  232   HD22  LEU  71          2HD2      LEU  71  -3.730   0.052  28.328
  233   HD23  LEU  71          3HD2      LEU  71  -3.645   1.818  28.135
  234    H    GLY  72           H        GLY  72  -4.672   3.592  23.837
  235    HA2  GLY  72          1HA       GLY  72  -4.994   1.462  21.747
  236    HA3  GLY  72          2HA       GLY  72  -5.781   3.023  21.622
  237    H    SER  73           H        SER  73  -4.643   3.187  19.560
  238    HA   SER  73           HA       SER  73  -1.992   4.435  19.904
  239    HB2  SER  73          1HB       SER  73  -0.913   3.070  18.227
  240    HB3  SER  73          2HB       SER  73  -1.533   2.026  19.496
  241    HG   SER  73           HG       SER  73  -2.214   2.229  16.878
  242    H    SER  74           H        SER  74  -1.213   5.420  17.841
  243    HA   SER  74           HA       SER  74  -3.434   6.053  15.969
  244    HB2  SER  74          1HB       SER  74  -3.383   7.855  17.639
  245    HB3  SER  74          2HB       SER  74  -1.667   8.099  17.348
  246    HG   SER  74           HG       SER  74  -2.697   8.176  15.018
  247    H    ASP  75           H        ASP  75  -2.639   5.109  14.192
  248    HA   ASP  75           HA       ASP  75   0.215   5.120  13.614
  249    HB2  ASP  75          1HB       ASP  75  -2.188   4.203  11.984
  250    HB3  ASP  75          2HB       ASP  75  -0.517   3.996  11.477
  251    H    PHE  76           H        PHE  76   1.285   6.101  11.901
  252    HA   PHE  76           HA       PHE  76  -0.260   8.016  10.246
  253    HB2  PHE  76          1HB       PHE  76   0.683   9.288  12.198
  254    HB3  PHE  76          2HB       PHE  76   2.295   8.791  11.708
  255    HD1  PHE  76           HD1      PHE  76  -0.673  10.747  10.676
  256    HD2  PHE  76           HD2      PHE  76   3.453   9.902   9.972
  257    HE1  PHE  76           HE1      PHE  76  -0.533  12.700   9.167
  258    HE2  PHE  76           HE2      PHE  76   3.601  11.855   8.464
  259    HZ   PHE  76           HZ       PHE  76   1.603  13.254   8.060
  260    H    LYS  77           H        LYS  77   0.268   7.900   8.180
  261    HA   LYS  77           HA       LYS  77   2.851   6.552   7.501
  262    HB2  LYS  77          1HB       LYS  77   0.193   6.457   6.015
  263    HB3  LYS  77          2HB       LYS  77   1.691   5.735   5.446
  264    HG2  LYS  77          1HG       LYS  77   1.723   4.218   7.371
  265    HG3  LYS  77          2HG       LYS  77   0.249   4.965   8.000
  266    HD2  LYS  77          1HD       LYS  77  -0.955   4.293   5.930
  267    HD3  LYS  77          2HD       LYS  77   0.519   3.510   5.343
  268    HE2  LYS  77          1HE       LYS  77   0.496   1.956   7.223
  269    HE3  LYS  77          2HE       LYS  77  -0.883   2.789   7.942
  270    HZ1  LYS  77          1HZ       LYS  77  -1.553   0.828   6.763
  271    HZ2  LYS  77          2HZ       LYS  77  -2.186   2.161   6.027
  272    HZ3  LYS  77          3HZ       LYS  77  -0.897   1.382   5.355
  273    H    PHE  78           H        PHE  78   3.352   6.974   5.048
  274    HA   PHE  78           HA       PHE  78   3.942   8.476   3.404
  275    HB2  PHE  78          1HB       PHE  78   1.616  10.123   4.478
  276    HB3  PHE  78          2HB       PHE  78   2.438  10.390   2.950
  277    HD1  PHE  78           HD1      PHE  78  -0.079   8.485   4.702
  278    HD2  PHE  78           HD2      PHE  78   2.278   8.662   1.142
  279    HE1  PHE  78           HE1      PHE  78  -1.639   6.921   3.593
  280    HE2  PHE  78           HE2      PHE  78   0.717   7.103   0.029
  281    HZ   PHE  78           HZ       PHE  78  -1.241   6.232   1.255
  282    H    LEU  79           H        LEU  79   5.142   8.592   6.046
  283    HA   LEU  79           HA       LEU  79   5.719  11.499   6.320
  284    HB2  LEU  79          1HB       LEU  79   5.032  10.325   8.364
  285    HB3  LEU  79          2HB       LEU  79   6.338   9.156   8.153
  286    HG   LEU  79           HG       LEU  79   7.986  11.026   8.443
  287   HD11  LEU  79          1HD1      LEU  79   7.167  13.148   9.365
  288   HD12  LEU  79          2HD1      LEU  79   6.539  12.858   7.726
  289   HD13  LEU  79          3HD1      LEU  79   5.490  12.599   9.139
  290   HD21  LEU  79          1HD2      LEU  79   7.628  11.203  10.883
  291   HD22  LEU  79          2HD2      LEU  79   5.956  10.626  10.679
  292   HD23  LEU  79          3HD2      LEU  79   7.323   9.547  10.309
  293    HA   PRO  80           HA       PRO  80   9.442  10.738   4.003
  294    HB2  PRO  80          1HB       PRO  80   9.940  13.511   5.149
  295    HB3  PRO  80          2HB       PRO  80  10.193  12.928   3.499
  296    HG2  PRO  80          1HG       PRO  80   8.039  14.407   3.988
  297    HG3  PRO  80          2HG       PRO  80   7.868  12.968   2.978
  298    HD2  PRO  80          1HD       PRO  80   7.198  13.333   5.928
  299    HD3  PRO  80          2HD       PRO  80   6.242  12.499   4.637
  300    HA   PRO  81           HA       PRO  81  11.805   9.345   7.513
  301    HB2  PRO  81          1HB       PRO  81  13.943   9.237   5.359
  302    HB3  PRO  81          2HB       PRO  81  13.484   7.999   6.536
  303    HG2  PRO  81          1HG       PRO  81  12.649   7.728   4.021
  304    HG3  PRO  81          2HG       PRO  81  11.525   7.380   5.339
  305    HD2  PRO  81          1HD       PRO  81  11.755   9.890   3.624
  306    HD3  PRO  81          2HD       PRO  81  10.268   8.999   4.147
  307    H    GLY  82           H        GLY  82  13.368  10.247   8.863
  308    HA2  GLY  82          1HA       GLY  82  15.429  11.979   8.432
  309    HA3  GLY  82          2HA       GLY  82  14.051  13.055   8.295
  310    H    SER  83           H        SER  83  15.447  13.900  10.217
  311    HA   SER  83           HA       SER  83  14.928  12.501  12.750
  312    HB2  SER  83          1HB       SER  83  17.070  13.595  12.481
  313    HB3  SER  83          2HB       SER  83  16.301  15.120  12.074
  314    HG   SER  83           HG       SER  83  15.221  14.525  14.280
  315    H    TYR  84           H        TYR  84  13.207  12.772  13.970
  316    HA   TYR  84           HA       TYR  84  11.809  15.406  13.861
  317    HB2  TYR  84          1HB       TYR  84  10.499  12.657  13.942
  318    HB3  TYR  84          2HB       TYR  84   9.646  14.180  14.152
  319    HD1  TYR  84           HD1      TYR  84  11.375  11.988  11.767
  320    HD2  TYR  84           HD2      TYR  84   9.238  15.671  12.285
  321    HE1  TYR  84           HE1      TYR  84  11.076  12.159   9.318
  322    HE2  TYR  84           HE2      TYR  84   8.937  15.841   9.838
  323    HH   TYR  84           HH       TYR  84   9.992  13.256   7.671
  324    H    THR  85           H        THR  85  11.009  16.204  15.749
  325    HA   THR  85           HA       THR  85  12.034  14.841  18.183
  326    HB   THR  85           HB       THR  85  11.054  17.700  17.779
  327    HG1  THR  85           HG1      THR  85  13.323  18.125  18.065
  328   HG21  THR  85          1HG2      THR  85  11.968  18.085  20.033
  329   HG22  THR  85          2HG2      THR  85  10.662  16.877  20.075
  330   HG23  THR  85          3HG2      THR  85  12.362  16.355  20.174
  331    H    ALA  86           H        ALA  86  10.660  13.500  19.103
  332    HA   ALA  86           HA       ALA  86   7.785  13.865  18.918
  333    HB1  ALA  86          1HB       ALA  86   7.684  11.894  20.412
  334    HB2  ALA  86          2HB       ALA  86   8.771  11.621  19.029
  335    HB3  ALA  86          3HB       ALA  86   9.445  11.985  20.634
  336    H    GLN  87           H        GLN  87   6.319  14.238  20.608
  337    HA   GLN  87           HA       GLN  87   7.482  15.530  23.026
  338    HB2  GLN  87          1HB       GLN  87   6.923  17.328  21.418
  339    HB3  GLN  87          2HB       GLN  87   5.284  16.710  21.279
  340    HG2  GLN  87          1HG       GLN  87   5.253  18.600  22.725
  341    HG3  GLN  87          2HG       GLN  87   4.974  17.144  23.724
  342   HE21  GLN  87          1HE2      GLN  87   7.481  18.010  25.939
  343   HE22  GLN  87          2HE2      GLN  87   5.923  17.322  25.635
  344    H    VAL  88           H        VAL  88   6.784  14.450  24.716
  345    HA   VAL  88           HA       VAL  88   3.863  13.832  24.814
  346    HB   VAL  88           HB       VAL  88   6.117  12.193  26.050
  347   HG11  VAL  88          1HG1      VAL  88   4.347  10.619  26.662
  348   HG12  VAL  88          2HG1      VAL  88   4.124  12.205  27.436
  349   HG13  VAL  88          3HG1      VAL  88   3.125  11.749  26.034
  350   HG21  VAL  88          1HG2      VAL  88   5.415  10.461  24.428
  351   HG22  VAL  88          2HG2      VAL  88   4.232  11.594  23.733
  352   HG23  VAL  88          3HG2      VAL  88   5.973  11.932  23.597
  353    H    GLY  89           H        GLY  89   3.039  15.352  26.098
  354    HA2  GLY  89          1HA       GLY  89   2.616  16.545  28.045
  355    HA3  GLY  89          2HA       GLY  89   3.676  15.435  28.895
  356    H    GLN  90           H        GLN  90   5.557  16.198  29.649
  357    HA   GLN  90           HA       GLN  90   6.542  18.785  28.524
  358    HB2  GLN  90          1HB       GLN  90   6.810  17.700  31.357
  359    HB3  GLN  90          2HB       GLN  90   7.540  19.189  30.775
  360    HG2  GLN  90          1HG       GLN  90   4.567  18.631  30.863
  361    HG3  GLN  90          2HG       GLN  90   5.493  19.578  32.064
  362   HE21  GLN  90          1HE2      GLN  90   3.845  21.528  29.105
  363   HE22  GLN  90          2HE2      GLN  90   3.302  20.059  29.846
  364    H    GLN  91           H        GLN  91   7.117  15.830  27.904
  365    HA   GLN  91           HA       GLN  91  10.084  16.097  28.128
  366    HB2  GLN  91          1HB       GLN  91   9.342  14.354  29.684
  367    HB3  GLN  91          2HB       GLN  91   8.417  13.565  28.414
  368    HG2  GLN  91          1HG       GLN  91  10.419  12.332  28.732
  369    HG3  GLN  91          2HG       GLN  91  10.567  13.195  27.174
  370   HE21  GLN  91          1HE2      GLN  91  13.562  14.692  28.027
  371   HE22  GLN  91          2HE2      GLN  91  12.463  14.122  26.816
  372    H    SER  92           H        SER  92  10.936  16.409  26.215
  373    HA   SER  92           HA       SER  92   9.575  15.370  23.808
  374    HB2  SER  92          1HB       SER  92  11.178  16.690  22.567
  375    HB3  SER  92          2HB       SER  92  10.495  17.677  23.850
  376    HG   SER  92           HG       SER  92  12.722  17.870  23.716
  377    H    LEU  93           H        LEU  93  10.675  14.131  22.200
  378    HA   LEU  93           HA       LEU  93  13.047  12.624  23.154
  379    HB2  LEU  93          1HB       LEU  93  10.436  11.372  22.234
  380    HB3  LEU  93          2HB       LEU  93  11.956  10.488  22.402
  381    HG   LEU  93           HG       LEU  93  10.523  11.887  24.686
  382   HD11  LEU  93          1HD1      LEU  93   9.872   9.622  25.374
  383   HD12  LEU  93          2HD1      LEU  93   9.189  10.049  23.788
  384   HD13  LEU  93          3HD1      LEU  93  10.596   8.964  23.889
  385   HD21  LEU  93          1HD2      LEU  93  12.091  10.569  26.066
  386   HD22  LEU  93          2HD2      LEU  93  12.848   9.921  24.590
  387   HD23  LEU  93          3HD2      LEU  93  12.969  11.658  24.965
  388    HA   PRO  94           HA       PRO  94  13.606  13.936  18.795
  389    HB2  PRO  94          1HB       PRO  94  16.422  13.536  19.857
  390    HB3  PRO  94          2HB       PRO  94  15.802  14.811  18.800
  391    HG2  PRO  94          1HG       PRO  94  16.215  15.390  21.365
  392    HG3  PRO  94          2HG       PRO  94  14.740  15.972  20.589
  393    HD2  PRO  94          1HD       PRO  94  15.127  13.551  22.400
  394    HD3  PRO  94          2HD       PRO  94  13.810  14.791  22.423
  395    H    VAL  95           H        VAL  95  13.648  12.428  17.229
  396    HA   VAL  95           HA       VAL  95  15.199   9.939  17.603
  397    HB   VAL  95           HB       VAL  95  12.969   9.446  18.576
  398   HG11  VAL  95          1HG1      VAL  95  10.970   9.462  17.165
  399   HG12  VAL  95          2HG1      VAL  95  11.657  11.090  17.366
  400   HG13  VAL  95          3HG1      VAL  95  11.910  10.199  15.845
  401   HG21  VAL  95          1HG2      VAL  95  12.457   7.474  17.172
  402   HG22  VAL  95          2HG2      VAL  95  13.446   8.155  15.859
  403   HG23  VAL  95          3HG2      VAL  95  14.212   7.670  17.390
  404    H    LYS  96           H        LYS  96  16.079   9.242  15.759
  405    HA   LYS  96           HA       LYS  96  15.318  10.543  13.229
  406    HB2  LYS  96          1HB       LYS  96  17.711  10.160  13.779
  407    HB3  LYS  96          2HB       LYS  96  17.427   8.427  13.823
  408    HG2  LYS  96          1HG       LYS  96  16.839   8.447  11.434
  409    HG3  LYS  96          2HG       LYS  96  17.085  10.196  11.384
  410    HD2  LYS  96          1HD       LYS  96  19.448   9.900  12.020
  411    HD3  LYS  96          2HD       LYS  96  19.210   8.148  12.118
  412    HE2  LYS  96          1HE       LYS  96  18.607   8.105   9.712
  413    HE3  LYS  96          2HE       LYS  96  18.869   9.846   9.619
  414    HZ1  LYS  96          1HZ       LYS  96  20.775   8.626   8.868
  415    HZ2  LYS  96          2HZ       LYS  96  21.162   9.476  10.229
  416    HZ3  LYS  96          3HZ       LYS  96  20.915   7.847  10.315
  417    H    LEU  97           H        LEU  97  13.923   9.787  11.827
  418    HA   LEU  97           HA       LEU  97  12.914   7.020  12.233
  419    HB2  LEU  97          1HB       LEU  97  11.722   9.263  10.569
  420    HB3  LEU  97          2HB       LEU  97  10.952   7.731  10.990
  421    HG   LEU  97           HG       LEU  97  11.610  10.015  12.881
  422   HD11  LEU  97          1HD1      LEU  97   9.170  10.134  13.108
  423   HD12  LEU  97          2HD1      LEU  97   9.687  10.400  11.426
  424   HD13  LEU  97          3HD1      LEU  97   8.995   8.833  11.906
  425   HD21  LEU  97          1HD2      LEU  97  10.508   8.616  14.593
  426   HD22  LEU  97          2HD2      LEU  97  10.352   7.292  13.415
  427   HD23  LEU  97          3HD2      LEU  97  11.964   7.816  13.955
  428    H    ASP  98           H        ASP  98  14.111   5.618  11.107
  429    HA   ASP  98           HA       ASP  98  15.292   6.288   8.546
  430    HB2  ASP  98          1HB       ASP  98  15.005   3.684  10.086
  431    HB3  ASP  98          2HB       ASP  98  15.781   3.770   8.510
  432    HA   PRO  99           HA       PRO  99  12.079   5.192   5.843
  433    HB2  PRO  99          1HB       PRO  99  13.460   4.171   3.688
  434    HB3  PRO  99          2HB       PRO  99  13.465   5.892   4.094
  435    HG2  PRO  99          1HG       PRO  99  15.522   3.757   4.804
  436    HG3  PRO  99          2HG       PRO  99  15.802   5.362   4.121
  437    HD2  PRO  99          1HD       PRO  99  16.075   4.920   6.785
  438    HD3  PRO  99          2HD       PRO  99  15.386   6.473   6.166
  439    H    ASP 100           H        ASP 100  10.828   3.425   5.139
  440    HA   ASP 100           HA       ASP 100   9.985   1.288   5.283
  441    HB2  ASP 100          1HB       ASP 100  12.906   0.602   4.772
  442    HB3  ASP 100          2HB       ASP 100  11.594  -0.568   4.718
  443    H    SER 101           H        SER 101  10.358   2.450   7.737
  444    HA   SER 101           HA       SER 101  10.746   0.054   9.398
  445    HB2  SER 101          1HB       SER 101  12.998   1.032   9.327
  446    HB3  SER 101          2HB       SER 101  12.360   2.589   9.831
  447    HG   SER 101           HG       SER 101  11.871   0.284  11.326
  448    H    TYR 102           H        TYR 102   9.744   0.160  11.414
  449    HA   TYR 102           HA       TYR 102   7.723   2.352  11.549
  450    HB2  TYR 102          1HB       TYR 102   7.646  -0.518  12.556
  451    HB3  TYR 102          2HB       TYR 102   6.421   0.681  12.945
  452    HD1  TYR 102           HD1      TYR 102   8.090  -1.000  10.060
  453    HD2  TYR 102           HD2      TYR 102   4.611   1.041  11.524
  454    HE1  TYR 102           HE1      TYR 102   6.889  -1.547   7.971
  455    HE2  TYR 102           HE2      TYR 102   3.411   0.494   9.434
  456    HH   TYR 102           HH       TYR 102   4.992  -1.344   6.831
  457    H    TYR 103           H        TYR 103   7.386   3.517  13.353
  458    HA   TYR 103           HA       TYR 103   9.039   2.824  15.739
  459    HB2  TYR 103          1HB       TYR 103   8.651   5.595  14.536
  460    HB3  TYR 103          2HB       TYR 103   9.409   5.275  16.090
  461    HD1  TYR 103           HD1      TYR 103   9.727   4.772  12.431
  462    HD2  TYR 103           HD2      TYR 103  11.668   4.571  16.254
  463    HE1  TYR 103           HE1      TYR 103  11.911   4.490  11.308
  464    HE2  TYR 103           HE2      TYR 103  13.852   4.289  15.129
  465    HH   TYR 103           HH       TYR 103  14.920   4.146  13.195
  466    H    THR 104           H        THR 104   8.151   3.150  17.714
  467    HA   THR 104           HA       THR 104   5.322   4.123  17.711
  468    HB   THR 104           HB       THR 104   6.534   1.904  19.417
  469    HG1  THR 104           HG1      THR 104   5.750   0.627  17.928
  470   HG21  THR 104          1HG2      THR 104   4.232   1.612  20.250
  471   HG22  THR 104          2HG2      THR 104   4.847   3.237  20.637
  472   HG23  THR 104          3HG2      THR 104   3.704   3.015  19.292
  473    H    LEU 105           H        LEU 105   4.923   5.821  18.920
  474    HA   LEU 105           HA       LEU 105   6.928   6.647  20.935
  475    HB2  LEU 105          1HB       LEU 105   6.145   8.332  19.333
  476    HB3  LEU 105          2HB       LEU 105   4.473   8.058  19.833
  477    HG   LEU 105           HG       LEU 105   5.032   8.925  22.097
  478   HD11  LEU 105          1HD1      LEU 105   7.186  10.051  22.437
  479   HD12  LEU 105          2HD1      LEU 105   7.394   8.312  22.123
  480   HD13  LEU 105          3HD1      LEU 105   7.728   9.495  20.837
  481   HD21  LEU 105          1HD2      LEU 105   5.266  11.282  21.386
  482   HD22  LEU 105          2HD2      LEU 105   5.783  10.744  19.770
  483   HD23  LEU 105          3HD2      LEU 105   4.129  10.407  20.334
  484    H    VAL 106           H        VAL 106   6.663   5.450  22.740
  485    HA   VAL 106           HA       VAL 106   4.009   4.780  23.740
  486    HB   VAL 106           HB       VAL 106   6.762   4.470  25.008
  487   HG11  VAL 106          1HG1      VAL 106   5.678   2.866  26.506
  488   HG12  VAL 106          2HG1      VAL 106   5.015   4.507  26.691
  489   HG13  VAL 106          3HG1      VAL 106   4.099   3.272  25.795
  490   HG21  VAL 106          1HG2      VAL 106   6.528   2.110  24.300
  491   HG22  VAL 106          2HG2      VAL 106   4.978   2.501  23.520
  492   HG23  VAL 106          3HG2      VAL 106   6.489   3.208  22.901
  493    H    SER 107           H        SER 107   2.795   6.396  24.502
  494    HA   SER 107           HA       SER 107   4.067   8.375  26.328
  495    HB2  SER 107          1HB       SER 107   2.050   9.704  26.000
  496    HB3  SER 107          2HB       SER 107   2.755   9.275  24.449
  497    HG   SER 107           HG       SER 107   1.268   7.411  24.597
  498    H    GLN 108           H        GLN 108   2.821   9.048  28.239
  499    HA   GLN 108           HA       GLN 108   0.918   7.099  29.323
  500    HB2  GLN 108          1HB       GLN 108   3.107   6.045  29.837
  501    HB3  GLN 108          2HB       GLN 108   3.626   7.514  30.652
  502    HG2  GLN 108          1HG       GLN 108   1.891   7.242  32.335
  503    HG3  GLN 108          2HG       GLN 108   1.283   5.792  31.488
  504   HE21  GLN 108          1HE2      GLN 108   3.208   4.099  33.920
  505   HE22  GLN 108          2HE2      GLN 108   1.623   4.659  33.504
  506    HA   PRO 109           HA       PRO 109  -0.632  10.821  30.989
  507    HB2  PRO 109          1HB       PRO 109  -1.848   8.902  33.005
  508    HB3  PRO 109          2HB       PRO 109  -2.634  10.183  32.075
  509    HG2  PRO 109          1HG       PRO 109  -2.968   7.667  31.278
  510    HG3  PRO 109          2HG       PRO 109  -2.650   8.909  30.062
  511    HD2  PRO 109          1HD       PRO 109  -0.718   6.907  31.305
  512    HD3  PRO 109          2HD       PRO 109  -0.896   7.390  29.570
  513    H    GLY 110           H        GLY 110   1.134  11.827  31.904
  514    HA2  GLY 110          1HA       GLY 110   2.274  12.764  33.707
  515    HA3  GLY 110          2HA       GLY 110   1.278  11.811  34.791
  516    H    GLY 111           H        GLY 111   2.995  10.185  32.231
  517    HA2  GLY 111          1HA       GLY 111   4.903   9.084  34.267
  518    HA3  GLY 111          2HA       GLY 111   4.176   8.113  32.999
  519    H    LYS 112           H        LYS 112   6.527   7.640  32.618
  520    HA   LYS 112           HA       LYS 112   7.899   9.804  31.105
  521    HB2  LYS 112          1HB       LYS 112   9.181   8.689  32.914
  522    HB3  LYS 112          2HB       LYS 112   8.954   7.135  32.124
  523    HG2  LYS 112          1HG       LYS 112  10.249   7.911  30.185
  524    HG3  LYS 112          2HG       LYS 112  10.455   9.492  30.949
  525    HD2  LYS 112          1HD       LYS 112  11.646   8.435  32.837
  526    HD3  LYS 112          2HD       LYS 112  11.427   6.846  32.089
  527    HE2  LYS 112          1HE       LYS 112  12.735   7.589  30.126
  528    HE3  LYS 112          2HE       LYS 112  12.953   9.175  30.867
  529    HZ1  LYS 112          1HZ       LYS 112  14.844   7.767  31.224
  530    HZ2  LYS 112          2HZ       LYS 112  14.125   8.108  32.669
  531    HZ3  LYS 112          3HZ       LYS 112  13.922   6.624  31.974
  532    HA   PRO 113           HA       PRO 113   6.633   7.722  27.460
  533    HB2  PRO 113          1HB       PRO 113   7.747   9.444  25.645
  534    HB3  PRO 113          2HB       PRO 113   6.315   9.877  26.587
  535    HG2  PRO 113          1HG       PRO 113   9.238  10.567  27.122
  536    HG3  PRO 113          2HG       PRO 113   7.841  11.646  27.133
  537    HD2  PRO 113          1HD       PRO 113   8.834  10.585  29.440
  538    HD3  PRO 113          2HD       PRO 113   7.062  10.872  29.218
  539    H    GLN 114           H        GLN 114   7.649   6.614  25.637
  540    HA   GLN 114           HA       GLN 114  10.574   6.198  25.887
  541    HB2  GLN 114          1HB       GLN 114   9.620   4.512  27.377
  542    HB3  GLN 114          2HB       GLN 114   8.488   3.997  26.134
  543    HG2  GLN 114          1HG       GLN 114  10.233   2.394  26.233
  544    HG3  GLN 114          2HG       GLN 114  10.457   3.324  24.724
  545   HE21  GLN 114          1HE2      GLN 114  13.759   4.023  25.463
  546   HE22  GLN 114          2HE2      GLN 114  12.526   3.664  24.301
  547    H    LEU 115           H        LEU 115  11.502   6.201  23.975
  548    HA   LEU 115           HA       LEU 115   9.967   5.890  21.528
  549    HB2  LEU 115          1HB       LEU 115  12.961   5.996  22.038
  550    HB3  LEU 115          2HB       LEU 115  12.215   5.995  20.436
  551    HG   LEU 115           HG       LEU 115  11.794   8.153  22.537
  552   HD11  LEU 115          1HD1      LEU 115  13.263   9.508  21.111
  553   HD12  LEU 115          2HD1      LEU 115  14.110   8.084  21.761
  554   HD13  LEU 115          3HD1      LEU 115  13.555   8.096  20.068
  555   HD21  LEU 115          1HD2      LEU 115  10.800   9.380  20.636
  556   HD22  LEU 115          2HD2      LEU 115  11.059   7.968  19.586
  557   HD23  LEU 115          3HD2      LEU 115   9.920   7.867  20.950
  558    H    VAL 116           H        VAL 116   9.626   4.143  20.320
  559    HA   VAL 116           HA       VAL 116  11.253   1.708  20.913
  560    HB   VAL 116           HB       VAL 116   8.270   1.815  20.292
  561   HG11  VAL 116          1HG1      VAL 116   8.318  -0.611  20.620
  562   HG12  VAL 116          2HG1      VAL 116   9.331  -0.104  19.248
  563   HG13  VAL 116          3HG1      VAL 116  10.088  -0.550  20.796
  564   HG21  VAL 116          1HG2      VAL 116   8.028   0.890  22.575
  565   HG22  VAL 116          2HG2      VAL 116   9.790   1.004  22.805
  566   HG23  VAL 116          3HG2      VAL 116   8.821   2.482  22.606
  567    H    ALA 117           H        ALA 117  12.327   0.990  19.215
  568    HA   ALA 117           HA       ALA 117  11.402   1.774  16.508
  569    HB1  ALA 117          1HB       ALA 117  13.620   0.974  15.761
  570    HB2  ALA 117          2HB       ALA 117  13.759   2.205  17.039
  571    HB3  ALA 117          3HB       ALA 117  13.998   0.486  17.428
  572    H    GLU 118           H        GLU 118  10.690   0.391  15.005
  573    HA   GLU 118           HA       GLU 118  10.634  -2.501  15.744
  574    HB2  GLU 118          1HB       GLU 118   8.338  -0.894  14.550
  575    HB3  GLU 118          2HB       GLU 118   8.333  -2.631  14.823
  576    HG2  GLU 118          1HG       GLU 118   8.578  -2.234  17.253
  577    HG3  GLU 118          2HG       GLU 118   8.530  -0.497  16.959
  578    HA   PRO 119           HA       PRO 119  12.210  -3.431  11.807
  579    HB2  PRO 119          1HB       PRO 119   9.973  -5.493  11.715
  580    HB3  PRO 119          2HB       PRO 119  11.693  -5.704  11.360
  581    HG2  PRO 119          1HG       PRO 119  10.789  -6.544  13.713
  582    HG3  PRO 119          2HG       PRO 119  12.316  -5.662  13.661
  583    HD2  PRO 119          1HD       PRO 119   9.545  -4.658  14.424
  584    HD3  PRO 119          2HD       PRO 119  11.139  -4.315  15.210
  Start of MODEL    6
    1    H    GLN  38          1H        GLN  38   9.000  -5.020   3.563
    2    HA   GLN  38           HA       GLN  38   9.274  -2.709   3.981
    3    HB2  GLN  38          1HB       GLN  38  10.565  -3.809   2.168
    4    HB3  GLN  38          2HB       GLN  38   9.273  -3.463   1.028
    5    HG2  GLN  38          1HG       GLN  38   9.626  -1.067   1.303
    6    HG3  GLN  38          2HG       GLN  38  10.904  -1.389   2.509
    7   HE21  GLN  38          1HE2      GLN  38  13.001  -0.863  -0.302
    8   HE22  GLN  38          2HE2      GLN  38  12.253  -0.094   1.057
    9    H    ALA  39           H        ALA  39   8.263  -0.864   4.250
   10    HA   ALA  39           HA       ALA  39   5.612  -0.506   3.078
   11    HB1  ALA  39          1HB       ALA  39   5.552   1.551   4.450
   12    HB2  ALA  39          2HB       ALA  39   6.027   0.132   5.412
   13    HB3  ALA  39          3HB       ALA  39   7.259   1.301   4.885
   14    HA   PRO  40           HA       PRO  40   6.512   1.896  -0.405
   15    HB2  PRO  40          1HB       PRO  40   4.376   3.797   0.620
   16    HB3  PRO  40          2HB       PRO  40   4.535   3.063  -0.979
   17    HG2  PRO  40          1HG       PRO  40   2.740   2.043   0.696
   18    HG3  PRO  40          2HG       PRO  40   3.750   0.939  -0.245
   19    HD2  PRO  40          1HD       PRO  40   4.054   1.814   2.659
   20    HD3  PRO  40          2HD       PRO  40   4.222   0.161   1.944
   21    H    LYS  41           H        LYS  41   8.004   3.439  -0.831
   22    HA   LYS  41           HA       LYS  41   8.954   5.148   1.345
   23    HB2  LYS  41          1HB       LYS  41   9.831   4.826  -1.550
   24    HB3  LYS  41          2HB       LYS  41  10.606   5.921  -0.413
   25    HG2  LYS  41          1HG       LYS  41  11.147   3.978   1.048
   26    HG3  LYS  41          2HG       LYS  41  10.440   2.904  -0.167
   27    HD2  LYS  41          1HD       LYS  41  12.075   3.682  -1.834
   28    HD3  LYS  41          2HD       LYS  41  12.761   4.809  -0.655
   29    HE2  LYS  41          1HE       LYS  41  13.384   2.905   0.798
   30    HE3  LYS  41          2HE       LYS  41  12.698   1.779  -0.375
   31    HZ1  LYS  41          1HZ       LYS  41  15.063   1.984  -0.624
   32    HZ2  LYS  41          2HZ       LYS  41  14.311   2.559  -1.975
   33    HZ3  LYS  41          3HZ       LYS  41  14.952   3.608  -0.878
   34    H    GLY  42           H        GLY  42   9.416   7.469   0.962
   35    HA2  GLY  42          1HA       GLY  42   8.684   9.521  -0.223
   36    HA3  GLY  42          2HA       GLY  42   7.133   8.750  -0.497
   37    H    SER  43           H        SER  43   7.359   7.561   2.329
   38    HA   SER  43           HA       SER  43   7.286   9.929   4.061
   39    HB2  SER  43          1HB       SER  43   5.022   9.977   3.193
   40    HB3  SER  43          2HB       SER  43   4.808   8.265   3.518
   41    HG   SER  43           HG       SER  43   5.198   8.769   5.728
   42    H    ALA  44           H        ALA  44   7.745   9.474   6.143
   43    HA   ALA  44           HA       ALA  44   8.411   6.686   6.782
   44    HB1  ALA  44          1HB       ALA  44   9.308   7.639   8.881
   45    HB2  ALA  44          2HB       ALA  44   9.953   8.476   7.450
   46    HB3  ALA  44          3HB       ALA  44   8.671   9.233   8.420
   47    H    PHE  45           H        PHE  45   7.659   5.570   8.642
   48    HA   PHE  45           HA       PHE  45   4.813   6.288   9.216
   49    HB2  PHE  45          1HB       PHE  45   6.101   3.540   8.973
   50    HB3  PHE  45          2HB       PHE  45   4.439   3.827   9.458
   51    HD1  PHE  45           HD1      PHE  45   6.838   4.115   6.663
   52    HD2  PHE  45           HD2      PHE  45   2.743   4.306   7.863
   53    HE1  PHE  45           HE1      PHE  45   6.145   4.098   4.292
   54    HE2  PHE  45           HE2      PHE  45   2.045   4.287   5.492
   55    HZ   PHE  45           HZ       PHE  45   3.747   4.185   3.706
   56    H    VAL  46           H        VAL  46   4.050   6.198  11.263
   57    HA   VAL  46           HA       VAL  46   5.889   5.243  13.393
   58    HB   VAL  46           HB       VAL  46   6.295   7.684  13.122
   59   HG11  VAL  46          1HG1      VAL  46   4.520   9.289  13.641
   60   HG12  VAL  46          2HG1      VAL  46   4.143   8.320  12.196
   61   HG13  VAL  46          3HG1      VAL  46   3.348   7.955  13.746
   62   HG21  VAL  46          1HG2      VAL  46   5.868   8.306  15.478
   63   HG22  VAL  46          2HG2      VAL  46   4.741   6.939  15.635
   64   HG23  VAL  46          3HG2      VAL  46   6.473   6.637  15.353
   65    H    ARG  47           H        ARG  47   4.899   4.381  15.147
   66    HA   ARG  47           HA       ARG  47   1.913   4.375  15.086
   67    HB2  ARG  47          1HB       ARG  47   2.904   2.155  14.761
   68    HB3  ARG  47          2HB       ARG  47   3.850   2.333  16.232
   69    HG2  ARG  47          1HG       ARG  47   1.904   2.216  17.608
   70    HG3  ARG  47          2HG       ARG  47   0.825   2.356  16.198
   71    HD2  ARG  47          1HD       ARG  47   2.763   0.101  16.642
   72    HD3  ARG  47          2HD       ARG  47   1.044   0.068  17.099
   73    HE   ARG  47           HE       ARG  47   1.065   0.784  14.432
   74   HH11  ARG  47          1HH1      ARG  47   2.266  -1.921  16.326
   75   HH12  ARG  47          2HH1      ARG  47   2.091  -3.073  15.023
   76   HH21  ARG  47          1HH2      ARG  47   0.840  -0.722  12.748
   77   HH22  ARG  47          2HH2      ARG  47   1.283  -2.397  12.996
   78    H    ALA  48           H        ALA  48   1.071   5.724  16.511
   79    HA   ALA  48           HA       ALA  48   2.553   6.370  18.971
   80    HB1  ALA  48          1HB       ALA  48   0.765   8.042  19.323
   81    HB2  ALA  48          2HB       ALA  48   1.506   8.198  17.712
   82    HB3  ALA  48          3HB       ALA  48  -0.085   7.422  17.889
   83    H    TYR  49           H        TYR  49   2.258   5.429  20.847
   84    HA   TYR  49           HA       TYR  49  -0.231   3.818  21.215
   85    HB2  TYR  49          1HB       TYR  49   1.786   2.435  21.211
   86    HB3  TYR  49          2HB       TYR  49   2.543   3.467  22.417
   87    HD1  TYR  49           HD1      TYR  49  -0.102   0.963  21.817
   88    HD2  TYR  49           HD2      TYR  49   2.004   3.290  24.744
   89    HE1  TYR  49           HE1      TYR  49  -1.047  -0.444  23.613
   90    HE2  TYR  49           HE2      TYR  49   1.057   1.880  26.543
   91    HH   TYR  49           HH       TYR  49  -1.167  -0.796  25.805
   92    H    ASN  50           H        ASN  50  -1.532   4.145  22.902
   93    HA   ASN  50           HA       ASN  50  -0.866   6.496  24.602
   94    HB2  ASN  50          1HB       ASN  50  -2.958   6.561  23.244
   95    HB3  ASN  50          2HB       ASN  50  -3.545   5.153  24.118
   96   HD21  ASN  50          1HD2      ASN  50  -4.898   8.277  25.634
   97   HD22  ASN  50          2HD2      ASN  50  -4.879   7.605  24.037
   98    H    ALA  51           H        ALA  51   0.157   5.939  26.381
   99    HA   ALA  51           HA       ALA  51  -0.545   3.390  27.697
  100    HB1  ALA  51          1HB       ALA  51   1.453   3.829  29.091
  101    HB2  ALA  51          2HB       ALA  51   1.834   3.893  27.351
  102    HB3  ALA  51          3HB       ALA  51   1.659   5.400  28.281
  103    H    GLY  52           H        GLY  52  -1.866   6.320  27.732
  104    HA2  GLY  52          1HA       GLY  52  -2.069   6.605  30.684
  105    HA3  GLY  52          2HA       GLY  52  -2.580   7.787  29.495
  106    H    ASN  53           H        ASN  53  -4.491   7.671  31.063
  107    HA   ASN  53           HA       ASN  53  -6.333   5.450  30.323
  108    HB2  ASN  53          1HB       ASN  53  -6.406   7.457  32.597
  109    HB3  ASN  53          2HB       ASN  53  -7.715   6.337  32.238
  110   HD21  ASN  53          1HD2      ASN  53  -5.087   5.093  34.755
  111   HD22  ASN  53          2HD2      ASN  53  -5.714   6.688  34.507
  112    H    SER  54           H        SER  54  -5.530   8.389  29.196
  113    HA   SER  54           HA       SER  54  -8.173   8.641  27.910
  114    HB2  SER  54          1HB       SER  54  -8.417  10.990  28.393
  115    HB3  SER  54          2HB       SER  54  -8.263  10.121  29.914
  116    HG   SER  54           HG       SER  54  -6.411  11.720  28.567
  117    H    GLU  55           H        GLU  55  -8.111  10.335  26.154
  118    HA   GLU  55           HA       GLU  55  -6.102   9.672  24.307
  119    HB2  GLU  55          1HB       GLU  55  -8.311  10.683  23.733
  120    HB3  GLU  55          2HB       GLU  55  -7.766  12.221  24.390
  121    HG2  GLU  55          1HG       GLU  55  -5.977  12.310  22.696
  122    HG3  GLU  55          2HG       GLU  55  -6.535  10.775  22.034
  123    H    LEU  56           H        LEU  56  -4.040  10.139  24.156
  124    HA   LEU  56           HA       LEU  56  -3.044  12.569  25.573
  125    HB2  LEU  56          1HB       LEU  56  -1.550  10.083  24.666
  126    HB3  LEU  56          2HB       LEU  56  -0.836  11.460  25.513
  127    HG   LEU  56           HG       LEU  56  -2.928   9.568  26.642
  128   HD11  LEU  56          1HD1      LEU  56  -1.086   8.816  28.081
  129   HD12  LEU  56          2HD1      LEU  56  -0.735   8.532  26.360
  130   HD13  LEU  56          3HD1      LEU  56   0.032   9.893  27.212
  131   HD21  LEU  56          1HD2      LEU  56  -2.498  10.778  28.754
  132   HD22  LEU  56          2HD2      LEU  56  -1.398  11.886  27.895
  133   HD23  LEU  56          3HD2      LEU  56  -3.135  11.875  27.506
  134    H    ASP  57           H        ASP  57  -1.904  14.118  24.541
  135    HA   ASP  57           HA       ASP  57  -1.656  13.818  21.584
  136    HB2  ASP  57          1HB       ASP  57  -1.748  16.300  23.344
  137    HB3  ASP  57          2HB       ASP  57  -1.432  16.332  21.613
  138    H    VAL  58           H        VAL  58   0.243  14.212  20.525
  139    HA   VAL  58           HA       VAL  58   2.613  14.916  22.170
  140    HB   VAL  58           HB       VAL  58   2.595  12.459  22.078
  141   HG11  VAL  58          1HG1      VAL  58   2.717  11.266  19.946
  142   HG12  VAL  58          2HG1      VAL  58   1.194  12.167  20.117
  143   HG13  VAL  58          3HG1      VAL  58   2.487  12.802  19.074
  144   HG21  VAL  58          1HG2      VAL  58   4.794  12.124  21.000
  145   HG22  VAL  58          2HG2      VAL  58   4.624  13.687  20.167
  146   HG23  VAL  58          3HG2      VAL  58   4.764  13.632  21.939
  147    H    SER  59           H        SER  59   4.058  16.194  21.169
  148    HA   SER  59           HA       SER  59   3.447  16.925  18.347
  149    HB2  SER  59          1HB       SER  59   3.420  18.773  19.940
  150    HB3  SER  59          2HB       SER  59   5.031  18.356  20.506
  151    HG   SER  59           HG       SER  59   5.561  18.577  18.161
  152    H    VAL  60           H        VAL  60   4.550  15.723  16.957
  153    HA   VAL  60           HA       VAL  60   7.346  14.966  17.649
  154    HB   VAL  60           HB       VAL  60   5.513  13.877  15.469
  155   HG11  VAL  60          1HG1      VAL  60   7.162  12.080  15.291
  156   HG12  VAL  60          2HG1      VAL  60   7.864  13.667  14.903
  157   HG13  VAL  60          3HG1      VAL  60   8.196  12.911  16.479
  158   HG21  VAL  60          1HG2      VAL  60   5.324  11.902  16.947
  159   HG22  VAL  60          2HG2      VAL  60   6.295  12.735  18.183
  160   HG23  VAL  60          3HG2      VAL  60   4.691  13.363  17.743
  161    H    GLY  61           H        GLY  61   8.544  16.736  17.081
  162    HA2  GLY  61          1HA       GLY  61   9.684  18.171  15.650
  163    HA3  GLY  61          2HA       GLY  61   9.107  17.211  14.301
  164    H    SER  62           H        SER  62   7.639  18.089  12.966
  165    HA   SER  62           HA       SER  62   6.397  20.660  13.813
  166    HB2  SER  62          1HB       SER  62   6.150  21.129  11.441
  167    HB3  SER  62          2HB       SER  62   7.820  20.714  11.796
  168    HG   SER  62           HG       SER  62   5.968  18.773  11.012
  169    H    THR  63           H        THR  63   5.667  17.421  13.545
  170    HA   THR  63           HA       THR  63   2.808  18.015  12.906
  171    HB   THR  63           HB       THR  63   4.384  15.479  12.282
  172    HG1  THR  63           HG1      THR  63   3.373  16.419  10.110
  173   HG21  THR  63          1HG2      THR  63   2.311  14.738  11.177
  174   HG22  THR  63          2HG2      THR  63   2.045  15.007  12.916
  175   HG23  THR  63          3HG2      THR  63   1.483  16.211  11.731
  176    H    SER  64           H        SER  64   1.534  17.832  14.585
  177    HA   SER  64           HA       SER  64   2.327  16.127  16.859
  178    HB2  SER  64          1HB       SER  64   0.460  17.139  18.016
  179    HB3  SER  64          2HB       SER  64   1.402  18.398  17.235
  180    HG   SER  64           HG       SER  64  -0.955  17.202  16.267
  181    H    LEU  65           H        LEU  65   0.953  14.531  17.772
  182    HA   LEU  65           HA       LEU  65  -0.894  13.300  15.770
  183    HB2  LEU  65          1HB       LEU  65   0.771  11.837  17.846
  184    HB3  LEU  65          2HB       LEU  65  -0.233  11.114  16.585
  185    HG   LEU  65           HG       LEU  65   2.302  12.724  16.113
  186   HD11  LEU  65          1HD1      LEU  65   3.254  10.557  15.474
  187   HD12  LEU  65          2HD1      LEU  65   2.726  10.566  17.173
  188   HD13  LEU  65          3HD1      LEU  65   1.737   9.752  15.938
  189   HD21  LEU  65          1HD2      LEU  65   2.028  11.950  13.784
  190   HD22  LEU  65          2HD2      LEU  65   0.493  11.164  14.223
  191   HD23  LEU  65          3HD2      LEU  65   0.640  12.936  14.294
  192    H    ASN  66           H        ASN  66  -2.752  12.265  16.524
  193    HA   ASN  66           HA       ASN  66  -3.437  12.357  19.357
  194    HB2  ASN  66          1HB       ASN  66  -5.340  13.892  19.115
  195    HB3  ASN  66          2HB       ASN  66  -3.816  14.703  18.794
  196   HD21  ASN  66          1HD2      ASN  66  -5.378  16.026  15.977
  197   HD22  ASN  66          2HD2      ASN  66  -4.722  16.310  17.555
  198    H    ASP  67           H        ASP  67  -6.049  12.071  19.420
  199    HA   ASP  67           HA       ASP  67  -7.785  10.620  19.008
  200    HB2  ASP  67          1HB       ASP  67  -7.522  11.721  16.676
  201    HB3  ASP  67          2HB       ASP  67  -6.704  10.241  16.198
  202    H    VAL  68           H        VAL  68  -5.564   9.557  20.259
  203    HA   VAL  68           HA       VAL  68  -5.619   6.769  19.181
  204    HB   VAL  68           HB       VAL  68  -3.519   8.070  20.967
  205   HG11  VAL  68          1HG1      VAL  68  -2.260   5.998  20.638
  206   HG12  VAL  68          2HG1      VAL  68  -3.808   5.713  21.468
  207   HG13  VAL  68          3HG1      VAL  68  -3.634   5.307  19.743
  208   HG21  VAL  68          1HG2      VAL  68  -2.053   7.838  18.986
  209   HG22  VAL  68          2HG2      VAL  68  -3.427   7.209  18.046
  210   HG23  VAL  68          3HG2      VAL  68  -3.447   8.887  18.636
  211    H    ALA  69           H        ALA  69  -6.726   5.347  20.325
  212    HA   ALA  69           HA       ALA  69  -8.043   6.186  22.751
  213    HB1  ALA  69          1HB       ALA  69  -9.013   3.910  22.732
  214    HB2  ALA  69          2HB       ALA  69  -9.136   4.690  21.140
  215    HB3  ALA  69          3HB       ALA  69  -7.893   3.452  21.427
  216    HA   PRO  70           HA       PRO  70  -5.278   5.042  25.901
  217    HB2  PRO  70          1HB       PRO  70  -7.765   3.846  27.183
  218    HB3  PRO  70          2HB       PRO  70  -6.553   4.912  27.900
  219    HG2  PRO  70          1HG       PRO  70  -8.871   5.977  27.159
  220    HG3  PRO  70          2HG       PRO  70  -7.382   6.844  26.777
  221    HD2  PRO  70          1HD       PRO  70  -9.099   5.092  24.973
  222    HD3  PRO  70          2HD       PRO  70  -8.307   6.676  24.605
  223    H    LEU  71           H        LEU  71  -3.969   3.311  26.085
  224    HA   LEU  71           HA       LEU  71  -3.201   1.141  26.053
  225    HB2  LEU  71          1HB       LEU  71  -6.118   0.337  26.308
  226    HB3  LEU  71          2HB       LEU  71  -4.711  -0.678  26.641
  227    HG   LEU  71           HG       LEU  71  -5.560   1.773  28.223
  228   HD11  LEU  71          1HD1      LEU  71  -6.047   0.131  29.981
  229   HD12  LEU  71          2HD1      LEU  71  -7.031  -0.152  28.527
  230   HD13  LEU  71          3HD1      LEU  71  -5.625  -1.188  28.866
  231   HD21  LEU  71          1HD2      LEU  71  -3.739   1.096  29.753
  232   HD22  LEU  71          2HD2      LEU  71  -3.285  -0.210  28.634
  233   HD23  LEU  71          3HD2      LEU  71  -3.105   1.489  28.137
  234    H    GLY  72           H        GLY  72  -4.440   2.614  23.631
  235    HA2  GLY  72          1HA       GLY  72  -4.218   0.217  21.843
  236    HA3  GLY  72          2HA       GLY  72  -5.343   1.520  21.504
  237    H    SER  73           H        SER  73  -4.091   1.518  19.437
  238    HA   SER  73           HA       SER  73  -2.046   3.614  19.551
  239    HB2  SER  73          1HB       SER  73  -0.307   2.372  18.444
  240    HB3  SER  73          2HB       SER  73  -0.758   1.504  19.901
  241    HG   SER  73           HG       SER  73  -1.678   0.994  17.289
  242    H    SER  74           H        SER  74  -1.367   4.311  17.367
  243    HA   SER  74           HA       SER  74  -3.083   3.400  15.151
  244    HB2  SER  74          1HB       SER  74  -4.430   5.155  16.212
  245    HB3  SER  74          2HB       SER  74  -3.074   6.270  16.139
  246    HG   SER  74           HG       SER  74  -3.166   6.258  13.965
  247    H    ASP  75           H        ASP  75  -2.233   3.756  13.142
  248    HA   ASP  75           HA       ASP  75   0.621   4.539  13.161
  249    HB2  ASP  75          1HB       ASP  75  -1.110   3.160  11.071
  250    HB3  ASP  75          2HB       ASP  75   0.578   3.586  10.816
  251    H    PHE  76           H        PHE  76   1.486   6.202  12.048
  252    HA   PHE  76           HA       PHE  76  -0.409   7.928  10.520
  253    HB2  PHE  76          1HB       PHE  76   1.680   8.864  12.529
  254    HB3  PHE  76          2HB       PHE  76   0.728   9.918  11.496
  255    HD1  PHE  76           HD1      PHE  76   0.716   7.784  14.457
  256    HD2  PHE  76           HD2      PHE  76  -1.666  10.232  11.892
  257    HE1  PHE  76           HE1      PHE  76  -1.063   7.850  16.173
  258    HE2  PHE  76           HE2      PHE  76  -3.444  10.302  13.606
  259    HZ   PHE  76           HZ       PHE  76  -3.143   9.109  15.747
  260    H    LYS  77           H        LYS  77   0.663   9.471   9.076
  261    HA   LYS  77           HA       LYS  77   3.433   8.932   8.327
  262    HB2  LYS  77          1HB       LYS  77   2.960   8.131   6.064
  263    HB3  LYS  77          2HB       LYS  77   2.291   7.021   7.253
  264    HG2  LYS  77          1HG       LYS  77   0.046   8.083   6.911
  265    HG3  LYS  77          2HG       LYS  77   0.758   9.063   5.620
  266    HD2  LYS  77          1HD       LYS  77   1.416   6.991   4.421
  267    HD3  LYS  77          2HD       LYS  77   0.673   6.023   5.705
  268    HE2  LYS  77          1HE       LYS  77  -1.515   7.114   5.222
  269    HE3  LYS  77          2HE       LYS  77  -0.761   8.004   3.898
  270    HZ1  LYS  77          1HZ       LYS  77  -1.871   6.040   3.120
  271    HZ2  LYS  77          2HZ       LYS  77  -0.249   5.904   2.855
  272    HZ3  LYS  77          3HZ       LYS  77  -0.955   5.072   4.092
  273    H    PHE  78           H        PHE  78   3.001   9.797   5.567
  274    HA   PHE  78           HA       PHE  78   3.074  11.793   4.419
  275    HB2  PHE  78          1HB       PHE  78   1.318  12.914   6.638
  276    HB3  PHE  78          2HB       PHE  78   1.572  13.616   5.047
  277    HD1  PHE  78           HD1      PHE  78  -0.621  11.738   6.974
  278    HD2  PHE  78           HD2      PHE  78   1.037  11.902   3.041
  279    HE1  PHE  78           HE1      PHE  78  -2.556  10.467   6.107
  280    HE2  PHE  78           HE2      PHE  78  -0.896  10.633   2.170
  281    HZ   PHE  78           HZ       PHE  78  -2.693   9.913   3.705
  282    H    LEU  79           H        LEU  79   5.064  11.092   6.380
  283    HA   LEU  79           HA       LEU  79   6.026  13.825   7.066
  284    HB2  LEU  79          1HB       LEU  79   5.069  12.845   9.106
  285    HB3  LEU  79          2HB       LEU  79   6.066  11.402   8.900
  286    HG   LEU  79           HG       LEU  79   8.104  12.863   9.181
  287   HD11  LEU  79          1HD1      LEU  79   7.772  15.092  10.155
  288   HD12  LEU  79          2HD1      LEU  79   7.082  14.979   8.518
  289   HD13  LEU  79          3HD1      LEU  79   6.013  14.923   9.940
  290   HD21  LEU  79          1HD2      LEU  79   7.813  13.058  11.629
  291   HD22  LEU  79          2HD2      LEU  79   6.055  12.861  11.434
  292   HD23  LEU  79          3HD2      LEU  79   7.150  11.520  11.026
  293    HA   PRO  80           HA       PRO  80   9.413  12.288   4.675
  294    HB2  PRO  80          1HB       PRO  80  10.651  14.696   6.078
  295    HB3  PRO  80          2HB       PRO  80  10.799  14.205   4.387
  296    HG2  PRO  80          1HG       PRO  80   9.113  16.170   4.970
  297    HG3  PRO  80          2HG       PRO  80   8.589  14.918   3.840
  298    HD2  PRO  80          1HD       PRO  80   7.916  15.247   6.786
  299    HD3  PRO  80          2HD       PRO  80   6.842  14.744   5.419
  300    HA   PRO  81           HA       PRO  81  11.312   9.868   7.839
  301    HB2  PRO  81          1HB       PRO  81  13.507   9.690   5.740
  302    HB3  PRO  81          2HB       PRO  81  12.754   8.389   6.670
  303    HG2  PRO  81          1HG       PRO  81  11.995   8.732   4.143
  304    HG3  PRO  81          2HG       PRO  81  10.761   8.418   5.367
  305    HD2  PRO  81          1HD       PRO  81  11.583  11.065   4.105
  306    HD3  PRO  81          2HD       PRO  81   9.924  10.445   4.482
  307    H    GLY  82           H        GLY  82  12.991  10.071   9.354
  308    HA2  GLY  82          1HA       GLY  82  15.352  11.356   9.436
  309    HA3  GLY  82          2HA       GLY  82  14.279  12.738   9.356
  310    H    SER  83           H        SER  83  15.481  13.044  11.499
  311    HA   SER  83           HA       SER  83  14.158  11.516  13.690
  312    HB2  SER  83          1HB       SER  83  16.580  11.506  13.797
  313    HB3  SER  83          2HB       SER  83  16.644  13.254  13.639
  314    HG   SER  83           HG       SER  83  15.090  12.958  15.594
  315    H    TYR  84           H        TYR  84  12.595  12.400  14.827
  316    HA   TYR  84           HA       TYR  84  12.440  15.382  14.926
  317    HB2  TYR  84          1HB       TYR  84  10.094  13.458  14.633
  318    HB3  TYR  84          2HB       TYR  84   9.976  15.204  14.813
  319    HD1  TYR  84           HD1      TYR  84  10.735  12.445  12.546
  320    HD2  TYR  84           HD2      TYR  84  10.655  16.711  12.999
  321    HE1  TYR  84           HE1      TYR  84  10.876  12.708  10.092
  322    HE2  TYR  84           HE2      TYR  84  10.797  16.974  10.545
  323    HH   TYR  84           HH       TYR  84  10.746  14.165   8.387
  324    H    THR  85           H        THR  85  11.886  16.311  16.819
  325    HA   THR  85           HA       THR  85  12.169  14.617  19.184
  326    HB   THR  85           HB       THR  85  11.681  17.617  18.944
  327    HG1  THR  85           HG1      THR  85  13.954  17.661  19.419
  328   HG21  THR  85          1HG2      THR  85  12.452  17.688  21.282
  329   HG22  THR  85          2HG2      THR  85  10.979  16.700  21.129
  330   HG23  THR  85          3HG2      THR  85  12.566  15.912  21.303
  331    H    ALA  86           H        ALA  86  10.573  13.581  20.111
  332    HA   ALA  86           HA       ALA  86   7.803  14.497  19.648
  333    HB1  ALA  86          1HB       ALA  86   7.166  12.332  20.658
  334    HB2  ALA  86          2HB       ALA  86   8.298  12.119  19.303
  335    HB3  ALA  86          3HB       ALA  86   8.881  11.987  20.978
  336    H    GLN  87           H        GLN  87   7.093  16.027  20.946
  337    HA   GLN  87           HA       GLN  87   8.041  16.183  23.724
  338    HB2  GLN  87          1HB       GLN  87   7.742  18.243  22.370
  339    HB3  GLN  87          2HB       GLN  87   6.028  17.895  22.210
  340    HG2  GLN  87          1HG       GLN  87   6.271  19.542  23.895
  341    HG3  GLN  87          2HG       GLN  87   5.846  18.012  24.714
  342   HE21  GLN  87          1HE2      GLN  87   8.443  18.553  26.954
  343   HE22  GLN  87          2HE2      GLN  87   6.757  18.273  26.681
  344    H    VAL  88           H        VAL  88   7.195  14.960  25.235
  345    HA   VAL  88           HA       VAL  88   4.241  14.511  25.163
  346    HB   VAL  88           HB       VAL  88   6.394  12.622  26.205
  347   HG11  VAL  88          1HG1      VAL  88   4.556  11.049  26.565
  348   HG12  VAL  88          2HG1      VAL  88   4.379  12.519  27.553
  349   HG13  VAL  88          3HG1      VAL  88   3.389  12.305  26.088
  350   HG21  VAL  88          1HG2      VAL  88   5.657  11.168  24.344
  351   HG22  VAL  88          2HG2      VAL  88   4.530  12.434  23.802
  352   HG23  VAL  88          3HG2      VAL  88   6.286  12.718  23.740
  353    H    GLY  89           H        GLY  89   3.453  15.920  26.604
  354    HA2  GLY  89          1HA       GLY  89   3.047  16.927  28.656
  355    HA3  GLY  89          2HA       GLY  89   3.947  15.623  29.409
  356    H    GLN  90           H        GLN  90   5.653  16.277  30.542
  357    HA   GLN  90           HA       GLN  90   6.985  18.825  29.787
  358    HB2  GLN  90          1HB       GLN  90   7.217  17.128  32.307
  359    HB3  GLN  90          2HB       GLN  90   8.057  18.648  32.031
  360    HG2  GLN  90          1HG       GLN  90   5.056  18.294  32.159
  361    HG3  GLN  90          2HG       GLN  90   6.103  18.947  33.449
  362   HE21  GLN  90          1HE2      GLN  90   4.481  21.465  30.901
  363   HE22  GLN  90          2HE2      GLN  90   3.884  19.900  31.347
  364    H    GLN  91           H        GLN  91   7.275  15.654  29.038
  365    HA   GLN  91           HA       GLN  91  10.258  15.731  29.061
  366    HB2  GLN  91          1HB       GLN  91   8.389  13.341  28.790
  367    HB3  GLN  91          2HB       GLN  91  10.145  13.268  28.790
  368    HG2  GLN  91          1HG       GLN  91   8.467  14.281  31.095
  369    HG3  GLN  91          2HG       GLN  91   9.143  12.631  30.946
  370   HE21  GLN  91          1HE2      GLN  91  11.292  15.410  32.738
  371   HE22  GLN  91          2HE2      GLN  91   9.570  15.388  32.563
  372    H    SER  92           H        SER  92  11.293  14.551  27.211
  373    HA   SER  92           HA       SER  92   9.731  14.599  24.708
  374    HB2  SER  92          1HB       SER  92  11.271  16.058  23.545
  375    HB3  SER  92          2HB       SER  92  10.628  16.899  24.946
  376    HG   SER  92           HG       SER  92  12.744  17.229  24.993
  377    H    LEU  93           H        LEU  93  10.741  13.506  22.961
  378    HA   LEU  93           HA       LEU  93  13.248  12.069  23.508
  379    HB2  LEU  93          1HB       LEU  93  11.567  10.643  24.595
  380    HB3  LEU  93          2HB       LEU  93  10.610  10.610  23.112
  381    HG   LEU  93           HG       LEU  93  12.526   9.436  21.979
  382   HD11  LEU  93          1HD1      LEU  93  14.263   8.451  23.405
  383   HD12  LEU  93          2HD1      LEU  93  14.311  10.229  23.444
  384   HD13  LEU  93          3HD1      LEU  93  13.609   9.328  24.809
  385   HD21  LEU  93          1HD2      LEU  93  12.070   7.273  23.085
  386   HD22  LEU  93          2HD2      LEU  93  11.385   8.135  24.485
  387   HD23  LEU  93          3HD2      LEU  93  10.577   8.225  22.901
  388    HA   PRO  94           HA       PRO  94  13.356  12.996  19.144
  389    HB2  PRO  94          1HB       PRO  94  15.915  11.413  19.527
  390    HB3  PRO  94          2HB       PRO  94  15.670  12.949  18.683
  391    HG2  PRO  94          1HG       PRO  94  16.784  13.002  21.100
  392    HG3  PRO  94          2HG       PRO  94  15.552  14.204  20.703
  393    HD2  PRO  94          1HD       PRO  94  15.263  11.616  22.291
  394    HD3  PRO  94          2HD       PRO  94  14.612  13.262  22.670
  395    H    VAL  95           H        VAL  95  12.492  11.772  17.567
  396    HA   VAL  95           HA       VAL  95  12.756   8.800  17.789
  397    HB   VAL  95           HB       VAL  95  10.345  10.406  16.836
  398   HG11  VAL  95          1HG1      VAL  95   9.234   8.236  16.603
  399   HG12  VAL  95          2HG1      VAL  95  10.635   8.388  15.516
  400   HG13  VAL  95          3HG1      VAL  95  10.762   7.413  16.998
  401   HG21  VAL  95          1HG2      VAL  95   9.231   9.389  18.799
  402   HG22  VAL  95          2HG2      VAL  95  10.762   8.610  19.260
  403   HG23  VAL  95          3HG2      VAL  95  10.624  10.382  19.289
  404    H    LYS  96           H        LYS  96  13.959   8.041  16.191
  405    HA   LYS  96           HA       LYS  96  14.010   9.390  13.575
  406    HB2  LYS  96          1HB       LYS  96  16.091   8.426  14.525
  407    HB3  LYS  96          2HB       LYS  96  15.356   6.829  14.527
  408    HG2  LYS  96          1HG       LYS  96  15.226   6.835  12.091
  409    HG3  LYS  96          2HG       LYS  96  15.856   8.489  12.041
  410    HD2  LYS  96          1HD       LYS  96  17.945   7.692  13.160
  411    HD3  LYS  96          2HD       LYS  96  17.315   6.039  13.095
  412    HE2  LYS  96          1HE       LYS  96  17.658   7.776  10.629
  413    HE3  LYS  96          2HE       LYS  96  18.915   6.692  11.229
  414    HZ1  LYS  96          1HZ       LYS  96  17.589   5.654   9.538
  415    HZ2  LYS  96          2HZ       LYS  96  17.383   4.862  10.972
  416    HZ3  LYS  96          3HZ       LYS  96  16.208   5.874  10.409
  417    H    LEU  97           H        LEU  97  12.746   8.958  11.930
  418    HA   LEU  97           HA       LEU  97  11.215   6.392  12.000
  419    HB2  LEU  97          1HB       LEU  97  10.344   9.092  10.915
  420    HB3  LEU  97          2HB       LEU  97   9.402   7.602  10.828
  421    HG   LEU  97           HG       LEU  97  10.203   8.997  13.406
  422   HD11  LEU  97          1HD1      LEU  97   7.845   9.671  13.503
  423   HD12  LEU  97          2HD1      LEU  97   8.666  10.352  12.079
  424   HD13  LEU  97          3HD1      LEU  97   7.574   8.957  11.897
  425   HD21  LEU  97          1HD2      LEU  97   8.561   7.440  14.403
  426   HD22  LEU  97          2HD2      LEU  97   8.299   6.692  12.807
  427   HD23  LEU  97          3HD2      LEU  97   9.885   6.552  13.609
  428    H    ASP  98           H        ASP  98  11.048   5.194  10.172
  429    HA   ASP  98           HA       ASP  98  12.735   6.134   7.891
  430    HB2  ASP  98          1HB       ASP  98  12.259   3.298   8.893
  431    HB3  ASP  98          2HB       ASP  98  13.180   3.714   7.457
  432    HA   PRO  99           HA       PRO  99   9.277   5.631   5.343
  433    HB2  PRO  99          1HB       PRO  99  10.402   5.302   2.882
  434    HB3  PRO  99          2HB       PRO  99  10.580   6.814   3.782
  435    HG2  PRO  99          1HG       PRO  99  12.524   4.473   3.575
  436    HG3  PRO  99          2HG       PRO  99  12.861   6.195   3.373
  437    HD2  PRO  99          1HD       PRO  99  13.312   4.898   5.744
  438    HD3  PRO  99          2HD       PRO  99  12.807   6.633   5.679
  439    H    ASP 100           H        ASP 100  11.584   3.070   5.689
  440    HA   ASP 100           HA       ASP 100  10.049   1.204   3.981
  441    HB2  ASP 100          1HB       ASP 100  12.677   0.872   5.477
  442    HB3  ASP 100          2HB       ASP 100  11.935  -0.371   4.479
  443    H    SER 101           H        SER 101  10.719   1.906   7.347
  444    HA   SER 101           HA       SER 101   8.935  -0.374   8.092
  445    HB2  SER 101          1HB       SER 101  11.356  -0.768   8.654
  446    HB3  SER 101          2HB       SER 101  11.301   0.645   9.697
  447    HG   SER 101           HG       SER 101   9.996  -1.804   9.924
  448    H    TYR 102           H        TYR 102   8.923   0.220  10.859
  449    HA   TYR 102           HA       TYR 102   8.082   3.031  11.116
  450    HB2  TYR 102          1HB       TYR 102   5.860   2.549  11.919
  451    HB3  TYR 102          2HB       TYR 102   6.037   1.790  10.343
  452    HD1  TYR 102           HD1      TYR 102   5.572   1.253  13.919
  453    HD2  TYR 102           HD2      TYR 102   6.266  -0.656  10.140
  454    HE1  TYR 102           HE1      TYR 102   4.886  -0.918  14.886
  455    HE2  TYR 102           HE2      TYR 102   5.582  -2.822  11.107
  456    HH   TYR 102           HH       TYR 102   5.415  -3.894  13.288
  457    H    TYR 103           H        TYR 103   7.721   3.695  13.314
  458    HA   TYR 103           HA       TYR 103   8.901   1.814  15.311
  459    HB2  TYR 103          1HB       TYR 103   9.433   4.803  15.055
  460    HB3  TYR 103          2HB       TYR 103   9.968   3.801  16.398
  461    HD1  TYR 103           HD1      TYR 103  10.329   4.373  12.751
  462    HD2  TYR 103           HD2      TYR 103  11.907   2.453  16.249
  463    HE1  TYR 103           HE1      TYR 103  12.391   3.809  11.511
  464    HE2  TYR 103           HE2      TYR 103  13.970   1.890  15.010
  465    HH   TYR 103           HH       TYR 103  14.378   2.819  11.600
  466    H    THR 104           H        THR 104   8.051   1.795  17.336
  467    HA   THR 104           HA       THR 104   5.396   3.130  17.522
  468    HB   THR 104           HB       THR 104   6.496   0.710  19.014
  469    HG1  THR 104           HG1      THR 104   5.059  -0.414  17.689
  470   HG21  THR 104          1HG2      THR 104   4.198   0.470  19.863
  471   HG22  THR 104          2HG2      THR 104   4.911   2.016  20.383
  472   HG23  THR 104          3HG2      THR 104   3.735   1.983  19.048
  473    H    LEU 105           H        LEU 105   5.213   4.853  18.738
  474    HA   LEU 105           HA       LEU 105   7.232   5.306  20.870
  475    HB2  LEU 105          1HB       LEU 105   6.950   7.089  19.207
  476    HB3  LEU 105          2HB       LEU 105   5.225   7.182  19.570
  477    HG   LEU 105           HG       LEU 105   5.798   7.926  21.889
  478   HD11  LEU 105          1HD1      LEU 105   8.104   8.641  22.344
  479   HD12  LEU 105          2HD1      LEU 105   8.005   6.891  22.039
  480   HD13  LEU 105          3HD1      LEU 105   8.616   7.982  20.773
  481   HD21  LEU 105          1HD2      LEU 105   6.499  10.193  21.198
  482   HD22  LEU 105          2HD2      LEU 105   6.989   9.557  19.608
  483   HD23  LEU 105          3HD2      LEU 105   5.275   9.534  20.087
  484    H    VAL 106           H        VAL 106   6.704   4.614  22.816
  485    HA   VAL 106           HA       VAL 106   3.907   4.370  23.637
  486    HB   VAL 106           HB       VAL 106   6.489   3.978  25.209
  487   HG11  VAL 106          1HG1      VAL 106   5.097   2.742  26.798
  488   HG12  VAL 106          2HG1      VAL 106   4.609   4.449  26.671
  489   HG13  VAL 106          3HG1      VAL 106   3.645   3.188  25.868
  490   HG21  VAL 106          1HG2      VAL 106   6.052   1.573  24.828
  491   HG22  VAL 106          2HG2      VAL 106   4.633   1.989  23.837
  492   HG23  VAL 106          3HG2      VAL 106   6.267   2.440  23.288
  493    H    SER 107           H        SER 107   2.914   6.299  23.890
  494    HA   SER 107           HA       SER 107   4.329   8.527  25.175
  495    HB2  SER 107          1HB       SER 107   2.913   9.025  23.278
  496    HB3  SER 107          2HB       SER 107   1.536   8.236  24.033
  497    HG   SER 107           HG       SER 107   2.012   9.814  25.800
  498    H    GLN 108           H        GLN 108   4.344   8.914  27.265
  499    HA   GLN 108           HA       GLN 108   2.391   7.539  29.002
  500    HB2  GLN 108          1HB       GLN 108   4.837   9.229  29.660
  501    HB3  GLN 108          2HB       GLN 108   3.814   8.447  30.856
  502    HG2  GLN 108          1HG       GLN 108   5.342   6.989  28.691
  503    HG3  GLN 108          2HG       GLN 108   5.890   7.209  30.374
  504   HE21  GLN 108          1HE2      GLN 108   3.976   3.931  29.631
  505   HE22  GLN 108          2HE2      GLN 108   5.085   4.809  28.631
  506    HA   PRO 109           HA       PRO 109  -0.084  11.043  29.561
  507    HB2  PRO 109          1HB       PRO 109  -1.242  10.536  31.987
  508    HB3  PRO 109          2HB       PRO 109  -1.590   9.546  30.565
  509    HG2  PRO 109          1HG       PRO 109   0.386   9.014  32.826
  510    HG3  PRO 109          2HG       PRO 109  -0.818   7.916  32.148
  511    HD2  PRO 109          1HD       PRO 109   1.793   7.840  31.351
  512    HD3  PRO 109          2HD       PRO 109   0.439   7.488  30.203
  513    H    GLY 110           H        GLY 110   2.169  12.166  29.766
  514    HA2  GLY 110          1HA       GLY 110   2.766  14.271  30.812
  515    HA3  GLY 110          2HA       GLY 110   2.139  13.676  32.338
  516    H    GLY 111           H        GLY 111   3.642  11.043  31.196
  517    HA2  GLY 111          1HA       GLY 111   6.089  11.620  32.781
  518    HA3  GLY 111          2HA       GLY 111   5.479  10.030  32.359
  519    H    LYS 112           H        LYS 112   7.810   9.743  31.778
  520    HA   LYS 112           HA       LYS 112   8.647  11.032  29.262
  521    HB2  LYS 112          1HB       LYS 112  10.276  10.652  31.117
  522    HB3  LYS 112          2HB       LYS 112  10.043   8.919  30.952
  523    HG2  LYS 112          1HG       LYS 112  10.965   8.974  28.689
  524    HG3  LYS 112          2HG       LYS 112  11.129  10.734  28.780
  525    HD2  LYS 112          1HD       LYS 112  12.693  10.495  30.678
  526    HD3  LYS 112          2HD       LYS 112  12.520   8.733  30.602
  527    HE2  LYS 112          1HE       LYS 112  13.433   8.741  28.305
  528    HE3  LYS 112          2HE       LYS 112  13.602  10.497  28.372
  529    HZ1  LYS 112          1HZ       LYS 112  15.657   9.394  28.868
  530    HZ2  LYS 112          2HZ       LYS 112  15.136  10.220  30.197
  531    HZ3  LYS 112          3HZ       LYS 112  14.981   8.581  30.132
  532    HA   PRO 113           HA       PRO 113   6.903   7.788  26.925
  533    HB2  PRO 113          1HB       PRO 113   7.716   8.616  24.439
  534    HB3  PRO 113          2HB       PRO 113   6.453   9.461  25.343
  535    HG2  PRO 113          1HG       PRO 113   9.424  10.121  25.138
  536    HG3  PRO 113          2HG       PRO 113   8.045  11.208  24.935
  537    HD2  PRO 113          1HD       PRO 113   9.388  11.052  27.300
  538    HD3  PRO 113          2HD       PRO 113   7.601  11.323  27.247
  539    H    GLN 114           H        GLN 114   7.594   6.006  25.541
  540    HA   GLN 114           HA       GLN 114  10.547   5.575  25.497
  541    HB2  GLN 114          1HB       GLN 114   9.657   4.248  27.342
  542    HB3  GLN 114          2HB       GLN 114   8.396   3.582  26.312
  543    HG2  GLN 114          1HG       GLN 114  10.085   1.929  26.592
  544    HG3  GLN 114          2HG       GLN 114  10.181   2.524  24.912
  545   HE21  GLN 114          1HE2      GLN 114  13.543   3.292  25.144
  546   HE22  GLN 114          2HE2      GLN 114  12.166   2.854  24.186
  547    H    LEU 115           H        LEU 115  11.249   5.367  23.513
  548    HA   LEU 115           HA       LEU 115   9.390   4.634  21.358
  549    HB2  LEU 115          1HB       LEU 115  11.045   6.459  21.070
  550    HB3  LEU 115          2HB       LEU 115  12.357   5.297  21.288
  551    HG   LEU 115           HG       LEU 115  11.552   4.104  19.222
  552   HD11  LEU 115          1HD1      LEU 115  10.009   5.310  17.740
  553   HD12  LEU 115          2HD1      LEU 115   9.234   4.870  19.280
  554   HD13  LEU 115          3HD1      LEU 115   9.766   6.544  18.998
  555   HD21  LEU 115          1HD2      LEU 115  12.468   5.811  17.685
  556   HD22  LEU 115          2HD2      LEU 115  12.262   7.053  18.943
  557   HD23  LEU 115          3HD2      LEU 115  13.420   5.724  19.188
  558    H    VAL 116           H        VAL 116   9.149   2.699  20.493
  559    HA   VAL 116           HA       VAL 116  11.273   0.663  21.022
  560    HB   VAL 116           HB       VAL 116   8.256   0.225  20.950
  561   HG11  VAL 116          1HG1      VAL 116   8.777  -2.083  21.572
  562   HG12  VAL 116          2HG1      VAL 116   9.456  -1.650  19.984
  563   HG13  VAL 116          3HG1      VAL 116  10.515  -1.731  21.413
  564   HG21  VAL 116          1HG2      VAL 116   8.545  -0.355  23.339
  565   HG22  VAL 116          2HG2      VAL 116  10.273   0.056  23.228
  566   HG23  VAL 116          3HG2      VAL 116   9.041   1.322  23.020
  567    H    ALA 117           H        ALA 117  12.119  -0.236  19.277
  568    HA   ALA 117           HA       ALA 117  11.027   0.401  16.651
  569    HB1  ALA 117          1HB       ALA 117  12.987  -0.846  15.802
  570    HB2  ALA 117          2HB       ALA 117  13.454   0.369  17.018
  571    HB3  ALA 117          3HB       ALA 117  13.374  -1.350  17.464
  572    H    GLU 118           H        GLU 118   8.939  -0.658  17.090
  573    HA   GLU 118           HA       GLU 118   8.791  -3.516  17.367
  574    HB2  GLU 118          1HB       GLU 118   6.944  -1.940  17.970
  575    HB3  GLU 118          2HB       GLU 118   6.714  -1.580  16.266
  576    HG2  GLU 118          1HG       GLU 118   6.077  -3.883  15.821
  577    HG3  GLU 118          2HG       GLU 118   6.406  -4.326  17.494
  578    HA   PRO 119           HA       PRO 119   9.918  -4.826  13.339
  579    HB2  PRO 119          1HB       PRO 119   7.983  -7.054  14.098
  580    HB3  PRO 119          2HB       PRO 119   9.593  -7.181  13.376
  581    HG2  PRO 119          1HG       PRO 119   9.350  -7.663  15.978
  582    HG3  PRO 119          2HG       PRO 119  10.704  -6.672  15.424
  583    HD2  PRO 119          1HD       PRO 119   8.076  -5.795  16.675
  584    HD3  PRO 119          2HD       PRO 119   9.748  -5.174  16.979
  Start of MODEL    7
    1    H    GLN  38          1H        GLN  38   1.334  -2.956   3.829
    2    HA   GLN  38           HA       GLN  38   2.943  -2.009   5.280
    3    HB2  GLN  38          1HB       GLN  38   3.637  -1.809   2.320
    4    HB3  GLN  38          2HB       GLN  38   4.803  -1.902   3.633
    5    HG2  GLN  38          1HG       GLN  38   2.767  -4.038   2.972
    6    HG3  GLN  38          2HG       GLN  38   4.486  -4.049   2.491
    7   HE21  GLN  38          1HE2      GLN  38   3.441  -5.697   5.927
    8   HE22  GLN  38          2HE2      GLN  38   2.403  -5.419   4.568
    9    H    ALA  39           H        ALA  39   4.717  -0.327   5.303
   10    HA   ALA  39           HA       ALA  39   3.496   2.286   5.379
   11    HB1  ALA  39          1HB       ALA  39   5.755   3.063   6.022
   12    HB2  ALA  39          2HB       ALA  39   5.256   1.635   6.961
   13    HB3  ALA  39          3HB       ALA  39   6.413   1.460   5.621
   14    HA   PRO  40           HA       PRO  40   4.070   3.784   1.351
   15    HB2  PRO  40          1HB       PRO  40   4.938   6.343   2.744
   16    HB3  PRO  40          2HB       PRO  40   3.731   6.123   1.470
   17    HG2  PRO  40          1HG       PRO  40   2.877   6.474   3.964
   18    HG3  PRO  40          2HG       PRO  40   2.104   5.241   2.964
   19    HD2  PRO  40          1HD       PRO  40   4.236   4.903   5.116
   20    HD3  PRO  40          2HD       PRO  40   2.748   3.914   4.820
   21    H    LYS  41           H        LYS  41   5.738   3.980  -0.110
   22    HA   LYS  41           HA       LYS  41   8.339   3.184   0.768
   23    HB2  LYS  41          1HB       LYS  41   7.391   2.658  -1.477
   24    HB3  LYS  41          2HB       LYS  41   7.498   4.356  -1.915
   25    HG2  LYS  41          1HG       LYS  41   9.938   4.285  -1.718
   26    HG3  LYS  41          2HG       LYS  41   9.860   2.595  -1.201
   27    HD2  LYS  41          1HD       LYS  41   8.819   1.982  -3.362
   28    HD3  LYS  41          2HD       LYS  41   8.900   3.673  -3.879
   29    HE2  LYS  41          1HE       LYS  41  11.365   3.618  -3.678
   30    HE3  LYS  41          2HE       LYS  41  11.287   1.931  -3.161
   31    HZ1  LYS  41          1HZ       LYS  41  11.777   2.118  -5.487
   32    HZ2  LYS  41          2HZ       LYS  41  10.313   1.385  -5.284
   33    HZ3  LYS  41          3HZ       LYS  41  10.387   2.961  -5.766
   34    H    GLY  42           H        GLY  42   9.907   4.308   1.636
   35    HA2  GLY  42          1HA       GLY  42  11.558   6.003   1.625
   36    HA3  GLY  42          2HA       GLY  42  10.570   6.962   0.538
   37    H    SER  43           H        SER  43   8.634   5.771   3.014
   38    HA   SER  43           HA       SER  43   8.956   8.314   4.557
   39    HB2  SER  43          1HB       SER  43   6.433   6.724   3.983
   40    HB3  SER  43          2HB       SER  43   6.521   8.133   5.030
   41    HG   SER  43           HG       SER  43   7.202   8.022   2.300
   42    H    ALA  44           H        ALA  44   8.302   8.236   6.808
   43    HA   ALA  44           HA       ALA  44   9.036   5.634   8.017
   44    HB1  ALA  44          1HB       ALA  44   9.272   6.930  10.111
   45    HB2  ALA  44          2HB       ALA  44  10.255   7.617   8.795
   46    HB3  ALA  44          3HB       ALA  44   8.723   8.392   9.258
   47    H    PHE  45           H        PHE  45   7.791   4.534   9.484
   48    HA   PHE  45           HA       PHE  45   4.964   5.483   9.718
   49    HB2  PHE  45          1HB       PHE  45   5.016   3.423   8.461
   50    HB3  PHE  45          2HB       PHE  45   6.109   2.670   9.611
   51    HD1  PHE  45           HD1      PHE  45   2.670   3.440   8.808
   52    HD2  PHE  45           HD2      PHE  45   5.291   2.072  11.893
   53    HE1  PHE  45           HE1      PHE  45   0.733   2.525  10.048
   54    HE2  PHE  45           HE2      PHE  45   3.358   1.155  13.132
   55    HZ   PHE  45           HZ       PHE  45   1.079   1.383  12.211
   56    H    VAL  46           H        VAL  46   4.191   5.901  11.667
   57    HA   VAL  46           HA       VAL  46   5.588   4.692  14.014
   58    HB   VAL  46           HB       VAL  46   4.488   7.525  13.770
   59   HG11  VAL  46          1HG1      VAL  46   5.277   7.836  16.064
   60   HG12  VAL  46          2HG1      VAL  46   4.001   6.599  15.961
   61   HG13  VAL  46          3HG1      VAL  46   5.704   6.110  16.153
   62   HG21  VAL  46          1HG2      VAL  46   6.841   8.174  14.169
   63   HG22  VAL  46          2HG2      VAL  46   7.309   6.454  14.191
   64   HG23  VAL  46          3HG2      VAL  46   6.687   7.189  12.694
   65    H    ARG  47           H        ARG  47   4.319   3.618  15.376
   66    HA   ARG  47           HA       ARG  47   1.388   4.201  15.293
   67    HB2  ARG  47          1HB       ARG  47   1.791   1.933  14.589
   68    HB3  ARG  47          2HB       ARG  47   2.878   1.641  15.938
   69    HG2  ARG  47          1HG       ARG  47   1.031   1.766  17.514
   70    HG3  ARG  47          2HG       ARG  47  -0.091   2.178  16.196
   71    HD2  ARG  47          1HD       ARG  47   1.545  -0.337  16.223
   72    HD3  ARG  47          2HD       ARG  47  -0.067  -0.214  16.959
   73    HE   ARG  47           HE       ARG  47  -0.445   0.751  14.430
   74   HH11  ARG  47          1HH1      ARG  47   0.935  -2.205  15.733
   75   HH12  ARG  47          2HH1      ARG  47   0.466  -3.180  14.357
   76   HH21  ARG  47          1HH2      ARG  47  -1.049  -0.522  12.650
   77   HH22  ARG  47          2HH2      ARG  47  -0.658  -2.228  12.613
   78    H    ALA  48           H        ALA  48   0.973   5.586  16.892
   79    HA   ALA  48           HA       ALA  48   2.492   5.507  19.382
   80    HB1  ALA  48          1HB       ALA  48   1.044   7.405  20.038
   81    HB2  ALA  48          2HB       ALA  48   1.773   7.653  18.433
   82    HB3  ALA  48          3HB       ALA  48   0.071   7.158  18.570
   83    H    TYR  49           H        TYR  49   1.760   5.029  21.431
   84    HA   TYR  49           HA       TYR  49  -0.945   3.818  21.646
   85    HB2  TYR  49          1HB       TYR  49   0.563   1.922  21.285
   86    HB3  TYR  49          2HB       TYR  49   1.642   2.496  22.550
   87    HD1  TYR  49           HD1      TYR  49  -1.830   1.283  21.948
   88    HD2  TYR  49           HD2      TYR  49   1.344   1.851  24.776
   89    HE1  TYR  49           HE1      TYR  49  -3.082  -0.039  23.619
   90    HE2  TYR  49           HE2      TYR  49   0.093   0.528  26.447
   91    HH   TYR  49           HH       TYR  49  -3.111  -0.820  25.700
   92    H    ASN  50           H        ASN  50  -2.013   4.303  23.445
   93    HA   ASN  50           HA       ASN  50  -0.575   6.027  25.397
   94    HB2  ASN  50          1HB       ASN  50  -2.604   6.930  24.257
   95    HB3  ASN  50          2HB       ASN  50  -3.558   5.643  24.983
   96   HD21  ASN  50          1HD2      ASN  50  -3.651   8.838  26.991
   97   HD22  ASN  50          2HD2      ASN  50  -3.821   8.512  25.298
   98    H    ALA  51           H        ALA  51   0.273   4.959  27.023
   99    HA   ALA  51           HA       ALA  51  -1.103   2.507  27.964
  100    HB1  ALA  51          1HB       ALA  51   1.030   2.023  29.118
  101    HB2  ALA  51          2HB       ALA  51   1.271   2.298  27.377
  102    HB3  ALA  51          3HB       ALA  51   1.683   3.575  28.543
  103    H    GLY  52           H        GLY  52  -1.960   5.307  28.587
  104    HA2  GLY  52          1HA       GLY  52  -1.830   5.064  31.572
  105    HA3  GLY  52          2HA       GLY  52  -1.767   6.614  30.758
  106    H    ASN  53           H        ASN  53  -3.648   7.050  32.178
  107    HA   ASN  53           HA       ASN  53  -6.168   5.954  30.996
  108    HB2  ASN  53          1HB       ASN  53  -5.592   6.909  33.817
  109    HB3  ASN  53          2HB       ASN  53  -7.206   6.567  33.209
  110   HD21  ASN  53          1HD2      ASN  53  -4.967   3.627  34.661
  111   HD22  ASN  53          2HD2      ASN  53  -4.647   5.317  34.865
  112    H    SER  54           H        SER  54  -4.539   8.237  30.083
  113    HA   SER  54           HA       SER  54  -6.750  10.199  30.057
  114    HB2  SER  54          1HB       SER  54  -5.346  10.937  31.921
  115    HB3  SER  54          2HB       SER  54  -3.916  10.881  30.904
  116    HG   SER  54           HG       SER  54  -4.942  12.416  29.561
  117    H    GLU  55           H        GLU  55  -7.058  11.029  28.109
  118    HA   GLU  55           HA       GLU  55  -5.573  10.133  25.859
  119    HB2  GLU  55          1HB       GLU  55  -7.937  10.963  25.799
  120    HB3  GLU  55          2HB       GLU  55  -7.350  12.597  26.072
  121    HG2  GLU  55          1HG       GLU  55  -6.131  12.547  23.958
  122    HG3  GLU  55          2HG       GLU  55  -6.631  10.877  23.687
  123    H    LEU  56           H        LEU  56  -3.860  10.864  24.775
  124    HA   LEU  56           HA       LEU  56  -2.527  13.279  25.926
  125    HB2  LEU  56          1HB       LEU  56  -1.271  10.761  24.774
  126    HB3  LEU  56          2HB       LEU  56  -0.385  12.175  25.356
  127    HG   LEU  56           HG       LEU  56  -2.133  10.382  27.076
  128   HD11  LEU  56          1HD1      LEU  56  -0.001   9.579  27.986
  129   HD12  LEU  56          2HD1      LEU  56  -0.152   9.221  26.249
  130   HD13  LEU  56          3HD1      LEU  56   0.879  10.565  26.796
  131   HD21  LEU  56          1HD2      LEU  56  -1.086  11.634  28.932
  132   HD22  LEU  56          2HD2      LEU  56  -0.220  12.652  27.756
  133   HD23  LEU  56          3HD2      LEU  56  -1.996  12.724  27.859
  134    H    ASP  57           H        ASP  57  -1.427  14.673  24.568
  135    HA   ASP  57           HA       ASP  57  -2.438  14.651  21.796
  136    HB2  ASP  57          1HB       ASP  57  -2.577  16.734  23.133
  137    HB3  ASP  57          2HB       ASP  57  -0.828  16.741  23.319
  138    H    VAL  58           H        VAL  58  -1.343  13.626  20.286
  139    HA   VAL  58           HA       VAL  58   1.558  13.173  20.706
  140    HB   VAL  58           HB       VAL  58  -0.400  11.932  18.723
  141   HG11  VAL  58          1HG1      VAL  58   1.382  10.319  18.268
  142   HG12  VAL  58          2HG1      VAL  58   1.855  11.976  17.825
  143   HG13  VAL  58          3HG1      VAL  58   2.483  11.240  19.319
  144   HG21  VAL  58          1HG2      VAL  58  -0.173   9.932  20.162
  145   HG22  VAL  58          2HG2      VAL  58   0.876  10.848  21.269
  146   HG23  VAL  58          3HG2      VAL  58  -0.833  11.308  21.074
  147    H    SER  59           H        SER  59   3.101  14.080  19.503
  148    HA   SER  59           HA       SER  59   2.548  14.848  16.734
  149    HB2  SER  59          1HB       SER  59   3.164  17.162  16.937
  150    HB3  SER  59          2HB       SER  59   1.845  16.852  18.055
  151    HG   SER  59           HG       SER  59   3.373  16.629  19.694
  152    H    VAL  60           H        VAL  60   4.542  15.689  15.650
  153    HA   VAL  60           HA       VAL  60   7.064  14.989  17.015
  154    HB   VAL  60           HB       VAL  60   6.296  12.854  15.994
  155   HG11  VAL  60          1HG1      VAL  60   6.154  12.639  13.561
  156   HG12  VAL  60          2HG1      VAL  60   4.932  13.763  14.203
  157   HG13  VAL  60          3HG1      VAL  60   6.388  14.394  13.394
  158   HG21  VAL  60          1HG2      VAL  60   8.350  12.407  14.690
  159   HG22  VAL  60          2HG2      VAL  60   8.648  14.158  14.564
  160   HG23  VAL  60          3HG2      VAL  60   8.709  13.356  16.151
  161    H    GLY  61           H        GLY  61   8.646  16.335  16.469
  162    HA2  GLY  61          1HA       GLY  61   9.836  17.966  15.323
  163    HA3  GLY  61          2HA       GLY  61   9.087  17.388  13.848
  164    H    SER  62           H        SER  62   7.858  18.816  12.800
  165    HA   SER  62           HA       SER  62   6.463  20.912  14.415
  166    HB2  SER  62          1HB       SER  62   6.485  22.292  12.394
  167    HB3  SER  62          2HB       SER  62   8.118  21.834  12.858
  168    HG   SER  62           HG       SER  62   6.814  20.101  11.180
  169    H    THR  63           H        THR  63   5.828  18.020  13.278
  170    HA   THR  63           HA       THR  63   3.336  18.742  11.822
  171    HB   THR  63           HB       THR  63   4.742  16.054  12.151
  172    HG1  THR  63           HG1      THR  63   4.431  17.804   9.909
  173   HG21  THR  63          1HG2      THR  63   3.105  15.245  10.496
  174   HG22  THR  63          2HG2      THR  63   2.289  15.806  11.976
  175   HG23  THR  63          3HG2      THR  63   2.292  16.826  10.520
  176    H    SER  64           H        SER  64   1.545  18.934  12.937
  177    HA   SER  64           HA       SER  64   1.220  17.688  15.555
  178    HB2  SER  64          1HB       SER  64   0.210  19.853  15.136
  179    HB3  SER  64          2HB       SER  64  -0.675  19.226  13.754
  180    HG   SER  64           HG       SER  64  -1.301  17.629  15.628
  181    H    LEU  65           H        LEU  65   0.493  15.738  15.988
  182    HA   LEU  65           HA       LEU  65  -0.783  14.213  13.763
  183    HB2  LEU  65          1HB       LEU  65   0.622  13.202  16.261
  184    HB3  LEU  65          2HB       LEU  65  -0.057  12.197  14.980
  185    HG   LEU  65           HG       LEU  65   2.267  14.129  14.648
  186   HD11  LEU  65          1HD1      LEU  65   3.618  12.086  14.481
  187   HD12  LEU  65          2HD1      LEU  65   2.823  12.221  16.067
  188   HD13  LEU  65          3HD1      LEU  65   2.177  11.105  14.841
  189   HD21  LEU  65          1HD2      LEU  65   2.492  13.032  12.445
  190   HD22  LEU  65          2HD2      LEU  65   1.037  12.063  12.778
  191   HD23  LEU  65          3HD2      LEU  65   0.909  13.830  12.602
  192    H    ASN  66           H        ASN  66  -2.193  12.340  14.671
  193    HA   ASN  66           HA       ASN  66  -4.432  13.667  15.953
  194    HB2  ASN  66          1HB       ASN  66  -3.993  10.782  15.119
  195    HB3  ASN  66          2HB       ASN  66  -5.505  11.405  15.763
  196   HD21  ASN  66          1HD2      ASN  66  -5.286  11.446  11.960
  197   HD22  ASN  66          2HD2      ASN  66  -4.778  10.264  13.120
  198    H    ASP  67           H        ASP  67  -5.361  13.337  17.918
  199    HA   ASP  67           HA       ASP  67  -3.587  12.587  20.068
  200    HB2  ASP  67          1HB       ASP  67  -6.575  13.164  20.020
  201    HB3  ASP  67          2HB       ASP  67  -5.651  12.889  21.490
  202    H    VAL  68           H        VAL  68  -3.803  10.900  21.573
  203    HA   VAL  68           HA       VAL  68  -5.155   8.494  20.422
  204    HB   VAL  68           HB       VAL  68  -2.592   8.634  22.070
  205   HG11  VAL  68          1HG1      VAL  68  -2.415   6.235  21.623
  206   HG12  VAL  68          2HG1      VAL  68  -3.872   6.633  22.565
  207   HG13  VAL  68          3HG1      VAL  68  -4.006   6.267  20.827
  208   HG21  VAL  68          1HG2      VAL  68  -1.511   7.862  19.983
  209   HG22  VAL  68          2HG2      VAL  68  -3.077   7.950  19.141
  210   HG23  VAL  68          3HG2      VAL  68  -2.310   9.435  19.751
  211    H    ALA  69           H        ALA  69  -6.708   7.636  21.607
  212    HA   ALA  69           HA       ALA  69  -7.314   8.721  24.219
  213    HB1  ALA  69          1HB       ALA  69  -9.199   7.120  24.184
  214    HB2  ALA  69          2HB       ALA  69  -9.093   8.047  22.668
  215    HB3  ALA  69          3HB       ALA  69  -8.519   6.365  22.723
  216    HA   PRO  70           HA       PRO  70  -5.364   6.158  27.079
  217    HB2  PRO  70          1HB       PRO  70  -8.140   5.403  28.082
  218    HB3  PRO  70          2HB       PRO  70  -6.728   5.920  29.013
  219    HG2  PRO  70          1HG       PRO  70  -8.643   7.703  28.548
  220    HG3  PRO  70          2HG       PRO  70  -6.958   8.201  28.360
  221    HD2  PRO  70          1HD       PRO  70  -8.982   7.432  26.225
  222    HD3  PRO  70          2HD       PRO  70  -7.758   8.765  26.211
  223    H    LEU  71           H        LEU  71  -4.483   4.225  26.660
  224    HA   LEU  71           HA       LEU  71  -4.257   1.986  26.172
  225    HB2  LEU  71          1HB       LEU  71  -7.246   1.818  26.693
  226    HB3  LEU  71          2HB       LEU  71  -6.107   0.467  26.658
  227    HG   LEU  71           HG       LEU  71  -6.178   2.700  28.719
  228   HD11  LEU  71          1HD1      LEU  71  -6.860   0.897  30.238
  229   HD12  LEU  71          2HD1      LEU  71  -8.024   1.113  28.911
  230   HD13  LEU  71          3HD1      LEU  71  -6.876  -0.246  28.877
  231   HD21  LEU  71          1HD2      LEU  71  -4.425   1.371  29.847
  232   HD22  LEU  71          2HD2      LEU  71  -4.406   0.232  28.479
  233   HD23  LEU  71          3HD2      LEU  71  -3.880   1.915  28.242
  234    H    GLY  72           H        GLY  72  -5.234   4.086  24.177
  235    HA2  GLY  72          1HA       GLY  72  -6.180   2.156  22.089
  236    HA3  GLY  72          2HA       GLY  72  -6.461   3.885  22.040
  237    H    SER  73           H        SER  73  -5.487   3.366  19.818
  238    HA   SER  73           HA       SER  73  -2.659   4.171  19.903
  239    HB2  SER  73          1HB       SER  73  -1.860   2.376  18.503
  240    HB3  SER  73          2HB       SER  73  -2.589   1.687  19.946
  241    HG   SER  73           HG       SER  73  -3.558   1.805  17.332
  242    H    SER  74           H        SER  74  -1.818   4.699  17.731
  243    HA   SER  74           HA       SER  74  -3.869   5.139  15.657
  244    HB2  SER  74          1HB       SER  74  -4.053   7.142  17.069
  245    HB3  SER  74          2HB       SER  74  -2.324   7.418  16.936
  246    HG   SER  74           HG       SER  74  -2.796   7.341  14.581
  247    H    ASP  75           H        ASP  75  -3.044   4.658  13.758
  248    HA   ASP  75           HA       ASP  75  -0.139   4.388  13.457
  249    HB2  ASP  75          1HB       ASP  75  -2.471   3.852  11.577
  250    HB3  ASP  75          2HB       ASP  75  -0.787   3.622  11.121
  251    H    PHE  76           H        PHE  76   1.209   5.626  12.282
  252    HA   PHE  76           HA       PHE  76   0.014   7.998  10.914
  253    HB2  PHE  76          1HB       PHE  76   2.539   7.969  12.617
  254    HB3  PHE  76          2HB       PHE  76   1.918   9.350  11.728
  255    HD1  PHE  76           HD1      PHE  76   2.124   7.938  14.868
  256    HD2  PHE  76           HD2      PHE  76  -0.701   9.825  12.280
  257    HE1  PHE  76           HE1      PHE  76   0.765   8.586  16.829
  258    HE2  PHE  76           HE2      PHE  76  -2.063  10.478  14.238
  259    HZ   PHE  76           HZ       PHE  76  -1.329   9.856  16.513
  260    H    LYS  77           H        LYS  77   0.480   8.030   8.845
  261    HA   LYS  77           HA       LYS  77   2.985   6.665   7.955
  262    HB2  LYS  77          1HB       LYS  77   0.332   7.019   6.506
  263    HB3  LYS  77          2HB       LYS  77   1.786   6.364   5.762
  264    HG2  LYS  77          1HG       LYS  77   1.772   4.485   7.345
  265    HG3  LYS  77          2HG       LYS  77   0.335   5.152   8.134
  266    HD2  LYS  77          1HD       LYS  77  -0.919   4.956   6.004
  267    HD3  LYS  77          2HD       LYS  77   0.516   4.273   5.228
  268    HE2  LYS  77          1HE       LYS  77   0.481   2.373   6.786
  269    HE3  LYS  77          2HE       LYS  77  -0.912   3.062   7.624
  270    HZ1  LYS  77          1HZ       LYS  77  -1.565   1.383   6.060
  271    HZ2  LYS  77          2HZ       LYS  77  -2.167   2.847   5.590
  272    HZ3  LYS  77          3HZ       LYS  77  -0.866   2.200   4.808
  273    H    PHE  78           H        PHE  78   3.859   7.483   5.860
  274    HA   PHE  78           HA       PHE  78   4.650   9.173   4.514
  275    HB2  PHE  78          1HB       PHE  78   2.112  10.632   5.359
  276    HB3  PHE  78          2HB       PHE  78   3.160  11.093   4.028
  277    HD1  PHE  78           HD1      PHE  78   0.409   9.047   5.068
  278    HD2  PHE  78           HD2      PHE  78   3.441   9.472   2.089
  279    HE1  PHE  78           HE1      PHE  78  -0.881   7.584   3.548
  280    HE2  PHE  78           HE2      PHE  78   2.154   8.012   0.566
  281    HZ   PHE  78           HZ       PHE  78  -0.008   7.066   1.298
  282    H    LEU  79           H        LEU  79   5.379   9.024   7.331
  283    HA   LEU  79           HA       LEU  79   5.662  11.825   8.181
  284    HB2  LEU  79          1HB       LEU  79   6.686   9.222   9.369
  285    HB3  LEU  79          2HB       LEU  79   6.903  10.813  10.106
  286    HG   LEU  79           HG       LEU  79   4.234   9.447   9.611
  287   HD11  LEU  79          1HD1      LEU  79   4.191   9.218  12.055
  288   HD12  LEU  79          2HD1      LEU  79   5.567   8.346  11.338
  289   HD13  LEU  79          3HD1      LEU  79   5.828   9.911  12.149
  290   HD21  LEU  79          1HD2      LEU  79   3.341  11.312  10.963
  291   HD22  LEU  79          2HD2      LEU  79   4.965  12.035  11.041
  292   HD23  LEU  79          3HD2      LEU  79   4.120  11.911   9.480
  293    HA   PRO  80           HA       PRO  80   9.354  12.470   5.899
  294    HB2  PRO  80          1HB       PRO  80   9.719  14.551   8.088
  295    HB3  PRO  80          2HB       PRO  80   9.906  14.736   6.340
  296    HG2  PRO  80          1HG       PRO  80   7.679  15.653   7.467
  297    HG3  PRO  80          2HG       PRO  80   7.556  14.759   5.950
  298    HD2  PRO  80          1HD       PRO  80   7.046  13.794   8.792
  299    HD3  PRO  80          2HD       PRO  80   6.091  13.470   7.289
  300    HA   PRO  81           HA       PRO  81  11.946  10.002   8.632
  301    HB2  PRO  81          1HB       PRO  81  13.711  10.227   6.184
  302    HB3  PRO  81          2HB       PRO  81  13.260   8.786   7.104
  303    HG2  PRO  81          1HG       PRO  81  12.082   9.216   4.752
  304    HG3  PRO  81          2HG       PRO  81  11.107   8.652   6.111
  305    HD2  PRO  81          1HD       PRO  81  11.433  11.491   5.040
  306    HD3  PRO  81          2HD       PRO  81   9.917  10.619   5.500
  307    H    GLY  82           H        GLY  82  13.790  10.498   9.831
  308    HA2  GLY  82          1HA       GLY  82  15.988  11.937   9.508
  309    HA3  GLY  82          2HA       GLY  82  14.842  13.264   9.488
  310    H    SER  83           H        SER  83  16.054  14.000  11.388
  311    HA   SER  83           HA       SER  83  15.408  12.481  13.870
  312    HB2  SER  83          1HB       SER  83  17.764  13.007  13.588
  313    HB3  SER  83          2HB       SER  83  17.397  14.704  13.319
  314    HG   SER  83           HG       SER  83  16.238  13.913  15.559
  315    H    TYR  84           H        TYR  84  13.564  13.045  14.779
  316    HA   TYR  84           HA       TYR  84  12.949  15.955  14.996
  317    HB2  TYR  84          1HB       TYR  84  10.978  13.767  14.209
  318    HB3  TYR  84          2HB       TYR  84  10.543  15.429  14.581
  319    HD1  TYR  84           HD1      TYR  84  11.992  13.167  12.115
  320    HD2  TYR  84           HD2      TYR  84  11.182  17.269  13.075
  321    HE1  TYR  84           HE1      TYR  84  12.363  13.794   9.752
  322    HE2  TYR  84           HE2      TYR  84  11.555  17.896  10.713
  323    HH   TYR  84           HH       TYR  84  12.402  15.450   8.273
  324    H    THR  85           H        THR  85  11.577  16.548  16.737
  325    HA   THR  85           HA       THR  85  11.936  14.767  19.060
  326    HB   THR  85           HB       THR  85  10.847  17.611  18.877
  327    HG1  THR  85           HG1      THR  85  13.070  17.625  20.172
  328   HG21  THR  85          1HG2      THR  85  11.130  17.627  21.323
  329   HG22  THR  85          2HG2      THR  85   9.964  16.377  20.827
  330   HG23  THR  85          3HG2      THR  85  11.621  15.918  21.284
  331    H    ALA  86           H        ALA  86  10.471  13.348  19.628
  332    HA   ALA  86           HA       ALA  86   7.702  13.683  18.644
  333    HB1  ALA  86          1HB       ALA  86   7.408  11.339  19.373
  334    HB2  ALA  86          2HB       ALA  86   8.793  11.515  18.270
  335    HB3  ALA  86          3HB       ALA  86   9.064  11.338  20.021
  336    H    GLN  87           H        GLN  87   6.292  14.711  19.842
  337    HA   GLN  87           HA       GLN  87   6.600  14.575  22.806
  338    HB2  GLN  87          1HB       GLN  87   6.715  16.853  21.857
  339    HB3  GLN  87          2HB       GLN  87   5.157  16.625  21.076
  340    HG2  GLN  87          1HG       GLN  87   4.057  16.445  23.242
  341    HG3  GLN  87          2HG       GLN  87   5.636  16.609  24.063
  342   HE21  GLN  87          1HE2      GLN  87   3.875  19.906  24.019
  343   HE22  GLN  87          2HE2      GLN  87   3.483  18.318  24.590
  344    H    VAL  88           H        VAL  88   5.141  13.575  24.003
  345    HA   VAL  88           HA       VAL  88   2.389  13.298  22.885
  346    HB   VAL  88           HB       VAL  88   3.872  11.198  24.524
  347   HG11  VAL  88          1HG1      VAL  88   1.913   9.797  24.087
  348   HG12  VAL  88          2HG1      VAL  88   1.495  11.257  25.014
  349   HG13  VAL  88          3HG1      VAL  88   1.116  11.165  23.277
  350   HG21  VAL  88          1HG2      VAL  88   3.777   9.854  22.449
  351   HG22  VAL  88          2HG2      VAL  88   3.039  11.230  21.594
  352   HG23  VAL  88          3HG2      VAL  88   4.708  11.350  22.205
  353    H    GLY  89           H        GLY  89   1.205  14.659  24.056
  354    HA2  GLY  89          1HA       GLY  89   0.129  15.478  25.979
  355    HA3  GLY  89          2HA       GLY  89   1.106  14.414  26.973
  356    H    GLN  90           H        GLN  90   2.838  15.223  28.040
  357    HA   GLN  90           HA       GLN  90   3.471  18.096  27.516
  358    HB2  GLN  90          1HB       GLN  90   3.582  16.544  30.135
  359    HB3  GLN  90          2HB       GLN  90   4.069  18.220  29.932
  360    HG2  GLN  90          1HG       GLN  90   1.280  17.149  29.458
  361    HG3  GLN  90          2HG       GLN  90   1.842  18.000  30.923
  362   HE21  GLN  90          1HE2      GLN  90   0.259  20.128  28.023
  363   HE22  GLN  90          2HE2      GLN  90  -0.041  18.459  28.379
  364    H    GLN  91           H        GLN  91   4.716  14.881  27.828
  365    HA   GLN  91           HA       GLN  91   7.501  15.904  28.008
  366    HB2  GLN  91          1HB       GLN  91   6.420  13.064  28.215
  367    HB3  GLN  91          2HB       GLN  91   8.104  13.525  28.406
  368    HG2  GLN  91          1HG       GLN  91   5.829  14.447  30.173
  369    HG3  GLN  91          2HG       GLN  91   7.003  13.156  30.550
  370   HE21  GLN  91          1HE2      GLN  91   7.815  16.848  31.673
  371   HE22  GLN  91          2HE2      GLN  91   6.247  16.184  31.362
  372    H    SER  92           H        SER  92   9.139  15.133  26.593
  373    HA   SER  92           HA       SER  92   8.264  13.921  24.055
  374    HB2  SER  92          1HB       SER  92   9.015  15.739  22.665
  375    HB3  SER  92          2HB       SER  92   7.825  16.363  23.793
  376    HG   SER  92           HG       SER  92   9.306  17.740  24.171
  377    H    LEU  93           H        LEU  93   9.911  13.004  22.870
  378    HA   LEU  93           HA       LEU  93  12.695  13.541  23.731
  379    HB2  LEU  93          1HB       LEU  93  11.386  10.806  23.641
  380    HB3  LEU  93          2HB       LEU  93  13.137  11.037  23.612
  381    HG   LEU  93           HG       LEU  93  11.320  11.963  25.864
  382   HD11  LEU  93          1HD1      LEU  93  12.244  10.054  27.099
  383   HD12  LEU  93          2HD1      LEU  93  11.330   9.531  25.666
  384   HD13  LEU  93          3HD1      LEU  93  13.109   9.525  25.635
  385   HD21  LEU  93          1HD2      LEU  93  13.465  12.247  27.061
  386   HD22  LEU  93          2HD2      LEU  93  14.349  11.750  25.596
  387   HD23  LEU  93          3HD2      LEU  93  13.407  13.263  25.598
  388    HA   PRO  94           HA       PRO  94  13.442  13.612  19.409
  389    HB2  PRO  94          1HB       PRO  94  16.123  12.472  20.261
  390    HB3  PRO  94          2HB       PRO  94  15.785  13.849  19.207
  391    HG2  PRO  94          1HG       PRO  94  16.558  14.338  21.706
  392    HG3  PRO  94          2HG       PRO  94  15.234  15.287  21.022
  393    HD2  PRO  94          1HD       PRO  94  15.103  12.884  22.896
  394    HD3  PRO  94          2HD       PRO  94  14.177  14.438  22.970
  395    H    VAL  95           H        VAL  95  13.109  12.136  17.819
  396    HA   VAL  95           HA       VAL  95  13.778   9.283  18.396
  397    HB   VAL  95           HB       VAL  95  11.753   8.623  17.125
  398   HG11  VAL  95          1HG1      VAL  95  10.095   9.227  18.818
  399   HG12  VAL  95          2HG1      VAL  95  11.647   8.751  19.546
  400   HG13  VAL  95          3HG1      VAL  95  11.197  10.470  19.454
  401   HG21  VAL  95          1HG2      VAL  95  10.046  10.339  16.601
  402   HG22  VAL  95          2HG2      VAL  95  11.154  11.611  17.165
  403   HG23  VAL  95          3HG2      VAL  95  11.563  10.650  15.724
  404    H    LYS  96           H        LYS  96  14.422   8.013  16.642
  405    HA   LYS  96           HA       LYS  96  15.324   9.582  14.283
  406    HB2  LYS  96          1HB       LYS  96  17.043   8.278  15.517
  407    HB3  LYS  96          2HB       LYS  96  16.134   6.802  15.222
  408    HG2  LYS  96          1HG       LYS  96  16.475   7.058  12.799
  409    HG3  LYS  96          2HG       LYS  96  17.366   8.561  13.080
  410    HD2  LYS  96          1HD       LYS  96  19.040   7.321  14.417
  411    HD3  LYS  96          2HD       LYS  96  18.151   5.817  14.131
  412    HE2  LYS  96          1HE       LYS  96  18.503   6.075  11.693
  413    HE3  LYS  96          2HE       LYS  96  19.400   7.569  11.981
  414    HZ1  LYS  96          1HZ       LYS  96  20.860   5.705  11.700
  415    HZ2  LYS  96          2HZ       LYS  96  21.003   6.296  13.233
  416    HZ3  LYS  96          3HZ       LYS  96  20.166   4.900  12.962
  417    H    LEU  97           H        LEU  97  14.128   9.556  12.539
  418    HA   LEU  97           HA       LEU  97  12.324   7.219  12.115
  419    HB2  LEU  97          1HB       LEU  97  12.128  10.045  11.019
  420    HB3  LEU  97          2HB       LEU  97  10.969   8.745  10.732
  421    HG   LEU  97           HG       LEU  97  11.554  10.030  13.424
  422   HD11  LEU  97          1HD1      LEU  97   9.304  10.976  13.168
  423   HD12  LEU  97          2HD1      LEU  97  10.397  11.525  11.878
  424   HD13  LEU  97          3HD1      LEU  97   9.188  10.262  11.544
  425   HD21  LEU  97          1HD2      LEU  97   9.614   8.697  14.176
  426   HD22  LEU  97          2HD2      LEU  97   9.502   7.951  12.564
  427   HD23  LEU  97          3HD2      LEU  97  10.923   7.645  13.587
  428    H    ASP  98           H        ASP  98  13.539   5.819  10.944
  429    HA   ASP  98           HA       ASP  98  14.887   6.771   8.502
  430    HB2  ASP  98          1HB       ASP  98  14.601   4.027   9.778
  431    HB3  ASP  98          2HB       ASP  98  15.385   4.284   8.225
  432    HA   PRO  99           HA       PRO  99  11.510   6.011   5.872
  433    HB2  PRO  99          1HB       PRO  99  12.811   5.626   3.480
  434    HB3  PRO  99          2HB       PRO  99  12.705   7.211   4.258
  435    HG2  PRO  99          1HG       PRO  99  14.976   5.179   4.358
  436    HG3  PRO  99          2HG       PRO  99  15.073   6.913   4.036
  437    HD2  PRO  99          1HD       PRO  99  15.572   5.917   6.517
  438    HD3  PRO  99          2HD       PRO  99  14.740   7.508   6.296
  439    H    ASP 100           H        ASP 100  10.374   4.309   4.890
  440    HA   ASP 100           HA       ASP 100   9.766   2.120   4.529
  441    HB2  ASP 100          1HB       ASP 100  12.739   1.766   3.975
  442    HB3  ASP 100          2HB       ASP 100  11.493   0.584   3.592
  443    H    SER 101           H        SER 101  10.099   2.845   7.181
  444    HA   SER 101           HA       SER 101  10.680   0.187   8.327
  445    HB2  SER 101          1HB       SER 101  12.142   1.006  10.040
  446    HB3  SER 101          2HB       SER 101  12.798   1.516   8.492
  447    HG   SER 101           HG       SER 101  11.892   3.523   8.807
  448    H    TYR 102           H        TYR 102   9.932  -0.002  10.581
  449    HA   TYR 102           HA       TYR 102   7.527   1.733  10.959
  450    HB2  TYR 102          1HB       TYR 102   7.878  -1.198  11.717
  451    HB3  TYR 102          2HB       TYR 102   6.430  -0.231  11.972
  452    HD1  TYR 102           HD1      TYR 102   8.677  -1.563   9.316
  453    HD2  TYR 102           HD2      TYR 102   4.792  -0.043  10.312
  454    HE1  TYR 102           HE1      TYR 102   7.850  -2.210   7.077
  455    HE2  TYR 102           HE2      TYR 102   3.963  -0.689   8.077
  456    HH   TYR 102           HH       TYR 102   5.756  -2.702   5.962
  457    H    TYR 103           H        TYR 103   6.990   2.463  12.964
  458    HA   TYR 103           HA       TYR 103   8.802   1.705  15.203
  459    HB2  TYR 103          1HB       TYR 103   7.974   4.544  14.479
  460    HB3  TYR 103          2HB       TYR 103   8.836   4.083  15.939
  461    HD1  TYR 103           HD1      TYR 103   9.084   4.723  12.367
  462    HD2  TYR 103           HD2      TYR 103  11.162   3.248  15.818
  463    HE1  TYR 103           HE1      TYR 103  11.236   4.968  11.177
  464    HE2  TYR 103           HE2      TYR 103  13.314   3.492  14.629
  465    HH   TYR 103           HH       TYR 103  14.323   4.163  12.770
  466    H    THR 104           H        THR 104   7.899   1.611  17.217
  467    HA   THR 104           HA       THR 104   5.031   2.438  17.405
  468    HB   THR 104           HB       THR 104   6.479   0.244  18.951
  469    HG1  THR 104           HG1      THR 104   5.771  -0.924  17.346
  470   HG21  THR 104          1HG2      THR 104   4.271  -0.200  19.949
  471   HG22  THR 104          2HG2      THR 104   4.832   1.441  20.348
  472   HG23  THR 104          3HG2      THR 104   3.596   1.203  19.092
  473    H    LEU 105           H        LEU 105   4.473   3.908  18.870
  474    HA   LEU 105           HA       LEU 105   6.687   4.919  20.604
  475    HB2  LEU 105          1HB       LEU 105   6.054   6.416  18.715
  476    HB3  LEU 105          2HB       LEU 105   4.403   6.478  19.340
  477    HG   LEU 105           HG       LEU 105   5.288   7.542  21.429
  478   HD11  LEU 105          1HD1      LEU 105   7.582   8.416  21.405
  479   HD12  LEU 105          2HD1      LEU 105   7.553   6.638  21.333
  480   HD13  LEU 105          3HD1      LEU 105   7.883   7.582  19.861
  481   HD21  LEU 105          1HD2      LEU 105   5.714   9.731  20.362
  482   HD22  LEU 105          2HD2      LEU 105   5.988   8.916  18.803
  483   HD23  LEU 105          3HD2      LEU 105   4.377   8.876  19.558
  484    H    VAL 106           H        VAL 106   6.287   4.110  22.572
  485    HA   VAL 106           HA       VAL 106   3.481   4.130  23.558
  486    HB   VAL 106           HB       VAL 106   5.977   2.768  24.661
  487   HG11  VAL 106          1HG1      VAL 106   4.441   1.599  26.164
  488   HG12  VAL 106          2HG1      VAL 106   4.437   3.356  26.442
  489   HG13  VAL 106          3HG1      VAL 106   3.094   2.592  25.559
  490   HG21  VAL 106          1HG2      VAL 106   4.862   0.699  23.892
  491   HG22  VAL 106          2HG2      VAL 106   3.533   1.669  23.213
  492   HG23  VAL 106          3HG2      VAL 106   5.172   1.804  22.533
  493    H    SER 107           H        SER 107   2.800   5.486  25.076
  494    HA   SER 107           HA       SER 107   4.741   6.848  26.829
  495    HB2  SER 107          1HB       SER 107   4.697   8.249  24.805
  496    HB3  SER 107          2HB       SER 107   2.945   8.353  24.900
  497    HG   SER 107           HG       SER 107   3.095   9.472  26.749
  498    H    GLN 108           H        GLN 108   3.830   7.809  28.653
  499    HA   GLN 108           HA       GLN 108   0.908   7.841  28.942
  500    HB2  GLN 108          1HB       GLN 108   0.829   6.394  30.891
  501    HB3  GLN 108          2HB       GLN 108   1.514   5.498  29.542
  502    HG2  GLN 108          1HG       GLN 108   3.777   5.882  30.441
  503    HG3  GLN 108          2HG       GLN 108   3.052   6.741  31.831
  504   HE21  GLN 108          1HE2      GLN 108   2.332   3.869  33.640
  505   HE22  GLN 108          2HE2      GLN 108   2.385   5.599  33.558
  506    HA   PRO 109           HA       PRO 109   1.555  11.270  31.503
  507    HB2  PRO 109          1HB       PRO 109  -0.220   9.875  33.541
  508    HB3  PRO 109          2HB       PRO 109  -0.332  11.526  32.917
  509    HG2  PRO 109          1HG       PRO 109  -2.016   9.704  31.961
  510    HG3  PRO 109          2HG       PRO 109  -1.248  10.825  30.833
  511    HD2  PRO 109          1HD       PRO 109  -0.521   7.935  31.459
  512    HD3  PRO 109          2HD       PRO 109  -0.602   8.767  29.854
  513    H    GLY 110           H        GLY 110   3.352  11.660  32.644
  514    HA2  GLY 110          1HA       GLY 110   4.580  11.572  34.728
  515    HA3  GLY 110          2HA       GLY 110   3.993   9.941  34.993
  516    H    GLY 111           H        GLY 111   4.543   9.454  31.987
  517    HA2  GLY 111          1HA       GLY 111   7.459   8.871  32.338
  518    HA3  GLY 111          2HA       GLY 111   6.351   7.885  31.400
  519    H    LYS 112           H        LYS 112   8.239   8.297  29.850
  520    HA   LYS 112           HA       LYS 112   7.602  10.740  28.247
  521    HB2  LYS 112          1HB       LYS 112  10.320   9.426  28.645
  522    HB3  LYS 112          2HB       LYS 112   9.991  10.728  27.508
  523    HG2  LYS 112          1HG       LYS 112   9.342  12.195  29.405
  524    HG3  LYS 112          2HG       LYS 112   9.750  10.889  30.526
  525    HD2  LYS 112          1HD       LYS 112  12.075  10.884  29.667
  526    HD3  LYS 112          2HD       LYS 112  11.663  12.207  28.564
  527    HE2  LYS 112          1HE       LYS 112  11.103  13.646  30.490
  528    HE3  LYS 112          2HE       LYS 112  11.490  12.329  31.598
  529    HZ1  LYS 112          1HZ       LYS 112  13.310  13.852  31.374
  530    HZ2  LYS 112          2HZ       LYS 112  13.745  12.377  30.777
  531    HZ3  LYS 112          3HZ       LYS 112  13.384  13.610  29.744
  532    HA   PRO 113           HA       PRO 113   6.679   8.291  24.827
  533    HB2  PRO 113          1HB       PRO 113   8.619  10.042  23.272
  534    HB3  PRO 113          2HB       PRO 113   6.947   9.616  22.879
  535    HG2  PRO 113          1HG       PRO 113   7.421  12.030  23.887
  536    HG3  PRO 113          2HG       PRO 113   6.037  11.115  24.490
  537    HD2  PRO 113          1HD       PRO 113   8.789  11.478  25.741
  538    HD3  PRO 113          2HD       PRO 113   7.161  11.534  26.532
  539    H    GLN 114           H        GLN 114   7.455   6.290  24.563
  540    HA   GLN 114           HA       GLN 114  10.406   5.906  24.395
  541    HB2  GLN 114          1HB       GLN 114   9.347   4.679  26.222
  542    HB3  GLN 114          2HB       GLN 114   8.166   3.981  25.125
  543    HG2  GLN 114          1HG       GLN 114   9.810   2.328  25.625
  544    HG3  GLN 114          2HG       GLN 114  10.034   2.833  23.926
  545   HE21  GLN 114          1HE2      GLN 114  13.372   3.618  24.351
  546   HE22  GLN 114          2HE2      GLN 114  12.058   3.165  23.315
  547    H    LEU 115           H        LEU 115  11.167   5.798  22.414
  548    HA   LEU 115           HA       LEU 115   9.522   4.928  20.177
  549    HB2  LEU 115          1HB       LEU 115  11.296   6.672  19.992
  550    HB3  LEU 115          2HB       LEU 115  12.515   5.438  20.317
  551    HG   LEU 115           HG       LEU 115  11.718   4.247  18.219
  552   HD11  LEU 115          1HD1      LEU 115  10.440   5.588  16.611
  553   HD12  LEU 115          2HD1      LEU 115   9.506   5.274  18.091
  554   HD13  LEU 115          3HD1      LEU 115  10.250   6.870  17.830
  555   HD21  LEU 115          1HD2      LEU 115  12.938   5.802  16.737
  556   HD22  LEU 115          2HD2      LEU 115  12.784   7.089  17.957
  557   HD23  LEU 115          3HD2      LEU 115  13.758   5.642  18.309
  558    H    VAL 116           H        VAL 116   9.244   2.945  19.426
  559    HA   VAL 116           HA       VAL 116  11.312   0.898  20.113
  560    HB   VAL 116           HB       VAL 116   8.366   0.489  19.436
  561   HG11  VAL 116          1HG1      VAL 116   8.771  -1.852  20.021
  562   HG12  VAL 116          2HG1      VAL 116   9.745  -1.336  18.622
  563   HG13  VAL 116          3HG1      VAL 116  10.504  -1.500  20.223
  564   HG21  VAL 116          1HG2      VAL 116   8.185  -0.224  21.799
  565   HG22  VAL 116          2HG2      VAL 116   9.899   0.185  22.051
  566   HG23  VAL 116          3HG2      VAL 116   8.725   1.469  21.676
  567    H    ALA 117           H        ALA 117  12.613   0.482  18.474
  568    HA   ALA 117           HA       ALA 117  11.874   1.191  15.754
  569    HB1  ALA 117          1HB       ALA 117  14.126   0.349  15.179
  570    HB2  ALA 117          2HB       ALA 117  14.177   1.483  16.549
  571    HB3  ALA 117          3HB       ALA 117  14.310  -0.268  16.837
  572    H    GLU 118           H        GLU 118  11.129  -0.030  14.157
  573    HA   GLU 118           HA       GLU 118  11.289  -2.983  14.436
  574    HB2  GLU 118          1HB       GLU 118   8.734  -1.471  13.751
  575    HB3  GLU 118          2HB       GLU 118   8.927  -3.217  13.729
  576    HG2  GLU 118          1HG       GLU 118   9.349  -3.210  16.148
  577    HG3  GLU 118          2HG       GLU 118   9.188  -1.457  16.177
  578    HA   PRO 119           HA       PRO 119  12.684  -1.387  10.334
  579    HB2  PRO 119          1HB       PRO 119  14.270  -3.953  10.747
  580    HB3  PRO 119          2HB       PRO 119  14.793  -2.430  10.015
  581    HG2  PRO 119          1HG       PRO 119  15.546  -2.945  12.512
  582    HG3  PRO 119          2HG       PRO 119  14.975  -1.322  12.116
  583    HD2  PRO 119          1HD       PRO 119  13.488  -3.599  13.483
  584    HD3  PRO 119          2HD       PRO 119  13.497  -1.836  13.890
  Start of MODEL    8
    1    H    GLN  38          1H        GLN  38   1.745  -2.354  -2.059
    2    HA   GLN  38           HA       GLN  38   3.831  -1.722  -1.141
    3    HB2  GLN  38          1HB       GLN  38   3.711  -2.162  -3.545
    4    HB3  GLN  38          2HB       GLN  38   3.140  -0.529  -3.854
    5    HG2  GLN  38          1HG       GLN  38   5.447  -0.653  -4.441
    6    HG3  GLN  38          2HG       GLN  38   5.304   0.344  -2.965
    7   HE21  GLN  38          1HE2      GLN  38   7.628  -1.540  -1.236
    8   HE22  GLN  38          2HE2      GLN  38   6.847  -0.023  -1.531
    9    H    ALA  39           H        ALA  39   4.603  -0.353   0.278
   10    HA   ALA  39           HA       ALA  39   3.637   2.374   0.465
   11    HB1  ALA  39          1HB       ALA  39   5.310   2.588   2.274
   12    HB2  ALA  39          2HB       ALA  39   4.315   1.123   2.466
   13    HB3  ALA  39          3HB       ALA  39   5.974   0.997   1.837
   14    HA   PRO  40           HA       PRO  40   6.291   4.545  -2.204
   15    HB2  PRO  40          1HB       PRO  40   6.632   6.450   0.137
   16    HB3  PRO  40          2HB       PRO  40   6.206   6.814  -1.539
   17    HG2  PRO  40          1HG       PRO  40   4.268   6.821   0.285
   18    HG3  PRO  40          2HG       PRO  40   3.961   6.066  -1.282
   19    HD2  PRO  40          1HD       PRO  40   4.680   4.755   1.372
   20    HD3  PRO  40          2HD       PRO  40   3.445   4.250   0.150
   21    H    LYS  41           H        LYS  41   8.477   4.669  -2.626
   22    HA   LYS  41           HA       LYS  41  10.280   3.201  -0.974
   23    HB2  LYS  41          1HB       LYS  41  10.537   3.496  -3.438
   24    HB3  LYS  41          2HB       LYS  41  10.921   5.194  -3.184
   25    HG2  LYS  41          1HG       LYS  41  12.939   4.583  -1.939
   26    HG3  LYS  41          2HG       LYS  41  12.542   2.868  -2.111
   27    HD2  LYS  41          1HD       LYS  41  12.678   3.084  -4.575
   28    HD3  LYS  41          2HD       LYS  41  13.083   4.799  -4.398
   29    HE2  LYS  41          1HE       LYS  41  15.118   4.188  -3.130
   30    HE3  LYS  41          2HE       LYS  41  14.716   2.477  -3.304
   31    HZ1  LYS  41          1HZ       LYS  41  16.303   3.182  -4.940
   32    HZ2  LYS  41          2HZ       LYS  41  14.899   2.737  -5.683
   33    HZ3  LYS  41          3HZ       LYS  41  15.275   4.335  -5.520
   34    H    GLY  42           H        GLY  42  11.077   3.744   0.908
   35    HA2  GLY  42          1HA       GLY  42  12.594   5.088   2.209
   36    HA3  GLY  42          2HA       GLY  42  12.152   6.496   1.261
   37    H    SER  43           H        SER  43   9.361   4.769   1.917
   38    HA   SER  43           HA       SER  43   8.310   6.802   3.638
   39    HB2  SER  43          1HB       SER  43   6.858   5.529   2.176
   40    HB3  SER  43          2HB       SER  43   7.319   4.020   2.950
   41    HG   SER  43           HG       SER  43   6.539   5.108   4.926
   42    H    ALA  44           H        ALA  44   8.340   7.056   5.763
   43    HA   ALA  44           HA       ALA  44   9.045   4.678   7.426
   44    HB1  ALA  44          1HB       ALA  44   9.917   6.276   9.099
   45    HB2  ALA  44          2HB       ALA  44  10.767   6.422   7.543
   46    HB3  ALA  44          3HB       ALA  44   9.537   7.622   8.002
   47    H    PHE  45           H        PHE  45   7.936   4.310   9.340
   48    HA   PHE  45           HA       PHE  45   5.313   5.738   9.487
   49    HB2  PHE  45          1HB       PHE  45   5.803   2.752   9.832
   50    HB3  PHE  45          2HB       PHE  45   4.260   3.566  10.038
   51    HD1  PHE  45           HD1      PHE  45   6.764   2.421   7.620
   52    HD2  PHE  45           HD2      PHE  45   2.989   4.355   8.132
   53    HE1  PHE  45           HE1      PHE  45   6.282   2.110   5.216
   54    HE2  PHE  45           HE2      PHE  45   2.502   4.044   5.729
   55    HZ   PHE  45           HZ       PHE  45   4.150   2.924   4.269
   56    H    VAL  46           H        VAL  46   4.687   6.422  11.432
   57    HA   VAL  46           HA       VAL  46   5.942   5.121  13.813
   58    HB   VAL  46           HB       VAL  46   5.066   8.028  13.537
   59   HG11  VAL  46          1HG1      VAL  46   6.033   8.313  15.766
   60   HG12  VAL  46          2HG1      VAL  46   4.671   7.167  15.771
   61   HG13  VAL  46          3HG1      VAL  46   6.343   6.562  15.854
   62   HG21  VAL  46          1HG2      VAL  46   7.481   8.515  13.763
   63   HG22  VAL  46          2HG2      VAL  46   7.829   6.770  13.782
   64   HG23  VAL  46          3HG2      VAL  46   7.156   7.528  12.320
   65    H    ARG  47           H        ARG  47   4.561   4.082  15.063
   66    HA   ARG  47           HA       ARG  47   1.689   4.899  14.968
   67    HB2  ARG  47          1HB       ARG  47   1.987   2.609  14.251
   68    HB3  ARG  47          2HB       ARG  47   2.990   2.242  15.647
   69    HG2  ARG  47          1HG       ARG  47   1.161   2.250  17.118
   70    HG3  ARG  47          2HG       ARG  47   0.120   3.115  15.963
   71    HD2  ARG  47          1HD       ARG  47   1.243   0.393  15.400
   72    HD3  ARG  47          2HD       ARG  47  -0.289   0.645  16.267
   73    HE   ARG  47           HE       ARG  47  -0.492   2.169  13.968
   74   HH11  ARG  47          1HH1      ARG  47   0.052  -1.220  14.722
   75   HH12  ARG  47          2HH1      ARG  47  -0.716  -1.797  13.261
   76   HH21  ARG  47          1HH2      ARG  47  -1.486   1.405  12.073
   77   HH22  ARG  47          2HH2      ARG  47  -1.586  -0.313  11.761
   78    H    ALA  48           H        ALA  48   1.201   6.202  16.595
   79    HA   ALA  48           HA       ALA  48   2.530   5.961  19.187
   80    HB1  ALA  48          1HB       ALA  48   1.034   7.815  19.851
   81    HB2  ALA  48          2HB       ALA  48   1.891   8.171  18.332
   82    HB3  ALA  48          3HB       ALA  48   0.183   7.675  18.296
   83    H    TYR  49           H        TYR  49   1.592   5.408  21.150
   84    HA   TYR  49           HA       TYR  49  -1.134   4.282  21.123
   85    HB2  TYR  49          1HB       TYR  49   0.220   2.344  20.484
   86    HB3  TYR  49          2HB       TYR  49   1.321   2.625  21.826
   87    HD1  TYR  49           HD1      TYR  49  -2.215   1.786  21.011
   88    HD2  TYR  49           HD2      TYR  49   0.919   1.704  23.940
   89    HE1  TYR  49           HE1      TYR  49  -3.602   0.335  22.455
   90    HE2  TYR  49           HE2      TYR  49  -0.466   0.253  25.383
   91    HH   TYR  49           HH       TYR  49  -3.730  -0.755  24.386
   92    H    ASN  50           H        ASN  50  -2.191   4.637  22.948
   93    HA   ASN  50           HA       ASN  50  -0.692   5.964  25.128
   94    HB2  ASN  50          1HB       ASN  50  -2.766   6.994  24.203
   95    HB3  ASN  50          2HB       ASN  50  -3.683   5.600  24.757
   96   HD21  ASN  50          1HD2      ASN  50  -3.878   8.369  27.247
   97   HD22  ASN  50          2HD2      ASN  50  -4.191   8.238  25.549
   98    H    ALA  51           H        ALA  51   0.301   4.545  26.397
   99    HA   ALA  51           HA       ALA  51  -1.104   2.048  27.116
  100    HB1  ALA  51          1HB       ALA  51   1.069   1.380  28.087
  101    HB2  ALA  51          2HB       ALA  51   1.233   1.886  26.388
  102    HB3  ALA  51          3HB       ALA  51   1.729   2.986  27.696
  103    H    GLY  52           H        GLY  52  -1.302   5.053  28.213
  104    HA2  GLY  52          1HA       GLY  52  -0.988   4.451  31.102
  105    HA3  GLY  52          2HA       GLY  52  -1.272   6.031  30.398
  106    H    ASN  53           H        ASN  53  -2.859   5.937  32.295
  107    HA   ASN  53           HA       ASN  53  -5.435   4.740  31.357
  108    HB2  ASN  53          1HB       ASN  53  -4.443   5.276  34.174
  109    HB3  ASN  53          2HB       ASN  53  -6.103   4.840  33.786
  110   HD21  ASN  53          1HD2      ASN  53  -3.472   1.979  34.391
  111   HD22  ASN  53          2HD2      ASN  53  -3.344   3.622  34.926
  112    H    SER  54           H        SER  54  -4.210   7.345  30.656
  113    HA   SER  54           HA       SER  54  -6.596   8.962  31.252
  114    HB2  SER  54          1HB       SER  54  -5.381  10.847  32.138
  115    HB3  SER  54          2HB       SER  54  -5.023   9.438  33.125
  116    HG   SER  54           HG       SER  54  -3.446  10.803  31.299
  117    H    GLU  55           H        GLU  55  -6.575  11.039  30.039
  118    HA   GLU  55           HA       GLU  55  -5.716  10.477  27.306
  119    HB2  GLU  55          1HB       GLU  55  -7.163  12.853  28.544
  120    HB3  GLU  55          2HB       GLU  55  -6.840  12.684  26.824
  121    HG2  GLU  55          1HG       GLU  55  -8.198  10.647  26.748
  122    HG3  GLU  55          2HG       GLU  55  -8.494  10.767  28.481
  123    H    LEU  56           H        LEU  56  -4.002  11.207  26.259
  124    HA   LEU  56           HA       LEU  56  -2.420  13.394  27.532
  125    HB2  LEU  56          1HB       LEU  56  -1.353  10.795  26.371
  126    HB3  LEU  56          2HB       LEU  56  -0.355  12.158  26.884
  127    HG   LEU  56           HG       LEU  56  -2.173  10.582  28.738
  128   HD11  LEU  56          1HD1      LEU  56  -0.101   9.534  29.538
  129   HD12  LEU  56          2HD1      LEU  56  -0.409   9.162  27.825
  130   HD13  LEU  56          3HD1      LEU  56   0.815  10.377  28.267
  131   HD21  LEU  56          1HD2      LEU  56  -0.858  11.732  30.486
  132   HD22  LEU  56          2HD2      LEU  56   0.050  12.607  29.229
  133   HD23  LEU  56          3HD2      LEU  56  -1.692  12.903  29.439
  134    H    ASP  57           H        ASP  57  -1.259  14.730  26.164
  135    HA   ASP  57           HA       ASP  57  -2.192  14.769  23.379
  136    HB2  ASP  57          1HB       ASP  57  -0.355  16.625  24.944
  137    HB3  ASP  57          2HB       ASP  57  -0.811  16.878  23.265
  138    H    VAL  58           H        VAL  58  -1.144  14.049  21.663
  139    HA   VAL  58           HA       VAL  58   1.731  13.309  22.014
  140    HB   VAL  58           HB       VAL  58  -0.400  11.837  20.407
  141   HG11  VAL  58          1HG1      VAL  58   1.350  10.182  19.979
  142   HG12  VAL  58          2HG1      VAL  58   1.759  11.773  19.298
  143   HG13  VAL  58          3HG1      VAL  58   2.535  11.223  20.802
  144   HG21  VAL  58          1HG2      VAL  58  -0.015  10.025  22.046
  145   HG22  VAL  58          2HG2      VAL  58   1.125  11.069  22.930
  146   HG23  VAL  58          3HG2      VAL  58  -0.599  11.504  22.846
  147    H    SER  59           H        SER  59   3.117  14.095  20.573
  148    HA   SER  59           HA       SER  59   2.054  15.100  17.981
  149    HB2  SER  59          1HB       SER  59   2.162  17.033  19.469
  150    HB3  SER  59          2HB       SER  59   3.819  16.646  19.905
  151    HG   SER  59           HG       SER  59   3.875  16.680  17.367
  152    H    VAL  60           H        VAL  60   3.157  14.305  16.349
  153    HA   VAL  60           HA       VAL  60   6.059  13.731  16.767
  154    HB   VAL  60           HB       VAL  60   4.079  12.096  15.123
  155   HG11  VAL  60          1HG1      VAL  60   5.954  10.563  14.774
  156   HG12  VAL  60          2HG1      VAL  60   6.272  12.172  14.085
  157   HG13  VAL  60          3HG1      VAL  60   7.035  11.692  15.621
  158   HG21  VAL  60          1HG2      VAL  60   4.536  10.332  16.798
  159   HG22  VAL  60          2HG2      VAL  60   5.569  11.462  17.704
  160   HG23  VAL  60          3HG2      VAL  60   3.823  11.772  17.560
  161    H    GLY  61           H        GLY  61   7.095  15.269  15.679
  162    HA2  GLY  61          1HA       GLY  61   7.904  16.403  13.811
  163    HA3  GLY  61          2HA       GLY  61   6.878  15.407  12.797
  164    H    SER  62           H        SER  62   5.281  16.418  11.759
  165    HA   SER  62           HA       SER  62   4.584  19.165  12.670
  166    HB2  SER  62          1HB       SER  62   3.877  19.562  10.378
  167    HB3  SER  62          2HB       SER  62   5.517  18.933  10.396
  168    HG   SER  62           HG       SER  62   3.305  17.238  10.173
  169    H    THR  63           H        THR  63   3.410  16.051  12.798
  170    HA   THR  63           HA       THR  63   0.577  17.007  12.741
  171    HB   THR  63           HB       THR  63   1.648  14.202  12.211
  172    HG1  THR  63           HG1      THR  63   0.159  15.602  10.323
  173   HG21  THR  63          1HG2      THR  63  -0.692  13.668  11.658
  174   HG22  THR  63          2HG2      THR  63  -0.543  14.189  13.352
  175   HG23  THR  63          3HG2      THR  63  -1.183  15.312  12.129
  176    H    SER  64           H        SER  64  -0.725  16.654  14.446
  177    HA   SER  64           HA       SER  64   0.358  15.122  16.743
  178    HB2  SER  64          1HB       SER  64   0.057  16.972  18.279
  179    HB3  SER  64          2HB       SER  64   1.159  17.454  16.999
  180    HG   SER  64           HG       SER  64  -0.885  18.721  17.731
  181    H    LEU  65           H        LEU  65  -1.200  14.663  18.390
  182    HA   LEU  65           HA       LEU  65  -4.018  15.291  17.681
  183    HB2  LEU  65          1HB       LEU  65  -3.601  13.050  16.807
  184    HB3  LEU  65          2HB       LEU  65  -2.926  12.537  18.356
  185    HG   LEU  65           HG       LEU  65  -5.172  12.864  19.401
  186   HD11  LEU  65          1HD1      LEU  65  -7.113  13.161  17.927
  187   HD12  LEU  65          2HD1      LEU  65  -6.016  14.560  17.859
  188   HD13  LEU  65          3HD1      LEU  65  -6.025  13.371  16.535
  189   HD21  LEU  65          1HD2      LEU  65  -6.180  10.868  18.344
  190   HD22  LEU  65          2HD2      LEU  65  -5.078  11.046  16.957
  191   HD23  LEU  65          3HD2      LEU  65  -4.427  10.658  18.568
  192    H    ASN  66           H        ASN  66  -5.003  16.201  19.331
  193    HA   ASN  66           HA       ASN  66  -3.712  16.060  21.981
  194    HB2  ASN  66          1HB       ASN  66  -5.991  17.760  20.915
  195    HB3  ASN  66          2HB       ASN  66  -5.368  17.854  22.557
  196   HD21  ASN  66          1HD2      ASN  66  -3.779  20.293  20.068
  197   HD22  ASN  66          2HD2      ASN  66  -5.416  19.749  20.215
  198    H    ASP  67           H        ASP  67  -4.739  15.520  23.897
  199    HA   ASP  67           HA       ASP  67  -6.068  14.185  25.224
  200    HB2  ASP  67          1HB       ASP  67  -8.210  15.089  23.254
  201    HB3  ASP  67          2HB       ASP  67  -8.526  14.314  24.800
  202    H    VAL  68           H        VAL  68  -4.610  12.574  23.832
  203    HA   VAL  68           HA       VAL  68  -6.133  10.725  22.186
  204    HB   VAL  68           HB       VAL  68  -3.424  10.422  23.551
  205   HG11  VAL  68          1HG1      VAL  68  -3.051   8.585  21.980
  206   HG12  VAL  68          2HG1      VAL  68  -4.414   8.257  23.076
  207   HG13  VAL  68          3HG1      VAL  68  -4.723   8.748  21.393
  208   HG21  VAL  68          1HG2      VAL  68  -2.535  10.912  21.294
  209   HG22  VAL  68          2HG2      VAL  68  -4.194  11.151  20.695
  210   HG23  VAL  68          3HG2      VAL  68  -3.517  12.265  21.907
  211    H    ALA  69           H        ALA  69  -7.457   9.181  22.836
  212    HA   ALA  69           HA       ALA  69  -8.062   8.901  25.619
  213    HB1  ALA  69          1HB       ALA  69  -9.632   7.139  24.874
  214    HB2  ALA  69          2HB       ALA  69  -9.758   8.603  23.870
  215    HB3  ALA  69          3HB       ALA  69  -8.892   7.175  23.257
  216    HA   PRO  70           HA       PRO  70  -5.368   5.844  27.146
  217    HB2  PRO  70          1HB       PRO  70  -7.926   4.598  28.234
  218    HB3  PRO  70          2HB       PRO  70  -6.401   4.915  29.072
  219    HG2  PRO  70          1HG       PRO  70  -8.425   6.587  29.482
  220    HG3  PRO  70          2HG       PRO  70  -6.811   7.257  29.229
  221    HD2  PRO  70          1HD       PRO  70  -9.119   7.017  27.259
  222    HD3  PRO  70          2HD       PRO  70  -7.978   8.400  27.519
  223    H    LEU  71           H        LEU  71  -4.549   4.045  26.223
  224    HA   LEU  71           HA       LEU  71  -4.381   2.122  24.968
  225    HB2  LEU  71          1HB       LEU  71  -7.380   1.832  25.343
  226    HB3  LEU  71          2HB       LEU  71  -6.233   0.563  24.900
  227    HG   LEU  71           HG       LEU  71  -6.384   1.979  27.584
  228   HD11  LEU  71          1HD1      LEU  71  -7.125  -0.219  28.390
  229   HD12  LEU  71          2HD1      LEU  71  -8.238   0.444  27.171
  230   HD13  LEU  71          3HD1      LEU  71  -7.091  -0.840  26.723
  231   HD21  LEU  71          1HD2      LEU  71  -4.677   0.325  28.264
  232   HD22  LEU  71          2HD2      LEU  71  -4.608  -0.291  26.595
  233   HD23  LEU  71          3HD2      LEU  71  -4.073   1.368  26.955
  234    H    GLY  72           H        GLY  72  -5.330   4.840  23.892
  235    HA2  GLY  72          1HA       GLY  72  -6.549   4.004  21.331
  236    HA3  GLY  72          2HA       GLY  72  -6.184   5.646  21.825
  237    H    SER  73           H        SER  73  -5.369   5.608  19.509
  238    HA   SER  73           HA       SER  73  -2.473   5.267  19.517
  239    HB2  SER  73          1HB       SER  73  -2.328   3.664  17.728
  240    HB3  SER  73          2HB       SER  73  -3.291   2.962  19.018
  241    HG   SER  73           HG       SER  73  -3.978   3.716  16.487
  242    H    SER  74           H        SER  74  -1.504   5.920  17.412
  243    HA   SER  74           HA       SER  74  -3.240   7.333  15.533
  244    HB2  SER  74          1HB       SER  74  -3.038   9.022  17.293
  245    HB3  SER  74          2HB       SER  74  -1.288   8.866  17.280
  246    HG   SER  74           HG       SER  74  -1.825   9.272  14.845
  247    H    ASP  75           H        ASP  75  -2.458   6.894  13.610
  248    HA   ASP  75           HA       ASP  75   0.340   5.989  13.387
  249    HB2  ASP  75          1HB       ASP  75  -2.034   5.940  11.495
  250    HB3  ASP  75          2HB       ASP  75  -0.414   5.494  10.977
  251    H    PHE  76           H        PHE  76   1.951   7.008  12.355
  252    HA   PHE  76           HA       PHE  76   1.238   9.476  10.822
  253    HB2  PHE  76          1HB       PHE  76   3.826   8.945  12.335
  254    HB3  PHE  76          2HB       PHE  76   3.416  10.407  11.453
  255    HD1  PHE  76           HD1      PHE  76   2.847   8.463  14.497
  256    HD2  PHE  76           HD2      PHE  76   1.801  11.999  12.339
  257    HE1  PHE  76           HE1      PHE  76   1.842   9.415  16.546
  258    HE2  PHE  76           HE2      PHE  76   0.798  12.955  14.387
  259    HZ   PHE  76           HZ       PHE  76   0.817  11.661  16.491
  260    H    LYS  77           H        LYS  77   1.206   8.732   8.755
  261    HA   LYS  77           HA       LYS  77   3.145   6.584   8.079
  262    HB2  LYS  77          1HB       LYS  77   0.574   7.443   6.690
  263    HB3  LYS  77          2HB       LYS  77   1.595   6.101   6.194
  264    HG2  LYS  77          1HG       LYS  77   1.161   4.994   8.381
  265    HG3  LYS  77          2HG       LYS  77   0.072   6.323   8.807
  266    HD2  LYS  77          1HD       LYS  77  -1.328   5.809   6.832
  267    HD3  LYS  77          2HD       LYS  77  -0.239   4.480   6.407
  268    HE2  LYS  77          1HE       LYS  77  -0.752   3.367   8.553
  269    HE3  LYS  77          2HE       LYS  77  -1.830   4.697   8.990
  270    HZ1  LYS  77          1HZ       LYS  77  -3.033   2.846   8.088
  271    HZ2  LYS  77          2HZ       LYS  77  -3.183   4.148   7.088
  272    HZ3  LYS  77          3HZ       LYS  77  -2.179   2.906   6.679
  273    H    PHE  78           H        PHE  78   4.344   6.578   6.161
  274    HA   PHE  78           HA       PHE  78   5.240   7.358   4.187
  275    HB2  PHE  78          1HB       PHE  78   3.077   9.495   4.212
  276    HB3  PHE  78          2HB       PHE  78   3.984   8.913   2.825
  277    HD1  PHE  78           HD1      PHE  78   0.876   8.875   4.108
  278    HD2  PHE  78           HD2      PHE  78   3.861   6.089   2.851
  279    HE1  PHE  78           HE1      PHE  78  -0.883   7.194   3.666
  280    HE2  PHE  78           HE2      PHE  78   2.105   4.406   2.406
  281    HZ   PHE  78           HZ       PHE  78  -0.268   4.960   2.814
  282    H    LEU  79           H        LEU  79   6.122   8.340   6.774
  283    HA   LEU  79           HA       LEU  79   6.858  11.143   6.319
  284    HB2  LEU  79          1HB       LEU  79   7.710   9.154   8.453
  285    HB3  LEU  79          2HB       LEU  79   8.141  10.867   8.435
  286    HG   LEU  79           HG       LEU  79   5.318   9.764   8.682
  287   HD11  LEU  79          1HD1      LEU  79   5.483  10.562  10.998
  288   HD12  LEU  79          2HD1      LEU  79   6.694   9.304  10.648
  289   HD13  LEU  79          3HD1      LEU  79   7.181  11.014  10.722
  290   HD21  LEU  79          1HD2      LEU  79   4.743  12.117   9.172
  291   HD22  LEU  79          2HD2      LEU  79   6.431  12.595   8.871
  292   HD23  LEU  79          3HD2      LEU  79   5.436  11.954   7.541
  293    HA   PRO  80           HA       PRO  80  10.599  10.182   4.212
  294    HB2  PRO  80          1HB       PRO  80  11.793  12.645   4.353
  295    HB3  PRO  80          2HB       PRO  80  10.415  12.332   3.290
  296    HG2  PRO  80          1HG       PRO  80  10.438  13.577   6.072
  297    HG3  PRO  80          2HG       PRO  80   9.619  14.161   4.619
  298    HD2  PRO  80          1HD       PRO  80   8.297  12.706   6.510
  299    HD3  PRO  80          2HD       PRO  80   7.906  12.548   4.751
  300    HA   PRO  81           HA       PRO  81  13.401   9.097   7.410
  301    HB2  PRO  81          1HB       PRO  81  15.551   9.822   5.393
  302    HB3  PRO  81          2HB       PRO  81  15.365   8.337   6.335
  303    HG2  PRO  81          1HG       PRO  81  14.663   8.303   3.766
  304    HG3  PRO  81          2HG       PRO  81  13.620   7.506   4.947
  305    HD2  PRO  81          1HD       PRO  81  13.312  10.248   3.658
  306    HD3  PRO  81          2HD       PRO  81  12.056   8.980   3.951
  307    H    GLY  82           H        GLY  82  14.628  10.097   8.996
  308    HA2  GLY  82          1HA       GLY  82  16.335  12.159   9.085
  309    HA3  GLY  82          2HA       GLY  82  14.854  13.047   8.782
  310    H    SER  83           H        SER  83  15.654  13.947  10.948
  311    HA   SER  83           HA       SER  83  14.931  12.217  13.243
  312    HB2  SER  83          1HB       SER  83  17.017  13.441  13.433
  313    HB3  SER  83          2HB       SER  83  16.216  14.959  13.059
  314    HG   SER  83           HG       SER  83  14.957  14.648  14.929
  315    H    TYR  84           H        TYR  84  13.183  12.472  14.484
  316    HA   TYR  84           HA       TYR  84  11.435  14.828  13.914
  317    HB2  TYR  84          1HB       TYR  84  10.640  11.909  14.226
  318    HB3  TYR  84          2HB       TYR  84   9.489  13.232  14.350
  319    HD1  TYR  84           HD1      TYR  84  11.942  11.617  12.068
  320    HD2  TYR  84           HD2      TYR  84   8.558  14.229  12.437
  321    HE1  TYR  84           HE1      TYR  84  11.664  11.607   9.611
  322    HE2  TYR  84           HE2      TYR  84   8.280  14.219   9.981
  323    HH   TYR  84           HH       TYR  84  10.390  12.259   7.900
  324    H    THR  85           H        THR  85  10.205  15.640  15.604
  325    HA   THR  85           HA       THR  85  11.144  14.844  18.300
  326    HB   THR  85           HB       THR  85   9.455  17.216  17.397
  327    HG1  THR  85           HG1      THR  85  11.529  18.240  18.201
  328   HG21  THR  85          1HG2      THR  85   9.812  18.054  19.685
  329   HG22  THR  85          2HG2      THR  85   8.925  16.511  19.705
  330   HG23  THR  85          3HG2      THR  85  10.656  16.547  20.109
  331    H    ALA  86           H        ALA  86  10.060  13.436  19.449
  332    HA   ALA  86           HA       ALA  86   7.143  13.139  18.910
  333    HB1  ALA  86          1HB       ALA  86   7.374  10.876  19.880
  334    HB2  ALA  86          2HB       ALA  86   8.448  11.106  18.481
  335    HB3  ALA  86          3HB       ALA  86   9.110  11.170  20.130
  336    H    GLN  87           H        GLN  87   6.235  14.611  20.242
  337    HA   GLN  87           HA       GLN  87   7.074  14.638  23.086
  338    HB2  GLN  87          1HB       GLN  87   6.833  16.807  21.921
  339    HB3  GLN  87          2HB       GLN  87   5.155  16.438  21.552
  340    HG2  GLN  87          1HG       GLN  87   4.620  16.413  23.946
  341    HG3  GLN  87          2HG       GLN  87   6.325  16.791  24.318
  342   HE21  GLN  87          1HE2      GLN  87   4.285  19.921  24.383
  343   HE22  GLN  87          2HE2      GLN  87   4.201  18.392  25.193
  344    H    VAL  88           H        VAL  88   6.009  13.609  24.627
  345    HA   VAL  88           HA       VAL  88   3.063  13.294  24.254
  346    HB   VAL  88           HB       VAL  88   4.971  11.368  25.648
  347   HG11  VAL  88          1HG1      VAL  88   2.991   9.988  26.056
  348   HG12  VAL  88          2HG1      VAL  88   2.888  11.562  26.880
  349   HG13  VAL  88          3HG1      VAL  88   1.958  11.275  25.389
  350   HG21  VAL  88          1HG2      VAL  88   4.207   9.787  23.903
  351   HG22  VAL  88          2HG2      VAL  88   3.218  11.074  23.172
  352   HG23  VAL  88          3HG2      VAL  88   4.992  11.211  23.182
  353    H    GLY  89           H        GLY  89   1.957  14.469  25.648
  354    HA2  GLY  89          1HA       GLY  89   1.353  15.564  27.603
  355    HA3  GLY  89          2HA       GLY  89   2.487  14.542  28.467
  356    H    GLN  90           H        GLN  90   4.312  15.430  29.250
  357    HA   GLN  90           HA       GLN  90   4.818  18.274  28.497
  358    HB2  GLN  90          1HB       GLN  90   5.457  16.797  31.084
  359    HB3  GLN  90          2HB       GLN  90   5.855  18.478  30.752
  360    HG2  GLN  90          1HG       GLN  90   3.058  17.329  30.853
  361    HG3  GLN  90          2HG       GLN  90   3.864  18.258  32.148
  362   HE21  GLN  90          1HE2      GLN  90   1.694  20.213  29.514
  363   HE22  GLN  90          2HE2      GLN  90   1.523  18.553  29.979
  364    H    GLN  91           H        GLN  91   6.026  15.176  28.129
  365    HA   GLN  91           HA       GLN  91   8.838  16.181  27.977
  366    HB2  GLN  91          1HB       GLN  91   7.839  13.338  28.425
  367    HB3  GLN  91          2HB       GLN  91   9.526  13.812  28.285
  368    HG2  GLN  91          1HG       GLN  91   7.636  14.800  30.430
  369    HG3  GLN  91          2HG       GLN  91   8.800  13.456  30.609
  370   HE21  GLN  91          1HE2      GLN  91   9.979  17.091  31.541
  371   HE22  GLN  91          2HE2      GLN  91   8.355  16.487  31.550
  372    H    SER  92           H        SER  92  10.203  15.215  26.326
  373    HA   SER  92           HA       SER  92   8.781  14.069  24.005
  374    HB2  SER  92          1HB       SER  92   9.571  15.753  22.458
  375    HB3  SER  92          2HB       SER  92   8.629  16.531  23.720
  376    HG   SER  92           HG       SER  92  11.433  16.316  23.597
  377    H    LEU  93           H        LEU  93  10.089  12.960  22.572
  378    HA   LEU  93           HA       LEU  93  13.001  12.922  23.185
  379    HB2  LEU  93          1HB       LEU  93  11.185  10.508  22.876
  380    HB3  LEU  93          2HB       LEU  93  12.949  10.426  22.831
  381    HG   LEU  93           HG       LEU  93  11.360  11.436  25.214
  382   HD11  LEU  93          1HD1      LEU  93  11.842   9.246  26.210
  383   HD12  LEU  93          2HD1      LEU  93  10.833   9.098  24.754
  384   HD13  LEU  93          3HD1      LEU  93  12.566   8.708  24.679
  385   HD21  LEU  93          1HD2      LEU  93  13.516  11.110  26.378
  386   HD22  LEU  93          2HD2      LEU  93  14.266  10.598  24.847
  387   HD23  LEU  93          3HD2      LEU  93  13.681  12.268  25.037
  388    HA   PRO  94           HA       PRO  94  13.365  13.186  18.873
  389    HB2  PRO  94          1HB       PRO  94  15.924  12.272  18.492
  390    HB3  PRO  94          2HB       PRO  94  15.586  13.812  19.292
  391    HG2  PRO  94          1HG       PRO  94  16.165  11.095  20.545
  392    HG3  PRO  94          2HG       PRO  94  16.880  12.657  20.947
  393    HD2  PRO  94          1HD       PRO  94  14.813  11.631  22.398
  394    HD3  PRO  94          2HD       PRO  94  14.969  13.410  22.105
  395    H    VAL  95           H        VAL  95  13.118  11.955  17.009
  396    HA   VAL  95           HA       VAL  95  13.302   8.990  17.337
  397    HB   VAL  95           HB       VAL  95  11.209  10.572  15.785
  398   HG11  VAL  95          1HG1      VAL  95  10.194   8.396  15.315
  399   HG12  VAL  95          2HG1      VAL  95  11.822   8.536  14.614
  400   HG13  VAL  95          3HG1      VAL  95  11.570   7.586  16.097
  401   HG21  VAL  95          1HG2      VAL  95   9.637   9.583  17.421
  402   HG22  VAL  95          2HG2      VAL  95  11.003   8.816  18.266
  403   HG23  VAL  95          3HG2      VAL  95  10.862  10.590  18.231
  404    H    LYS  96           H        LYS  96  14.640   8.037  15.972
  405    HA   LYS  96           HA       LYS  96  15.418   9.482  13.492
  406    HB2  LYS  96          1HB       LYS  96  17.241   8.672  14.966
  407    HB3  LYS  96          2HB       LYS  96  16.638   7.027  14.817
  408    HG2  LYS  96          1HG       LYS  96  17.131   7.029  12.419
  409    HG3  LYS  96          2HG       LYS  96  17.666   8.713  12.515
  410    HD2  LYS  96          1HD       LYS  96  19.424   8.014  14.158
  411    HD3  LYS  96          2HD       LYS  96  18.927   6.332  13.925
  412    HE2  LYS  96          1HE       LYS  96  19.853   8.145  11.671
  413    HE3  LYS  96          2HE       LYS  96  20.919   7.047  12.550
  414    HZ1  LYS  96          1HZ       LYS  96  20.110   6.064  10.533
  415    HZ2  LYS  96          2HZ       LYS  96  19.537   5.222  11.831
  416    HZ3  LYS  96          3HZ       LYS  96  18.543   6.248  11.008
  417    H    LEU  97           H        LEU  97  14.225   9.095  11.783
  418    HA   LEU  97           HA       LEU  97  13.144   6.341  11.411
  419    HB2  LEU  97          1HB       LEU  97  12.311   8.989  10.177
  420    HB3  LEU  97          2HB       LEU  97  11.608   7.423   9.764
  421    HG   LEU  97           HG       LEU  97  11.443   8.828  12.453
  422   HD11  LEU  97          1HD1      LEU  97   9.050   8.944  11.915
  423   HD12  LEU  97          2HD1      LEU  97  10.038   9.800  10.707
  424   HD13  LEU  97          3HD1      LEU  97   9.369   8.195  10.333
  425   HD21  LEU  97          1HD2      LEU  97   9.989   6.933  13.088
  426   HD22  LEU  97          2HD2      LEU  97  10.319   6.153  11.523
  427   HD23  LEU  97          3HD2      LEU  97  11.634   6.375  12.702
  428    H    ASP  98           H        ASP  98  13.664   5.125   9.693
  429    HA   ASP  98           HA       ASP  98  15.668   6.306   7.814
  430    HB2  ASP  98          1HB       ASP  98  15.378   3.445   8.813
  431    HB3  ASP  98          2HB       ASP  98  16.493   3.943   7.551
  432    HA   PRO  99           HA       PRO  99  13.325   5.407   4.246
  433    HB2  PRO  99          1HB       PRO  99  15.627   3.598   3.409
  434    HB3  PRO  99          2HB       PRO  99  14.794   4.842   2.468
  435    HG2  PRO  99          1HG       PRO  99  17.172   5.436   3.493
  436    HG3  PRO  99          2HG       PRO  99  15.877   6.632   3.610
  437    HD2  PRO  99          1HD       PRO  99  16.898   4.698   5.729
  438    HD3  PRO  99          2HD       PRO  99  16.444   6.443   5.900
  439    H    ASP 100           H        ASP 100  11.631   4.060   4.210
  440    HA   ASP 100           HA       ASP 100  10.325   2.185   4.490
  441    HB2  ASP 100          1HB       ASP 100  12.882   0.733   3.696
  442    HB3  ASP 100          2HB       ASP 100  11.268   0.036   3.692
  443    H    SER 101           H        SER 101  10.614   2.952   6.840
  444    HA   SER 101           HA       SER 101  11.437   0.574   8.416
  445    HB2  SER 101          1HB       SER 101  12.685   1.867   9.996
  446    HB3  SER 101          2HB       SER 101  13.320   2.234   8.400
  447    HG   SER 101           HG       SER 101  12.264   4.123   8.393
  448    H    TYR 102           H        TYR 102  10.531   0.503  10.558
  449    HA   TYR 102           HA       TYR 102   8.056   2.166  10.782
  450    HB2  TYR 102          1HB       TYR 102   8.502  -0.750  11.537
  451    HB3  TYR 102          2HB       TYR 102   7.085   0.177  12.011
  452    HD1  TYR 102           HD1      TYR 102   8.972  -1.110   9.080
  453    HD2  TYR 102           HD2      TYR 102   5.270   0.496  10.540
  454    HE1  TYR 102           HE1      TYR 102   7.877  -1.690   6.942
  455    HE2  TYR 102           HE2      TYR 102   4.175  -0.084   8.402
  456    HH   TYR 102           HH       TYR 102   4.426  -0.970   6.387
  457    H    TYR 103           H        TYR 103   7.215   2.397  12.995
  458    HA   TYR 103           HA       TYR 103   9.160   2.204  15.166
  459    HB2  TYR 103          1HB       TYR 103   9.571   4.366  13.593
  460    HB3  TYR 103          2HB       TYR 103   8.316   5.024  14.633
  461    HD1  TYR 103           HD1      TYR 103  11.748   3.716  14.493
  462    HD2  TYR 103           HD2      TYR 103   8.703   5.424  16.986
  463    HE1  TYR 103           HE1      TYR 103  13.436   4.178  16.239
  464    HE2  TYR 103           HE2      TYR 103  10.390   5.886  18.732
  465    HH   TYR 103           HH       TYR 103  13.812   5.049  18.249
  466    H    THR 104           H        THR 104   8.310   2.637  17.199
  467    HA   THR 104           HA       THR 104   5.371   3.168  17.238
  468    HB   THR 104           HB       THR 104   6.875   1.087  18.882
  469    HG1  THR 104           HG1      THR 104   6.168  -0.243  17.402
  470   HG21  THR 104          1HG2      THR 104   4.661   0.551  19.820
  471   HG22  THR 104          2HG2      THR 104   5.124   2.228  20.199
  472   HG23  THR 104          3HG2      THR 104   3.943   1.900  18.910
  473    H    LEU 105           H        LEU 105   4.665   4.614  18.662
  474    HA   LEU 105           HA       LEU 105   6.625   5.576  20.703
  475    HB2  LEU 105          1HB       LEU 105   6.159   7.283  19.026
  476    HB3  LEU 105          2HB       LEU 105   4.419   7.077  19.249
  477    HG   LEU 105           HG       LEU 105   4.678   7.916  21.600
  478   HD11  LEU 105          1HD1      LEU 105   6.772   9.053  22.191
  479   HD12  LEU 105          2HD1      LEU 105   7.023   7.314  21.914
  480   HD13  LEU 105          3HD1      LEU 105   7.505   8.493  20.670
  481   HD21  LEU 105          1HD2      LEU 105   4.987  10.271  20.913
  482   HD22  LEU 105          2HD2      LEU 105   5.695   9.727  19.373
  483   HD23  LEU 105          3HD2      LEU 105   3.987   9.385  19.735
  484    H    VAL 106           H        VAL 106   6.137   4.884  22.658
  485    HA   VAL 106           HA       VAL 106   3.279   4.314  23.275
  486    HB   VAL 106           HB       VAL 106   5.830   3.364  24.648
  487   HG11  VAL 106          1HG1      VAL 106   4.361   1.862  25.903
  488   HG12  VAL 106          2HG1      VAL 106   3.998   3.574  26.226
  489   HG13  VAL 106          3HG1      VAL 106   2.941   2.626  25.151
  490   HG21  VAL 106          1HG2      VAL 106   5.221   1.170  23.680
  491   HG22  VAL 106          2HG2      VAL 106   3.830   1.920  22.861
  492   HG23  VAL 106          3HG2      VAL 106   5.487   2.383  22.407
  493    H    SER 107           H        SER 107   2.195   5.596  24.589
  494    HA   SER 107           HA       SER 107   3.620   7.745  25.999
  495    HB2  SER 107          1HB       SER 107   0.663   7.083  25.795
  496    HB3  SER 107          2HB       SER 107   1.325   8.518  26.561
  497    HG   SER 107           HG       SER 107   1.675   7.731  23.881
  498    H    GLN 108           H        GLN 108   4.163   7.773  28.060
  499    HA   GLN 108           HA       GLN 108   3.234   5.525  29.766
  500    HB2  GLN 108          1HB       GLN 108   5.510   7.511  30.163
  501    HB3  GLN 108          2HB       GLN 108   5.113   6.195  31.258
  502    HG2  GLN 108          1HG       GLN 108   5.599   4.562  29.492
  503    HG3  GLN 108          2HG       GLN 108   6.009   5.902  28.383
  504   HE21  GLN 108          1HE2      GLN 108   9.131   4.502  29.874
  505   HE22  GLN 108          2HE2      GLN 108   7.811   3.850  28.961
  506    HA   PRO 109           HA       PRO 109   0.531   7.874  32.249
  507    HB2  PRO 109          1HB       PRO 109   2.043   6.563  34.545
  508    HB3  PRO 109          2HB       PRO 109   0.297   6.704  34.302
  509    HG2  PRO 109          1HG       PRO 109   1.452   4.375  33.753
  510    HG3  PRO 109          2HG       PRO 109   0.251   5.011  32.627
  511    HD2  PRO 109          1HD       PRO 109   3.287   5.076  32.431
  512    HD3  PRO 109          2HD       PRO 109   2.069   4.727  31.140
  513    H    GLY 110           H        GLY 110   0.653   9.930  32.969
  514    HA2  GLY 110          1HA       GLY 110   1.605  11.681  34.346
  515    HA3  GLY 110          2HA       GLY 110   3.163  10.883  34.268
  516    H    GLY 111           H        GLY 111   2.252  10.475  31.234
  517    HA2  GLY 111          1HA       GLY 111   2.268  11.768  29.255
  518    HA3  GLY 111          2HA       GLY 111   2.562  13.216  30.200
  519    H    LYS 112           H        LYS 112   4.169  10.104  29.409
  520    HA   LYS 112           HA       LYS 112   6.566  11.659  28.606
  521    HB2  LYS 112          1HB       LYS 112   6.952  10.899  30.946
  522    HB3  LYS 112          2HB       LYS 112   6.664   9.237  30.447
  523    HG2  LYS 112          1HG       LYS 112   8.632   9.285  29.006
  524    HG3  LYS 112          2HG       LYS 112   8.897  10.992  29.386
  525    HD2  LYS 112          1HD       LYS 112   9.205  10.414  31.773
  526    HD3  LYS 112          2HD       LYS 112   8.943   8.705  31.390
  527    HE2  LYS 112          1HE       LYS 112  10.919   8.728  29.908
  528    HE3  LYS 112          2HE       LYS 112  11.177  10.437  30.267
  529    HZ1  LYS 112          1HZ       LYS 112  12.570   9.034  31.601
  530    HZ2  LYS 112          2HZ       LYS 112  11.506   9.842  32.569
  531    HZ3  LYS 112          3HZ       LYS 112  11.265   8.246  32.233
  532    HA   PRO 113           HA       PRO 113   6.104   8.915  25.250
  533    HB2  PRO 113          1HB       PRO 113   8.264   9.724  23.766
  534    HB3  PRO 113          2HB       PRO 113   6.819  10.727  23.946
  535    HG2  PRO 113          1HG       PRO 113   9.443  10.866  25.489
  536    HG3  PRO 113          2HG       PRO 113   8.544  12.189  24.740
  537    HD2  PRO 113          1HD       PRO 113   8.312  11.636  27.402
  538    HD3  PRO 113          2HD       PRO 113   6.907  12.239  26.434
  539    H    GLN 114           H        GLN 114   6.940   6.934  24.581
  540    HA   GLN 114           HA       GLN 114   9.645   6.191  25.610
  541    HB2  GLN 114          1HB       GLN 114   7.919   4.985  26.891
  542    HB3  GLN 114          2HB       GLN 114   7.188   4.405  25.400
  543    HG2  GLN 114          1HG       GLN 114   9.227   3.142  24.878
  544    HG3  GLN 114          2HG       GLN 114   9.964   3.728  26.396
  545   HE21  GLN 114          1HE2      GLN 114   8.134   0.307  26.559
  546   HE22  GLN 114          2HE2      GLN 114   9.025   1.002  25.245
  547    H    LEU 115           H        LEU 115  11.059   5.621  24.127
  548    HA   LEU 115           HA       LEU 115  10.148   5.557  21.334
  549    HB2  LEU 115          1HB       LEU 115  12.933   5.423  22.545
  550    HB3  LEU 115          2HB       LEU 115  12.578   5.545  20.818
  551    HG   LEU 115           HG       LEU 115  11.931   7.646  22.918
  552   HD11  LEU 115          1HD1      LEU 115  13.682   8.936  21.783
  553   HD12  LEU 115          2HD1      LEU 115  14.321   7.426  22.472
  554   HD13  LEU 115          3HD1      LEU 115  14.019   7.549  20.723
  555   HD21  LEU 115          1HD2      LEU 115  11.312   9.025  20.962
  556   HD22  LEU 115          2HD2      LEU 115  11.614   7.638  19.888
  557   HD23  LEU 115          3HD2      LEU 115  10.287   7.574  21.072
  558    H    VAL 116           H        VAL 116   9.563   3.754  20.370
  559    HA   VAL 116           HA       VAL 116  11.125   1.284  20.996
  560    HB   VAL 116           HB       VAL 116   8.164   1.465  20.291
  561   HG11  VAL 116          1HG1      VAL 116   8.136  -0.952  20.677
  562   HG12  VAL 116          2HG1      VAL 116   9.204  -0.505  19.325
  563   HG13  VAL 116          3HG1      VAL 116   9.900  -0.934  20.906
  564   HG21  VAL 116          1HG2      VAL 116   7.826   0.604  22.585
  565   HG22  VAL 116          2HG2      VAL 116   9.582   0.676  22.869
  566   HG23  VAL 116          3HG2      VAL 116   8.660   2.175  22.605
  567    H    ALA 117           H        ALA 117  12.393   0.866  19.326
  568    HA   ALA 117           HA       ALA 117  11.576   1.652  16.614
  569    HB1  ALA 117          1HB       ALA 117  13.827   0.854  15.967
  570    HB2  ALA 117          2HB       ALA 117  13.900   2.015  17.313
  571    HB3  ALA 117          3HB       ALA 117  14.089   0.274  17.628
  572    H    GLU 118           H        GLU 118  10.923   0.365  15.008
  573    HA   GLU 118           HA       GLU 118  10.425  -2.480  15.728
  574    HB2  GLU 118          1HB       GLU 118   9.260  -0.782  13.483
  575    HB3  GLU 118          2HB       GLU 118   8.823  -2.448  13.830
  576    HG2  GLU 118          1HG       GLU 118   8.444  -0.150  15.760
  577    HG3  GLU 118          2HG       GLU 118   7.205  -0.749  14.660
  578    HA   PRO 119           HA       PRO 119  13.416  -3.833  12.911
  579    HB2  PRO 119          1HB       PRO 119  12.576  -6.379  12.378
  580    HB3  PRO 119          2HB       PRO 119  13.147  -5.905  13.983
  581    HG2  PRO 119          1HG       PRO 119  10.284  -6.115  12.959
  582    HG3  PRO 119          2HG       PRO 119  10.958  -6.757  14.459
  583    HD2  PRO 119          1HD       PRO 119   9.613  -4.374  14.385
  584    HD3  PRO 119          2HD       PRO 119  10.990  -4.660  15.521
  Start of MODEL    9
    1    H    GLN  38          1H        GLN  38   1.942   0.911  -3.470
    2    HA   GLN  38           HA       GLN  38   2.646   0.972  -1.214
    3    HB2  GLN  38          1HB       GLN  38   4.896   0.637  -3.240
    4    HB3  GLN  38          2HB       GLN  38   4.925   0.039  -1.588
    5    HG2  GLN  38          1HG       GLN  38   2.941  -0.807  -3.710
    6    HG3  GLN  38          2HG       GLN  38   4.398  -1.714  -3.212
    7   HE21  GLN  38          1HE2      GLN  38   0.975  -2.404  -1.357
    8   HE22  GLN  38          2HE2      GLN  38   1.165  -1.723  -2.939
    9    H    ALA  39           H        ALA  39   4.534   1.537   0.184
   10    HA   ALA  39           HA       ALA  39   4.804   4.415   0.238
   11    HB1  ALA  39          1HB       ALA  39   6.208   4.008   2.233
   12    HB2  ALA  39          2HB       ALA  39   4.679   3.099   2.306
   13    HB3  ALA  39          3HB       ALA  39   6.192   2.265   1.879
   14    HA   PRO  40           HA       PRO  40   8.425   4.811  -2.120
   15    HB2  PRO  40          1HB       PRO  40   9.277   7.287  -1.324
   16    HB3  PRO  40          2HB       PRO  40   7.808   7.070  -2.285
   17    HG2  PRO  40          1HG       PRO  40   8.085   7.408   0.732
   18    HG3  PRO  40          2HG       PRO  40   6.990   8.252  -0.366
   19    HD2  PRO  40          1HD       PRO  40   6.169   6.087   1.081
   20    HD3  PRO  40          2HD       PRO  40   5.540   6.409  -0.585
   21    H    LYS  41           H        LYS  41  10.732   4.777  -1.961
   22    HA   LYS  41           HA       LYS  41  11.814   3.545   0.373
   23    HB2  LYS  41          1HB       LYS  41  12.771   3.314  -1.918
   24    HB3  LYS  41          2HB       LYS  41  13.276   4.997  -1.870
   25    HG2  LYS  41          1HG       LYS  41  14.789   4.521  -0.001
   26    HG3  LYS  41          2HG       LYS  41  14.246   2.837   0.025
   27    HD2  LYS  41          1HD       LYS  41  15.076   2.534  -2.287
   28    HD3  LYS  41          2HD       LYS  41  15.618   4.218  -2.314
   29    HE2  LYS  41          1HE       LYS  41  17.143   3.756  -0.422
   30    HE3  LYS  41          2HE       LYS  41  16.605   2.075  -0.394
   31    HZ1  LYS  41          1HZ       LYS  41  18.649   2.327  -1.598
   32    HZ2  LYS  41          2HZ       LYS  41  17.458   1.827  -2.623
   33    HZ3  LYS  41          3HZ       LYS  41  17.963   3.397  -2.648
   34    H    GLY  42           H        GLY  42  12.492   4.309   2.232
   35    HA2  GLY  42          1HA       GLY  42  13.765   5.956   3.517
   36    HA3  GLY  42          2HA       GLY  42  13.214   7.205   2.413
   37    H    SER  43           H        SER  43  10.605   5.237   2.829
   38    HA   SER  43           HA       SER  43   9.198   7.180   4.419
   39    HB2  SER  43          1HB       SER  43   7.303   5.708   4.204
   40    HB3  SER  43          2HB       SER  43   8.154   5.745   2.667
   41    HG   SER  43           HG       SER  43   9.184   3.828   3.280
   42    H    ALA  44           H        ALA  44   8.009   6.719   6.404
   43    HA   ALA  44           HA       ALA  44   8.935   4.523   8.081
   44    HB1  ALA  44          1HB       ALA  44   9.841   5.963   9.876
   45    HB2  ALA  44          2HB       ALA  44  10.796   6.094   8.380
   46    HB3  ALA  44          3HB       ALA  44   9.653   7.384   8.823
   47    H    PHE  45           H        PHE  45   7.709   4.218   9.951
   48    HA   PHE  45           HA       PHE  45   5.257   5.920  10.074
   49    HB2  PHE  45          1HB       PHE  45   5.418   2.887  10.286
   50    HB3  PHE  45          2HB       PHE  45   3.972   3.839  10.578
   51    HD1  PHE  45           HD1      PHE  45   6.358   2.696   8.018
   52    HD2  PHE  45           HD2      PHE  45   2.692   4.758   8.771
   53    HE1  PHE  45           HE1      PHE  45   5.800   2.579   5.612
   54    HE2  PHE  45           HE2      PHE  45   2.129   4.639   6.366
   55    HZ   PHE  45           HZ       PHE  45   3.684   3.551   4.786
   56    H    VAL  46           H        VAL  46   4.444   6.397  12.053
   57    HA   VAL  46           HA       VAL  46   5.816   5.149  14.398
   58    HB   VAL  46           HB       VAL  46   4.874   8.034  14.110
   59   HG11  VAL  46          1HG1      VAL  46   5.828   8.364  16.338
   60   HG12  VAL  46          2HG1      VAL  46   4.485   7.199  16.355
   61   HG13  VAL  46          3HG1      VAL  46   6.166   6.621  16.451
   62   HG21  VAL  46          1HG2      VAL  46   7.282   8.561  14.337
   63   HG22  VAL  46          2HG2      VAL  46   7.656   6.822  14.383
   64   HG23  VAL  46          3HG2      VAL  46   6.976   7.548  12.906
   65    H    ARG  47           H        ARG  47   4.523   4.170  15.795
   66    HA   ARG  47           HA       ARG  47   1.595   4.716  15.579
   67    HB2  ARG  47          1HB       ARG  47   2.143   2.434  14.971
   68    HB3  ARG  47          2HB       ARG  47   3.099   2.218  16.429
   69    HG2  ARG  47          1HG       ARG  47   1.162   2.227  17.817
   70    HG3  ARG  47          2HG       ARG  47   0.126   2.778  16.477
   71    HD2  ARG  47          1HD       ARG  47   1.643   0.184  16.458
   72    HD3  ARG  47          2HD       ARG  47  -0.030   0.356  17.039
   73    HE   ARG  47           HE       ARG  47   0.011   1.500  14.512
   74   HH11  ARG  47          1HH1      ARG  47   0.698  -1.653  15.902
   75   HH12  ARG  47          2HH1      ARG  47   0.228  -2.529  14.462
   76   HH21  ARG  47          1HH2      ARG  47  -0.596   0.351  12.649
   77   HH22  ARG  47          2HH2      ARG  47  -0.505  -1.395  12.621
   78    H    ALA  48           H        ALA  48   1.227   6.262  17.078
   79    HA   ALA  48           HA       ALA  48   2.436   6.251  19.692
   80    HB1  ALA  48          1HB       ALA  48   0.756   7.989  20.220
   81    HB2  ALA  48          2HB       ALA  48   1.570   8.309  18.671
   82    HB3  ALA  48          3HB       ALA  48  -0.078   7.638  18.688
   83    H    TYR  49           H        TYR  49   1.585   5.733  21.693
   84    HA   TYR  49           HA       TYR  49  -1.001   4.302  21.768
   85    HB2  TYR  49          1HB       TYR  49   0.637   2.517  21.312
   86    HB3  TYR  49          2HB       TYR  49   1.623   3.044  22.669
   87    HD1  TYR  49           HD1      TYR  49  -1.811   1.816  21.846
   88    HD2  TYR  49           HD2      TYR  49   1.313   2.115  24.773
   89    HE1  TYR  49           HE1      TYR  49  -3.072   0.312  23.346
   90    HE2  TYR  49           HE2      TYR  49   0.050   0.609  26.273
   91    HH   TYR  49           HH       TYR  49  -3.108  -0.718  25.315
   92    H    ASN  50           H        ASN  50  -2.133   4.752  23.515
   93    HA   ASN  50           HA       ASN  50  -0.795   6.301  25.658
   94    HB2  ASN  50          1HB       ASN  50  -2.874   7.185  24.620
   95    HB3  ASN  50          2HB       ASN  50  -3.744   5.763  25.178
   96   HD21  ASN  50          1HD2      ASN  50  -4.221   8.585  27.560
   97   HD22  ASN  50          2HD2      ASN  50  -4.448   8.376  25.857
   98    H    ALA  51           H        ALA  51   0.199   5.038  27.075
   99    HA   ALA  51           HA       ALA  51  -0.992   2.424  27.734
  100    HB1  ALA  51          1HB       ALA  51   1.146   2.016  28.909
  101    HB2  ALA  51          2HB       ALA  51   1.408   2.532  27.226
  102    HB3  ALA  51          3HB       ALA  51   1.649   3.687  28.557
  103    H    GLY  52           H        GLY  52  -1.625   5.396  28.766
  104    HA2  GLY  52          1HA       GLY  52  -1.520   4.801  31.684
  105    HA3  GLY  52          2HA       GLY  52  -1.781   6.379  30.963
  106    H    ASN  53           H        ASN  53  -3.559   6.278  32.650
  107    HA   ASN  53           HA       ASN  53  -5.986   5.002  31.457
  108    HB2  ASN  53          1HB       ASN  53  -5.338   5.634  34.352
  109    HB3  ASN  53          2HB       ASN  53  -6.931   5.152  33.790
  110   HD21  ASN  53          1HD2      ASN  53  -4.300   2.374  34.746
  111   HD22  ASN  53          2HD2      ASN  53  -4.245   4.037  35.226
  112    H    SER  54           H        SER  54  -4.655   7.667  30.961
  113    HA   SER  54           HA       SER  54  -7.192   9.177  31.093
  114    HB2  SER  54          1HB       SER  54  -6.209  11.143  32.052
  115    HB3  SER  54          2HB       SER  54  -5.873   9.798  33.131
  116    HG   SER  54           HG       SER  54  -4.197  11.256  31.501
  117    H    GLU  55           H        GLU  55  -6.929  11.326  29.879
  118    HA   GLU  55           HA       GLU  55  -6.047  10.507  27.226
  119    HB2  GLU  55          1HB       GLU  55  -7.347  13.053  28.267
  120    HB3  GLU  55          2HB       GLU  55  -6.966  12.780  26.573
  121    HG2  GLU  55          1HG       GLU  55  -8.458  10.833  26.536
  122    HG3  GLU  55          2HG       GLU  55  -8.824  11.075  28.243
  123    H    LEU  56           H        LEU  56  -4.410  11.264  25.999
  124    HA   LEU  56           HA       LEU  56  -2.502  13.111  27.372
  125    HB2  LEU  56          1HB       LEU  56  -1.946  10.870  25.396
  126    HB3  LEU  56          2HB       LEU  56  -0.732  11.990  26.022
  127    HG   LEU  56           HG       LEU  56  -2.321  10.020  27.705
  128   HD11  LEU  56          1HD1      LEU  56  -0.199   8.797  27.843
  129   HD12  LEU  56          2HD1      LEU  56  -0.789   8.901  26.168
  130   HD13  LEU  56          3HD1      LEU  56   0.543   9.951  26.711
  131   HD21  LEU  56          1HD2      LEU  56  -0.694  10.655  29.455
  132   HD22  LEU  56          2HD2      LEU  56   0.040  11.837  28.345
  133   HD23  LEU  56          3HD2      LEU  56  -1.632  12.067  28.911
  134    H    ASP  57           H        ASP  57  -1.527  14.741  26.214
  135    HA   ASP  57           HA       ASP  57  -2.675  15.244  23.506
  136    HB2  ASP  57          1HB       ASP  57  -1.374  17.135  25.505
  137    HB3  ASP  57          2HB       ASP  57  -1.852  17.597  23.877
  138    H    VAL  58           H        VAL  58  -1.445  14.603  21.892
  139    HA   VAL  58           HA       VAL  58   1.510  14.931  22.170
  140    HB   VAL  58           HB       VAL  58   1.838  12.799  21.008
  141   HG11  VAL  58          1HG1      VAL  58   1.071  11.269  22.756
  142   HG12  VAL  58          2HG1      VAL  58   1.753  12.767  23.434
  143   HG13  VAL  58          3HG1      VAL  58  -0.010  12.534  23.387
  144   HG21  VAL  58          1HG2      VAL  58  -0.087  11.309  20.562
  145   HG22  VAL  58          2HG2      VAL  58  -1.199  12.582  21.122
  146   HG23  VAL  58          3HG2      VAL  58  -0.227  12.833  19.652
  147    H    SER  59           H        SER  59   2.658  14.889  20.067
  148    HA   SER  59           HA       SER  59   1.020  15.360  17.674
  149    HB2  SER  59          1HB       SER  59   1.167  17.605  18.674
  150    HB3  SER  59          2HB       SER  59   2.919  17.476  18.739
  151    HG   SER  59           HG       SER  59   2.692  17.028  16.399
  152    H    VAL  60           H        VAL  60   1.911  14.295  16.061
  153    HA   VAL  60           HA       VAL  60   4.848  13.761  16.209
  154    HB   VAL  60           HB       VAL  60   2.648  11.840  15.334
  155   HG11  VAL  60          1HG1      VAL  60   4.445  10.188  15.156
  156   HG12  VAL  60          2HG1      VAL  60   4.675  11.547  14.031
  157   HG13  VAL  60          3HG1      VAL  60   5.642  11.454  15.522
  158   HG21  VAL  60          1HG2      VAL  60   3.323  10.556  17.338
  159   HG22  VAL  60          2HG2      VAL  60   4.482  11.838  17.767
  160   HG23  VAL  60          3HG2      VAL  60   2.733  12.176  17.781
  161    H    GLY  61           H        GLY  61   5.964  14.333  14.481
  162    HA2  GLY  61          1HA       GLY  61   6.486  14.852  12.276
  163    HA3  GLY  61          2HA       GLY  61   5.041  13.992  11.778
  164    H    SER  62           H        SER  62   3.537  15.181  10.801
  165    HA   SER  62           HA       SER  62   3.458  18.108  11.404
  166    HB2  SER  62          1HB       SER  62   2.602  18.418   9.132
  167    HB3  SER  62          2HB       SER  62   4.164  17.615   9.108
  168    HG   SER  62           HG       SER  62   1.954  15.992   9.278
  169    H    THR  63           H        THR  63   1.964  15.468  12.347
  170    HA   THR  63           HA       THR  63  -0.755  16.695  12.147
  171    HB   THR  63           HB       THR  63  -0.052  13.729  12.239
  172    HG1  THR  63           HG1      THR  63  -1.446  15.103  10.187
  173   HG21  THR  63          1HG2      THR  63  -2.479  13.385  11.984
  174   HG22  THR  63          2HG2      THR  63  -2.115  14.258  13.493
  175   HG23  THR  63          3HG2      THR  63  -2.743  15.141  12.082
  176    H    SER  64           H        SER  64  -1.327  17.535  14.009
  177    HA   SER  64           HA       SER  64  -0.281  16.451  16.532
  178    HB2  SER  64          1HB       SER  64  -2.232  18.702  15.946
  179    HB3  SER  64          2HB       SER  64  -1.635  18.286  17.544
  180    HG   SER  64           HG       SER  64   0.506  18.495  16.471
  181    H    LEU  65           H        LEU  65  -1.524  15.620  18.224
  182    HA   LEU  65           HA       LEU  65  -4.307  14.831  17.592
  183    HB2  LEU  65          1HB       LEU  65  -2.872  12.997  16.742
  184    HB3  LEU  65          2HB       LEU  65  -2.138  12.837  18.341
  185    HG   LEU  65           HG       LEU  65  -4.387  12.211  19.257
  186   HD11  LEU  65          1HD1      LEU  65  -6.154  11.605  17.663
  187   HD12  LEU  65          2HD1      LEU  65  -5.756  13.337  17.577
  188   HD13  LEU  65          3HD1      LEU  65  -5.159  12.223  16.324
  189   HD21  LEU  65          1HD2      LEU  65  -4.367   9.948  18.262
  190   HD22  LEU  65          2HD2      LEU  65  -3.345  10.542  16.930
  191   HD23  LEU  65          3HD2      LEU  65  -2.713  10.516  18.593
  192    H    ASN  66           H        ASN  66  -5.081  16.087  19.238
  193    HA   ASN  66           HA       ASN  66  -3.968  15.673  21.953
  194    HB2  ASN  66          1HB       ASN  66  -6.062  17.603  20.904
  195    HB3  ASN  66          2HB       ASN  66  -5.528  17.521  22.577
  196   HD21  ASN  66          1HD2      ASN  66  -3.663  20.065  20.418
  197   HD22  ASN  66          2HD2      ASN  66  -5.339  19.626  20.452
  198    H    ASP  67           H        ASP  67  -5.348  15.275  23.773
  199    HA   ASP  67           HA       ASP  67  -6.966  14.083  24.892
  200    HB2  ASP  67          1HB       ASP  67  -8.640  14.637  22.408
  201    HB3  ASP  67          2HB       ASP  67  -9.259  14.056  23.948
  202    H    VAL  68           H        VAL  68  -5.072  12.544  23.708
  203    HA   VAL  68           HA       VAL  68  -6.217  10.436  22.091
  204    HB   VAL  68           HB       VAL  68  -3.690  10.494  23.797
  205   HG11  VAL  68          1HG1      VAL  68  -2.958   8.590  22.445
  206   HG12  VAL  68          2HG1      VAL  68  -4.417   8.214  23.394
  207   HG13  VAL  68          3HG1      VAL  68  -4.548   8.546  21.649
  208   HG21  VAL  68          1HG2      VAL  68  -2.565  10.901  21.631
  209   HG22  VAL  68          2HG2      VAL  68  -4.147  10.929  20.816
  210   HG23  VAL  68          3HG2      VAL  68  -3.731  12.192  22.002
  211    H    ALA  69           H        ALA  69  -7.531   8.874  22.706
  212    HA   ALA  69           HA       ALA  69  -8.409   8.681  25.417
  213    HB1  ALA  69          1HB       ALA  69  -9.736   6.750  24.622
  214    HB2  ALA  69          2HB       ALA  69  -9.867   8.140  23.517
  215    HB3  ALA  69          3HB       ALA  69  -8.823   6.763  23.095
  216    HA   PRO  70           HA       PRO  70  -5.605   6.014  27.395
  217    HB2  PRO  70          1HB       PRO  70  -8.136   4.675  28.427
  218    HB3  PRO  70          2HB       PRO  70  -6.707   5.193  29.330
  219    HG2  PRO  70          1HG       PRO  70  -8.874   6.726  29.435
  220    HG3  PRO  70          2HG       PRO  70  -7.300   7.498  29.225
  221    HD2  PRO  70          1HD       PRO  70  -9.430   6.888  27.138
  222    HD3  PRO  70          2HD       PRO  70  -8.418   8.375  27.335
  223    H    LEU  71           H        LEU  71  -4.577   4.253  26.637
  224    HA   LEU  71           HA       LEU  71  -4.176   2.227  25.619
  225    HB2  LEU  71          1HB       LEU  71  -7.140   1.685  25.991
  226    HB3  LEU  71          2HB       LEU  71  -5.875   0.491  25.688
  227    HG   LEU  71           HG       LEU  71  -6.195   2.159  28.208
  228   HD11  LEU  71          1HD1      LEU  71  -6.734  -0.003  29.238
  229   HD12  LEU  71          2HD1      LEU  71  -7.888   0.419  27.951
  230   HD13  LEU  71          3HD1      LEU  71  -6.619  -0.791  27.646
  231   HD21  LEU  71          1HD2      LEU  71  -4.348   0.758  29.065
  232   HD22  LEU  71          2HD2      LEU  71  -4.197  -0.021  27.470
  233   HD23  LEU  71          3HD2      LEU  71  -3.827   1.711  27.655
  234    H    GLY  72           H        GLY  72  -5.350   4.685  24.203
  235    HA2  GLY  72          1HA       GLY  72  -6.398   3.418  21.739
  236    HA3  GLY  72          2HA       GLY  72  -6.249   5.138  22.043
  237    H    SER  73           H        SER  73  -5.412   4.538  19.667
  238    HA   SER  73           HA       SER  73  -2.509   4.902  19.790
  239    HB2  SER  73          1HB       SER  73  -1.929   3.020  18.403
  240    HB3  SER  73          2HB       SER  73  -2.784   2.424  19.817
  241    HG   SER  73           HG       SER  73  -3.490   2.445  17.177
  242    H    SER  74           H        SER  74  -1.576   5.306  17.622
  243    HA   SER  74           HA       SER  74  -3.406   5.889  15.435
  244    HB2  SER  74          1HB       SER  74  -3.835   7.844  16.847
  245    HB3  SER  74          2HB       SER  74  -2.114   8.177  16.954
  246    HG   SER  74           HG       SER  74  -2.255   8.173  14.561
  247    H    ASP  75           H        ASP  75  -2.368   5.581  13.601
  248    HA   ASP  75           HA       ASP  75   0.574   5.407  13.648
  249    HB2  ASP  75          1HB       ASP  75  -1.499   4.752  11.520
  250    HB3  ASP  75          2HB       ASP  75   0.233   4.614  11.256
  251    H    PHE  76           H        PHE  76   1.969   6.761  12.701
  252    HA   PHE  76           HA       PHE  76   0.807   9.016  11.117
  253    HB2  PHE  76          1HB       PHE  76   3.250   9.038  12.933
  254    HB3  PHE  76          2HB       PHE  76   2.739  10.377  11.919
  255    HD1  PHE  76           HD1      PHE  76   1.988   8.415  14.925
  256    HD2  PHE  76           HD2      PHE  76   0.812  11.723  12.490
  257    HE1  PHE  76           HE1      PHE  76   0.528   9.234  16.745
  258    HE2  PHE  76           HE2      PHE  76  -0.647  12.547  14.309
  259    HZ   PHE  76           HZ       PHE  76  -0.789  11.299  16.437
  260    H    LYS  77           H        LYS  77   1.684   9.499   9.180
  261    HA   LYS  77           HA       LYS  77   3.597   7.440   8.184
  262    HB2  LYS  77          1HB       LYS  77   1.346   7.470   7.130
  263    HB3  LYS  77          2HB       LYS  77   1.587   9.145   6.658
  264    HG2  LYS  77          1HG       LYS  77   3.441   8.504   5.197
  265    HG3  LYS  77          2HG       LYS  77   3.290   6.820   5.716
  266    HD2  LYS  77          1HD       LYS  77   0.971   6.766   4.822
  267    HD3  LYS  77          2HD       LYS  77   1.158   8.437   4.270
  268    HE2  LYS  77          1HE       LYS  77   3.046   7.744   2.824
  269    HE3  LYS  77          2HE       LYS  77   2.848   6.076   3.367
  270    HZ1  LYS  77          1HZ       LYS  77   1.767   6.457   1.276
  271    HZ2  LYS  77          2HZ       LYS  77   0.642   6.092   2.426
  272    HZ3  LYS  77          3HZ       LYS  77   0.828   7.650   1.917
  273    H    PHE  78           H        PHE  78   5.593   8.020   7.781
  274    HA   PHE  78           HA       PHE  78   6.088  10.842   6.932
  275    HB2  PHE  78          1HB       PHE  78   7.977   8.801   8.172
  276    HB3  PHE  78          2HB       PHE  78   8.471  10.380   7.582
  277    HD1  PHE  78           HD1      PHE  78   6.453   8.623  10.127
  278    HD2  PHE  78           HD2      PHE  78   8.091  12.357   8.853
  279    HE1  PHE  78           HE1      PHE  78   5.908   9.611  12.326
  280    HE2  PHE  78           HE2      PHE  78   7.550  13.348  11.052
  281    HZ   PHE  78           HZ       PHE  78   6.456  11.974  12.789
  282    H    LEU  79           H        LEU  79   6.895  11.270   4.984
  283    HA   LEU  79           HA       LEU  79   7.265   8.996   3.140
  284    HB2  LEU  79          1HB       LEU  79   7.215  12.000   2.684
  285    HB3  LEU  79          2HB       LEU  79   7.400  10.794   1.406
  286    HG   LEU  79           HG       LEU  79   4.966  11.080   3.202
  287   HD11  LEU  79          1HD1      LEU  79   3.883  11.955   1.181
  288   HD12  LEU  79          2HD1      LEU  79   5.243  12.980   1.694
  289   HD13  LEU  79          3HD1      LEU  79   5.433  11.873   0.313
  290   HD21  LEU  79          1HD2      LEU  79   3.959   9.482   1.607
  291   HD22  LEU  79          2HD2      LEU  79   5.512   9.364   0.745
  292   HD23  LEU  79          3HD2      LEU  79   5.376   8.772   2.417
  293    HA   PRO  80           HA       PRO  80  11.509  10.933   2.910
  294    HB2  PRO  80          1HB       PRO  80  12.250  13.142   4.237
  295    HB3  PRO  80          2HB       PRO  80  11.117  13.279   2.886
  296    HG2  PRO  80          1HG       PRO  80  10.534  13.237   5.876
  297    HG3  PRO  80          2HG       PRO  80   9.904  14.344   4.653
  298    HD2  PRO  80          1HD       PRO  80   8.562  12.060   5.522
  299    HD3  PRO  80          2HD       PRO  80   8.300  12.835   3.908
  300    HA   PRO  81           HA       PRO  81  13.176   8.983   6.554
  301    HB2  PRO  81          1HB       PRO  81  15.752   8.659   5.758
  302    HB3  PRO  81          2HB       PRO  81  14.446   7.730   5.011
  303    HG2  PRO  81          1HG       PRO  81  15.804  10.267   4.008
  304    HG3  PRO  81          2HG       PRO  81  15.456   8.785   3.113
  305    HD2  PRO  81          1HD       PRO  81  13.810  10.990   3.020
  306    HD3  PRO  81          2HD       PRO  81  13.188   9.300   2.841
  307    H    GLY  82           H        GLY  82  14.803   9.450   8.228
  308    HA2  GLY  82          1HA       GLY  82  16.722  11.233   8.586
  309    HA3  GLY  82          2HA       GLY  82  15.394  12.364   8.412
  310    H    SER  83           H        SER  83  14.560  13.048  10.272
  311    HA   SER  83           HA       SER  83  13.747  11.209  12.347
  312    HB2  SER  83          1HB       SER  83  15.196  11.944  14.125
  313    HB3  SER  83          2HB       SER  83  16.193  11.355  12.804
  314    HG   SER  83           HG       SER  83  15.537  14.034  13.362
  315    H    TYR  84           H        TYR  84  12.711  12.303  14.169
  316    HA   TYR  84           HA       TYR  84  12.310  15.184  14.019
  317    HB2  TYR  84          1HB       TYR  84  10.744  14.374  12.249
  318    HB3  TYR  84          2HB       TYR  84   9.944  13.356  13.438
  319    HD1  TYR  84           HD1      TYR  84  10.625  16.855  12.446
  320    HD2  TYR  84           HD2      TYR  84   8.364  14.236  14.985
  321    HE1  TYR  84           HE1      TYR  84   9.132  18.729  13.051
  322    HE2  TYR  84           HE2      TYR  84   6.871  16.111  15.590
  323    HH   TYR  84           HH       TYR  84   6.401  18.256  15.299
  324    H    THR  85           H        THR  85  11.788  16.025  15.931
  325    HA   THR  85           HA       THR  85  11.490  14.143  18.178
  326    HB   THR  85           HB       THR  85  11.760  17.180  18.151
  327    HG1  THR  85           HG1      THR  85  13.906  16.641  18.845
  328   HG21  THR  85          1HG2      THR  85  12.244  16.920  20.552
  329   HG22  THR  85          2HG2      THR  85  10.607  16.337  20.167
  330   HG23  THR  85          3HG2      THR  85  11.927  15.174  20.432
  331    H    ALA  86           H        ALA  86   9.568  13.424  18.717
  332    HA   ALA  86           HA       ALA  86   7.176  14.931  17.935
  333    HB1  ALA  86          1HB       ALA  86   5.954  12.945  18.761
  334    HB2  ALA  86          2HB       ALA  86   7.235  12.498  17.608
  335    HB3  ALA  86          3HB       ALA  86   7.485  12.259  19.353
  336    H    GLN  87           H        GLN  87   5.613  15.760  19.268
  337    HA   GLN  87           HA       GLN  87   6.530  16.432  21.990
  338    HB2  GLN  87          1HB       GLN  87   5.537  18.180  20.502
  339    HB3  GLN  87          2HB       GLN  87   4.021  17.292  20.495
  340    HG2  GLN  87          1HG       GLN  87   3.798  19.056  22.053
  341    HG3  GLN  87          2HG       GLN  87   3.955  17.549  22.999
  342   HE21  GLN  87          1HE2      GLN  87   6.396  19.025  24.967
  343   HE22  GLN  87          2HE2      GLN  87   4.912  18.140  24.850
  344    H    VAL  88           H        VAL  88   6.014  15.317  23.714
  345    HA   VAL  88           HA       VAL  88   3.506  13.695  23.634
  346    HB   VAL  88           HB       VAL  88   6.129  12.912  24.974
  347   HG11  VAL  88          1HG1      VAL  88   5.039  10.748  25.312
  348   HG12  VAL  88          2HG1      VAL  88   4.172  12.066  26.135
  349   HG13  VAL  88          3HG1      VAL  88   3.536  11.396  24.613
  350   HG21  VAL  88          1HG2      VAL  88   6.266  11.193  23.201
  351   HG22  VAL  88          2HG2      VAL  88   4.802  11.863  22.440
  352   HG23  VAL  88          3HG2      VAL  88   6.293  12.832  22.510
  353    H    GLY  89           H        GLY  89   2.468  15.487  24.682
  354    HA2  GLY  89          1HA       GLY  89   1.632  16.547  26.571
  355    HA3  GLY  89          2HA       GLY  89   2.440  15.331  27.543
  356    H    GLN  90           H        GLN  90   3.934  16.081  28.900
  357    HA   GLN  90           HA       GLN  90   5.232  18.684  28.330
  358    HB2  GLN  90          1HB       GLN  90   5.320  16.906  30.802
  359    HB3  GLN  90          2HB       GLN  90   6.098  18.476  30.658
  360    HG2  GLN  90          1HG       GLN  90   3.121  17.965  30.485
  361    HG3  GLN  90          2HG       GLN  90   4.006  18.618  31.892
  362   HE21  GLN  90          1HE2      GLN  90   2.499  21.146  29.280
  363   HE22  GLN  90          2HE2      GLN  90   1.949  19.536  29.609
  364    H    GLN  91           H        GLN  91   5.771  15.501  27.617
  365    HA   GLN  91           HA       GLN  91   8.734  15.824  27.779
  366    HB2  GLN  91          1HB       GLN  91   7.082  13.296  27.382
  367    HB3  GLN  91          2HB       GLN  91   8.836  13.366  27.481
  368    HG2  GLN  91          1HG       GLN  91   6.933  14.168  29.693
  369    HG3  GLN  91          2HG       GLN  91   7.811  12.616  29.571
  370   HE21  GLN  91          1HE2      GLN  91   9.497  15.577  31.538
  371   HE22  GLN  91          2HE2      GLN  91   7.803  15.334  31.273
  372    H    SER  92           H        SER  92   9.832  14.455  25.949
  373    HA   SER  92           HA       SER  92   8.378  14.643  23.390
  374    HB2  SER  92          1HB       SER  92  10.065  15.985  22.300
  375    HB3  SER  92          2HB       SER  92   9.458  16.865  23.693
  376    HG   SER  92           HG       SER  92  11.792  15.294  23.605
  377    H    LEU  93           H        LEU  93   9.515  13.605  21.614
  378    HA   LEU  93           HA       LEU  93  11.575  11.660  22.529
  379    HB2  LEU  93          1HB       LEU  93   9.382  10.546  22.653
  380    HB3  LEU  93          2HB       LEU  93   9.054  10.983  20.973
  381    HG   LEU  93           HG       LEU  93  11.004   9.561  20.281
  382   HD11  LEU  93          1HD1      LEU  93  11.914   7.979  21.923
  383   HD12  LEU  93          2HD1      LEU  93  12.252   9.664  22.378
  384   HD13  LEU  93          3HD1      LEU  93  10.962   8.763  23.205
  385   HD21  LEU  93          1HD2      LEU  93   9.813   7.429  20.662
  386   HD22  LEU  93          2HD2      LEU  93   8.830   8.205  21.929
  387   HD23  LEU  93          3HD2      LEU  93   8.676   8.730  20.234
  388    HA   PRO  94           HA       PRO  94  13.177  13.218  18.669
  389    HB2  PRO  94          1HB       PRO  94  15.734  12.307  19.023
  390    HB3  PRO  94          2HB       PRO  94  15.131  13.745  19.856
  391    HG2  PRO  94          1HG       PRO  94  15.320  10.882  20.887
  392    HG3  PRO  94          2HG       PRO  94  15.859  12.365  21.679
  393    HD2  PRO  94          1HD       PRO  94  13.450  11.237  22.274
  394    HD3  PRO  94          2HD       PRO  94  13.674  13.032  22.261
  395    H    VAL  95           H        VAL  95  11.774  11.670  17.583
  396    HA   VAL  95           HA       VAL  95  12.496   8.863  17.464
  397    HB   VAL  95           HB       VAL  95  10.547  10.500  15.787
  398   HG11  VAL  95          1HG1      VAL  95   9.553   8.349  15.181
  399   HG12  VAL  95          2HG1      VAL  95  11.233   8.489  14.615
  400   HG13  VAL  95          3HG1      VAL  95  10.857   7.504  16.048
  401   HG21  VAL  95          1HG2      VAL  95   8.843   9.487  17.268
  402   HG22  VAL  95          2HG2      VAL  95  10.132   8.684  18.197
  403   HG23  VAL  95          3HG2      VAL  95  10.009  10.460  18.198
  404    H    LYS  96           H        LYS  96  14.166   8.103  16.358
  405    HA   LYS  96           HA       LYS  96  15.124   9.418  13.925
  406    HB2  LYS  96          1HB       LYS  96  16.652   8.218  15.509
  407    HB3  LYS  96          2HB       LYS  96  15.857   6.704  15.095
  408    HG2  LYS  96          1HG       LYS  96  16.610   6.900  12.778
  409    HG3  LYS  96          2HG       LYS  96  17.337   8.476  13.127
  410    HD2  LYS  96          1HD       LYS  96  18.825   7.389  14.805
  411    HD3  LYS  96          2HD       LYS  96  18.127   5.819  14.379
  412    HE2  LYS  96          1HE       LYS  96  18.899   6.119  12.042
  413    HE3  LYS  96          2HE       LYS  96  19.612   7.674  12.480
  414    HZ1  LYS  96          1HZ       LYS  96  21.235   5.925  12.489
  415    HZ2  LYS  96          2HZ       LYS  96  21.048   6.517  14.016
  416    HZ3  LYS  96          3HZ       LYS  96  20.382   5.063  13.607
  417    H    LEU  97           H        LEU  97  14.705   8.940  11.869
  418    HA   LEU  97           HA       LEU  97  12.618   6.847  11.433
  419    HB2  LEU  97          1HB       LEU  97  13.151   9.374   9.831
  420    HB3  LEU  97          2HB       LEU  97  11.859   8.207   9.535
  421    HG   LEU  97           HG       LEU  97  12.106   9.897  12.048
  422   HD11  LEU  97          1HD1      LEU  97  10.266  11.205  11.083
  423   HD12  LEU  97          2HD1      LEU  97  11.728  11.281  10.072
  424   HD13  LEU  97          3HD1      LEU  97  10.366  10.242   9.589
  425   HD21  LEU  97          1HD2      LEU  97   9.784   9.133  12.416
  426   HD22  LEU  97          2HD2      LEU  97   9.876   8.141  10.940
  427   HD23  LEU  97          3HD2      LEU  97  10.907   7.755  12.339
  428    H    ASP  98           H        ASP  98  14.065   5.159  11.040
  429    HA   ASP  98           HA       ASP  98  16.054   5.319   8.945
  430    HB2  ASP  98          1HB       ASP  98  14.719   2.983  10.359
  431    HB3  ASP  98          2HB       ASP  98  15.934   2.767   9.108
  432    HA   PRO  99           HA       PRO  99  13.736   5.080   5.322
  433    HB2  PRO  99          1HB       PRO  99  15.768   2.960   4.509
  434    HB3  PRO  99          2HB       PRO  99  15.202   4.361   3.591
  435    HG2  PRO  99          1HG       PRO  99  17.569   4.522   4.787
  436    HG3  PRO  99          2HG       PRO  99  16.472   5.903   4.891
  437    HD2  PRO  99          1HD       PRO  99  17.052   3.750   6.960
  438    HD3  PRO  99          2HD       PRO  99  16.829   5.530   7.196
  439    H    ASP 100           H        ASP 100  11.838   4.053   5.123
  440    HA   ASP 100           HA       ASP 100  10.247   2.389   5.076
  441    HB2  ASP 100          1HB       ASP 100  12.630   0.732   4.153
  442    HB3  ASP 100          2HB       ASP 100  10.949   0.230   4.030
  443    H    SER 101           H        SER 101  10.574   2.778   7.545
  444    HA   SER 101           HA       SER 101  10.690   0.067   8.731
  445    HB2  SER 101          1HB       SER 101  12.099   0.769  10.568
  446    HB3  SER 101          2HB       SER 101  12.939   1.069   9.055
  447    HG   SER 101           HG       SER 101  12.468   3.187   9.199
  448    H    TYR 102           H        TYR 102   9.644  -0.098  10.793
  449    HA   TYR 102           HA       TYR 102   7.602   2.048  11.161
  450    HB2  TYR 102          1HB       TYR 102   7.514  -0.914  11.864
  451    HB3  TYR 102          2HB       TYR 102   6.269   0.244  12.306
  452    HD1  TYR 102           HD1      TYR 102   8.046  -1.212   9.369
  453    HD2  TYR 102           HD2      TYR 102   4.529   0.760  10.835
  454    HE1  TYR 102           HE1      TYR 102   6.933  -1.579   7.193
  455    HE2  TYR 102           HE2      TYR 102   3.416   0.393   8.660
  456    HH   TYR 102           HH       TYR 102   3.600  -0.444   6.617
  457    H    TYR 103           H        TYR 103   7.030   2.749  13.217
  458    HA   TYR 103           HA       TYR 103   8.790   1.855  15.445
  459    HB2  TYR 103          1HB       TYR 103   8.264   4.756  14.679
  460    HB3  TYR 103          2HB       TYR 103   9.049   4.237  16.163
  461    HD1  TYR 103           HD1      TYR 103   9.415   4.747  12.574
  462    HD2  TYR 103           HD2      TYR 103  11.286   3.196  16.111
  463    HE1  TYR 103           HE1      TYR 103  11.600   4.745  11.418
  464    HE2  TYR 103           HE2      TYR 103  13.470   3.195  14.955
  465    HH   TYR 103           HH       TYR 103  14.555   3.627  13.073
  466    H    THR 104           H        THR 104   7.944   2.071  17.515
  467    HA   THR 104           HA       THR 104   5.080   2.927  17.621
  468    HB   THR 104           HB       THR 104   6.435   0.718  19.230
  469    HG1  THR 104           HG1      THR 104   5.703  -0.489  17.666
  470   HG21  THR 104          1HG2      THR 104   4.192   0.344  20.176
  471   HG22  THR 104          2HG2      THR 104   4.780   1.977  20.565
  472   HG23  THR 104          3HG2      THR 104   3.574   1.749  19.279
  473    H    LEU 105           H        LEU 105   4.466   4.312  19.171
  474    HA   LEU 105           HA       LEU 105   6.626   5.267  21.001
  475    HB2  LEU 105          1HB       LEU 105   5.877   6.853  19.177
  476    HB3  LEU 105          2HB       LEU 105   4.282   6.873  19.935
  477    HG   LEU 105           HG       LEU 105   6.782   7.689  21.437
  478   HD11  LEU 105          1HD1      LEU 105   6.212  10.006  20.859
  479   HD12  LEU 105          2HD1      LEU 105   6.625   9.052  19.416
  480   HD13  LEU 105          3HD1      LEU 105   4.923   9.420  19.781
  481   HD21  LEU 105          1HD2      LEU 105   5.118   8.884  22.821
  482   HD22  LEU 105          2HD2      LEU 105   3.812   8.282  21.771
  483   HD23  LEU 105          3HD2      LEU 105   4.762   7.141  22.753
  484    H    VAL 106           H        VAL 106   6.254   4.355  22.919
  485    HA   VAL 106           HA       VAL 106   3.442   4.250  23.898
  486    HB   VAL 106           HB       VAL 106   5.943   2.816  24.893
  487   HG11  VAL 106          1HG1      VAL 106   4.409   1.533  26.302
  488   HG12  VAL 106          2HG1      VAL 106   4.398   3.266  26.709
  489   HG13  VAL 106          3HG1      VAL 106   3.059   2.562  25.769
  490   HG21  VAL 106          1HG2      VAL 106   4.835   0.805  23.969
  491   HG22  VAL 106          2HG2      VAL 106   3.505   1.818  23.363
  492   HG23  VAL 106          3HG2      VAL 106   5.145   2.012  22.698
  493    H    SER 107           H        SER 107   2.779   5.653  25.361
  494    HA   SER 107           HA       SER 107   4.736   6.796  27.274
  495    HB2  SER 107          1HB       SER 107   4.058   9.073  26.807
  496    HB3  SER 107          2HB       SER 107   4.657   8.335  25.330
  497    HG   SER 107           HG       SER 107   2.212   7.748  25.263
  498    H    GLN 108           H        GLN 108   3.689   8.030  29.015
  499    HA   GLN 108           HA       GLN 108   0.823   7.685  29.405
  500    HB2  GLN 108          1HB       GLN 108   0.939   6.227  31.352
  501    HB3  GLN 108          2HB       GLN 108   1.652   5.410  29.969
  502    HG2  GLN 108          1HG       GLN 108   3.906   6.012  30.794
  503    HG3  GLN 108          2HG       GLN 108   3.144   6.755  32.229
  504   HE21  GLN 108          1HE2      GLN 108   3.265   3.771  33.973
  505   HE22  GLN 108          2HE2      GLN 108   3.438   5.494  33.941
  506    HA   PRO 109           HA       PRO 109   1.194  11.140  31.970
  507    HB2  PRO 109          1HB       PRO 109  -0.421   9.604  34.038
  508    HB3  PRO 109          2HB       PRO 109  -0.699  11.228  33.393
  509    HG2  PRO 109          1HG       PRO 109  -2.206   9.233  32.480
  510    HG3  PRO 109          2HG       PRO 109  -1.568  10.413  31.331
  511    HD2  PRO 109          1HD       PRO 109  -0.545   7.618  31.977
  512    HD3  PRO 109          2HD       PRO 109  -0.732   8.419  30.366
  513    H    GLY 110           H        GLY 110   2.978  11.681  33.075
  514    HA2  GLY 110          1HA       GLY 110   4.284  11.837  35.042
  515    HA3  GLY 110          2HA       GLY 110   3.568  10.350  35.636
  516    H    GLY 111           H        GLY 111   4.356   9.747  32.483
  517    HA2  GLY 111          1HA       GLY 111   7.064   8.695  33.231
  518    HA3  GLY 111          2HA       GLY 111   5.931   7.801  32.237
  519    H    LYS 112           H        LYS 112   7.899   7.811  30.803
  520    HA   LYS 112           HA       LYS 112   7.838  10.249  29.074
  521    HB2  LYS 112          1HB       LYS 112  10.228   8.491  29.756
  522    HB3  LYS 112          2HB       LYS 112  10.233   9.732  28.510
  523    HG2  LYS 112          1HG       LYS 112   9.734  11.444  30.246
  524    HG3  LYS 112          2HG       LYS 112   9.817  10.178  31.479
  525    HD2  LYS 112          1HD       LYS 112  12.154   9.690  30.821
  526    HD3  LYS 112          2HD       LYS 112  12.071  10.963  29.594
  527    HE2  LYS 112          1HE       LYS 112  11.646  12.640  31.362
  528    HE3  LYS 112          2HE       LYS 112  11.726  11.373  32.588
  529    HZ1  LYS 112          1HZ       LYS 112  13.796  12.539  32.391
  530    HZ2  LYS 112          2HZ       LYS 112  13.999  10.966  31.938
  531    HZ3  LYS 112          3HZ       LYS 112  13.926  12.151  30.793
  532    HA   PRO 113           HA       PRO 113   6.791   7.626  25.797
  533    HB2  PRO 113          1HB       PRO 113   7.949   8.921  23.651
  534    HB3  PRO 113          2HB       PRO 113   6.521   9.541  24.488
  535    HG2  PRO 113          1HG       PRO 113   9.447  10.294  24.888
  536    HG3  PRO 113          2HG       PRO 113   8.058  11.367  24.701
  537    HD2  PRO 113          1HD       PRO 113   9.035  10.785  27.163
  538    HD3  PRO 113          2HD       PRO 113   7.254  10.960  26.889
  539    H    GLN 114           H        GLN 114   7.576   5.766  24.940
  540    HA   GLN 114           HA       GLN 114  10.545   5.460  24.803
  541    HB2  GLN 114          1HB       GLN 114   9.567   3.973  26.469
  542    HB3  GLN 114          2HB       GLN 114   8.368   3.397  25.320
  543    HG2  GLN 114          1HG       GLN 114  10.027   1.720  25.523
  544    HG3  GLN 114          2HG       GLN 114  10.255   2.489  23.926
  545   HE21  GLN 114          1HE2      GLN 114  13.601   3.117  24.508
  546   HE22  GLN 114          2HE2      GLN 114  12.314   2.752  23.410
  547    H    LEU 115           H        LEU 115  11.436   5.221  22.893
  548    HA   LEU 115           HA       LEU 115   9.730   4.746  20.544
  549    HB2  LEU 115          1HB       LEU 115  11.516   6.458  20.490
  550    HB3  LEU 115          2HB       LEU 115  12.727   5.202  20.777
  551    HG   LEU 115           HG       LEU 115  12.094   4.153  18.595
  552   HD11  LEU 115          1HD1      LEU 115  10.720   5.458  17.033
  553   HD12  LEU 115          2HD1      LEU 115   9.798   4.980  18.478
  554   HD13  LEU 115          3HD1      LEU 115  10.394   6.650  18.315
  555   HD21  LEU 115          1HD2      LEU 115  13.185   5.893  17.219
  556   HD22  LEU 115          2HD2      LEU 115  12.895   7.092  18.503
  557   HD23  LEU 115          3HD2      LEU 115  13.995   5.722  18.796
  558    H    VAL 116           H        VAL 116   9.295   2.809  19.781
  559    HA   VAL 116           HA       VAL 116  11.288   0.634  20.252
  560    HB   VAL 116           HB       VAL 116   8.315   0.428  19.609
  561   HG11  VAL 116          1HG1      VAL 116   8.595  -1.960  20.055
  562   HG12  VAL 116          2HG1      VAL 116   9.575  -1.421  18.671
  563   HG13  VAL 116          3HG1      VAL 116  10.348  -1.719  20.247
  564   HG21  VAL 116          1HG2      VAL 116   8.128  -0.404  21.930
  565   HG22  VAL 116          2HG2      VAL 116   9.865  -0.108  22.174
  566   HG23  VAL 116          3HG2      VAL 116   8.760   1.258  21.893
  567    H    ALA 117           H        ALA 117  12.492   0.111  18.575
  568    HA   ALA 117           HA       ALA 117  11.754   0.996  15.892
  569    HB1  ALA 117          1HB       ALA 117  13.932   0.023  15.237
  570    HB2  ALA 117          2HB       ALA 117  14.090   1.114  16.635
  571    HB3  ALA 117          3HB       ALA 117  14.115  -0.649  16.875
  572    H    GLU 118           H        GLU 118  10.907  -0.130  14.277
  573    HA   GLU 118           HA       GLU 118  10.810  -3.091  14.505
  574    HB2  GLU 118          1HB       GLU 118   8.378  -1.352  13.924
  575    HB3  GLU 118          2HB       GLU 118   8.418  -3.109  13.884
  576    HG2  GLU 118          1HG       GLU 118   8.917  -3.164  16.287
  577    HG3  GLU 118          2HG       GLU 118   8.910  -1.404  16.335
  578    HA   PRO 119           HA       PRO 119  12.199  -1.525  10.382
  579    HB2  PRO 119          1HB       PRO 119  13.603  -4.207  10.709
  580    HB3  PRO 119          2HB       PRO 119  14.213  -2.718   9.977
  581    HG2  PRO 119          1HG       PRO 119  15.011  -3.320  12.440
  582    HG3  PRO 119          2HG       PRO 119  14.547  -1.653  12.083
  583    HD2  PRO 119          1HD       PRO 119  12.945  -3.833  13.476
  584    HD3  PRO 119          2HD       PRO 119  13.095  -2.081  13.900
  Start of MODEL   10
    1    H    GLN  38          1H        GLN  38  -1.418  -0.038  -1.788
    2    HA   GLN  38           HA       GLN  38  -0.033  -0.789  -0.024
    3    HB2  GLN  38          1HB       GLN  38   1.443   0.599  -2.297
    4    HB3  GLN  38          2HB       GLN  38   2.125  -0.642  -1.255
    5    HG2  GLN  38          1HG       GLN  38  -0.253  -1.022  -3.085
    6    HG3  GLN  38          2HG       GLN  38   1.428  -1.523  -3.428
    7   HE21  GLN  38          1HE2      GLN  38  -1.003  -4.061  -1.619
    8   HE22  GLN  38          2HE2      GLN  38  -1.474  -2.715  -2.601
    9    H    ALA  39           H        ALA  39   2.072  -0.341   1.077
   10    HA   ALA  39           HA       ALA  39   1.805   2.105   2.598
   11    HB1  ALA  39          1HB       ALA  39   3.836   1.316   3.769
   12    HB2  ALA  39          2HB       ALA  39   2.611   0.031   3.635
   13    HB3  ALA  39          3HB       ALA  39   4.027   0.030   2.556
   14    HA   PRO  40           HA       PRO  40   4.315   4.734   0.214
   15    HB2  PRO  40          1HB       PRO  40   5.050   6.579   2.112
   16    HB3  PRO  40          2HB       PRO  40   3.401   6.477   1.483
   17    HG2  PRO  40          1HG       PRO  40   4.545   5.276   4.039
   18    HG3  PRO  40          2HG       PRO  40   3.062   6.210   3.843
   19    HD2  PRO  40          1HD       PRO  40   3.008   3.491   3.915
   20    HD3  PRO  40          2HD       PRO  40   1.885   4.423   2.847
   21    H    LYS  41           H        LYS  41   5.867   2.881   0.026
   22    HA   LYS  41           HA       LYS  41   8.074   2.521   1.772
   23    HB2  LYS  41          1HB       LYS  41   7.451   0.951  -0.056
   24    HB3  LYS  41          2HB       LYS  41   7.968   2.138  -1.247
   25    HG2  LYS  41          1HG       LYS  41  10.273   1.994  -0.434
   26    HG3  LYS  41          2HG       LYS  41   9.774   0.858   0.827
   27    HD2  LYS  41          1HD       LYS  41   9.026  -0.739  -0.909
   28    HD3  LYS  41          2HD       LYS  41   9.518   0.399  -2.171
   29    HE2  LYS  41          1HE       LYS  41  11.855   0.280  -1.361
   30    HE3  LYS  41          2HE       LYS  41  11.363  -0.856  -0.103
   31    HZ1  LYS  41          1HZ       LYS  41  12.275  -1.979  -2.000
   32    HZ2  LYS  41          2HZ       LYS  41  10.684  -2.381  -1.827
   33    HZ3  LYS  41          3HZ       LYS  41  11.145  -1.319  -3.004
   34    H    GLY  42           H        GLY  42   9.891   3.577   2.155
   35    HA2  GLY  42          1HA       GLY  42  11.756   4.963   1.339
   36    HA3  GLY  42          2HA       GLY  42  10.618   5.832   0.324
   37    H    SER  43           H        SER  43   8.627   5.675   2.671
   38    HA   SER  43           HA       SER  43   9.666   8.074   4.076
   39    HB2  SER  43          1HB       SER  43   7.397   8.492   4.721
   40    HB3  SER  43          2HB       SER  43   7.397   8.097   3.008
   41    HG   SER  43           HG       SER  43   6.888   5.953   3.610
   42    H    ALA  44           H        ALA  44   9.108   8.283   6.416
   43    HA   ALA  44           HA       ALA  44   9.894   5.791   7.797
   44    HB1  ALA  44          1HB       ALA  44  10.222   7.264   9.758
   45    HB2  ALA  44          2HB       ALA  44  11.120   7.849   8.337
   46    HB3  ALA  44          3HB       ALA  44   9.600   8.640   8.822
   47    H    PHE  45           H        PHE  45   8.796   4.933   9.576
   48    HA   PHE  45           HA       PHE  45   5.905   5.695   9.672
   49    HB2  PHE  45          1HB       PHE  45   7.151   2.937  10.020
   50    HB3  PHE  45          2HB       PHE  45   5.447   3.309  10.224
   51    HD1  PHE  45           HD1      PHE  45   8.176   2.911   7.809
   52    HD2  PHE  45           HD2      PHE  45   4.017   3.751   8.320
   53    HE1  PHE  45           HE1      PHE  45   7.803   2.517   5.398
   54    HE2  PHE  45           HE2      PHE  45   3.639   3.356   5.909
   55    HZ   PHE  45           HZ       PHE  45   5.534   2.739   4.447
   56    H    VAL  46           H        VAL  46   5.046   6.184  11.576
   57    HA   VAL  46           HA       VAL  46   6.576   5.429  14.027
   58    HB   VAL  46           HB       VAL  46   5.229   8.102  13.453
   59   HG11  VAL  46          1HG1      VAL  46   6.040   8.775  15.661
   60   HG12  VAL  46          2HG1      VAL  46   4.879   7.433  15.758
   61   HG13  VAL  46          3HG1      VAL  46   6.621   7.119  15.952
   62   HG21  VAL  46          1HG2      VAL  46   7.527   8.997  13.685
   63   HG22  VAL  46          2HG2      VAL  46   8.145   7.344  13.911
   64   HG23  VAL  46          3HG2      VAL  46   7.427   7.821  12.355
   65    H    ARG  47           H        ARG  47   5.413   4.686  15.711
   66    HA   ARG  47           HA       ARG  47   2.438   4.853  15.492
   67    HB2  ARG  47          1HB       ARG  47   3.037   2.599  14.891
   68    HB3  ARG  47          2HB       ARG  47   4.145   2.462  16.248
   69    HG2  ARG  47          1HG       ARG  47   2.344   2.403  17.825
   70    HG3  ARG  47          2HG       ARG  47   1.158   2.821  16.565
   71    HD2  ARG  47          1HD       ARG  47   2.869   0.363  16.430
   72    HD3  ARG  47          2HD       ARG  47   1.293   0.404  17.252
   73    HE   ARG  47           HE       ARG  47   0.835   1.462  14.736
   74   HH11  ARG  47          1HH1      ARG  47   2.079  -1.561  16.028
   75   HH12  ARG  47          2HH1      ARG  47   1.504  -2.517  14.682
   76   HH21  ARG  47          1HH2      ARG  47   0.092   0.208  12.995
   77   HH22  ARG  47          2HH2      ARG  47   0.377  -1.518  12.966
   78    H    ALA  48           H        ALA  48   2.216   6.501  16.959
   79    HA   ALA  48           HA       ALA  48   3.479   6.408  19.566
   80    HB1  ALA  48          1HB       ALA  48   1.986   8.311  20.090
   81    HB2  ALA  48          2HB       ALA  48   2.828   8.540  18.539
   82    HB3  ALA  48          3HB       ALA  48   1.120   8.043  18.559
   83    H    TYR  49           H        TYR  49   2.507   6.095  21.589
   84    HA   TYR  49           HA       TYR  49  -0.107   4.681  21.561
   85    HB2  TYR  49          1HB       TYR  49   1.652   2.937  21.492
   86    HB3  TYR  49          2HB       TYR  49   2.410   3.635  22.917
   87    HD1  TYR  49           HD1      TYR  49  -0.653   1.943  21.674
   88    HD2  TYR  49           HD2      TYR  49   1.644   3.136  25.098
   89    HE1  TYR  49           HE1      TYR  49  -2.076   0.534  23.121
   90    HE2  TYR  49           HE2      TYR  49   0.220   1.726  26.545
   91    HH   TYR  49           HH       TYR  49  -2.533  -0.081  25.213
   92    H    ASN  50           H        ASN  50  -1.421   5.162  23.190
   93    HA   ASN  50           HA       ASN  50  -0.423   7.147  25.151
   94    HB2  ASN  50          1HB       ASN  50  -2.489   7.633  23.859
   95    HB3  ASN  50          2HB       ASN  50  -3.253   6.213  24.562
   96   HD21  ASN  50          1HD2      ASN  50  -4.217   9.271  26.455
   97   HD22  ASN  50          2HD2      ASN  50  -4.275   8.799  24.789
   98    H    ALA  51           H        ALA  51   0.702   6.043  26.658
   99    HA   ALA  51           HA       ALA  51  -0.555   3.664  27.882
  100    HB1  ALA  51          1HB       ALA  51   1.616   3.402  29.036
  101    HB2  ALA  51          2HB       ALA  51   1.820   3.527  27.273
  102    HB3  ALA  51          3HB       ALA  51   2.177   4.926  28.312
  103    H    GLY  52           H        GLY  52  -1.191   6.719  28.252
  104    HA2  GLY  52          1HA       GLY  52  -0.881   6.902  31.197
  105    HA3  GLY  52          2HA       GLY  52  -1.412   8.186  30.128
  106    H    ASN  53           H        ASN  53  -3.072   8.377  31.885
  107    HA   ASN  53           HA       ASN  53  -5.326   6.475  31.393
  108    HB2  ASN  53          1HB       ASN  53  -4.597   8.022  33.900
  109    HB3  ASN  53          2HB       ASN  53  -6.125   7.178  33.678
  110   HD21  ASN  53          1HD2      ASN  53  -2.992   5.205  35.060
  111   HD22  ASN  53          2HD2      ASN  53  -3.169   6.928  35.025
  112    H    SER  54           H        SER  54  -4.535   8.968  29.955
  113    HA   SER  54           HA       SER  54  -7.227  10.115  29.892
  114    HB2  SER  54          1HB       SER  54  -6.595  12.384  30.377
  115    HB3  SER  54          2HB       SER  54  -6.103  11.377  31.730
  116    HG   SER  54           HG       SER  54  -4.575  12.578  29.737
  117    H    GLU  55           H        GLU  55  -7.460  11.741  28.161
  118    HA   GLU  55           HA       GLU  55  -6.254  10.778  25.750
  119    HB2  GLU  55          1HB       GLU  55  -7.845  13.305  26.342
  120    HB3  GLU  55          2HB       GLU  55  -7.357  12.820  24.726
  121    HG2  GLU  55          1HG       GLU  55  -9.496  12.013  24.814
  122    HG3  GLU  55          2HG       GLU  55  -8.579  10.586  25.291
  123    H    LEU  56           H        LEU  56  -4.612  11.473  24.514
  124    HA   LEU  56           HA       LEU  56  -2.997  13.733  25.620
  125    HB2  LEU  56          1HB       LEU  56  -2.036  11.139  24.360
  126    HB3  LEU  56          2HB       LEU  56  -0.992  12.500  24.778
  127    HG   LEU  56           HG       LEU  56  -2.603  10.841  26.749
  128   HD11  LEU  56          1HD1      LEU  56  -0.405   9.991  27.435
  129   HD12  LEU  56          2HD1      LEU  56  -0.761   9.599  25.736
  130   HD13  LEU  56          3HD1      LEU  56   0.363  10.923  26.127
  131   HD21  LEU  56          1HD2      LEU  56  -1.315  12.104  28.441
  132   HD22  LEU  56          2HD2      LEU  56  -0.560  13.064  27.147
  133   HD23  LEU  56          3HD2      LEU  56  -2.309  13.195  27.447
  134    H    ASP  57           H        ASP  57  -1.926  15.077  24.176
  135    HA   ASP  57           HA       ASP  57  -2.873  14.888  21.361
  136    HB2  ASP  57          1HB       ASP  57  -1.587  17.179  22.898
  137    HB3  ASP  57          2HB       ASP  57  -2.001  17.243  21.193
  138    H    VAL  58           H        VAL  58  -1.587  14.149  19.836
  139    HA   VAL  58           HA       VAL  58   1.322  13.926  20.496
  140    HB   VAL  58           HB       VAL  58  -0.412  12.048  18.835
  141   HG11  VAL  58          1HG1      VAL  58   1.562  10.606  18.776
  142   HG12  VAL  58          2HG1      VAL  58   1.855  12.170  17.980
  143   HG13  VAL  58          3HG1      VAL  58   2.506  11.864  19.609
  144   HG21  VAL  58          1HG2      VAL  58  -0.011  10.455  20.688
  145   HG22  VAL  58          2HG2      VAL  58   0.877  11.715  21.576
  146   HG23  VAL  58          3HG2      VAL  58  -0.863  11.909  21.261
  147    H    SER  59           H        SER  59   2.717  14.852  19.164
  148    HA   SER  59           HA       SER  59   1.893  15.304  16.337
  149    HB2  SER  59          1HB       SER  59   1.566  17.418  17.528
  150    HB3  SER  59          2HB       SER  59   3.199  17.339  18.176
  151    HG   SER  59           HG       SER  59   2.680  17.235  15.424
  152    H    VAL  60           H        VAL  60   3.201  13.986  15.264
  153    HA   VAL  60           HA       VAL  60   6.080  13.931  16.053
  154    HB   VAL  60           HB       VAL  60   4.478  11.940  14.388
  155   HG11  VAL  60          1HG1      VAL  60   6.461  10.519  14.561
  156   HG12  VAL  60          2HG1      VAL  60   6.802  12.037  13.699
  157   HG13  VAL  60          3HG1      VAL  60   7.331  11.832  15.387
  158   HG21  VAL  60          1HG2      VAL  60   4.748  10.463  16.355
  159   HG22  VAL  60          2HG2      VAL  60   5.560  11.781  17.231
  160   HG23  VAL  60          3HG2      VAL  60   3.846  11.936  16.776
  161    H    GLY  61           H        GLY  61   7.340  15.184  14.873
  162    HA2  GLY  61          1HA       GLY  61   8.334  16.145  13.006
  163    HA3  GLY  61          2HA       GLY  61   7.461  15.000  12.006
  164    H    SER  62           H        SER  62   5.926  15.780  10.699
  165    HA   SER  62           HA       SER  62   4.992  18.568  11.163
  166    HB2  SER  62          1HB       SER  62   4.362  18.563   8.818
  167    HB3  SER  62          2HB       SER  62   6.032  18.044   8.980
  168    HG   SER  62           HG       SER  62   3.814  16.687   8.154
  169    H    THR  63           H        THR  63   4.025  15.471  11.818
  170    HA   THR  63           HA       THR  63   1.205  15.806  11.038
  171    HB   THR  63           HB       THR  63   0.898  13.530  11.906
  172    HG1  THR  63           HG1      THR  63   3.655  13.421  12.549
  173   HG21  THR  63          1HG2      THR  63   2.463  12.334  10.422
  174   HG22  THR  63          2HG2      THR  63   1.820  13.792   9.628
  175   HG23  THR  63          3HG2      THR  63   3.467  13.795  10.298
  176    H    SER  64           H        SER  64  -0.504  15.277  12.656
  177    HA   SER  64           HA       SER  64   0.055  15.800  15.455
  178    HB2  SER  64          1HB       SER  64   0.223  18.092  14.619
  179    HB3  SER  64          2HB       SER  64  -1.328  17.944  13.810
  180    HG   SER  64           HG       SER  64  -1.486  17.217  16.387
  181    H    LEU  65           H        LEU  65  -1.353  14.657  16.568
  182    HA   LEU  65           HA       LEU  65  -4.175  14.606  15.614
  183    HB2  LEU  65          1HB       LEU  65  -3.183  12.474  14.955
  184    HB3  LEU  65          2HB       LEU  65  -2.558  12.222  16.587
  185    HG   LEU  65           HG       LEU  65  -4.913  12.091  17.421
  186   HD11  LEU  65          1HD1      LEU  65  -6.715  11.825  15.775
  187   HD12  LEU  65          2HD1      LEU  65  -5.963  13.436  15.674
  188   HD13  LEU  65          3HD1      LEU  65  -5.570  12.192  14.463
  189   HD21  LEU  65          1HD2      LEU  65  -5.332   9.850  16.466
  190   HD22  LEU  65          2HD2      LEU  65  -4.168  10.186  15.163
  191   HD23  LEU  65          3HD2      LEU  65  -3.607  10.070  16.848
  192    H    ASN  66           H        ASN  66  -5.471  15.392  17.106
  193    HA   ASN  66           HA       ASN  66  -4.451  15.567  19.885
  194    HB2  ASN  66          1HB       ASN  66  -6.771  16.958  18.505
  195    HB3  ASN  66          2HB       ASN  66  -6.312  17.200  20.184
  196   HD21  ASN  66          1HD2      ASN  66  -4.775  19.682  17.709
  197   HD22  ASN  66          2HD2      ASN  66  -6.353  18.969  17.752
  198    H    ASP  67           H        ASP  67  -5.747  15.086  21.699
  199    HA   ASP  67           HA       ASP  67  -7.269  13.870  22.922
  200    HB2  ASP  67          1HB       ASP  67  -8.927  14.074  20.377
  201    HB3  ASP  67          2HB       ASP  67  -9.535  13.510  21.927
  202    H    VAL  68           H        VAL  68  -5.228  12.395  21.897
  203    HA   VAL  68           HA       VAL  68  -6.223   9.978  20.637
  204    HB   VAL  68           HB       VAL  68  -3.655  10.516  22.189
  205   HG11  VAL  68          1HG1      VAL  68  -2.798   8.495  21.108
  206   HG12  VAL  68          2HG1      VAL  68  -4.182   8.147  22.170
  207   HG13  VAL  68          3HG1      VAL  68  -4.404   8.191  20.405
  208   HG21  VAL  68          1HG2      VAL  68  -2.646  10.676  19.935
  209   HG22  VAL  68          2HG2      VAL  68  -4.253  10.443  19.203
  210   HG23  VAL  68          3HG2      VAL  68  -3.914  11.905  20.163
  211    H    ALA  69           H        ALA  69  -7.261   8.330  21.534
  212    HA   ALA  69           HA       ALA  69  -8.208   8.638  24.216
  213    HB1  ALA  69          1HB       ALA  69  -9.334   6.470  23.834
  214    HB2  ALA  69          2HB       ALA  69  -9.554   7.576  22.458
  215    HB3  ALA  69          3HB       ALA  69  -8.381   6.245  22.347
  216    HA   PRO  70           HA       PRO  70  -5.277   6.678  26.759
  217    HB2  PRO  70          1HB       PRO  70  -7.715   5.301  27.955
  218    HB3  PRO  70          2HB       PRO  70  -6.389   6.129  28.783
  219    HG2  PRO  70          1HG       PRO  70  -8.701   7.414  28.524
  220    HG3  PRO  70          2HG       PRO  70  -7.202   8.297  28.215
  221    HD2  PRO  70          1HD       PRO  70  -9.151   7.074  26.222
  222    HD3  PRO  70          2HD       PRO  70  -8.308   8.675  26.160
  223    H    LEU  71           H        LEU  71  -4.055   4.908  26.415
  224    HA   LEU  71           HA       LEU  71  -3.416   2.775  25.826
  225    HB2  LEU  71          1HB       LEU  71  -6.342   2.046  26.201
  226    HB3  LEU  71          2HB       LEU  71  -4.976   0.926  26.150
  227    HG   LEU  71           HG       LEU  71  -5.522   2.987  28.316
  228   HD11  LEU  71          1HD1      LEU  71  -5.929   1.010  29.709
  229   HD12  LEU  71          2HD1      LEU  71  -7.065   1.094  28.340
  230   HD13  LEU  71          3HD1      LEU  71  -5.694  -0.039  28.291
  231   HD21  LEU  71          1HD2      LEU  71  -3.606   1.922  29.455
  232   HD22  LEU  71          2HD2      LEU  71  -3.335   0.886  28.034
  233   HD23  LEU  71          3HD2      LEU  71  -3.107   2.647  27.909
  234    H    GLY  72           H        GLY  72  -4.726   4.791  23.910
  235    HA2  GLY  72          1HA       GLY  72  -5.357   2.915  21.684
  236    HA3  GLY  72          2HA       GLY  72  -5.599   4.651  21.667
  237    H    SER  73           H        SER  73  -4.480   4.277  19.521
  238    HA   SER  73           HA       SER  73  -1.609   4.859  19.856
  239    HB2  SER  73          1HB       SER  73  -0.872   3.143  18.320
  240    HB3  SER  73          2HB       SER  73  -1.739   2.385  19.647
  241    HG   SER  73           HG       SER  73  -2.496   2.789  17.002
  242    H    SER  74           H        SER  74  -0.590   5.562  17.834
  243    HA   SER  74           HA       SER  74  -2.525   6.499  15.784
  244    HB2  SER  74          1HB       SER  74  -2.325   8.340  17.388
  245    HB3  SER  74          2HB       SER  74  -0.572   8.283  17.276
  246    HG   SER  74           HG       SER  74  -1.294   8.441  14.854
  247    H    ASP  75           H        ASP  75  -1.778   5.490  14.042
  248    HA   ASP  75           HA       ASP  75   1.095   5.211  13.554
  249    HB2  ASP  75          1HB       ASP  75  -1.381   4.502  11.942
  250    HB3  ASP  75          2HB       ASP  75   0.246   4.301  11.307
  251    H    PHE  76           H        PHE  76   2.364   6.349  12.211
  252    HA   PHE  76           HA       PHE  76   1.077   8.650  10.795
  253    HB2  PHE  76          1HB       PHE  76   3.820   8.546  12.117
  254    HB3  PHE  76          2HB       PHE  76   3.194   9.900  11.190
  255    HD1  PHE  76           HD1      PHE  76   3.263   8.253  14.391
  256    HD2  PHE  76           HD2      PHE  76   1.170  11.138  12.035
  257    HE1  PHE  76           HE1      PHE  76   2.238   9.180  16.441
  258    HE2  PHE  76           HE2      PHE  76   0.145  12.069  14.083
  259    HZ   PHE  76           HZ       PHE  76   0.677  11.087  16.286
  260    H    LYS  77           H        LYS  77   0.939   7.871   8.764
  261    HA   LYS  77           HA       LYS  77   3.395   6.752   7.526
  262    HB2  LYS  77          1HB       LYS  77   0.535   6.961   6.503
  263    HB3  LYS  77          2HB       LYS  77   1.872   6.285   5.584
  264    HG2  LYS  77          1HG       LYS  77   2.165   4.529   7.301
  265    HG3  LYS  77          2HG       LYS  77   0.803   5.205   8.207
  266    HD2  LYS  77          1HD       LYS  77  -0.684   4.806   6.266
  267    HD3  LYS  77          2HD       LYS  77   0.678   4.119   5.370
  268    HE2  LYS  77          1HE       LYS  77   0.912   2.333   7.037
  269    HE3  LYS  77          2HE       LYS  77  -0.389   3.034   8.001
  270    HZ1  LYS  77          1HZ       LYS  77  -1.167   1.230   6.649
  271    HZ2  LYS  77          2HZ       LYS  77  -1.885   2.635   6.167
  272    HZ3  LYS  77          3HZ       LYS  77  -0.669   1.978   5.267
  273    H    PHE  78           H        PHE  78   3.782   7.447   5.207
  274    HA   PHE  78           HA       PHE  78   4.587   9.124   3.851
  275    HB2  PHE  78          1HB       PHE  78   2.074  10.583   4.764
  276    HB3  PHE  78          2HB       PHE  78   3.043  10.989   3.356
  277    HD1  PHE  78           HD1      PHE  78   0.558   8.717   4.745
  278    HD2  PHE  78           HD2      PHE  78   3.055   9.535   1.376
  279    HE1  PHE  78           HE1      PHE  78  -0.796   7.172   3.369
  280    HE2  PHE  78           HE2      PHE  78   1.702   7.995  -0.005
  281    HZ   PHE  78           HZ       PHE  78  -0.223   6.812   0.994
  282    H    LEU  79           H        LEU  79   5.723   9.065   6.388
  283    HA   LEU  79           HA       LEU  79   5.919  11.942   7.146
  284    HB2  LEU  79          1HB       LEU  79   5.236  10.402   8.945
  285    HB3  LEU  79          2HB       LEU  79   6.694   9.439   8.688
  286    HG   LEU  79           HG       LEU  79   8.058  11.448   9.351
  287   HD11  LEU  79          1HD1      LEU  79   6.901  13.277  10.511
  288   HD12  LEU  79          2HD1      LEU  79   6.407  13.163   8.807
  289   HD13  LEU  79          3HD1      LEU  79   5.331  12.551  10.087
  290   HD21  LEU  79          1HD2      LEU  79   7.554  11.197  11.756
  291   HD22  LEU  79          2HD2      LEU  79   5.992  10.443  11.352
  292   HD23  LEU  79          3HD2      LEU  79   7.516   9.624  10.926
  293    HA   PRO  80           HA       PRO  80   9.730  11.925   4.923
  294    HB2  PRO  80          1HB       PRO  80  10.030  14.424   6.642
  295    HB3  PRO  80          2HB       PRO  80  10.388  14.212   4.923
  296    HG2  PRO  80          1HG       PRO  80   8.117  15.422   5.586
  297    HG3  PRO  80          2HG       PRO  80   8.086  14.210   4.302
  298    HD2  PRO  80          1HD       PRO  80   7.252  13.944   7.214
  299    HD3  PRO  80          2HD       PRO  80   6.450  13.285   5.731
  300    HA   PRO  81           HA       PRO  81  12.081   9.975   8.195
  301    HB2  PRO  81          1HB       PRO  81  14.130   9.995   5.960
  302    HB3  PRO  81          2HB       PRO  81  13.632   8.658   7.002
  303    HG2  PRO  81          1HG       PRO  81  12.710   8.729   4.503
  304    HG3  PRO  81          2HG       PRO  81  11.607   8.291   5.810
  305    HD2  PRO  81          1HD       PRO  81  11.939  10.976   4.403
  306    HD3  PRO  81          2HD       PRO  81  10.416  10.104   4.847
  307    H    GLY  82           H        GLY  82  13.836  10.606   9.505
  308    HA2  GLY  82          1HA       GLY  82  15.965  12.217   9.181
  309    HA3  GLY  82          2HA       GLY  82  14.689  13.421   9.155
  310    H    SER  83           H        SER  83  16.530  13.649  11.100
  311    HA   SER  83           HA       SER  83  15.531  12.387  13.558
  312    HB2  SER  83          1HB       SER  83  17.917  12.770  13.354
  313    HB3  SER  83          2HB       SER  83  17.662  14.479  13.032
  314    HG   SER  83           HG       SER  83  16.386  14.019  15.214
  315    H    TYR  84           H        TYR  84  13.752  13.070  14.499
  316    HA   TYR  84           HA       TYR  84  13.245  16.013  14.567
  317    HB2  TYR  84          1HB       TYR  84  11.207  13.808  14.056
  318    HB3  TYR  84          2HB       TYR  84  10.796  15.487  14.380
  319    HD1  TYR  84           HD1      TYR  84  11.968  13.095  11.913
  320    HD2  TYR  84           HD2      TYR  84  11.430  17.267  12.762
  321    HE1  TYR  84           HE1      TYR  84  12.172  13.612   9.505
  322    HE2  TYR  84           HE2      TYR  84  11.633  17.782  10.354
  323    HH   TYR  84           HH       TYR  84  12.144  15.205   7.956
  324    H    THR  85           H        THR  85  12.346  16.852  16.406
  325    HA   THR  85           HA       THR  85  12.275  15.041  18.750
  326    HB   THR  85           HB       THR  85  12.032  18.074  18.576
  327    HG1  THR  85           HG1      THR  85  14.171  17.735  19.708
  328   HG21  THR  85          1HG2      THR  85  12.325  18.003  21.021
  329   HG22  THR  85          2HG2      THR  85  10.851  17.136  20.531
  330   HG23  THR  85          3HG2      THR  85  12.313  16.225  20.975
  331    H    ALA  86           H        ALA  86  10.430  13.873  18.620
  332    HA   ALA  86           HA       ALA  86   7.921  15.140  17.848
  333    HB1  ALA  86          1HB       ALA  86   6.950  12.900  18.248
  334    HB2  ALA  86          2HB       ALA  86   8.391  12.818  17.209
  335    HB3  ALA  86          3HB       ALA  86   8.503  12.357  18.923
  336    H    GLN  87           H        GLN  87   6.139  15.569  19.085
  337    HA   GLN  87           HA       GLN  87   6.552  15.392  22.040
  338    HB2  GLN  87          1HB       GLN  87   6.318  17.708  21.246
  339    HB3  GLN  87          2HB       GLN  87   4.818  17.306  20.424
  340    HG2  GLN  87          1HG       GLN  87   4.289  18.437  22.452
  341    HG3  GLN  87          2HG       GLN  87   3.820  16.723  22.639
  342   HE21  GLN  87          1HE2      GLN  87   5.459  16.627  25.695
  343   HE22  GLN  87          2HE2      GLN  87   4.022  16.351  24.770
  344    H    VAL  88           H        VAL  88   5.629  13.601  22.760
  345    HA   VAL  88           HA       VAL  88   3.026  12.794  21.543
  346    HB   VAL  88           HB       VAL  88   5.022  11.086  23.084
  347   HG11  VAL  88          1HG1      VAL  88   3.713   9.204  22.233
  348   HG12  VAL  88          2HG1      VAL  88   2.741  10.280  23.263
  349   HG13  VAL  88          3HG1      VAL  88   2.561  10.340  21.492
  350   HG21  VAL  88          1HG2      VAL  88   5.572  10.124  20.870
  351   HG22  VAL  88          2HG2      VAL  88   4.480  11.297  20.095
  352   HG23  VAL  88          3HG2      VAL  88   5.945  11.864  20.928
  353    H    GLY  89           H        GLY  89   1.591  13.919  22.806
  354    HA2  GLY  89          1HA       GLY  89   0.191  14.201  24.645
  355    HA3  GLY  89          2HA       GLY  89   0.988  12.844  25.419
  356    H    GLN  90           H        GLN  90   2.033  13.312  27.241
  357    HA   GLN  90           HA       GLN  90   2.785  16.150  27.727
  358    HB2  GLN  90          1HB       GLN  90   2.437  13.839  29.681
  359    HB3  GLN  90          2HB       GLN  90   2.838  15.493  30.123
  360    HG2  GLN  90          1HG       GLN  90   0.285  14.604  28.765
  361    HG3  GLN  90          2HG       GLN  90   0.484  15.009  30.494
  362   HE21  GLN  90          1HE2      GLN  90  -0.646  17.859  28.046
  363   HE22  GLN  90          2HE2      GLN  90  -0.906  16.155  27.869
  364    H    GLN  91           H        GLN  91   4.229  13.567  26.460
  365    HA   GLN  91           HA       GLN  91   6.833  14.195  27.775
  366    HB2  GLN  91          1HB       GLN  91   6.081  12.021  28.617
  367    HB3  GLN  91          2HB       GLN  91   5.781  11.451  26.982
  368    HG2  GLN  91          1HG       GLN  91   7.825  10.498  27.743
  369    HG3  GLN  91          2HG       GLN  91   8.222  11.721  26.502
  370   HE21  GLN  91          1HE2      GLN  91  10.441  13.389  28.560
  371   HE22  GLN  91          2HE2      GLN  91   9.918  12.937  26.971
  372    H    SER  92           H        SER  92   8.102  15.146  26.358
  373    HA   SER  92           HA       SER  92   7.910  14.765  23.509
  374    HB2  SER  92          1HB       SER  92   8.878  16.791  24.430
  375    HB3  SER  92          2HB       SER  92  10.117  15.872  25.271
  376    HG   SER  92           HG       SER  92   9.790  15.621  22.513
  377    H    LEU  93           H        LEU  93   8.795  13.322  22.187
  378    HA   LEU  93           HA       LEU  93  10.841  11.470  23.316
  379    HB2  LEU  93          1HB       LEU  93   8.407  10.676  21.677
  380    HB3  LEU  93          2HB       LEU  93   9.705   9.588  22.177
  381    HG   LEU  93           HG       LEU  93   7.835  11.041  24.082
  382   HD11  LEU  93          1HD1      LEU  93   6.805   8.834  24.387
  383   HD12  LEU  93          2HD1      LEU  93   6.649   9.407  22.709
  384   HD13  LEU  93          3HD1      LEU  93   7.858   8.167  23.117
  385   HD21  LEU  93          1HD2      LEU  93   8.811   9.493  25.743
  386   HD22  LEU  93          2HD2      LEU  93   9.895   8.835  24.494
  387   HD23  LEU  93          3HD2      LEU  93  10.065  10.528  25.016
  388    HA   PRO  94           HA       PRO  94  12.214  13.094  19.283
  389    HB2  PRO  94          1HB       PRO  94  14.857  13.402  19.997
  390    HB3  PRO  94          2HB       PRO  94  13.630  14.628  20.343
  391    HG2  PRO  94          1HG       PRO  94  14.715  12.442  22.168
  392    HG3  PRO  94          2HG       PRO  94  14.500  14.157  22.524
  393    HD2  PRO  94          1HD       PRO  94  12.647  12.328  23.301
  394    HD3  PRO  94          2HD       PRO  94  12.154  13.976  22.743
  395    H    VAL  95           H        VAL  95  13.239  11.930  17.657
  396    HA   VAL  95           HA       VAL  95  14.813   9.548  18.235
  397    HB   VAL  95           HB       VAL  95  12.520   8.720  18.720
  398   HG11  VAL  95          1HG1      VAL  95  10.855   8.579  16.930
  399   HG12  VAL  95          2HG1      VAL  95  11.260  10.265  17.334
  400   HG13  VAL  95          3HG1      VAL  95  11.927   9.515  15.862
  401   HG21  VAL  95          1HG2      VAL  95  12.567   6.797  17.162
  402   HG22  VAL  95          2HG2      VAL  95  13.694   7.681  16.107
  403   HG23  VAL  95          3HG2      VAL  95  14.200   7.196  17.742
  404    H    LYS  96           H        LYS  96  15.987   8.897  16.501
  405    HA   LYS  96           HA       LYS  96  15.808  10.459  14.039
  406    HB2  LYS  96          1HB       LYS  96  17.992   9.724  14.967
  407    HB3  LYS  96          2HB       LYS  96  17.531   8.044  14.736
  408    HG2  LYS  96          1HG       LYS  96  17.526   8.301  12.338
  409    HG3  LYS  96          2HG       LYS  96  17.743  10.050  12.476
  410    HD2  LYS  96          1HD       LYS  96  19.942   9.676  13.576
  411    HD3  LYS  96          2HD       LYS  96  19.726   7.931  13.378
  412    HE2  LYS  96          1HE       LYS  96  19.624   9.831  11.021
  413    HE3  LYS  96          2HE       LYS  96  21.144   9.159  11.615
  414    HZ1  LYS  96          1HZ       LYS  96  20.227   7.844   9.849
  415    HZ2  LYS  96          2HZ       LYS  96  20.251   6.962  11.242
  416    HZ3  LYS  96          3HZ       LYS  96  18.830   7.592  10.688
  417    H    LEU  97           H        LEU  97  14.573  10.049  12.368
  418    HA   LEU  97           HA       LEU  97  13.200   7.408  12.308
  419    HB2  LEU  97          1HB       LEU  97  12.442  10.043  10.998
  420    HB3  LEU  97          2HB       LEU  97  11.491   8.555  10.951
  421    HG   LEU  97           HG       LEU  97  12.125  10.134  13.469
  422   HD11  LEU  97          1HD1      LEU  97   9.769  10.811  13.358
  423   HD12  LEU  97          2HD1      LEU  97  10.685  11.384  11.944
  424   HD13  LEU  97          3HD1      LEU  97   9.603   9.979  11.794
  425   HD21  LEU  97          1HD2      LEU  97  10.414   8.655  14.468
  426   HD22  LEU  97          2HD2      LEU  97  10.257   7.791  12.919
  427   HD23  LEU  97          3HD2      LEU  97  11.783   7.710  13.832
  428    H    ASP  98           H        ASP  98  14.583   6.122  11.162
  429    HA   ASP  98           HA       ASP  98  15.562   6.936   8.537
  430    HB2  ASP  98          1HB       ASP  98  15.471   4.251   9.964
  431    HB3  ASP  98          2HB       ASP  98  16.155   4.469   8.359
  432    HA   PRO  99           HA       PRO  99  12.103   5.887   6.147
  433    HB2  PRO  99          1HB       PRO  99  13.282   5.079   3.787
  434    HB3  PRO  99          2HB       PRO  99  13.252   6.768   4.311
  435    HG2  PRO  99          1HG       PRO  99  15.468   4.701   4.645
  436    HG3  PRO  99          2HG       PRO  99  15.601   6.359   4.055
  437    HD2  PRO  99          1HD       PRO  99  16.184   5.754   6.634
  438    HD3  PRO  99          2HD       PRO  99  15.358   7.306   6.209
  439    H    ASP 100           H        ASP 100  10.841   4.120   5.489
  440    HA   ASP 100           HA       ASP 100  10.114   1.937   5.506
  441    HB2  ASP 100          1HB       ASP 100  13.012   1.398   4.741
  442    HB3  ASP 100          2HB       ASP 100  11.723   0.205   4.667
  443    H    SER 101           H        SER 101  10.662   2.963   7.999
  444    HA   SER 101           HA       SER 101  11.190   0.453   9.439
  445    HB2  SER 101          1HB       SER 101  13.419   1.484   9.306
  446    HB3  SER 101          2HB       SER 101  12.785   2.979   9.978
  447    HG   SER 101           HG       SER 101  12.415   0.556  11.306
  448    H    TYR 102           H        TYR 102  10.274   0.360  11.483
  449    HA   TYR 102           HA       TYR 102   8.198   2.461  11.869
  450    HB2  TYR 102          1HB       TYR 102   8.298  -0.461  12.718
  451    HB3  TYR 102          2HB       TYR 102   7.038   0.657  13.218
  452    HD1  TYR 102           HD1      TYR 102   8.624  -0.886  10.226
  453    HD2  TYR 102           HD2      TYR 102   5.185   1.096  11.851
  454    HE1  TYR 102           HE1      TYR 102   7.363  -1.384   8.160
  455    HE2  TYR 102           HE2      TYR 102   3.922   0.599   9.785
  456    HH   TYR 102           HH       TYR 102   5.425  -1.169   7.090
  457    H    TYR 103           H        TYR 103   8.076   3.654  13.639
  458    HA   TYR 103           HA       TYR 103   9.846   2.899  15.927
  459    HB2  TYR 103          1HB       TYR 103   9.311   5.691  14.832
  460    HB3  TYR 103          2HB       TYR 103  10.209   5.339  16.302
  461    HD1  TYR 103           HD1      TYR 103  10.230   5.095  12.622
  462    HD2  TYR 103           HD2      TYR 103  12.469   4.535  16.239
  463    HE1  TYR 103           HE1      TYR 103  12.310   4.890  11.304
  464    HE2  TYR 103           HE2      TYR 103  14.548   4.330  14.922
  465    HH   TYR 103           HH       TYR 103  15.457   4.368  12.901
  466    H    THR 104           H        THR 104   8.544   2.192  17.458
  467    HA   THR 104           HA       THR 104   5.895   3.395  17.851
  468    HB   THR 104           HB       THR 104   7.358   1.230  19.422
  469    HG1  THR 104           HG1      THR 104   6.796   0.179  17.658
  470   HG21  THR 104          1HG2      THR 104   5.140   0.751  20.383
  471   HG22  THR 104          2HG2      THR 104   5.663   2.405  20.780
  472   HG23  THR 104          3HG2      THR 104   4.456   2.137  19.503
  473    H    LEU 105           H        LEU 105   5.405   4.995  19.158
  474    HA   LEU 105           HA       LEU 105   7.483   5.849  21.124
  475    HB2  LEU 105          1HB       LEU 105   5.358   7.512  19.729
  476    HB3  LEU 105          2HB       LEU 105   6.538   8.117  20.893
  477    HG   LEU 105           HG       LEU 105   7.185   6.970  18.155
  478   HD11  LEU 105          1HD1      LEU 105   7.765   9.294  17.609
  479   HD12  LEU 105          2HD1      LEU 105   6.050   9.131  18.051
  480   HD13  LEU 105          3HD1      LEU 105   7.209   9.809  19.216
  481   HD21  LEU 105          1HD2      LEU 105   9.466   7.773  18.657
  482   HD22  LEU 105          2HD2      LEU 105   8.936   8.269  20.282
  483   HD23  LEU 105          3HD2      LEU 105   8.945   6.547  19.838
  484    H    VAL 106           H        VAL 106   6.752   4.594  22.838
  485    HA   VAL 106           HA       VAL 106   3.985   4.880  23.760
  486    HB   VAL 106           HB       VAL 106   6.419   3.578  25.056
  487   HG11  VAL 106          1HG1      VAL 106   4.809   2.485  26.541
  488   HG12  VAL 106          2HG1      VAL 106   4.796   4.254  26.729
  489   HG13  VAL 106          3HG1      VAL 106   3.496   3.446  25.821
  490   HG21  VAL 106          1HG2      VAL 106   5.334   1.471  24.338
  491   HG22  VAL 106          2HG2      VAL 106   4.042   2.407  23.548
  492   HG23  VAL 106          3HG2      VAL 106   5.714   2.509  22.941
  493    H    SER 107           H        SER 107   3.291   6.598  24.810
  494    HA   SER 107           HA       SER 107   5.229   8.057  26.557
  495    HB2  SER 107          1HB       SER 107   4.426   9.454  24.747
  496    HB3  SER 107          2HB       SER 107   2.756   9.025  25.089
  497    HG   SER 107           HG       SER 107   3.657  11.056  25.938
  498    H    GLN 108           H        GLN 108   4.808   8.329  28.659
  499    HA   GLN 108           HA       GLN 108   2.126   7.579  29.685
  500    HB2  GLN 108          1HB       GLN 108   3.573   5.517  29.686
  501    HB3  GLN 108          2HB       GLN 108   4.704   6.353  30.741
  502    HG2  GLN 108          1HG       GLN 108   3.081   6.488  32.504
  503    HG3  GLN 108          2HG       GLN 108   1.802   5.858  31.429
  504   HE21  GLN 108          1HE2      GLN 108   2.439   2.540  32.170
  505   HE22  GLN 108          2HE2      GLN 108   1.380   3.755  31.537
  506    HA   PRO 109           HA       PRO 109   3.490  11.401  31.673
  507    HB2  PRO 109          1HB       PRO 109   0.530  11.280  32.338
  508    HB3  PRO 109          2HB       PRO 109   1.494  12.663  31.800
  509    HG2  PRO 109          1HG       PRO 109  -0.087  11.460  30.028
  510    HG3  PRO 109          2HG       PRO 109   1.543  11.928  29.537
  511    HD2  PRO 109          1HD       PRO 109   0.507   9.191  30.387
  512    HD3  PRO 109          2HD       PRO 109   1.601   9.617  29.008
  513    H    GLY 110           H        GLY 110   4.473  11.138  33.584
  514    HA2  GLY 110          1HA       GLY 110   4.566  10.907  35.930
  515    HA3  GLY 110          2HA       GLY 110   2.941  10.246  35.930
  516    H    GLY 111           H        GLY 111   4.713   8.727  33.520
  517    HA2  GLY 111          1HA       GLY 111   5.552   6.516  35.361
  518    HA3  GLY 111          2HA       GLY 111   4.665   6.196  33.881
  519    H    LYS 112           H        LYS 112   6.052   5.223  32.529
  520    HA   LYS 112           HA       LYS 112   8.605   6.629  31.925
  521    HB2  LYS 112          1HB       LYS 112   9.114   4.783  33.510
  522    HB3  LYS 112          2HB       LYS 112   8.343   3.635  32.424
  523    HG2  LYS 112          1HG       LYS 112  10.035   4.083  30.706
  524    HG3  LYS 112          2HG       LYS 112  10.793   5.293  31.752
  525    HD2  LYS 112          1HD       LYS 112  11.252   3.552  33.445
  526    HD3  LYS 112          2HD       LYS 112  10.484   2.339  32.410
  527    HE2  LYS 112          1HE       LYS 112  12.171   2.768  30.652
  528    HE3  LYS 112          2HE       LYS 112  12.938   3.979  31.682
  529    HZ1  LYS 112          1HZ       LYS 112  14.050   1.874  31.820
  530    HZ2  LYS 112          2HZ       LYS 112  13.388   2.250  33.284
  531    HZ3  LYS 112          3HZ       LYS 112  12.672   1.118  32.322
  532    HA   PRO 113           HA       PRO 113   6.942   5.851  27.915
  533    HB2  PRO 113          1HB       PRO 113   8.716   7.366  26.498
  534    HB3  PRO 113          2HB       PRO 113   7.455   8.105  27.494
  535    HG2  PRO 113          1HG       PRO 113  10.384   7.605  28.180
  536    HG3  PRO 113          2HG       PRO 113   9.450   9.092  28.384
  537    HD2  PRO 113          1HD       PRO 113   9.834   7.335  30.447
  538    HD3  PRO 113          2HD       PRO 113   8.311   8.296  30.280
  539    H    GLN 114           H        GLN 114   7.784   4.898  25.873
  540    HA   GLN 114           HA       GLN 114  10.369   3.488  26.109
  541    HB2  GLN 114          1HB       GLN 114   8.777   1.944  27.172
  542    HB3  GLN 114          2HB       GLN 114   7.706   2.050  25.784
  543    HG2  GLN 114          1HG       GLN 114   8.875   0.001  25.613
  544    HG3  GLN 114          2HG       GLN 114   9.572   1.091  24.383
  545   HE21  GLN 114          1HE2      GLN 114  12.802   0.619  25.516
  546   HE22  GLN 114          2HE2      GLN 114  11.701   0.958  24.223
  547    H    LEU 115           H        LEU 115  11.416   3.649  24.271
  548    HA   LEU 115           HA       LEU 115   9.845   3.964  21.762
  549    HB2  LEU 115          1HB       LEU 115  12.662   4.658  22.584
  550    HB3  LEU 115          2HB       LEU 115  12.272   4.436  20.876
  551    HG   LEU 115           HG       LEU 115  10.451   6.209  21.209
  552   HD11  LEU 115          1HD1      LEU 115  10.776   7.717  23.118
  553   HD12  LEU 115          2HD1      LEU 115  10.340   6.076  23.646
  554   HD13  LEU 115          3HD1      LEU 115  12.026   6.632  23.764
  555   HD21  LEU 115          1HD2      LEU 115  12.102   8.037  21.012
  556   HD22  LEU 115          2HD2      LEU 115  13.375   6.956  21.629
  557   HD23  LEU 115          3HD2      LEU 115  12.603   6.617  20.061
  558    H    VAL 116           H        VAL 116   9.747   2.429  20.273
  559    HA   VAL 116           HA       VAL 116  11.743   0.214  20.415
  560    HB   VAL 116           HB       VAL 116   8.747  -0.082  19.922
  561   HG11  VAL 116          1HG1      VAL 116   9.201  -2.487  19.894
  562   HG12  VAL 116          2HG1      VAL 116  10.045  -1.632  18.579
  563   HG13  VAL 116          3HG1      VAL 116  10.944  -2.158  20.022
  564   HG21  VAL 116          1HG2      VAL 116   8.779  -1.341  22.053
  565   HG22  VAL 116          2HG2      VAL 116  10.509  -0.970  22.245
  566   HG23  VAL 116          3HG2      VAL 116   9.307   0.342  22.292
  567    H    ALA 117           H        ALA 117  12.848   0.087  18.598
  568    HA   ALA 117           HA       ALA 117  11.599   1.054  16.087
  569    HB1  ALA 117          1HB       ALA 117  13.889   0.916  15.158
  570    HB2  ALA 117          2HB       ALA 117  13.831   1.928  16.622
  571    HB3  ALA 117          3HB       ALA 117  14.471   0.268  16.708
  572    H    GLU 118           H        GLU 118  11.018  -0.211  14.456
  573    HA   GLU 118           HA       GLU 118  11.799  -3.088  14.587
  574    HB2  GLU 118          1HB       GLU 118   9.013  -1.977  14.057
  575    HB3  GLU 118          2HB       GLU 118   9.475  -3.658  13.823
  576    HG2  GLU 118          1HG       GLU 118  10.028  -3.824  16.231
  577    HG3  GLU 118          2HG       GLU 118   9.505  -2.155  16.449
  578    HA   PRO 119           HA       PRO 119  12.939  -2.779  10.400
  579    HB2  PRO 119          1HB       PRO 119  11.433  -5.409  10.110
  580    HB3  PRO 119          2HB       PRO 119  13.062  -4.994   9.562
  581    HG2  PRO 119          1HG       PRO 119  12.815  -6.456  11.767
  582    HG3  PRO 119          2HG       PRO 119  13.988  -5.135  11.754
  583    HD2  PRO 119          1HD       PRO 119  11.191  -5.202  12.954
  584    HD3  PRO 119          2HD       PRO 119  12.713  -4.517  13.649