NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type subtype subsubtype
2884 1cqg cing 1-original 2 XPLOR/CNS distance NOE ambi


!within hTRX

!M1

!V2
assign (resid 2 and name HG2#) (resid 3 and name HN) 4.0 2.2 1.5	!#A 762  2.78e+05
assign (resid 2 and name HB) (resid 3 and name HN) 4.0 2.2 1.0	!#A 760  2.82e+05
assign (resid 2 and name HA) (resid 3 and name HN) 2.5 0.7 0.4	!#A 34  2.36e+06
assign (resid 2 and name HG1#) (resid 3 and name HN) 2.5 0.7 0.9	!#A 23  1.27e+06
assign (resid 2 and name HG2#) (resid 46 and name HN) 4.0 2.2 1.5	!#A 637  1.85e+05
assign (resid 2 and name HG1#) (resid 56 and name HN) 3.0 1.2 1.2	!#A 348  8.33e+05

!K3
assign (resid 3 and name HB#) (resid 3 and name HN) 2.5 0.7 0.4	!#A 22  1.45e+06
assign (resid 3 and name HA) (resid 3 and name HN) 3.0 1.2 0.5	!#A 21  7.75e+05
assign (resid 3 and name HB#) (resid 4 and name HN) 4.0 2.2 1.0	!#A 74  3.87e+05
assign (resid 3 and name HB1) (resid 4 and name HN) 4.0 2.2 1.0	!#A 37  3.87e+05
assign (resid 3 and name HN) (resid 4 and name HN) 4.0 2.2 1.0	!#A 763  2.01e+05
assign (resid 3 and name HN) (resid 4 and name HA) 4.0 2.2 1.0	!#A 32  6.64e+05
assign (resid 3 and name HG#) (resid 4 and name HN) 4.0 2.2 1.0	!#A 55  2.57e+05
assign (resid 3 and name HA) (resid 4 and name HN) 2.5 0.7 0.4	!#A 53  4.13e+06
assign (resid 3 and name HB1) (resid 5 and name HN) 4.0 2.2 1.5	!#A 767  1.87e+05
assign (resid 3 and name HG#) (resid 5 and name HN) 4.0 2.2 1.0	!#A 77  2.15e+05
assign (resid 3 and name HN) (resid 5 and name HN) 4.0 2.2 2.0	!#A 67  1.68e+05
assign (resid 3 and name HN) (resid 55 and name HA) 3.0 1.2 0.5	!#A 31  6.13e+05
assign (resid 3 and name HB1) (resid 56 and name HN) 4.0 2.2 1.0	!#A 343  1.84e+05
assign (resid 3 and name HN) (resid 56 and name HN) 4.0 2.2 1.0	!#A 764  1.51e+05
assign (resid 3 and name HN) (resid 56 and name HB#) 4.0 2.2 1.0	!#A 35  1.55e+05

!Q4
assign (resid 4 and name HG#) (resid 4 and name HE2#) 4.0 2.2 1.0	!#A 694  4.75e+05
assign (resid 4 and name HG#) (resid 4 and name HE2#) 3.0 1.2 1.0	!#A 693  6.40e+05
assign (resid 4 and name HA) (resid 4 and name HE2#) 4.0 2.2 1.0	!#A 689  4.62e+05
assign (resid 4 and name HG#) (resid 4 and name HE2#) 4.0 2.2 1.0	!#A 514  4.75e+05
assign (resid 4 and name HN) (resid 5 and name HG1#) 4.0 2.2 1.0	!#A 93  2.31e+05
assign (resid 4 and name HG#) (resid 5 and name HN) 4.0 2.2 1.0	!#A 42  4.53e+05
assign (resid 4 and name HA) (resid 5 and name HN) 2.5 0.7 0.4	!#A 40  1.96e+06
assign (resid 4 and name HG#) (resid 6 and name HN) 4.0 2.2 1.0	!#A 153  1.59e+05
assign (resid 4 and name HE2#) (resid 30 and name HG2#) 4.0 2.2 1.0	!#A 696  1.71e+05
assign (resid 4 and name HN) (resid 56 and name HN) 4.0 2.2 1.0	!#A 92  1.92e+05
assign (resid 4 and name HA) (resid 56 and name HN) 3.0 1.2 0.5	!#A 245  7.29e+05
assign (resid 4 and name HE2#) (resid 58 and name HB1) 4.0 2.2 1.0	!#A 690  1.65e+05
assign (resid 4 and name HE2#) (resid 58 and name HN) 4.0 2.2 1.0	!#A 683  2.09e+05
assign (resid 4 and name HG#) (resid 58 and name HN) 4.0 2.2 1.0	!#A 16  3.23e+05

!I5
assign (resid 5 and name HG2#) (resid 5 and name HN) 4.0 2.2 1.5	!#A 79  1.61e+05
assign (resid 5 and name HD1#) (resid 5 and name HN) 4.0 2.2 1.5	!#A 80  2.43e+05
assign (resid 5 and name HB) (resid 5 and name HN) 2.5 0.7 0.4	!#A 43  2.63e+06
assign (resid 5 and name HG1#) (resid 5 and name HN) 4.0 2.2 1.0	!#A 46  2.42e+05
assign (resid 5 and name HD1#) (resid 6 and name HN) 4.0 2.2 1.0	!#A 110  5.05e+05
assign (resid 5 and name HA) (resid 6 and name HN) 2.5 0.7 0.4	!#A 106  2.21e+06
assign (resid 5 and name HG2#) (resid 6 and name HN) 3.0 1.2 1.3	!#A 109  5.61e+05
assign (resid 5 and name HN) (resid 6 and name HN) 4.0 2.2 1.0	!#A 39  1.68e+05
assign (resid 5 and name HB) (resid 7 and name HN) 4.0 2.2 1.0	!#A 733  3.60e+05
assign (resid 5 and name HN) (resid 7 and name HN) 4.0 2.2 1.3	!#A 68  2.17e+05
assign (resid 5 and name HG2#) (resid 7 and name HN) 2.5 0.7 0.9	!#A 544  1.79e+06
assign (resid 5 and name HA) (resid 7 and name HN) 3.0 1.2 0.5	!#A 540  5.94e+05
assign (resid 5 and name HD1#) (resid 11 and name HN) 4.0 2.2 1.5	!#A 327  2.24e+05
assign (resid 5 and name HG2#) (resid 11 and name HN) 2.5 0.7 0.9	!#A 236  1.05e+06
assign (resid 5 and name HG2#) (resid 12 and name HN) 4.0 2.2 1.5	!#A 569  1.53e+05
assign (resid 5 and name HD1#) (resid 14 and name HN) 4.0 2.2 1.5	!#A 262  2.11e+05
assign (resid 5 and name HG1#) (resid 56 and name HN) 4.0 2.2 1.0	!#A 247  1.63e+05
assign (resid 5 and name HN) (resid 56 and name HN) 4.0 2.2 1.0	!#A 243  4.21e+05
assign (resid 5 and name HN) (resid 57 and name HA) 4.0 2.2 1.0	!#A 41  2.00e+05
assign (resid 5 and name HN) (resid 57 and name HG2#) 4.0 2.2 1.5	!#A 47  1.95e+05
assign (resid 5 and name HN) (resid 58 and name HN) 4.0 2.2 1.0	!#A 38  1.58e+05

!E6
assign (resid 6 and name HG#) (resid 6 and name HN) 2.5 0.7 0.4	!#A 107  1.29e+06
assign (resid 6 and name HB2) (resid 6 and name HN) 2.5 0.7 0.4	!#A 107  1.29e+06
assign (resid 6 and name HA) (resid 6 and name HN) 3.0 1.2 0.5	!#A 105  7.24e+05
assign (resid 6 and name HB2) (resid 7 and name HN) 3.0 1.2 0.5	!#A 732  5.05e+05
assign (resid 6 and name HN) (resid 7 and name HB1) 4.0 2.2 1.0	!#A 152  1.79e+05
assign (resid 6 and name HG#) (resid 7 and name HN) 4.0 2.2 1.0	!#A 541  5.05e+05
assign (resid 6 and name HA) (resid 7 and name HN) 3.0 1.2 0.5	!#A 539  5.67e+05
assign (resid 6 and name HB1) (resid 7 and name HN) 4.0 2.2 1.0	!#A 542  3.60e+05
assign (resid 6 and name HN) (resid 7 and name HN) 2.5 0.7 0.4	!#A 104  9.83e+05
assign (resid 6 and name HN) (resid 10 and name HB#) 3.0 1.2 0.5	!#A 108  6.77e+05

!S7
assign (resid 7 and name HB2) (resid 7 and name HN) 4.0 2.2 1.0	!#A 729  1.94e+05
assign (resid 7 and name HA) (resid 7 and name HN) 3.0 1.2 0.5	!#A 538  8.22e+05
assign (resid 7 and name HN) (resid 8 and name HN) 4.0 2.2 1.0	!#A 146  1.65e+05
assign (resid 7 and name HA) (resid 8 and name HN) 4.0 2.2 1.0	!#A 147  2.04e+05
assign (resid 7 and name HN) (resid 9 and name HN) 4.0 2.2 1.0	!#A 536  2.41e+05
assign (resid 7 and name HN) (resid 10 and name HB#) 2.5 0.7 0.9	!#A 543  2.59e+06
assign (resid 7 and name HN) (resid 10 and name HN) 4.0 2.2 1.0	!#A 119  2.34e+05
assign (resid 7 and name HN) (resid 11 and name HN) 4.0 2.2 1.0	!#A 319  1.62e+05
assign (resid 7 and name HN) (resid 65 and name HG2#) 3.0 1.2 1.2	!#A 545  6.27e+05

!K8
assign (resid 8 and name HG#) (resid 8 and name HN) 4.0 2.2 1.0	!#A 148  6.68e+05
assign (resid 8 and name HG#) (resid 9 and name HN) 4.0 2.2 1.0	!#A 615  2.27e+05
assign (resid 8 and name HN) (resid 9 and name HN) 3.0 1.2 0.5	!#A 145  5.65e+05
assign (resid 8 and name HN) (resid 10 and name HN) 4.0 2.2 1.0	!#A 116  1.65e+05
assign (resid 8 and name HB#) (resid 11 and name HN) 4.0 2.2 1.0	!#A 323  3.57e+05
assign (resid 8 and name HG#) (resid 11 and name HN) 4.0 2.2 1.0	!#A 325  1.57e+05
assign (resid 8 and name HA) (resid 11 and name HN) 3.0 1.2 0.5	!#A 232  7.57e+05
assign (resid 8 and name HA) (resid 12 and name HN) 4.0 2.2 1.0	!#A 566  2.39e+05
assign (resid 8 and name HN) (resid 64 and name HB1) 4.0 2.2 1.0	!#A 214  2.01e+05
assign (resid 8 and name HG#) (resid 65 and name HN) 4.0 2.2 1.0	!#A 219  1.72e+05
assign (resid 8 and name HN) (resid 65 and name HN) 4.0 2.2 1.0	!#A 211  1.60e+05
assign (resid 8 and name HN) (resid 65 and name HG2#) 3.0 1.2 0.5	!#A 150  5.58e+05

!T9
assign (resid 9 and name HB) (resid 10 and name HN) 2.5 0.7 0.4	!#A 168  1.05e+06
assign (resid 9 and name HG2#) (resid 10 and name HN) 4.0 2.2 1.5	!#A 122  3.11e+05
assign (resid 9 and name HA) (resid 10 and name HN) 3.0 1.2 0.5	!#A 120  1.05e+06
assign (resid 9 and name HN) (resid 10 and name HN) 3.0 1.2 0.5	!#A 117  7.90e+05
assign (resid 9 and name HG2#) (resid 11 and name HN) 4.0 2.2 1.7	!#A 326  1.96e+05
assign (resid 9 and name HA) (resid 11 and name HN) 4.0 2.2 1.0	!#A 322  2.57e+05
assign (resid 9 and name HA) (resid 12 and name HN) 3.0 1.2 0.8	!#A 424  6.39e+05
assign (resid 9 and name HN) (resid 64 and name HB2) 4.0 2.2 1.2	!#A 465  1.79e+05

!A10
assign (resid 10 and name HA) (resid 10 and name HN) 2.5 0.7 0.4	!#A 167  1.01e+06
assign (resid 10 and name HB#) (resid 10 and name HN) 2.5 0.7 0.9	!#A 121  2.07e+06
assign (resid 10 and name HB#) (resid 11 and name HN) 2.5 0.7 0.9	!#A 235  1.23e+06
assign (resid 10 and name HN) (resid 11 and name HN) 3.0 1.2 0.5	!#A 118  8.01e+05
assign (resid 10 and name HN) (resid 12 and name HN) 4.0 2.2 1.0	!#A 166  1.51e+05
assign (resid 10 and name HN) (resid 13 and name HG#) 4.0 2.2 2.0	!#A 169  1.98e+05
assign (resid 10 and name HA) (resid 13 and name HN) 3.0 1.2 0.7	!#A 414  5.89e+05
assign (resid 10 and name HA) (resid 14 and name HN) 4.0 2.2 1.0	!#A 254  2.91e+05

!F11
assign (resid 11 and name HD#) (resid 11 and name HN) 4.0 2.2 1.0	!#A 320  3.02e+05
assign (resid 11 and name HA) (resid 11 and name HN) 2.5 0.7 0.4	!#A 321  1.19e+06
assign (resid 11 and name HB2) (resid 11 and name HN) 2.5 0.7 0.4	!#A 234  1.50e+06
assign (resid 11 and name HB1) (resid 11 and name HN) 2.5 0.7 0.4	!#A 233  1.51e+06
assign (resid 11 and name HD#) (resid 12 and name HN) 4.0 2.2 1.0	!#A 565  2.91e+05
assign (resid 11 and name HN) (resid 12 and name HN) 2.5 0.7 0.6	!#A 318  1.02e+06
assign (resid 11 and name HB2) (resid 12 and name HN) 3.0 1.2 0.5	!#A 427  6.08e+05
assign (resid 11 and name HA) (resid 12 and name HN) 4.0 2.2 1.0	!#A 423  3.13e+05
assign (resid 11 and name HB1) (resid 12 and name HN) 2.5 0.7 0.4	!#A 426  1.08e+06
assign (resid 11 and name HD#) (resid 14 and name HN) 4.0 2.2 1.5	!#A 253  2.55e+05
assign (resid 11 and name HN) (resid 14 and name HN) 4.0 2.2 1.0	!#A 250  1.63e+05
assign (resid 11 and name HN) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 327  2.24e+05

!Q12
assign (resid 12 and name HB#) (resid 12 and name HE2#) 3.0 1.2 0.5	!#A 628  5.00e+05
assign (resid 12 and name HE2#) (resid 12 and name HN) 4.0 2.2 1.5	!#A 564  1.87e+05
assign (resid 12 and name HG#) (resid 12 and name HE2#) 2.5 0.7 0.6	!#A 476  2.40e+06
assign (resid 12 and name HG#) (resid 12 and name HN) 3.0 1.2 0.5	!#A 428  5.81e+05
assign (resid 12 and name HA) (resid 12 and name HE2#) 4.0 2.2 1.5	!#A 475  2.49e+05
assign (resid 12 and name HB#) (resid 12 and name HN) 2.5 0.7 0.8	!#A 429  2.27e+06
assign (resid 12 and name HA) (resid 12 and name HN) 2.5 0.7 0.4	!#A 425  1.01e+06
assign (resid 12 and name HE2#) (resid 13 and name HN) 4.0 2.2 2.0	!#A 623  2.39e+05
assign (resid 12 and name HN) (resid 13 and name HN) 2.5 0.7 0.4	!#A 561  9.67e+05
assign (resid 12 and name HA) (resid 13 and name HN) 4.0 2.2 1.0	!#A 552  2.74e+05
assign (resid 12 and name HN) (resid 14 and name HN) 4.0 2.2 1.0	!#A 563  2.06e+05
assign (resid 12 and name HN) (resid 14 and name HB#) 4.0 2.2 1.7	!#A 568  1.73e+05
assign (resid 12 and name HA) (resid 14 and name HN) 4.0 2.2 1.0	!#A 255  1.65e+05
assign (resid 12 and name HA) (resid 15 and name HN) 4.0 2.2 1.0	!#A 558  3.89e+05
assign (resid 12 and name HA) (resid 16 and name HN) 4.0 2.2 1.0	!#A 270  2.27e+05

!E13
assign (resid 13 and name HG#) (resid 14 and name HN) 4.0 2.2 1.0	!#A 257  1.54e+05
assign (resid 13 and name HB1) (resid 14 and name HN) 3.0 1.2 0.8	!#A 260  8.71e+05
assign (resid 13 and name HB2) (resid 14 and name HN) 3.0 1.2 0.5	!#A 259  8.70e+05
assign (resid 13 and name HG#) (resid 14 and name HN) 4.0 2.2 1.0	!#A 182  1.74e+05
assign (resid 13 and name HN) (resid 14 and name HN) 2.5 0.7 0.4	!#A 179  1.34e+06
assign (resid 13 and name HN) (resid 15 and name HN) 4.0 2.2 1.0	!#A 553  1.51e+05
assign (resid 13 and name HA) (resid 16 and name HN) 3.0 1.2 0.5	!#A 269  7.71e+05

!A14
assign (resid 14 and name HB#) (resid 14 and name HN) 2.5 0.7 0.9	!#A 183  3.60e+06
assign (resid 14 and name HA) (resid 14 and name HN) 2.5 0.7 0.4	!#A 181  1.95e+06
assign (resid 14 and name HN) (resid 15 and name HB2) 4.0 2.2 1.0	!#A 261  1.74e+05
assign (resid 14 and name HN) (resid 15 and name HN) 4.0 2.2 1.0	!#A 252  1.79e+05
assign (resid 14 and name HB#) (resid 15 and name HN) 3.0 1.2 1.0	!#A 419  8.41e+05
assign (resid 14 and name HA) (resid 15 and name HN) 4.0 2.2 1.0	!#A 417  3.13e+05
assign (resid 14 and name HB#) (resid 16 and name HN) 4.0 2.2 1.5	!#A 368  2.06e+05
assign (resid 14 and name HN) (resid 16 and name HN) 4.0 2.2 1.0	!#A 249  1.84e+05
assign (resid 14 and name HN) (resid 17 and name HN) 4.0 2.2 1.0	!#A 250  1.63e+05
assign (resid 14 and name HA) (resid 17 and name HN) 3.0 1.2 0.5	!#A 195  7.46e+05
assign (resid 14 and name HA) (resid 18 and name HN) 4.0 2.2 1.0	!#A 445  3.39e+05

!L15
assign (resid 15 and name HG) (resid 15 and name HN) 2.5 0.7 0.4	!#A 420  1.57e+06
assign (resid 15 and name HB1) (resid 15 and name HN) 4.0 2.2 1.0	!#A 420  1.57e+05
assign (resid 15 and name HD2#) (resid 15 and name HN) 4.0 2.2 1.5	!#A 421  4.46e+05
assign (resid 15 and name HD1#) (resid 15 and name HN) 4.0 2.2 1.5	!#A 422  3.34e+05
assign (resid 15 and name HB2) (resid 15 and name HN) 3.0 1.2 0.5	!#A 418  7.22e+05
assign (resid 15 and name HG) (resid 16 and name HN) 3.0 1.2 1.5	!#A 369  9.73e+05
assign (resid 15 and name HA) (resid 16 and name HN) 4.0 2.2 1.0	!#A 365  4.11e+05
assign (resid 15 and name HD1#) (resid 16 and name HN) 4.0 2.2 1.5	!#A 371  1.83e+05
assign (resid 15 and name HD2#) (resid 16 and name HN) 4.0 2.2 1.5	!#A 370  1.70e+05
assign (resid 15 and name HN) (resid 16 and name HA) 4.0 2.2 1.2	!#A 416  1.64e+05
assign (resid 15 and name HB1) (resid 16 and name HN) 3.0 1.2 0.7	!#A 273  9.73e+05
assign (resid 15 and name HB2) (resid 16 and name HN) 2.5 0.7 0.4	!#A 272  9.54e+05
assign (resid 15 and name HN) (resid 16 and name HN) 2.5 0.7 0.4	!#A 266  1.05e+06
assign (resid 15 and name HN) (resid 17 and name HN) 4.0 2.2 1.0	!#A 554  1.59e+05
assign (resid 15 and name HB2) (resid 17 and name HN) 4.0 2.2 1.0	!#A 197  1.89e+05
assign (resid 15 and name HN) (resid 18 and name HN) 4.0 2.2 1.0	!#A 442  1.88e+05
assign (resid 15 and name HD2#) (resid 18 and name HN) 4.0 2.2 2.2	!#A 450  1.94e+05
assign (resid 15 and name HA) (resid 18 and name HN) 4.0 2.2 1.0	!#A 336  4.66e+05
assign (resid 15 and name HD2#) (resid 83 and name HN) 4.0 2.2 1.5	!#A 12  -2.80e+05
assign (resid 15 and name HD1#) (resid 83 and name HN) 4.0 2.2 1.5	!#A 9  -2.54e+05
assign (resid 15 and name HB1) (resid 83 and name HN) 4.0 2.2 1.0	!#A 8  -3.28e+05
assign (resid 15 and name HB1) (resid 84 and name HN) 4.0 2.2 1.2	!#A 484  1.94e+05

!D16
assign (resid 16 and name HB#) (resid 16 and name HN) 2.5 0.7 0.4	!#A 271  3.10e+06
assign (resid 16 and name HA) (resid 16 and name HN) 2.5 0.7 0.4	!#A 268  1.64e+06
assign (resid 16 and name HN) (resid 17 and name HB#) 4.0 2.2 1.2	!#A 367  1.54e+05
assign (resid 16 and name HB#) (resid 17 and name HN) 2.5 0.7 0.6	!#A 196  1.35e+06
assign (resid 16 and name HA) (resid 17 and name HN) 4.0 2.2 1.0	!#A 194  4.49e+05
assign (resid 16 and name HN) (resid 17 and name HN) 2.5 0.7 0.4	!#A 191  1.29e+06
assign (resid 16 and name HB#) (resid 18 and name HN) 4.0 2.2 1.0	!#A 448  1.72e+05
assign (resid 16 and name HA) (resid 18 and name HN) 4.0 2.2 1.0	!#A 443  2.06e+05
assign (resid 16 and name HN) (resid 18 and name HN) 4.0 2.2 1.0	!#A 267  3.16e+05
assign (resid 16 and name HA) (resid 19 and name HN) 4.0 2.2 1.0	!#A 753  2.26e+05

!A17
assign (resid 17 and name HA) (resid 17 and name HN) 2.5 0.7 0.4	!#A 272  1.54e+06
assign (resid 17 and name HB#) (resid 17 and name HN) 2.5 0.7 0.9	!#A 198  3.99e+06
assign (resid 17 and name HA) (resid 18 and name HN) 3.0 1.2 0.5	!#A 444  8.09e+05
assign (resid 17 and name HN) (resid 18 and name HN) 2.5 0.7 0.4	!#A 193  1.68e+06
assign (resid 17 and name HA) (resid 19 and name HN) 4.0 2.2 1.0	!#A 754  4.54e+05
assign (resid 17 and name HN) (resid 19 and name HN) 4.0 2.2 1.0	!#A 192  2.18e+05

!A18
assign (resid 18 and name HA) (resid 18 and name HN) 2.5 0.7 0.4	!#A 446  2.39e+06
assign (resid 18 and name HB#) (resid 18 and name HN) 2.5 0.7 0.9	!#A 337  4.96e+06
assign (resid 18 and name HB#) (resid 19 and name HN) 2.5 0.7 0.9	!#A 572  1.07e+06
assign (resid 18 and name HN) (resid 19 and name HN) 2.5 0.7 0.4	!#A 335  1.55e+06
assign (resid 18 and name HB#) (resid 20 and name HN) 4.0 2.2 1.5	!#A 23  2.17e+05
assign (resid 18 and name HB#) (resid 21 and name HN) 3.0 1.2 1.4	!#A 318  5.93e+05
assign (resid 18 and name HN) (resid 23 and name HG2#) 4.0 2.2 1.5	!#A 449  4.06e+05
assign (resid 18 and name HN) (resid 53 and name HG2#) 4.0 2.2 1.5	!#A 449  4.06e+05

!G19
assign (resid 19 and name HA1) (resid 19 and name HN) 2.5 0.7 0.4	!#A 756  2.90e+06
assign (resid 19 and name HA2) (resid 19 and name HN) 2.5 0.7 0.4	!#A 571  3.07e+06
assign (resid 19 and name HA2) (resid 20 and name HN) 2.5 0.7 0.9	!#A 21  1.61e+06
assign (resid 19 and name HA1) (resid 20 and name HN) 2.5 0.7 0.4	!#A 13  2.89e+06
assign (resid 19 and name HN) (resid 20 and name HN) 4.0 2.2 1.0	!#A 11  4.76e+05
assign (resid 19 and name HA1) (resid 21 and name HN) 3.0 1.2 0.5	!#A 420  5.68e+05
assign (resid 19 and name HA2) (resid 21 and name HN) 4.0 2.2 1.0	!#A 421  1.78e+05
assign (resid 19 and name HN) (resid 21 and name HN) 4.0 2.2 1.0	!#A 314  1.86e+05
assign (resid 19 and name HN) (resid 23 and name HG2#) 4.0 2.2 1.3	!#A 759  3.12e+05

!D20
assign (resid 20 and name HB#) (resid 20 and name HN) 2.5 0.7 0.6	!#A 14  1.78e+06
assign (resid 20 and name HA) (resid 20 and name HN) 2.5 0.7 0.4	!#A 12  1.19e+06
assign (resid 20 and name HN) (resid 21 and name HB2) 4.0 2.2 1.0	!#A 22  2.42e+05
assign (resid 20 and name HB#) (resid 21 and name HN) 4.0 2.2 1.0	!#A 422  4.20e+05
assign (resid 20 and name HA) (resid 21 and name HN) 3.0 1.2 0.5	!#A 417  7.30e+05
assign (resid 20 and name HN) (resid 21 and name HA) 4.0 2.2 1.0	!#A 19  1.87e+05
assign (resid 20 and name HN) (resid 21 and name HN) 2.5 0.7 0.4	!#A 10  1.77e+06
assign (resid 20 and name HN) (resid 82 and name HG#) 4.0 2.2 1.0	!#A 23  2.17e+05

!K21
assign (resid 21 and name HB2) (resid 21 and name HN) 2.5 0.7 0.4	!#A 316  2.18e+06
assign (resid 21 and name HB1) (resid 21 and name HN) 4.0 2.2 1.0	!#A 316  2.18e+05
assign (resid 21 and name HD#) (resid 21 and name HN) 3.0 1.2 1.3	!#A 317  2.21e+06
assign (resid 21 and name HA) (resid 21 and name HN) 2.5 0.7 0.4	!#A 315  1.27e+06
assign (resid 21 and name HN) (resid 22 and name HN) 4.0 2.2 1.0	!#A 202  3.33e+05
assign (resid 21 and name HA) (resid 22 and name HN) 2.5 0.7 0.4	!#A 138  3.96e+06
assign (resid 21 and name HN) (resid 23 and name HG2#) 4.0 2.2 1.0	!#A 425  4.58e+05
assign (resid 21 and name HB1) (resid 53 and name HN) 4.0 2.2 1.0	!#A 44  2.35e+05
assign (resid 21 and name HN) (resid 53 and name HG1#) 4.0 2.2 1.0	!#A 423  1.51e+05

!L22
assign (resid 22 and name HD1#) (resid 22 and name HN) 4.0 2.2 1.0	!#A 210  9.57e+05
assign (resid 22 and name HG) (resid 22 and name HN) 3.0 1.2 0.8	!#A 208  7.64e+05
assign (resid 22 and name HD2#) (resid 22 and name HN) 3.0 1.2 2.0	!#A 143  5.93e+05
assign (resid 22 and name HB2) (resid 22 and name HN) 2.5 0.7 0.4	!#A 142  1.56e+06
assign (resid 22 and name HB1) (resid 22 and name HN) 3.0 1.2 0.5	!#A 141  2.19e+06
assign (resid 22 and name HG) (resid 23 and name HN) 4.0 2.2 1.0	!#A 103  2.50e+05
assign (resid 22 and name HB1) (resid 23 and name HN) 2.5 0.7 0.6	!#A 89  8.85e+05
assign (resid 22 and name HN) (resid 23 and name HN) 4.0 2.2 1.0	!#A 200  5.10e+05
assign (resid 22 and name HD2#) (resid 23 and name HN) 3.0 1.2 1.0	!#A 66  8.05e+05
assign (resid 22 and name HA) (resid 23 and name HN) 2.5 0.7 0.4	!#A 64  1.49e+06
assign (resid 22 and name HB1) (resid 24 and name HN) 4.0 2.2 1.0	!#A 56  1.95e+05
assign (resid 22 and name HN) (resid 52 and name HA) 4.0 2.2 1.0	!#A 137  1.82e+05
assign (resid 22 and name HB1) (resid 53 and name HN) 4.0 2.2 1.0	!#A 44  2.35e+05
assign (resid 22 and name HA) (resid 53 and name HN) 4.0 2.2 1.0	!#A 42  9.75e+05
assign (resid 22 and name HD2#) (resid 80 and name HN) 4.0 2.2 1.5	!#A 170  2.26e+05
assign (resid 22 and name HN) (resid 81 and name HE#) 4.0 2.2 1.0	!#A 139  4.00e+05
assign (resid 22 and name HA) (resid 82 and name HN) 4.0 2.2 1.0	!#A 24  1.93e+05
assign (resid 22 and name HD1#) (resid 103 and name HN) 4.0 2.2 1.5	!#A 502  1.90e+05
assign (resid 22 and name HD1#) (resid 104 and name HN) 4.0 2.2 1.5	!#A 548  1.90e+05
assign (resid 22 and name HN) (resid 105 and name HA) 4.0 2.2 1.0	!#A 205  2.73e+05
assign (resid 22 and name HD1#) (resid 105 and name HN) 4.0 2.2 1.5	!#A 176  4.78e+05

!V23
assign (resid 23 and name HB) (resid 23 and name HN) 2.5 0.7 0.6	!#A 65  8.85e+05
assign (resid 23 and name HA) (resid 23 and name HN) 4.0 2.2 1.0	!#A 63  2.08e+05
assign (resid 23 and name HG1#) (resid 24 and name HN) 4.0 2.2 1.5	!#A 58  3.01e+05
assign (resid 23 and name HN) (resid 24 and name HN) 4.0 2.2 1.0	!#A 49  3.93e+05
assign (resid 23 and name HN) (resid 24 and name HA) 3.0 1.2 1.3	!#A 102  5.03e+05
assign (resid 23 and name HN) (resid 24 and name HG2#) 4.0 2.2 1.5	!#A 67  1.59e+05
assign (resid 23 and name HA) (resid 24 and name HN) 2.5 0.7 0.4	!#A 36  1.01e+06
assign (resid 23 and name HA) (resid 53 and name HN) 4.0 2.2 1.0	!#A 41  3.47e+05
assign (resid 23 and name HN) (resid 53 and name HN) 4.0 2.2 1.0	!#A 38  2.41e+05
assign (resid 23 and name HN) (resid 79 and name HA) 4.0 2.2 1.0	!#A 100  1.87e+05
assign (resid 23 and name HG1#) (resid 80 and name HN) 4.0 2.2 1.5	!#A 171  1.67e+05
assign (resid 23 and name HB) (resid 80 and name HN) 4.0 2.2 1.0	!#A 169  2.74e+05
assign (resid 23 and name HN) (resid 80 and name HN) 4.0 2.2 1.0	!#A 164  3.12e+05
assign (resid 23 and name HN) (resid 81 and name HA) 4.0 2.2 1.0	!#A 101  4.44e+05

!V24
assign (resid 24 and name HB) (resid 24 and name HN) 4.0 2.2 1.0	!#A 61  2.91e+05
assign (resid 24 and name HG2#) (resid 24 and name HN) 4.0 2.2 1.5	!#A 37  1.71e+05
assign (resid 24 and name HG1#) (resid 25 and name HN) 3.0 1.2 1.0	!#A 59  6.05e+05
assign (resid 24 and name HB) (resid 25 and name HN) 4.0 2.2 1.0	!#A 33  2.91e+05
assign (resid 24 and name HN) (resid 52 and name HG1#) 4.0 2.2 1.5	!#A 65  1.82e+05
assign (resid 24 and name HN) (resid 53 and name HB) 4.0 2.2 1.0	!#A 56  1.95e+05
assign (resid 24 and name HN) (resid 53 and name HN) 4.0 2.2 1.0	!#A 24  2.07e+05
assign (resid 24 and name HN) (resid 54 and name HA) 4.0 2.2 1.0	!#A 53  1.71e+05
assign (resid 24 and name HN) (resid 54 and name HN) 4.0 2.2 1.0	!#A 57  2.17e+05
assign (resid 24 and name HN) (resid 55 and name HN) 4.0 2.2 1.0	!#A 221  1.54e+05
assign (resid 24 and name HG1#) (resid 55 and name HN) 4.0 2.2 1.5	!#A 230  2.05e+05
assign (resid 24 and name HA) (resid 80 and name HN) 4.0 2.2 1.0	!#A 167  1.88e+05

!V25
assign (resid 25 and name HA) (resid 25 and name HN) 4.0 2.2 1.0	!#A 55  1.77e+05
assign (resid 25 and name HG2#) (resid 25 and name HN) 3.0 1.2 1.0	!#A 57  5.21e+05
assign (resid 25 and name HG1#) (resid 25 and name HN) 4.0 2.2 1.5	!#A 34  1.53e+05
assign (resid 25 and name HB) (resid 25 and name HN) 4.0 2.2 1.0	!#A 32  3.95e+05
assign (resid 25 and name HB) (resid 26 and name HN) 4.0 2.2 1.0	!#A 184  1.59e+05
assign (resid 25 and name HG1#) (resid 26 and name HN) 4.0 2.2 1.5	!#A 131  2.13e+05
assign (resid 25 and name HG2#) (resid 26 and name HN) 4.0 2.2 1.5	!#A 130  1.77e+05
assign (resid 25 and name HA) (resid 26 and name HN) 3.0 1.2 0.5	!#A 129  5.38e+05
assign (resid 25 and name HG1#) (resid 27 and name HN) 4.0 2.2 1.5	!#A 131  1.85e+05
assign (resid 25 and name HG1#) (resid 55 and name HN) 4.0 2.2 2.5	!#A 231  1.60e+05
assign (resid 25 and name HA) (resid 55 and name HN) 4.0 2.2 1.0	!#A 161  3.36e+05
assign (resid 25 and name HN) (resid 77 and name HA) 4.0 2.2 1.0	!#A 52  1.63e+05
assign (resid 25 and name HN) (resid 77 and name HD1) 4.0 2.2 1.0	!#A 51  1.64e+05
assign (resid 25 and name HG2#) (resid 78 and name HN) 4.0 2.2 1.5	!#A 472  2.52e+05
assign (resid 25 and name HN) (resid 79 and name HN) 4.0 2.2 1.0	!#A 378  1.83e+05
assign (resid 25 and name HG2#) (resid 80 and name HN) 4.0 2.2 1.5	!#A 238  2.19e+05
assign (resid 25 and name HN) (resid 80 and name HN) 4.0 2.2 1.0	!#A 232  1.98e+05
assign (resid 25 and name HN) (resid 80 and name HD2) 4.0 2.2 1.0	!#A 50  1.85e+05

!D26
assign (resid 26 and name HB1) (resid 26 and name HN) 4.0 2.2 1.0	!#A 183  2.47e+05
assign (resid 26 and name HA) (resid 27 and name HN) 3.0 1.2 0.5	!#A 76  7.62e+05
assign (resid 26 and name HN) (resid 42 and name HE#) 4.0 2.2 1.0	!#A 179  1.57e+05
assign (resid 26 and name HN) (resid 55 and name HA) 4.0 2.2 1.0	!#A 180  1.65e+05
assign (resid 26 and name HN) (resid 55 and name HB1) 4.0 2.2 1.0	!#A 185  1.55e+05
assign (resid 26 and name HN) (resid 56 and name HA) 4.0 2.2 1.0	!#A 181  1.95e+05
assign (resid 26 and name HN) (resid 57 and name HG2#) 4.0 2.2 1.5	!#A 187  1.64e+05
assign (resid 26 and name HA) (resid 77 and name HN) 4.0 2.2 1.0	!#A 76  1.62e+05
assign (resid 26 and name HA) (resid 78 and name HN) 3.0 1.2 0.8	!#A 348  3.35e+06

!F27
assign (resid 27 and name HE#) (resid 27 and name HN) 4.0 2.2 1.0	!#A 126  2.70e+05
assign (resid 27 and name HB1) (resid 27 and name HN) 4.0 2.2 1.0	!#A 130  2.39e+05
assign (resid 27 and name HD#) (resid 27 and name HN) 4.0 2.2 1.0	!#A 88  4.70e+05
assign (resid 27 and name HB2) (resid 27 and name HN) 4.0 2.2 1.0	!#A 90  1.52e+05
assign (resid 27 and name HA) (resid 27 and name HN) 4.0 2.2 1.0	!#A 89  1.90e+05
assign (resid 27 and name HE#) (resid 66 and name HN) 4.0 2.2 1.0	!#A 309  1.62e+05
assign (resid 27 and name HD#) (resid 66 and name HN) 4.0 2.2 1.0	!#A 309  1.62e+05
assign (resid 27 and name HB2) (resid 77 and name HN) 4.0 2.2 1.2	!#A 77  1.67e+05
assign (resid 27 and name HN) (resid 78 and name HN) 4.0 2.2 1.0	!#A 462  2.29e+05

!S28
assign (resid 28 and name HB1) (resid 29 and name HN) 4.0 2.2 1.0	!#A 322  2.20e+05
assign (resid 28 and name HB2) (resid 29 and name HN) 4.0 2.2 1.0	!#A 321  1.75e+05
assign (resid 28 and name HA) (resid 29 and name HN) 3.0 1.2 0.5	!#A 320  5.70e+05
assign (resid 28 and name HA) (resid 59 and name HN) 4.0 2.2 1.3	!#A 529  1.78e+05

!A29
assign (resid 29 and name HA) (resid 29 and name HN) 4.0 2.2 1.0	!#A 319  1.69e+05
assign (resid 29 and name HN) (resid 30 and name HN) 4.0 2.2 1.0	!#A 426  1.73e+05
assign (resid 29 and name HB#) (resid 30 and name HN) 4.0 2.2 1.5	!#A 442  3.48e+05
assign (resid 29 and name HA) (resid 30 and name HN) 2.5 0.7 0.4	!#A 438  9.94e+05
assign (resid 29 and name HB#) (resid 31 and name HN) 4.0 2.2 1.5	!#A 497  3.79e+05
assign (resid 29 and name HA) (resid 32 and name HN) 4.0 2.2 1.0	!#A 397  2.53e+05
assign (resid 29 and name HB#) (resid 32 and name HN) 4.0 2.2 1.5	!#A 402  3.12e+05
assign (resid 29 and name HN) (resid 35 and name HB#) 3.0 1.2 1.0	!#A 431  7.21e+05
assign (resid 29 and name HN) (resid 58 and name HA) 4.0 2.2 2.0	!#A 428  4.14e+05
assign (resid 29 and name HB#) (resid 60 and name HN) 4.0 2.2 1.5	!#A 595  4.08e+05

!T30
assign (resid 30 and name HB) (resid 30 and name HN) 4.0 2.2 1.0	!#A 439  3.52e+05
assign (resid 30 and name HG2#) (resid 30 and name HN) 3.0 1.2 1.0	!#A 441  7.47e+05
assign (resid 30 and name HA) (resid 30 and name HN) 4.0 2.2 1.0	!#A 440  3.57e+05
assign (resid 30 and name HN) (resid 31 and name HB1) 4.0 2.2 1.0	!#A 585  2.04e+05
assign (resid 30 and name HN) (resid 31 and name HN) 4.0 2.2 1.0	!#A 580  3.14e+05
assign (resid 30 and name HG2#) (resid 31 and name HN) 4.0 2.2 1.5	!#A 496  1.64e+05
assign (resid 30 and name HG2#) (resid 32 and name HN) 4.0 2.2 1.5	!#A 401  2.13e+05
assign (resid 30 and name HN) (resid 32 and name HN) 4.0 2.2 1.0	!#A 294  1.73e+05
assign (resid 30 and name HN) (resid 58 and name HA) 3.0 1.2 0.5	!#A 581  7.03e+05
assign (resid 30 and name HG2#) (resid 60 and name HN) 4.0 2.2 1.5	!#A 594  1.80e+05

!W31
assign (resid 31 and name HB1) (resid 31 and name HN) 4.0 2.2 1.0	!#A 495  2.56e+05
assign (resid 31 and name HB2) (resid 31 and name HN) 4.0 2.2 1.0	!#A 494  3.80e+05
assign (resid 31 and name HD1) (resid 31 and name HN) 3.0 1.2 0.5	!#A 492  5.88e+05
assign (resid 31 and name HB2) (resid 32 and name HN) 4.0 2.2 1.0	!#A 398  1.96e+05
assign (resid 31 and name HA) (resid 32 and name HN) 4.0 2.2 1.0	!#A 397  2.53e+05
assign (resid 31 and name HN) (resid 58 and name HA) 4.0 2.2 2.0	!#A 648  1.73e+05
assign (resid 31 and name HN) (resid 60 and name HN) 4.0 2.2 1.2	!#A 589  2.02e+05

!C32
assign (resid 32 and name HB2) (resid 32 and name HN) 4.0 2.2 1.0	!#A 400  4.68e+05
assign (resid 32 and name HA) (resid 32 and name HN) 4.0 2.2 1.0	!#A 396  2.86e+05
assign (resid 32 and name HB1) (resid 32 and name HN) 4.0 2.2 1.0	!#A 296  4.43e+05
assign (resid 32 and name HA) (resid 33 and name HN) 4.0 2.2 1.0	!#A 374  3.43e+05
assign (resid 32 and name HN) (resid 34 and name HD2) 4.0 2.2 2.0	!#A 295  1.64e+05
assign (resid 32 and name HN) (resid 35 and name HB#) 4.0 2.2 1.5	!#A 401  2.13e+05
assign (resid 32 and name HA) (resid 36 and name HN) 4.0 2.2 1.5	!#A 302  1.71e+05

!G33
assign (resid 33 and name HA2) (resid 33 and name HN) 4.0 2.2 1.0	!#A 277  2.18e+05
assign (resid 33 and name HA1) (resid 33 and name HN) 4.0 2.2 1.0	!#A 274  4.11e+05
assign (resid 33 and name HN) (resid 34 and name HG#) 4.0 2.2 1.0	!#A 375  1.85e+05
assign (resid 33 and name HN) (resid 34 and name HD#) 4.0 2.2 1.0	!#A 275  1.92e+05

!P34
assign (resid 34 and name HB1) (resid 35 and name HN) 4.0 2.2 1.0	!#A 538  1.68e+05
assign (resid 34 and name HG#) (resid 35 and name HN) 4.0 2.2 1.0	!#A 540  2.46e+05
assign (resid 34 and name HD#) (resid 35 and name HN) 4.0 2.2 1.0	!#A 401  1.84e+05

!A35
assign (resid 35 and name HB#) (resid 35 and name HN) 2.5 0.7 0.7	!#A 541  9.60e+05
assign (resid 35 and name HA) (resid 35 and name HN) 4.0 2.2 1.0	!#A 402  4.08e+05
assign (resid 35 and name HB#) (resid 36 and name HN) 4.0 2.2 1.0	!#A 306  3.59e+05
assign (resid 35 and name HN) (resid 36 and name HN) 4.0 2.2 1.0	!#A 224  4.33e+05

!K36
assign (resid 36 and name HG#) (resid 36 and name HN) 4.0 2.2 1.0	!#A 305  2.96e+05
assign (resid 36 and name HA) (resid 36 and name HN) 4.0 2.2 1.0	!#A 303  3.76e+05
assign (resid 36 and name HB#) (resid 36 and name HN) 3.0 1.2 0.8	!#A 225  7.06e+05
assign (resid 36 and name HG#) (resid 37 and name HN) 4.0 2.2 1.0	!#A 600  2.08e+05
assign (resid 36 and name HB#) (resid 37 and name HN) 3.0 1.2 0.5	!#A 452  5.29e+05
assign (resid 36 and name HN) (resid 37 and name HN) 4.0 2.2 1.0	!#A 447  2.95e+05
assign (resid 36 and name HN) (resid 38 and name HN) 4.0 2.2 1.0	!#A 453  3.16e+05
assign (resid 36 and name HA) (resid 39 and name HN) 4.0 2.2 1.0	!#A 70  3.62e+05

!M37
assign (resid 37 and name HB#) (resid 37 and name HN) 2.5 0.7 0.4	!#A 451  1.05e+06
assign (resid 37 and name HA) (resid 37 and name HN) 3.0 1.2 0.5	!#A 450  6.22e+05
assign (resid 37 and name HG#) (resid 38 and name HN) 4.0 2.2 1.0	!#A 603  1.66e+05
assign (resid 37 and name HN) (resid 38 and name HN) 4.0 2.2 1.0	!#A 596  3.01e+05
assign (resid 37 and name HA) (resid 39 and name HN) 4.0 2.2 1.0	!#A 106  1.89e+05
assign (resid 37 and name HN) (resid 39 and name HN) 4.0 2.2 1.0	!#A 448  3.01e+05

!I38
assign (resid 38 and name HG1#) (resid 38 and name HN) 4.0 2.2 1.5	!#A 605  3.36e+05
assign (resid 38 and name HG2#) (resid 38 and name HN) 4.0 2.2 1.5	!#A 457  3.07e+05
assign (resid 38 and name HB) (resid 38 and name HN) 4.0 2.2 1.0	!#A 456  3.36e+05
assign (resid 38 and name HA) (resid 38 and name HN) 4.0 2.2 1.0	!#A 455  1.91e+05
assign (resid 38 and name HN) (resid 39 and name HG#) 4.0 2.2 1.0	!#A 607  1.57e+05
assign (resid 38 and name HN) (resid 39 and name HN) 2.5 0.7 0.4	!#A 68  2.99e+06
assign (resid 38 and name HG1#) (resid 94 and name HN) 4.0 2.2 2.0	!#A 136  3.10e+05

!K39
assign (resid 39 and name HG#) (resid 39 and name HN) 4.0 2.2 1.0	!#A 110  1.67e+05
assign (resid 39 and name HB#) (resid 39 and name HN) 3.0 1.2 0.5	!#A 72  8.51e+05
assign (resid 39 and name HA) (resid 39 and name HN) 4.0 2.2 1.0	!#A 69  3.89e+05
assign (resid 39 and name HN) (resid 40 and name HG1) 4.0 2.2 1.0	!#A 108  1.66e+05
assign (resid 39 and name HN) (resid 40 and name HD#) 4.0 2.2 1.0	!#A 71  3.53e+05
assign (resid 39 and name HB#) (resid 42 and name HN) 4.0 2.2 1.7	!#A 246  2.01e+05
assign (resid 39 and name HA) (resid 42 and name HN) 4.0 2.2 1.0	!#A 175  2.76e+05
assign (resid 39 and name HB#) (resid 43 and name HN) 4.0 2.2 1.0	!#A 643  2.53e+05

!P40
assign (resid 40 and name HG#) (resid 41 and name HN) 4.0 2.2 1.0	!#A 264  3.96e+05
assign (resid 40 and name HD#) (resid 41 and name HN) 4.0 2.2 1.0	!#A 261  2.16e+05
assign (resid 40 and name HB2) (resid 44 and name HN) 4.0 2.2 1.2	!#A 409  2.74e+05

!F41
assign (resid 41 and name HA) (resid 41 and name HN) 3.0 1.2 0.5	!#A 359  4.94e+05
assign (resid 41 and name HB2) (resid 41 and name HN) 3.0 1.2 0.5	!#A 263  4.93e+05
assign (resid 41 and name HB1) (resid 41 and name HN) 4.0 2.2 1.0	!#A 262  4.74e+05
assign (resid 41 and name HB2) (resid 42 and name HN) 3.0 1.2 0.5	!#A 245  6.67e+05
assign (resid 41 and name HB1) (resid 42 and name HN) 4.0 2.2 1.0	!#A 244  1.99e+05
assign (resid 41 and name HD#) (resid 42 and name HN) 4.0 2.2 1.0	!#A 242  3.03e+05
assign (resid 41 and name HN) (resid 42 and name HN) 4.0 2.2 1.0	!#A 173  3.31e+05
assign (resid 41 and name HD#) (resid 42 and name HN) 4.0 2.2 1.0	!#A 174  3.03e+05
assign (resid 41 and name HN) (resid 44 and name HN) 4.0 2.2 1.0	!#A 358  1.63e+05
assign (resid 41 and name HA) (resid 44 and name HN) 4.0 2.2 1.0	!#A 298  2.86e+05

!F42
assign (resid 42 and name HD#) (resid 42 and name HN) 4.0 2.2 1.0	!#A 241  2.30e+05
assign (resid 42 and name HB2) (resid 42 and name HN) 3.0 1.2 0.5	!#A 178  6.67e+05
assign (resid 42 and name HB1) (resid 42 and name HN) 4.0 2.2 1.0	!#A 177  2.57e+05
assign (resid 42 and name HA) (resid 42 and name HN) 4.0 2.2 1.0	!#A 176  3.62e+05
assign (resid 42 and name HA) (resid 43 and name HN) 4.0 2.2 1.0	!#A 640  1.58e+05
assign (resid 42 and name HD#) (resid 43 and name HN) 4.0 2.2 1.0	!#A 638  2.09e+05
assign (resid 42 and name HB2) (resid 43 and name HN) 4.0 2.2 1.0	!#A 485  2.23e+05
assign (resid 42 and name HB1) (resid 43 and name HN) 4.0 2.2 1.0	!#A 483  2.93e+05
assign (resid 42 and name HN) (resid 43 and name HN) 4.0 2.2 1.0	!#A 172  1.70e+05
assign (resid 42 and name HA) (resid 44 and name HN) 4.0 2.2 1.0	!#A 407  3.64e+05
assign (resid 42 and name HN) (resid 44 and name HN) 4.0 2.2 1.0	!#A 240  2.43e+05

!H43
assign (resid 43 and name HD2) (resid 43 and name HN) 4.0 2.2 1.0	!#A 482  4.13e+05
assign (resid 43 and name HB#) (resid 43 and name HN) 2.5 0.7 0.4	!#A 484  8.94e+05
assign (resid 43 and name HD2) (resid 44 and name HN) 4.0 2.2 1.0	!#A 404  1.93e+05
assign (resid 43 and name HB#) (resid 44 and name HN) 2.5 0.7 0.7	!#A 302  9.15e+05
assign (resid 43 and name HA) (resid 44 and name HN) 4.0 2.2 1.0	!#A 301  3.26e+05
assign (resid 43 and name HA) (resid 46 and name HN) 4.0 2.2 1.0	!#A 632  1.79e+05

!S44
assign (resid 44 and name HB#) (resid 44 and name HN) 2.5 0.7 0.4	!#A 300  1.64e+06
assign (resid 44 and name HA) (resid 44 and name HN) 2.5 0.7 0.4	!#A 299  1.01e+06
assign (resid 44 and name HN) (resid 45 and name HG) 4.0 2.2 1.0	!#A 410  4.08e+05
assign (resid 44 and name HN) (resid 45 and name HN) 3.0 1.2 0.5	!#A 297  6.24e+05
assign (resid 44 and name HA) (resid 47 and name HN) 4.0 2.2 1.0	!#A 487  2.89e+05
assign (resid 44 and name HN) (resid 47 and name HN) 4.0 2.2 2.0	!#A 405  1.69e+05

!L45
assign (resid 45 and name HG) (resid 46 and name HN) 4.0 2.2 1.0	!#A 636  3.29e+05
assign (resid 45 and name HB1) (resid 46 and name HN) 4.0 2.2 1.0	!#A 636  3.29e+05
assign (resid 45 and name HB2) (resid 46 and name HN) 4.0 2.2 1.0	!#A 635  2.92e+05
assign (resid 45 and name HA) (resid 46 and name HN) 4.0 2.2 1.0	!#A 632  2.79e+05
assign (resid 45 and name HB1) (resid 48 and name HN) 4.0 2.2 1.0	!#A 393  1.85e+05
assign (resid 45 and name HA) (resid 48 and name HN) 4.0 2.2 1.0	!#A 289  4.33e+05
assign (resid 45 and name HB2) (resid 49 and name HN) 4.0 2.2 1.0	!#A 460  2.12e+05
assign (resid 45 and name HA) (resid 49 and name HN) 4.0 2.2 1.0	!#A 458  1.62e+05
assign (resid 45 and name HD1#) (resid 98 and name HN) 4.0 2.2 1.5	!#A 578  2.17e+05

!S46
assign (resid 46 and name HB#) (resid 46 and name HN) 3.0 1.2 0.5	!#A 480  7.62e+05
assign (resid 46 and name HA) (resid 46 and name HN) 2.5 0.7 0.4	!#A 479  9.43e+05
assign (resid 46 and name HN) (resid 47 and name HN) 2.5 0.7 0.4	!#A 630  5.86e+06
assign (resid 46 and name HA) (resid 47 and name HN) 4.0 2.2 1.0	!#A 489  2.51e+05
assign (resid 46 and name HN) (resid 48 and name HN) 4.0 2.2 1.0	!#A 478  1.74e+05
assign (resid 46 and name HA) (resid 49 and name HN) 4.0 2.2 1.0	!#A 459  2.06e+05
assign (resid 46 and name HN) (resid 49 and name HN) 4.0 2.2 1.0	!#A 341  1.75e+05
assign (resid 46 and name HN) (resid 54 and name HE1) 4.0 2.2 1.0	!#A 629  1.74e+05
assign (resid 46 and name HN) (resid 54 and name HD1) 4.0 2.2 1.0	!#A 631  3.02e+05

!E47
assign (resid 47 and name HB2) (resid 47 and name HN) 2.5 0.7 0.4	!#A 361  1.22e+06
assign (resid 47 and name HB1) (resid 47 and name HN) 4.0 2.2 1.0	!#A 361  1.52e+05
assign (resid 47 and name HG#) (resid 47 and name HN) 3.0 1.2 0.5	!#A 360  6.33e+05
assign (resid 47 and name HA) (resid 47 and name HN) 2.5 0.7 0.4	!#A 359  9.12e+05
assign (resid 47 and name HA) (resid 48 and name HN) 4.0 2.2 1.0	!#A 388  4.30e+05
assign (resid 47 and name HB#) (resid 48 and name HN) 4.0 2.2 1.0	!#A 290  3.92e+05
assign (resid 47 and name HN) (resid 48 and name HN) 2.5 0.7 0.4	!#A 287  1.04e+06
assign (resid 47 and name HN) (resid 49 and name HN) 4.0 2.2 1.0	!#A 485  2.25e+05

!K48
assign (resid 48 and name HG#) (resid 48 and name HN) 4.0 2.2 1.0	!#A 293  1.85e+05
assign (resid 48 and name HB1) (resid 48 and name HN) 2.5 0.7 0.4	!#A 292  1.00e+06
assign (resid 48 and name HB2) (resid 48 and name HN) 2.5 0.7 0.4	!#A 291  9.64e+05
assign (resid 48 and name HA) (resid 48 and name HN) 2.5 0.7 0.4	!#A 288  1.30e+06
assign (resid 48 and name HA) (resid 49 and name HN) 4.0 2.2 1.0	!#A 457  4.06e+05
assign (resid 48 and name HN) (resid 49 and name HA) 4.0 2.2 1.0	!#A 387  1.61e+05
assign (resid 48 and name HN) (resid 49 and name HD#) 4.0 2.2 1.0	!#A 384  2.88e+05
assign (resid 48 and name HB1) (resid 49 and name HN) 3.0 1.2 0.5	!#A 343  6.12e+05
assign (resid 48 and name HN) (resid 49 and name HN) 2.5 0.7 0.4	!#A 286  1.14e+06
assign (resid 48 and name HN) (resid 54 and name HE#) 4.0 2.2 1.0	!#A 385  3.67e+05

!Y49
assign (resid 49 and name HE#) (resid 49 and name HN) 4.0 2.2 1.0	!#A 454  2.31e+05
assign (resid 49 and name HA) (resid 49 and name HN) 3.0 1.2 0.5	!#A 456  6.35e+05
assign (resid 49 and name HB#) (resid 49 and name HN) 2.5 0.7 0.4	!#A 342  1.09e+06
assign (resid 49 and name HD#) (resid 49 and name HN) 3.0 1.2 0.5	!#A 339  7.02e+05
assign (resid 49 and name HB#) (resid 50 and name HN) 4.0 2.2 1.0	!#A 612  3.38e+05
assign (resid 49 and name HD#) (resid 50 and name HN) 4.0 2.2 1.0	!#A 609  2.17e+05
assign (resid 49 and name HA) (resid 50 and name HN) 2.5 0.7 0.4	!#A 461  3.98e+06
assign (resid 49 and name HN) (resid 50 and name HN) 4.0 2.2 1.0	!#A 338  3.02e+05
assign (resid 49 and name HA) (resid 51 and name HN) 2.5 0.7 0.4	!#A 491  2.53e+06
assign (resid 49 and name HB#) (resid 52 and name HN) 4.0 2.2 1.0	!#A 298  2.05e+05
assign (resid 49 and name HN) (resid 54 and name HZ) 4.0 2.2 1.0	!#A 455  1.75e+05

!S50
assign (resid 50 and name HB1) (resid 50 and name HN) 4.0 2.2 1.0	!#A 464  3.61e+05
assign (resid 50 and name HB2) (resid 50 and name HN) 3.0 1.2 0.5	!#A 463  8.96e+05
assign (resid 50 and name HA) (resid 50 and name HN) 2.5 0.7 0.4	!#A 462  1.42e+06
assign (resid 50 and name HB1) (resid 51 and name HN) 4.0 2.2 1.0	!#A 494  2.84e+05
assign (resid 50 and name HB2) (resid 51 and name HN) 4.0 2.2 1.0	!#A 493  3.27e+05
assign (resid 50 and name HA) (resid 51 and name HN) 2.5 0.7 0.8	!#A 365  8.91e+05
assign (resid 50 and name HN) (resid 51 and name HN) 2.5 0.7 0.4	!#A 362  1.14e+06
assign (resid 50 and name HN) (resid 52 and name HN) 4.0 2.2 1.0	!#A 460  1.64e+05

!N51
assign (resid 51 and name HA) (resid 51 and name HD2#) 4.0 2.2 1.0	!#A 710  3.44e+05
assign (resid 51 and name HN) (resid 51 and name HD2#) 4.0 2.2 1.0	!#A 707  2.37e+05
assign (resid 51 and name HB#) (resid 51 and name HD2#) 3.0 1.2 0.5	!#A 522  9.44e+05
assign (resid 51 and name HB#) (resid 51 and name HN) 2.5 0.7 0.4	!#A 366  1.68e+06
assign (resid 51 and name HA) (resid 51 and name HN) 2.5 0.7 0.4	!#A 364  2.53e+06
assign (resid 51 and name HB1) (resid 52 and name HN) 4.0 2.2 1.0	!#A 298  2.05e+05
assign (resid 51 and name HD2#) (resid 52 and name HA) 4.0 2.2 1.0	!#A 712  1.61e+05
assign (resid 51 and name HD2#) (resid 52 and name HG2#) 4.0 2.2 1.0	!#A 713  1.89e+05
assign (resid 51 and name HN) (resid 52 and name HB) 4.0 2.2 1.0	!#A 495  1.75e+05
assign (resid 51 and name HB#) (resid 52 and name HN) 4.0 2.2 1.0	!#A 299  3.93e+05
assign (resid 51 and name HN) (resid 52 and name HG2#) 4.0 2.2 1.0	!#A 367  4.37e+05
assign (resid 51 and name HA) (resid 52 and name HN) 3.0 1.2 0.5	!#A 219  8.34e+05
assign (resid 51 and name HN) (resid 52 and name HN) 2.5 0.7 0.4	!#A 217  1.40e+06
assign (resid 51 and name HD2#) (resid 105 and name HG2#) 3.0 1.2 0.5	!#A 524  6.98e+05

!V52
assign (resid 52 and name HG1#) (resid 52 and name HN) 4.0 2.2 1.5	!#A 223  4.60e+05
assign (resid 52 and name HG2#) (resid 52 and name HN) 2.5 0.7 0.9	!#A 222  1.09e+06
assign (resid 52 and name HB) (resid 52 and name HN) 2.5 0.7 0.4	!#A 221  1.19e+06
assign (resid 52 and name HA) (resid 52 and name HN) 2.5 0.7 0.4	!#A 220  1.12e+06
assign (resid 52 and name HN) (resid 53 and name HN) 4.0 2.2 1.0	!#A 39  1.64e+05
assign (resid 52 and name HB) (resid 53 and name HN) 4.0 2.2 1.0	!#A 43  1.89e+05
assign (resid 52 and name HG1#) (resid 53 and name HN) 3.0 1.2 0.8	!#A 30  5.65e+05
assign (resid 52 and name HA) (resid 53 and name HN) 2.5 0.7 0.4	!#A 25  9.75e+05
assign (resid 52 and name HN) (resid 54 and name HD1) 4.0 2.2 1.0	!#A 296  1.52e+05
assign (resid 52 and name HN) (resid 54 and name HN) 4.0 2.2 1.9	!#A 94  2.30e+05

!I53
assign (resid 53 and name HG2#) (resid 53 and name HN) 4.0 2.2 1.5	!#A 29  2.29e+05
assign (resid 53 and name HD1#) (resid 53 and name HN) 4.0 2.2 1.5	!#A 29  4.29e+05
assign (resid 53 and name HG1#) (resid 53 and name HN) 4.0 2.2 1.0	!#A 27  1.51e+05
assign (resid 53 and name HB) (resid 53 and name HN) 3.0 1.2 0.5	!#A 26  6.79e+05
assign (resid 53 and name HN) (resid 54 and name HA) 4.0 2.2 1.2	!#A 40  2.40e+05
assign (resid 53 and name HG2#) (resid 54 and name HN) 2.5 0.7 1.1	!#A 62  1.61e+06
assign (resid 53 and name HA) (resid 54 and name HN) 2.5 0.7 0.4	!#A 60  2.78e+06

!F54
assign (resid 54 and name HE#) (resid 54 and name HN) 4.0 2.2 1.0	!#A 766  2.09e+05
assign (resid 54 and name HB2) (resid 54 and name HN) 3.0 1.2 0.5	!#A 61  6.64e+05
assign (resid 54 and name HA) (resid 54 and name HN) 4.0 2.2 1.0	!#A 59  4.09e+05
assign (resid 54 and name HD#) (resid 54 and name HN) 2.5 0.7 0.4	!#A 58  1.06e+06
assign (resid 54 and name HN) (resid 55 and name HD1#) 4.0 2.2 1.0	!#A 98  1.88e+05
assign (resid 54 and name HB1) (resid 55 and name HN) 4.0 2.2 1.0	!#A 162  1.93e+05
assign (resid 54 and name HA) (resid 55 and name HN) 2.5 0.7 0.4	!#A 160  9.18e+05
assign (resid 54 and name HN) (resid 55 and name HN) 4.0 2.2 1.0	!#A 56  1.56e+05

!L55
assign (resid 55 and name HD2#) (resid 55 and name HN) 4.0 2.2 1.5	!#A 229  1.83e+05
assign (resid 55 and name HD1#) (resid 55 and name HN) 4.0 2.2 1.5	!#A 227  3.38e+05
assign (resid 55 and name HB1) (resid 55 and name HN) 4.0 2.2 1.0	!#A 225  1.75e+05
assign (resid 55 and name HB2) (resid 55 and name HN) 4.0 2.2 1.0	!#A 163  1.62e+05
assign (resid 55 and name HG) (resid 56 and name HN) 4.0 2.2 1.0	!#A 345  1.65e+05
assign (resid 55 and name HB2) (resid 56 and name HN) 4.0 2.2 1.0	!#A 344  3.63e+05
assign (resid 55 and name HA) (resid 56 and name HN) 2.5 0.7 0.4	!#A 244  1.94e+06
assign (resid 55 and name HD1#) (resid 56 and name HN) 4.0 2.2 1.5	!#A 249  1.53e+05
assign (resid 55 and name HB1) (resid 56 and name HN) 4.0 2.2 1.0	!#A 248  4.16e+05

!E56
assign (resid 56 and name HG#) (resid 56 and name HN) 4.0 2.2 1.0	!#A 342  2.38e+05
assign (resid 56 and name HA) (resid 56 and name HN) 4.0 2.2 1.0	!#A 339  4.62e+05
assign (resid 56 and name HB#) (resid 56 and name HN) 3.0 1.2 0.5	!#A 246  7.84e+05

!V57
assign (resid 57 and name HB) (resid 59 and name HN) 4.0 2.2 1.5	!#A 533  1.62e+05
assign (resid 57 and name HG1#) (resid 66 and name HN) 4.0 2.2 1.5	!#A 229  2.62e+05

!D58
assign (resid 58 and name HA) (resid 59 and name HN) 2.5 0.7 0.4	!#A 396  1.08e+06
assign (resid 58 and name HB1) (resid 60 and name HN) 4.0 2.2 1.0	!#A 593  1.93e+05
assign (resid 58 and name HN) (resid 60 and name HN) 4.0 2.2 1.0	!#A 13  1.67e+05
assign (resid 58 and name HB1) (resid 62 and name HN) 4.0 2.2 1.0	!#A 125  4.47e+05
assign (resid 58 and name HA) (resid 62 and name HN) 4.0 2.2 1.0	!#A 124  1.75e+05
assign (resid 58 and name HN) (resid 62 and name HN) 4.0 2.2 1.0	!#A 120  1.97e+05
assign (resid 58 and name HB1) (resid 63 and name HN) 3.0 1.2 1.8	!#A 280  5.07e+05

!V59
assign (resid 59 and name HG2#) (resid 59 and name HN) 4.0 2.2 1.5	!#A 399  2.90e+05
assign (resid 59 and name HG1#) (resid 59 and name HN) 4.0 2.2 1.5	!#A 398  2.25e+05
assign (resid 59 and name HN) (resid 60 and name HB1) 4.0 2.2 1.8	!#A 530  1.94e+05
assign (resid 59 and name HG1#) (resid 60 and name HN) 4.0 2.2 1.5	!#A 446  2.15e+05
assign (resid 59 and name HA) (resid 60 and name HN) 4.0 2.2 1.0	!#A 444  2.02e+05
assign (resid 59 and name HN) (resid 60 and name HB2) 4.0 2.2 1.0	!#A 397  1.67e+05
assign (resid 59 and name HN) (resid 61 and name HN) 4.0 2.2 1.0	!#A 527  1.62e+05
assign (resid 59 and name HA) (resid 62 and name HN) 4.0 2.2 1.0	!#A 83  1.62e+05

!D60
assign (resid 60 and name HB#) (resid 60 and name HN) 3.0 1.2 0.5	!#A 445  6.93e+05
assign (resid 60 and name HA) (resid 61 and name HN) 4.0 2.2 1.0	!#A 263  1.67e+05
assign (resid 60 and name HN) (resid 61 and name HN) 3.0 1.2 0.5	!#A 443  6.22e+05
assign (resid 60 and name HA) (resid 62 and name HN) 4.0 2.2 1.0	!#A 123  1.69e+05
assign (resid 60 and name HN) (resid 62 and name HN) 4.0 2.2 1.0	!#A 122  2.08e+05
assign (resid 60 and name HN) (resid 63 and name HA) 4.0 2.2 1.0	!#A 592  2.15e+05
assign (resid 60 and name HA) (resid 63 and name HN) 4.0 2.2 1.0	!#A 278  1.58e+05

!D61
assign (resid 61 and name HB2) (resid 62 and name HN) 4.0 2.2 1.0	!#A 84  4.47e+05
assign (resid 61 and name HB1) (resid 62 and name HN) 4.0 2.2 1.0	!#A 85  3.63e+05
assign (resid 61 and name HA) (resid 62 and name HN) 4.0 2.2 1.0	!#A 82  3.19e+05
assign (resid 61 and name HN) (resid 62 and name HN) 3.0 1.2 0.5	!#A 79  8.43e+05

!A62
assign (resid 62 and name HB#) (resid 62 and name HN) 2.5 0.7 0.7	!#A 86  1.05e+06
assign (resid 62 and name HA) (resid 62 and name HN) 3.0 1.2 0.5	!#A 81  6.69e+05
assign (resid 62 and name HN) (resid 63 and name HN) 4.0 2.2 1.0	!#A 121  3.26e+05
assign (resid 62 and name HB#) (resid 63 and name HN) 4.0 2.2 1.5	!#A 205  3.53e+05
assign (resid 62 and name HA) (resid 63 and name HN) 2.5 0.7 0.4	!#A 200  1.28e+06
assign (resid 62 and name HB#) (resid 64 and name HN) 4.0 2.2 1.5	!#A 520  3.89e+05
assign (resid 62 and name HA) (resid 64 and name HN) 4.0 2.2 1.0	!#A 517  3.92e+05
assign (resid 62 and name HA) (resid 65 and name HN) 4.0 2.2 1.0	!#A 216  2.31e+05
assign (resid 62 and name HB#) (resid 65 and name HN) 4.0 2.2 1.5	!#A 156  4.74e+05
assign (resid 62 and name HB#) (resid 66 and name HN) 3.0 1.2 2.0	!#A 315  7.64e+05

!Q63
assign (resid 63 and name HN) (resid 63 and name HE2#) 4.0 2.2 1.0	!#A 720  2.23e+05
assign (resid 63 and name HG#) (resid 63 and name HE2#) 4.0 2.2 1.0	!#A 529  2.27e+05
assign (resid 63 and name HB#) (resid 63 and name HN) 3.0 1.2 0.5	!#A 204  7.44e+05
assign (resid 63 and name HG1) (resid 63 and name HN) 4.0 2.2 1.0	!#A 202  4.33e+05
assign (resid 63 and name HA) (resid 63 and name HN) 4.0 2.2 1.0	!#A 201  3.08e+05
assign (resid 63 and name HG#) (resid 63 and name HN) 2.5 0.7 0.6	!#A 203  9.73e+05
assign (resid 63 and name HN) (resid 64 and name HA) 4.0 2.2 1.2	!#A 279  1.80e+05
assign (resid 63 and name HG#) (resid 64 and name HN) 4.0 2.2 1.0	!#A 391  5.99e+05
assign (resid 63 and name HB#) (resid 64 and name HN) 3.0 1.2 1.1	!#A 392  1.04e+06
assign (resid 63 and name HA) (resid 64 and name HN) 4.0 2.2 1.0	!#A 389  2.65e+05
assign (resid 63 and name HN) (resid 64 and name HN) 4.0 2.2 1.0	!#A 199  3.78e+05
assign (resid 63 and name HN) (resid 65 and name HN) 4.0 2.2 1.0	!#A 277  1.64e+05
assign (resid 63 and name HG#) (resid 66 and name HN) 4.0 2.2 2.0	!#A 312  1.72e+05
assign (resid 63 and name HA) (resid 66 and name HN) 4.0 2.2 1.0	!#A 310  1.74e+05
assign (resid 63 and name HA) (resid 67 and name HN) 3.0 1.2 0.5	!#A 6  7.85e+05

!D64
assign (resid 64 and name HB1) (resid 64 and name HN) 3.0 1.2 0.5	!#A 519  7.34e+05
assign (resid 64 and name HA) (resid 64 and name HN) 2.5 0.7 0.4	!#A 518  9.88e+05
assign (resid 64 and name HB2) (resid 64 and name HN) 3.0 1.2 0.5	!#A 390  5.25e+05
assign (resid 64 and name HB1) (resid 65 and name HN) 4.0 2.2 1.0	!#A 218  1.70e+05
assign (resid 64 and name HN) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 393  2.38e+05
assign (resid 64 and name HA) (resid 65 and name HN) 4.0 2.2 1.0	!#A 153  4.50e+05
assign (resid 64 and name HN) (resid 65 and name HN) 2.5 0.7 0.4	!#A 151  1.31e+06
assign (resid 64 and name HN) (resid 66 and name HN) 4.0 2.2 1.0	!#A 226  1.70e+05
assign (resid 64 and name HA) (resid 67 and name HN) 4.0 2.2 1.0	!#A 5  1.80e+05
assign (resid 64 and name HN) (resid 67 and name HN) 2.5 0.7 2.0	!#A 8  7.52e+06

!V65
assign (resid 65 and name HG1#) (resid 65 and name HN) 3.0 1.2 1.3	!#A 158  5.37e+05
assign (resid 65 and name HB) (resid 65 and name HN) 2.5 0.7 0.4	!#A 155  1.42e+06
assign (resid 65 and name HG2#) (resid 65 and name HN) 2.5 0.7 0.7	!#A 157  2.13e+06
assign (resid 65 and name HA) (resid 65 and name HN) 2.5 0.7 0.4	!#A 154  9.13e+05
assign (resid 65 and name HG2#) (resid 66 and name HN) 4.0 2.2 1.5	!#A 316  2.62e+05
assign (resid 65 and name HB) (resid 66 and name HN) 3.0 1.2 0.5	!#A 313  6.01e+05
assign (resid 65 and name HA) (resid 66 and name HN) 4.0 2.2 1.0	!#A 311  2.20e+05
assign (resid 65 and name HG1#) (resid 66 and name HN) 4.0 2.2 1.5	!#A 230  2.26e+05
assign (resid 65 and name HN) (resid 66 and name HN) 2.5 0.7 0.4	!#A 152  9.02e+05
assign (resid 65 and name HN) (resid 67 and name HN) 4.0 2.2 1.0	!#A 4  1.88e+05

!A66
assign (resid 66 and name HB#) (resid 66 and name HN) 4.0 2.2 1.5	!#A 314  2.89e+05
assign (resid 66 and name HA) (resid 66 and name HN) 4.0 2.2 1.0	!#A 228  2.81e+05
assign (resid 66 and name HA) (resid 67 and name HN) 4.0 2.2 1.0	!#A 7  2.04e+05
assign (resid 66 and name HN) (resid 67 and name HN) 4.0 2.2 1.0	!#A 2  3.53e+05
assign (resid 66 and name HB#) (resid 67 and name HN) 4.0 2.2 1.5	!#A 528  3.45e+05
assign (resid 66 and name HN) (resid 69 and name HN) 4.0 2.2 1.0	!#A 308  1.71e+05

!S67
assign (resid 67 and name HB#) (resid 67 and name HN) 3.0 1.2 0.5	!#A 527  5.16e+05
assign (resid 67 and name HA) (resid 67 and name HN) 4.0 2.2 1.0	!#A 526  3.87e+05
assign (resid 67 and name HA) (resid 68 and name HN) 4.0 2.2 1.0	!#A 11  2.16e+05
assign (resid 67 and name HB#) (resid 68 and name HN) 3.0 1.2 0.5	!#A 12  1.06e+06
assign (resid 67 and name HN) (resid 68 and name HN) 4.0 2.2 1.0	!#A 525  1.63e+05
assign (resid 67 and name HA) (resid 70 and name HN) 4.0 2.2 1.0	!#A 13  4.02e+05

!E68
assign (resid 68 and name HB#) (resid 68 and name HN) 2.5 0.7 0.4	!#A 97  1.88e+06
assign (resid 68 and name HG#) (resid 68 and name HN) 4.0 2.2 1.0	!#A 96  2.62e+05
assign (resid 68 and name HA) (resid 68 and name HN) 2.5 0.7 0.4	!#A 95  1.06e+06
assign (resid 68 and name HN) (resid 69 and name HA) 4.0 2.2 1.3	!#A 141  2.16e+05
assign (resid 68 and name HN) (resid 69 and name HN) 3.0 1.2 0.5	!#A 94  8.03e+05
assign (resid 68 and name HA) (resid 70 and name HN) 4.0 2.2 1.0	!#A 488  1.83e+05

!A69
assign (resid 69 and name HN) (resid 70 and name HN) 2.5 0.7 0.4	!#A 644  9.83e+05
assign (resid 69 and name HB#) (resid 70 and name HN) 4.0 2.2 1.5	!#A 491  3.23e+05
assign (resid 69 and name HA) (resid 70 and name HN) 4.0 2.2 1.0	!#A 487  4.02e+05
assign (resid 69 and name HA) (resid 71 and name HN) 4.0 2.2 1.0	!#A 327  1.55e+05
assign (resid 69 and name HA) (resid 78 and name HE2#) 4.0 2.2 1.0	!#A 748  2.04e+05
assign (resid 69 and name HB#) (resid 78 and name HE2#) 4.0 2.2 1.5	!#A 567  1.62e+05

!E70
assign (resid 70 and name HG#) (resid 70 and name HN) 4.0 2.2 1.0	!#A 490  3.44e+05
assign (resid 70 and name HB#) (resid 70 and name HN) 3.0 1.2 0.5	!#A 490  5.44e+05
assign (resid 70 and name HA) (resid 70 and name HN) 2.5 0.7 0.4	!#A 489  1.92e+06
assign (resid 70 and name HA) (resid 71 and name HN) 3.0 1.2 0.5	!#A 328  5.53e+05
assign (resid 70 and name HN) (resid 71 and name HN) 4.0 2.2 1.0	!#A 326  4.63e+05
assign (resid 70 and name HA) (resid 72 and name HN) 4.0 2.2 2.0	!#A 159  1.52e+05

!V71
assign (resid 71 and name HB) (resid 71 and name HN) 3.0 1.2 0.5	!#A 330  6.36e+05
assign (resid 71 and name HA) (resid 71 and name HN) 4.0 2.2 1.0	!#A 329  4.43e+05
assign (resid 71 and name HG2#) (resid 71 and name HN) 3.0 1.2 0.8	!#A 332  7.44e+05
assign (resid 71 and name HG1#) (resid 71 and name HN) 4.0 2.2 1.5	!#A 331  1.99e+05
assign (resid 71 and name HB) (resid 72 and name HN) 4.0 2.2 1.0	!#A 163  1.73e+05
assign (resid 71 and name HG1#) (resid 72 and name HN) 4.0 2.2 1.5	!#A 115  3.09e+05
assign (resid 71 and name HA) (resid 72 and name HN) 2.5 0.7 0.4	!#A 112  1.01e+06
assign (resid 71 and name HB) (resid 73 and name HN) 4.0 2.2 1.0	!#A 292  2.07e+05
assign (resid 71 and name HA) (resid 73 and name HN) 4.0 2.2 1.0	!#A 214  2.02e+05
assign (resid 71 and name HG1#) (resid 73 and name HN) 3.0 1.2 0.8	!#A 216  5.65e+05
assign (resid 71 and name HN) (resid 78 and name HE2#) 4.0 2.2 1.0	!#A 439  2.73e+05

!K72
assign (resid 72 and name HA) (resid 72 and name HN) 4.0 2.2 1.0	!#A 158  3.24e+05
assign (resid 72 and name HG#) (resid 72 and name HN) 4.0 2.2 1.0	!#A 113  1.54e+05
assign (resid 72 and name HB2) (resid 72 and name HN) 4.0 2.2 1.0	!#A 113  2.44e+05
assign (resid 72 and name HB1) (resid 73 and name HN) 4.0 2.2 1.0	!#A 291  1.83e+05
assign (resid 72 and name HB2) (resid 73 and name HN) 4.0 2.2 1.0	!#A 215  2.07e+05
assign (resid 72 and name HA) (resid 73 and name HN) 4.0 2.2 1.0	!#A 213  2.62e+05
assign (resid 72 and name HN) (resid 73 and name HN) 3.0 1.2 0.5	!#A 111  7.44e+05

!A73
assign (resid 73 and name HA) (resid 73 and name HN) 4.0 2.2 1.0	!#A 288  2.60e+05
assign (resid 73 and name HN) (resid 74 and name HA) 4.0 2.2 1.0	!#A 289  1.52e+05
assign (resid 73 and name HB#) (resid 74 and name HN) 4.0 2.2 1.5	!#A 532  3.73e+05
assign (resid 73 and name HA) (resid 74 and name HN) 3.0 1.2 0.5	!#A 530  5.59e+05
assign (resid 73 and name HN) (resid 74 and name HN) 4.0 2.2 1.0	!#A 211  1.54e+05

!T74
assign (resid 74 and name HG2#) (resid 74 and name HN) 4.0 2.2 1.5	!#A 533  1.99e+05
assign (resid 74 and name HA) (resid 74 and name HN) 4.0 2.2 1.0	!#A 531  1.77e+05

!P75
assign (resid 75 and name HA) (resid 76 and name HN) 4.0 2.2 1.0	!#A 324  2.57e+05
assign (resid 75 and name HG#) (resid 92 and name HN) 3.0 1.2 0.8	!#A 18  6.10e+05

!T76
assign (resid 76 and name HB) (resid 76 and name HN) 4.0 2.2 1.0	!#A 325  1.74e+05
assign (resid 76 and name HN) (resid 77 and name HN) 4.0 2.2 1.0	!#A 113  1.69e+05
assign (resid 76 and name HG2#) (resid 78 and name HE2#) 4.0 2.2 1.5	!#A 566  2.69e+05
assign (resid 76 and name HA) (resid 91 and name HN) 4.0 2.2 1.0	!#A 549  1.92e+05

!F77
assign (resid 77 and name HB1) (resid 77 and name HN) 4.0 2.2 1.0	!#A 78  2.30e+05
assign (resid 77 and name HD#) (resid 77 and name HN) 4.0 2.2 1.0	!#A 74  1.77e+05
assign (resid 77 and name HN) (resid 78 and name HN) 4.0 2.2 1.0	!#A 112  1.76e+05
assign (resid 77 and name HA) (resid 78 and name HN) 2.5 0.7 0.4	!#A 346  1.15e+06
assign (resid 77 and name HN) (resid 89 and name HZ) 4.0 2.2 1.3	!#A 114  2.24e+05
assign (resid 77 and name HN) (resid 90 and name HA) 4.0 2.2 1.0	!#A 75  2.79e+05
assign (resid 77 and name HN) (resid 91 and name HN) 4.0 2.2 1.0	!#A 546  1.61e+05

!Q78
assign (resid 78 and name HB2) (resid 78 and name HE2#) 4.0 2.2 1.0	!#A 752  2.55e+05
assign (resid 78 and name HB2) (resid 78 and name HN) 2.5 0.7 0.4	!#A 470  1.08e+06
assign (resid 78 and name HG#) (resid 78 and name HN) 3.0 1.2 0.5	!#A 468  5.08e+05
assign (resid 78 and name HG#) (resid 78 and name HE2#) 4.0 2.2 1.0	!#A 565  2.29e+05
assign (resid 78 and name HB1) (resid 78 and name HN) 4.0 2.2 1.0	!#A 350  2.72e+05
assign (resid 78 and name HA) (resid 78 and name HN) 4.0 2.2 1.0	!#A 347  2.53e+05
assign (resid 78 and name HN) (resid 79 and name HD#) 4.0 2.2 1.0	!#A 464  3.46e+05
assign (resid 78 and name HN) (resid 79 and name HE2#) 4.0 2.2 1.0	!#A 463  1.97e+05
assign (resid 78 and name HB1) (resid 79 and name HN) 4.0 2.2 1.0	!#A 283  2.06e+05
assign (resid 78 and name HA) (resid 79 and name HN) 3.0 1.2 0.5	!#A 281  6.85e+05
assign (resid 78 and name HN) (resid 80 and name HE#) 4.0 2.2 1.0	!#A 344  1.62e+05
assign (resid 78 and name HN) (resid 80 and name HD#) 4.0 2.2 1.0	!#A 345  2.00e+05

!F79
assign (resid 79 and name HD#) (resid 79 and name HN) 3.0 1.2 0.5	!#A 379  6.09e+05
assign (resid 79 and name HB2) (resid 79 and name HN) 4.0 2.2 1.0	!#A 381  2.41e+05
assign (resid 79 and name HB1) (resid 79 and name HN) 4.0 2.2 1.0	!#A 282  1.86e+05
assign (resid 79 and name HA) (resid 79 and name HN) 4.0 2.2 1.0	!#A 280  1.55e+05
assign (resid 79 and name HA) (resid 80 and name HN) 2.5 0.7 0.4	!#A 166  1.29e+06
assign (resid 79 and name HN) (resid 85 and name HG#) 4.0 2.2 1.0	!#A 284  1.85e+05
assign (resid 79 and name HN) (resid 86 and name HG2#) 4.0 2.2 1.5	!#A 285  1.90e+05
assign (resid 79 and name HB2) (resid 86 and name HN) 4.0 2.2 1.0	!#A 188  1.93e+05
assign (resid 79 and name HB1) (resid 87 and name HN) 4.0 2.2 1.0	!#A 743  3.56e+05
assign (resid 79 and name HD#) (resid 87 and name HN) 4.0 2.2 1.0	!#A 740  4.23e+05
assign (resid 79 and name HB2) (resid 87 and name HN) 3.0 1.2 0.5	!#A 561  7.02e+05
assign (resid 79 and name HN) (resid 87 and name HN) 4.0 2.2 1.0	!#A 279  1.72e+05
assign (resid 79 and name HN) (resid 88 and name HB1) 4.0 2.2 1.0	!#A 382  2.23e+05
assign (resid 79 and name HN) (resid 88 and name HA) 4.0 2.2 1.0	!#A 380  1.66e+05
assign (resid 79 and name HE#) (resid 88 and name HN) 4.0 2.2 1.0	!#A 521  2.31e+05
assign (resid 79 and name HN) (resid 89 and name HN) 4.0 2.2 1.2	!#A 278  1.68e+05
assign (resid 79 and name HZ) (resid 101 and name HN) 4.0 2.2 1.0	!#A 352  1.77e+05
assign (resid 79 and name HE#) (resid 101 and name HN) 4.0 2.2 1.0	!#A 253  1.84e+05

!F80
assign (resid 80 and name HB2) (resid 80 and name HN) 4.0 2.2 1.0	!#A 236  3.46e+05
assign (resid 80 and name HB1) (resid 80 and name HN) 4.0 2.2 1.0	!#A 168  3.93e+05
assign (resid 80 and name HD#) (resid 80 and name HN) 4.0 2.2 1.0	!#A 165  4.74e+05
assign (resid 80 and name HD#) (resid 81 and name HN) 4.0 2.2 1.0	!#A 507  1.73e+05
assign (resid 80 and name HB2) (resid 81 and name HN) 4.0 2.2 1.0	!#A 509  2.49e+05
assign (resid 80 and name HB1) (resid 81 and name HN) 4.0 2.2 1.0	!#A 382  2.73e+05
assign (resid 80 and name HA) (resid 81 and name HN) 2.5 0.7 0.4	!#A 380  2.02e+06
assign (resid 80 and name HD#) (resid 83 and name HN) 4.0 2.2 1.0	!#A 2  -1.59e+05
assign (resid 80 and name HA) (resid 84 and name HN) 4.0 2.2 1.0	!#A 477  2.07e+05
assign (resid 80 and name HD#) (resid 84 and name HN) 4.0 2.2 1.0	!#A 476  2.53e+05
assign (resid 80 and name HB1) (resid 84 and name HN) 4.0 2.2 1.0	!#A 354  1.92e+05
assign (resid 80 and name HE#) (resid 85 and name HN) 4.0 2.2 1.0	!#A 83  3.61e+05
assign (resid 80 and name HA) (resid 85 and name HN) 4.0 2.2 1.0	!#A 85  2.14e+05
assign (resid 80 and name HD#) (resid 85 and name HN) 4.0 2.2 1.0	!#A 84  4.73e+05
assign (resid 80 and name HD#) (resid 86 and name HN) 4.0 2.2 1.0	!#A 267  1.83e+05
assign (resid 80 and name HN) (resid 86 and name HG2#) 4.0 2.2 1.0	!#A 171  1.67e+05
assign (resid 80 and name HA) (resid 86 and name HN) 4.0 2.2 1.0	!#A 185  4.06e+05
assign (resid 80 and name HA) (resid 87 and name HN) 4.0 2.2 1.0	!#A 556  1.77e+05

!K81
assign (resid 81 and name HG#) (resid 81 and name HN) 4.0 2.2 1.0	!#A 513  2.57e+05
assign (resid 81 and name HG#) (resid 82 and name HN) 2.5 0.7 0.7	!#A 28  1.00e+06
assign (resid 81 and name HN) (resid 82 and name HN) 4.0 2.2 1.0	!#A 376  1.88e+05
assign (resid 81 and name HB#) (resid 82 and name HN) 3.0 1.2 1.0	!#A 19  6.33e+05
assign (resid 81 and name HA) (resid 82 and name HN) 2.5 0.7 0.4	!#A 16  3.41e+06
assign (resid 81 and name HB#) (resid 83 and name HN) 4.0 2.2 1.0	!#A 9  -1.76e+05
assign (resid 81 and name HN) (resid 83 and name HN) 4.0 2.2 1.0	!#A 1  -1.56e+05
assign (resid 81 and name HG#) (resid 83 and name HN) 4.0 2.2 1.0	!#A 7  -2.30e+05
assign (resid 81 and name HA) (resid 83 and name HN) 4.0 2.2 1.0	!#A 3  -3.79e+05
assign (resid 81 and name HG#) (resid 84 and name HN) 4.0 2.2 1.7	!#A 483  2.09e+05
assign (resid 81 and name HN) (resid 84 and name HE2#) 4.0 2.2 1.0	!#A 505  2.18e+05
assign (resid 81 and name HN) (resid 84 and name HB2) 4.0 2.2 1.0	!#A 383  1.79e+05
assign (resid 81 and name HN) (resid 84 and name HN) 3.0 1.2 0.5	!#A 353  7.10e+05
assign (resid 81 and name HN) (resid 85 and name HN) 4.0 2.2 1.0	!#A 82  4.10e+05
assign (resid 81 and name HN) (resid 85 and name HA) 4.0 2.2 1.0	!#A 381  2.76e+05
assign (resid 81 and name HN) (resid 86 and name HG2#) 4.0 2.2 1.0	!#A 385  4.02e+05
assign (resid 81 and name HN) (resid 86 and name HG1#) 3.0 1.2 1.0	!#A 384  4.92e+05

!K82
assign (resid 82 and name HD#) (resid 82 and name HN) 4.0 2.2 1.0	!#A 27  1.53e+05
assign (resid 82 and name HG#) (resid 82 and name HN) 2.5 0.7 0.4	!#A 20  1.00e+06
assign (resid 82 and name HB1) (resid 82 and name HN) 4.0 2.2 1.0	!#A 18  3.35e+05
assign (resid 82 and name HA) (resid 82 and name HN) 2.5 0.7 0.4	!#A 17  2.79e+06
assign (resid 82 and name HG#) (resid 83 and name HN) 4.0 2.2 1.0	!#A 10  -2.30e+05
assign (resid 82 and name HB1) (resid 83 and name HN) 4.0 2.2 1.0	!#A 6  -2.25e+05
assign (resid 82 and name HA) (resid 83 and name HN) 2.5 0.7 0.7	!#A 5  -2.01e+06
assign (resid 82 and name HN) (resid 83 and name HN) 3.0 1.2 0.5	!#A 1  -8.21e+05
assign (resid 82 and name HB2) (resid 84 and name HE2#) 4.0 2.2 2.0	!#A 704  1.64e+05

!G83
assign (resid 83 and name HA2) (resid 83 and name HN) 2.5 0.7 0.4	!#A 6  -2.46e+06
assign (resid 83 and name HA1) (resid 83 and name HN) 2.5 0.7 0.4	!#A 4  -1.76e+06
assign (resid 83 and name HA2) (resid 84 and name HN) 4.0 2.2 1.0	!#A 479  3.81e+05
assign (resid 83 and name HN) (resid 84 and name HA) 4.0 2.2 1.0	!#A 3  -6.81e+05
assign (resid 83 and name HN) (resid 84 and name HN) 3.0 1.2 0.5	!#A 2  -6.45e+05

!Q84
assign (resid 84 and name HA) (resid 84 and name HE2#) 4.0 2.2 1.0	!#A 701  1.76e+05
assign (resid 84 and name HN) (resid 84 and name HE2#) 4.0 2.2 1.0	!#A 698  6.69e+05
assign (resid 84 and name HB1) (resid 84 and name HN) 4.0 2.2 1.0	!#A 481  3.39e+05
assign (resid 84 and name HE2#) (resid 84 and name HN) 4.0 2.2 1.0	!#A 474  1.80e+05
assign (resid 84 and name HA) (resid 84 and name HN) 2.5 0.7 0.4	!#A 478  1.02e+06
assign (resid 84 and name HB1) (resid 84 and name HE2#) 4.0 2.2 1.0	!#A 518  1.60e+05
assign (resid 84 and name HG#) (resid 84 and name HE2#) 2.5 0.7 0.4	!#A 516  1.37e+06
assign (resid 84 and name HB2) (resid 84 and name HN) 2.5 0.7 0.4	!#A 357  1.45e+06
assign (resid 84 and name HG#) (resid 84 and name HN) 2.5 0.7 0.7	!#A 355  1.11e+06
assign (resid 84 and name HG#) (resid 85 and name HN) 4.0 2.2 1.0	!#A 88  4.00e+05
assign (resid 84 and name HA) (resid 85 and name HN) 2.5 0.7 0.4	!#A 86  4.75e+06
assign (resid 84 and name HN) (resid 85 and name HN) 4.0 2.2 1.0	!#A 352  2.83e+05
assign (resid 84 and name HB1) (resid 85 and name HN) 3.0 1.2 0.5	!#A 50  7.99e+05
assign (resid 84 and name HN) (resid 86 and name HG1#) 4.0 2.2 1.0	!#A 484  1.94e+05
assign (resid 84 and name HE2#) (resid 86 and name HG1#) 4.0 2.2 1.5	!#A 520  1.95e+05

!K85
assign (resid 85 and name HG#) (resid 85 and name HN) 4.0 2.2 1.0	!#A 90  2.05e+05
assign (resid 85 and name HB2) (resid 85 and name HN) 2.5 0.7 0.4	!#A 52  1.79e+06
assign (resid 85 and name HB1) (resid 85 and name HN) 2.5 0.7 0.4	!#A 51  1.53e+06
assign (resid 85 and name HA) (resid 85 and name HN) 3.0 1.2 0.5	!#A 49  7.78e+05
assign (resid 85 and name HA) (resid 86 and name HN) 2.5 0.7 0.4	!#A 187  1.23e+06
assign (resid 85 and name HN) (resid 86 and name HN) 4.0 2.2 1.0	!#A 48  2.46e+05
assign (resid 85 and name HA) (resid 87 and name HN) 3.0 1.2 0.5	!#A 559  6.02e+05
assign (resid 85 and name HG#) (resid 87 and name HN) 2.5 0.7 0.4	!#A 562  1.74e+06

!V86
assign (resid 86 and name HB) (resid 86 and name HN) 4.0 2.2 1.0	!#A 269  1.93e+05
assign (resid 86 and name HG2#) (resid 86 and name HN) 2.5 0.7 0.7	!#A 190  9.16e+05
assign (resid 86 and name HG1#) (resid 86 and name HN) 4.0 2.2 1.5	!#A 189  2.67e+05
assign (resid 86 and name HA) (resid 86 and name HN) 4.0 2.2 1.0	!#A 186  3.62e+05
assign (resid 86 and name HB) (resid 87 and name HN) 4.0 2.2 1.0	!#A 744  1.52e+05
assign (resid 86 and name HA) (resid 87 and name HN) 3.0 1.2 0.5	!#A 557  6.74e+05
assign (resid 86 and name HG2#) (resid 87 and name HN) 3.0 1.2 0.9	!#A 563  8.44e+05
assign (resid 86 and name HN) (resid 87 and name HN) 3.0 1.2 0.5	!#A 184  7.69e+05

!G87
assign (resid 87 and name HA2) (resid 87 and name HN) 2.5 0.7 0.4	!#A 560  9.05e+05
assign (resid 87 and name HA1) (resid 87 and name HN) 2.5 0.7 0.4	!#A 558  8.83e+05
assign (resid 87 and name HN) (resid 88 and name HN) 4.0 2.2 1.0	!#A 394  3.40e+05
assign (resid 87 and name HN) (resid 104 and name HD1#) 4.0 2.2 1.0	!#A 745  1.85e+05

!E88
assign (resid 88 and name HN) (resid 89 and name HN) 4.0 2.2 1.0	!#A 395  1.95e+05

!F89
assign (resid 89 and name HA) (resid 90 and name HN) 4.0 2.2 1.0	!#A 473  1.78e+05
assign (resid 89 and name HZ) (resid 93 and name HN) 4.0 2.2 1.0	!#A 147  1.89e+05
assign (resid 89 and name HE#) (resid 97 and name HN) 4.0 2.2 1.0	!#A 190  2.10e+05
assign (resid 89 and name HZ) (resid 97 and name HN) 4.0 2.2 1.0	!#A 133  4.57e+05
assign (resid 89 and name HZ) (resid 98 and name HN) 4.0 2.2 1.5	!#A 571  2.01e+05

!S90
assign (resid 90 and name HB2) (resid 91 and name HN) 4.0 2.2 1.0	!#A 739  2.02e+05
assign (resid 90 and name HN) (resid 91 and name HN) 4.0 2.2 1.0	!#A 621  1.59e+05
assign (resid 90 and name HA) (resid 91 and name HN) 3.0 1.2 0.5	!#A 547  6.98e+05

!G91
assign (resid 91 and name HA2) (resid 91 and name HN) 4.0 2.2 1.0	!#A 552  4.02e+05
assign (resid 91 and name HA1) (resid 91 and name HN) 4.0 2.2 1.0	!#A 548  2.97e+05
assign (resid 91 and name HA1) (resid 92 and name HN) 4.0 2.2 1.0	!#A 15  4.55e+05
assign (resid 91 and name HA2) (resid 92 and name HN) 4.0 2.2 1.0	!#A 17  4.45e+05
assign (resid 91 and name HN) (resid 92 and name HA) 4.0 2.2 1.0	!#A 737  1.92e+05

!A92
assign (resid 92 and name HA) (resid 92 and name HN) 4.0 2.2 1.0	!#A 16  2.07e+05
assign (resid 92 and name HN) (resid 93 and name HN) 4.0 2.2 1.0	!#A 14  1.65e+05
assign (resid 92 and name HB#) (resid 93 and name HN) 4.0 2.2 1.5	!#A 102  2.18e+05
assign (resid 92 and name HA) (resid 93 and name HN) 3.0 1.2 0.5	!#A 99  7.48e+05
assign (resid 92 and name HA) (resid 94 and name HN) 4.0 2.2 1.0	!#A 135  2.07e+05

!N93
assign (resid 93 and name HB1) (resid 93 and name HD2#) 4.0 2.2 1.0	!#A 674  3.06e+05
assign (resid 93 and name HB2) (resid 93 and name HD2#) 4.0 2.2 1.0	!#A 509  4.75e+05
assign (resid 93 and name HB1) (resid 93 and name HN) 4.0 2.2 1.0	!#A 100  3.35e+05
assign (resid 93 and name HA) (resid 93 and name HN) 4.0 2.2 1.0	!#A 98  2.65e+05
assign (resid 93 and name HB2) (resid 93 and name HN) 4.0 2.2 1.0	!#A 101  2.70e+05
assign (resid 93 and name HD2#) (resid 94 and name HN) 4.0 2.2 1.0	!#A 133  1.57e+05
assign (resid 93 and name HN) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 150  3.28e+05
assign (resid 93 and name HN) (resid 94 and name HN) 4.0 2.2 1.0	!#A 144  1.60e+05
assign (resid 93 and name HD2#) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 512  2.16e+05
assign (resid 93 and name HD2#) (resid 95 and name HN) 4.0 2.2 1.0	!#A 668  1.68e+05
assign (resid 93 and name HA) (resid 95 and name HN) 4.0 2.2 1.0	!#A 306  1.88e+05
assign (resid 93 and name HD2#) (resid 96 and name HB1) 4.0 2.2 1.0	!#A 681  2.16e+05
assign (resid 93 and name HD2#) (resid 96 and name HB2) 4.0 2.2 1.0	!#A 679  1.68e+05
assign (resid 93 and name HN) (resid 96 and name HB1) 4.0 2.2 1.0	!#A 149  1.98e+05
assign (resid 93 and name HN) (resid 96 and name HB2) 4.0 2.2 1.0	!#A 148  2.18e+05
assign (resid 93 and name HD2#) (resid 96 and name HN) 4.0 2.2 1.0	!#A 283  2.24e+05
assign (resid 93 and name HA) (resid 96 and name HN) 4.0 2.2 1.0	!#A 284  1.66e+05
assign (resid 93 and name HB1) (resid 96 and name HN) 4.0 2.2 1.0	!#A 209  1.90e+05
assign (resid 93 and name HD2#) (resid 97 and name HN) 4.0 2.2 2.0	!#A 191  1.91e+05

!K94
assign (resid 94 and name HB1) (resid 94 and name HN) 3.0 1.2 0.5	!#A 92  6.11e+05
assign (resid 94 and name HG#) (resid 94 and name HN) 4.0 2.2 1.0	!#A 93  1.64e+05
assign (resid 94 and name HN) (resid 95 and name HB2) 4.0 2.2 1.0	!#A 136  3.10e+05
assign (resid 94 and name HD#) (resid 95 and name HN) 4.0 2.2 1.0	!#A 414  2.05e+05
assign (resid 94 and name HB2) (resid 95 and name HN) 4.0 2.2 1.0	!#A 312  2.05e+05
assign (resid 94 and name HA) (resid 95 and name HN) 4.0 2.2 1.0	!#A 308  1.84e+05
assign (resid 94 and name HN) (resid 95 and name HN) 4.0 2.2 1.0	!#A 91  2.33e+05
assign (resid 94 and name HA) (resid 97 and name HN) 4.0 2.2 1.0	!#A 193  2.49e+05

!E95
assign (resid 95 and name HB2) (resid 95 and name HN) 4.0 2.2 1.0	!#A 413  3.36e+05
assign (resid 95 and name HG#) (resid 95 and name HN) 4.0 2.2 1.0	!#A 309  3.73e+05
assign (resid 95 and name HB1) (resid 95 and name HN) 3.0 1.2 0.5	!#A 310  6.08e+05
assign (resid 95 and name HA) (resid 95 and name HN) 3.0 1.2 0.5	!#A 307  4.96e+05
assign (resid 95 and name HG#) (resid 96 and name HN) 4.0 2.2 1.0	!#A 285  1.90e+05
assign (resid 95 and name HB2) (resid 96 and name HN) 4.0 2.2 1.0	!#A 286  1.65e+05
assign (resid 95 and name HN) (resid 96 and name HB#) 4.0 2.2 1.0	!#A 311  2.24e+05
assign (resid 95 and name HN) (resid 96 and name HN) 4.0 2.2 1.0	!#A 305  2.75e+05
assign (resid 95 and name HA) (resid 98 and name HN) 3.0 1.2 0.5	!#A 433  5.35e+05
assign (resid 95 and name HN) (resid 98 and name HN) 4.0 2.2 1.2	!#A 304  4.82e+05

!K96
assign (resid 96 and name HB1) (resid 96 and name HN) 3.0 1.2 0.5	!#A 210  8.04e+05
assign (resid 96 and name HA) (resid 96 and name HN) 3.0 1.2 0.5	!#A 208  7.97e+05
assign (resid 96 and name HB2) (resid 97 and name HN) 4.0 2.2 1.0	!#A 195  2.64e+05
assign (resid 96 and name HA) (resid 97 and name HN) 4.0 2.2 1.0	!#A 192  3.45e+05
assign (resid 96 and name HG#) (resid 97 and name HN) 4.0 2.2 1.0	!#A 199  1.54e+05
assign (resid 96 and name HB1) (resid 97 and name HN) 4.0 2.2 1.0	!#A 196  3.26e+05
assign (resid 96 and name HN) (resid 97 and name HN) 4.0 2.2 1.0	!#A 206  4.75e+05
assign (resid 96 and name HG#) (resid 98 and name HN) 4.0 2.2 1.8	!#A 578  2.17e+05
assign (resid 96 and name HB2) (resid 98 and name HN) 4.0 2.2 1.3	!#A 576  2.37e+05
assign (resid 96 and name HA) (resid 98 and name HN) 4.0 2.2 1.0	!#A 573  1.55e+05
assign (resid 96 and name HN) (resid 99 and name HN) 4.0 2.2 1.0	!#A 281  4.70e+05
assign (resid 96 and name HA) (resid 99 and name HN) 4.0 2.2 1.0	!#A 240  3.40e+05

!L97
assign (resid 97 and name HD1#) (resid 97 and name HN) 4.0 2.2 1.5	!#A 197  2.67e+05
assign (resid 97 and name HB1) (resid 97 and name HN) 3.0 1.2 0.5	!#A 136  1.32e+06
assign (resid 97 and name HB2) (resid 97 and name HN) 3.0 1.2 0.5	!#A 135  7.76e+05
assign (resid 97 and name HA) (resid 97 and name HN) 3.0 1.2 0.5	!#A 134  5.44e+05
assign (resid 97 and name HB1) (resid 98 and name HN) 3.0 1.2 0.5	!#A 575  7.89e+05
assign (resid 97 and name HD2#) (resid 98 and name HN) 4.0 2.2 1.7	!#A 436  4.37e+05
assign (resid 97 and name HN) (resid 98 and name HN) 2.5 0.7 0.4	!#A 132  1.07e+06
assign (resid 97 and name HB1) (resid 99 and name HN) 4.0 2.2 1.5	!#A 333  2.17e+05
assign (resid 97 and name HN) (resid 99 and name HN) 4.0 2.2 1.0	!#A 328  1.62e+05

!E98
assign (resid 98 and name HB#) (resid 98 and name HN) 2.5 0.7 0.4	!#A 435  1.73e+06
assign (resid 98 and name HA) (resid 98 and name HN) 3.0 1.2 0.5	!#A 434  8.45e+05
assign (resid 98 and name HN) (resid 99 and name HB#) 4.0 2.2 1.2	!#A 576  2.37e+05
assign (resid 98 and name HG#) (resid 99 and name HN) 4.0 2.2 1.0	!#A 331  2.05e+05
assign (resid 98 and name HA) (resid 99 and name HN) 4.0 2.2 1.0	!#A 240  3.40e+05
assign (resid 98 and name HB#) (resid 99 and name HN) 2.5 0.7 0.6	!#A 241  8.88e+05
assign (resid 98 and name HN) (resid 99 and name HN) 2.5 0.7 0.4	!#A 238  1.04e+06
assign (resid 98 and name HN) (resid 100 and name HN) 4.0 2.2 1.0	!#A 467  1.79e+05
assign (resid 98 and name HA) (resid 101 and name HN) 4.0 2.2 1.0	!#A 355  2.36e+05
assign (resid 98 and name HN) (resid 101 and name HD1#) 4.0 2.2 1.0	!#A 577  2.35e+05
assign (resid 98 and name HN) (resid 101 and name HN) 4.0 2.2 1.0	!#A 251  4.96e+05
assign (resid 98 and name HG#) (resid 102 and name HN) 4.0 2.2 1.0	!#A 662  1.57e+05
assign (resid 98 and name HG#) (resid 102 and name HD2#) 4.0 2.2 1.0	!#A 501  3.29e+05

!A99
assign (resid 99 and name HB#) (resid 99 and name HN) 2.5 0.7 0.7	!#A 242  3.94e+06
assign (resid 99 and name HA) (resid 99 and name HN) 4.0 2.2 1.0	!#A 239  1.86e+05
assign (resid 99 and name HA) (resid 100 and name HN) 4.0 2.2 1.0	!#A 619  2.27e+05
assign (resid 99 and name HB#) (resid 100 and name HN) 2.5 0.7 0.7	!#A 471  9.79e+05
assign (resid 99 and name HN) (resid 100 and name HN) 3.0 1.2 0.5	!#A 237  5.62e+05
assign (resid 99 and name HA) (resid 101 and name HN) 4.0 2.2 1.0	!#A 354  2.85e+05
assign (resid 99 and name HA) (resid 102 and name HN) 4.0 2.2 1.0	!#A 660  4.01e+05
assign (resid 99 and name HA) (resid 102 and name HD2#) 4.0 2.2 1.0	!#A 499  3.45e+05

!T100
assign (resid 100 and name HG2#) (resid 100 and name HN) 4.0 2.2 1.5	!#A 472  3.83e+05
assign (resid 100 and name HA) (resid 100 and name HN) 3.0 1.2 0.5	!#A 470  5.72e+05
assign (resid 100 and name HB) (resid 100 and name HN) 3.0 1.2 0.5	!#A 469  7.03e+05
assign (resid 100 and name HB) (resid 101 and name HN) 4.0 2.2 1.0	!#A 254  3.20e+05
assign (resid 100 and name HN) (resid 101 and name HN) 4.0 2.2 1.0	!#A 250  3.38e+05
assign (resid 100 and name HN) (resid 102 and name HN) 4.0 2.2 1.0	!#A 617  1.66e+05
assign (resid 100 and name HG2#) (resid 103 and name HN) 4.0 2.2 1.5	!#A 503  1.79e+05
assign (resid 100 and name HN) (resid 103 and name HN) 4.0 2.2 1.0	!#A 496  1.74e+05
assign (resid 100 and name HA) (resid 103 and name HN) 3.0 1.2 0.5	!#A 499  6.82e+05
assign (resid 100 and name HA) (resid 104 and name HN) 4.0 2.2 1.0	!#A 543  1.69e+05

!I101
assign (resid 101 and name HG1#) (resid 101 and name HN) 4.0 2.2 1.5	!#A 258  3.17e+05
assign (resid 101 and name HG2#) (resid 101 and name HN) 4.0 2.2 1.5	!#A 259  2.56e+05
assign (resid 101 and name HB) (resid 101 and name HN) 3.0 1.2 0.5	!#A 257  5.14e+05
assign (resid 101 and name HA) (resid 101 and name HN) 4.0 2.2 1.0	!#A 255  2.40e+05
assign (resid 101 and name HD1#) (resid 102 and name HN) 4.0 2.2 1.5	!#A 665  1.68e+05
assign (resid 101 and name HG1#) (resid 102 and name HN) 4.0 2.2 1.0	!#A 666  2.17e+05
assign (resid 101 and name HN) (resid 102 and name HN) 2.5 0.7 0.4	!#A 657  2.62e+06
assign (resid 101 and name HG2#) (resid 102 and name HN) 4.0 2.2 1.5	!#A 508  4.67e+05
assign (resid 101 and name HB) (resid 102 and name HN) 3.0 1.2 0.5	!#A 507  8.73e+05
assign (resid 101 and name HN) (resid 103 and name HB2) 4.0 2.2 1.0	!#A 256  6.43e+05
assign (resid 101 and name HN) (resid 103 and name HN) 4.0 2.2 1.0	!#A 252  2.63e+05
assign (resid 101 and name HA) (resid 104 and name HN) 4.0 2.2 1.0	!#A 407  2.09e+05

!N102
assign (resid 102 and name HN) (resid 102 and name HD2#) 4.0 2.2 1.0	!#A 653  6.23e+05
assign (resid 102 and name HB#) (resid 102 and name HD2#) 3.0 1.2 0.5	!#A 500  8.68e+05
assign (resid 102 and name HB#) (resid 102 and name HN) 2.5 0.7 0.4	!#A 506  1.32e+06
assign (resid 102 and name HA) (resid 102 and name HN) 3.0 1.2 0.5	!#A 505  7.30e+05
assign (resid 102 and name HN) (resid 103 and name HB2) 4.0 2.2 1.0	!#A 663  1.96e+05
assign (resid 102 and name HD2#) (resid 103 and name HN) 4.0 2.2 2.5	!#A 651  2.33e+05
assign (resid 102 and name HN) (resid 103 and name HN) 3.0 1.2 0.5	!#A 504  6.02e+05
assign (resid 102 and name HB#) (resid 103 and name HN) 3.0 1.2 0.5	!#A 372  5.76e+05
assign (resid 102 and name HA) (resid 103 and name HN) 4.0 2.2 1.0	!#A 370  4.41e+05
assign (resid 102 and name HN) (resid 105 and name HB) 4.0 2.2 1.0	!#A 663  1.96e+05
assign (resid 102 and name HA) (resid 105 and name HN) 4.0 2.2 1.0	!#A 171  3.24e+05

!E103
assign (resid 103 and name HB1) (resid 103 and name HN) 2.5 0.7 0.4	!#A 375  1.14e+06
assign (resid 103 and name HB2) (resid 103 and name HN) 2.5 0.7 0.4	!#A 374  1.39e+06
assign (resid 103 and name HG#) (resid 103 and name HN) 4.0 2.2 1.0	!#A 373  7.19e+05
assign (resid 103 and name HA) (resid 103 and name HN) 2.5 0.7 0.4	!#A 371  1.72e+06
assign (resid 103 and name HN) (resid 104 and name HG) 4.0 2.2 1.0	!#A 500  2.22e+05
assign (resid 103 and name HB1) (resid 104 and name HN) 4.0 2.2 1.0	!#A 545  3.83e+05
assign (resid 103 and name HN) (resid 104 and name HA) 4.0 2.2 1.3	!#A 497  1.60e+05
assign (resid 103 and name HB2) (resid 104 and name HN) 4.0 2.2 1.0	!#A 408  3.70e+05
assign (resid 103 and name HA) (resid 104 and name HN) 4.0 2.2 1.0	!#A 406  4.48e+05
assign (resid 103 and name HN) (resid 104 and name HN) 2.5 0.7 0.4	!#A 369  1.66e+06
assign (resid 103 and name HN) (resid 105 and name HN) 4.0 2.2 1.0	!#A 123  3.24e+05

!L104
assign (resid 104 and name HB2) (resid 104 and name HN) 2.5 0.7 0.4	!#A 546  2.02e+06
assign (resid 104 and name HD1#) (resid 104 and name HN) 3.0 1.2 1.1	!#A 413  5.17e+05
assign (resid 104 and name HD2#) (resid 104 and name HN) 3.0 1.2 1.0	!#A 412  5.33e+05
assign (resid 104 and name HB1) (resid 104 and name HN) 3.0 1.2 0.7	!#A 410  5.87e+05
assign (resid 104 and name HG) (resid 104 and name HN) 2.5 0.7 0.4	!#A 409  2.02e+06
assign (resid 104 and name HA) (resid 104 and name HN) 3.0 1.2 0.5	!#A 405  8.64e+05
assign (resid 104 and name HB1) (resid 105 and name HN) 4.0 2.2 1.0	!#A 174  2.06e+05
assign (resid 104 and name HB2) (resid 105 and name HN) 4.0 2.2 1.0	!#A 173  4.15e+05
assign (resid 104 and name HN) (resid 105 and name HB) 4.0 2.2 1.0	!#A 544  1.70e+05
assign (resid 104 and name HD2#) (resid 105 and name HN) 4.0 2.2 1.7	!#A 177  2.12e+05
assign (resid 104 and name HN) (resid 105 and name HG1#) 4.0 2.2 1.5	!#A 411  2.29e+05
assign (resid 104 and name HA) (resid 105 and name HN) 3.0 1.2 0.5	!#A 125  5.30e+05
assign (resid 104 and name HN) (resid 105 and name HN) 2.5 0.7 0.4	!#A 124  1.54e+06

!V105
assign (resid 105 and name HG2#) (resid 105 and name HN) 4.0 2.2 1.5	!#A 175  2.39e+05
assign (resid 105 and name HG1#) (resid 105 and name HN) 2.5 0.7 0.7	!#A 128  2.39e+06
assign (resid 105 and name HB) (resid 105 and name HN) 2.5 0.7 0.4	!#A 127  1.60e+06
assign (resid 105 and name HA) (resid 105 and name HN) 2.5 0.7 0.4	!#A 126  1.44e+06

!EDIT_HISTORY
!	A(1591)  3dcc.in   Fri Sep 15 16:58:02 1995


!M1
assign (resid 1 and name HG#) (resid 1 and name HB#) 4.0 2.2 1.0	!#A 1491  2.98e+05
assign (resid 1 and name HA) (resid 1 and name HG#) 4.0 2.2 1.0	!#A 662  3.14e+05
assign (resid 1 and name HA) (resid 1 and name HB#) 4.0 2.2 1.0	!#A 661  4.07e+05
assign (resid 1 and name HA) (resid 2 and name HA) 4.0 2.2 1.0	!#A 998  -2.17e+05

!V2
assign (resid 2 and name HG1#) (resid 2 and name HB) 3.0 1.2 0.8	!#A 1856  -1.05e+06
assign (resid 2 and name HB) (resid 2 and name HA) 3.0 1.2 0.5	!#A 1316  6.10e+05
assign (resid 2 and name HB) (resid 2 and name HG2#) 2.5 0.7 0.7	!#A 1315  2.02e+06
assign (resid 2 and name HA) (resid 2 and name HG2#) 2.5 0.7 0.7	!#A 808  1.61e+06
assign (resid 2 and name HA) (resid 2 and name HG1#) 2.5 0.7 0.7	!#A 807  1.49e+06
assign (resid 2 and name HG1#) (resid 3 and name HA) 4.0 2.2 1.5	!#A 2635  2.17e+05
assign (resid 2 and name HA) (resid 3 and name HB1) 4.0 2.2 1.0	!#A 1141  1.83e+05
assign (resid 2 and name HG1#) (resid 42 and name HD2) 3.0 1.2 1.5	!#A 23  6.71e+05
assign (resid 2 and name HG2#) (resid 43 and name HA) 3.0 1.2 0.8	!#A 2700  6.71e+05
assign (resid 2 and name HG1#) (resid 43 and name HA) 4.0 2.2 1.5	!#A 2633  2.82e+05
assign (resid 2 and name HG2#) (resid 43 and name HD2) 4.0 2.2 1.5	!#A 386  6.01e+05
assign (resid 2 and name HB) (resid 43 and name HE1) 4.0 2.2 1.0	!#A 149  -1.97e+05
assign (resid 2 and name HG1#) (resid 43 and name HE1) 4.0 2.2 1.5	!#A 1855  1.60e+05
assign (resid 2 and name HG2#) (resid 43 and name HB#) 4.0 2.2 1.5	!#A 1910  1.59e+05
assign (resid 2 and name HG2#) (resid 46 and name HA) 3.0 1.2 1.3	!#A 892  6.18e+05
assign (resid 2 and name HG2#) (resid 54 and name HB1) 4.0 2.2 1.5	!#A 2699  -1.56e+05
assign (resid 2 and name HG1#) (resid 54 and name HB2) 4.0 2.2 1.5	!#A 1410  2.82e+05
assign (resid 2 and name HG2#) (resid 54 and name HB2) 3.0 1.2 0.8	!#A 1390  6.82e+05
assign (resid 2 and name HA) (resid 54 and name HB2) 4.0 2.2 1.0	!#A 809  -2.01e+05
assign (resid 2 and name HG2#) (resid 54 and name HD1) 4.0 2.2 1.5	!#A 1911  -1.58e+05
assign (resid 2 and name HG1#) (resid 55 and name HA) 4.0 2.2 1.5	!#A 571  3.92e+05
assign (resid 2 and name HG1#) (resid 56 and name HG1) 4.0 2.2 1.5	!#A 1794  2.89e+05
assign (resid 2 and name HG1#) (resid 56 and name HB#) 3.0 1.2 1.2	!#A 2636  -1.11e+06
assign (resid 2 and name HG1#) (resid 56 and name HA) 4.0 2.2 1.5	!#A 1854  1.53e+05

!K3
assign (resid 3 and name HG#) (resid 3 and name HA) 4.0 2.2 1.0	!#A 1571  4.24e+05
assign (resid 3 and name HB1) (resid 3 and name HA) 3.0 1.2 0.5	!#A 1357  9.59e+05
assign (resid 3 and name HA) (resid 3 and name HD#) 4.0 2.2 1.0	!#A 416  4.66e+05
assign (resid 3 and name HE#) (resid 3 and name HG#) 4.0 2.2 1.0	!#A 1338  4.09e+05
assign (resid 3 and name HE#) (resid 3 and name HG#) 3.0 1.2 0.5	!#A 1337  7.77e+05
assign (resid 3 and name HB1) (resid 3 and name HE#) 4.0 2.2 1.0	!#A 2023  -1.99e+05
assign (resid 3 and name HB2) (resid 3 and name HE#) 4.0 2.2 1.0	!#A 2038  -4.01e+05
assign (resid 3 and name HD2) (resid 3 and name HB2) 3.0 1.2 0.5	!#A 1421  -7.08e+05
assign (resid 3 and name HA) (resid 3 and name HB2) 3.0 1.2 0.5	!#A 440  -6.95e+05
assign (resid 3 and name HA) (resid 3 and name HG#) 4.0 2.2 1.0	!#A 437  3.70e+05
assign (resid 3 and name HA) (resid 3 and name HD#) 4.0 2.2 1.0	!#A 435  4.97e+05
assign (resid 3 and name HB2) (resid 3 and name HD#) 2.5 0.7 0.4	!#A 1360  6.92e+07
assign (resid 3 and name HG#) (resid 4 and name HG#) 4.0 2.2 2.0	!#A 1672  -1.64e+05
assign (resid 3 and name HA) (resid 4 and name HG#) 4.0 2.2 2.3	!#A 438  -1.51e+05
assign (resid 3 and name HG1) (resid 5 and name HA) 4.0 2.2 1.0	!#A 853  1.75e+05
assign (resid 3 and name HE#) (resid 5 and name HD1#) 4.0 2.2 1.5	!#A 2710  -4.28e+05
assign (resid 3 and name HG#) (resid 5 and name HG1#) 4.0 2.2 1.0	!#A 2329  3.03e+05
assign (resid 3 and name HG#) (resid 5 and name HD1#) 4.0 2.2 1.5	!#A 1935  2.35e+05
assign (resid 3 and name HG#) (resid 5 and name HD1#) 4.0 2.2 1.5	!#A 1934  1.94e+05
assign (resid 3 and name HD#) (resid 5 and name HD1#) 4.0 2.2 1.5	!#A 1931  4.73e+05
assign (resid 3 and name HB1) (resid 5 and name HD1#) 4.0 2.2 1.5	!#A 1355  2.28e+05
assign (resid 3 and name HD#) (resid 5 and name HD1#) 4.0 2.2 1.5	!#A 1372  -1.66e+05
assign (resid 3 and name HG#) (resid 10 and name HB#) 3.0 1.2 2.1	!#A 2334  6.86e+05
assign (resid 3 and name HD#) (resid 14 and name HB#) 4.0 2.2 1.5	!#A 1590  4.88e+05
assign (resid 3 and name HE#) (resid 14 and name HB#) 4.0 2.2 1.5	!#A 1316  2.45e+05
assign (resid 3 and name HG#) (resid 14 and name HB#) 2.5 0.7 0.7	!#A 1595  1.27e+07
assign (resid 3 and name HD#) (resid 14 and name HB#) 4.0 2.2 1.5	!#A 1591  4.11e+05
assign (resid 3 and name HD#) (resid 53 and name HG2#) 4.0 2.2 1.5	!#A 1373  2.28e+05
assign (resid 3 and name HB1) (resid 53 and name HG2#) 3.0 1.2 1.3	!#A 1356  1.78e+06
assign (resid 3 and name HB1) (resid 55 and name HD1#) 2.5 0.7 0.7	!#A 1339  1.43e+06
assign (resid 3 and name HB2) (resid 55 and name HA) 4.0 2.2 1.0	!#A 575  -1.81e+05
assign (resid 3 and name HB1) (resid 55 and name HG) 4.0 2.2 1.0	!#A 2238  -3.17e+05
assign (resid 3 and name HD#) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 2755  -2.05e+05
assign (resid 3 and name HG#) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 2330  2.54e+05
assign (resid 3 and name HB2) (resid 55 and name HD1#) 3.0 1.2 1.2	!#A 2616  -7.42e+05
assign (resid 3 and name HG#) (resid 55 and name HD1#) 4.0 2.2 1.5	!#A 2601  3.11e+05
assign (resid 3 and name HB1) (resid 55 and name HA) 4.0 2.2 1.0	!#A 249  -1.42e+05

!Q4
assign (resid 4 and name HG#) (resid 4 and name HA) 4.0 2.2 1.0	!#A 1145  5.24e+05
assign (resid 4 and name HA) (resid 4 and name HB#) 3.0 1.2 0.5	!#A 374  8.08e+05
assign (resid 4 and name HG#) (resid 5 and name HA) 4.0 2.2 1.0	!#A 1157  1.51e+05
assign (resid 4 and name HG#) (resid 5 and name HG1#) 4.0 2.2 2.0	!#A 1716  -1.65e+05
assign (resid 4 and name HG#) (resid 6 and name HA) 4.0 2.2 1.0	!#A 777  -1.51e+05
assign (resid 4 and name HG#) (resid 6 and name HB2) 4.0 2.2 1.0	!#A 1671  1.77e+05
assign (resid 4 and name HG#) (resid 6 and name HB1) 4.0 2.2 1.0	!#A 1284  -2.01e+06
assign (resid 4 and name HA) (resid 55 and name HB1) 4.0 2.2 1.0	!#A 375  1.65e+05
assign (resid 4 and name HG#) (resid 56 and name HB#) 4.0 2.2 1.0	!#A 1146  1.80e+05
assign (resid 4 and name HG#) (resid 56 and name HG#) 4.0 2.2 1.0	!#A 1624  -1.92e+05
assign (resid 4 and name HA) (resid 56 and name HB#) 4.0 2.2 1.0	!#A 1351  4.62e+05
assign (resid 4 and name HA) (resid 56 and name HG#) 4.0 2.2 1.0	!#A 377  -2.00e+05
assign (resid 4 and name HG#) (resid 57 and name HA) 4.0 2.2 2.0	!#A 641  -1.47e+05

!I5
assign (resid 5 and name HG1#) (resid 5 and name HA) 3.0 1.2 0.8	!#A 1436  9.73e+05
assign (resid 5 and name HG2#) (resid 5 and name HA) 3.0 1.2 0.8	!#A 1817  7.28e+05
assign (resid 5 and name HB) (resid 5 and name HA) 4.0 2.2 1.0	!#A 1261  3.35e+05
assign (resid 5 and name HG1#) (resid 5 and name HG2#) 2.5 0.7 0.7	!#A 1435  2.41e+06
assign (resid 5 and name HG2#) (resid 5 and name HD1#) 2.5 0.7 0.7	!#A 1806  -3.28e+06
assign (resid 5 and name HG1#) (resid 5 and name HD1#) 3.0 1.2 0.8	!#A 1709  -1.28e+06
assign (resid 5 and name HB) (resid 5 and name HD1#) 3.0 1.2 0.8	!#A 1256  -8.45e+05
assign (resid 5 and name HA) (resid 5 and name HD1#) 2.5 0.7 0.7	!#A 515  -1.99e+06
assign (resid 5 and name HG2#) (resid 6 and name HA) 4.0 2.2 1.5	!#A 1818  2.02e+05
assign (resid 5 and name HA) (resid 6 and name HG#) 4.0 2.2 1.0	!#A 521  -1.74e+05
assign (resid 5 and name HG2#) (resid 8 and name HA) 4.0 2.2 1.5	!#A 1813  1.85e+05
assign (resid 5 and name HA) (resid 10 and name HB#) 3.0 1.2 0.8	!#A 517  7.19e+05
assign (resid 5 and name HG2#) (resid 10 and name HA) 4.0 2.2 1.5	!#A 575  2.26e+05
assign (resid 5 and name HD1#) (resid 10 and name HB#) 3.0 1.2 0.8	!#A 1936  1.83e+06
assign (resid 5 and name HG2#) (resid 10 and name HB#) 2.5 0.7 1.2	!#A 1811  2.10e+06
assign (resid 5 and name HG1#) (resid 10 and name HB#) 4.0 2.2 1.5	!#A 1713  2.12e+05
assign (resid 5 and name HB) (resid 10 and name HB#) 4.0 2.2 1.5	!#A 1260  6.28e+05
assign (resid 5 and name HD1#) (resid 11 and name HA) 3.0 1.2 0.8	!#A 602  -1.03e+06
assign (resid 5 and name HG1#) (resid 11 and name HD#) 4.0 2.2 1.0	!#A 435  2.04e+05
assign (resid 5 and name HG2#) (resid 11 and name HB2) 3.0 1.2 0.8	!#A 966  1.03e+06
assign (resid 5 and name HG2#) (resid 11 and name HB1) 3.0 1.2 1.1	!#A 886  7.60e+05
assign (resid 5 and name HG2#) (resid 11 and name HD#) 3.0 1.2 0.8	!#A 124  8.45e+05
assign (resid 5 and name HG2#) (resid 11 and name HA) 3.0 1.2 0.8	!#A 1812  8.23e+05
assign (resid 5 and name HA) (resid 11 and name HA) 4.0 2.2 1.0	!#A 518  1.65e+05
assign (resid 5 and name HD1#) (resid 11 and name HD#) 4.0 2.2 1.5	!#A 119  -3.10e+05
assign (resid 5 and name HG1#) (resid 14 and name HB#) 4.0 2.2 1.0	!#A 1419  2.13e+05
assign (resid 5 and name HD1#) (resid 14 and name HB#) 2.5 0.7 1.2	!#A 1569  -2.16e+06
assign (resid 5 and name HG2#) (resid 14 and name HB#) 4.0 2.2 1.3	!#A 2605  2.45e+06
assign (resid 5 and name HA) (resid 14 and name HB#) 4.0 2.2 1.5	!#A 854  2.48e+05
assign (resid 5 and name HD1#) (resid 14 and name HA) 4.0 2.2 1.5	!#A 1942  1.91e+05
assign (resid 5 and name HG1#) (resid 14 and name HB#) 4.0 2.2 1.5	!#A 1714  4.13e+05
assign (resid 5 and name HG1#) (resid 55 and name HD1#) 4.0 2.2 1.5	!#A 2510  2.79e+05
assign (resid 5 and name HG1#) (resid 55 and name HG) 4.0 2.2 1.0	!#A 2228  2.23e+05
assign (resid 5 and name HD1#) (resid 55 and name HG) 4.0 2.2 1.5	!#A 2227  -3.61e+05
assign (resid 5 and name HD1#) (resid 55 and name HD1#) 4.0 2.2 2.3	!#A 2652  -3.28e+05
assign (resid 5 and name HG2#) (resid 55 and name HD2#) 4.0 2.2 2.0	!#A 2021  4.80e+05
assign (resid 5 and name HG1#) (resid 55 and name HB1) 3.0 1.2 0.5	!#A 1433  1.38e+06
assign (resid 5 and name HG1#) (resid 55 and name HB2) 4.0 2.2 1.5	!#A 1711  2.06e+05
assign (resid 5 and name HG1#) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 2012  2.42e+05
assign (resid 5 and name HG1#) (resid 55 and name HB2) 3.0 1.2 1.0	!#A 1395  1.83e+06
assign (resid 5 and name HG1#) (resid 55 and name HB1) 4.0 2.2 1.0	!#A 1626  -1.63e+05
assign (resid 5 and name HD1#) (resid 55 and name HD2#) 2.5 0.7 1.5	!#A 2009  -2.59e+06
assign (resid 5 and name HG2#) (resid 57 and name HG1#) 3.0 1.2 1.8	!#A 2753  7.80e+05
assign (resid 5 and name HG2#) (resid 57 and name HA) 4.0 2.2 1.5	!#A 2604  1.99e+05
assign (resid 5 and name HB) (resid 57 and name HG2#) 4.0 2.2 1.5	!#A 2121  -5.24e+05
assign (resid 5 and name HA) (resid 57 and name HG2#) 4.0 2.2 1.7	!#A 2120  -1.45e+05
assign (resid 5 and name HG1#) (resid 57 and name HA) 4.0 2.2 1.0	!#A 1434  -1.80e+05
assign (resid 5 and name HG2#) (resid 57 and name HG2#) 3.0 1.2 1.3	!#A 1810  1.19e+06
assign (resid 5 and name HD1#) (resid 57 and name HG2#) 4.0 2.2 2.0	!#A 2113  -3.16e+05
assign (resid 5 and name HG2#) (resid 62 and name HB#) 4.0 2.2 2.0	!#A 1667  2.09e+05
assign (resid 5 and name HG2#) (resid 65 and name HG1#) 4.0 2.2 2.0	!#A 2054  5.48e+05

!E6
assign (resid 6 and name HA) (resid 6 and name HG#) 3.0 1.2 0.5	!#A 433  -1.05e+06
assign (resid 6 and name HA) (resid 6 and name HB1) 4.0 2.2 1.0	!#A 429  5.78e+05
assign (resid 6 and name HA) (resid 6 and name HB2) 3.0 1.2 0.5	!#A 428  7.06e+05
assign (resid 6 and name HB2) (resid 7 and name HB1) 4.0 2.2 1.0	!#A 1151  1.76e+05
assign (resid 6 and name HA) (resid 7 and name HA) 4.0 2.2 1.0	!#A 432  1.76e+05
assign (resid 6 and name HB1) (resid 7 and name HA) 4.0 2.2 1.3	!#A 290  -1.51e+05
assign (resid 6 and name HB2) (resid 10 and name HB#) 4.0 2.2 1.5	!#A 1641  4.41e+05
assign (resid 6 and name HA) (resid 10 and name HB#) 4.0 2.2 1.8	!#A 1456  -1.93e+05
assign (resid 6 and name HG#) (resid 10 and name HB#) 4.0 2.2 1.5	!#A 1156  4.41e+05
assign (resid 6 and name HB1) (resid 61 and name HB2) 4.0 2.2 1.0	!#A 1378  -2.00e+05
assign (resid 6 and name HA) (resid 62 and name HB#) 3.0 1.2 0.8	!#A 431  1.13e+06
assign (resid 6 and name HA) (resid 62 and name HA) 4.0 2.2 1.0	!#A 430  -2.05e+05

!S7
assign (resid 7 and name HA) (resid 7 and name HB1) 3.0 1.2 0.5	!#A 292  8.61e+05
assign (resid 7 and name HA) (resid 7 and name HB2) 3.0 1.2 0.5	!#A 291  1.04e+06
assign (resid 7 and name HB2) (resid 9 and name HA) 4.0 2.2 1.0	!#A 881  1.60e+05
assign (resid 7 and name HB2) (resid 9 and name HB) 4.0 2.2 1.0	!#A 880  2.38e+05
assign (resid 7 and name HB2) (resid 9 and name HG2#) 4.0 2.2 1.5	!#A 544  2.65e+05
assign (resid 7 and name HB2) (resid 10 and name HB#) 4.0 2.2 1.5	!#A 517  1.49e+05
assign (resid 7 and name HB1) (resid 10 and name HB#) 4.0 2.2 1.5	!#A 1452  1.54e+05
assign (resid 7 and name HA) (resid 62 and name HB#) 3.0 1.2 0.8	!#A 293  2.61e+06
assign (resid 7 and name HA) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 287  2.16e+05
assign (resid 7 and name HB1) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 1949  1.44e+05

!K8
assign (resid 8 and name HG#) (resid 8 and name HA) 4.0 2.2 1.0	!#A 1487  3.64e+05
assign (resid 8 and name HE#) (resid 8 and name HG#) 3.0 1.2 0.5	!#A 969  6.88e+05
assign (resid 8 and name HB1) (resid 8 and name HE#) 4.0 2.2 1.0	!#A 1331  2.54e+05
assign (resid 8 and name HE#) (resid 8 and name HG1) 4.0 2.2 1.0	!#A 974  5.54e+05
assign (resid 8 and name HD#) (resid 8 and name HB2) 3.0 1.2 0.5	!#A 1384  1.25e+06
assign (resid 8 and name HE#) (resid 8 and name HB2) 4.0 2.2 1.0	!#A 973  3.52e+05
assign (resid 8 and name HA) (resid 8 and name HB2) 3.0 1.2 0.5	!#A 689  8.49e+05
assign (resid 8 and name HB1) (resid 9 and name HA) 4.0 2.2 1.0	!#A 1975  2.32e+05
assign (resid 8 and name HA) (resid 9 and name HA) 4.0 2.2 1.0	!#A 690  1.56e+05
assign (resid 8 and name HB2) (resid 11 and name HB2) 4.0 2.2 1.0	!#A 1335  2.00e+05
assign (resid 8 and name HG1) (resid 11 and name HB2) 4.0 2.2 1.0	!#A 2206  1.89e+05
assign (resid 8 and name HA) (resid 11 and name HD#) 4.0 2.2 1.0	!#A 446  2.11e+05
assign (resid 8 and name HA) (resid 11 and name HB2) 4.0 2.2 1.0	!#A 694  -1.97e+05
assign (resid 8 and name HA) (resid 11 and name HB1) 4.0 2.2 1.0	!#A 884  4.98e+05
assign (resid 8 and name HB1) (resid 11 and name HB1) 4.0 2.2 1.0	!#A 877  -1.74e+05
assign (resid 8 and name HB2) (resid 11 and name HB1) 4.0 2.2 1.0	!#A 878  -1.76e+05
assign (resid 8 and name HG#) (resid 12 and name HG#) 4.0 2.2 1.0	!#A 1489  -1.88e+05
assign (resid 8 and name HA) (resid 12 and name HG#) 4.0 2.2 1.0	!#A 1030  -3.17e+05
assign (resid 8 and name HB1) (resid 12 and name HG#) 2.5 0.7 1.8	!#A 1336  -2.41e+06
assign (resid 8 and name HE#) (resid 12 and name HG#) 4.0 2.2 1.0	!#A 1102  2.00e+05
assign (resid 8 and name HG#) (resid 12 and name HG#) 4.0 2.2 1.0	!#A 1099  -1.68e+05
assign (resid 8 and name HB2) (resid 64 and name HB2) 4.0 2.2 1.0	!#A 1042  -3.27e+05
assign (resid 8 and name HB2) (resid 64 and name HA) 4.0 2.2 1.0	!#A 2008  -2.49e+05
assign (resid 8 and name HE#) (resid 64 and name HB2) 3.0 1.2 0.8	!#A 1047  9.09e+05
assign (resid 8 and name HG#) (resid 64 and name HB2) 4.0 2.2 1.0	!#A 1044  -1.56e+05
assign (resid 8 and name HD#) (resid 64 and name HB2) 4.0 2.2 1.0	!#A 1043  -2.52e+05
assign (resid 8 and name HB1) (resid 64 and name HB2) 4.0 2.2 1.0	!#A 1041  -3.04e+05
assign (resid 8 and name HB2) (resid 65 and name HA) 4.0 2.2 1.0	!#A 1198  -2.78e+05
assign (resid 8 and name HA) (resid 65 and name HG2#) 3.0 1.2 0.8	!#A 1952  1.26e+06
assign (resid 8 and name HA) (resid 65 and name HA) 4.0 2.2 1.0	!#A 868  1.59e+05
assign (resid 8 and name HE#) (resid 65 and name HA) 4.0 2.2 1.0	!#A 867  2.76e+05
assign (resid 8 and name HA) (resid 65 and name HG1#) 4.0 2.2 1.5	!#A 691  2.74e+05
assign (resid 8 and name HG#) (resid 65 and name HA) 4.0 2.2 1.0	!#A 863  1.47e+05
assign (resid 8 and name HG#) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 1948  4.25e+05
assign (resid 8 and name HD#) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 1945  2.79e+05
assign (resid 8 and name HD#) (resid 65 and name HA) 4.0 2.2 1.0	!#A 861  -2.07e+05
assign (resid 8 and name HB2) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 1944  3.23e+05
assign (resid 8 and name HE#) (resid 68 and name HB#) 4.0 2.2 1.0	!#A 1217  -3.99e+05
assign (resid 8 and name HG#) (resid 68 and name HB#) 4.0 2.2 1.0	!#A 1484  1.50e+05
assign (resid 8 and name HD#) (resid 68 and name HG#) 4.0 2.2 1.0	!#A 1079  -2.45e+05

!T9
assign (resid 9 and name HA) (resid 9 and name HB) 2.5 0.7 0.5	!#A 989  1.99e+06
assign (resid 9 and name HG2#) (resid 9 and name HA) 2.5 0.7 0.7	!#A 1640  2.41e+06
assign (resid 9 and name HB) (resid 10 and name HA) 4.0 2.2 1.0	!#A 910  3.29e+05
assign (resid 9 and name HB) (resid 10 and name HB#) 4.0 2.2 1.5	!#A 966  5.33e+05
assign (resid 9 and name HG2#) (resid 10 and name HB#) 4.0 2.2 2.0	!#A 1453  4.20e+05
assign (resid 9 and name HG2#) (resid 10 and name HA) 3.0 1.2 1.0	!#A 573  8.84e+05
assign (resid 9 and name HA) (resid 10 and name HA) 4.0 2.2 1.0	!#A 572  3.06e+05
assign (resid 9 and name HA) (resid 12 and name HG#) 4.0 2.2 1.0	!#A 1100  2.37e+05
assign (resid 9 and name HG2#) (resid 12 and name HG#) 4.0 2.2 1.5	!#A 1644  1.84e+05
assign (resid 9 and name HA) (resid 12 and name HB#) 4.0 2.2 1.0	!#A 651  5.97e+05
assign (resid 9 and name HG2#) (resid 13 and name HG1) 4.0 2.2 1.5	!#A 1642  -2.63e+05

!A10
assign (resid 10 and name HA) (resid 10 and name HB#) 2.5 0.7 0.7	!#A 574  5.17e+06
assign (resid 10 and name HB#) (resid 11 and name HB2) 4.0 2.2 1.5	!#A 963  1.82e+05
assign (resid 10 and name HB#) (resid 11 and name HB1) 4.0 2.2 1.8	!#A 882  -2.35e+05
assign (resid 10 and name HB#) (resid 11 and name HA) 4.0 2.2 1.5	!#A 605  4.82e+05
assign (resid 10 and name HA) (resid 12 and name HG#) 4.0 2.2 1.5	!#A 1104  -2.36e+05
assign (resid 10 and name HA) (resid 13 and name HA) 4.0 2.2 1.2	!#A 956  3.59e+05
assign (resid 10 and name HA) (resid 13 and name HG#) 4.0 2.2 1.0	!#A 1092  1.54e+05
assign (resid 10 and name HA) (resid 13 and name HG#) 4.0 2.2 1.0	!#A 577  -1.75e+05
assign (resid 10 and name HA) (resid 13 and name HB1) 3.0 1.2 0.7	!#A 571  7.41e+05
assign (resid 10 and name HA) (resid 13 and name HB2) 3.0 1.2 0.5	!#A 570  6.92e+05
assign (resid 10 and name HB#) (resid 13 and name HB2) 4.0 2.2 1.5	!#A 1450  2.35e+05

!F11
assign (resid 11 and name HD#) (resid 11 and name HB2) 4.0 2.2 1.0	!#A 118  -1.98e+05
assign (resid 11 and name HD#) (resid 11 and name HA) 4.0 2.2 1.0	!#A 116  5.30e+05
assign (resid 11 and name HB1) (resid 11 and name HD#) 4.0 2.2 1.0	!#A 879  -2.57e+05
assign (resid 11 and name HB2) (resid 11 and name HD#) 4.0 2.2 1.0	!#A 961  -1.79e+05
assign (resid 11 and name HB2) (resid 11 and name HA) 4.0 2.2 1.0	!#A 964  4.76e+05
assign (resid 11 and name HB1) (resid 11 and name HA) 4.0 2.2 1.0	!#A 883  4.74e+05
assign (resid 11 and name HD#) (resid 12 and name HA) 4.0 2.2 1.0	!#A 448  2.06e+05
assign (resid 11 and name HD#) (resid 14 and name HB#) 4.0 2.2 1.5	!#A 452  3.40e+05
assign (resid 11 and name HB1) (resid 14 and name HB#) 4.0 2.2 1.9	!#A 885  1.73e+05
assign (resid 11 and name HA) (resid 14 and name HB#) 4.0 2.2 1.5	!#A 1597  4.65e+05
assign (resid 11 and name HD#) (resid 15 and name HD1#) 3.0 1.2 0.8	!#A 115  7.90e+05
assign (resid 11 and name HD#) (resid 15 and name HD2#) 4.0 2.2 1.3	!#A 445  6.16e+05
assign (resid 11 and name HD#) (resid 15 and name HD2#) 4.0 2.2 1.5	!#A 121  2.16e+05
assign (resid 11 and name HD#) (resid 25 and name HG2#) 4.0 2.2 1.5	!#A 449  4.70e+05
assign (resid 11 and name HD#) (resid 25 and name HG1#) 4.0 2.2 1.5	!#A 122  1.77e+05
assign (resid 11 and name HA) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 2019  1.48e+05
assign (resid 11 and name HD#) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 2010  -2.80e+05
assign (resid 11 and name HD#) (resid 57 and name HG1#) 4.0 2.2 1.5	!#A 450  3.53e+05
assign (resid 11 and name HD#) (resid 57 and name HG2#) 4.0 2.2 1.5	!#A 123  3.11e+05
assign (resid 11 and name HD#) (resid 65 and name HG1#) 3.0 1.2 0.8	!#A 440  9.71e+05
assign (resid 11 and name HB2) (resid 65 and name HG1#) 4.0 2.2 1.5	!#A 2055  -1.60e+05
assign (resid 11 and name HA) (resid 65 and name HG1#) 4.0 2.2 1.5	!#A 604  -1.80e+05
assign (resid 11 and name HB2) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 962  2.50e+05
assign (resid 11 and name HB1) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 880  2.14e+05

!Q12
assign (resid 12 and name HA) (resid 12 and name HG#) 4.0 2.2 1.0	!#A 854  -4.73e+05
assign (resid 12 and name HA) (resid 12 and name HB#) 3.0 1.2 0.5	!#A 848  8.36e+05
assign (resid 12 and name HA) (resid 13 and name HA) 4.0 2.2 1.0	!#A 1013  1.76e+05
assign (resid 12 and name HB#) (resid 15 and name HD1#) 4.0 2.2 1.5	!#A 1737  1.84e+05
assign (resid 12 and name HG#) (resid 15 and name HD1#) 4.0 2.2 1.5	!#A 2172  -1.86e+05
assign (resid 12 and name HA) (resid 15 and name HA) 4.0 2.2 1.5	!#A 803  1.59e+05
assign (resid 12 and name HG#) (resid 15 and name HB2) 4.0 2.2 2.0	!#A 1130  -1.47e+05
assign (resid 12 and name HA) (resid 15 and name HB2) 4.0 2.2 1.0	!#A 851  -2.17e+05
assign (resid 12 and name HA) (resid 15 and name HB1) 4.0 2.2 1.0	!#A 852  -1.82e+05
assign (resid 12 and name HA) (resid 15 and name HD1#) 3.0 1.2 0.8	!#A 850  9.64e+05
assign (resid 12 and name HA) (resid 15 and name HG) 4.0 2.2 1.0	!#A 849  2.43e+05

!E13
assign (resid 13 and name HB2) (resid 13 and name HA) 3.0 1.2 0.5	!#A 1241  1.01e+06
assign (resid 13 and name HG#) (resid 13 and name HA) 3.0 1.2 0.7	!#A 1091  6.03e+05
assign (resid 13 and name HA) (resid 13 and name HB1) 3.0 1.2 0.5	!#A 674  1.10e+06
assign (resid 13 and name HB1) (resid 14 and name HA) 4.0 2.2 1.0	!#A 1288  2.18e+05
assign (resid 13 and name HA) (resid 14 and name HB#) 4.0 2.2 2.0	!#A 1599  -1.54e+05
assign (resid 13 and name HA) (resid 15 and name HB2) 4.0 2.2 1.2	!#A 2126  -1.97e+05
assign (resid 13 and name HA) (resid 16 and name HA) 4.0 2.2 1.3	!#A 849  2.22e+05
assign (resid 13 and name HG#) (resid 16 and name HB#) 4.0 2.2 1.0	!#A 1183  -1.45e+05
assign (resid 13 and name HA) (resid 16 and name HB#) 4.0 2.2 1.0	!#A 675  -5.05e+05
assign (resid 13 and name HB1) (resid 16 and name HB#) 4.0 2.2 1.0	!#A 1031  -2.19e+05
assign (resid 13 and name HB1) (resid 17 and name HB#) 4.0 2.2 1.5	!#A 1515  1.72e+05

!A14
assign (resid 14 and name HB#) (resid 15 and name HA) 4.0 2.2 1.5	!#A 1127  2.25e+05
assign (resid 14 and name HB#) (resid 15 and name HD2#) 4.0 2.2 2.0	!#A 2153  2.96e+05
assign (resid 14 and name HB#) (resid 15 and name HG) 4.0 2.2 1.5	!#A 1593  2.37e+05
assign (resid 14 and name HA) (resid 17 and name HB#) 2.5 0.7 0.7	!#A 1517  1.55e+06
assign (resid 14 and name HB#) (resid 23 and name HG1#) 4.0 2.2 2.0	!#A 1532  3.83e+05
assign (resid 14 and name HB#) (resid 55 and name HB2) 4.0 2.2 1.5	!#A 2370  2.63e+05
assign (resid 14 and name HA) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 2022  1.62e+05
assign (resid 14 and name HB#) (resid 55 and name HD1#) 3.0 1.2 1.6	!#A 1879  2.45e+06
assign (resid 14 and name HB#) (resid 55 and name HD2#) 2.5 0.7 1.2	!#A 1594  2.54e+06

!L15
assign (resid 15 and name HD1#) (resid 15 and name HA) 4.0 2.2 1.5	!#A 2171  4.05e+05
assign (resid 15 and name HD1#) (resid 15 and name HB1) 3.0 1.2 0.8	!#A 2169  -6.20e+05
assign (resid 15 and name HD2#) (resid 15 and name HB1) 4.0 2.2 1.5	!#A 2152  -5.31e+05
assign (resid 15 and name HD2#) (resid 15 and name HB2) 4.0 2.2 1.5	!#A 2151  -3.60e+05
assign (resid 15 and name HA) (resid 15 and name HB2) 4.0 2.2 1.0	!#A 800  -3.21e+05
assign (resid 15 and name HD2#) (resid 15 and name HD1#) 2.5 0.7 1.2	!#A 2145  6.26e+06
assign (resid 15 and name HB2) (resid 15 and name HD1#) 2.5 0.7 0.7	!#A 1422  1.63e+06
assign (resid 15 and name HA) (resid 15 and name HG) 4.0 2.2 1.0	!#A 794  3.94e+05
assign (resid 15 and name HB1) (resid 16 and name HA) 4.0 2.2 1.0	!#A 1743  1.42e+05
assign (resid 15 and name HA) (resid 16 and name HB#) 4.0 2.2 2.0	!#A 1034  -1.66e+05
assign (resid 15 and name HB1) (resid 18 and name HB#) 4.0 2.2 1.5	!#A 2538  5.70e+05
assign (resid 15 and name HD2#) (resid 18 and name HB#) 4.0 2.2 2.0	!#A 2150  3.72e+05
assign (resid 15 and name HB2) (resid 18 and name HB#) 4.0 2.2 1.9	!#A 1424  7.09e+05
assign (resid 15 and name HA) (resid 18 and name HB#) 3.0 1.2 0.8	!#A 799  9.16e+05
assign (resid 15 and name HA) (resid 23 and name HG1#) 4.0 2.2 1.5	!#A 781  2.61e+05
assign (resid 15 and name HB1) (resid 23 and name HG1#) 4.0 2.2 1.7	!#A 2537  2.54e+05
assign (resid 15 and name HA) (resid 23 and name HG2#) 4.0 2.2 1.5	!#A 1861  5.24e+05
assign (resid 15 and name HD2#) (resid 23 and name HG1#) 3.0 1.2 1.3	!#A 2149  1.27e+06
assign (resid 15 and name HD2#) (resid 23 and name HG2#) 3.0 1.2 1.7	!#A 2148  1.40e+06
assign (resid 15 and name HD2#) (resid 23 and name HB) 4.0 2.2 1.5	!#A 1279  5.65e+05
assign (resid 15 and name HD2#) (resid 25 and name HG2#) 4.0 2.2 1.0	!#A 2620  2.57e+06
assign (resid 15 and name HD1#) (resid 55 and name HD2#) 4.0 2.2 2.0	!#A 2015  2.74e+05
assign (resid 15 and name HD2#) (resid 55 and name HD2#) 4.0 2.2 2.0	!#A 2144  2.53e+05
assign (resid 15 and name HA) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 795  -1.64e+05
assign (resid 15 and name HD2#) (resid 80 and name HD#) 4.0 2.2 1.5	!#A 2142  -2.50e+05
assign (resid 15 and name HA) (resid 80 and name HB1) 4.0 2.2 1.0	!#A 1125  1.56e+05
assign (resid 15 and name HG) (resid 80 and name HB1) 4.0 2.2 1.0	!#A 1469  -2.10e+05
assign (resid 15 and name HD2#) (resid 80 and name HA) 4.0 2.2 1.5	!#A 230  2.40e+05
assign (resid 15 and name HD2#) (resid 80 and name HB1) 4.0 2.2 1.5	!#A 2147  -1.62e+05
assign (resid 15 and name HD2#) (resid 80 and name HB2) 4.0 2.2 1.5	!#A 2146  -1.70e+05
assign (resid 15 and name HD1#) (resid 80 and name HE#) 4.0 2.2 1.5	!#A 33  2.27e+05
assign (resid 15 and name HD1#) (resid 80 and name HB1) 4.0 2.2 1.5	!#A 1050  1.56e+05
assign (resid 15 and name HB2) (resid 83 and name HA2) 4.0 2.2 1.0	!#A 2124  -1.96e+05
assign (resid 15 and name HD2#) (resid 83 and name HA2) 4.0 2.2 1.5	!#A 876  1.76e+05
assign (resid 15 and name HD2#) (resid 83 and name HA1) 4.0 2.2 1.5	!#A 580  2.34e+05
assign (resid 15 and name HB1) (resid 83 and name HA2) 4.0 2.2 1.0	!#A 1745  -2.37e+05
assign (resid 15 and name HB1) (resid 83 and name HA1) 4.0 2.2 1.0	!#A 1744  -1.91e+05
assign (resid 15 and name HD1#) (resid 83 and name HA1) 4.0 2.2 1.5	!#A 579  4.71e+05
assign (resid 15 and name HD1#) (resid 83 and name HA2) 4.0 2.2 1.5	!#A 2166  -2.02e+05

!D16
assign (resid 16 and name HA) (resid 16 and name HB#) 3.0 1.2 0.5	!#A 514  -9.32e+05
assign (resid 16 and name HB#) (resid 17 and name HA) 4.0 2.2 1.0	!#A 1445  -1.96e+05
assign (resid 16 and name HB#) (resid 17 and name HB#) 4.0 2.2 1.5	!#A 1032  3.29e+05
assign (resid 16 and name HA) (resid 17 and name HA) 4.0 2.2 1.0	!#A 512  -4.84e+05
assign (resid 16 and name HA) (resid 18 and name HB#) 4.0 2.2 1.5	!#A 513  3.00e+05
assign (resid 16 and name HA) (resid 82 and name HA) 4.0 2.2 1.5	!#A 670  1.89e+05

!A17
assign (resid 17 and name HB#) (resid 17 and name HA) 2.5 0.7 0.7	!#A 1514  -3.93e+06
assign (resid 17 and name HA) (resid 18 and name HA) 4.0 2.2 1.0	!#A 1045  -2.37e+05
assign (resid 17 and name HA) (resid 18 and name HB#) 4.0 2.2 2.0	!#A 1558  -3.84e+05

!A18
assign (resid 18 and name HA) (resid 18 and name HB#) 2.5 0.7 0.7	!#A 712  4.12e+06
assign (resid 18 and name HB#) (resid 21 and name HB#) 4.0 2.2 1.5	!#A 1542  -1.41e+05
assign (resid 18 and name HB#) (resid 21 and name HB2) 4.0 2.2 1.5	!#A 1311  3.16e+05
assign (resid 18 and name HA) (resid 21 and name HD#) 4.0 2.2 1.0	!#A 1406  -3.09e+05
assign (resid 18 and name HB#) (resid 23 and name HG2#) 2.5 0.7 1.2	!#A 1522  5.07e+06
assign (resid 18 and name HA) (resid 23 and name HG2#) 4.0 2.2 1.5	!#A 668  4.62e+05
assign (resid 18 and name HB#) (resid 23 and name HB) 4.0 2.2 1.5	!#A 2286  -2.62e+05
assign (resid 18 and name HB#) (resid 23 and name HG1#) 4.0 2.2 2.0	!#A 1985  4.99e+05
assign (resid 18 and name HB#) (resid 53 and name HD1#) 4.0 2.2 1.0	!#A 1568  5.00e+06
assign (resid 18 and name HA) (resid 53 and name HD1#) 2.5 0.7 1.3	!#A 714  2.69e+06
assign (resid 18 and name HB#) (resid 53 and name HG2#) 2.5 0.7 1.6	!#A 1565  1.77e+06
assign (resid 18 and name HA) (resid 53 and name HG2#) 4.0 2.2 1.5	!#A 713  1.96e+05
assign (resid 18 and name HB#) (resid 53 and name HB) 3.0 1.2 0.8	!#A 1564  -7.73e+05
assign (resid 18 and name HB#) (resid 53 and name HG1#) 4.0 2.2 1.5	!#A 1607  2.91e+05
assign (resid 18 and name HA) (resid 53 and name HG1#) 4.0 2.2 1.0	!#A 711  1.62e+05

!G19

!D20
assign (resid 20 and name HA) (resid 20 and name HB#) 2.5 0.7 0.4	!#A 404  -1.50e+06
assign (resid 20 and name HA) (resid 81 and name HG#) 4.0 2.2 1.0	!#A 1495  2.00e+05
assign (resid 20 and name HB#) (resid 82 and name HA) 4.0 2.2 1.2	!#A 1013  -2.10e+05
assign (resid 20 and name HA) (resid 82 and name HA) 4.0 2.2 1.0	!#A 405  1.86e+05
assign (resid 20 and name HA) (resid 82 and name HE#) 3.0 1.2 0.5	!#A 403  -6.04e+05
assign (resid 20 and name HB#) (resid 82 and name HG#) 4.0 2.2 1.0	!#A 1012  1.53e+05
assign (resid 20 and name HA) (resid 82 and name HG1) 4.0 2.2 1.0	!#A 402  4.41e+05

!K21
assign (resid 21 and name HD#) (resid 21 and name HB#) 3.0 1.2 0.5	!#A 1408  -1.13e+06
assign (resid 21 and name HB#) (resid 21 and name HA) 3.0 1.2 0.5	!#A 1313  1.25e+06
assign (resid 21 and name HB#) (resid 21 and name HE#) 3.0 1.2 0.5	!#A 1310  -9.86e+05
assign (resid 21 and name HB1) (resid 21 and name HD#) 2.5 0.7 0.8	!#A 1306  1.62e+06
assign (resid 21 and name HB2) (resid 21 and name HD#) 2.5 0.7 0.4	!#A 1306  1.62e+06
assign (resid 21 and name HE#) (resid 21 and name HG#) 4.0 2.2 1.0	!#A 1293  4.79e+05
assign (resid 21 and name HA) (resid 21 and name HG#) 4.0 2.2 1.0	!#A 868  5.20e+05
assign (resid 21 and name HA) (resid 21 and name HE#) 4.0 2.2 1.0	!#A 531  -6.19e+05
assign (resid 21 and name HA) (resid 22 and name HB2) 4.0 2.2 1.0	!#A 2264  2.55e+05
assign (resid 21 and name HA) (resid 23 and name HG2#) 4.0 2.2 1.8	!#A 871  2.48e+05
assign (resid 21 and name HD#) (resid 51 and name HA) 4.0 2.2 1.0	!#A 345  2.34e+05
assign (resid 21 and name HB1) (resid 52 and name HA) 4.0 2.2 1.0	!#A 1312  3.28e+05
assign (resid 21 and name HD#) (resid 52 and name HA) 4.0 2.2 2.0	!#A 458  1.82e+05
assign (resid 21 and name HB#) (resid 53 and name HG1#) 4.0 2.2 1.0	!#A 1308  4.79e+05
assign (resid 21 and name HD#) (resid 53 and name HG1#) 4.0 2.2 1.0	!#A 2100  2.85e+05
assign (resid 21 and name HD#) (resid 53 and name HG2#) 4.0 2.2 2.8	!#A 2092  4.20e+05
assign (resid 21 and name HE#) (resid 53 and name HD1#) 3.0 1.2 0.8	!#A 937  1.07e+06
assign (resid 21 and name HD#) (resid 53 and name HD1#) 3.0 1.2 0.8	!#A 1821  1.14e+06

!L22
assign (resid 22 and name HB2) (resid 22 and name HA) 3.0 1.2 0.5	!#A 1513  9.05e+05
assign (resid 22 and name HD2#) (resid 22 and name HA) 3.0 1.2 0.8	!#A 1736  8.95e+05
assign (resid 22 and name HB1) (resid 22 and name HA) 4.0 2.2 1.0	!#A 1325  2.73e+05
assign (resid 22 and name HD1#) (resid 22 and name HB1) 4.0 2.2 1.5	!#A 1845  -5.21e+05
assign (resid 22 and name HD2#) (resid 22 and name HB2) 4.0 2.2 1.5	!#A 1728  -4.46e+05
assign (resid 22 and name HD2#) (resid 22 and name HB1) 4.0 2.2 1.5	!#A 1727  -2.68e+05
assign (resid 22 and name HA) (resid 22 and name HG) 4.0 2.2 1.0	!#A 482  2.40e+05
assign (resid 22 and name HA) (resid 22 and name HD1#) 3.0 1.2 1.8	!#A 481  6.57e+05
assign (resid 22 and name HB2) (resid 22 and name HD1#) 3.0 1.2 0.8	!#A 1505  1.33e+06
assign (resid 22 and name HA) (resid 23 and name HG2#) 4.0 2.2 1.5	!#A 487  3.61e+05
assign (resid 22 and name HD2#) (resid 24 and name HG2#) 4.0 2.2 2.0	!#A 2764  -3.23e+05
assign (resid 22 and name HD2#) (resid 24 and name HB) 4.0 2.2 2.0	!#A 1737  1.57e+05
assign (resid 22 and name HD2#) (resid 24 and name HG1#) 4.0 2.2 2.2	!#A 1729  2.84e+05
assign (resid 22 and name HD1#) (resid 24 and name HG2#) 4.0 2.2 2.0	!#A 2025  -2.06e+05
assign (resid 22 and name HB2) (resid 52 and name HA) 4.0 2.2 1.0	!#A 1512  1.55e+05
assign (resid 22 and name HD1#) (resid 52 and name HG2#) 4.0 2.2 2.0	!#A 1843  2.83e+05
assign (resid 22 and name HD1#) (resid 52 and name HG1#) 3.0 1.2 1.3	!#A 2059  6.01e+05
assign (resid 22 and name HB2) (resid 52 and name HG1#) 4.0 2.2 1.5	!#A 2085  -2.13e+05
assign (resid 22 and name HD2#) (resid 52 and name HG1#) 4.0 2.2 2.0	!#A 1726  4.07e+05
assign (resid 22 and name HB1) (resid 52 and name HG1#) 4.0 2.2 1.5	!#A 1323  3.17e+05
assign (resid 22 and name HB1) (resid 52 and name HG2#) 3.0 1.2 0.8	!#A 1322  6.57e+05
assign (resid 22 and name HB2) (resid 52 and name HG2#) 3.0 1.2 0.8	!#A 1508  7.57e+05
assign (resid 22 and name HD2#) (resid 79 and name HB2) 4.0 2.2 1.5	!#A 1085  4.81e+05
assign (resid 22 and name HD2#) (resid 79 and name HB1) 3.0 1.2 0.8	!#A 1059  6.82e+05
assign (resid 22 and name HD2#) (resid 79 and name HA) 4.0 2.2 1.5	!#A 237  4.49e+05
assign (resid 22 and name HD2#) (resid 79 and name HE#) 4.0 2.2 1.5	!#A 93  1.81e+05
assign (resid 22 and name HD1#) (resid 79 and name HE#) 4.0 2.2 1.5	!#A 90  2.13e+05
assign (resid 22 and name HD1#) (resid 79 and name HD#) 4.0 2.2 1.5	!#A 134  4.63e+05
assign (resid 22 and name HD2#) (resid 79 and name HD#) 4.0 2.2 1.5	!#A 1721  -2.24e+05
assign (resid 22 and name HD2#) (resid 80 and name HA) 4.0 2.2 2.5	!#A 563  2.01e+05
assign (resid 22 and name HD2#) (resid 81 and name HB#) 4.0 2.2 1.5	!#A 2527  -3.10e+05
assign (resid 22 and name HD2#) (resid 81 and name HG#) 3.0 1.2 2.1	!#A 2273  6.81e+05
assign (resid 22 and name HA) (resid 81 and name HB#) 4.0 2.2 1.0	!#A 490  -2.24e+05
assign (resid 22 and name HA) (resid 81 and name HE#) 3.0 1.2 0.5	!#A 488  -7.08e+05
assign (resid 22 and name HB2) (resid 81 and name HE#) 4.0 2.2 1.0	!#A 955  -2.41e+05
assign (resid 22 and name HD2#) (resid 81 and name HE#) 3.0 1.2 1.8	!#A 954  9.83e+05
assign (resid 22 and name HD2#) (resid 81 and name HA) 4.0 2.2 1.5	!#A 418  4.98e+05
assign (resid 22 and name HA) (resid 81 and name HG#) 4.0 2.2 1.0	!#A 483  5.88e+05
assign (resid 22 and name HG) (resid 81 and name HE#) 4.0 2.2 1.0	!#A 951  -2.04e+05
assign (resid 22 and name HD2#) (resid 81 and name HD#) 4.0 2.2 1.5	!#A 1720  3.87e+05
assign (resid 22 and name HA) (resid 81 and name HD#) 4.0 2.2 1.0	!#A 480  3.10e+05
assign (resid 22 and name HA) (resid 86 and name HG2#) 4.0 2.2 1.7	!#A 489  2.06e+05
assign (resid 22 and name HD2#) (resid 86 and name HG2#) 3.0 1.2 1.5	!#A 1956  1.27e+06
assign (resid 22 and name HB1) (resid 101 and name HG2#) 4.0 2.2 1.5	!#A 1324  -1.82e+05
assign (resid 22 and name HB1) (resid 101 and name HA) 4.0 2.2 1.0	!#A 1319  -1.50e+05
assign (resid 22 and name HD1#) (resid 101 and name HG2#) 3.0 1.2 1.3	!#A 2095  1.26e+06
assign (resid 22 and name HD1#) (resid 101 and name HA) 3.0 1.2 0.8	!#A 905  6.92e+05
assign (resid 22 and name HD1#) (resid 101 and name HG1#) 4.0 2.2 1.5	!#A 1838  5.50e+05
assign (resid 22 and name HD1#) (resid 104 and name HB1) 4.0 2.2 1.5	!#A 2270  2.33e+05
assign (resid 22 and name HD2#) (resid 104 and name HB1) 3.0 1.2 0.8	!#A 2273  6.81e+05
assign (resid 22 and name HD2#) (resid 104 and name HB2) 4.0 2.2 1.5	!#A 1724  -2.36e+05
assign (resid 22 and name HD1#) (resid 104 and name HD1#) 4.0 2.2 2.0	!#A 1839  3.23e+05
assign (resid 22 and name HD2#) (resid 104 and name HD1#) 3.0 1.2 1.3	!#A 1723  7.55e+05
assign (resid 22 and name HD1#) (resid 104 and name HB2) 2.5 0.7 0.7	!#A 1437  1.59e+06
assign (resid 22 and name HG) (resid 105 and name HA) 4.0 2.2 1.0	!#A 2131  3.17e+05
assign (resid 22 and name HD1#) (resid 105 and name HG2#) 3.0 1.2 1.7	!#A 1847  8.86e+05
assign (resid 22 and name HD2#) (resid 105 and name HA) 4.0 2.2 1.5	!#A 771  3.45e+05
assign (resid 22 and name HB2) (resid 105 and name HA) 4.0 2.2 1.0	!#A 1506  5.98e+05
assign (resid 22 and name HB1) (resid 105 and name HA) 4.0 2.2 1.0	!#A 1320  3.19e+05
assign (resid 22 and name HD1#) (resid 105 and name HB) 3.0 1.2 0.8	!#A 1196  6.19e+05
assign (resid 22 and name HD1#) (resid 105 and name HA) 3.0 1.2 0.8	!#A 770  8.03e+05

!V23
assign (resid 23 and name HG1#) (resid 23 and name HB) 4.0 2.2 1.5	!#A 1991  -5.93e+05
assign (resid 23 and name HG1#) (resid 23 and name HA) 3.0 1.2 0.8	!#A 1987  6.65e+05
assign (resid 23 and name HA) (resid 23 and name HG2#) 2.5 0.7 0.7	!#A 311  1.55e+06
assign (resid 23 and name HA) (resid 24 and name HG2#) 4.0 2.2 1.5	!#A 620  2.71e+05
assign (resid 23 and name HG1#) (resid 24 and name HA) 4.0 2.2 1.5	!#A 442  1.79e+05
assign (resid 23 and name HG1#) (resid 25 and name HG2#) 4.0 2.2 2.0	!#A 2737  2.50e+05
assign (resid 23 and name HA) (resid 53 and name HD1#) 4.0 2.2 1.8	!#A 317  1.54e+05
assign (resid 23 and name HA) (resid 53 and name HG1#) 4.0 2.2 1.0	!#A 1540  1.87e+05
assign (resid 23 and name HG1#) (resid 53 and name HG2#) 2.5 0.7 1.5	!#A 1831  4.94e+06
assign (resid 23 and name HG2#) (resid 53 and name HG1#) 3.0 1.2 0.8	!#A 2400  7.68e+05
assign (resid 23 and name HG2#) (resid 53 and name HG2#) 4.0 2.2 2.0	!#A 2641  3.17e+05
assign (resid 23 and name HA) (resid 53 and name HG2#) 4.0 2.2 1.5	!#A 316  5.19e+05
assign (resid 23 and name HG1#) (resid 53 and name HB) 4.0 2.2 1.5	!#A 1989  -2.97e+05
assign (resid 23 and name HA) (resid 53 and name HB) 4.0 2.2 1.0	!#A 1341  6.00e+05
assign (resid 23 and name HA) (resid 53 and name HA) 4.0 2.2 1.0	!#A 314  3.12e+05
assign (resid 23 and name HG2#) (resid 53 and name HD1#) 4.0 2.2 2.0	!#A 1822  5.08e+05
assign (resid 23 and name HA) (resid 54 and name HA) 4.0 2.2 1.0	!#A 262  2.50e+05
assign (resid 23 and name HG1#) (resid 55 and name HB1) 4.0 2.2 1.5	!#A 1629  1.01e+06
assign (resid 23 and name HG1#) (resid 55 and name HB2) 4.0 2.2 1.5	!#A 1400  -1.99e+05
assign (resid 23 and name HG1#) (resid 55 and name HD1#) 2.5 0.7 1.2	!#A 1984  2.00e+06
assign (resid 23 and name HG1#) (resid 55 and name HD2#) 2.5 0.7 1.2	!#A 1981  1.88e+07
assign (resid 23 and name HG1#) (resid 55 and name HG) 4.0 2.2 1.5	!#A 1980  4.50e+05
assign (resid 23 and name HB) (resid 80 and name HA) 4.0 2.2 1.0	!#A 1883  1.50e+05
assign (resid 23 and name HB) (resid 80 and name HD2) 4.0 2.2 1.0	!#A 188  -2.14e+05
assign (resid 23 and name HG2#) (resid 80 and name HB2) 4.0 2.2 1.5	!#A 1019  4.40e+05
assign (resid 23 and name HG1#) (resid 80 and name HB2) 4.0 2.2 1.5	!#A 1982  -2.48e+05
assign (resid 23 and name HG2#) (resid 80 and name HB1) 4.0 2.2 1.5	!#A 1858  -2.46e+05
assign (resid 23 and name HB) (resid 80 and name HB1) 4.0 2.2 1.0	!#A 1276  -3.01e+05
assign (resid 23 and name HB) (resid 80 and name HB2) 4.0 2.2 1.0	!#A 1275  -3.68e+05
assign (resid 23 and name HG1#) (resid 80 and name HB1) 4.0 2.2 1.5	!#A 1983  -2.42e+05
assign (resid 23 and name HG2#) (resid 81 and name HA) 4.0 2.2 1.5	!#A 767  3.87e+05
assign (resid 23 and name HG2#) (resid 81 and name HG#) 4.0 2.2 1.5	!#A 1857  3.02e+05
assign (resid 23 and name HG2#) (resid 82 and name HA) 4.0 2.2 1.5	!#A 1862  -1.53e+05

!V24
assign (resid 24 and name HG1#) (resid 24 and name HA) 4.0 2.2 1.5	!#A 2029  5.95e+05
assign (resid 24 and name HB) (resid 24 and name HA) 4.0 2.2 1.0	!#A 1478  2.08e+05
assign (resid 24 and name HG2#) (resid 42 and name HD#) 4.0 2.2 1.8	!#A 334  5.32e+05
assign (resid 24 and name HG2#) (resid 42 and name HE#) 4.0 2.2 1.5	!#A 254  1.42e+05
assign (resid 24 and name HG1#) (resid 42 and name HE#) 4.0 2.2 1.5	!#A 253  -1.98e+05
assign (resid 24 and name HG2#) (resid 52 and name HG1#) 4.0 2.2 2.0	!#A 2086  2.76e+05
assign (resid 24 and name HB) (resid 52 and name HG1#) 4.0 2.2 1.5	!#A 1476  3.58e+05
assign (resid 24 and name HB) (resid 54 and name HA) 4.0 2.2 1.0	!#A 1479  1.75e+05
assign (resid 24 and name HG2#) (resid 54 and name HD#) 4.0 2.2 1.5	!#A 203  1.93e+05
assign (resid 24 and name HG2#) (resid 54 and name HA) 4.0 2.2 1.5	!#A 260  2.40e+05
assign (resid 24 and name HG1#) (resid 54 and name HD#) 4.0 2.2 1.5	!#A 202  1.53e+05
assign (resid 24 and name HG2#) (resid 54 and name HE#) 4.0 2.2 1.5	!#A 2026  1.72e+05
assign (resid 24 and name HG2#) (resid 77 and name HD#) 4.0 2.2 2.5	!#A 539  2.27e+05
assign (resid 24 and name HG1#) (resid 77 and name HD#) 4.0 2.2 1.5	!#A 2041  -1.56e+05
assign (resid 24 and name HG2#) (resid 79 and name HA) 4.0 2.2 1.5	!#A 2033  2.00e+05
assign (resid 24 and name HG1#) (resid 79 and name HD#) 3.0 1.2 1.0	!#A 127  9.71e+05
assign (resid 24 and name HG1#) (resid 79 and name HE#) 4.0 2.2 1.5	!#A 88  3.88e+05
assign (resid 24 and name HG1#) (resid 79 and name HE#) 4.0 2.2 1.5	!#A 88  3.88e+05
assign (resid 24 and name HG1#) (resid 79 and name HD#) 4.0 2.2 1.5	!#A 2042  -2.42e+05
assign (resid 24 and name HA) (resid 79 and name HA) 4.0 2.2 1.0	!#A 241  5.13e+05
assign (resid 24 and name HG1#) (resid 79 and name HB1) 4.0 2.2 1.5	!#A 2045  1.53e+05
assign (resid 24 and name HG2#) (resid 79 and name HE#) 4.0 2.2 1.5	!#A 94  2.22e+05
assign (resid 24 and name HG2#) (resid 79 and name HB1) 4.0 2.2 1.5	!#A 2028  -2.09e+05
assign (resid 24 and name HG1#) (resid 79 and name HA) 4.0 2.2 1.5	!#A 238  -1.67e+05
assign (resid 24 and name HG1#) (resid 97 and name HD2#) 4.0 2.2 2.0	!#A 2705  3.84e+05
assign (resid 24 and name HB) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 1924  -1.60e+05
assign (resid 24 and name HG2#) (resid 101 and name HG1#) 4.0 2.2 1.5	!#A 2023  1.55e+05
assign (resid 24 and name HG2#) (resid 101 and name HA) 4.0 2.2 1.5	!#A 1242  -1.71e+05
assign (resid 24 and name HG1#) (resid 101 and name HD1#) 4.0 2.2 2.0	!#A 2046  4.80e+05
assign (resid 24 and name HG2#) (resid 101 and name HD1#) 4.0 2.2 2.0	!#A 2031  2.70e+05
assign (resid 24 and name HG2#) (resid 101 and name HG2#) 4.0 2.2 2.0	!#A 2101  -1.73e+05

!V25
assign (resid 25 and name HA) (resid 25 and name HB) 4.0 2.2 1.0	!#A 371  -1.59e+05
assign (resid 25 and name HG1#) (resid 25 and name HA) 4.0 2.2 1.5	!#A 2139  5.62e+05
assign (resid 25 and name HG1#) (resid 26 and name HB1) 4.0 2.2 1.7	!#A 2140  1.43e+05
assign (resid 25 and name HA) (resid 26 and name HB1) 4.0 2.2 1.0	!#A 369  1.92e+05
assign (resid 25 and name HG1#) (resid 27 and name HE#) 4.0 2.2 1.5	!#A 166  2.55e+05
assign (resid 25 and name HG1#) (resid 27 and name HD#) 4.0 2.2 1.5	!#A 166  2.55e+05
assign (resid 25 and name HB) (resid 27 and name HE#) 4.0 2.2 1.0	!#A 1295  -1.76e+05
assign (resid 25 and name HG1#) (resid 27 and name HE#) 4.0 2.2 1.5	!#A 508  5.55e+05
assign (resid 25 and name HG1#) (resid 27 and name HA) 4.0 2.2 1.5	!#A 339  2.05e+05
assign (resid 25 and name HA) (resid 42 and name HE#) 4.0 2.2 1.0	!#A 248  1.68e+05
assign (resid 25 and name HA) (resid 54 and name HA) 4.0 2.2 1.0	!#A 263  -2.18e+05
assign (resid 25 and name HG2#) (resid 55 and name HG) 4.0 2.2 1.5	!#A 1829  2.12e+05
assign (resid 25 and name HA) (resid 55 and name HB1) 4.0 2.2 1.0	!#A 2392  3.02e+05
assign (resid 25 and name HG2#) (resid 55 and name HB2) 4.0 2.2 1.5	!#A 2611  -2.73e+05
assign (resid 25 and name HG2#) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 2618  4.56e+05
assign (resid 25 and name HA) (resid 55 and name HB2) 4.0 2.2 1.0	!#A 1401  1.82e+05
assign (resid 25 and name HG1#) (resid 55 and name HB1) 4.0 2.2 1.5	!#A 1628  -2.67e+05
assign (resid 25 and name HG2#) (resid 55 and name HB1) 4.0 2.2 1.5	!#A 1627  3.29e+05
assign (resid 25 and name HA) (resid 55 and name HD1#) 4.0 2.2 1.5	!#A 367  4.18e+05
assign (resid 25 and name HG1#) (resid 55 and name HB2) 4.0 2.2 1.5	!#A 2134  -1.52e+05
assign (resid 25 and name HG1#) (resid 55 and name HD2#) 4.0 2.2 2.0	!#A 2133  1.68e+05
assign (resid 25 and name HA) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 365  2.73e+05
assign (resid 25 and name HA) (resid 56 and name HA) 3.0 1.2 1.5	!#A 372  7.07e+05
assign (resid 25 and name HG1#) (resid 56 and name HA) 4.0 2.2 1.5	!#A 294  3.60e+05
assign (resid 25 and name HG1#) (resid 57 and name HG2#) 2.5 0.7 1.2	!#A 2138  1.72e+06
assign (resid 25 and name HG1#) (resid 57 and name HG1#) 4.0 2.2 2.0	!#A 2137  -4.92e+05
assign (resid 25 and name HG1#) (resid 57 and name HB) 4.0 2.2 1.5	!#A 1674  1.68e+05
assign (resid 25 and name HG1#) (resid 65 and name HG1#) 4.0 2.2 2.0	!#A 2051  -3.35e+05
assign (resid 25 and name HB) (resid 78 and name HB2) 4.0 2.2 1.0	!#A 1757  -2.97e+05
assign (resid 25 and name HB) (resid 80 and name HD#) 4.0 2.2 1.0	!#A 1264  -2.08e+05
assign (resid 25 and name HB) (resid 80 and name HE#) 4.0 2.2 1.0	!#A 1294  -1.72e+05
assign (resid 25 and name HA) (resid 80 and name HE#) 4.0 2.2 2.0	!#A 356  1.89e+05
assign (resid 25 and name HG2#) (resid 80 and name HD#) 4.0 2.2 1.5	!#A 2617  -2.51e+05
assign (resid 25 and name HG2#) (resid 80 and name HB2) 4.0 2.2 1.5	!#A 1017  -1.76e+05

!D26
assign (resid 26 and name HB1) (resid 26 and name HA) 4.0 2.2 1.0	!#A 1222  -2.91e+05
assign (resid 26 and name HB1) (resid 56 and name HG#) 3.0 1.2 0.5	!#A 1769  -8.01e+05
assign (resid 26 and name HA) (resid 56 and name HG#) 4.0 2.2 1.5	!#A 529  -1.43e+05
assign (resid 26 and name HB1) (resid 56 and name HA) 4.0 2.2 1.0	!#A 298  -1.99e+05
assign (resid 26 and name HB1) (resid 57 and name HB) 4.0 2.2 1.2	!#A 2473  -3.78e+05
assign (resid 26 and name HB2) (resid 77 and name HE#) 4.0 2.2 1.0	!#A 1606  -1.90e+05
assign (resid 26 and name HA) (resid 77 and name HD#) 4.0 2.2 1.0	!#A 526  -1.49e+05
assign (resid 26 and name HB1) (resid 77 and name HD#) 4.0 2.2 1.0	!#A 1765  -1.66e+05
assign (resid 26 and name HB2) (resid 77 and name HD#) 4.0 2.2 1.0	!#A 1605  1.51e+05
assign (resid 26 and name HA) (resid 77 and name HA) 4.0 2.2 1.0	!#A 223  -1.89e+05
assign (resid 26 and name HB2) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 2389  -2.71e+05

!F27
assign (resid 27 and name HD#) (resid 27 and name HB1) 4.0 2.2 1.0	!#A 171  -2.18e+05
assign (resid 27 and name HB2) (resid 27 and name HD#) 4.0 2.2 1.0	!#A 984  -1.51e+05
assign (resid 27 and name HA) (resid 27 and name HD#) 4.0 2.2 1.0	!#A 336  -2.87e+05
assign (resid 27 and name HA) (resid 27 and name HB1) 4.0 2.2 1.0	!#A 343  -2.17e+05
assign (resid 27 and name HA) (resid 27 and name HB2) 4.0 2.2 1.0	!#A 342  -2.26e+05
assign (resid 27 and name HA) (resid 28 and name HA) 4.0 2.2 1.0	!#A 344  1.56e+05
assign (resid 27 and name HA) (resid 57 and name HB) 4.0 2.2 1.0	!#A 1678  3.49e+05
assign (resid 27 and name HD#) (resid 57 and name HG2#) 4.0 2.2 1.5	!#A 177  5.35e+05
assign (resid 27 and name HE#) (resid 57 and name HB) 4.0 2.2 1.0	!#A 1646  -1.51e+05
assign (resid 27 and name HD#) (resid 57 and name HG1#) 4.0 2.2 1.5	!#A 1993  -2.28e+05
assign (resid 27 and name HD#) (resid 57 and name HB) 4.0 2.2 1.0	!#A 1661  -3.25e+05
assign (resid 27 and name HB1) (resid 57 and name HB) 4.0 2.2 1.0	!#A 1182  1.53e+05
assign (resid 27 and name HA) (resid 57 and name HG2#) 4.0 2.2 1.5	!#A 340  2.98e+05
assign (resid 27 and name HE#) (resid 57 and name HG1#) 4.0 2.2 1.5	!#A 2003  -1.44e+05
assign (resid 27 and name HA) (resid 58 and name HA) 3.0 1.2 1.5	!#A 364  2.39e+06
assign (resid 27 and name HB1) (resid 59 and name HG1#) 4.0 2.2 1.5	!#A 1178  1.62e+05
assign (resid 27 and name HB2) (resid 59 and name HG1#) 4.0 2.2 1.5	!#A 987  1.54e+05
assign (resid 27 and name HE#) (resid 65 and name HG1#) 4.0 2.2 1.5	!#A 2048  -1.45e+05
assign (resid 27 and name HD#) (resid 66 and name HA) 4.0 2.2 1.0	!#A 753  -2.01e+05
assign (resid 27 and name HB1) (resid 66 and name HB#) 4.0 2.2 1.5	!#A 1536  -2.07e+05
assign (resid 27 and name HE#) (resid 66 and name HA) 4.0 2.2 1.0	!#A 778  -1.53e+05
assign (resid 27 and name HE#) (resid 69 and name HB#) 4.0 2.2 1.5	!#A 1633  -1.75e+05
assign (resid 27 and name HE#) (resid 71 and name HG2#) 3.0 1.2 0.8	!#A 167  1.10e+06
assign (resid 27 and name HD#) (resid 71 and name HG1#) 3.0 1.2 1.0	!#A 181  7.60e+05
assign (resid 27 and name HD#) (resid 71 and name HG2#) 4.0 2.2 1.5	!#A 2142  -2.50e+05
assign (resid 27 and name HB1) (resid 71 and name HG2#) 4.0 2.2 1.5	!#A 1174  1.74e+05
assign (resid 27 and name HB2) (resid 71 and name HG1#) 4.0 2.2 1.5	!#A 985  1.58e+05
assign (resid 27 and name HB2) (resid 71 and name HG2#) 4.0 2.2 1.5	!#A 986  1.53e+05
assign (resid 27 and name HB2) (resid 74 and name HG2#) 4.0 2.2 1.5	!#A 1370  3.32e+05
assign (resid 27 and name HA) (resid 75 and name HA) 4.0 2.2 2.0	!#A 590  4.52e+05
assign (resid 27 and name HE#) (resid 76 and name HB) 4.0 2.2 1.3	!#A 489  2.14e+05
assign (resid 27 and name HB2) (resid 76 and name HB) 4.0 2.2 1.0	!#A 757  -2.24e+05
assign (resid 27 and name HB1) (resid 76 and name HB) 4.0 2.2 1.0	!#A 1171  -1.50e+05
assign (resid 27 and name HE#) (resid 78 and name HB1) 4.0 2.2 1.0	!#A 175  -1.64e+05
assign (resid 27 and name HE#) (resid 78 and name HB2) 4.0 2.2 1.0	!#A 174  -1.44e+05
assign (resid 27 and name HE#) (resid 78 and name HG#) 4.0 2.2 1.0	!#A 172  -1.61e+05
assign (resid 27 and name HE#) (resid 80 and name HZ) 4.0 2.2 1.0	!#A 164  -1.51e+05

!S28
assign (resid 28 and name HA) (resid 28 and name HB1) 4.0 2.2 1.0	!#A 621  3.65e+05
assign (resid 28 and name HA) (resid 28 and name HB2) 4.0 2.2 1.0	!#A 620  3.10e+05
assign (resid 28 and name HB1) (resid 29 and name HB#) 4.0 2.2 1.7	!#A 2821  -1.66e+05
assign (resid 28 and name HA) (resid 29 and name HA) 4.0 2.2 1.0	!#A 947  -1.76e+05
assign (resid 28 and name HB2) (resid 30 and name HA) 4.0 2.2 1.0	!#A 1223  -1.90e+05
assign (resid 28 and name HB1) (resid 35 and name HA) 4.0 2.2 1.0	!#A 922  1.68e+05
assign (resid 28 and name HA) (resid 35 and name HB#) 4.0 2.2 1.5	!#A 2367  4.27e+05
assign (resid 28 and name HB1) (resid 35 and name HB#) 4.0 2.2 1.5	!#A 1268  3.05e+05
assign (resid 28 and name HB1) (resid 36 and name HB#) 4.0 2.2 1.7	!#A 2001  1.77e+05
assign (resid 28 and name HA) (resid 74 and name HA) 4.0 2.2 1.0	!#A 950  2.20e+05
assign (resid 28 and name HB1) (resid 74 and name HG2#) 4.0 2.2 1.5	!#A 932  -1.98e+05
assign (resid 28 and name HA) (resid 74 and name HG2#) 3.0 1.2 0.8	!#A 623  6.29e+05
assign (resid 28 and name HB1) (resid 74 and name HB) 4.0 2.2 1.0	!#A 826  1.68e+05
assign (resid 28 and name HA) (resid 74 and name HB) 4.0 2.2 1.0	!#A 619  5.02e+05
assign (resid 28 and name HA) (resid 75 and name HB2) 4.0 2.2 1.0	!#A 625  -1.52e+05
assign (resid 28 and name HA) (resid 75 and name HA) 4.0 2.2 1.0	!#A 268  2.54e+05
assign (resid 28 and name HB1) (resid 75 and name HD#) 4.0 2.2 2.4	!#A 931  1.41e+05

!A29
assign (resid 29 and name HA) (resid 30 and name HG2#) 4.0 2.2 1.5	!#A 409  3.30e+05
assign (resid 29 and name HB#) (resid 31 and name HD1) 4.0 2.2 1.5	!#A 2128  -2.43e+05
assign (resid 29 and name HB#) (resid 31 and name HZ2) 4.0 2.2 1.5	!#A 2125  2.61e+05
assign (resid 29 and name HA) (resid 32 and name HB2) 4.0 2.2 1.0	!#A 2052  -1.72e+05
assign (resid 29 and name HB#) (resid 32 and name HB2) 4.0 2.2 1.5	!#A 1371  5.58e+05
assign (resid 29 and name HB#) (resid 32 and name HB1) 4.0 2.2 1.5	!#A 1170  5.24e+05
assign (resid 29 and name HB#) (resid 32 and name HA) 4.0 2.2 1.5	!#A 2124  -1.58e+05
assign (resid 29 and name HB#) (resid 35 and name HB#) 4.0 2.2 2.0	!#A 2363  5.08e+05
assign (resid 29 and name HB#) (resid 58 and name HA) 4.0 2.2 1.5	!#A 2820  -1.93e+05
assign (resid 29 and name HA) (resid 58 and name HA) 3.0 1.2 0.5	!#A 357  -8.65e+05
assign (resid 29 and name HB#) (resid 59 and name HG2#) 3.0 1.2 1.3	!#A 2129  8.62e+05
assign (resid 29 and name HB#) (resid 59 and name HB) 4.0 2.2 1.5	!#A 1458  1.55e+05
assign (resid 29 and name HB#) (resid 74 and name HG2#) 3.0 1.2 1.8	!#A 1997  1.30e+06
assign (resid 29 and name HA) (resid 74 and name HG2#) 4.0 2.2 1.5	!#A 1992  -1.89e+05
assign (resid 29 and name HB#) (resid 74 and name HB) 4.0 2.2 1.5	!#A 2126  1.67e+05

!T30
assign (resid 30 and name HA) (resid 30 and name HG2#) 3.0 1.2 0.8	!#A 793  2.46e+06
assign (resid 30 and name HA) (resid 30 and name HB) 2.5 0.7 0.4	!#A 790  1.97e+06
assign (resid 30 and name HG2#) (resid 31 and name HD1) 4.0 2.2 1.5	!#A 50  -1.52e+05
assign (resid 30 and name HG2#) (resid 31 and name HB2) 4.0 2.2 1.5	!#A 1601  1.63e+05
assign (resid 30 and name HA) (resid 36 and name HD#) 4.0 2.2 1.0	!#A 783  2.21e+05
assign (resid 30 and name HA) (resid 36 and name HA) 4.0 2.2 1.0	!#A 1059  3.49e+05
assign (resid 30 and name HG2#) (resid 36 and name HD#) 4.0 2.2 1.5	!#A 1369  5.59e+05
assign (resid 30 and name HA) (resid 36 and name HG#) 4.0 2.2 1.0	!#A 1503  2.53e+05
assign (resid 30 and name HG2#) (resid 58 and name HB2) 4.0 2.2 1.5	!#A 1155  2.03e+05

!W31
assign (resid 31 and name HE3) (resid 31 and name HA) 4.0 2.2 1.0	!#A 310  -1.88e+05
assign (resid 31 and name HZ3) (resid 31 and name HH2) 4.0 2.2 1.0	!#A 109  -1.62e+05
assign (resid 31 and name HD1) (resid 31 and name HB2) 4.0 2.2 1.0	!#A 47  2.20e+05
assign (resid 31 and name HD1) (resid 31 and name HB1) 4.0 2.2 1.0	!#A 48  2.62e+05
assign (resid 31 and name HD1) (resid 31 and name HA) 4.0 2.2 1.0	!#A 46  -1.62e+05
assign (resid 31 and name HB1) (resid 31 and name HA) 3.0 1.2 0.5	!#A 929  -7.86e+05
assign (resid 31 and name HB2) (resid 31 and name HA) 3.0 1.2 0.5	!#A 812  -6.92e+05
assign (resid 31 and name HB1) (resid 32 and name HB2) 4.0 2.2 2.3	!#A 1286  1.78e+05
assign (resid 31 and name HE3) (resid 32 and name HA) 4.0 2.2 1.0	!#A 309  -1.55e+05
assign (resid 31 and name HB2) (resid 32 and name HA) 4.0 2.2 1.0	!#A 1143  -1.57e+05
assign (resid 31 and name HD1) (resid 32 and name HB1) 4.0 2.2 2.0	!#A 1654  1.57e+05
assign (resid 31 and name HA) (resid 36 and name HD#) 4.0 2.2 1.3	!#A 401  5.23e+05
assign (resid 31 and name HD1) (resid 60 and name HA) 4.0 2.2 1.0	!#A 373  2.02e+05

!C32
assign (resid 32 and name HA) (resid 32 and name HB1) 4.0 2.2 1.0	!#A 333  -2.41e+05
assign (resid 32 and name HA) (resid 32 and name HB2) 4.0 2.2 1.0	!#A 334  -2.45e+05
assign (resid 32 and name HB1) (resid 34 and name HG#) 4.0 2.2 1.0	!#A 1678  1.90e+05
assign (resid 32 and name HA) (resid 35 and name HB#) 4.0 2.2 1.5	!#A 645  2.48e+05
assign (resid 32 and name HB2) (resid 35 and name HB#) 3.0 1.2 0.8	!#A 2056  6.27e+05
assign (resid 32 and name HB1) (resid 35 and name HB#) 4.0 2.2 1.5	!#A 1681  5.05e+05
assign (resid 32 and name HB2) (resid 36 and name HB#) 4.0 2.2 2.0	!#A 2003  1.82e+05

!G33
assign (resid 33 and name HA1) (resid 34 and name HG#) 4.0 2.2 1.0	!#A 583  1.60e+05
assign (resid 33 and name HA1) (resid 34 and name HD#) 4.0 2.2 1.0	!#A 845  -1.47e+05
assign (resid 33 and name HA2) (resid 36 and name HB#) 4.0 2.2 1.0	!#A 1099  1.92e+05

!P34
assign (resid 34 and name HG#) (resid 34 and name HA) 4.0 2.2 1.0	!#A 1346  2.86e+05
assign (resid 34 and name HB2) (resid 34 and name HG#) 4.0 2.2 1.0	!#A 2110  3.20e+05
assign (resid 34 and name HG#) (resid 34 and name HB1) 4.0 2.2 1.0	!#A 2004  2.00e+05
assign (resid 34 and name HD#) (resid 34 and name HA) 4.0 2.2 1.0	!#A 673  2.00e+05
assign (resid 34 and name HA) (resid 34 and name HD#) 4.0 2.2 1.0	!#A 537  1.55e+05
assign (resid 34 and name HA) (resid 34 and name HB2) 4.0 2.2 1.0	!#A 534  2.31e+05
assign (resid 34 and name HA) (resid 34 and name HB1) 4.0 2.2 1.0	!#A 533  3.76e+05
assign (resid 34 and name HD#) (resid 35 and name HB#) 4.0 2.2 1.5	!#A 1169  -2.06e+05
assign (resid 34 and name HA) (resid 35 and name HB#) 4.0 2.2 2.0	!#A 2359  1.79e+05
assign (resid 34 and name HB2) (resid 35 and name HB#) 4.0 2.2 1.5	!#A 2356  3.37e+05
assign (resid 34 and name HA) (resid 37 and name HE#) 4.0 2.2 1.5	!#A 1444  1.44e+05
assign (resid 34 and name HA) (resid 37 and name HG#) 4.0 2.2 1.0	!#A 535  -1.70e+05
assign (resid 34 and name HB1) (resid 37 and name HB#) 3.0 1.2 1.7	!#A 1139  1.18e+06
assign (resid 34 and name HB2) (resid 38 and name HD1#) 4.0 2.2 1.5	!#A 2554  -1.52e+05
assign (resid 34 and name HB2) (resid 75 and name HD#) 4.0 2.2 1.0	!#A 631  1.99e+05

!A35
assign (resid 35 and name HA) (resid 38 and name HD1#) 4.0 2.2 1.5	!#A 1769  -1.57e+05
assign (resid 35 and name HA) (resid 38 and name HB) 4.0 2.2 1.0	!#A 721  -1.44e+05
assign (resid 35 and name HB#) (resid 74 and name HB) 4.0 2.2 1.0	!#A 2357  3.38e+05
assign (resid 35 and name HA) (resid 75 and name HG#) 4.0 2.2 1.0	!#A 1304  2.64e+05
assign (resid 35 and name HB#) (resid 75 and name HA) 4.0 2.2 1.0	!#A 589  2.02e+05
assign (resid 35 and name HA) (resid 75 and name HB1) 4.0 2.2 1.0	!#A 1291  1.78e+05
assign (resid 35 and name HA) (resid 75 and name HD#) 4.0 2.2 1.0	!#A 720  1.41e+05

!K36
assign (resid 36 and name HG#) (resid 36 and name HA) 4.0 2.2 1.0	!#A 2212  5.34e+05
assign (resid 36 and name HD#) (resid 36 and name HB#) 3.0 1.2 0.5	!#A 2050  1.25e+06
assign (resid 36 and name HA) (resid 36 and name HG#) 4.0 2.2 1.0	!#A 719  4.11e+05
assign (resid 36 and name HA) (resid 36 and name HD#) 4.0 2.2 1.0	!#A 718  -1.45e+05
assign (resid 36 and name HA) (resid 36 and name HB#) 3.0 1.2 0.5	!#A 717  8.99e+05
assign (resid 36 and name HG#) (resid 37 and name HA) 4.0 2.2 1.0	!#A 2213  1.79e+05
assign (resid 36 and name HG#) (resid 39 and name HG#) 4.0 2.2 1.0	!#A 2211  2.50e+05
assign (resid 36 and name HA) (resid 39 and name HB#) 4.0 2.2 1.0	!#A 1054  4.51e+05
assign (resid 36 and name HA) (resid 39 and name HD#) 4.0 2.2 1.0	!#A 1418  2.04e+05
assign (resid 36 and name HG#) (resid 39 and name HA) 4.0 2.2 1.5	!#A 555  1.62e+05

!M37
assign (resid 37 and name HA) (resid 37 and name HB#) 3.0 1.2 0.5	!#A 549  1.01e+06
assign (resid 37 and name HA) (resid 37 and name HG#) 4.0 2.2 1.0	!#A 546  -2.22e+05
assign (resid 37 and name HG#) (resid 40 and name HG#) 4.0 2.2 2.0	!#A 1277  -1.89e+05
assign (resid 37 and name HA) (resid 40 and name HD#) 4.0 2.2 1.0	!#A 548  -1.77e+05

!I38
assign (resid 38 and name HD1#) (resid 38 and name HA) 4.0 2.2 1.5	!#A 1767  2.99e+05
assign (resid 38 and name HG2#) (resid 38 and name HA) 4.0 2.2 1.5	!#A 1621  1.93e+05
assign (resid 38 and name HD1#) (resid 38 and name HB) 4.0 2.2 1.5	!#A 1766  -3.27e+05
assign (resid 38 and name HG2#) (resid 38 and name HB) 4.0 2.2 1.5	!#A 1620  -5.34e+05
assign (resid 38 and name HA) (resid 38 and name HB) 4.0 2.2 1.0	!#A 389  -4.09e+05
assign (resid 38 and name HA) (resid 38 and name HG1#) 4.0 2.2 1.5	!#A 387  3.13e+05
assign (resid 38 and name HA) (resid 39 and name HA) 4.0 2.2 1.0	!#A 728  -1.46e+05
assign (resid 38 and name HB) (resid 39 and name HA) 4.0 2.2 1.0	!#A 1937  1.94e+05
assign (resid 38 and name HG2#) (resid 39 and name HA) 4.0 2.2 1.5	!#A 557  2.62e+05
assign (resid 38 and name HG2#) (resid 40 and name HD#) 4.0 2.2 2.5	!#A 768  1.46e+05
assign (resid 38 and name HG2#) (resid 41 and name HB2) 4.0 2.2 1.5	!#A 917  2.47e+05
assign (resid 38 and name HA) (resid 41 and name HD#) 4.0 2.2 1.0	!#A 723  1.73e+05
assign (resid 38 and name HA) (resid 41 and name HB2) 4.0 2.2 1.0	!#A 916  1.68e+05
assign (resid 38 and name HG1#) (resid 41 and name HD#) 4.0 2.2 1.5	!#A 73  1.70e+05
assign (resid 38 and name HB) (resid 75 and name HB2) 4.0 2.2 1.0	!#A 1305  -2.92e+05
assign (resid 38 and name HD1#) (resid 75 and name HG#) 4.0 2.2 1.5	!#A 1765  1.53e+05
assign (resid 38 and name HB) (resid 75 and name HG#) 4.0 2.2 1.0	!#A 1300  4.75e+05
assign (resid 38 and name HD1#) (resid 77 and name HZ) 4.0 2.2 1.5	!#A 2557  -1.94e+05
assign (resid 38 and name HD1#) (resid 77 and name HE#) 4.0 2.2 1.5	!#A 2556  -1.89e+05
assign (resid 38 and name HB) (resid 77 and name HZ) 4.0 2.2 1.0	!#A 1908  -1.70e+05
assign (resid 38 and name HG1#) (resid 77 and name HZ) 4.0 2.2 1.5	!#A 442  1.89e+05
assign (resid 38 and name HG2#) (resid 77 and name HZ) 4.0 2.2 1.5	!#A 1618  -4.16e+05
assign (resid 38 and name HB) (resid 92 and name HB#) 4.0 2.2 1.5	!#A 1528  -3.25e+05
assign (resid 38 and name HD1#) (resid 92 and name HB#) 3.0 1.2 1.3	!#A 1548  1.19e+06
assign (resid 38 and name HD1#) (resid 92 and name HA) 3.0 1.2 0.8	!#A 1763  -6.06e+05
assign (resid 38 and name HG2#) (resid 92 and name HA) 4.0 2.2 1.5	!#A 1616  -3.46e+05
assign (resid 38 and name HA) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 722  -1.53e+05
assign (resid 38 and name HG1#) (resid 94 and name HE#) 4.0 2.2 1.5	!#A 1337  1.97e+05
assign (resid 38 and name HD1#) (resid 94 and name HD#) 4.0 2.2 1.5	!#A 1764  4.36e+05
assign (resid 38 and name HG2#) (resid 94 and name HB2) 4.0 2.2 1.5	!#A 1615  2.72e+05
assign (resid 38 and name HG2#) (resid 94 and name HB1) 4.0 2.2 1.5	!#A 1614  3.34e+05
assign (resid 38 and name HG2#) (resid 97 and name HD1#) 4.0 2.2 2.0	!#A 1617  2.83e+05

!K39
assign (resid 39 and name HD#) (resid 39 and name HA) 4.0 2.2 1.0	!#A 1404  5.43e+05
assign (resid 39 and name HB#) (resid 39 and name HA) 3.0 1.2 0.5	!#A 1872  6.87e+05
assign (resid 39 and name HD#) (resid 39 and name HB#) 3.0 1.2 0.5	!#A 2094  1.07e+06
assign (resid 39 and name HE#) (resid 39 and name HG#) 4.0 2.2 1.0	!#A 994  3.88e+05
assign (resid 39 and name HA) (resid 39 and name HG#) 4.0 2.2 1.0	!#A 554  2.92e+05
assign (resid 39 and name HE#) (resid 39 and name HG#) 4.0 2.2 1.0	!#A 995  3.59e+05
assign (resid 39 and name HG#) (resid 40 and name HD#) 4.0 2.2 1.0	!#A 1402  -1.83e+05
assign (resid 39 and name HA) (resid 40 and name HD#) 4.0 2.2 1.0	!#A 895  -1.77e+05
assign (resid 39 and name HB#) (resid 40 and name HD#) 4.0 2.2 1.0	!#A 1089  4.48e+05
assign (resid 39 and name HA) (resid 40 and name HG#) 4.0 2.2 1.3	!#A 1255  6.87e+05
assign (resid 39 and name HA) (resid 41 and name HD#) 4.0 2.2 2.0	!#A 552  1.73e+05
assign (resid 39 and name HA) (resid 42 and name HB2) 4.0 2.2 1.0	!#A 927  1.44e+05
assign (resid 39 and name HA) (resid 42 and name HB1) 4.0 2.2 1.0	!#A 847  2.50e+05
assign (resid 39 and name HA) (resid 42 and name HD#) 4.0 2.2 1.0	!#A 25  2.09e+05
assign (resid 39 and name HG#) (resid 43 and name HD#) 4.0 2.2 1.0	!#A 1405  -2.37e+05
assign (resid 39 and name HE#) (resid 43 and name HB#) 2.5 0.7 0.4	!#A 1231  2.06e+06
assign (resid 39 and name HD#) (resid 43 and name HD2) 4.0 2.2 2.3	!#A 69  2.42e+05

!P40
assign (resid 40 and name HD#) (resid 40 and name HA) 4.0 2.2 1.0	!#A 1093  2.09e+05
assign (resid 40 and name HA) (resid 40 and name HG#) 4.0 2.2 1.0	!#A 829  3.07e+05
assign (resid 40 and name HD#) (resid 40 and name HB2) 4.0 2.2 1.0	!#A 1088  4.09e+05
assign (resid 40 and name HG#) (resid 40 and name HB1) 2.5 0.7 0.4	!#A 1837  2.11e+06
assign (resid 40 and name HD#) (resid 40 and name HB1) 4.0 2.2 1.0	!#A 1087  2.50e+05
assign (resid 40 and name HA) (resid 40 and name HB1) 3.0 1.2 0.5	!#A 824  8.41e+05
assign (resid 40 and name HG#) (resid 40 and name HA) 4.0 2.2 1.0	!#A 1842  2.45e+05
assign (resid 40 and name HB2) (resid 40 and name HA) 3.0 1.2 0.5	!#A 1842  9.45e+05
assign (resid 40 and name HB2) (resid 40 and name HG1) 2.5 0.7 0.4	!#A 1839  3.29e+06
assign (resid 40 and name HB1) (resid 40 and name HG1) 2.5 0.7 0.4	!#A 1547  4.17e+06
assign (resid 40 and name HB2) (resid 40 and name HB1) 2.5 0.7 0.4	!#A 1272  2.11e+06
assign (resid 40 and name HB2) (resid 41 and name HD2) 4.0 2.2 1.0	!#A 1273  -2.08e+05
assign (resid 40 and name HB2) (resid 41 and name HA) 4.0 2.2 1.0	!#A 785  -1.51e+05
assign (resid 40 and name HB2) (resid 41 and name HB1) 4.0 2.2 1.5	!#A 1193  -1.74e+05
assign (resid 40 and name HG#) (resid 41 and name HE#) 4.0 2.2 1.0	!#A 1254  1.43e+05
assign (resid 40 and name HA) (resid 43 and name HB#) 4.0 2.2 1.0	!#A 1229  3.98e+05
assign (resid 40 and name HA) (resid 44 and name HA) 4.0 2.2 1.0	!#A 896  1.85e+05

!F41
assign (resid 41 and name HE#) (resid 41 and name HA) 4.0 2.2 1.0	!#A 4  1.93e+05
assign (resid 41 and name HD#) (resid 41 and name HA) 4.0 2.2 1.0	!#A 74  5.88e+05
assign (resid 41 and name HB1) (resid 41 and name HD#) 4.0 2.2 1.0	!#A 857  -3.71e+05
assign (resid 41 and name HB2) (resid 41 and name HD#) 4.0 2.2 1.0	!#A 914  -4.23e+05
assign (resid 41 and name HB2) (resid 41 and name HA) 4.0 2.2 1.0	!#A 915  3.54e+05
assign (resid 41 and name HB1) (resid 41 and name HA) 4.0 2.2 1.0	!#A 859  5.35e+05
assign (resid 41 and name HD#) (resid 42 and name HA) 4.0 2.2 1.8	!#A 79  2.43e+05
assign (resid 41 and name HA) (resid 44 and name HB#) 4.0 2.2 1.0	!#A 451  5.60e+05
assign (resid 41 and name HD#) (resid 45 and name HD2#) 4.0 2.2 1.5	!#A 2707  -3.10e+05
assign (resid 41 and name HD#) (resid 94 and name HG#) 4.0 2.2 1.0	!#A 1977  -3.10e+05
assign (resid 41 and name HD#) (resid 94 and name HD#) 4.0 2.2 1.5	!#A 76  2.43e+05
assign (resid 41 and name HE#) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 4  2.63e+05
assign (resid 41 and name HD#) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 2568  -2.58e+05
assign (resid 41 and name HE#) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 300  2.63e+05
assign (resid 41 and name HD#) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 389  2.43e+05
assign (resid 41 and name HB2) (resid 94 and name HA) 4.0 2.2 1.0	!#A 1136  -1.74e+05
assign (resid 41 and name HE#) (resid 94 and name HE#) 4.0 2.2 1.0	!#A 303  -2.29e+05
assign (resid 41 and name HD#) (resid 94 and name HE#) 4.0 2.2 1.0	!#A 1490  -1.54e+05
assign (resid 41 and name HD#) (resid 94 and name HB2) 4.0 2.2 1.0	!#A 2479  -2.87e+05
assign (resid 41 and name HE#) (resid 94 and name HB2) 4.0 2.2 1.0	!#A 2493  -1.99e+05
assign (resid 41 and name HB1) (resid 94 and name HE#) 4.0 2.2 1.0	!#A 858  -2.39e+05
assign (resid 41 and name HD#) (resid 94 and name HA) 4.0 2.2 1.0	!#A 835  -2.13e+05
assign (resid 41 and name HE#) (resid 94 and name HD#) 4.0 2.2 2.0	!#A 1772  -1.66e+05
assign (resid 41 and name HE#) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 1696  -1.99e+05
assign (resid 41 and name HB2) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 913  -1.42e+05
assign (resid 41 and name HB2) (resid 94 and name HD1) 4.0 2.2 1.5	!#A 912  -2.15e+05
assign (resid 41 and name HD#) (resid 95 and name HA) 4.0 2.2 1.0	!#A 397  1.86e+05
assign (resid 41 and name HD#) (resid 95 and name HG#) 4.0 2.2 1.0	!#A 1549  1.71e+05
assign (resid 41 and name HD#) (resid 97 and name HD1#) 4.0 2.2 1.0	!#A 395  6.65e+05

!F42
assign (resid 42 and name HB2) (resid 42 and name HD#) 4.0 2.2 1.0	!#A 923  -2.29e+05
assign (resid 42 and name HA) (resid 42 and name HD#) 4.0 2.2 1.0	!#A 681  -3.50e+05
assign (resid 42 and name HB1) (resid 42 and name HD#) 4.0 2.2 1.0	!#A 1171  -2.28e+05
assign (resid 42 and name HB2) (resid 42 and name HA) 4.0 2.2 1.0	!#A 926  3.77e+05
assign (resid 42 and name HB1) (resid 42 and name HA) 4.0 2.2 1.0	!#A 846  3.28e+05
assign (resid 42 and name HD#) (resid 43 and name HA) 4.0 2.2 1.0	!#A 27  1.80e+05
assign (resid 42 and name HD#) (resid 43 and name HD#) 4.0 2.2 2.3	!#A 330  -5.63e+05
assign (resid 42 and name HD#) (resid 43 and name HB#) 4.0 2.2 1.0	!#A 307  1.80e+05
assign (resid 42 and name HD#) (resid 45 and name HD1#) 4.0 2.2 1.5	!#A 333  5.47e+05
assign (resid 42 and name HA) (resid 45 and name HG) 4.0 2.2 1.0	!#A 1688  -1.53e+05
assign (resid 42 and name HA) (resid 45 and name HB1) 4.0 2.2 1.0	!#A 686  -1.79e+05
assign (resid 42 and name HA) (resid 45 and name HB2) 4.0 2.2 1.0	!#A 685  -2.01e+05
assign (resid 42 and name HA) (resid 45 and name HD1#) 3.0 1.2 0.8	!#A 683  6.42e+05
assign (resid 42 and name HD#) (resid 77 and name HE#) 4.0 2.2 1.0	!#A 125  -2.01e+05
assign (resid 42 and name HD#) (resid 77 and name HE#) 4.0 2.2 1.0	!#A 114  -2.16e+05
assign (resid 42 and name HD#) (resid 77 and name HD#) 4.0 2.2 1.0	!#A 332  -1.56e+05
assign (resid 42 and name HD#) (resid 77 and name HZ) 4.0 2.2 1.2	!#A 328  -1.92e+05
assign (resid 42 and name HB2) (resid 77 and name HE#) 4.0 2.2 1.0	!#A 1266  1.57e+05
assign (resid 42 and name HB2) (resid 94 and name HA) 4.0 2.2 1.2	!#A 1261  -3.42e+05
assign (resid 42 and name HD#) (resid 97 and name HD1#) 3.0 1.2 0.8	!#A 1791  -6.07e+05
assign (resid 42 and name HD#) (resid 97 and name HB1) 4.0 2.2 1.0	!#A 336  -1.73e+05
assign (resid 42 and name HD#) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 2665  -1.77e+05
assign (resid 42 and name HB2) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 925  -3.74e+05
assign (resid 42 and name HB2) (resid 97 and name HD1#) 4.0 2.2 1.5	!#A 924  2.08e+05
assign (resid 42 and name HA) (resid 97 and name HD1#) 4.0 2.2 1.5	!#A 684  3.29e+05

!H43
assign (resid 43 and name HD2) (resid 43 and name HA) 4.0 2.2 1.0	!#A 72  2.32e+05
assign (resid 43 and name HA) (resid 43 and name HB#) 4.0 2.2 1.0	!#A 788  4.19e+05
assign (resid 43 and name HD2) (resid 43 and name HB#) 4.0 2.2 1.0	!#A 70  1.72e+05
assign (resid 43 and name HD2) (resid 44 and name HA) 4.0 2.2 1.0	!#A 925  -1.50e+05
assign (resid 43 and name HE1) (resid 46 and name HB#) 4.0 2.2 1.2	!#A 996  1.67e+05
assign (resid 43 and name HA) (resid 46 and name HB#) 4.0 2.2 1.0	!#A 1001  1.56e+05

!S44
assign (resid 44 and name HA) (resid 44 and name HB#) 4.0 2.2 1.0	!#A 586  2.55e+05
assign (resid 44 and name HA) (resid 47 and name HB2) 4.0 2.2 1.0	!#A 1268  3.43e+05
assign (resid 44 and name HA) (resid 47 and name HG#) 4.0 2.2 1.0	!#A 587  -1.54e+05

!L45
assign (resid 45 and name HB2) (resid 45 and name HD2#) 3.0 1.2 0.8	!#A 1481  2.51e+06
assign (resid 45 and name HA) (resid 45 and name HB1) 4.0 2.2 1.0	!#A 765  -2.73e+05
assign (resid 45 and name HG) (resid 45 and name HB2) 4.0 2.2 1.0	!#A 1689  -4.00e+05
assign (resid 45 and name HA) (resid 45 and name HB2) 4.0 2.2 1.0	!#A 764  -2.89e+05
assign (resid 45 and name HA) (resid 45 and name HD2#) 2.5 0.7 0.7	!#A 763  1.73e+06
assign (resid 45 and name HB1) (resid 45 and name HD2#) 3.0 1.2 0.8	!#A 1693  7.47e+05
assign (resid 45 and name HB1) (resid 45 and name HD1#) 2.5 0.7 0.7	!#A 1692  2.15e+06
assign (resid 45 and name HB2) (resid 45 and name HD1#) 3.0 1.2 0.8	!#A 1498  1.29e+06
assign (resid 45 and name HA) (resid 45 and name HD1#) 4.0 2.2 1.5	!#A 761  5.49e+05
assign (resid 45 and name HA) (resid 47 and name HB2) 4.0 2.2 1.2	!#A 1298  -1.88e+05
assign (resid 45 and name HA) (resid 48 and name HA) 4.0 2.2 1.0	!#A 981  3.06e+05
assign (resid 45 and name HA) (resid 48 and name HB1) 4.0 2.2 1.0	!#A 767  -2.57e+05
assign (resid 45 and name HA) (resid 48 and name HB2) 4.0 2.2 1.0	!#A 1417  4.12e+05
assign (resid 45 and name HA) (resid 48 and name HG#) 4.0 2.2 1.0	!#A 2037  -1.77e+05
assign (resid 45 and name HD2#) (resid 48 and name HD#) 4.0 2.2 1.5	!#A 1925  2.02e+05
assign (resid 45 and name HA) (resid 48 and name HD#) 4.0 2.2 1.0	!#A 759  1.51e+05
assign (resid 45 and name HB1) (resid 49 and name HE#) 4.0 2.2 1.0	!#A 1685  -2.90e+05
assign (resid 45 and name HD2#) (resid 49 and name HE#) 2.5 0.7 0.7	!#A 140  1.63e+06
assign (resid 45 and name HB1) (resid 49 and name HD#) 4.0 2.2 1.0	!#A 1679  -3.86e+05
assign (resid 45 and name HA) (resid 49 and name HE#) 4.0 2.2 1.0	!#A 155  1.51e+05
assign (resid 45 and name HD2#) (resid 49 and name HD#) 3.0 1.2 0.8	!#A 64  1.03e+06
assign (resid 45 and name HD1#) (resid 49 and name HB#) 4.0 2.2 1.7	!#A 941  -1.78e+05
assign (resid 45 and name HD1#) (resid 49 and name HE#) 4.0 2.2 1.5	!#A 149  3.95e+05
assign (resid 45 and name HD1#) (resid 49 and name HD#) 4.0 2.2 1.5	!#A 60  2.47e+05
assign (resid 45 and name HA) (resid 49 and name HD1) 4.0 2.2 1.0	!#A 760  -3.18e+05
assign (resid 45 and name HB1) (resid 52 and name HG2#) 4.0 2.2 2.5	!#A 2489  2.78e+05
assign (resid 45 and name HB1) (resid 54 and name HE#) 4.0 2.2 1.0	!#A 102  -1.48e+05
assign (resid 45 and name HD1#) (resid 54 and name HE#) 4.0 2.2 1.5	!#A 1896  -2.45e+05
assign (resid 45 and name HB2) (resid 54 and name HZ) 4.0 2.2 1.0	!#A 521  -1.54e+05
assign (resid 45 and name HB1) (resid 54 and name HZ) 4.0 2.2 1.0	!#A 195  -1.66e+05
assign (resid 45 and name HD1#) (resid 54 and name HZ) 4.0 2.2 1.5	!#A 192  1.81e+05
assign (resid 45 and name HD1#) (resid 98 and name HA) 4.0 2.2 1.5	!#A 1886  3.34e+05
assign (resid 45 and name HD1#) (resid 98 and name HB#) 4.0 2.2 1.5	!#A 1632  3.66e+05
assign (resid 45 and name HD2#) (resid 98 and name HG1) 4.0 2.2 1.5	!#A 2685  -2.30e+05
assign (resid 45 and name HD2#) (resid 101 and name HD1#) 3.0 1.2 2.2	!#A 1904  6.64e+05
assign (resid 45 and name HD1#) (resid 101 and name HB) 4.0 2.2 1.5	!#A 2060  -2.23e+05
assign (resid 45 and name HB1) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 1694  -1.67e+05
assign (resid 45 and name HG) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 1691  1.94e+05
assign (resid 45 and name HD1#) (resid 101 and name HD1#) 2.5 0.7 1.2	!#A 1864  3.23e+06

!S46
assign (resid 46 and name HB#) (resid 46 and name HA) 3.0 1.2 0.5	!#A 1000  7.44e+05
assign (resid 46 and name HB#) (resid 47 and name HA) 4.0 2.2 1.0	!#A 1394  -2.65e+05
assign (resid 46 and name HB#) (resid 54 and name HE#) 4.0 2.2 1.2	!#A 1389  -1.44e+05
assign (resid 46 and name HA) (resid 54 and name HD#) 4.0 2.2 1.0	!#A 210  2.31e+05
assign (resid 46 and name HA) (resid 54 and name HZ) 4.0 2.2 1.0	!#A 911  -1.60e+05
assign (resid 46 and name HA) (resid 54 and name HE#) 4.0 2.2 1.0	!#A 910  -2.92e+05

!E47
assign (resid 47 and name HB#) (resid 47 and name HA) 3.0 1.2 0.5	!#A 1269  1.05e+06
assign (resid 47 and name HA) (resid 47 and name HB1) 3.0 1.2 0.5	!#A 589  9.35e+05
assign (resid 47 and name HG#) (resid 47 and name HA) 3.0 1.2 0.5	!#A 1238  1.15e+06
assign (resid 47 and name HB2) (resid 48 and name HB2) 4.0 2.2 1.0	!#A 1932  -5.92e+05
assign (resid 47 and name HA) (resid 50 and name HB2) 3.0 1.2 0.9	!#A 627  1.11e+07

!K48
assign (resid 48 and name HE#) (resid 48 and name HG#) 4.0 2.2 1.0	!#A 1008  5.29e+05
assign (resid 48 and name HA) (resid 48 and name HB1) 4.0 2.2 1.0	!#A 648  -5.16e+05
assign (resid 48 and name HE#) (resid 48 and name HB2) 4.0 2.2 1.0	!#A 1010  -1.65e+05
assign (resid 48 and name HG#) (resid 48 and name HA) 3.0 1.2 0.5	!#A 1683  7.85e+05
assign (resid 48 and name HB2) (resid 48 and name HA) 3.0 1.2 0.5	!#A 1416  1.20e+06
assign (resid 48 and name HG#) (resid 48 and name HE#) 3.0 1.2 0.5	!#A 1682  -7.30e+05
assign (resid 48 and name HB1) (resid 48 and name HE#) 4.0 2.2 1.0	!#A 1471  -2.14e+05
assign (resid 48 and name HG#) (resid 48 and name HE#) 3.0 1.2 0.5	!#A 2035  -6.90e+05
assign (resid 48 and name HG#) (resid 48 and name HE#) 3.0 1.2 0.5	!#A 1681  -8.15e+05
assign (resid 48 and name HB2) (resid 48 and name HG#) 4.0 2.2 1.0	!#A 1415  2.94e+05
assign (resid 48 and name HB1) (resid 48 and name HG#) 4.0 2.2 1.0	!#A 1469  4.59e+05
assign (resid 48 and name HA) (resid 48 and name HG#) 4.0 2.2 1.0	!#A 646  2.82e+05
assign (resid 48 and name HA) (resid 48 and name HD1) 4.0 2.2 1.0	!#A 643  2.69e+05
assign (resid 48 and name HB1) (resid 48 and name HD#) 3.0 1.2 0.5	!#A 1466  2.61e+06
assign (resid 48 and name HB2) (resid 48 and name HD#) 3.0 1.2 0.5	!#A 1412  6.65e+05
assign (resid 48 and name HA) (resid 48 and name HD#) 4.0 2.2 1.0	!#A 644  1.89e+05
assign (resid 48 and name HB1) (resid 49 and name HD#) 4.0 2.2 1.0	!#A 1467  -3.43e+05
assign (resid 48 and name HD#) (resid 49 and name HD#) 4.0 2.2 1.0	!#A 1467  -3.43e+05
assign (resid 48 and name HB1) (resid 49 and name HB#) 4.0 2.2 1.0	!#A 1301  1.74e+05
assign (resid 48 and name HB2) (resid 49 and name HE#) 4.0 2.2 1.0	!#A 157  -1.53e+05
assign (resid 48 and name HE#) (resid 49 and name HE#) 4.0 2.2 1.0	!#A 153  -2.44e+05
assign (resid 48 and name HE#) (resid 49 and name HE#) 4.0 2.2 1.0	!#A 152  -1.96e+05
assign (resid 48 and name HG#) (resid 49 and name HD#) 4.0 2.2 1.0	!#A 63  1.83e+05
assign (resid 48 and name HG#) (resid 49 and name HB#) 4.0 2.2 1.0	!#A 943  -1.71e+05
assign (resid 48 and name HG#) (resid 49 and name HE#) 4.0 2.2 1.0	!#A 150  1.85e+05
assign (resid 48 and name HG#) (resid 49 and name HD#) 4.0 2.2 1.0	!#A 62  1.48e+05
assign (resid 48 and name HB#) (resid 49 and name HD#) 4.0 2.2 1.0	!#A 1413  1.61e+05
assign (resid 48 and name HD#) (resid 49 and name HD#) 4.0 2.2 1.0	!#A 58  1.65e+05
assign (resid 48 and name HD#) (resid 49 and name HE#) 4.0 2.2 1.0	!#A 146  2.53e+05
assign (resid 48 and name HA) (resid 50 and name HB1) 4.0 2.2 2.0	!#A 1056  3.21e+05
assign (resid 48 and name HB1) (resid 54 and name HZ) 4.0 2.2 1.0	!#A 200  -1.77e+05

!Y49
assign (resid 49 and name HB#) (resid 49 and name HE#) 4.0 2.2 1.0	!#A 948  -2.19e+05
assign (resid 49 and name HA) (resid 49 and name HE#) 4.0 2.2 1.0	!#A 356  -2.19e+05
assign (resid 49 and name HD#) (resid 49 and name HB#) 4.0 2.2 1.0	!#A 54  -3.49e+05
assign (resid 49 and name HB#) (resid 49 and name HD#) 3.0 1.2 0.5	!#A 938  -1.00e+06
assign (resid 49 and name HA) (resid 49 and name HD#) 3.0 1.2 0.5	!#A 352  -7.50e+05
assign (resid 49 and name HB#) (resid 49 and name HA) 3.0 1.2 0.5	!#A 947  9.00e+05
assign (resid 49 and name HA) (resid 50 and name HA) 4.0 2.2 1.0	!#A 471  -2.46e+05
assign (resid 49 and name HB#) (resid 52 and name HB) 4.0 2.2 1.0	!#A 1230  -2.88e+05
assign (resid 49 and name HB#) (resid 52 and name HG1#) 4.0 2.2 1.5	!#A 945  2.90e+05
assign (resid 49 and name HB#) (resid 52 and name HG2#) 3.0 1.2 0.8	!#A 944  1.11e+06
assign (resid 49 and name HE#) (resid 52 and name HG2#) 4.0 2.2 1.5	!#A 142  2.26e+05
assign (resid 49 and name HD#) (resid 52 and name HG2#) 4.0 2.2 1.5	!#A 51  4.42e+05
assign (resid 49 and name HA) (resid 52 and name HG2#) 4.0 2.2 1.5	!#A 354  3.61e+05
assign (resid 49 and name HE#) (resid 54 and name HZ) 4.0 2.2 1.0	!#A 523  -9.58e+05
assign (resid 49 and name HD#) (resid 54 and name HE#) 4.0 2.2 1.0	!#A 423  -4.40e+05
assign (resid 49 and name HA) (resid 54 and name HE#) 4.0 2.2 1.0	!#A 421  2.17e+05
assign (resid 49 and name HB#) (resid 54 and name HZ) 4.0 2.2 1.0	!#A 942  -2.49e+05
assign (resid 49 and name HB#) (resid 54 and name HE#) 4.0 2.2 1.0	!#A 940  -3.04e+05
assign (resid 49 and name HD#) (resid 54 and name HE#) 4.0 2.2 1.0	!#A 106  -4.40e+05
assign (resid 49 and name HD#) (resid 54 and name HZ) 4.0 2.2 1.0	!#A 190  -4.90e+05
assign (resid 49 and name HE#) (resid 98 and name HG#) 4.0 2.2 1.0	!#A 1078  -1.46e+05
assign (resid 49 and name HE#) (resid 101 and name HG2#) 4.0 2.2 1.5	!#A 144  4.70e+05
assign (resid 49 and name HD#) (resid 101 and name HG2#) 4.0 2.2 1.5	!#A 55  5.75e+05
assign (resid 49 and name HD#) (resid 101 and name HG2#) 4.0 2.2 1.5	!#A 2094  -4.09e+05
assign (resid 49 and name HE#) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 156  2.26e+05
assign (resid 49 and name HD1) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 66  2.47e+05
assign (resid 49 and name HB#) (resid 101 and name HG2#) 4.0 2.2 1.5	!#A 946  2.33e+05
assign (resid 49 and name HE#) (resid 105 and name HG2#) 4.0 2.2 1.5	!#A 143  2.90e+05
assign (resid 49 and name HD#) (resid 105 and name HG2#) 4.0 2.2 1.5	!#A 1738  -2.90e+05

!S50
assign (resid 50 and name HA) (resid 50 and name HB1) 2.5 0.7 0.4	!#A 470  2.31e+06
assign (resid 50 and name HA) (resid 50 and name HB2) 2.5 0.7 0.4	!#A 469  2.62e+06

!N51
assign (resid 51 and name HA) (resid 51 and name HB2) 2.5 0.7 0.4	!#A 351  -1.53e+06
assign (resid 51 and name HA) (resid 51 and name HB1) 2.5 0.7 0.5	!#A 350  -1.46e+06
assign (resid 51 and name HB1) (resid 52 and name HB) 4.0 2.2 1.0	!#A 1782  -2.11e+05
assign (resid 51 and name HA) (resid 52 and name HG2#) 4.0 2.2 1.5	!#A 2575  -2.73e+05
assign (resid 51 and name HB2) (resid 52 and name HG2#) 4.0 2.2 1.6	!#A 1785  -2.27e+05
assign (resid 51 and name HA) (resid 52 and name HA) 3.0 1.2 1.5	!#A 348  8.97e+05
assign (resid 51 and name HA) (resid 53 and name HD1#) 4.0 2.2 1.5	!#A 317  2.04e+05
assign (resid 51 and name HB1) (resid 105 and name HG2#) 4.0 2.2 1.5	!#A 972  3.80e+05

!V52
assign (resid 52 and name HB) (resid 52 and name HA) 4.0 2.2 1.0	!#A 1228  1.83e+05
assign (resid 52 and name HA) (resid 52 and name HG1#) 3.0 1.2 0.8	!#A 462  1.02e+06
assign (resid 52 and name HA) (resid 52 and name HG2#) 2.5 0.7 0.7	!#A 461  1.71e+06
assign (resid 52 and name HA) (resid 53 and name HB) 4.0 2.2 1.0	!#A 1312  3.30e+05
assign (resid 52 and name HG1#) (resid 53 and name HG1#) 4.0 2.2 1.5	!#A 2399  -1.77e+05
assign (resid 52 and name HA) (resid 53 and name HD1#) 4.0 2.2 1.5	!#A 465  3.45e+05
assign (resid 52 and name HA) (resid 53 and name HG1#) 4.0 2.2 1.3	!#A 459  1.66e+05
assign (resid 52 and name HG1#) (resid 54 and name HD#) 4.0 2.2 1.5	!#A 201  2.43e+05
assign (resid 52 and name HG2#) (resid 54 and name HE#) 4.0 2.2 1.5	!#A 98  4.35e+05
assign (resid 52 and name HB) (resid 54 and name HE#) 4.0 2.2 1.0	!#A 1226  -3.58e+05
assign (resid 52 and name HG1#) (resid 54 and name HE#) 4.0 2.2 1.5	!#A 2083  -2.22e+05
assign (resid 52 and name HG1#) (resid 54 and name HZ) 4.0 2.2 1.5	!#A 194  2.20e+05
assign (resid 52 and name HG2#) (resid 54 and name HZ) 4.0 2.2 1.5	!#A 193  2.56e+05
assign (resid 52 and name HB) (resid 54 and name HZ) 4.0 2.2 1.0	!#A 1227  -1.56e+05
assign (resid 52 and name HB) (resid 54 and name HD#) 4.0 2.2 1.0	!#A 1225  -1.45e+05
assign (resid 52 and name HA) (resid 101 and name HG2#) 4.0 2.2 1.7	!#A 800  1.84e+05
assign (resid 52 and name HB) (resid 101 and name HG2#) 4.0 2.2 1.8	!#A 2107  -3.40e+05
assign (resid 52 and name HB) (resid 101 and name HD1#) 4.0 2.2 2.0	!#A 1231  1.18e+06
assign (resid 52 and name HG1#) (resid 101 and name HG2#) 2.5 0.7 1.5	!#A 2099  1.17e+07
assign (resid 52 and name HG2#) (resid 101 and name HG2#) 2.5 0.7 1.2	!#A 2098  2.92e+06
assign (resid 52 and name HG2#) (resid 105 and name HG2#) 4.0 2.2 2.0	!#A 2530  4.29e+05
assign (resid 52 and name HG2#) (resid 105 and name HB) 4.0 2.2 1.5	!#A 1198  1.58e+05
assign (resid 52 and name HG2#) (resid 105 and name HA) 4.0 2.2 1.5	!#A 772  2.65e+05

!I53
assign (resid 53 and name HA) (resid 53 and name HD1#) 2.5 0.7 0.7	!#A 502  1.53e+06
assign (resid 53 and name HA) (resid 53 and name HG2#) 2.5 0.7 0.7	!#A 501  1.50e+06
assign (resid 53 and name HD1#) (resid 53 and name HB) 3.0 1.2 0.8	!#A 1827  -1.48e+06
assign (resid 53 and name HB) (resid 53 and name HA) 4.0 2.2 1.0	!#A 1342  3.10e+05
assign (resid 53 and name HA) (resid 53 and name HG1#) 4.0 2.2 1.0	!#A 497  4.39e+05
assign (resid 53 and name HG2#) (resid 54 and name HA) 4.0 2.2 1.5	!#A 585  1.73e+05
assign (resid 53 and name HG2#) (resid 54 and name HB2) 4.0 2.2 1.7	!#A 1006  -1.96e+05
assign (resid 53 and name HA) (resid 54 and name HD1) 4.0 2.2 1.0	!#A 209  1.93e+05
assign (resid 53 and name HG2#) (resid 55 and name HG) 4.0 2.2 1.5	!#A 1829  2.12e+05
assign (resid 53 and name HA) (resid 55 and name HD1#) 4.0 2.2 1.5	!#A 839  1.85e+05
assign (resid 53 and name HG2#) (resid 55 and name HA) 4.0 2.2 1.5	!#A 248  1.43e+05
assign (resid 53 and name HG2#) (resid 55 and name HD1#) 2.5 0.7 1.2	!#A 1880  3.17e+07

!F54
assign (resid 54 and name HD#) (resid 54 and name HB2) 4.0 2.2 1.0	!#A 204  -2.33e+05
assign (resid 54 and name HB2) (resid 54 and name HD#) 4.0 2.2 1.0	!#A 1004  -2.91e+05
assign (resid 54 and name HB1) (resid 54 and name HD#) 4.0 2.2 1.0	!#A 1109  -2.44e+05
assign (resid 54 and name HA) (resid 54 and name HD2) 4.0 2.2 1.0	!#A 256  -1.42e+05
assign (resid 54 and name HB2) (resid 54 and name HE#) 4.0 2.2 1.0	!#A 1407  -1.56e+05
assign (resid 54 and name HZ) (resid 54 and name HD#) 4.0 2.2 1.0	!#A 518  -4.06e+05
assign (resid 54 and name HB2) (resid 54 and name HA) 4.0 2.2 1.0	!#A 1007  1.89e+05
assign (resid 54 and name HA) (resid 54 and name HB1) 4.0 2.2 1.0	!#A 261  -1.70e+05
assign (resid 54 and name HZ) (resid 54 and name HE2) 4.0 2.2 1.0	!#A 191  -5.56e+05
assign (resid 54 and name HA) (resid 55 and name HD1#) 4.0 2.2 1.5	!#A 257  1.47e+05
assign (resid 54 and name HE#) (resid 101 and name HG2#) 4.0 2.2 1.5	!#A 95  2.95e+05
assign (resid 54 and name HE#) (resid 101 and name HG1#) 4.0 2.2 1.5	!#A 2667  -1.56e+05
assign (resid 54 and name HD#) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 206  1.76e+05
assign (resid 54 and name HZ) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 198  4.61e+05
assign (resid 54 and name HE#) (resid 101 and name HD1#) 3.0 1.2 0.8	!#A 104  6.54e+05
assign (resid 54 and name HZ) (resid 101 and name HG2#) 4.0 2.2 1.5	!#A 197  2.51e+05
assign (resid 54 and name HE#) (resid 101 and name HB) 4.0 2.2 1.5	!#A 103  -1.64e+05

!L55
assign (resid 55 and name HD2#) (resid 55 and name HB1) 4.0 2.2 1.5	!#A 2014  -2.58e+05
assign (resid 55 and name HD1#) (resid 55 and name HB2) 4.0 2.2 1.5	!#A 1876  -2.73e+05
assign (resid 55 and name HD1#) (resid 55 and name HB1) 4.0 2.2 1.5	!#A 1877  -3.89e+05
assign (resid 55 and name HB2) (resid 55 and name HD2#) 3.0 1.2 0.8	!#A 1397  1.12e+06
assign (resid 55 and name HA) (resid 55 and name HD2#) 4.0 2.2 1.5	!#A 243  3.44e+05
assign (resid 55 and name HD1#) (resid 55 and name HA) 3.0 1.2 0.8	!#A 1874  -9.73e+05
assign (resid 55 and name HB1) (resid 55 and name HA) 4.0 2.2 1.0	!#A 1625  -2.98e+05
assign (resid 55 and name HG) (resid 55 and name HA) 4.0 2.2 1.0	!#A 1496  -1.64e+05
assign (resid 55 and name HB2) (resid 55 and name HA) 4.0 2.2 1.0	!#A 1393  -1.86e+05
assign (resid 55 and name HA) (resid 56 and name HB#) 4.0 2.2 1.0	!#A 250  -1.41e+05
assign (resid 55 and name HB1) (resid 57 and name HA) 4.0 2.2 1.2	!#A 976  2.04e+05
assign (resid 55 and name HD2#) (resid 57 and name HG2#) 4.0 2.2 2.0	!#A 2114  -3.82e+05

!E56
assign (resid 56 and name HB#) (resid 56 and name HA) 3.0 1.2 0.5	!#A 1353  6.11e+05
assign (resid 56 and name HA) (resid 56 and name HG1) 4.0 2.2 1.0	!#A 299  -2.32e+05
assign (resid 56 and name HB#) (resid 57 and name HA) 4.0 2.2 1.0	!#A 642  -1.62e+05
assign (resid 56 and name HA) (resid 57 and name HB) 4.0 2.2 1.2	!#A 301  -2.07e+05
assign (resid 56 and name HG#) (resid 57 and name HA) 4.0 2.2 1.0	!#A 639  -1.73e+05
assign (resid 56 and name HA) (resid 57 and name HA) 4.0 2.2 1.0	!#A 297  1.62e+05
assign (resid 56 and name HA) (resid 57 and name HG2#) 4.0 2.2 1.5	!#A 296  2.24e+05

!V57
assign (resid 57 and name HG1#) (resid 57 and name HB) 4.0 2.2 1.5	!#A 2007  -2.61e+05
assign (resid 57 and name HG1#) (resid 57 and name HA) 4.0 2.2 1.5	!#A 2005  4.94e+05
assign (resid 57 and name HB) (resid 57 and name HA) 4.0 2.2 1.0	!#A 1676  1.98e+05
assign (resid 57 and name HB) (resid 57 and name HG2#) 3.0 1.2 0.8	!#A 1675  1.22e+06
assign (resid 57 and name HA) (resid 57 and name HG2#) 3.0 1.2 0.8	!#A 637  1.06e+06
assign (resid 57 and name HG1#) (resid 59 and name HA) 4.0 2.2 1.5	!#A 898  -2.46e+05
assign (resid 57 and name HG2#) (resid 62 and name HB#) 4.0 2.2 2.0	!#A 2118  3.13e+05
assign (resid 57 and name HA) (resid 62 and name HB#) 4.0 2.2 1.5	!#A 638  2.60e+05
assign (resid 57 and name HG1#) (resid 62 and name HB#) 2.5 0.7 1.2	!#A 2006  2.00e+06
assign (resid 57 and name HG1#) (resid 62 and name HA) 4.0 2.2 1.5	!#A 2002  -2.13e+05
assign (resid 57 and name HG1#) (resid 65 and name HB) 2.5 0.7 0.7	!#A 1863  1.68e+06
assign (resid 57 and name HG1#) (resid 65 and name HG1#) 4.0 2.2 2.0	!#A 2705  3.84e+05
assign (resid 57 and name HG2#) (resid 65 and name HG1#) 3.0 1.2 1.3	!#A 2115  7.24e+05
assign (resid 57 and name HG1#) (resid 66 and name HA) 4.0 2.2 1.5	!#A 2008  1.97e+05

!D58
assign (resid 58 and name HB2) (resid 58 and name HA) 4.0 2.2 1.0	!#A 1154  -4.37e+05
assign (resid 58 and name HB1) (resid 58 and name HA) 4.0 2.2 1.0	!#A 1003  -3.40e+05
assign (resid 58 and name HA) (resid 59 and name HG2#) 4.0 2.2 1.5	!#A 359  -2.23e+05
assign (resid 58 and name HA) (resid 60 and name HB1) 4.0 2.2 2.3	!#A 679  -3.19e+05
assign (resid 58 and name HB2) (resid 61 and name HB1) 4.0 2.2 1.0	!#A 1450  -2.46e+05
assign (resid 58 and name HB2) (resid 61 and name HB2) 4.0 2.2 1.0	!#A 1657  -1.80e+05
assign (resid 58 and name HA) (resid 61 and name HB2) 4.0 2.2 1.0	!#A 679  -3.19e+05
assign (resid 58 and name HB1) (resid 61 and name HB2) 2.5 0.7 0.4	!#A 1399  -1.97e+06
assign (resid 58 and name HB2) (resid 62 and name HB#) 4.0 2.2 1.5	!#A 1660  2.86e+05
assign (resid 58 and name HA) (resid 62 and name HB#) 4.0 2.2 1.5	!#A 2449  2.09e+05

!V59
assign (resid 59 and name HG2#) (resid 59 and name HA) 4.0 2.2 1.5	!#A 2079  5.14e+05
assign (resid 59 and name HG1#) (resid 59 and name HA) 4.0 2.2 1.5	!#A 1706  4.45e+05
assign (resid 59 and name HG2#) (resid 59 and name HB) 4.0 2.2 1.5	!#A 2078  -1.43e+05
assign (resid 59 and name HG1#) (resid 59 and name HB) 4.0 2.2 1.5	!#A 1705  2.15e+05
assign (resid 59 and name HA) (resid 59 and name HB) 4.0 2.2 1.0	!#A 895  -1.62e+05
assign (resid 59 and name HG2#) (resid 60 and name HB2) 4.0 2.2 1.5	!#A 1375  1.66e+05
assign (resid 59 and name HB) (resid 60 and name HA) 4.0 2.2 1.0	!#A 1461  -1.52e+05
assign (resid 59 and name HG2#) (resid 60 and name HA) 4.0 2.2 1.5	!#A 327  1.76e+05
assign (resid 59 and name HA) (resid 63 and name HB#) 4.0 2.2 1.0	!#A 1236  -2.82e+05
assign (resid 59 and name HG1#) (resid 63 and name HA) 4.0 2.2 1.5	!#A 1708  -1.71e+05
assign (resid 59 and name HB) (resid 63 and name HA) 4.0 2.2 1.0	!#A 1460  -1.43e+05
assign (resid 59 and name HA) (resid 63 and name HG#) 4.0 2.2 1.5	!#A 1124  -1.78e+05
assign (resid 59 and name HA) (resid 65 and name HB) 4.0 2.2 1.0	!#A 1860  -1.72e+05
assign (resid 59 and name HG2#) (resid 66 and name HB#) 4.0 2.2 2.0	!#A 2082  -1.72e+05
assign (resid 59 and name HG1#) (resid 66 and name HB#) 4.0 2.2 2.0	!#A 1707  4.37e+05
assign (resid 59 and name HA) (resid 66 and name HB#) 4.0 2.2 1.5	!#A 901  -2.11e+05
assign (resid 59 and name HA) (resid 66 and name HA) 4.0 2.2 1.0	!#A 779  1.47e+05
assign (resid 59 and name HG1#) (resid 71 and name HG1#) 4.0 2.2 2.0	!#A 1649  2.31e+05
assign (resid 59 and name HG1#) (resid 71 and name HB) 4.0 2.2 1.5	!#A 1704  2.05e+05
assign (resid 59 and name HG2#) (resid 74 and name HG2#) 3.0 1.2 1.3	!#A 1996  8.03e+05

!D60
assign (resid 60 and name HA) (resid 60 and name HB1) 4.0 2.2 1.0	!#A 328  -2.94e+05
assign (resid 60 and name HA) (resid 60 and name HB2) 4.0 2.2 1.0	!#A 329  -4.35e+05
assign (resid 60 and name HA) (resid 63 and name HB#) 4.0 2.2 1.0	!#A 1221  -1.43e+05
assign (resid 60 and name HA) (resid 63 and name HA) 4.0 2.2 1.0	!#A 331  -1.48e+05

!D61
assign (resid 61 and name HA) (resid 61 and name HB1) 4.0 2.2 1.0	!#A 399  -4.89e+05
assign (resid 61 and name HA) (resid 61 and name HB2) 3.0 1.2 0.5	!#A 398  -6.42e+05
assign (resid 61 and name HA) (resid 62 and name HA) 4.0 2.2 1.0	!#A 307  -3.64e+05
assign (resid 61 and name HB1) (resid 62 and name HB#) 4.0 2.2 1.5	!#A 1035  -1.47e+05
assign (resid 61 and name HB2) (resid 62 and name HB#) 4.0 2.2 1.5	!#A 1665  -1.52e+05
assign (resid 61 and name HA) (resid 63 and name HG#) 4.0 2.2 1.2	!#A 400  -1.50e+05

!A62
assign (resid 62 and name HA) (resid 63 and name HG#) 4.0 2.2 1.0	!#A 1123  1.53e+05
assign (resid 62 and name HB#) (resid 65 and name HG2#) 4.0 2.2 2.0	!#A 2452  4.31e+05
assign (resid 62 and name HB#) (resid 65 and name HG1#) 4.0 2.2 2.0	!#A 1663  3.60e+05
assign (resid 62 and name HA) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 1946  -2.55e+05
assign (resid 62 and name HB#) (resid 65 and name HB) 4.0 2.2 1.5	!#A 1660  3.96e+05

!Q63
assign (resid 63 and name HB#) (resid 63 and name HA) 2.5 0.7 0.4	!#A 1219  2.42e+06
assign (resid 63 and name HG#) (resid 63 and name HA) 3.0 1.2 0.5	!#A 1126  6.45e+05
assign (resid 63 and name HB#) (resid 64 and name HA) 4.0 2.2 1.0	!#A 1220  1.42e+05
assign (resid 63 and name HG#) (resid 64 and name HA) 4.0 2.2 1.3	!#A 1127  -1.55e+05
assign (resid 63 and name HA) (resid 64 and name HA) 4.0 2.2 1.0	!#A 506  1.67e+05
assign (resid 63 and name HA) (resid 66 and name HB#) 4.0 2.2 1.5	!#A 1537  2.97e+05

!D64
assign (resid 64 and name HB1) (resid 64 and name HA) 3.0 1.2 0.7	!#A 998  1.28e+06
assign (resid 64 and name HA) (resid 64 and name HB2) 3.0 1.2 0.5	!#A 505  -9.07e+05
assign (resid 64 and name HB1) (resid 65 and name HA) 4.0 2.2 1.5	!#A 870  1.78e+05
assign (resid 64 and name HB2) (resid 65 and name HG2#) 4.0 2.2 1.5	!#A 1046  -4.43e+05
assign (resid 64 and name HA) (resid 67 and name HB#) 4.0 2.2 1.0	!#A 2  5.27e+05
assign (resid 64 and name HB2) (resid 68 and name HB#) 4.0 2.2 1.1	!#A 1218  -1.82e+05

!V65
assign (resid 65 and name HG2#) (resid 65 and name HA) 3.0 1.2 0.8	!#A 1950  1.28e+06
assign (resid 65 and name HA) (resid 65 and name HB) 4.0 2.2 1.0	!#A 860  2.19e+05
assign (resid 65 and name HG1#) (resid 66 and name HA) 4.0 2.2 1.5	!#A 780  1.91e+05
assign (resid 65 and name HA) (resid 66 and name HB#) 4.0 2.2 2.0	!#A 1530  2.10e+05
assign (resid 65 and name HA) (resid 68 and name HG#) 4.0 2.2 1.0	!#A 1080  -1.82e+05
assign (resid 65 and name HG1#) (resid 68 and name HB#) 4.0 2.2 1.5	!#A 2047  1.68e+05
assign (resid 65 and name HA) (resid 68 and name HB#) 4.0 2.2 1.0	!#A 862  4.30e+05
assign (resid 65 and name HG1#) (resid 69 and name HB#) 4.0 2.2 2.0	!#A 1636  3.10e+05

!A66
assign (resid 66 and name HA) (resid 69 and name HB#) 3.0 1.2 0.8	!#A 782  9.57e+05
assign (resid 66 and name HB#) (resid 69 and name HB#) 4.0 2.2 2.0	!#A 1533  5.20e+05
assign (resid 66 and name HB#) (resid 71 and name HG2#) 4.0 2.2 2.0	!#A 2163  2.33e+05

!S67
assign (resid 67 and name HA) (resid 67 and name HB#) 3.0 1.2 0.5	!#A 1  1.19e+06

!E68
assign (resid 68 and name HB#) (resid 68 and name HA) 2.5 0.7 0.4	!#A 1219  2.42e+06
assign (resid 68 and name HG#) (resid 68 and name HA) 4.0 2.2 1.0	!#A 1082  5.49e+05
assign (resid 68 and name HB#) (resid 69 and name HB#) 4.0 2.2 1.5	!#A 1632  1.63e+05
assign (resid 68 and name HB#) (resid 69 and name HA) 4.0 2.2 1.0	!#A 1214  -2.51e+05

!A69
assign (resid 69 and name HA) (resid 70 and name HB2) 4.0 2.2 1.0	!#A 1699  -2.51e+05
assign (resid 69 and name HB#) (resid 71 and name HA) 4.0 2.2 1.5	!#A 844  1.69e+05
assign (resid 69 and name HA) (resid 71 and name HG2#) 4.0 2.2 1.5	!#A 467  2.36e+05
assign (resid 69 and name HB#) (resid 71 and name HG2#) 2.5 0.7 1.2	!#A 1635  1.66e+06
assign (resid 69 and name HB#) (resid 71 and name HG1#) 4.0 2.2 2.0	!#A 1634  2.51e+05
assign (resid 69 and name HB#) (resid 71 and name HB) 4.0 2.2 1.5	!#A 1631  1.43e+05

!E70
assign (resid 70 and name HA) (resid 70 and name HB#) 4.0 2.2 1.0	!#A 745  4.48e+05
assign (resid 70 and name HA) (resid 70 and name HG#) 3.0 1.2 0.5	!#A 747  -6.31e+05
assign (resid 70 and name HG#) (resid 72 and name HG#) 4.0 2.2 1.0	!#A 1664  2.01e+05

!V71
assign (resid 71 and name HA) (resid 71 and name HG2#) 2.5 0.7 0.7	!#A 842  1.53e+06
assign (resid 71 and name HG1#) (resid 71 and name HA) 3.0 1.2 0.8	!#A 1968  6.84e+05
assign (resid 71 and name HA) (resid 71 and name HB) 4.0 2.2 1.5	!#A 839  2.06e+05
assign (resid 71 and name HG1#) (resid 72 and name HG#) 4.0 2.2 1.8	!#A 2308  -3.73e+05
assign (resid 71 and name HA) (resid 72 and name HG#) 4.0 2.2 1.0	!#A 840  1.78e+05
assign (resid 71 and name HG1#) (resid 73 and name HB#) 4.0 2.2 2.0	!#A 2727  1.71e+05
assign (resid 71 and name HG1#) (resid 74 and name HA) 4.0 2.2 1.5	!#A 287  2.16e+05
assign (resid 71 and name HG1#) (resid 74 and name HG2#) 2.5 0.7 1.7	!#A 1971  2.32e+07
assign (resid 71 and name HG1#) (resid 76 and name HB) 4.0 2.2 1.5	!#A 1965  3.16e+05
assign (resid 71 and name HG2#) (resid 76 and name HG2#) 3.0 1.2 1.7	!#A 2161  7.78e+05
assign (resid 71 and name HG1#) (resid 76 and name HG2#) 3.0 1.2 1.3	!#A 1970  6.87e+05
assign (resid 71 and name HA) (resid 76 and name HG2#) 4.0 2.2 1.5	!#A 1648  2.24e+05
assign (resid 71 and name HG2#) (resid 76 and name HB) 4.0 2.2 1.5	!#A 2158  1.54e+05
assign (resid 71 and name HG2#) (resid 78 and name HG#) 4.0 2.2 1.5	!#A 1593  -2.51e+05

!K72
assign (resid 72 and name HD#) (resid 72 and name HA) 4.0 2.2 1.0	!#A 1410  3.41e+05
assign (resid 72 and name HB2) (resid 72 and name HA) 4.0 2.2 1.0	!#A 1410  3.41e+05
assign (resid 72 and name HG#) (resid 72 and name HA) 4.0 2.2 1.0	!#A 1410  3.41e+05
assign (resid 72 and name HG#) (resid 72 and name HE#) 2.5 0.7 0.4	!#A 1501  -2.23e+06
assign (resid 72 and name HA) (resid 72 and name HE#) 4.0 2.2 1.0	!#A 603  -1.87e+05
assign (resid 72 and name HB1) (resid 72 and name HD#) 3.0 1.2 0.5	!#A 1809  1.28e+06
assign (resid 72 and name HA) (resid 72 and name HB1) 4.0 2.2 1.0	!#A 288  -3.49e+05
assign (resid 72 and name HE#) (resid 72 and name HG#) 4.0 2.2 1.0	!#A 976  1.56e+05
assign (resid 72 and name HA) (resid 72 and name HG#) 4.0 2.2 1.0	!#A 285  3.64e+05
assign (resid 72 and name HA) (resid 72 and name HD#) 4.0 2.2 1.0	!#A 284  -1.56e+05
assign (resid 72 and name HB2) (resid 73 and name HB#) 4.0 2.2 1.5	!#A 2136  2.75e+05
assign (resid 72 and name HA) (resid 73 and name HB#) 4.0 2.2 1.5	!#A 1613  -1.44e+05
assign (resid 72 and name HB2) (resid 73 and name HA) 4.0 2.2 1.0	!#A 272  -1.58e+05
assign (resid 72 and name HB1) (resid 73 and name HB#) 4.0 2.2 1.5	!#A 1243  -1.78e+05

!A73
assign (resid 73 and name HB#) (resid 90 and name HB2) 4.0 2.2 1.5	!#A 1612  3.26e+05
assign (resid 73 and name HB#) (resid 90 and name HB1) 4.0 2.2 1.5	!#A 1611  4.23e+05

!T74
assign (resid 74 and name HA) (resid 74 and name HG2#) 3.0 1.2 0.8	!#A 321  9.82e+05
assign (resid 74 and name HA) (resid 74 and name HB) 4.0 2.2 1.0	!#A 318  5.01e+05
assign (resid 74 and name HG2#) (resid 75 and name HB1) 4.0 2.2 1.5	!#A 2001  -2.35e+05
assign (resid 74 and name HA) (resid 75 and name HB1) 4.0 2.2 1.0	!#A 324  -1.43e+05
assign (resid 74 and name HA) (resid 75 and name HB2) 4.0 2.2 1.0	!#A 1529  1.47e+05
assign (resid 74 and name HA) (resid 75 and name HD1) 4.0 2.2 1.0	!#A 634  2.20e+05
assign (resid 74 and name HG2#) (resid 75 and name HA) 4.0 2.2 1.5	!#A 1998  2.92e+05
assign (resid 74 and name HB) (resid 75 and name HA) 4.0 2.2 1.0	!#A 827  4.53e+05
assign (resid 74 and name HA) (resid 75 and name HA) 3.0 1.2 0.5	!#A 322  9.79e+05
assign (resid 74 and name HA) (resid 75 and name HD2) 4.0 2.2 1.0	!#A 319  -1.46e+05
assign (resid 74 and name HA) (resid 76 and name HG2#) 4.0 2.2 1.7	!#A 2448  2.13e+05
assign (resid 74 and name HA) (resid 76 and name HB) 4.0 2.2 1.0	!#A 758  1.46e+05

!P75
assign (resid 75 and name HB2) (resid 75 and name HD#) 4.0 2.2 1.0	!#A 2289  -1.54e+05
assign (resid 75 and name HB1) (resid 75 and name HA) 4.0 2.2 1.0	!#A 1290  1.77e+05
assign (resid 75 and name HB2) (resid 75 and name HA) 4.0 2.2 1.0	!#A 1527  2.70e+05
assign (resid 75 and name HG#) (resid 75 and name HD#) 4.0 2.2 1.0	!#A 1327  -2.05e+05
assign (resid 75 and name HG#) (resid 75 and name HD#) 4.0 2.2 1.0	!#A 1326  -1.64e+05
assign (resid 75 and name HA) (resid 75 and name HD#) 4.0 2.2 1.0	!#A 265  -1.78e+05
assign (resid 75 and name HG#) (resid 77 and name HZ) 4.0 2.2 1.0	!#A 139  -1.41e+05
assign (resid 75 and name HG#) (resid 92 and name HA) 4.0 2.2 1.0	!#A 1299  -2.87e+05
assign (resid 75 and name HD2) (resid 92 and name HB#) 4.0 2.2 1.5	!#A 921  1.68e+05

!T76
assign (resid 76 and name HG2#) (resid 76 and name HA) 4.0 2.2 1.5	!#A 1651  5.77e+05
assign (resid 76 and name HG2#) (resid 76 and name HB) 3.0 1.2 0.8	!#A 1645  8.39e+05
assign (resid 76 and name HG2#) (resid 77 and name HA) 4.0 2.2 1.5	!#A 1655  1.50e+05
assign (resid 76 and name HG2#) (resid 77 and name HB2) 4.0 2.2 1.7	!#A 1252  -2.51e+05
assign (resid 76 and name HG2#) (resid 78 and name HE2#) 4.0 2.2 1.5	!#A 495  4.77e+05
assign (resid 76 and name HG2#) (resid 78 and name HB1) 4.0 2.2 1.8	!#A 1659  -1.63e+05
assign (resid 76 and name HG2#) (resid 78 and name HB2) 4.0 2.2 1.5	!#A 1658  -2.37e+05
assign (resid 76 and name HG2#) (resid 78 and name HA) 4.0 2.2 1.5	!#A 1657  1.91e+05
assign (resid 76 and name HG2#) (resid 78 and name HG#) 3.0 1.2 0.8	!#A 1132  7.97e+05
assign (resid 76 and name HG2#) (resid 88 and name HB2) 3.0 1.2 1.3	!#A 1176  8.40e+05
assign (resid 76 and name HG2#) (resid 90 and name HB2) 4.0 2.2 1.5	!#A 1151  2.38e+05
assign (resid 76 and name HG2#) (resid 90 and name HA) 4.0 2.2 1.5	!#A 255  3.36e+05
assign (resid 76 and name HA) (resid 90 and name HA) 3.0 1.2 0.5	!#A 254  9.93e+05
assign (resid 76 and name HA) (resid 90 and name HB2) 4.0 2.2 1.0	!#A 454  2.86e+05
assign (resid 76 and name HA) (resid 90 and name HB1) 4.0 2.2 1.0	!#A 453  2.95e+05
assign (resid 76 and name HG2#) (resid 90 and name HB1) 4.0 2.2 1.5	!#A 1647  2.02e+05
assign (resid 76 and name HB) (resid 90 and name HA) 4.0 2.2 1.0	!#A 251  1.59e+05

!F77
assign (resid 77 and name HA) (resid 77 and name HD#) 4.0 2.2 1.0	!#A 224  -2.31e+05
assign (resid 77 and name HB2) (resid 77 and name HD#) 4.0 2.2 1.0	!#A 1250  -3.48e+05
assign (resid 77 and name HB1) (resid 77 and name HD#) 4.0 2.2 1.0	!#A 1165  -3.44e+05
assign (resid 77 and name HA) (resid 77 and name HB2) 4.0 2.2 1.0	!#A 226  -1.50e+05
assign (resid 77 and name HA) (resid 77 and name HB1) 4.0 2.2 1.0	!#A 225  -2.06e+05
assign (resid 77 and name HB1) (resid 79 and name HZ) 4.0 2.2 1.0	!#A 1667  -1.63e+05
assign (resid 77 and name HD#) (resid 89 and name HD#) 4.0 2.2 1.0	!#A 22  -1.56e+05
assign (resid 77 and name HB2) (resid 89 and name HD#) 4.0 2.2 1.0	!#A 1249  1.76e+05
assign (resid 77 and name HD#) (resid 89 and name HE#) 4.0 2.2 1.0	!#A 17  -2.25e+05
assign (resid 77 and name HE#) (resid 92 and name HB#) 4.0 2.2 1.0	!#A 113  2.16e+05
assign (resid 77 and name HE#) (resid 92 and name HA) 4.0 2.2 1.0	!#A 110  -1.58e+05
assign (resid 77 and name HB1) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 1167  5.07e+05
assign (resid 77 and name HE#) (resid 97 and name HD1#) 4.0 2.2 1.5	!#A 112  2.52e+05
assign (resid 77 and name HD#) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 1915  -1.81e+05
assign (resid 77 and name HZ) (resid 97 and name HD1#) 4.0 2.2 1.5	!#A 138  1.87e+05
assign (resid 77 and name HB1) (resid 97 and name HD1#) 4.0 2.2 1.5	!#A 1166  1.67e+05

!Q78
assign (resid 78 and name HB1) (resid 78 and name HA) 4.0 2.2 1.0	!#A 1297  3.46e+05
assign (resid 78 and name HA) (resid 78 and name HG#) 4.0 2.2 1.0	!#A 282  -2.29e+05
assign (resid 78 and name HA) (resid 79 and name HB2) 4.0 2.2 1.0	!#A 281  1.54e+05
assign (resid 78 and name HA) (resid 79 and name HD#) 4.0 2.2 1.0	!#A 279  -1.49e+05
assign (resid 78 and name HB1) (resid 80 and name HD#) 4.0 2.2 1.0	!#A 1877  -2.08e+05
assign (resid 78 and name HB1) (resid 80 and name HE#) 4.0 2.2 1.0	!#A 31  -1.60e+05
assign (resid 78 and name HB1) (resid 85 and name HG#) 4.0 2.2 1.0	!#A 2224  -2.69e+05
assign (resid 78 and name HG#) (resid 85 and name HG#) 4.0 2.2 1.3	!#A 2221  -1.87e+05
assign (resid 78 and name HB1) (resid 85 and name HG#) 4.0 2.2 1.0	!#A 1925  -2.66e+05
assign (resid 78 and name HA) (resid 87 and name HA1) 4.0 2.2 1.3	!#A 280  2.18e+05
assign (resid 78 and name HB1) (resid 88 and name HA) 4.0 2.2 1.0	!#A 222  -1.45e+05
assign (resid 78 and name HA) (resid 88 and name HA) 3.0 1.2 0.5	!#A 276  9.19e+05
assign (resid 78 and name HA) (resid 88 and name HB2) 4.0 2.2 1.0	!#A 278  2.09e+05

!F79
assign (resid 79 and name HD#) (resid 79 and name HA) 4.0 2.2 1.0	!#A 132  2.54e+05
assign (resid 79 and name HB1) (resid 79 and name HD#) 4.0 2.2 1.0	!#A 1057  -2.55e+05
assign (resid 79 and name HB2) (resid 79 and name HD#) 4.0 2.2 1.0	!#A 1083  -2.46e+05
assign (resid 79 and name HA) (resid 79 and name HD#) 4.0 2.2 1.0	!#A 235  -1.94e+05
assign (resid 79 and name HB1) (resid 79 and name HA) 4.0 2.2 1.0	!#A 1062  4.55e+05
assign (resid 79 and name HA) (resid 79 and name HB2) 4.0 2.2 1.0	!#A 240  -1.84e+05
assign (resid 79 and name HA) (resid 80 and name HD2) 4.0 2.2 1.0	!#A 513  1.74e+05
assign (resid 79 and name HB2) (resid 85 and name HG#) 4.0 2.2 1.0	!#A 2501  -1.92e+05
assign (resid 79 and name HB1) (resid 85 and name HA) 4.0 2.2 1.3	!#A 699  -2.30e+05
assign (resid 79 and name HD1) (resid 86 and name HG2#) 4.0 2.2 1.5	!#A 462  3.38e+05
assign (resid 79 and name HA) (resid 86 and name HG2#) 4.0 2.2 1.5	!#A 1963  2.10e+05
assign (resid 79 and name HB1) (resid 86 and name HG2#) 3.0 1.2 0.8	!#A 1061  6.92e+05
assign (resid 79 and name HB2) (resid 86 and name HG2#) 4.0 2.2 1.5	!#A 1958  -1.67e+05
assign (resid 79 and name HB2) (resid 87 and name HA1) 4.0 2.2 1.0	!#A 524  1.53e+05
assign (resid 79 and name HD#) (resid 87 and name HA2) 4.0 2.2 1.0	!#A 126  -1.64e+05
assign (resid 79 and name HE#) (resid 88 and name HA) 4.0 2.2 1.0	!#A 217  -1.67e+05
assign (resid 79 and name HD#) (resid 88 and name HA) 4.0 2.2 1.0	!#A 216  -2.22e+05
assign (resid 79 and name HZ) (resid 89 and name HE#) 4.0 2.2 1.0	!#A 11  -3.23e+05
assign (resid 79 and name HE#) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 87  4.50e+05
assign (resid 79 and name HZ) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 1919  -4.11e+05
assign (resid 79 and name HD#) (resid 100 and name HG2#) 4.0 2.2 1.5	!#A 130  2.46e+05
assign (resid 79 and name HE#) (resid 100 and name HB) 4.0 2.2 1.0	!#A 85  2.57e+05
assign (resid 79 and name HB2) (resid 100 and name HG2#) 4.0 2.2 1.5	!#A 1087  1.52e+05
assign (resid 79 and name HZ) (resid 100 and name HG2#) 4.0 2.2 1.5	!#A 2076  -3.00e+05
assign (resid 79 and name HZ) (resid 100 and name HB) 4.0 2.2 1.0	!#A 81  2.14e+05
assign (resid 79 and name HE#) (resid 101 and name HG1#) 4.0 2.2 1.5	!#A 1881  -1.48e+05
assign (resid 79 and name HZ) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 84  -1.43e+05
assign (resid 79 and name HE#) (resid 101 and name HA) 4.0 2.2 1.0	!#A 92  2.66e+05
assign (resid 79 and name HB2) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 1084  3.43e+05
assign (resid 79 and name HD#) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 2058  -1.73e+05
assign (resid 79 and name HB1) (resid 104 and name HB1) 4.0 2.2 1.0	!#A 1480  1.57e+05
assign (resid 79 and name HD#) (resid 104 and name HB2) 4.0 2.2 1.0	!#A 136  -1.53e+05
assign (resid 79 and name HD#) (resid 104 and name HG) 4.0 2.2 1.0	!#A 135  1.46e+05
assign (resid 79 and name HA) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 236  1.95e+05
assign (resid 79 and name HE1) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 91  1.64e+05
assign (resid 79 and name HB1) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 1058  2.47e+05

!F80
assign (resid 80 and name HD#) (resid 80 and name HA) 4.0 2.2 1.0	!#A 187  3.06e+05
assign (resid 80 and name HD#) (resid 80 and name HB1) 4.0 2.2 1.0	!#A 185  -4.11e+05
assign (resid 80 and name HA) (resid 80 and name HD#) 4.0 2.2 1.0	!#A 228  -1.75e+05
assign (resid 80 and name HB1) (resid 80 and name HD#) 4.0 2.2 1.0	!#A 1048  -2.79e+05
assign (resid 80 and name HB2) (resid 80 and name HA) 4.0 2.2 1.0	!#A 1022  3.13e+05
assign (resid 80 and name HE#) (resid 80 and name HA) 4.0 2.2 1.0	!#A 34  1.46e+05
assign (resid 80 and name HA) (resid 80 and name HB1) 4.0 2.2 1.0	!#A 229  -2.10e+05
assign (resid 80 and name HB2) (resid 80 and name HD#) 4.0 2.2 1.0	!#A 1015  -2.32e+05
assign (resid 80 and name HD#) (resid 81 and name HB#) 4.0 2.2 2.3	!#A 2076  2.04e+05
assign (resid 80 and name HA) (resid 81 and name HA) 4.0 2.2 1.0	!#A 234  1.52e+05
assign (resid 80 and name HB1) (resid 83 and name HA2) 4.0 2.2 1.0	!#A 1211  -1.67e+05
assign (resid 80 and name HE#) (resid 84 and name HA) 4.0 2.2 1.0	!#A 359  -1.90e+05
assign (resid 80 and name HA) (resid 84 and name HA) 4.0 2.2 1.0	!#A 385  1.76e+05
assign (resid 80 and name HB2) (resid 85 and name HA) 4.0 2.2 1.0	!#A 1021  -2.21e+05
assign (resid 80 and name HD#) (resid 85 and name HA) 4.0 2.2 1.0	!#A 697  -1.64e+05
assign (resid 80 and name HD#) (resid 85 and name HD#) 4.0 2.2 1.2	!#A 1382  2.04e+05
assign (resid 80 and name HD#) (resid 85 and name HB2) 4.0 2.2 1.0	!#A 1492  1.55e+05
assign (resid 80 and name HB1) (resid 85 and name HA) 4.0 2.2 1.0	!#A 1474  -2.21e+05
assign (resid 80 and name HE#) (resid 85 and name HB2) 4.0 2.2 1.0	!#A 353  1.62e+05
assign (resid 80 and name HA) (resid 85 and name HG#) 4.0 2.2 1.0	!#A 1703  1.62e+05
assign (resid 80 and name HA) (resid 85 and name HA) 3.0 1.2 0.5	!#A 233  7.24e+05
assign (resid 80 and name HE#) (resid 85 and name HG#) 4.0 2.2 1.0	!#A 32  1.43e+05
assign (resid 80 and name HA) (resid 86 and name HG2#) 4.0 2.2 1.5	!#A 1962  5.81e+05
assign (resid 80 and name HA) (resid 86 and name HG1#) 4.0 2.2 1.5	!#A 231  4.15e+05

!K81
assign (resid 81 and name HA) (resid 81 and name HD#) 4.0 2.2 1.0	!#A 416  4.66e+05
assign (resid 81 and name HD#) (resid 81 and name HB#) 2.5 0.7 0.4	!#A 2045  -5.73e+06
assign (resid 81 and name HB#) (resid 81 and name HE#) 4.0 2.2 1.0	!#A 2078  -5.14e+05
assign (resid 81 and name HE#) (resid 81 and name HA) 4.0 2.2 1.0	!#A 956  2.38e+05
assign (resid 81 and name HA) (resid 81 and name HB#) 3.0 1.2 0.5	!#A 423  -9.90e+05
assign (resid 81 and name HE#) (resid 81 and name HG#) 3.0 1.2 0.5	!#A 952  1.17e+06
assign (resid 81 and name HA) (resid 81 and name HG#) 3.0 1.2 0.5	!#A 417  1.40e+06
assign (resid 81 and name HB#) (resid 82 and name HG#) 4.0 2.2 1.0	!#A 2185  -2.25e+05
assign (resid 81 and name HA) (resid 82 and name HA) 4.0 2.2 1.0	!#A 424  1.52e+05
assign (resid 81 and name HB#) (resid 84 and name HB2) 4.0 2.2 1.0	!#A 1389  -1.51e+05
assign (resid 81 and name HE#) (resid 86 and name HG2#) 4.0 2.2 1.5	!#A 2724  -2.59e+05
assign (resid 81 and name HA) (resid 86 and name HG2#) 4.0 2.2 1.5	!#A 1961  1.96e+05
assign (resid 81 and name HB#) (resid 86 and name HG1#) 3.0 1.2 0.8	!#A 1761  -6.94e+05
assign (resid 81 and name HB#) (resid 86 and name HB) 4.0 2.2 1.0	!#A 1095  2.91e+05
assign (resid 81 and name HB#) (resid 86 and name HG2#) 3.0 1.2 0.8	!#A 1391  1.03e+06
assign (resid 81 and name HG#) (resid 86 and name HG2#) 3.0 1.2 2.0	!#A 1955  6.10e+05
assign (resid 81 and name HG#) (resid 86 and name HG1#) 4.0 2.2 1.5	!#A 1759  4.89e+05
assign (resid 81 and name HD#) (resid 86 and name HG1#) 4.0 2.2 1.5	!#A 1757  2.88e+05
assign (resid 81 and name HD#) (resid 86 and name HG2#) 4.0 2.2 1.5	!#A 1954  3.07e+05
assign (resid 81 and name HG#) (resid 104 and name HB1) 4.0 2.2 1.0	!#A 1519  2.31e+07
assign (resid 81 and name HE#) (resid 105 and name HA) 4.0 2.2 1.0	!#A 953  3.04e+05

!K82
assign (resid 82 and name HG#) (resid 82 and name HE#) 2.5 0.7 0.4	!#A 1501  -2.23e+06
assign (resid 82 and name HE#) (resid 82 and name HG#) 3.0 1.2 0.5	!#A 969  6.88e+05
assign (resid 82 and name HB2) (resid 82 and name HE#) 4.0 2.2 1.0	!#A 2023  -1.99e+05
assign (resid 82 and name HG#) (resid 82 and name HA) 3.0 1.2 0.5	!#A 1494  1.17e+06
assign (resid 82 and name HA) (resid 82 and name HG#) 3.0 1.2 0.5	!#A 667  7.57e+05
assign (resid 82 and name HA) (resid 82 and name HD#) 3.0 1.2 1.5	!#A 665  1.04e+06
assign (resid 82 and name HD#) (resid 82 and name HB1) 3.0 1.2 0.5	!#A 1365  8.36e+05
assign (resid 82 and name HA) (resid 82 and name HB2) 3.0 1.2 0.5	!#A 664  6.52e+05
assign (resid 82 and name HA) (resid 82 and name HB1) 3.0 1.2 0.5	!#A 663  1.15e+06
assign (resid 82 and name HE#) (resid 82 and name HB1) 4.0 2.2 1.0	!#A 968  2.18e+05
assign (resid 82 and name HA) (resid 83 and name HA1) 4.0 2.2 1.0	!#A 916  2.16e+05
assign (resid 82 and name HB2) (resid 84 and name HG#) 4.0 2.2 1.0	!#A 1589  2.42e+05

!G83

!Q84
assign (resid 84 and name HB2) (resid 84 and name HA) 3.0 1.2 0.5	!#A 1270  -1.17e+06
assign (resid 84 and name HG#) (resid 84 and name HA) 3.0 1.2 0.5	!#A 1131  -1.12e+06
assign (resid 84 and name HA) (resid 85 and name HB1) 4.0 2.2 1.0	!#A 381  -1.73e+05
assign (resid 84 and name HB1) (resid 85 and name HB2) 4.0 2.2 2.0	!#A 1211  -1.75e+05
assign (resid 84 and name HE2#) (resid 86 and name HG1#) 4.0 2.2 1.5	!#A 470  4.19e+05
assign (resid 84 and name HB2) (resid 86 and name HG1#) 4.0 2.2 1.7	!#A 1879  4.28e+05
assign (resid 84 and name HA) (resid 86 and name HG1#) 4.0 2.2 1.5	!#A 1756  -2.08e+05

!K85
assign (resid 85 and name HG#) (resid 85 and name HE#) 3.0 1.2 0.5	!#A 2219  -7.70e+05
assign (resid 85 and name HA) (resid 85 and name HD#) 3.0 1.2 1.5	!#A 1027  1.04e+06
assign (resid 85 and name HG#) (resid 85 and name HA) 4.0 2.2 1.0	!#A 1702  5.92e+05
assign (resid 85 and name HD#) (resid 85 and name HB2) 3.0 1.2 0.5	!#A 1381  6.34e+05
assign (resid 85 and name HA) (resid 85 and name HB2) 4.0 2.2 1.0	!#A 696  3.13e+05
assign (resid 85 and name HA) (resid 85 and name HB1) 4.0 2.2 1.0	!#A 695  2.29e+05
assign (resid 85 and name HE#) (resid 85 and name HB2) 4.0 2.2 1.0	!#A 978  -1.42e+05
assign (resid 85 and name HE#) (resid 85 and name HB1) 4.0 2.2 1.0	!#A 977  1.43e+05
assign (resid 85 and name HG#) (resid 86 and name HA) 4.0 2.2 1.0	!#A 1701  3.31e+05
assign (resid 85 and name HA) (resid 86 and name HG2#) 4.0 2.2 1.5	!#A 701  2.26e+05
assign (resid 85 and name HG#) (resid 86 and name HA) 4.0 2.2 1.3	!#A 1493  -1.45e+05
assign (resid 85 and name HA) (resid 86 and name HA) 4.0 2.2 1.0	!#A 700  1.66e+05
assign (resid 85 and name HA) (resid 86 and name HG1#) 4.0 2.2 1.5	!#A 698  2.07e+05
assign (resid 85 and name HG#) (resid 87 and name HA2) 4.0 2.2 1.0	!#A 1133  1.72e+05
assign (resid 85 and name HE#) (resid 88 and name HB2) 4.0 2.2 1.0	!#A 1710  -4.35e+05
assign (resid 85 and name HD#) (resid 88 and name HB1) 4.0 2.2 1.0	!#A 1575  2.23e+05
assign (resid 85 and name HG#) (resid 88 and name HB1) 4.0 2.2 1.0	!#A 1119  -1.82e+05

!V86
assign (resid 86 and name HB) (resid 86 and name HA) 2.5 0.7 0.4	!#A 1094  2.43e+06
assign (resid 86 and name HA) (resid 86 and name HG2#) 3.0 1.2 0.8	!#A 427  1.29e+06
assign (resid 86 and name HA) (resid 86 and name HG1#) 2.5 0.7 0.7	!#A 426  4.05e+06
assign (resid 86 and name HA) (resid 87 and name HA1) 4.0 2.2 1.0	!#A 525  2.32e+05
assign (resid 86 and name HA) (resid 104 and name HD1#) 4.0 2.2 1.7	!#A 770  1.81e+05
assign (resid 86 and name HG2#) (resid 104 and name HD1#) 2.5 0.7 1.2	!#A 2071  1.93e+06
assign (resid 86 and name HG2#) (resid 104 and name HD2#) 2.5 0.7 1.6	!#A 1891  1.65e+06
assign (resid 86 and name HG2#) (resid 104 and name HB1) 4.0 2.2 1.5	!#A 2277  3.16e+05
assign (resid 86 and name HB) (resid 104 and name HD2#) 3.0 1.2 0.8	!#A 1093  7.81e+05
assign (resid 86 and name HG1#) (resid 104 and name HD1#) 4.0 2.2 2.0	!#A 1758  2.01e+05

!G87
assign (resid 87 and name HA1) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 522  2.42e+05
assign (resid 87 and name HA2) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 804  3.51e+05

!E88
assign (resid 88 and name HB2) (resid 88 and name HA) 4.0 2.2 1.0	!#A 1190  5.22e+05
assign (resid 88 and name HG#) (resid 88 and name HA) 3.0 1.2 0.5	!#A 1190  7.22e+05
assign (resid 88 and name HB1) (resid 88 and name HA) 3.0 1.2 0.5	!#A 1121  8.50e+05
assign (resid 88 and name HB2) (resid 89 and name HA) 4.0 2.2 2.0	!#A 1714  4.24e+05
assign (resid 88 and name HG#) (resid 89 and name HA) 4.0 2.2 2.0	!#A 1193  4.24e+05

!F89
assign (resid 89 and name HD#) (resid 89 and name HA) 3.0 1.2 0.5	!#A 42  6.45e+05
assign (resid 89 and name HD#) (resid 89 and name HB2) 4.0 2.2 1.0	!#A 40  -4.34e+05
assign (resid 89 and name HD#) (resid 89 and name HB1) 4.0 2.2 1.0	!#A 39  -3.87e+05
assign (resid 89 and name HA) (resid 89 and name HB2) 4.0 2.2 1.0	!#A 275  -5.47e+05
assign (resid 89 and name HA) (resid 89 and name HB1) 4.0 2.2 1.0	!#A 274  -5.07e+05
assign (resid 89 and name HB2) (resid 90 and name HA) 4.0 2.2 1.0	!#A 874  -1.45e+05
assign (resid 89 and name HZ) (resid 93 and name HB1) 4.0 2.2 1.0	!#A 162  -1.80e+05
assign (resid 89 and name HD#) (resid 96 and name HG#) 4.0 2.2 1.0	!#A 37  1.81e+05
assign (resid 89 and name HD#) (resid 96 and name HD#) 4.0 2.2 1.0	!#A 35  1.49e+05
assign (resid 89 and name HE#) (resid 96 and name HD#) 4.0 2.2 1.0	!#A 18  1.59e+05
assign (resid 89 and name HD#) (resid 96 and name HD#) 4.0 2.2 1.0	!#A 18  1.59e+05
assign (resid 89 and name HZ) (resid 96 and name HD#) 4.0 2.2 1.0	!#A 2593  -3.83e+05
assign (resid 89 and name HE#) (resid 96 and name HG#) 4.0 2.2 1.0	!#A 2809  -1.41e+05
assign (resid 89 and name HE#) (resid 96 and name HE#) 4.0 2.2 1.0	!#A 21  -1.89e+05
assign (resid 89 and name HB2) (resid 96 and name HE#) 4.0 2.2 1.0	!#A 1106  -1.57e+05
assign (resid 89 and name HD#) (resid 96 and name HE#) 4.0 2.2 1.0	!#A 44  -2.64e+05
assign (resid 89 and name HB2) (resid 96 and name HE#) 4.0 2.2 1.0	!#A 872  -2.23e+05
assign (resid 89 and name HE#) (resid 96 and name HE#) 4.0 2.2 1.2	!#A 20  -1.89e+05
assign (resid 89 and name HB2) (resid 96 and name HD#) 4.0 2.2 1.0	!#A 871  -1.44e+05
assign (resid 89 and name HZ) (resid 97 and name HG) 4.0 2.2 1.0	!#A 1444  -2.74e+05
assign (resid 89 and name HE#) (resid 97 and name HA) 4.0 2.2 1.0	!#A 559  -1.64e+05
assign (resid 89 and name HD#) (resid 97 and name HA) 4.0 2.2 1.3	!#A 41  1.92e+05
assign (resid 89 and name HZ) (resid 97 and name HB1) 4.0 2.2 1.0	!#A 161  -1.66e+05
assign (resid 89 and name HE#) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 12  2.68e+05
assign (resid 89 and name HZ) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 1918  -3.51e+05
assign (resid 89 and name HZ) (resid 97 and name HA) 4.0 2.2 1.0	!#A 563  -3.24e+05
assign (resid 89 and name HZ) (resid 97 and name HB2) 4.0 2.2 1.0	!#A 1135  -1.67e+05
assign (resid 89 and name HZ) (resid 97 and name HD1#) 4.0 2.2 1.5	!#A 159  1.44e+05
assign (resid 89 and name HD#) (resid 100 and name HG2#) 4.0 2.2 1.5	!#A 38  4.79e+05
assign (resid 89 and name HD#) (resid 100 and name HB) 4.0 2.2 1.0	!#A 36  2.08e+05
assign (resid 89 and name HE#) (resid 100 and name HB) 4.0 2.2 1.0	!#A 8  2.36e+05
assign (resid 89 and name HE#) (resid 100 and name HG2#) 4.0 2.2 1.5	!#A 2072  -1.41e+05

!S90
assign (resid 90 and name HA) (resid 90 and name HB2) 3.0 1.2 0.5	!#A 253  6.90e+05
assign (resid 90 and name HA) (resid 90 and name HB1) 3.0 1.2 0.5	!#A 252  8.51e+05
assign (resid 90 and name HB2) (resid 91 and name HA2) 3.0 1.2 0.9	!#A 787  2.89e+06

!G91

!A92
assign (resid 92 and name HB#) (resid 92 and name HA) 3.0 1.2 0.8	!#A 1543  -1.02e+06
assign (resid 92 and name HB#) (resid 94 and name HD#) 4.0 2.2 1.5	!#A 1699  4.08e+05

!N93
assign (resid 93 and name HB1) (resid 93 and name HA) 4.0 2.2 1.0	!#A 1345  -4.87e+05
assign (resid 93 and name HB2) (resid 93 and name HA) 4.0 2.2 1.0	!#A 1038  -5.81e+05
assign (resid 93 and name HA) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 2543  -1.76e+05
assign (resid 93 and name HB2) (resid 96 and name HB2) 4.0 2.2 1.0	!#A 1502  -2.58e+05
assign (resid 93 and name HB1) (resid 96 and name HA) 4.0 2.2 1.0	!#A 1076  -1.86e+05
assign (resid 93 and name HA) (resid 96 and name HD#) 4.0 2.2 1.3	!#A 2543  -1.76e+05
assign (resid 93 and name HB2) (resid 96 and name HB1) 4.0 2.2 1.0	!#A 1754  -1.44e+05
assign (resid 93 and name HB1) (resid 96 and name HD#) 4.0 2.2 1.0	!#A 982  -1.48e+05
assign (resid 93 and name HB1) (resid 96 and name HB1) 4.0 2.2 1.0	!#A 981  1.52e+05
assign (resid 93 and name HB1) (resid 96 and name HB2) 4.0 2.2 1.0	!#A 980  -1.48e+05

!K94
assign (resid 94 and name HG#) (resid 94 and name HA) 4.0 2.2 1.0	!#A 1639  1.83e+05
assign (resid 94 and name HE#) (resid 94 and name HG#) 4.0 2.2 1.0	!#A 1066  1.87e+05
assign (resid 94 and name HE#) (resid 94 and name HG#) 4.0 2.2 1.0	!#A 1065  -1.58e+05
assign (resid 94 and name HA) (resid 94 and name HG#) 4.0 2.2 1.0	!#A 837  1.41e+05
assign (resid 94 and name HB1) (resid 94 and name HD#) 3.0 1.2 0.5	!#A 1585  6.53e+05
assign (resid 94 and name HA) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 833  2.31e+05
assign (resid 94 and name HA) (resid 94 and name HD#) 4.0 2.2 1.0	!#A 834  -1.41e+05
assign (resid 94 and name HA) (resid 94 and name HB1) 4.0 2.2 1.0	!#A 831  2.59e+05
assign (resid 94 and name HD#) (resid 94 and name HB1) 3.0 1.2 0.5	!#A 1770  8.52e+05
assign (resid 94 and name HD#) (resid 94 and name HB2) 3.0 1.2 1.5	!#A 1695  1.16e+06
assign (resid 94 and name HE#) (resid 94 and name HB2) 4.0 2.2 1.0	!#A 1064  -1.73e+05
assign (resid 94 and name HE#) (resid 94 and name HB1) 4.0 2.2 1.0	!#A 1063  1.68e+05
assign (resid 94 and name HA) (resid 94 and name HB2) 4.0 2.2 1.0	!#A 832  2.55e+05
assign (resid 94 and name HD#) (resid 94 and name HB2) 4.0 2.2 1.0	!#A 1771  1.60e+05
assign (resid 94 and name HA) (resid 95 and name HG#) 4.0 2.2 1.5	!#A 1164  1.70e+05
assign (resid 94 and name HG#) (resid 95 and name HA) 3.0 1.2 1.0	!#A 2735  7.13e+05
assign (resid 94 and name HG#) (resid 95 and name HG#) 4.0 2.2 1.0	!#A 1551  -2.35e+05
assign (resid 94 and name HA) (resid 96 and name HB2) 4.0 2.2 1.5	!#A 830  1.46e+05
assign (resid 94 and name HB2) (resid 97 and name HD1#) 4.0 2.2 1.0	!#A 2481  3.88e+05
assign (resid 94 and name HA) (resid 97 and name HB2) 4.0 2.2 1.0	!#A 1137  2.44e+05
assign (resid 94 and name HA) (resid 97 and name HB1) 4.0 2.2 1.0	!#A 838  -1.47e+05
assign (resid 94 and name HB1) (resid 97 and name HD1#) 4.0 2.2 1.5	!#A 1586  1.80e+05
assign (resid 94 and name HA) (resid 97 and name HD1#) 4.0 2.2 1.5	!#A 836  2.42e+05

!E95
assign (resid 95 and name HB1) (resid 95 and name HA) 3.0 1.2 0.5	!#A 1788  9.41e+05
assign (resid 95 and name HG#) (resid 95 and name HA) 3.0 1.2 0.5	!#A 1153  1.27e+06
assign (resid 95 and name HA) (resid 95 and name HB2) 3.0 1.2 0.5	!#A 614  7.67e+05
assign (resid 95 and name HB1) (resid 96 and name HA) 4.0 2.2 1.0	!#A 1232  -1.48e+05
assign (resid 95 and name HA) (resid 96 and name HA) 4.0 2.2 1.0	!#A 743  2.55e+05
assign (resid 95 and name HB2) (resid 96 and name HA) 4.0 2.2 1.0	!#A 738  1.70e+05
assign (resid 95 and name HA) (resid 98 and name HB#) 4.0 2.2 1.0	!#A 611  1.59e+05
assign (resid 95 and name HA) (resid 98 and name HG#) 4.0 2.2 2.0	!#A 618  -1.41e+05

!K96
assign (resid 96 and name HA) (resid 96 and name HE#) 4.0 2.2 1.0	!#A 741  -2.17e+05
assign (resid 96 and name HE#) (resid 96 and name HG#) 4.0 2.2 1.0	!#A 1070  1.69e+05
assign (resid 96 and name HE#) (resid 96 and name HG#) 4.0 2.2 1.0	!#A 1069  2.04e+05
assign (resid 96 and name HA) (resid 96 and name HG#) 4.0 2.2 1.0	!#A 739  3.60e+05
assign (resid 96 and name HA) (resid 96 and name HD#) 4.0 2.2 1.0	!#A 736  1.79e+05
assign (resid 96 and name HD#) (resid 96 and name HB1) 4.0 2.2 1.0	!#A 1803  2.79e+05
assign (resid 96 and name HD#) (resid 96 and name HB2) 4.0 2.2 1.0	!#A 1802  2.84e+05
assign (resid 96 and name HA) (resid 96 and name HB2) 4.0 2.2 1.0	!#A 733  4.41e+05
assign (resid 96 and name HA) (resid 96 and name HB1) 4.0 2.2 1.0	!#A 734  2.70e+05
assign (resid 96 and name HE#) (resid 96 and name HB2) 4.0 2.2 1.0	!#A 1105  -1.64e+05
assign (resid 96 and name HB1) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 2546  4.39e+05
assign (resid 96 and name HA) (resid 99 and name HB#) 2.5 0.7 0.9	!#A 744  2.63e+06
assign (resid 96 and name HG#) (resid 99 and name HB#) 4.0 2.2 1.5	!#A 1574  2.74e+05
assign (resid 96 and name HG#) (resid 100 and name HB) 4.0 2.2 1.0	!#A 2108  1.72e+05

!L97
assign (resid 97 and name HD2#) (resid 97 and name HB1) 4.0 2.2 1.5	!#A 1921  -4.42e+05
assign (resid 97 and name HG) (resid 97 and name HB2) 4.0 2.2 1.0	!#A 1445  -4.63e+05
assign (resid 97 and name HA) (resid 97 and name HB1) 4.0 2.2 1.0	!#A 566  -2.15e+05
assign (resid 97 and name HA) (resid 97 and name HB2) 4.0 2.2 1.0	!#A 565  -2.05e+05
assign (resid 97 and name HA) (resid 97 and name HD2#) 3.0 1.2 0.8	!#A 564  7.33e+05
assign (resid 97 and name HB2) (resid 97 and name HD2#) 4.0 2.2 1.5	!#A 1136  4.10e+05
assign (resid 97 and name HB1) (resid 97 and name HD1#) 2.5 0.7 0.7	!#A 1480  1.48e+06
assign (resid 97 and name HB2) (resid 97 and name HD1#) 3.0 1.2 0.8	!#A 1134  6.02e+05
assign (resid 97 and name HA) (resid 97 and name HD1#) 4.0 2.2 1.5	!#A 562  2.51e+05
assign (resid 97 and name HA) (resid 97 and name HG) 4.0 2.2 1.0	!#A 560  1.50e+05
assign (resid 97 and name HA) (resid 100 and name HG2#) 4.0 2.2 1.5	!#A 567  1.47e+05
assign (resid 97 and name HA) (resid 100 and name HB) 4.0 2.2 1.0	!#A 561  1.78e+05
assign (resid 97 and name HD2#) (resid 100 and name HB) 4.0 2.2 1.5	!#A 1916  1.55e+05
assign (resid 97 and name HD2#) (resid 101 and name HD1#) 3.0 1.2 2.2	!#A 1904  6.64e+05
assign (resid 97 and name HB1) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 1447  3.65e+05
assign (resid 97 and name HA) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 2651  2.34e+05
assign (resid 97 and name HD1#) (resid 101 and name HD1#) 4.0 2.2 2.0	!#A 2648  1.52e+05

!E98
assign (resid 98 and name HG#) (resid 98 and name HA) 4.0 2.2 1.0	!#A 1114  4.22e+05
assign (resid 98 and name HA) (resid 98 and name HB#) 4.0 2.2 1.0	!#A 724  4.66e+05
assign (resid 98 and name HG#) (resid 99 and name HA) 4.0 2.2 1.0	!#A 941  -5.43e+05
assign (resid 98 and name HB#) (resid 99 and name HB#) 4.0 2.2 1.5	!#A 2342  1.60e+05
assign (resid 98 and name HG#) (resid 99 and name HB#) 4.0 2.2 1.5	!#A 1116  -2.25e+05
assign (resid 98 and name HA) (resid 101 and name HD1#) 3.0 1.2 0.8	!#A 732  7.11e+05
assign (resid 98 and name HA) (resid 101 and name HG2#) 4.0 2.2 1.5	!#A 731  3.44e+05
assign (resid 98 and name HG#) (resid 101 and name HG2#) 4.0 2.2 1.5	!#A 1077  -2.06e+05
assign (resid 98 and name HG#) (resid 101 and name HB) 4.0 2.2 1.0	!#A 1117  -1.53e+05
assign (resid 98 and name HA) (resid 101 and name HB) 4.0 2.2 1.0	!#A 1377  2.72e+05
assign (resid 98 and name HA) (resid 101 and name HG1#) 4.0 2.2 1.0	!#A 722  1.66e+05
assign (resid 98 and name HG#) (resid 102 and name HB#) 4.0 2.2 1.0	!#A 1026  -1.41e+05
assign (resid 98 and name HA) (resid 102 and name HB#) 4.0 2.2 1.2	!#A 727  1.97e+05

!A99
assign (resid 99 and name HA) (resid 100 and name HA) 4.0 2.2 1.0	!#A 937  2.10e+05
assign (resid 99 and name HB#) (resid 100 and name HA) 4.0 2.2 1.5	!#A 1573  1.73e+05
assign (resid 99 and name HA) (resid 101 and name HB) 4.0 2.2 1.0	!#A 2067  1.87e+05
assign (resid 99 and name HA) (resid 102 and name HB#) 4.0 2.2 1.0	!#A 612  -2.75e+05

!T100
assign (resid 100 and name HA) (resid 100 and name HG2#) 2.5 0.7 0.7	!#A 818  2.40e+06
assign (resid 100 and name HA) (resid 100 and name HB) 3.0 1.2 0.5	!#A 816  8.90e+05
assign (resid 100 and name HG2#) (resid 101 and name HA) 4.0 2.2 1.5	!#A 2062  2.05e+05
assign (resid 100 and name HB) (resid 101 and name HG1#) 4.0 2.2 1.0	!#A 1866  1.63e+05
assign (resid 100 and name HG2#) (resid 101 and name HG1#) 4.0 2.2 1.5	!#A 2660  3.08e+05
assign (resid 100 and name HG2#) (resid 103 and name HG#) 4.0 2.2 1.5	!#A 2077  -1.57e+05
assign (resid 100 and name HG2#) (resid 103 and name HB2) 4.0 2.2 1.5	!#A 1206  2.35e+05
assign (resid 100 and name HG2#) (resid 103 and name HG#) 4.0 2.2 1.5	!#A 1162  -2.30e+05
assign (resid 100 and name HA) (resid 103 and name HG#) 4.0 2.2 1.0	!#A 1160  2.27e+05
assign (resid 100 and name HA) (resid 103 and name HA) 4.0 2.2 1.0	!#A 590  2.10e+05
assign (resid 100 and name HA) (resid 103 and name HB1) 4.0 2.2 1.0	!#A 815  3.07e+05
assign (resid 100 and name HA) (resid 103 and name HB2) 4.0 2.2 1.0	!#A 814  3.55e+05
assign (resid 100 and name HG2#) (resid 104 and name HD1#) 2.5 0.7 1.2	!#A 2073  1.35e+07
assign (resid 100 and name HG2#) (resid 104 and name HG) 4.0 2.2 1.5	!#A 2074  3.57e+05
assign (resid 100 and name HA) (resid 104 and name HG) 4.0 2.2 1.0	!#A 817  -1.49e+05

!I101
assign (resid 101 and name HA) (resid 101 and name HD1#) 4.0 2.2 1.5	!#A 909  5.19e+05
assign (resid 101 and name HG2#) (resid 101 and name HB) 3.0 1.2 0.8	!#A 2102  -7.94e+05
assign (resid 101 and name HD1#) (resid 101 and name HB) 3.0 1.2 0.8	!#A 1870  -6.64e+05
assign (resid 101 and name HB) (resid 101 and name HA) 4.0 2.2 1.0	!#A 1376  1.61e+05
assign (resid 101 and name HA) (resid 101 and name HG1#) 4.0 2.2 1.0	!#A 902  2.17e+05
assign (resid 101 and name HG1#) (resid 102 and name HA) 4.0 2.2 2.5	!#A 844  1.81e+05
assign (resid 101 and name HG2#) (resid 102 and name HA) 4.0 2.2 1.5	!#A 511  4.44e+05
assign (resid 101 and name HA) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 906  -1.77e+05
assign (resid 101 and name HG2#) (resid 105 and name HG2#) 3.0 1.2 1.3	!#A 2100  1.37e+06
assign (resid 101 and name HB) (resid 105 and name HB) 4.0 2.2 1.0	!#A 1731  -3.07e+05
assign (resid 101 and name HA) (resid 105 and name HA) 4.0 2.2 1.0	!#A 1241  -2.41e+05
assign (resid 101 and name HA) (resid 105 and name HB) 4.0 2.2 1.0	!#A 1727  3.38e+05
assign (resid 101 and name HG1#) (resid 105 and name HB) 4.0 2.2 1.5	!#A 1726  2.09e+05
assign (resid 101 and name HG2#) (resid 105 and name HA) 4.0 2.2 1.5	!#A 2097  1.59e+05
assign (resid 101 and name HG2#) (resid 105 and name HB) 4.0 2.2 1.5	!#A 2091  2.66e+05

!N102
assign (resid 102 and name HA) (resid 102 and name HB#) 3.0 1.2 0.5	!#A 509  -7.50e+05
assign (resid 102 and name HB#) (resid 103 and name HB2) 4.0 2.2 1.0	!#A 1433  -2.09e+05
assign (resid 102 and name HB#) (resid 103 and name HB1) 4.0 2.2 1.5	!#A 1434  -2.89e+05
assign (resid 102 and name HA) (resid 103 and name HA) 4.0 2.2 1.0	!#A 510  2.10e+05
assign (resid 102 and name HB#) (resid 103 and name HA) 4.0 2.2 1.0	!#A 593  -5.42e+05
assign (resid 102 and name HA) (resid 105 and name HG2#) 3.0 1.2 1.2	!#A 846  1.39e+06
assign (resid 102 and name HA) (resid 105 and name HA) 4.0 2.2 1.0	!#A 1052  -2.07e+05
assign (resid 102 and name HB#) (resid 105 and name HG1#) 4.0 2.2 1.5	!#A 1742  -2.11e+05
assign (resid 102 and name HA) (resid 105 and name HG1#) 3.0 1.2 0.8	!#A 508  1.39e+06
assign (resid 102 and name HA) (resid 105 and name HB) 4.0 2.2 1.0	!#A 507  2.72e+05

!E103
assign (resid 103 and name HB1) (resid 103 and name HA) 3.0 1.2 0.5	!#A 1247  1.22e+06
assign (resid 103 and name HG#) (resid 103 and name HA) 3.0 1.2 0.5	!#A 1163  8.23e+05
assign (resid 103 and name HA) (resid 103 and name HB2) 3.0 1.2 0.5	!#A 588  9.48e+05
assign (resid 103 and name HG#) (resid 104 and name HG) 4.0 2.2 1.0	!#A 1429  -2.18e+05
assign (resid 103 and name HG#) (resid 104 and name HA) 4.0 2.2 1.5	!#A 1666  -2.19e+05
assign (resid 103 and name HG#) (resid 104 and name HD2#) 4.0 2.2 1.5	!#A 2678  -1.95e+05
assign (resid 103 and name HB1) (resid 104 and name HG) 4.0 2.2 1.0	!#A 1819  3.12e+05
assign (resid 103 and name HB1) (resid 104 and name HA) 4.0 2.2 1.0	!#A 1248  1.89e+05
assign (resid 103 and name HA) (resid 104 and name HA) 4.0 2.2 1.0	!#A 479  1.47e+05
assign (resid 103 and name HA) (resid 104 and name HD2#) 4.0 2.2 1.8	!#A 591  -1.56e+05
assign (resid 103 and name HG#) (resid 104 and name HD2#) 4.0 2.2 1.5	!#A 1161  4.63e+05
assign (resid 103 and name HG#) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 1158  -1.89e+05
assign (resid 103 and name HB2) (resid 104 and name HD2#) 4.0 2.2 1.5	!#A 1887  2.09e+05
assign (resid 103 and name HB1) (resid 104 and name HD2#) 4.0 2.2 1.5	!#A 1888  1.74e+05
assign (resid 103 and name HB2) (resid 104 and name HG) 4.0 2.2 1.0	!#A 1427  2.29e+05
assign (resid 103 and name HA) (resid 105 and name HG1#) 4.0 2.2 1.5	!#A 592  -1.86e+05

!L104
assign (resid 104 and name HB1) (resid 104 and name HD2#) 2.5 0.7 0.7	!#A 2274  1.92e+06
assign (resid 104 and name HA) (resid 104 and name HB1) 4.0 2.2 1.0	!#A 809  -4.21e+05
assign (resid 104 and name HA) (resid 104 and name HD2#) 2.5 0.7 0.7	!#A 477  4.68e+06
assign (resid 104 and name HD2#) (resid 104 and name HB2) 4.0 2.2 1.5	!#A 1890  -3.59e+05
assign (resid 104 and name HA) (resid 104 and name HB2) 4.0 2.2 1.0	!#A 475  -2.39e+05
assign (resid 104 and name HB2) (resid 104 and name HD1#) 2.5 0.7 0.7	!#A 1438  1.62e+06
assign (resid 104 and name HA) (resid 104 and name HD1#) 4.0 2.2 1.5	!#A 473  4.52e+05
assign (resid 104 and name HB1) (resid 104 and name HD1#) 3.0 1.2 0.8	!#A 1518  8.69e+05
assign (resid 104 and name HA) (resid 104 and name HG) 4.0 2.2 1.0	!#A 474  3.03e+05
assign (resid 104 and name HA) (resid 105 and name HG1#) 4.0 2.2 1.8	!#A 478  4.50e+05
assign (resid 104 and name HA) (resid 105 and name HA) 4.0 2.2 1.0	!#A 476  3.12e+05

!V105
assign (resid 105 and name HG1#) (resid 105 and name HA) 3.0 1.2 0.8	!#A 2534  2.72e+06
assign (resid 105 and name HG2#) (resid 105 and name HA) 2.5 0.7 0.7	!#A 1739  2.72e+06
assign (resid 105 and name HA) (resid 105 and name HB) 3.0 1.2 0.5	!#A 769  1.29e+06


!within Ref-1 peptide


!P106

!A107
assign (resid 107 and name HB#) (resid 108 and name HN) 4.0 2.2 1.5	!#A 25  1.60e+05
assign (resid 107 and name HA) (resid 108 and name HN) 2.5 0.7 0.4	!#A 27  5.61e+05

!T108
assign (resid 108 and name HN) (resid 108 and name HG2#) 4.0 2.2 1.5	!#A 24  1.07e+05
assign (resid 108 and name HN) (resid 108 and name HB) 4.0 2.2 1.0	!#A 26  1.30e+05
assign (resid 108 and name HN) (resid 108 and name HA) 4.0 2.2 1.0      !new
assign (resid 108 and name HA) (resid 109 and name HN) 2.5 0.7 0.4	!#A 6  1.10e+06
assign (resid 108 and name HB) (resid 109 and name HN) 4.0 2.2 1.0	!#A 18  1.77e+05
assign (resid 108 and name HG2#) (resid 109 and name HN) 4.0 2.2 1.5	!#A 22  1.19e+05
assign (resid 108 and name HN) (resid 109 and name HN) 4.0 2.2 1.0	!#A 45  1.80e+05

!L109
assign (resid 109 and name HN) (resid 109 and name HG) 4.0 2.2 1.0	!#A 19  3.51e+05
assign (resid 109 and name HN) (resid 109 and name HB2) 4.0 2.2 1.0	!#A 20  2.41e+05
assign (resid 109 and name HN) (resid 109 and name HB1) 4.0 2.2 1.0	!#A 21  1.74e+05
assign (resid 109 and name HN) (resid 109 and name HA) 4.0 2.2 1.0      !new
assign (resid 109 and name HA) (resid 110 and name HN) 3.0 1.2 0.5	!#A 8  4.84e+05
assign (resid 109 and name HB#) (resid 110 and name HN) 4.0 2.2 1.0	!#A 11  7.47e+04
assign (resid 109 and name hn) (resid 110 and name hn) 4.0 2.2 1.0

!K110
assign (resid 110 and name HN) (resid 110 and name HG#) 4.0 2.2 1.0	!#A 12  7.87e+04
assign (resid 110 and name HN) (resid 110 and name HA) 4.0 2.2 1.0      !new2
assign (resid 110 and name HN) (resid 110 and name HB#) 4.0 2.2 1.0     !new2
assign (resid 110 and name HA) (resid 111 and name HN) 4.0 2.2 1.0	!#A 33  3.18e+05
assign (resid 110 and name HB#) (resid 111 and name HN) 4.0 2.2 1.0	!#A 39  9.29e+04
assign (resid 110 and name HN) (resid 111 and name HN) 3.0 1.2 0.5	!#A 44  1.34e+05

!I111
assign (resid 111 and name HN) (resid 111 and name HD1#) 4.0 2.2 1.5	!#A 36  1.27e+05
assign (resid 111 and name HG1#) (resid 111 and name HN) 4.0 2.2 1.0	!#A 37  8.02e+04
assign (resid 111 and name HG2#) (resid 111 and name HN) 4.0 2.2 1.5	!#A 38  9.06e+04
assign (resid 111 and name HG1#) (resid 112 and name HN) 4.0 2.2 1.0	!#A 15  2.22e+05
assign (resid 111 and name HD1#) (resid 112 and name HN) 4.0 2.2 1.5	!#A 17  1.27e+05
assign (resid 111 and name HG2#) (resid 114 and name HE1) 4.0 2.2 2.5	!#A 1  1.20e+05

!C112
assign (resid 112 and name HN) (resid 112 and name HA) 3.0 1.2 0.5	!#A 14  2.42e+05
assign (resid 112 and name HB2) (resid 113 and name HN) 4.0 2.2 1.0	!#A 3  8.44e+04
assign (resid 112 and name HB1) (resid 113 and name HN) 4.0 2.2 1.0	!#A 4  1.64e+05

!S113
assign (resid 113 and name HN) (resid 113 and name HA) 4.0 2.2 1.0	!#A 2  3.23e+05
assign (resid 113 and name HN) (resid 113 and name HB#) 3.0 1.2 0.5     !new3
assign (resid 113 and name HN) (resid 112 and name HA) 3.0 1.2 0.5      !new3

!W114
assign (resid 114 and name HN) (resid 113 and name HA) 3.0 1.2 0.5 !new3
assign (resid 114 and name HN) (resid 113 and name HB#) 4.0 2.2 1.0 !new3

!N115
assign (resid 115 and name HN) (resid 114 and name HA) 3.0 1.2 0.5 !new3
assign (resid 115 and name HN) (resid 115 and name HA) 4.0 2.2 1.0 !new3
assign (resid 115 and name HN) (resid 114 and name HD1) 4.0 2.2 1.0 !new3


!V116
assign (resid 116 and name HN) (resid 116 and name HA) 4.0 2.2 1.0 !new3
assign (resid 116 and name HN) (resid 116 and name HB) 4.0 2.2 1.0 !new3
assign (resid 116 and name HN) (resid 116 and name HG*) 3.0 1.2 0.8 !new3
assign (resid 116 and name HN) (resid 115 and name HA) 3.0 1.2 0.5 !new3
assign (resid 116 and name HN) (resid 117 and name HN) 4.0 2.2 1.0 !new3


!D117
assign (resid 117 and name HN) (resid 117 and name HA) 4.0 2.2 1.0 !new3
assign (resid 117 and name HN) (resid 117 and name HB#) 4.0 2.2 1.0 !new3
assign (resid 117 and name HN) (resid 116 and name HA) 3.0 1.2 0.5 !new3
assign (resid 117 and name HN) (resid 116 and name HG*) 3.0 1.2 0.8 !new3

!G118


!P106
assign (resid 106 and name HB1) (resid 106 and name HA) 3.0 1.2 0.3	!#A 46  2.41e+05

!A107

!T108
assign (resid 108 and name HA) (resid 108 and name HG2#) 2.5 0.7 0.7	!#A 40  6.53e+05
assign (resid 108 and name HG2#) (resid 110 and name HE#) 4.0 2.2 1.5	!#A 55  8.15e+04

!L109
assign (resid 109 and name HA) (resid 109 and name HB#) 3.0 1.2 0.3	!#A 35  4.87e+05 hb1
assign (resid 109 and name HA) (resid 109 and name HG) 3.0 1.2 0.6	!#A 37  3.25e+05
assign (resid 109 and name HA) (resid 109 and name HD1#) 4.0 2.2 1.5	!#A 38  2.72e+05
assign (resid 109 and name HA) (resid 109 and name HD2#) 2.5 0.7 0.7	!#A 39  7.19e+05

!K110
assign (resid 110 and name HA) (resid 110 and name HB#) 3.0 1.2 0.3	!#A 26  3.67e+05
assign (resid 110 and name HA) (resid 110 and name HD#) 4.0 2.2 1.0	!#A 27  3.10e+05
assign (resid 110 and name HA) (resid 110 and name HG#) 4.0 2.2 1.0	!#A 28  2.03e+05
assign (resid 110 and name HB#) (resid 110 and name HE#) 4.0 2.2 1.0	!#A 48  1.13e+05
assign (resid 110 and name HG#) (resid 110 and name HE#) 4.0 2.2 1.0	!#A 50  1.48e+05 !hg1
assign (resid 110 and name HD#) (resid 110 and name HB#) 4.0 2.2 1.0	!#A 59  2.00e+05

!I111
assign (resid 111 and name HD1#) (resid 112 and name HA) 4.0 2.2 1.5	!#A 13  2.43e+05
assign (resid 111 and name HG1#) (resid 112 and name HA) 4.0 2.2 2.0	!#A 15  6.86e+04 hg12
assign (resid 116 and name HG*) (resid 113 and name HB#) 3.0 1.2 0.8 !new3
assign (resid 116 and name HG*) (resid 113 and name HA) 4.0 2.2 1.5 !new3
assign (resid 116 and name HG*) (resid 114 and name HZ2) 4.0 2.2 2.5 !new3
assign (resid 116 and name HG*) (resid 114 and name HZ3) 4.0 2.2 2.5 !new3
assign (resid 116 and name HG*) (resid 114 and name HB#) 4.0 2.2 1.5 !new3

!C112

!S113
assign (resid 113 and name HA) (resid 113 and name HB#) 3.0 1.2 0.5  !new3

!W114
assign (resid 114 and name HA) (resid 114 and name HD1) 4.0 2.2 1.0	!#A 1  3.04e+05
assign (resid 114 and name HB#) (resid 114 and name HD1) 4.0 2.2 1.0	!#A 2  6.94e+04
assign (resid 114 and name HB#) (resid 114 and name HE3) 4.0 2.2 1.0	!#A 3  1.03e+05
assign (resid 114 and name HA) (resid 114 and name HE3) 4.0 2.2 1.0	!#A 4  6.42e+04
assign (resid 114 and name HB#) (resid 114 and name HE3) 4.0 2.2 1.0	!#A 5  9.44e+04
assign (resid 114 and name HA) (resid 114 and name HB2) 4.0 2.2 1.0	!#A 17  1.49e+05
assign (resid 114 and name HA) (resid 114 and name HB1) 4.0 2.2 1.0	!#A 18  7.82e+04

!N115
assign (resid 115 and name HA) (resid 115 and name HB#) 3.0 1.2 0.5 !new3

!V116
assign (resid 116 and name HA) (resid 116 and name HB) 3.0 1.2 0.5 !new3
assign (resid 116 and name HA) (resid 116 and name HG*) 3.0 1.2 0.8 !new3

!D117

!G118


!between hTRX and Ref-1 peptide
!EDIT_HISTORY
!	A(46)  internoe.pck   Fri Oct 20 15:08:50 1995


!M1

!V2

!K3

!Q4

!I5

!E6

!S7

!K8

!T9

!A10

!F11

!Q12

!E13

!A14

!L15

!D16

!A17

!A18

!G19

!D20

!K21

!L22

!V23

!V24

!V25

!D26

!F27

!S28

!A29
assign (resid 29 and name HB#) (resid 114 and name HZ2) 4.0 2.2 1.5     !new2 

!T30

!W31

!C32

!G33

!P34
assign (resid 34 and name HG#) ((resid 110 and name HA) 
          or (resid 112 and name HB1)) 4.0 2.2 1.0	!#A 10  2.38e+05
assign (resid 34 and name HB1) ((resid 110 and name HA) 
           or (resid 112 and name HB1)) 4.0 2.2 1.0	!#A 1  2.74e+05

!A35

!K36

!M37

!I38

!K39

!P40

!F41

!F42

!H43

!S44

!L45

!S46

!E47

!K48

!Y49

!S50

!N51

!V52

!I53

!F54

!L55

!E56

!V57

!D58

!V59
assign (resid 59 and name HG1#) (resid 114 and name HZ2) 3.0 1.2 0.8	!#A 43  5.56e+05
assign (resid 59 and name HG1#) (resid 114 and name HH2) 3.0 1.2 0.8	!#A 44  7.13e+05
assign (resid 59 and name HG1#) (resid 114 and name HZ3) 4.0 2.2 1.5	!#A 45  4.16e+05
assign (resid 59 and name HG2#) (resid 114 and name HZ2) 4.0 2.2 1.5	!#A 30  2.30e+05
assign (resid 59 and name HG2#) (resid 114 and name HH2) 4.0 2.2 1.5	!#A 31  2.26e+05

!D60

!D61

!A62

!Q63

!D64

!V65

!A66
assign (resid 66 and name hb#) (resid 114 and name hz3) 4.0 2.2 2.5

!S67

!E68

!A69

!E70

!V71
assign (resid 71 and name HG1#) (resid 114 and name HZ2) 4.0 2.2 1.5	!#A 26  2.26e+05
assign (resid 71 and name HG1#) (resid 114 and name HE3) 4.0 2.2 1.5	!#A 27  5.20e+05
assign (resid 71 and name HG1#) (resid 114 and name HZ3) 4.0 2.2 1.5	!#A 28  4.22e+05
assign (resid 71 and name HG2#) (resid 114 and name HE3) 4.0 2.2 2.5	!#A 33  3.07e+05
assign (resid 71 and name HG2#) (resid 114 and name HZ3) 4.0 2.2 1.5	!#A 34  2.88e+05
assign (resid 71 and name HB) (resid 114 and name HZ3) 4.0 2.2 2.0	!#A 4  1.90e+05
assign (resid 71 and name HB) (resid 114 and name HE3) 4.0 2.2 1.0	!#A 3  1.71e+05

!K72
assign (resid 72 and name ha) (resid 114 and name he3) 4.0 1.0 10.0
assign (resid 72 and name ha) (resid 114 and name hz3) 5.0 1.0 50.0
assign (resid 72 and name ha) (resid 114 and name hb#) 5.0 1.0 50.0
assign (resid 72 and name ha) (resid 114 and name hd1) 5.0 1.0 50.0

!A73
assign (resid 73 and name HB#) (resid 111 and name HG1#) 3.0 1.2 1.3	!#A 18  8.75e+05 hg11
assign (resid 73 and name HB#) (resid 111 and name HD1#) 3.0 1.2 1.3	!#A 21  1.20e+06
assign (resid 73 and name HB#) (resid 111 and name HG2#) 2.5 0.7 1.2	!#A 22  2.22e+06
assign (resid 73 and name HA) (resid 111 and name HG2#) 4.0 2.2 1.5	!#A 7  -2.03e+05
assign (resid 73 and name HB#) (resid 113 and name HB#) 4.0 2.2 1.5 !new3
assign (resid 73 and name HB#) (resid 113 and name HA) 3.0 1.2 1.0 !new3
assign (resid 73 and name HA) (resid 113 and name HA) 4.0 2.2 1.0      !new3
assign (resid 73 and name HA) (resid 114 and name HB#) 4.0 2.2 1.0      !new2

!T74
assign (resid 74 and name HG2#) (resid 114 and name HZ2) 4.0 2.2 1.5	!#A 39  2.84e+05
assign (resid 74 and name HG2#) (resid 114 and name HB#) 4.0 2.2 1.5	!#A 54  3.04e+05 hb2
assign (resid 74 and name HG2#) (resid 114 and name HZ3) 4.0 2.2 1.5	!#A 40  1.79e+05
assign (resid 74 and name hn) (resid 112 and name hn) 4.0 2.2 1.0
assign (resid 74 and name HG2#) (resid 114 and name HA) 4.0 2.2 1.5	!new2 41  2.07e+05

!P75

!T76

!F77

!Q78

!F79

!F80

!K81

!K82

!G83

!Q84

!K85

!V86

!G87

!E88

!F89

!S90
assign (resid 90 and name HB2) (resid 111 and name HD1#) 4.0 2.2 1.5	!#A 11  4.69e+05
assign (resid 90 and name HB2) (resid 111 and name HG2#) 4.0 2.2 1.5	!#A 12  4.96e+05
assign (resid 90 and name HB1) (resid 111 and name HD1#) 3.0 1.2 1.2	!#A 13  6.05e+05
assign (resid 90 and name HB1) (resid 111 and name HG2#) 4.0 2.2 1.5	!#A 14  3.98e+05

!G91
assign (resid 91 and name HN) (resid 111 and name HD1#) 4.0 2.2 1.0     !new2
assign (resid 91 and name HN) (resid 111 and name HA) 4.0 2.2 1.0       !new2
assign (resid 91 and name HA2) (resid 111 and name HD1#) 3.0 1.2 0.8	!#A 23  -2.31e+05
assign (resid 91 and name HA1) (resid 111 and name HD1#) 4.0 2.2 1.5	!#A 25  -2.32e+05
assign (resid 91 and name HA2) (resid 111 and name HG1#) 3.0 1.2 0.8    !new2

!A92
assign (resid 92 and name HB#) (resid 110 and name HB#) 3.0 1.2 0.8	!#A 47  5.57e+05
assign (resid 92 and name HB#) (resid 110 and name HA) 4.0 2.2 1.5	!#A 50  3.91e+05
assign (resid 92 and name HB#) (resid 110 and name HG#) 3.0 1.2 0.8	!#A 52  5.22e+05
assign (resid 92 and name HN) (resid 111 and name HD1#) 4.0 2.2 1.5    !new2
assign (resid 92 and name HB#) (resid 111 and name HD1#) 4.0 2.2 1.5	!#A 49  2.61e+05
assign (resid 92 and name HN) (resid 110 and name HB#) 2.5 0.7 0.5     !new2
assign (resid 92 and name HB#) (resid 111 and name HG1#) 4.0 2.2 1.5	!#A 53  6.03e+05

!N93

!K94

!E95

!K96

!L97

!E98

!A99

!T100

!I101

!N102

!E103

!L104

!V105

!P106

!A107

!T108

!L109

!K110

!I111

!C112

!S113

!W114

!N115

!V116

!D117

!G118



Please acknowledge these references in publications where the data from this site have been utilized.

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