*HEADER    ISOMERASE                               10-JUN-13   2M9I              
*TITLE     NMR SOLUTION STRUCTURE OF PIN1 WW DOMAIN VARIANT 6-1                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE NIMA-INTERACTING 1;    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: MODIFIED WW DOMAIN (UNP RESIDUES 6-39);                    
*COMPND   5 SYNONYM: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE PIN1, PPIASE PIN1,      
*COMPND   6 ROTAMASE PIN1;                                                       
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606                                                 
*KEYWDS    N-GLYCOSYLATION, ENHANCED AROMATIC SEQUON, WW DOMAIN, CH-PI           
*KEYWDS   2 INTERACTION, ISOMERASE                                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    19                                                                    
*AUTHOR    S.ENCK, W.CHEN, J.L.PRICE, E.T.POWERS, C.WONG, H.J.DYSON, J.W.KELLY   
*REVDAT   1   26-JUN-13 2M9I    0                                                


# SEA005  6-residue-turn without GlcNAc

# intra-residue distance restraints

# HA/H

# 6 TRP HA 6 TRP H 3.27  # 93  0.2007
# 7 GLU HA 7 GLU H 3.23  # 130 0.2177
# 8 LYS HA 8 LYS H 3.20  # 123 0.2297
# 10 MET HA 10 MET H 3.59  # 104 0.1185 slight ol
# 17 VAL HA 17 VAL H 3.29  # 118 0.1937
# 18 TYR HA 18 TYR H 3.33  # 119 0.1808
# 19 TYR HA 19 TYR H 3.48  # 124 0.1415
# 20 PHE HA 20 PHE H 3.81  # 125 0.0844
# 23 ILE HA 23 ILE H 2.93  # 113 0.3852
# 26 ALA HA 26 ALA H 3.16  # 90  0.2452
# 31 ARG HA 31 ARG H 3.22  # 295 0.2221
# 33 SER HA 33 SER H 2.97  # 110 0.3572

# HB/H

8 LYS HB2 8 LYS H 4.00  # 157 0.3899
8 LYS HB3 8 LYS H 4.00  # 158 0.5224
9 ARG QB 9 ARG H 5.00  # 141,142 0.1547 2 protons
11 PHE HB2 11 PHE H 4.00  # 216 0.1313
11 PHE HB3 11 PHE H 4.00  # 217 0.2910
14 ASN HB2 14 ASN H 4.00  # 236 0.1025
14 ASN HB3 14 ASN H 4.27  # 237 0.0465
17 VAL HB 17 VAL H 3.00  # 174 0.4836
18 TYR HB2 18 TYR H 5.00  # 186 0.0523
18 TYR HB3 18 TYR H 4.00  # 187 0.1075
20 PHE HB3 20 PHE H 4.00  # 182 0.1882
20 PHE HB2 20 PHE H 4.00  # 183 0.2380
23 ILE HB 23 ILE H 3.00  # 172 0.6863
24 THR HB 24 THR H 4.00  # 233 0.1115
25 ASN HB2 25 ASN H 4.00  # 198 0.2024
25 ASN HB3 25 ASN H 4.50  # 199 0.2024
30 GLU HB2 30 GLU H 4.00  # 159 0.3498
30 GLU HB3 30 GLU H 4.00  # 160 0.4063
31 ARG QB 31 ARG H 4.00  # 147,148 1.1234 2 protons

# HB/HA

6 TRP HB2 6 TRP HA 4.00  # 279 0.3157  slight ol
6 TRP HB3 6 TRP HA 4.00  # 280 0.3086
8 LYS HB2 8 LYS HA 4.00  # 253 0.3675
8 LYS HB3 8 LYS HA 4.00  # 254 0.4478  slight ol
11 PHE HB2 11 PHE HA 4.00  # 283 0.2038
11 PHE HB3 11 PHE HA 4.00  # 284 0.2489
17 VAL HB 17 VAL HA 4.00  # 261 0.3455
19 TYR HB2 19 TYR HA 4.00  # 271 0.2956
19 TYR HB3 19 TYR HA 4.00  # 272 0.4036
21 ASN HB2 21 ASN HA 4.00  # 246 0.2312
21 ASN HB3 21 ASN HA 4.00  # 247 0.2186  slight ol
22 HIS HB3 22 HIS HA 3.00  # 281 0.6755  slight ol
22 HIS HB2 22 HIS HA 3.00  # 282 0.8230  slight ol
24 THR HB 24 THR HA 3.00  # 291 1.0359
25 ASN HB2 25 ASN HA 3.00  # 275 0.5342
25 ASN HB3 25 ASN HA 3.00  # 276 0.6943
29 PHE HB2 29 PHE HA 3.00  # 277 0.9334  slight ol
29 PHE HB3 29 PHE HA 3.00  # 278 0.5268
30 GLU HB2 30 GLU HA 3.00  # 255 0.7255  slight ol
30 GLU HB3 30 GLU HA 3.00  # 256 0.6068  slight ol
33 SER HB2 33 SER HA 4.00  # 285 0.5672
33 SER HB3 33 SER HA 4.00  # 286 0.5073

# others

6 TRP HZ3 6 TRP HA 5.00  # 459 0.0719
6 TRP HD1 6 TRP HA 5.00  # 460 0.0462
16 THR QG2 16 THR H 5.00  # 372 0.1692
18 TYR QD 18 TYR H 4.00  # 517 0.2801
19 TYR QD 19 TYR H 4.00  # 528 0.5456
20 PHE QD 20 PHE HA 4.00  # 458 0.4163
20 PHE QD 20 PHE H 5.00  # 459,538 0.0978
24 THR QG2 24 THR H 4.00  # 344 0.6218
29 PHE QD 29 PHE H 4.00  # 502 0.1367

# sequential distance restraints

# H/H: values of both cross peaks were mediated

5 GLY H 6 TRP H 4.00  # 59,60 0.1712 calibration peak
7 GLU H 8 LYS H 5.00  # 28,29 0.0502 calibration peak
8 LYS H 9 ARG H 5.00  # 22 0.1573 calibration peak
9 ARG H 10 MET H 5.00  # 19,25 0.0769 calibration peak
14 ASN H 15 GLY H 4.00  # 85,86 0.1461
15 GLY H 16 THR H 4.00  # 61,62 0.2536
16 THR H 17 VAL H 4.50  # 63,64 0.0807
18 TYR H 19 TYR H 4.50  # 26 0.0415 calibration peak
20 PHE H 21 ASN H 5.00  # 20,24 0.0325 calibration peak
22 HIS H 23 ILE H 4.00  # 77,78 0.3325
23 ILE H 24 THR H 3.00  # 57,58 0.5562
24 THR H 25 ASN H 3.00  # 55,56 0.6130
25 ASN H 26 ALA H 4.00  # 71 0.4227
29 PHE H 30 GLU H 4.00  # 84 0.1733
30 GLU H 31 ARG H 5.00  # 82 0.0823
33 SER H 34 GLY H 4.00  # 67,68 0.2055

# HA/H

6 TRP HA 7 GLU H 3.00  # 17 0.6987 calibration peak
7 GLU HA 8 LYS H 3.00  # 12 1.0004 calibration peak
9 ARG HA 10 MET H 3.00  # 7 1.0000 calibration peak
14 ASN HA 15 GLY H 4.00  # 115 0.2369
15 GLY HA2 16 THR H 4.00  # 99 0.2557
15 GLY HA3 16 THR H 4.00  # 100 0.3303
17 VAL HA 18 TYR H 3.00  # 11 0.8532 calibration peak
20 PHE HA 21 ASN H 4.00  # 9 0.4261 calibration peak
21 ASN HA 22 HIS H 3.00  # 8 0.7429 calibration peak
# 23 ILE HA 22 HIS H 5.00  # 108 0.0328
23 ILE HA 24 THR H 4.00  # 94 0.1389
25 ASN HA 26 ALA H 4.00  # 89 0.2866
26 ALA HA 27 SER H 3.00  # 10 0.9694 calibration peak
27 SER HA 28 GLN H 4.00  # 16 0.2299 calibration peak
28 GLN HA 29 PHE H 4.00  # 13 0.2154 calibration peak
30 GLU HA 31 ARG H 3.00  # 117 1.2795 slight ol
32 PRO HA 33 SER H 3.00  # 109 0.8672

# HA/HA

# 3 PRO HA 4 PRO HA 3.23  # 294 0.2171 
# 26 ALA HA 27 SER HA 3.81  # 133 0.0844 
# 27 SER HA 28 GLN HA 4.41  # 134 0.0393 
# 30 GLU HA 31 ARG HA 3.82  # 131 0.0835 slight ol
# 32 PRO HA 33 SER HA 3.86  # 132 0.0789 

# HB/H

4 PRO HB2 5 GLY H 4.00  # 169 0.1562
4 PRO HB3 5 GLY H 4.00  # 170 0.1800
6 TRP HB2 7 GLU H 4.50  # 206 0.2326
6 TRP HB3 7 GLU H 4.00  # 207 0.1212
8 LYS HB2 9 ARG H 4.00  # 153 0.1435
8 LYS HB3 9 ARG H 4.50  # 154 0.1910
17 VAL HB 18 TYR H 4.00  # 173 0.2710
19 TYR HB2 20 PHE H 4.00  # 188 0.1194 HF cross peak
19 TYR HB3 20 PHE H 4.00  # 189 0.2074 HF cross peak
20 PHE HB3 21 ASN H 5.00  # 180 0.0539 HF cross peak
20 PHE HB2 21 ASN H 4.50  # 181 0.1412 HF cross peak
23 ILE HB 24 THR H 3.00  # 171 0.5820
24 THR HB 25 ASN H 4.00  # 235 0.1098
25 ASN HB2 26 ALA H 5.00  # 194 0.0728
25 ASN HB3 26 ALA H 5.00  # 195 0.0556
# 26 ALA QB 25 ASN H 5.00  # 241 0.1576
26 ALA QB 27 SER H 5.00  # 245 0.4380
30 GLU HB2 31 ARG H 4.00  # 161 0.2698 HF cross peak
30 GLU HB3 31 ARG H 4.50  # 162 0.2629 HF cross peak
32 PRO HB3 33 SER H 4.00  # 145 0.1358
32 PRO HB2 33 SER H 4.00  # 146 0.1900

# HB/HA

# 20 PHE HB2 19 TYR HA 3.61  # 402 0.1141
# 21 ASN HB2 20 PHE HA 4.00  # 299 0.0648
# 26 ALA QB 27 SER HA 5.23  # 356 0.0487
# 28 GLN QB 27 SER HA 5.20  # 388 0.0506 2 protons
# 32 PRO HB3 31 ARG HA 3.37  # 315 0.1704

# SC/SC

# 2 LEU HB23 3 PRO HD3 3.21  # 359 0.2262
# 16 THR QG2 17 VAL HB 4.07  # 360 0.2897
# 22 HIS HD2 23 ILE QG2 5.69  # 342 0.0294
# 22 HIS HD2 23 ILE QD1 4.48  # 341,475 0.1414 
# 23 ILE HB 24 THR QG2 3.66  # 343 0.6867
# 31 ARG HG2 32 PRO HD3 3.28  # 382 0.1994
# 31 ARG HG3 32 PRO HD3 3.19  # 383 0.2320
# 31 ARG HG2 32 PRO HD2 3.70  # 384 0.0999
# 31 ARG HG3 32 PRO HD2 3.62  # 385 0.1132

# others

# 6 TRP HZ3 7 GLU H 5.60  # 541 0.1271
7 GLU HB2 8 LYS H 4.50  # 387 0.3498
7 GLU HG2 8 LYS H 4.00  # 396 0.1610
7 GLU HG3 8 LYS H 4.50  # 397 0.1199
8 LYS HG2 9 ARG H 4.00  # 349 0.1611
10 MET HG2 11 PHE H 4.00  # 394 0.1219
10 MET HG3 11 PHE H 4.00  # 395 0.1263
16 THR QG2 17 VAL HA 5.00  # 365 0.0648
17 VAL QG1 18 TYR H 5.00  # 345 0.2481
17 VAL QG2 18 TYR H 5.00  # 346 0.3407
18 TYR QD 17 VAL HA 4.00  # 429 0.2007
18 TYR QD 19 TYR H 4.00  # 527 0.3142
19 TYR QD 20 PHE H 4.50  # 537 0.1193
# 22 HIS HD2 23 ILE HA 6.00  # 478 0.0597
24 THR QG2 25 ASN H 5.00  # 347 0.1739
24 THR QG2 23 ILE H 5.00  # 348 0.2771
32 PRO HB3 33 SER H 4.00  # 143 0.1278
32 PRO HB2 33 SER H 4.00  # 144 0.1554

# long-range distances on turn side

# BB/BB

9 ARG H 19 TYR HA 4.00  # 36 0.1590
9 ARG H 18 TYR H 4.00  # 46,47 0.2057
9 ARG H 20 PHE H 4.50  # 28,29 0.0502
10 MET HA 18 TYR H 4.00  # 120 0.2082
11 PHE H 16 THR H 5.00  # 66 0.0296
11 PHE H 18 TYR H 5.00  # 87,519 0.0733

# SC/BB

8 LYS HG2 18 TYR H 4.00  # 335 0.0897
9 ARG QB 18 TYR H 6.00  # 516 0.0273 2 protons
10 MET HG2 15 GLY HA2 3.00  # 389 0.0746
10 MET HG2 15 GLY HA3 4.00  # 390 0.0827
10 MET HG3 15 GLY HA3 4.00  # 391 0.1086
10 MET HG2 17 VAL HA 4.50  # 392 0.1120
10 MET HG3 17 VAL HA 4.50  # 393 0.0862
11 PHE HB2 15 GLY H 5.00  # 514 0.0431
11 PHE HB3 15 GLY H 5.00  # 515 0.0541
11 PHE HB2 16 THR H 4.00  # 210,212 0.0868
11 PHE HB3 16 THR H 3.00  # 211,213 0.2437
16 THR QG2 11 PHE H 6.00  # 373 0.0370
17 VAL QG1 9 ARG H 5.60  # 332,524 0.1053
17 VAL QG2 9 ARG H 5.60  # 336 0.2468
17 VAL QG1 10 MET HA 5.60  # 328 0.0674
# 17 VAL QG1 11 PHE H 6.00  # 333,531 0.0409
17 VAL QG2 11 PHE H 6.00  # 532 0.0517
20 PHE HB2 7 GLU H 5.60  # 179 0.0408
18 TYR QD 10 MET HA 4.00  # 430 0.1031
18 TYR QD 20 PHE HA 5.00  # 431 0.0660
20 PHE QD 22 HIS HA 4.00  # 457 0.4604
20 PHE QE 22 HIS HA 4.00  # 474 0.7343
20 PHE HZ 22 HIS HA 4.00  # 482 0.6238
20 PHE HZ 25 ASN H 4.50  # 483,511 0.1149
20 PHE HB2 27 SER HA 4.00  # 404 0.2511
22 HIS HD2 6 TRP HA 5.00  # 480 0.0319
22 HIS HD2 7 GLU HA 5.00  # 479 0.0313
24 THR QG2 26 ALA H 5.00  # 334 0.1161
29 PHE QD 19 TYR H 5.00  # 503 0.0469

# SC/SC

7 GLU HG2 22 HIS HD2 5.00  # 476 0.0508
7 GLU HG3 22 HIS HD2 5.00  # 477 0.0461
9 ARG QB 20 PHE QD 6.00  # 452 0.0233 2 protons
9 ARG HG2 20 PHE QD 5.00  # 453 0.0486
9 ARG HG3 20 PHE QD 5.00  # 454 0.0636
16 THR QG2 29 PHE QD 5.00  # 497 0.1700
18 TYR QD 29 PHE QD 5.00  # 433 0.0553
20 PHE QD 22 HIE HB3 4.00  # 455 0.1916
20 PHE QD 22 HIE HB2 4.00  # 456 0.1098

# long-range distances on beta sheet side

# BB/BB

4 PRO HA 6 TRP H 4.00  # 92 0.1678 006 ol
6 TRP HA 21 ASN HA 4.00  # 30 0.2065
6 TRP HA 22 HIE H 4.00  # 107 0.1750
7 GLU H 20 PHE H 4.00  # 44,45 0.1386
7 GLU H 21 ASN HA 4.00  # 35 0.2253
7 GLU H 22 HIS H 5.00  # 79,80 0.0673
8 LYS HA 19 TYR HA 4.00  # 31 0.1001
8 LYS HA 20 PHE H 4.00  # 40 0.1638
9 ARG H 18 TYR H 4.00  # 46,47 0.2057
9 ARG H 19 TYR HA 4.00  # 36 0.1590
9 ARG H 20 PHE H 5.00  # 48,49 0.0607
19 TYR H 27 SER HA 5.00  # 37,38 0.0440
19 TYR H 28 GLN H 5.00  # 50 0.0697
20 PHE H 27 SER HA 5.60  # 126 0.0203
20 PHE HA 27 SER HA 4.00  # 33 0.3694
20 PHE HA 28 GLN H 5.00  # 42,43 0.0479
21 ASN HA 23 ILE H 4.00  # 114 0.1255
21 ASN H 27 SER HA 4.00  # 41 0.1064
22 HIS H 24 THR H 4.50  # 76 0.1286
23 ILE H 25 ASN H 4.00  # 72,73 0.2089
23 ILE HA 25 ASN H 5.00  # 101 0.0678

# SC/BB

# 2 LEU QD1 7 GLU H 6.00   # 337 0.0605
2 LEU HB2 6 TRP H 5.50  # 149 0.0891
2 LEU HB3 6 TRP H 6.00  # 150 0.0522
# 2 LEU QD2 6 TRP H 6.00  # 331 0.0811
# 2 LEU QD2 6 TRP HA 6.00  # 327 0.0826
6 TRP HE1 3 PRO HA 6.00  # 553 0.0419
# 6 TRP HE3 19 TYR H 5.60  # 529 0.0361
# 6 TRP HE3 20 PHE H 4.00  # 539 0.1043
# 6 TRP HZ2 32 PRO HA 4.00  # 496 0.2877
# 6 TRP HE1 32 PRO HA 6.00  # 552 0.0231
19 TYR QD 8 LYS H 4.50  # 449,451 0.0911
19 TYR QE 8 LYS H 4.00  # 445,447 0.0754
19 TYR QD 9 ARG H 4.50  # 448,450 0.1072
19 TYR QE 9 ARG H 5.60  # 444,446 0.0728
19 TYR HB3 28 GLN H 5.00  # 191 0.0418
20 PHE HB3 7 GLU H 4.00  # 178 0.1361
20 PHE HB2 7 GLU H 5.60  # 179 0.0408
21 ASN HB2 6 TRP HA 5.00  # 298 0.0713
21 ASN HB2 26 ALA H 4.00  # 135,136 0.1621
21 ASN HB3 26 ALA H 4.00  # 481 0.1659
23 ILE QD1 4 PRO HA 6.00  # 322 0.0519
23 ILE QD1 5 GLY H 5.60  # 329,523 0.0527
23 ILE QD1 5 GLY HA2 5.00  # 318 0.3168
23 ILE QD1 5 GLY HA3 5.00  # 320 0.3994
23 ILE QG2 5 GLY HA2 6.00  # 319 0.0674 slight ol
# 23 ILE QG2 25 ASN H 6.00  # 323 0.0690
24 THR HB 26 ALA H 5.00  # 230,231 0.0573
26 ALA QB 20 PHE HA 6.00  # 355 0.0217
26 ALA QB 21 ASN H 5.00  # 242,243 0.0894
28 GLN QG 30 GLU H 5.00  # 398 0.1771 2 protons
32 PRO HG2 2 LEU HA 5.20  # 313 0.0317

# SC/SC

2 LEU HB2 6 TRP HB3 5.00  # 358 0.2144
2 LEU QD2 6 TRP HB3 5.50  # 326 0.1830
# 2 LEU QD1 6 TRP HD1 6.00  # 330 0.0521
2 LEU QD2 32 PRO HG3 5.60  # 307 0.0551
2 LEU QD2 32 PRO HG2 5.00  # 308 0.1889
3 PRO HB2 6 TRP HD1 4.00  # 374 0.2019
3 PRO HG3 6 TRP HD1 4.80  # 375 0.2228
3 PRO HB2 6 TRP HE1 5.00  # 376,547 0.0612
3 PRO HB3 6 TRP HE1 5.00  # 549 0.0518
3 PRO HG2 6 TRP HE1 5.00  # 377,548 0.0497
3 PRO HG2 6 TRP HE1 4.00  # 381 0.1169
3 PRO HG2 6 TRP HD1 4.00  # 380 0.5307
3 PRO HD2 6 TRP HE1 5.00  # 550 0.0553
3 PRO HD3 6 TRP HE1 5.00  # 551 0.0480
# 3 PRO HB2 32 PRO HD3 5.00  # 386 0.0730
# 3 PRO HB2 32 PRO HG3 6.00  # 301 0.0291
3 PRO HD2 32 PRO HG3 5.00  # 303 0.0585
3 PRO HD3 32 PRO HG3 6.00  # 304 0.0618
3 PRO HB2 32 PRO HG2 5.50  # 306 0.0906
3 PRO HD2 32 PRO HG2 4.50  # 311 0.1156
3 PRO HD3 32 PRO HG2 5.50  # 312 0.1078
3 PRO HD2 32 PRO HB3 4.50  # 316 0.1792
3 PRO HD3 32 PRO HB2 5.50  # 317 0.1000
# 6 TRP HE3 19 TYR HB2 4.00  # 399 0.4116
6 TRP HB2 19 TYR QE 5.60  # 442 0.0235
6 TRP HB3 19 TYR QE 5.00  # 443 0.0351
# 6 TRP HE3 21 ASN HB2 4.00  # 489 0.1498
6 TRP HH2 21 ASN HB2 4.00  # 462 0.0874
6 TRP HH2 21 ASN HB3 5.00  # 463 0.1014
# 6 TRP HZ2 21 ASN HB2 4.00  # 492 0.1025
6 TRP HE1 21 ASN HB2 5.00  # 546 0.0333
6 TRP HZ3 26 ALA QB 5.00  # 357 0.1041
# 6 TRP HZ2 26 ALA QB 5.00  # 495 0.2034
6 TRP HB2 32 PRO HG3 4.00  # 302 0.0964
6 TRP HB2 32 PRO HG2 4.00  # 309 0.0862
6 TRP HB3 32 PRO HG2 6.00  # 310 0.0344
6 TRP HZ3 32 PRO HG3 6.00  # 305,464 0.0574
6 TRP HZ3 32 PRO HG2 5.60  # 314 0.0520
# 6 TRP HE1 32 PRO HB3 5.00  # 324,542 0.0606
# 6 TRP HE1 32 PRO HB2 4.50  # 325,543 0.0820
6 TRP HD1 32 PRO HG3 5.00  # 465 0.0442
6 TRP HD1 32 PRO HG2 5.00  # 466 0.0369
# 6 TRP HE3 32 PRO HG3 4.50  # 490 0.0942
# 6 TRP HE3 32 PRO HG2 5.00  # 491 0.0468
# 6 TRP HZ2 32 PRO HG3 5.60  # 493 0.0913
# 6 TRP HZ2 32 PRO HG2 5.60  # 494 0.0401
6 TRP HE1 32 PRO HG3 5.00  # 544 0.0273
6 TRP HE1 32 PRO HG2 5.60  # 545 0.0176
19 TYR QD 31 ARG QB 5.00  # 441 0.2339 2 protons
19 TYR QD 31 ARG HG2 4.00  # 439 0.1757
19 TYR QD 31 ARG HG3 4.00  # 440 0.1518
19 TYR QE 31 ARG QB 4.00  # 438 0.4954 2 protons
19 TYR QE 31 ARG HG2 4.00  # 436 0.3437
19 TYR QE 31 ARG HG3 4.00  # 437 0.2368
19 TYR QE 31 ARG QD 5.00  # 207 0.1212 2 protons
19 TYR HB3 32 PRO HD3 4.00  # 405 0.4572
19 TYR HB3 32 PRO HD2 4.00  # 406 0.4366
21 ASN HB2 6 TRP HZ3 4.00  # 300 0.0798
21 ASN HB2 24 THR QG2 5.60  # 297 0.0481
21 ASN HB2 26 ALA QB 5.00  # 296 0.1607
24 THR HB 26 ALA QB 5.00  # 354 0.2399

# Hydrogen bonding restraints SEA005  6-residue-turn without GlcNAc

# Hbonds.lol  (lol = lower distance limit)

# 6 TRP  H     3 PRO  O          1.80     # +2.2  OK
# 6 TRP  N     3 PRO  O          2.70     # +2.2
# 7 GLU  H    20 PHE  O          1.80     # -2.0  OK
# 7 GLU  N    20 PHE  O          2.70     # -2.0
# 9 ARG  H    18 TYR  O          1.80     # -3.1  OK
# 9 ARG  N    18 TYR  O          2.70     # -3.1
# 11 PHE  H   16 THR  O          1.80     # -2.8  OK
# 11 PHE  N   16 THR  O          2.70     # -2.8
# 14 ASN  H   11 PHE  O          1.80     # -0.4  PDB: big angle +0.30
# 14 ASN  N   11 PHE  O          2.70     # -0.4
# 15 GLY  H   14 ASN  OD1        1.80     # -5.5  bridged with THR16 +0.60
# 15 GLY  N   14 ASN  OD1        2.70     # -5.5
# 16 THR  H   14 ASN  OD1        1.80     # -2.8  bridged with GLY15 +0.60
# 16 THR  N   14 ASN  OD1        2.70     # -2.8
# 18 TYR  H    9 ARG  O          1.80     # -1.5  OK
# 18 TYR  N    9 ARG  O          2.70     # -1.5
# 19 TYR  H   28 GLN  O          1.80     # -5.5  C-terminal mobility or Ar sc? +0.60
# 19 TYR  N   28 GLN  O          2.70     # -5.5
# 20 PHE  H    7 GLU  O          1.80     # -0.2  OK
# 20 PHE  N    7 GLU  O          2.70     # -0.2
# 21 ASN  H   26 ALA  O          1.80     # -1.8  OK
# 21 ASN  N   26 ALA  O          2.70     # -1.8
# 22 HIS  H    5 GLY  O          1.80     # -0.5  PDB: big angle +0.30
# 22 HIS  N    5 GLY  O          2.70     # -0.5
# 23 ILE  H   21 ASN  OD1        1.80     # -5.1  bridged with THR24 +0.30
# 23 ILE  N   21 ASN  OD1        2.70     # -5.1
# 24 THR  H   21 ASN  OD1        1.80     # -0.6  bridged with ILE23 +0.30
# 24 THR  N   21 ASN  OD1        2.70     # -0.6
# 25 ASN  H   21 ASN  O          1.80     # -1.7  PDB: big angle +0.30
# 25 ASN  N   21 ASN  O          2.70     # -1.7
# 26 ALA  H   24 THR  OG1        1.80     # -0.1  OK +0.20
# 26 ALA  N   24 THR  OG1        2.70     # -0.1
# 28 GLN  H   19 TYR  O          1.80     # -7.0  but present in PDB. Ar sc? +0.80
# 28 GLN  N   19 TYR  O          2.70     # -7.0
# 29 PHE  H   30 GLU  OE1        1.80     # -5.4  high mobility? compare 4res.turn +0.60
# 29 PHE  N   30 GLU  OE1        2.70     # -5.4

# Hbonds.upl  (upl = upper distance limit)

6 TRP  H     3 PRO  O          2.30     # +2.2  OK
6 TRP  N     3 PRO  O          3.30     # +2.2
7 GLU  H    20 PHE  O          2.30     # -2.0  OK
7 GLU  N    20 PHE  O          3.00     # -2.0
9 ARG  H    18 TYR  O          2.00     # -3.1  OK
9 ARG  N    18 TYR  O          3.00     # -3.1
11 PHE  H   16 THR  O          2.00     # -2.8  OK
11 PHE  N   16 THR  O          3.00     # -2.8
14 ASN  H   11 PHE  O          2.30     # -0.4  PDB: big angle +0.30
14 ASN  N   11 PHE  O          3.30     # -0.4
15 GLY  H   14 ASN  OD1        2.80     # -5.5  bridged with THR16 +0.60
15 GLY  N   14 ASN  OD1        3.60     # -5.5
16 THR  H   14 ASN  OD1        2.30     # -2.8  bridged with GLY15 +0.60
16 THR  N   14 ASN  OD1        3.20     # -2.8
18 TYR  H    9 ARG  O          2.00     # -1.5  OK
18 TYR  N    9 ARG  O          3.00     # -1.5
19 TYR  H   28 GLN  O          2.60     # -5.5  C-terminal mobility or Ar sc? +0.60
19 TYR  N   28 GLN  O          3.60     # -5.5
20 PHE  H    7 GLU  O          2.00     # -0.2  OK
20 PHE  N    7 GLU  O          3.00     # -0.2
21 ASN  H   26 ALA  O          2.00     # -1.8  OK
21 ASN  N   26 ALA  O          3.00     # -1.8
22 HIS  H    5 GLY  O          2.30     # -0.5  PDB: big angle +0.30
22 HIS  N    5 GLY  O          3.30     # -0.5
23 ILE  H   21 ASN  OD1        2.30     # -5.1  bridged with THR24 +0.30
23 ILE  N   21 ASN  OD1        3.30     # -5.1
24 THR  H   21 ASN  OD1        2.30     # -0.6  bridged with ILE23 +0.30
24 THR  N   21 ASN  OD1        3.30     # -0.6
25 ASN  H   21 ASN  O          2.30     # -1.7  PDB: big angle +0.30
25 ASN  N   21 ASN  O          3.30     # -1.7
26 ALA  H   24 THR  OG1        2.20     # -0.1  OK +0.20
26 ALA  N   24 THR  OG1        3.20     # -0.1
28 GLN  H   19 TYR  O          2.80     # -7.0  but present in PDB. Ar sc? +0.80
28 GLN  N   19 TYR  O          3.80     # -7.0
29 PHE  H   30 GLU  OE1        2.60     # -5.4  high mobility? compare 4res.turn +0.60
29 PHE  N   30 GLU  OE1        3.60     # -5.4


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           H1       LYS   1 -12.290  -0.397  -2.744
    2    H2   LYS   1           H2       LYS   1 -11.383   0.779  -1.993
    3    H3   LYS   1           H3       LYS   1 -10.653  -0.456  -2.731
    4    HA   LYS   1           HA       LYS   1 -12.453   1.274  -4.276
    5    HB2  LYS   1           HB2      LYS   1  -9.623   1.982  -3.489
    6    HB3  LYS   1           HB3      LYS   1 -10.419   2.658  -4.924
    7    HG2  LYS   1           HG2      LYS   1 -12.230   3.584  -3.596
    8    HG3  LYS   1           HG3      LYS   1 -11.599   2.894  -2.126
    9    HD2  LYS   1           HD2      LYS   1 -10.536   5.192  -3.750
   10    HD3  LYS   1           HD3      LYS   1 -10.975   5.157  -2.048
   11    HE2  LYS   1           HE2      LYS   1  -8.489   3.946  -3.334
   12    HE3  LYS   1           HE3      LYS   1  -8.569   5.397  -2.344
   13    HZ1  LYS   1           HZ1      LYS   1  -9.320   3.900  -0.463
   14    HZ2  LYS   1           HZ2      LYS   1  -9.077   2.632  -1.344
   15    HZ3  LYS   1           HZ3      LYS   1  -7.760   3.626  -1.031
   16    H    LEU   2           H        LEU   2  -9.020   0.380  -4.919
   17    HA   LEU   2           HA       LEU   2  -9.691  -0.801  -7.416
   18    HB2  LEU   2           HB2      LEU   2  -7.064  -1.244  -6.003
   19    HB3  LEU   2           HB3      LEU   2  -7.360  -1.304  -7.638
   20    HG   LEU   2           HG       LEU   2  -7.608   1.070  -7.907
   21   HD11  LEU   2          HD11      LEU   2  -8.319   2.059  -5.872
   22   HD12  LEU   2          HD12      LEU   2  -7.020   1.271  -4.924
   23   HD13  LEU   2          HD13      LEU   2  -6.660   2.566  -6.073
   24   HD21  LEU   2          HD21      LEU   2  -5.450  -0.090  -8.174
   25   HD22  LEU   2          HD22      LEU   2  -5.207   1.547  -7.561
   26   HD23  LEU   2          HD23      LEU   2  -5.077   0.159  -6.460
   27    HA   PRO   3           HA       PRO   3 -10.745  -4.921  -6.962
   28    HB2  PRO   3           HB2      PRO   3  -8.023  -5.725  -8.067
   29    HB3  PRO   3           HB3      PRO   3  -9.620  -6.372  -8.576
   30    HG2  PRO   3           HG2      PRO   3  -8.493  -4.504 -10.078
   31    HG3  PRO   3           HG3      PRO   3 -10.199  -4.210  -9.557
   32    HD2  PRO   3           HD2      PRO   3  -7.636  -3.220  -8.252
   33    HD3  PRO   3           HD3      PRO   3  -9.066  -2.271  -8.702
   34    HA   PRO   4           HA       PRO   4  -9.040  -7.690  -3.794
   35    HB2  PRO   4           HB2      PRO   4 -10.055 -10.110  -4.632
   36    HB3  PRO   4           HB3      PRO   4 -11.038  -8.865  -3.802
   37    HG2  PRO   4           HG2      PRO   4 -10.808  -9.380  -6.779
   38    HG3  PRO   4           HG3      PRO   4 -12.295  -9.132  -5.808
   39    HD2  PRO   4           HD2      PRO   4 -11.189  -7.121  -7.226
   40    HD3  PRO   4           HD3      PRO   4 -11.886  -6.809  -5.614
   41    H    GLY   5           H        GLY   5  -7.127  -8.902  -3.701
   42    HA2  GLY   5           HA2      GLY   5  -5.359 -10.247  -4.833
   43    HA3  GLY   5           HA3      GLY   5  -5.691  -9.325  -6.290
   44    H    TRP   6           H        TRP   6  -5.985  -6.584  -4.914
   45    HA   TRP   6           HA       TRP   6  -3.181  -5.968  -4.552
   46    HB2  TRP   6           HB2      TRP   6  -5.785  -4.520  -4.037
   47    HB3  TRP   6           HB3      TRP   6  -4.192  -3.840  -3.735
   48    HD1  TRP   6           HD1      TRP   6  -6.593  -4.413  -6.555
   49    HE1  TRP   6           HE1      TRP   6  -5.693  -3.235  -8.644
   50    HE3  TRP   6           HE3      TRP   6  -1.908  -3.387  -4.894
   51    HZ2  TRP   6           HZ2      TRP   6  -3.170  -2.117  -9.546
   52    HZ3  TRP   6           HZ3      TRP   6  -0.311  -2.236  -6.314
   53    HH2  TRP   6           HH2      TRP   6  -0.882  -1.620  -8.679
   54    H    GLU   7           H        GLU   7  -1.944  -6.298  -2.782
   55    HA   GLU   7           HA       GLU   7  -3.208  -6.445  -0.086
   56    HB2  GLU   7           HB2      GLU   7  -2.708  -8.647  -1.461
   57    HB3  GLU   7           HB3      GLU   7  -1.037  -8.350  -1.013
   58    HG2  GLU   7           HG2      GLU   7  -3.395  -8.645   0.914
   59    HG3  GLU   7           HG3      GLU   7  -2.308  -9.953   0.448
   60    H    LYS   8           H        LYS   8  -1.765  -5.996   1.667
   61    HA   LYS   8           HA       LYS   8  -0.091  -3.711   1.260
   62    HB2  LYS   8           HB2      LYS   8  -1.312  -3.706   3.188
   63    HB3  LYS   8           HB3      LYS   8  -1.111  -5.383   3.539
   64    HG2  LYS   8           HG2      LYS   8   1.102  -3.325   3.883
   65    HG3  LYS   8           HG3      LYS   8  -0.085  -3.717   5.116
   66    HD2  LYS   8           HD2      LYS   8   2.178  -5.471   4.137
   67    HD3  LYS   8           HD3      LYS   8   1.845  -4.849   5.723
   68    HE2  LYS   8           HE2      LYS   8   1.351  -7.083   5.928
   69    HE3  LYS   8           HE3      LYS   8  -0.245  -6.347   5.786
   70    HZ1  LYS   8           HZ1      LYS   8  -0.535  -7.337   3.678
   71    HZ2  LYS   8           HZ2      LYS   8   1.024  -7.321   3.309
   72    HZ3  LYS   8           HZ3      LYS   8   0.421  -8.452   4.348
   73    H    ARG   9           H        ARG   9   2.063  -3.403   1.283
   74    HA   ARG   9           HA       ARG   9   3.981  -5.502   2.030
   75    HB2  ARG   9           HB2      ARG   9   4.007  -4.116  -0.692
   76    HB3  ARG   9           HB3      ARG   9   5.304  -5.139  -0.076
   77    HG2  ARG   9           HG2      ARG   9   2.491  -6.024  -0.784
   78    HG3  ARG   9           HG3      ARG   9   3.947  -6.295  -1.735
   79    HD2  ARG   9           HD2      ARG   9   4.622  -8.078  -0.517
   80    HD3  ARG   9           HD3      ARG   9   4.172  -7.350   1.013
   81    HE   ARG   9           HE       ARG   9   1.912  -8.014   0.765
   82   HH11  ARG   9          HH11      ARG   9   3.824  -9.399  -1.832
   83   HH12  ARG   9          HH12      ARG   9   2.736 -10.747  -2.050
   84   HH21  ARG   9          HH21      ARG   9   0.597  -9.698   0.496
   85   HH22  ARG   9          HH22      ARG   9   0.863 -10.899  -0.767
   86    H    MET  10           H        MET  10   6.305  -4.453   1.810
   87    HA   MET  10           HA       MET  10   6.210  -1.587   2.574
   88    HB2  MET  10           HB2      MET  10   6.234  -2.986   4.624
   89    HB3  MET  10           HB3      MET  10   7.725  -3.762   4.062
   90    HG2  MET  10           HG2      MET  10   8.832  -1.526   4.027
   91    HG3  MET  10           HG3      MET  10   7.359  -0.791   4.649
   92    HE1  MET  10           HE1      MET  10   7.231  -1.762   8.336
   93    HE2  MET  10           HE2      MET  10   6.809  -0.545   7.113
   94    HE3  MET  10           HE3      MET  10   6.212  -2.216   6.952
   95    H    PHE  11           H        PHE  11   7.639  -0.386   1.565
   96    HA   PHE  11           HA       PHE  11   9.344  -1.401  -0.470
   97    HB2  PHE  11           HB2      PHE  11   8.053   0.749  -0.400
   98    HB3  PHE  11           HB3      PHE  11   9.195   1.345   0.787
   99    HD1  PHE  11           HD1      PHE  11  11.255  -0.470  -1.494
  100    HD2  PHE  11           HD2      PHE  11   8.855   3.121  -1.202
  101    HE1  PHE  11           HE1      PHE  11  12.585   0.569  -3.264
  102    HE2  PHE  11           HE2      PHE  11  10.214   4.152  -2.995
  103    HZ   PHE  11           HZ       PHE  11  12.084   2.880  -4.031
  104    H    ARG  12           H        ARG  12  10.949  -2.678   0.213
  105    HA   ARG  12           HA       ARG  12  12.555  -2.583   2.460
  106    HB2  ARG  12           HB2      ARG  12  13.318  -3.438  -0.368
  107    HB3  ARG  12           HB3      ARG  12  14.238  -3.834   1.088
  108    HG2  ARG  12           HG2      ARG  12  12.284  -5.077   2.005
  109    HG3  ARG  12           HG3      ARG  12  11.348  -4.673   0.561
  110    HD2  ARG  12           HD2      ARG  12  12.151  -6.906   0.287
  111    HD3  ARG  12           HD3      ARG  12  13.023  -5.861  -0.847
  112    HE   ARG  12           HE       ARG  12  14.378  -6.281   1.718
  113   HH11  ARG  12          HH11      ARG  12  14.022  -7.652  -1.477
  114   HH12  ARG  12          HH12      ARG  12  15.550  -8.488  -1.418
  115   HH21  ARG  12          HH21      ARG  12  16.343  -7.357   1.765
  116   HH22  ARG  12          HH22      ARG  12  16.828  -8.314   0.403
  117    H    SER  13           H        SER  13  14.588  -1.847   2.975
  118    HA   SER  13           HA       SER  13  16.199  -0.367   3.311
  119    HB2  SER  13           HB2      SER  13  16.960  -1.034   1.044
  120    HB3  SER  13           HB3      SER  13  16.092   0.368   0.374
  121    HG   SER  13           HG       SER  13  17.297   1.580   2.051
  122    H    ASN  14           H        ASN  14  13.097   0.785   2.737
  123    HA   ASN  14           HA       ASN  14  13.981   3.254   4.109
  124    HB2  ASN  14           HB2      ASN  14  12.583   4.721   2.753
  125    HB3  ASN  14           HB3      ASN  14  13.851   3.969   1.793
  126   HD21  ASN  14          HD22      ASN  14  13.252   2.675   0.003
  127   HD22  ASN  14          HD21      ASN  14  11.579   2.461  -0.434
  128    H    GLY  15           H        GLY  15  11.220   1.078   3.328
  129    HA2  GLY  15           HA2      GLY  15   9.972   0.174   5.109
  130    HA3  GLY  15           HA3      GLY  15  10.246   1.603   6.093
  131    H    THR  16           H        THR  16   9.388   2.573   2.919
  132    HA   THR  16           HA       THR  16   6.879   3.667   3.694
  133    HB   THR  16           HB       THR  16   7.749   3.005   0.854
  134    HG1  THR  16           HG1      THR  16   9.372   4.192   1.695
  135   HG21  THR  16          HG21      THR  16   5.899   5.143   1.980
  136   HG22  THR  16          HG22      THR  16   6.386   4.976   0.279
  137   HG23  THR  16          HG23      THR  16   5.401   3.715   1.040
  138    H    VAL  17           H        VAL  17   5.045   2.515   4.200
  139    HA   VAL  17           HA       VAL  17   4.636  -0.153   3.052
  140    HB   VAL  17           HB       VAL  17   3.001   1.545   4.937
  141   HG11  VAL  17          HG11      VAL  17   1.310   0.342   3.643
  142   HG12  VAL  17          HG12      VAL  17   2.218  -1.178   3.819
  143   HG13  VAL  17          HG13      VAL  17   1.475  -0.403   5.232
  144   HG21  VAL  17          HG21      VAL  17   3.526  -0.312   6.492
  145   HG22  VAL  17          HG22      VAL  17   4.330  -1.197   5.175
  146   HG23  VAL  17          HG23      VAL  17   5.024   0.326   5.791
  147    H    TYR  18           H        TYR  18   3.207  -0.769   1.598
  148    HA   TYR  18           HA       TYR  18   1.617   1.120   0.020
  149    HB2  TYR  18           HB2      TYR  18   2.882   1.083  -1.931
  150    HB3  TYR  18           HB3      TYR  18   4.082   1.344  -0.687
  151    HD1  TYR  18           HD1      TYR  18   5.520  -0.624   0.072
  152    HD2  TYR  18           HD2      TYR  18   3.058  -0.669  -3.440
  153    HE1  TYR  18           HE1      TYR  18   6.818  -2.603  -0.827
  154    HE2  TYR  18           HE2      TYR  18   4.286  -2.661  -4.304
  155    HH   TYR  18           HH       TYR  18   6.065  -4.047  -3.981
  156    H    TYR  19           H        TYR  19   0.942  -0.351  -2.167
  157    HA   TYR  19           HA       TYR  19   0.310  -3.080  -1.159
  158    HB2  TYR  19           HB2      TYR  19  -1.536  -1.009  -2.297
  159    HB3  TYR  19           HB3      TYR  19  -1.812  -2.690  -2.673
  160    HD1  TYR  19           HD2      TYR  19  -0.952  -0.785   0.503
  161    HD2  TYR  19           HD1      TYR  19  -3.429  -3.744  -1.416
  162    HE1  TYR  19           HE2      TYR  19  -2.140  -1.210   2.644
  163    HE2  TYR  19           HE1      TYR  19  -4.703  -4.047   0.684
  164    HH   TYR  19           HH       TYR  19  -5.175  -2.727   2.797
  165    H    PHE  20           H        PHE  20   0.149  -4.666  -2.565
  166    HA   PHE  20           HA       PHE  20   1.383  -4.399  -5.273
  167    HB2  PHE  20           HB2      PHE  20   3.017  -5.154  -3.670
  168    HB3  PHE  20           HB3      PHE  20   1.876  -6.310  -2.969
  169    HD1  PHE  20           HD2      PHE  20   4.114  -5.640  -5.820
  170    HD2  PHE  20           HD1      PHE  20   1.479  -8.527  -3.973
  171    HE1  PHE  20           HE2      PHE  20   5.021  -7.409  -7.282
  172    HE2  PHE  20           HE1      PHE  20   2.473 -10.303  -5.389
  173    HZ   PHE  20           HZ       PHE  20   4.182  -9.747  -7.085
  174    H    ASN  21           H        ASN  21   0.224  -5.434  -6.855
  175    HA   ASN  21           HA       ASN  21  -2.195  -6.916  -6.038
  176    HB2  ASN  21           HB2      ASN  21  -2.197  -5.263  -7.933
  177    HB3  ASN  21           HB3      ASN  21  -1.191  -6.397  -8.827
  178   HD21  ASN  21          HD22      ASN  21  -4.459  -5.551  -8.090
  179   HD22  ASN  21          HD21      ASN  21  -5.140  -7.094  -8.596
  180    H    HIS  22           H        HIS  22  -1.795  -8.883  -5.230
  181    HA   HIS  22           HA       HIS  22   0.462 -10.447  -6.101
  182    HB2  HIS  22           HB2      HIS  22  -0.004 -11.807  -4.324
  183    HB3  HIS  22           HB3      HIS  22  -0.655 -10.287  -3.768
  184    HD1  HIS  22           HD1      HIS  22  -2.070 -13.389  -5.594
  185    HD2  HIS  22           HD2      HIS  22  -3.066 -10.481  -2.732
  186    HE1  HIS  22           HE1      HIS  22  -4.403 -14.033  -4.654
  187    H    ILE  23           H        ILE  23  -2.305  -9.921  -7.808
  188    HA   ILE  23           HA       ILE  23  -2.369 -12.650  -8.991
  189    HB   ILE  23           HB       ILE  23  -4.417 -10.406  -9.165
  190   HG12  ILE  23          HG12      ILE  23  -4.396 -12.970  -7.504
  191   HG13  ILE  23          HG13      ILE  23  -4.308 -11.325  -6.881
  192   HG21  ILE  23          HG21      ILE  23  -5.877 -12.074 -10.191
  193   HG22  ILE  23          HG22      ILE  23  -4.421 -11.894 -11.152
  194   HG23  ILE  23          HG23      ILE  23  -4.595 -13.302 -10.078
  195   HD11  ILE  23          HD11      ILE  23  -6.520 -12.055  -6.503
  196   HD12  ILE  23          HD12      ILE  23  -6.607 -10.897  -7.847
  197   HD13  ILE  23          HD13      ILE  23  -6.714 -12.649  -8.156
  198    H    THR  24           H        THR  24  -1.714  -9.214  -9.695
  199    HA   THR  24           HA       THR  24  -0.915  -9.974 -12.483
  200    HB   THR  24           HB       THR  24  -1.244  -7.700 -13.076
  201    HG1  THR  24           HG1      THR  24  -2.081  -6.229 -11.570
  202   HG21  THR  24          HG21      THR  24  -3.292  -9.142 -13.027
  203   HG22  THR  24          HG22      THR  24  -3.661  -8.514 -11.406
  204   HG23  THR  24          HG23      THR  24  -3.644  -7.418 -12.806
  205    H    ASN  25           H        ASN  25   0.481  -8.918  -9.553
  206    HA   ASN  25           HA       ASN  25   2.521  -8.347  -8.901
  207    HB2  ASN  25           HB2      ASN  25   3.217  -9.941 -10.848
  208    HB3  ASN  25           HB3      ASN  25   3.684  -8.459 -11.679
  209   HD21  ASN  25          HD22      ASN  25   5.083  -6.952 -10.086
  210   HD22  ASN  25          HD21      ASN  25   6.441  -7.874  -9.397
  211    H    ALA  26           H        ALA  26   0.439  -6.394 -10.365
  212    HA   ALA  26           HA       ALA  26   2.033  -4.038 -10.843
  213    HB1  ALA  26           HB1      ALA  26  -0.101  -2.856 -10.673
  214    HB2  ALA  26           HB2      ALA  26  -0.290  -4.330 -11.634
  215    HB3  ALA  26           HB3      ALA  26  -0.868  -4.287  -9.952
  216    H    SER  27           H        SER  27   1.944  -2.015  -9.410
  217    HA   SER  27           HA       SER  27   1.828  -2.528  -6.495
  218    HB2  SER  27           HB2      SER  27   4.303  -1.659  -8.010
  219    HB3  SER  27           HB3      SER  27   4.071  -1.387  -6.267
  220    HG   SER  27           HG       SER  27   3.527  -3.929  -7.296
  221    H    GLN  28           H        GLN  28   1.188  -0.732  -5.322
  222    HA   GLN  28           HA       GLN  28   1.283   1.977  -6.458
  223    HB2  GLN  28           HB2      GLN  28  -1.298   0.453  -5.841
  224    HB3  GLN  28           HB3      GLN  28  -1.226   2.206  -5.765
  225    HG2  GLN  28           HG2      GLN  28  -0.710   0.567  -8.263
  226    HG3  GLN  28           HG3      GLN  28  -2.162   1.481  -7.884
  227   HE21  GLN  28          HE22      GLN  28   1.216   1.700  -8.921
  228   HE22  GLN  28          HE21      GLN  28   1.094   3.418  -9.352
  229    H    PHE  29           H        PHE  29   0.932   3.621  -4.908
  230    HA   PHE  29           HA       PHE  29   1.283   2.868  -2.096
  231    HB2  PHE  29           HB2      PHE  29   1.085   5.580  -3.417
  232    HB3  PHE  29           HB3      PHE  29   1.506   5.276  -1.734
  233    HD1  PHE  29           HD2      PHE  29   3.481   3.317  -1.530
  234    HD2  PHE  29           HD1      PHE  29   2.942   6.095  -4.789
  235    HE1  PHE  29           HE2      PHE  29   5.863   3.060  -2.142
  236    HE2  PHE  29           HE1      PHE  29   5.331   5.828  -5.398
  237    HZ   PHE  29           HZ       PHE  29   6.795   4.311  -4.078
  238    H    GLU  30           H        GLU  30  -1.411   3.537  -4.184
  239    HA   GLU  30           HA       GLU  30  -3.176   4.253  -2.021
  240    HB2  GLU  30           HB2      GLU  30  -3.610   5.058  -4.260
  241    HB3  GLU  30           HB3      GLU  30  -3.903   3.405  -4.822
  242    HG2  GLU  30           HG2      GLU  30  -5.983   4.780  -4.294
  243    HG3  GLU  30           HG3      GLU  30  -5.883   3.228  -3.465
  244    H    ARG  31           H        ARG  31  -4.458   3.040  -0.842
  245    HA   ARG  31           HA       ARG  31  -3.870   0.134  -0.634
  246    HB2  ARG  31           HB2      ARG  31  -5.181   2.071   1.327
  247    HB3  ARG  31           HB3      ARG  31  -4.879   0.369   1.602
  248    HG2  ARG  31           HG2      ARG  31  -2.916   0.835   2.453
  249    HG3  ARG  31           HG3      ARG  31  -2.329   1.415   0.902
  250    HD2  ARG  31           HD2      ARG  31  -3.790   3.175   2.936
  251    HD3  ARG  31           HD3      ARG  31  -2.062   2.872   3.001
  252    HE   ARG  31           HE       ARG  31  -1.698   4.050   0.972
  253   HH11  ARG  31          HH21      ARG  31  -5.126   4.103   1.676
  254   HH12  ARG  31          HH22      ARG  31  -5.411   4.969   0.184
  255   HH21  ARG  31          HH11      ARG  31  -2.113   5.636  -0.426
  256   HH22  ARG  31          HH12      ARG  31  -3.796   6.069  -0.767
  257    HA   PRO  32           HA       PRO  32  -7.986   0.161  -2.474
  258    HB2  PRO  32           HB2      PRO  32  -7.541  -2.713  -3.255
  259    HB3  PRO  32           HB3      PRO  32  -8.042  -1.312  -4.132
  260    HG2  PRO  32           HG2      PRO  32  -5.581  -2.225  -4.438
  261    HG3  PRO  32           HG3      PRO  32  -5.781  -0.507  -4.387
  262    HD2  PRO  32           HD2      PRO  32  -5.163  -2.270  -1.986
  263    HD3  PRO  32           HD3      PRO  32  -4.263  -0.830  -2.530
  264    H    SER  33           H        SER  33  -6.976  -1.775  -0.200
  265    HA   SER  33           HA       SER  33  -9.491  -3.035   0.759
  266    HB2  SER  33           HB2      SER  33  -8.274  -3.755   2.703
  267    HB3  SER  33           HB3      SER  33  -7.212  -3.998   1.301
  268    HG   SER  33           HG       SER  33  -7.272  -1.717   2.969
  269    H    GLY  34           H        GLY  34 -10.283  -0.698   0.208
  270    HA2  GLY  34           HA2      GLY  34 -11.733   0.767   1.773
  271    HA3  GLY  34           HA3      GLY  34 -10.161   1.235   2.454
  Start of MODEL    2
    1    H1   LYS   1           H1       LYS   1 -10.593  -9.320   4.931
    2    H2   LYS   1           H2       LYS   1 -11.016  -9.347   3.332
    3    H3   LYS   1           H3       LYS   1 -11.501  -8.103   4.267
    4    HA   LYS   1           HA       LYS   1  -9.219  -7.400   4.608
    5    HB2  LYS   1           HB2      LYS   1  -8.479  -9.898   3.941
    6    HB3  LYS   1           HB3      LYS   1  -8.425  -9.205   2.323
    7    HG2  LYS   1           HG2      LYS   1  -6.930  -7.329   3.500
    8    HG3  LYS   1           HG3      LYS   1  -6.792  -8.516   4.794
    9    HD2  LYS   1           HD2      LYS   1  -5.886 -10.168   3.148
   10    HD3  LYS   1           HD3      LYS   1  -6.052  -8.953   1.861
   11    HE2  LYS   1           HE2      LYS   1  -4.522  -7.437   3.180
   12    HE3  LYS   1           HE3      LYS   1  -4.270  -8.759   4.332
   13    HZ1  LYS   1           HZ1      LYS   1  -2.509  -8.744   2.678
   14    HZ2  LYS   1           HZ2      LYS   1  -3.430 -10.088   2.456
   15    HZ3  LYS   1           HZ3      LYS   1  -3.628  -8.815   1.434
   16    H    LEU   2           H        LEU   2  -7.894  -6.565   2.280
   17    HA   LEU   2           HA       LEU   2  -9.822  -4.953   0.846
   18    HB2  LEU   2           HB2      LEU   2  -6.830  -5.494   0.476
   19    HB3  LEU   2           HB3      LEU   2  -7.748  -4.298  -0.398
   20    HG   LEU   2           HG       LEU   2  -6.653  -3.035   1.143
   21   HD11  LEU   2          HD11      LEU   2  -9.115  -2.547   1.146
   22   HD12  LEU   2          HD12      LEU   2  -9.267  -3.515   2.629
   23   HD13  LEU   2          HD13      LEU   2  -8.267  -2.048   2.614
   24   HD21  LEU   2          HD21      LEU   2  -7.386  -4.824   3.479
   25   HD22  LEU   2          HD22      LEU   2  -5.847  -4.911   2.576
   26   HD23  LEU   2          HD23      LEU   2  -6.296  -3.439   3.442
   27    HA   PRO   3           HA       PRO   3 -11.002  -7.358  -2.447
   28    HB2  PRO   3           HB2      PRO   3  -9.531  -5.704  -4.518
   29    HB3  PRO   3           HB3      PRO   3 -11.243  -6.233  -4.512
   30    HG2  PRO   3           HG2      PRO   3 -10.673  -3.744  -3.733
   31    HG3  PRO   3           HG3      PRO   3 -11.771  -4.721  -2.715
   32    HD2  PRO   3           HD2      PRO   3  -8.791  -4.250  -2.369
   33    HD3  PRO   3           HD3      PRO   3 -10.098  -4.054  -1.171
   34    HA   PRO   4           HA       PRO   4  -8.800 -10.835  -3.540
   35    HB2  PRO   4           HB2      PRO   4  -9.388 -10.524  -6.474
   36    HB3  PRO   4           HB3      PRO   4  -9.538 -11.982  -5.447
   37    HG2  PRO   4           HG2      PRO   4 -11.743 -10.515  -6.024
   38    HG3  PRO   4           HG3      PRO   4 -11.480 -11.122  -4.357
   39    HD2  PRO   4           HD2      PRO   4 -10.991  -8.356  -5.454
   40    HD3  PRO   4           HD3      PRO   4 -11.697  -8.846  -3.884
   41    H    GLY   5           H        GLY   5  -6.744 -11.181  -3.477
   42    HA2  GLY   5           HA2      GLY   5  -4.563 -11.456  -4.284
   43    HA3  GLY   5           HA3      GLY   5  -4.876 -10.290  -5.566
   44    H    TRP   6           H        TRP   6  -5.945  -8.406  -3.104
   45    HA   TRP   6           HA       TRP   6  -3.470  -6.961  -3.169
   46    HB2  TRP   6           HB2      TRP   6  -6.082  -6.529  -1.739
   47    HB3  TRP   6           HB3      TRP   6  -4.698  -5.479  -1.491
   48    HD1  TRP   6           HD1      TRP   6  -7.583  -5.764  -3.632
   49    HE1  TRP   6           HE1      TRP   6  -7.505  -3.980  -5.494
   50    HE3  TRP   6           HE3      TRP   6  -2.653  -4.536  -3.327
   51    HZ2  TRP   6           HZ2      TRP   6  -5.500  -2.431  -6.831
   52    HZ3  TRP   6           HZ3      TRP   6  -1.709  -2.803  -4.813
   53    HH2  TRP   6           HH2      TRP   6  -3.104  -1.769  -6.602
   54    H    GLU   7           H        GLU   7  -1.725  -6.944  -1.985
   55    HA   GLU   7           HA       GLU   7  -1.914  -7.698   0.853
   56    HB2  GLU   7           HB2      GLU   7  -0.796  -9.325  -1.151
   57    HB3  GLU   7           HB3      GLU   7   0.603  -8.501  -0.470
   58    HG2  GLU   7           HG2      GLU   7  -1.465 -10.165   1.029
   59    HG3  GLU   7           HG3      GLU   7   0.195 -10.622   0.669
   60    H    LYS   8           H        LYS   8  -0.758  -6.636   2.233
   61    HA   LYS   8           HA       LYS   8   0.368  -4.028   1.590
   62    HB2  LYS   8           HB2      LYS   8  -0.620  -4.008   3.622
   63    HB3  LYS   8           HB3      LYS   8  -0.254  -5.643   4.033
   64    HG2  LYS   8           HG2      LYS   8   1.757  -3.352   4.100
   65    HG3  LYS   8           HG3      LYS   8   0.749  -3.838   5.453
   66    HD2  LYS   8           HD2      LYS   8   3.098  -5.351   4.287
   67    HD3  LYS   8           HD3      LYS   8   2.869  -4.699   5.880
   68    HE2  LYS   8           HE2      LYS   8   2.690  -7.002   6.140
   69    HE3  LYS   8           HE3      LYS   8   1.033  -6.412   6.283
   70    HZ1  LYS   8           HZ1      LYS   8   0.496  -7.430   4.215
   71    HZ2  LYS   8           HZ2      LYS   8   1.996  -7.342   3.638
   72    HZ3  LYS   8           HZ3      LYS   8   1.606  -8.469   4.736
   73    H    ARG   9           H        ARG   9   2.427  -3.433   1.429
   74    HA   ARG   9           HA       ARG   9   4.644  -5.447   1.641
   75    HB2  ARG   9           HB2      ARG   9   3.960  -3.741  -0.793
   76    HB3  ARG   9           HB3      ARG   9   5.501  -4.564  -0.578
   77    HG2  ARG   9           HG2      ARG   9   2.809  -5.966  -0.828
   78    HG3  ARG   9           HG3      ARG   9   3.990  -5.684  -2.097
   79    HD2  ARG   9           HD2      ARG   9   4.677  -7.726  -1.656
   80    HD3  ARG   9           HD3      ARG   9   5.635  -6.941  -0.396
   81    HE   ARG   9           HE       ARG   9   3.237  -7.570   0.878
   82   HH11  ARG   9          HH11      ARG   9   5.663  -9.435  -0.825
   83   HH12  ARG   9          HH12      ARG   9   5.266 -10.924  -0.011
   84   HH21  ARG   9          HH21      ARG   9   2.633  -9.589   1.816
   85   HH22  ARG   9          HH22      ARG   9   3.639 -10.971   1.486
   86    H    MET  10           H        MET  10   6.838  -4.335   1.459
   87    HA   MET  10           HA       MET  10   6.772  -1.533   2.423
   88    HB2  MET  10           HB2      MET  10   6.816  -3.053   4.393
   89    HB3  MET  10           HB3      MET  10   8.319  -3.765   3.782
   90    HG2  MET  10           HG2      MET  10   9.397  -1.516   3.907
   91    HG3  MET  10           HG3      MET  10   7.884  -0.829   4.491
   92    HE1  MET  10           HE1      MET  10  11.063  -2.894   5.282
   93    HE2  MET  10           HE2      MET  10  10.733  -3.573   6.891
   94    HE3  MET  10           HE3      MET  10   9.867  -4.199   5.474
   95    H    PHE  11           H        PHE  11   8.187  -0.276   1.464
   96    HA   PHE  11           HA       PHE  11   9.981  -1.194  -0.562
   97    HB2  PHE  11           HB2      PHE  11   8.646   0.929  -0.465
   98    HB3  PHE  11           HB3      PHE  11   9.727   1.502   0.787
   99    HD1  PHE  11           HD2      PHE  11  12.015  -0.108  -1.344
  100    HD2  PHE  11           HD1      PHE  11   9.323   3.276  -1.270
  101    HE1  PHE  11           HE2      PHE  11  13.380   1.018  -3.038
  102    HE2  PHE  11           HE1      PHE  11  10.716   4.399  -2.981
  103    HZ   PHE  11           HZ       PHE  11  12.748   3.274  -3.871
  104    H    ARG  12           H        ARG  12  11.381  -2.644   0.459
  105    HA   ARG  12           HA       ARG  12  13.083  -2.344   2.581
  106    HB2  ARG  12           HB2      ARG  12  14.799  -3.651   1.170
  107    HB3  ARG  12           HB3      ARG  12  13.255  -4.371   1.560
  108    HG2  ARG  12           HG2      ARG  12  14.014  -4.878  -0.721
  109    HG3  ARG  12           HG3      ARG  12  12.423  -4.148  -0.656
  110    HD2  ARG  12           HD2      ARG  12  13.786  -3.346  -2.568
  111    HD3  ARG  12           HD3      ARG  12  13.246  -2.056  -1.509
  112    HE   ARG  12           HE       ARG  12  15.377  -1.614  -0.811
  113   HH11  ARG  12          HH21      ARG  12  15.547  -4.337  -3.018
  114   HH12  ARG  12          HH22      ARG  12  17.289  -4.302  -3.103
  115   HH21  ARG  12          HH11      ARG  12  17.579  -1.751  -0.762
  116   HH22  ARG  12          HH12      ARG  12  18.432  -2.776  -1.899
  117    H    SER  13           H        SER  13  14.998  -1.485   3.116
  118    HA   SER  13           HA       SER  13  16.740  -0.092   3.244
  119    HB2  SER  13           HB2      SER  13  16.416   0.684   0.331
  120    HB3  SER  13           HB3      SER  13  17.797   0.998   1.379
  121    HG   SER  13           HG       SER  13  18.150  -1.208   1.546
  122    H    ASN  14           H        ASN  14  13.583   1.031   2.678
  123    HA   ASN  14           HA       ASN  14  14.404   3.431   4.203
  124    HB2  ASN  14           HB2      ASN  14  13.011   4.951   2.900
  125    HB3  ASN  14           HB3      ASN  14  14.316   4.274   1.937
  126   HD21  ASN  14          HD22      ASN  14  13.759   3.376  -0.039
  127   HD22  ASN  14          HD21      ASN  14  12.113   2.993  -0.480
  128    H    GLY  15           H        GLY  15  11.745   1.201   3.306
  129    HA2  GLY  15           HA2      GLY  15  10.451   0.218   5.002
  130    HA3  GLY  15           HA3      GLY  15  10.693   1.600   6.059
  131    H    THR  16           H        THR  16   9.887   2.704   2.910
  132    HA   THR  16           HA       THR  16   7.346   3.732   3.654
  133    HB   THR  16           HB       THR  16   8.236   3.107   0.813
  134    HG1  THR  16           HG1      THR  16   9.833   4.316   1.693
  135   HG21  THR  16          HG21      THR  16   5.877   3.760   0.994
  136   HG22  THR  16          HG22      THR  16   6.333   5.186   1.957
  137   HG23  THR  16          HG23      THR  16   6.833   5.057   0.257
  138    H    VAL  17           H        VAL  17   5.548   2.541   4.158
  139    HA   VAL  17           HA       VAL  17   5.201  -0.132   3.018
  140    HB   VAL  17           HB       VAL  17   3.570   1.540   4.933
  141   HG11  VAL  17          HG11      VAL  17   2.789  -1.195   3.840
  142   HG12  VAL  17          HG12      VAL  17   2.069  -0.416   5.264
  143   HG13  VAL  17          HG13      VAL  17   1.864   0.316   3.674
  144   HG21  VAL  17          HG21      VAL  17   4.144  -0.305   6.478
  145   HG22  VAL  17          HG22      VAL  17   4.932  -1.187   5.150
  146   HG23  VAL  17          HG23      VAL  17   5.623   0.341   5.747
  147    H    TYR  18           H        TYR  18   3.680  -0.814   1.647
  148    HA   TYR  18           HA       TYR  18   1.974   1.030   0.164
  149    HB2  TYR  18           HB2      TYR  18   2.971   0.734  -1.959
  150    HB3  TYR  18           HB3      TYR  18   4.238   1.253  -0.891
  151    HD1  TYR  18           HD1      TYR  18   5.980  -0.465  -0.122
  152    HD2  TYR  18           HD2      TYR  18   3.105  -1.223  -3.243
  153    HE1  TYR  18           HE1      TYR  18   7.442  -2.284  -1.064
  154    HE2  TYR  18           HE2      TYR  18   4.531  -3.027  -4.148
  155    HH   TYR  18           HH       TYR  18   6.561  -4.111  -3.972
  156    H    TYR  19           H        TYR  19   1.038  -0.507  -1.834
  157    HA   TYR  19           HA       TYR  19   0.581  -3.246  -0.776
  158    HB2  TYR  19           HB2      TYR  19  -1.399  -1.120  -1.436
  159    HB3  TYR  19           HB3      TYR  19  -1.761  -2.708  -2.035
  160    HD1  TYR  19           HD1      TYR  19  -0.963  -0.891   1.158
  161    HD2  TYR  19           HD2      TYR  19  -2.608  -4.426  -0.686
  162    HE1  TYR  19           HE1      TYR  19  -2.087  -1.486   3.279
  163    HE2  TYR  19           HE2      TYR  19  -3.687  -5.053   1.469
  164    HH   TYR  19           HH       TYR  19  -3.395  -3.008   4.380
  165    H    PHE  20           H        PHE  20   0.156  -4.788  -2.188
  166    HA   PHE  20           HA       PHE  20   0.690  -4.379  -5.094
  167    HB2  PHE  20           HB2      PHE  20   2.743  -4.943  -3.897
  168    HB3  PHE  20           HB3      PHE  20   1.973  -6.372  -3.186
  169    HD1  PHE  20           HD1      PHE  20   3.390  -4.858  -6.193
  170    HD2  PHE  20           HD2      PHE  20   1.683  -8.452  -4.540
  171    HE1  PHE  20           HE1      PHE  20   4.096  -6.122  -8.221
  172    HE2  PHE  20           HE2      PHE  20   2.503  -9.730  -6.508
  173    HZ   PHE  20           HZ       PHE  20   3.637  -8.571  -8.372
  174    H    ASN  21           H        ASN  21  -0.849  -5.353  -6.285
  175    HA   ASN  21           HA       ASN  21  -2.646  -7.353  -5.089
  176    HB2  ASN  21           HB2      ASN  21  -3.508  -5.474  -6.539
  177    HB3  ASN  21           HB3      ASN  21  -2.596  -6.153  -7.867
  178   HD21  ASN  21          HD22      ASN  21  -5.472  -6.472  -5.824
  179   HD22  ASN  21          HD21      ASN  21  -6.054  -7.960  -6.527
  180    H    HIS  22           H        HIS  22  -1.660  -9.311  -4.871
  181    HA   HIS  22           HA       HIS  22   0.409 -10.191  -6.639
  182    HB2  HIS  22           HB2      HIS  22   0.742 -11.893  -5.119
  183    HB3  HIS  22           HB3      HIS  22   0.119 -10.602  -4.123
  184    HD1  HIS  22           HD1      HIS  22  -1.413 -13.628  -5.976
  185    HD2  HIS  22           HD2      HIS  22  -1.721 -11.402  -2.426
  186    HE1  HIS  22           HE1      HIS  22  -3.207 -14.803  -4.507
  187    H    ILE  23           H        ILE  23  -2.710 -10.054  -7.530
  188    HA   ILE  23           HA       ILE  23  -2.605 -12.587  -9.124
  189    HB   ILE  23           HB       ILE  23  -4.917 -10.775  -8.347
  190   HG12  ILE  23          HG12      ILE  23  -4.269 -13.692  -7.681
  191   HG13  ILE  23          HG13      ILE  23  -4.107 -12.331  -6.579
  192   HG21  ILE  23          HG21      ILE  23  -6.395 -12.350  -9.561
  193   HG22  ILE  23          HG22      ILE  23  -5.284 -11.561 -10.658
  194   HG23  ILE  23          HG23      ILE  23  -4.968 -13.235 -10.150
  195   HD11  ILE  23          HD11      ILE  23  -6.683 -13.520  -7.638
  196   HD12  ILE  23          HD12      ILE  23  -6.112 -13.409  -5.968
  197   HD13  ILE  23          HD13      ILE  23  -6.611 -11.938  -6.828
  198    H    THR  24           H        THR  24  -2.604  -9.073  -9.275
  199    HA   THR  24           HA       THR  24  -2.573  -9.167 -12.280
  200    HB   THR  24           HB       THR  24  -3.430  -6.867 -12.180
  201    HG1  THR  24           HG1      THR  24  -3.754  -7.321  -9.422
  202   HG21  THR  24          HG21      THR  24  -5.127  -8.695 -12.196
  203   HG22  THR  24          HG22      THR  24  -5.131  -8.691 -10.415
  204   HG23  THR  24          HG23      THR  24  -5.672  -7.258 -11.301
  205    H    ASN  25           H        ASN  25  -0.705  -8.148  -9.524
  206    HA   ASN  25           HA       ASN  25   1.299  -7.277  -9.241
  207    HB2  ASN  25           HB2      ASN  25   1.622  -6.624 -12.175
  208    HB3  ASN  25           HB3      ASN  25   2.859  -6.659 -10.934
  209   HD21  ASN  25          HD22      ASN  25   0.808  -8.625 -12.989
  210   HD22  ASN  25          HD21      ASN  25   1.753 -10.112 -12.762
  211    H    ALA  26           H        ALA  26  -1.492  -5.674  -9.997
  212    HA   ALA  26           HA       ALA  26  -0.691  -2.997 -10.382
  213    HB1  ALA  26           HB1      ALA  26  -3.040  -3.803 -10.465
  214    HB2  ALA  26           HB2      ALA  26  -3.016  -4.039  -8.704
  215    HB3  ALA  26           HB3      ALA  26  -2.849  -2.412  -9.381
  216    H    SER  27           H        SER  27   0.162  -1.413  -9.043
  217    HA   SER  27           HA       SER  27   0.943  -2.205  -6.265
  218    HB2  SER  27           HB2      SER  27   2.718  -1.188  -8.523
  219    HB3  SER  27           HB3      SER  27   3.214  -1.417  -6.838
  220    HG   SER  27           HG       SER  27   2.280  -3.507  -8.589
  221    H    GLN  28           H        GLN  28   0.616  -0.533  -4.827
  222    HA   GLN  28           HA       GLN  28   0.773   2.270  -5.734
  223    HB2  GLN  28           HB2      GLN  28  -1.532   2.760  -4.893
  224    HB3  GLN  28           HB3      GLN  28  -1.486   1.801  -6.370
  225    HG2  GLN  28           HG2      GLN  28  -1.973  -0.257  -5.099
  226    HG3  GLN  28           HG3      GLN  28  -1.949   0.641  -3.584
  227   HE21  GLN  28          HE22      GLN  28  -3.785   1.889  -2.997
  228   HE22  GLN  28          HE21      GLN  28  -5.224   1.942  -4.035
  229    H    PHE  29           H        PHE  29   0.999   3.789  -4.004
  230    HA   PHE  29           HA       PHE  29   2.066   2.672  -1.545
  231    HB2  PHE  29           HB2      PHE  29   1.621   5.467  -2.583
  232    HB3  PHE  29           HB3      PHE  29   2.105   5.159  -0.925
  233    HD1  PHE  29           HD1      PHE  29   3.651   2.743  -3.229
  234    HD2  PHE  29           HD2      PHE  29   3.975   6.713  -1.546
  235    HE1  PHE  29           HE1      PHE  29   6.045   2.781  -3.766
  236    HE2  PHE  29           HE2      PHE  29   6.385   6.741  -2.118
  237    HZ   PHE  29           HZ       PHE  29   7.428   4.770  -3.219
  238    H    GLU  30           H        GLU  30  -0.932   4.615  -2.221
  239    HA   GLU  30           HA       GLU  30  -1.789   4.290   0.526
  240    HB2  GLU  30           HB2      GLU  30  -2.454   6.246  -0.729
  241    HB3  GLU  30           HB3      GLU  30  -3.218   5.250  -1.963
  242    HG2  GLU  30           HG2      GLU  30  -4.868   6.330  -0.530
  243    HG3  GLU  30           HG3      GLU  30  -4.982   4.583  -0.429
  244    H    ARG  31           H        ARG  31  -3.492   3.062   1.282
  245    HA   ARG  31           HA       ARG  31  -3.411   0.319   0.516
  246    HB2  ARG  31           HB2      ARG  31  -5.493   1.614   2.302
  247    HB3  ARG  31           HB3      ARG  31  -4.956  -0.076   2.311
  248    HG2  ARG  31           HG2      ARG  31  -3.215   0.295   3.630
  249    HG3  ARG  31           HG3      ARG  31  -2.718   1.780   2.869
  250    HD2  ARG  31           HD2      ARG  31  -5.049   1.459   4.826
  251    HD3  ARG  31           HD3      ARG  31  -3.419   1.992   5.272
  252    HE   ARG  31           HE       ARG  31  -4.133   3.810   3.313
  253   HH11  ARG  31          HH11      ARG  31  -5.550   2.994   6.398
  254   HH12  ARG  31          HH12      ARG  31  -6.276   4.575   6.579
  255   HH21  ARG  31          HH22      ARG  31  -5.139   5.751   3.503
  256   HH22  ARG  31          HH21      ARG  31  -6.005   6.124   4.970
  257    HA   PRO  32           HA       PRO  32  -6.327   0.443  -2.757
  258    HB2  PRO  32           HB2      PRO  32  -6.903  -2.242  -3.107
  259    HB3  PRO  32           HB3      PRO  32  -5.362  -1.477  -3.554
  260    HG2  PRO  32           HG2      PRO  32  -6.012  -3.094  -1.121
  261    HG3  PRO  32           HG3      PRO  32  -4.504  -3.079  -2.038
  262    HD2  PRO  32           HD2      PRO  32  -4.738  -1.727   0.299
  263    HD3  PRO  32           HD3      PRO  32  -3.704  -1.186  -1.063
  264    H    SER  33           H        SER  33  -8.462   0.192  -3.459
  265    HA   SER  33           HA       SER  33 -10.499  -0.856  -1.581
  266    HB2  SER  33           HB2      SER  33 -10.252   1.535  -1.035
  267    HB3  SER  33           HB3      SER  33 -10.547   1.958  -2.736
  268    HG   SER  33           HG       SER  33 -12.524   0.643  -2.441
  269    H    GLY  34           H        GLY  34  -9.328  -1.429  -4.500
  270    HA2  GLY  34           HA2      GLY  34 -11.851  -2.264  -5.643
  271    HA3  GLY  34           HA3      GLY  34 -10.872  -1.165  -6.641
  Start of MODEL    3
    1    H1   LYS   1           H1       LYS   1 -10.917  -0.529  -2.568
    2    H2   LYS   1           H2       LYS   1 -12.419  -0.678  -3.219
    3    H3   LYS   1           H3       LYS   1 -12.096   0.521  -2.135
    4    HA   LYS   1           HA       LYS   1 -12.237   1.453  -4.298
    5    HB2  LYS   1           HB2      LYS   1  -9.266   1.429  -3.687
    6    HB3  LYS   1           HB3      LYS   1 -10.246   2.679  -4.442
    7    HG2  LYS   1           HG2      LYS   1 -11.377   2.949  -2.147
    8    HG3  LYS   1           HG3      LYS   1 -10.131   1.846  -1.520
    9    HD2  LYS   1           HD2      LYS   1  -8.405   3.486  -2.618
   10    HD3  LYS   1           HD3      LYS   1  -9.775   4.591  -2.774
   11    HE2  LYS   1           HE2      LYS   1  -9.045   5.293  -0.723
   12    HE3  LYS   1           HE3      LYS   1 -10.100   3.982  -0.179
   13    HZ1  LYS   1           HZ1      LYS   1  -7.943   2.564  -0.300
   14    HZ2  LYS   1           HZ2      LYS   1  -7.134   3.971  -0.428
   15    HZ3  LYS   1           HZ3      LYS   1  -8.036   3.663   0.908
   16    H    LEU   2           H        LEU   2  -9.005   0.236  -5.011
   17    HA   LEU   2           HA       LEU   2  -9.802  -0.970  -7.455
   18    HB2  LEU   2           HB2      LEU   2  -7.141  -1.399  -6.091
   19    HB3  LEU   2           HB3      LEU   2  -7.478  -1.529  -7.720
   20    HG   LEU   2           HG       LEU   2  -7.712   0.823  -8.097
   21   HD11  LEU   2          HD11      LEU   2  -8.357   1.908  -6.077
   22   HD12  LEU   2          HD12      LEU   2  -7.008   1.178  -5.153
   23   HD13  LEU   2          HD13      LEU   2  -6.713   2.409  -6.386
   24   HD21  LEU   2          HD21      LEU   2  -5.297   1.287  -7.842
   25   HD22  LEU   2          HD22      LEU   2  -5.150  -0.054  -6.683
   26   HD23  LEU   2          HD23      LEU   2  -5.577  -0.371  -8.373
   27    HA   PRO   3           HA       PRO   3 -10.902  -5.067  -6.809
   28    HB2  PRO   3           HB2      PRO   3  -8.213  -5.918  -7.961
   29    HB3  PRO   3           HB3      PRO   3  -9.825  -6.583  -8.407
   30    HG2  PRO   3           HG2      PRO   3  -8.744  -4.777 -10.008
   31    HG3  PRO   3           HG3      PRO   3 -10.426  -4.442  -9.436
   32    HD2  PRO   3           HD2      PRO   3  -7.807  -3.460  -8.238
   33    HD3  PRO   3           HD3      PRO   3  -9.221  -2.494  -8.678
   34    HA   PRO   4           HA       PRO   4  -9.098  -7.785  -3.640
   35    HB2  PRO   4           HB2      PRO   4 -10.158 -10.213  -4.393
   36    HB3  PRO   4           HB3      PRO   4 -11.107  -8.945  -3.554
   37    HG2  PRO   4           HG2      PRO   4 -10.983  -9.522  -6.527
   38    HG3  PRO   4           HG3      PRO   4 -12.434  -9.244  -5.509
   39    HD2  PRO   4           HD2      PRO   4 -11.368  -7.270  -7.006
   40    HD3  PRO   4           HD3      PRO   4 -12.005  -6.921  -5.376
   41    H    GLY   5           H        GLY   5  -7.180  -9.009  -3.602
   42    HA2  GLY   5           HA2      GLY   5  -5.465 -10.376  -4.804
   43    HA3  GLY   5           HA3      GLY   5  -5.863  -9.463  -6.248
   44    H    TRP   6           H        TRP   6  -6.103  -6.722  -4.873
   45    HA   TRP   6           HA       TRP   6  -3.274  -6.100  -4.659
   46    HB2  TRP   6           HB2      TRP   6  -5.843  -4.618  -4.063
   47    HB3  TRP   6           HB3      TRP   6  -4.234  -3.953  -3.831
   48    HD1  TRP   6           HD1      TRP   6  -6.733  -4.579  -6.555
   49    HE1  TRP   6           HE1      TRP   6  -5.900  -3.459  -8.710
   50    HE3  TRP   6           HE3      TRP   6  -1.985  -3.541  -5.094
   51    HZ2  TRP   6           HZ2      TRP   6  -3.439  -2.281  -9.692
   52    HZ3  TRP   6           HZ3      TRP   6  -0.428  -2.443  -6.600
   53    HH2  TRP   6           HH2      TRP   6  -1.115  -1.779  -8.923
   54    H    GLU   7           H        GLU   7  -1.970  -6.444  -2.949
   55    HA   GLU   7           HA       GLU   7  -3.128  -6.486  -0.207
   56    HB2  GLU   7           HB2      GLU   7  -2.674  -8.739  -1.594
   57    HB3  GLU   7           HB3      GLU   7  -1.026  -8.485  -1.045
   58    HG2  GLU   7           HG2      GLU   7  -3.494  -8.606   0.764
   59    HG3  GLU   7           HG3      GLU   7  -2.492 -10.000   0.362
   60    H    LYS   8           H        LYS   8  -1.645  -6.029   1.470
   61    HA   LYS   8           HA       LYS   8  -0.041  -3.729   0.955
   62    HB2  LYS   8           HB2      LYS   8  -1.146  -3.634   2.917
   63    HB3  LYS   8           HB3      LYS   8  -1.016  -5.311   3.292
   64    HG2  LYS   8           HG2      LYS   8   1.277  -3.333   3.592
   65    HG3  LYS   8           HG3      LYS   8   0.087  -3.673   4.837
   66    HD2  LYS   8           HD2      LYS   8   2.306  -5.482   3.877
   67    HD3  LYS   8           HD3      LYS   8   1.958  -4.870   5.464
   68    HE2  LYS   8           HE2      LYS   8   1.425  -7.109   5.623
   69    HE3  LYS   8           HE3      LYS   8  -0.154  -6.333   5.488
   70    HZ1  LYS   8           HZ1      LYS   8   0.488  -8.420   3.994
   71    HZ2  LYS   8           HZ2      LYS   8  -0.468  -7.285   3.382
   72    HZ3  LYS   8           HZ3      LYS   8   1.106  -7.255   3.002
   73    H    ARG   9           H        ARG   9   2.093  -3.326   0.917
   74    HA   ARG   9           HA       ARG   9   4.106  -5.390   1.584
   75    HB2  ARG   9           HB2      ARG   9   3.944  -3.917  -1.085
   76    HB3  ARG   9           HB3      ARG   9   5.353  -4.826  -0.545
   77    HG2  ARG   9           HG2      ARG   9   2.609  -6.003  -1.118
   78    HG3  ARG   9           HG3      ARG   9   4.017  -6.044  -2.184
   79    HD2  ARG   9           HD2      ARG   9   5.261  -7.421  -0.631
   80    HD3  ARG   9           HD3      ARG   9   3.967  -7.348   0.561
   81    HE   ARG   9           HE       ARG   9   4.025  -8.925  -1.936
   82   HH11  ARG   9          HH21      ARG   9   1.947  -7.784   0.636
   83   HH12  ARG   9          HH22      ARG   9   0.876  -9.134   0.646
   84   HH21  ARG   9          HH11      ARG   9   2.557 -10.677  -2.070
   85   HH22  ARG   9          HH12      ARG   9   1.188 -10.668  -0.982
   86    H    MET  10           H        MET  10   6.372  -4.290   1.509
   87    HA   MET  10           HA       MET  10   6.189  -1.464   2.391
   88    HB2  MET  10           HB2      MET  10   6.013  -2.975   4.364
   89    HB3  MET  10           HB3      MET  10   7.572  -3.695   3.927
   90    HG2  MET  10           HG2      MET  10   8.627  -1.450   4.128
   91    HG3  MET  10           HG3      MET  10   7.077  -0.764   4.600
   92    HE1  MET  10           HE1      MET  10   6.532  -1.868   8.201
   93    HE2  MET  10           HE2      MET  10   6.247  -0.610   6.979
   94    HE3  MET  10           HE3      MET  10   5.690  -2.278   6.689
   95    H    PHE  11           H        PHE  11   7.813  -0.198   1.703
   96    HA   PHE  11           HA       PHE  11   9.696  -1.243  -0.195
   97    HB2  PHE  11           HB2      PHE  11   8.468   0.967  -0.275
   98    HB3  PHE  11           HB3      PHE  11   9.579   1.550   0.954
   99    HD1  PHE  11           HD1      PHE  11  12.069   1.654   0.418
  100    HD2  PHE  11           HD2      PHE  11   9.113   0.740  -2.582
  101    HE1  PHE  11           HE1      PHE  11  13.713   2.183  -1.362
  102    HE2  PHE  11           HE2      PHE  11  10.765   1.250  -4.360
  103    HZ   PHE  11           HZ       PHE  11  13.066   1.973  -3.757
  104    H    ARG  12           H        ARG  12  11.269  -2.476   0.551
  105    HA   ARG  12           HA       ARG  12  12.763  -2.434   2.845
  106    HB2  ARG  12           HB2      ARG  12  14.695  -3.299   1.297
  107    HB3  ARG  12           HB3      ARG  12  13.237  -4.227   1.563
  108    HG2  ARG  12           HG2      ARG  12  13.880  -4.404  -0.740
  109    HG3  ARG  12           HG3      ARG  12  12.333  -3.603  -0.610
  110    HD2  ARG  12           HD2      ARG  12  13.508  -2.501  -2.319
  111    HD3  ARG  12           HD3      ARG  12  13.514  -1.387  -0.974
  112    HE   ARG  12           HE       ARG  12  15.807  -3.199  -1.694
  113   HH11  ARG  12          HH11      ARG  12  14.924  -0.031  -0.492
  114   HH12  ARG  12          HH12      ARG  12  16.425   0.701  -1.025
  115   HH21  ARG  12          HH21      ARG  12  17.792  -2.286  -2.121
  116   HH22  ARG  12          HH22      ARG  12  18.058  -0.607  -1.772
  117    H    SER  13           H        SER  13  14.476  -1.499   3.716
  118    HA   SER  13           HA       SER  13  16.021  -0.026   4.280
  119    HB2  SER  13           HB2      SER  13  17.028  -0.469   2.041
  120    HB3  SER  13           HB3      SER  13  16.183   0.978   1.436
  121    HG   SER  13           HG       SER  13  17.179   2.029   3.344
  122    H    ASN  14           H        ASN  14  12.948   1.107   3.345
  123    HA   ASN  14           HA       ASN  14  13.562   3.410   5.074
  124    HB2  ASN  14           HB2      ASN  14  12.540   5.085   3.751
  125    HB3  ASN  14           HB3      ASN  14  13.802   4.315   2.807
  126   HD21  ASN  14          HD22      ASN  14  12.999   4.834   0.726
  127   HD22  ASN  14          HD21      ASN  14  11.444   4.232   0.188
  128    H    GLY  15           H        GLY  15  11.104   1.129   3.901
  129    HA2  GLY  15           HA2      GLY  15   9.606   0.191   5.432
  130    HA3  GLY  15           HA3      GLY  15   9.723   1.596   6.484
  131    H    THR  16           H        THR  16   9.275   2.652   3.272
  132    HA   THR  16           HA       THR  16   6.687   3.723   3.717
  133    HB   THR  16           HB       THR  16   7.931   3.095   1.008
  134    HG1  THR  16           HG1      THR  16   9.375   4.296   2.134
  135   HG21  THR  16          HG21      THR  16   6.622   5.060   0.274
  136   HG22  THR  16          HG22      THR  16   5.564   3.766   0.862
  137   HG23  THR  16          HG23      THR  16   5.892   5.182   1.890
  138    H    VAL  17           H        VAL  17   4.806   2.590   3.982
  139    HA   VAL  17           HA       VAL  17   4.520  -0.077   2.815
  140    HB   VAL  17           HB       VAL  17   2.682   1.659   4.476
  141   HG11  VAL  17          HG11      VAL  17   2.055  -1.100   3.348
  142   HG12  VAL  17          HG12      VAL  17   1.155  -0.307   4.658
  143   HG13  VAL  17          HG13      VAL  17   1.153   0.403   3.044
  144   HG21  VAL  17          HG21      VAL  17   4.599   0.501   5.599
  145   HG22  VAL  17          HG22      VAL  17   3.042  -0.151   6.132
  146   HG23  VAL  17          HG23      VAL  17   4.016  -1.051   4.947
  147    H    TYR  18           H        TYR  18   3.217  -0.711   1.232
  148    HA   TYR  18           HA       TYR  18   1.676   1.143  -0.426
  149    HB2  TYR  18           HB2      TYR  18   2.939   0.909  -2.407
  150    HB3  TYR  18           HB3      TYR  18   4.069   1.396  -1.173
  151    HD1  TYR  18           HD2      TYR  18   5.706  -0.295  -0.236
  152    HD2  TYR  18           HD1      TYR  18   3.202  -1.088  -3.650
  153    HE1  TYR  18           HE2      TYR  18   7.206  -2.179  -0.912
  154    HE2  TYR  18           HE1      TYR  18   4.672  -3.004  -4.290
  155    HH   TYR  18           HH       TYR  18   7.618  -3.811  -2.444
  156    H    TYR  19           H        TYR  19   1.059  -0.445  -2.575
  157    HA   TYR  19           HA       TYR  19   0.352  -3.112  -1.463
  158    HB2  TYR  19           HB2      TYR  19  -1.460  -0.991  -2.540
  159    HB3  TYR  19           HB3      TYR  19  -1.792  -2.640  -2.992
  160    HD1  TYR  19           HD1      TYR  19  -0.987  -0.734   0.193
  161    HD2  TYR  19           HD2      TYR  19  -3.250  -3.869  -1.705
  162    HE1  TYR  19           HE1      TYR  19  -2.144  -1.232   2.334
  163    HE2  TYR  19           HE2      TYR  19  -4.496  -4.264   0.398
  164    HH   TYR  19           HH       TYR  19  -5.033  -2.762   2.530
  165    H    PHE  20           H        PHE  20   0.055  -4.730  -2.837
  166    HA   PHE  20           HA       PHE  20   1.179  -4.538  -5.598
  167    HB2  PHE  20           HB2      PHE  20   2.911  -5.210  -4.066
  168    HB3  PHE  20           HB3      PHE  20   1.844  -6.387  -3.289
  169    HD1  PHE  20           HD1      PHE  20   3.707  -5.632  -6.426
  170    HD2  PHE  20           HD2      PHE  20   1.601  -8.634  -4.139
  171    HE1  PHE  20           HE1      PHE  20   4.638  -7.405  -7.887
  172    HE2  PHE  20           HE2      PHE  20   2.582 -10.403  -5.580
  173    HZ   PHE  20           HZ       PHE  20   4.096  -9.796  -7.444
  174    H    ASN  21           H        ASN  21  -0.118  -5.478  -7.058
  175    HA   ASN  21           HA       ASN  21  -2.445  -7.048  -6.209
  176    HB2  ASN  21           HB2      ASN  21  -2.528  -5.372  -8.087
  177    HB3  ASN  21           HB3      ASN  21  -1.455  -6.416  -8.989
  178   HD21  ASN  21          HD22      ASN  21  -4.765  -5.984  -7.758
  179   HD22  ASN  21          HD21      ASN  21  -5.383  -7.434  -8.536
  180    H    HIS  22           H        HIS  22  -1.869  -8.977  -5.369
  181    HA   HIS  22           HA       HIS  22   0.394 -10.461  -6.311
  182    HB2  HIS  22           HB2      HIS  22   0.008 -11.853  -4.521
  183    HB3  HIS  22           HB3      HIS  22  -0.662 -10.341  -3.955
  184    HD1  HIS  22           HD1      HIS  22  -2.032 -13.504  -5.705
  185    HD2  HIS  22           HD2      HIS  22  -3.062 -10.568  -2.885
  186    HE1  HIS  22           HE1      HIS  22  -4.337 -14.186  -4.722
  187    H    ILE  23           H        ILE  23  -2.393 -10.075  -7.992
  188    HA   ILE  23           HA       ILE  23  -2.513 -12.868  -9.026
  189    HB   ILE  23           HB       ILE  23  -4.507 -10.575  -9.248
  190   HG12  ILE  23          HG12      ILE  23  -4.501 -13.058  -7.468
  191   HG13  ILE  23          HG13      ILE  23  -4.362 -11.386  -6.931
  192   HG21  ILE  23          HG21      ILE  23  -4.814 -13.505 -10.013
  193   HG22  ILE  23          HG22      ILE  23  -6.054 -12.236 -10.148
  194   HG23  ILE  23          HG23      ILE  23  -4.625 -12.160 -11.163
  195   HD11  ILE  23          HD11      ILE  23  -6.579 -12.056  -6.455
  196   HD12  ILE  23          HD12      ILE  23  -6.685 -10.963  -7.850
  197   HD13  ILE  23          HD13      ILE  23  -6.830 -12.725  -8.070
  198    H    THR  24           H        THR  24  -1.776  -9.536  -9.853
  199    HA   THR  24           HA       THR  24  -1.107 -10.300 -12.683
  200    HB   THR  24           HB       THR  24  -1.407  -7.917 -13.205
  201    HG1  THR  24           HG1      THR  24  -2.390  -7.704 -10.580
  202   HG21  THR  24          HG21      THR  24  -3.426  -9.347 -13.394
  203   HG22  THR  24          HG22      THR  24  -3.844  -8.986 -11.706
  204   HG23  THR  24          HG23      THR  24  -3.824  -7.685 -12.909
  205    H    ASN  25           H        ASN  25   0.280  -9.158  -9.753
  206    HA   ASN  25           HA       ASN  25   2.205  -8.541  -9.048
  207    HB2  ASN  25           HB2      ASN  25   4.081  -9.319  -9.873
  208    HB3  ASN  25           HB3      ASN  25   3.084 -10.078 -11.100
  209   HD21  ASN  25          HD22      ASN  25   2.639  -8.324 -13.046
  210   HD22  ASN  25          HD21      ASN  25   4.174  -7.605 -13.588
  211    H    ALA  26           H        ALA  26   0.220  -6.637 -10.703
  212    HA   ALA  26           HA       ALA  26   1.798  -4.306 -11.171
  213    HB1  ALA  26           HB1      ALA  26  -0.501  -4.679 -12.024
  214    HB2  ALA  26           HB2      ALA  26  -1.134  -4.529 -10.369
  215    HB3  ALA  26           HB3      ALA  26  -0.356  -3.141 -11.155
  216    H    SER  27           H        SER  27   1.788  -2.259  -9.932
  217    HA   SER  27           HA       SER  27   1.911  -2.615  -6.966
  218    HB2  SER  27           HB2      SER  27   4.001  -1.337  -7.051
  219    HB3  SER  27           HB3      SER  27   4.139  -2.815  -8.027
  220    HG   SER  27           HG       SER  27   3.295  -0.364  -9.170
  221    H    GLN  28           H        GLN  28   1.096  -0.901  -5.749
  222    HA   GLN  28           HA       GLN  28   0.689   1.763  -6.956
  223    HB2  GLN  28           HB2      GLN  28  -1.341   0.536  -7.530
  224    HB3  GLN  28           HB3      GLN  28  -1.499  -0.072  -5.884
  225    HG2  GLN  28           HG2      GLN  28  -3.123   1.708  -6.465
  226    HG3  GLN  28           HG3      GLN  28  -2.154   2.050  -5.044
  227   HE21  GLN  28          HE22      GLN  28  -2.183   2.771  -8.644
  228   HE22  GLN  28          HE21      GLN  28  -1.543   4.381  -8.360
  229    H    PHE  29           H        PHE  29   0.303   3.412  -5.246
  230    HA   PHE  29           HA       PHE  29   1.511   2.621  -2.658
  231    HB2  PHE  29           HB2      PHE  29   0.907   5.347  -3.812
  232    HB3  PHE  29           HB3      PHE  29   1.777   5.012  -2.315
  233    HD1  PHE  29           HD1      PHE  29   3.790   3.152  -2.699
  234    HD2  PHE  29           HD2      PHE  29   2.274   5.909  -5.651
  235    HE1  PHE  29           HE1      PHE  29   5.913   2.967  -3.962
  236    HE2  PHE  29           HE2      PHE  29   4.403   5.720  -6.911
  237    HZ   PHE  29           HZ       PHE  29   6.223   4.249  -6.071
  238    H    GLU  30           H        GLU  30  -1.556   3.991  -3.979
  239    HA   GLU  30           HA       GLU  30  -2.693   4.159  -1.312
  240    HB2  GLU  30           HB2      GLU  30  -3.557   4.836  -4.006
  241    HB3  GLU  30           HB3      GLU  30  -4.820   3.928  -3.199
  242    HG2  GLU  30           HG2      GLU  30  -3.450   6.440  -2.135
  243    HG3  GLU  30           HG3      GLU  30  -5.084   6.344  -2.806
  244    H    ARG  31           H        ARG  31  -4.426   2.968  -0.518
  245    HA   ARG  31           HA       ARG  31  -3.821   0.045  -0.586
  246    HB2  ARG  31           HB2      ARG  31  -5.326   1.696   1.447
  247    HB3  ARG  31           HB3      ARG  31  -4.803   0.039   1.670
  248    HG2  ARG  31           HG2      ARG  31  -2.493   0.709   1.930
  249    HG3  ARG  31           HG3      ARG  31  -2.731   2.233   1.244
  250    HD2  ARG  31           HD2      ARG  31  -3.720   1.269   3.950
  251    HD3  ARG  31           HD3      ARG  31  -2.476   2.489   3.647
  252    HE   ARG  31           HE       ARG  31  -5.397   2.764   3.573
  253   HH11  ARG  31          HH12      ARG  31  -2.487   4.365   2.226
  254   HH12  ARG  31          HH11      ARG  31  -3.581   5.491   1.368
  255   HH21  ARG  31          HH21      ARG  31  -6.482   4.371   2.526
  256   HH22  ARG  31          HH22      ARG  31  -5.507   5.497   1.518
  257    HA   PRO  32           HA       PRO  32  -7.857   0.219  -2.598
  258    HB2  PRO  32           HB2      PRO  32  -7.557  -2.722  -3.232
  259    HB3  PRO  32           HB3      PRO  32  -8.063  -1.374  -4.182
  260    HG2  PRO  32           HG2      PRO  32  -5.631  -2.322  -4.496
  261    HG3  PRO  32           HG3      PRO  32  -5.817  -0.609  -4.540
  262    HD2  PRO  32           HD2      PRO  32  -5.017  -2.213  -2.091
  263    HD3  PRO  32           HD3      PRO  32  -4.247  -0.734  -2.738
  264    H    SER  33           H        SER  33  -6.974  -1.792  -0.281
  265    HA   SER  33           HA       SER  33  -9.480  -2.818   0.814
  266    HB2  SER  33           HB2      SER  33  -8.186  -3.310   2.848
  267    HB3  SER  33           HB3      SER  33  -7.322  -3.835   1.393
  268    HG   SER  33           HG       SER  33  -6.851  -1.475   2.925
  269    H    GLY  34           H        GLY  34  -7.919   0.362   1.134
  270    HA2  GLY  34           HA2      GLY  34  -9.784   1.933   2.282
  271    HA3  GLY  34           HA3      GLY  34  -9.318   0.948   3.671
  Start of MODEL    4
    1    H1   LYS   1           H1       LYS   1 -13.535   0.284  -4.415
    2    H2   LYS   1           H2       LYS   1 -13.281   1.281  -3.118
    3    H3   LYS   1           H3       LYS   1 -12.420  -0.127  -3.298
    4    HA   LYS   1           HA       LYS   1 -12.308   2.173  -5.136
    5    HB2  LYS   1           HB2      LYS   1 -10.278   1.294  -3.046
    6    HB3  LYS   1           HB3      LYS   1  -9.983   2.495  -4.317
    7    HG2  LYS   1           HG2      LYS   1 -12.010   3.775  -3.439
    8    HG3  LYS   1           HG3      LYS   1 -11.959   2.726  -2.014
    9    HD2  LYS   1           HD2      LYS   1  -9.679   4.489  -3.015
   10    HD3  LYS   1           HD3      LYS   1 -10.781   4.926  -1.707
   11    HE2  LYS   1           HE2      LYS   1  -9.932   3.248  -0.244
   12    HE3  LYS   1           HE3      LYS   1  -9.180   2.360  -1.578
   13    HZ1  LYS   1           HZ1      LYS   1  -7.477   3.448  -0.482
   14    HZ2  LYS   1           HZ2      LYS   1  -7.627   4.131  -1.907
   15    HZ3  LYS   1           HZ3      LYS   1  -8.193   4.965  -0.583
   16    H    LEU   2           H        LEU   2  -9.283   0.890  -5.340
   17    HA   LEU   2           HA       LEU   2  -9.867  -0.598  -7.676
   18    HB2  LEU   2           HB2      LEU   2  -7.234  -0.842  -6.228
   19    HB3  LEU   2           HB3      LEU   2  -7.538  -1.065  -7.847
   20    HG   LEU   2           HG       LEU   2  -7.821   1.213  -8.397
   21   HD11  LEU   2          HD11      LEU   2  -8.640   2.398  -6.485
   22   HD12  LEU   2          HD12      LEU   2  -7.290   1.812  -5.461
   23   HD13  LEU   2          HD13      LEU   2  -7.020   2.971  -6.774
   24   HD21  LEU   2          HD21      LEU   2  -5.308   0.549  -6.781
   25   HD22  LEU   2          HD22      LEU   2  -5.621   0.106  -8.463
   26   HD23  LEU   2          HD23      LEU   2  -5.436   1.804  -8.027
   27    HA   PRO   3           HA       PRO   3 -10.896  -4.644  -6.914
   28    HB2  PRO   3           HB2      PRO   3  -8.135  -5.507  -7.873
   29    HB3  PRO   3           HB3      PRO   3  -9.707  -6.214  -8.361
   30    HG2  PRO   3           HG2      PRO   3  -8.553  -4.471  -9.989
   31    HG3  PRO   3           HG3      PRO   3 -10.282  -4.171  -9.555
   32    HD2  PRO   3           HD2      PRO   3  -7.790  -2.997  -8.258
   33    HD3  PRO   3           HD3      PRO   3  -9.229  -2.141  -8.858
   34    HA   PRO   4           HA       PRO   4  -9.229  -7.088  -3.470
   35    HB2  PRO   4           HB2      PRO   4 -10.270  -9.561  -4.071
   36    HB3  PRO   4           HB3      PRO   4 -11.255  -8.228  -3.388
   37    HG2  PRO   4           HG2      PRO   4 -10.985  -9.052  -6.292
   38    HG3  PRO   4           HG3      PRO   4 -12.484  -8.690  -5.376
   39    HD2  PRO   4           HD2      PRO   4 -11.322  -6.851  -6.979
   40    HD3  PRO   4           HD3      PRO   4 -12.062  -6.365  -5.429
   41    H    GLY   5           H        GLY   5  -7.317  -8.308  -3.286
   42    HA2  GLY   5           HA2      GLY   5  -5.567  -9.758  -4.320
   43    HA3  GLY   5           HA3      GLY   5  -5.908  -8.958  -5.847
   44    H    TRP   6           H        TRP   6  -6.175  -6.099  -4.714
   45    HA   TRP   6           HA       TRP   6  -3.357  -5.483  -4.409
   46    HB2  TRP   6           HB2      TRP   6  -5.934  -3.929  -4.009
   47    HB3  TRP   6           HB3      TRP   6  -4.324  -3.275  -3.776
   48    HD1  TRP   6           HD1      TRP   6  -6.734  -4.049  -6.518
   49    HE1  TRP   6           HE1      TRP   6  -5.828  -3.009  -8.686
   50    HE3  TRP   6           HE3      TRP   6  -2.037  -2.956  -4.931
   51    HZ2  TRP   6           HZ2      TRP   6  -3.299  -1.919  -9.639
   52    HZ3  TRP   6           HZ3      TRP   6  -0.419  -1.908  -6.422
   53    HH2  TRP   6           HH2      TRP   6  -1.013  -1.380  -8.795
   54    H    GLU   7           H        GLU   7  -2.159  -5.848  -2.614
   55    HA   GLU   7           HA       GLU   7  -3.439  -5.782   0.079
   56    HB2  GLU   7           HB2      GLU   7  -3.140  -8.050  -1.143
   57    HB3  GLU   7           HB3      GLU   7  -1.418  -7.857  -0.852
   58    HG2  GLU   7           HG2      GLU   7  -3.611  -7.902   1.278
   59    HG3  GLU   7           HG3      GLU   7  -2.679  -9.308   0.772
   60    H    LYS   8           H        LYS   8  -2.037  -5.265   1.800
   61    HA   LYS   8           HA       LYS   8  -0.208  -3.161   1.404
   62    HB2  LYS   8           HB2      LYS   8  -1.434  -3.184   3.362
   63    HB3  LYS   8           HB3      LYS   8  -1.173  -4.852   3.708
   64    HG2  LYS   8           HG2      LYS   8   1.019  -2.756   3.933
   65    HG3  LYS   8           HG3      LYS   8  -0.124  -3.111   5.218
   66    HD2  LYS   8           HD2      LYS   8   2.107  -4.895   4.217
   67    HD3  LYS   8           HD3      LYS   8   1.835  -4.213   5.791
   68    HE2  LYS   8           HE2      LYS   8   1.348  -6.429   6.115
   69    HE3  LYS   8           HE3      LYS   8  -0.257  -5.707   5.983
   70    HZ1  LYS   8           HZ1      LYS   8  -0.595  -6.781   3.925
   71    HZ2  LYS   8           HZ2      LYS   8   0.951  -6.787   3.522
   72    HZ3  LYS   8           HZ3      LYS   8   0.371  -7.873   4.632
   73    H    ARG   9           H        ARG   9   1.942  -2.954   1.246
   74    HA   ARG   9           HA       ARG   9   3.769  -5.105   2.090
   75    HB2  ARG   9           HB2      ARG   9   3.843  -3.879  -0.698
   76    HB3  ARG   9           HB3      ARG   9   5.083  -4.945  -0.035
   77    HG2  ARG   9           HG2      ARG   9   2.209  -5.683  -0.671
   78    HG3  ARG   9           HG3      ARG   9   3.631  -6.114  -1.613
   79    HD2  ARG   9           HD2      ARG   9   4.261  -7.815  -0.219
   80    HD3  ARG   9           HD3      ARG   9   3.689  -7.009   1.229
   81    HE   ARG   9           HE       ARG   9   1.476  -7.723   0.886
   82   HH11  ARG   9          HH11      ARG   9   3.466  -9.038  -1.696
   83   HH12  ARG   9          HH12      ARG   9   2.370 -10.370  -1.977
   84   HH21  ARG   9          HH22      ARG   9   0.193  -9.307   0.528
   85   HH22  ARG   9          HH21      ARG   9   0.415 -10.498  -0.766
   86    H    MET  10           H        MET  10   6.136  -4.226   1.830
   87    HA   MET  10           HA       MET  10   6.238  -1.349   2.536
   88    HB2  MET  10           HB2      MET  10   6.030  -2.684   4.621
   89    HB3  MET  10           HB3      MET  10   7.468  -3.611   4.157
   90    HG2  MET  10           HG2      MET  10   8.777  -1.482   4.125
   91    HG3  MET  10           HG3      MET  10   7.349  -0.609   4.673
   92    HE1  MET  10           HE1      MET  10   6.706  -0.298   7.116
   93    HE2  MET  10           HE2      MET  10   5.996  -1.924   6.944
   94    HE3  MET  10           HE3      MET  10   6.988  -1.529   8.366
   95    H    PHE  11           H        PHE  11   7.866  -0.301   1.591
   96    HA   PHE  11           HA       PHE  11   9.564  -1.624  -0.283
   97    HB2  PHE  11           HB2      PHE  11   8.502   0.705  -0.354
   98    HB3  PHE  11           HB3      PHE  11   9.827   1.233   0.660
   99    HD1  PHE  11           HD1      PHE  11  12.291   0.535  -0.291
  100    HD2  PHE  11           HD2      PHE  11   8.693   0.818  -2.664
  101    HE1  PHE  11           HE1      PHE  11  13.654   0.783  -2.332
  102    HE2  PHE  11           HE2      PHE  11  10.072   1.085  -4.704
  103    HZ   PHE  11           HZ       PHE  11  12.552   1.070  -4.548
  104    H    ARG  12           H        ARG  12  10.769  -3.102   0.812
  105    HA   ARG  12           HA       ARG  12  12.533  -2.933   2.906
  106    HB2  ARG  12           HB2      ARG  12  12.042  -4.924   1.543
  107    HB3  ARG  12           HB3      ARG  12  12.952  -4.262   0.196
  108    HG2  ARG  12           HG2      ARG  12  14.634  -4.339   2.607
  109    HG3  ARG  12           HG3      ARG  12  13.861  -5.897   2.356
  110    HD2  ARG  12           HD2      ARG  12  16.010  -5.879   1.247
  111    HD3  ARG  12           HD3      ARG  12  14.724  -6.000   0.051
  112    HE   ARG  12           HE       ARG  12  16.228  -3.458   0.704
  113   HH11  ARG  12          HH11      ARG  12  14.618  -5.334  -1.798
  114   HH12  ARG  12          HH12      ARG  12  15.001  -4.143  -3.014
  115   HH21  ARG  12          HH21      ARG  12  16.622  -2.076  -0.747
  116   HH22  ARG  12          HH22      ARG  12  16.178  -2.281  -2.439
  117    H    SER  13           H        SER  13  14.322  -1.931   3.400
  118    HA   SER  13           HA       SER  13  16.284  -0.819   3.364
  119    HB2  SER  13           HB2      SER  13  15.932  -0.196   0.416
  120    HB3  SER  13           HB3      SER  13  17.317   0.222   1.415
  121    HG   SER  13           HG       SER  13  17.878  -1.843   1.621
  122    H    ASN  14           H        ASN  14  13.187   0.556   2.703
  123    HA   ASN  14           HA       ASN  14  14.234   2.883   4.199
  124    HB2  ASN  14           HB2      ASN  14  13.186   4.561   2.852
  125    HB3  ASN  14           HB3      ASN  14  14.312   3.629   1.877
  126   HD21  ASN  14          HD21      ASN  14  13.470   3.572  -0.209
  127   HD22  ASN  14          HD22      ASN  14  11.790   3.203  -0.532
  128    H    GLY  15           H        GLY  15  11.419   0.865   3.422
  129    HA2  GLY  15           HA2      GLY  15  10.013   0.162   5.178
  130    HA3  GLY  15           HA3      GLY  15  10.377   1.606   6.108
  131    H    THR  16           H        THR  16   9.708   2.551   2.916
  132    HA   THR  16           HA       THR  16   7.245   3.835   3.493
  133    HB   THR  16           HB       THR  16   8.242   2.960   0.750
  134    HG1  THR  16           HG1      THR  16   9.840   4.115   1.658
  135   HG21  THR  16          HG21      THR  16   5.921   3.795   0.709
  136   HG22  THR  16          HG22      THR  16   6.416   5.241   1.622
  137   HG23  THR  16          HG23      THR  16   7.025   4.970  -0.025
  138    H    VAL  17           H        VAL  17   5.323   2.831   3.990
  139    HA   VAL  17           HA       VAL  17   4.738   0.158   2.932
  140    HB   VAL  17           HB       VAL  17   3.215   2.055   4.724
  141   HG11  VAL  17          HG11      VAL  17   2.229  -0.641   3.697
  142   HG12  VAL  17          HG12      VAL  17   1.534   0.249   5.067
  143   HG13  VAL  17          HG13      VAL  17   1.449   0.939   3.447
  144   HG21  VAL  17          HG21      VAL  17   3.565   0.223   6.353
  145   HG22  VAL  17          HG22      VAL  17   4.315  -0.773   5.085
  146   HG23  VAL  17          HG23      VAL  17   5.118   0.713   5.657
  147    H    TYR  18           H        TYR  18   3.207  -0.400   1.503
  148    HA   TYR  18           HA       TYR  18   1.776   1.551  -0.141
  149    HB2  TYR  18           HB2      TYR  18   2.983   1.235  -2.141
  150    HB3  TYR  18           HB3      TYR  18   4.194   1.572  -0.924
  151    HD1  TYR  18           HD2      TYR  18   5.646  -0.246  -0.043
  152    HD2  TYR  18           HD1      TYR  18   3.048  -0.740  -3.413
  153    HE1  TYR  18           HE2      TYR  18   6.907  -2.338  -0.727
  154    HE2  TYR  18           HE1      TYR  18   4.226  -2.830  -4.057
  155    HH   TYR  18           HH       TYR  18   5.973  -4.242  -3.573
  156    H    TYR  19           H        TYR  19   0.947   0.020  -2.270
  157    HA   TYR  19           HA       TYR  19   0.158  -2.607  -1.121
  158    HB2  TYR  19           HB2      TYR  19  -1.554  -0.416  -2.136
  159    HB3  TYR  19           HB3      TYR  19  -1.943  -2.005  -2.723
  160    HD1  TYR  19           HD2      TYR  19  -1.152  -0.385   0.636
  161    HD2  TYR  19           HD1      TYR  19  -3.540  -3.176  -1.589
  162    HE1  TYR  19           HE2      TYR  19  -2.438  -0.954   2.685
  163    HE2  TYR  19           HE1      TYR  19  -4.826  -3.732   0.437
  164    HH   TYR  19           HH       TYR  19  -5.166  -3.346   2.649
  165    H    PHE  20           H        PHE  20  -0.122  -4.222  -2.451
  166    HA   PHE  20           HA       PHE  20   1.073  -4.095  -5.195
  167    HB2  PHE  20           HB2      PHE  20   2.747  -4.797  -3.545
  168    HB3  PHE  20           HB3      PHE  20   1.619  -5.978  -2.881
  169    HD1  PHE  20           HD1      PHE  20   3.531  -5.133  -5.995
  170    HD2  PHE  20           HD2      PHE  20   1.493  -8.198  -3.737
  171    HE1  PHE  20           HE1      PHE  20   4.477  -6.871  -7.491
  172    HE2  PHE  20           HE2      PHE  20   2.489  -9.932  -5.217
  173    HZ   PHE  20           HZ       PHE  20   3.961  -9.276  -7.090
  174    H    ASN  21           H        ASN  21  -0.153  -5.105  -6.686
  175    HA   ASN  21           HA       ASN  21  -2.519  -6.623  -5.868
  176    HB2  ASN  21           HB2      ASN  21  -2.430  -5.038  -7.858
  177    HB3  ASN  21           HB3      ASN  21  -1.440  -6.249  -8.659
  178   HD21  ASN  21          HD22      ASN  21  -4.686  -5.295  -8.068
  179   HD22  ASN  21          HD21      ASN  21  -5.400  -6.856  -8.475
  180    H    HIS  22           H        HIS  22  -2.003  -8.505  -4.891
  181    HA   HIS  22           HA       HIS  22   0.281 -10.075  -5.702
  182    HB2  HIS  22           HB2      HIS  22  -0.163 -11.388  -3.861
  183    HB3  HIS  22           HB3      HIS  22  -0.777  -9.826  -3.361
  184    HD1  HIS  22           HD1      HIS  22  -2.217 -13.047  -4.938
  185    HD2  HIS  22           HD2      HIS  22  -3.220  -9.898  -2.349
  186    HE1  HIS  22           HE1      HIS  22  -4.547 -13.610  -3.945
  187    H    ILE  23           H        ILE  23  -2.525  -9.717  -7.380
  188    HA   ILE  23           HA       ILE  23  -2.629 -12.531  -8.341
  189    HB   ILE  23           HB       ILE  23  -4.671 -10.293  -8.635
  190   HG12  ILE  23          HG12      ILE  23  -4.610 -12.712  -6.772
  191   HG13  ILE  23          HG13      ILE  23  -4.505 -11.021  -6.290
  192   HG21  ILE  23          HG21      ILE  23  -4.722 -11.945 -10.495
  193   HG22  ILE  23          HG22      ILE  23  -4.891 -13.254  -9.301
  194   HG23  ILE  23          HG23      ILE  23  -6.162 -12.024  -9.493
  195   HD11  ILE  23          HD11      ILE  23  -6.943 -12.442  -7.390
  196   HD12  ILE  23          HD12      ILE  23  -6.707 -11.718  -5.796
  197   HD13  ILE  23          HD13      ILE  23  -6.829 -10.672  -7.226
  198    H    THR  24           H        THR  24  -2.116  -9.133  -9.372
  199    HA   THR  24           HA       THR  24  -1.370 -10.132 -12.097
  200    HB   THR  24           HB       THR  24  -1.614  -7.896 -12.873
  201    HG1  THR  24           HG1      THR  24  -2.345  -6.279 -11.444
  202   HG21  THR  24          HG21      THR  24  -4.001  -8.465 -11.064
  203   HG22  THR  24          HG22      THR  24  -3.983  -7.480 -12.543
  204   HG23  THR  24          HG23      THR  24  -3.716  -9.230 -12.642
  205    H    ASN  25           H        ASN  25   0.074  -8.695  -9.289
  206    HA   ASN  25           HA       ASN  25   2.162  -8.319  -8.673
  207    HB2  ASN  25           HB2      ASN  25   3.213  -8.577 -11.498
  208    HB3  ASN  25           HB3      ASN  25   4.143  -8.501 -10.015
  209   HD21  ASN  25          HD22      ASN  25   2.063 -10.527 -11.974
  210   HD22  ASN  25          HD21      ASN  25   2.511 -12.037 -11.152
  211    H    ALA  26           H        ALA  26   0.148  -6.353 -10.276
  212    HA   ALA  26           HA       ALA  26   1.797  -4.062 -10.803
  213    HB1  ALA  26           HB1      ALA  26  -1.125  -4.208  -9.953
  214    HB2  ALA  26           HB2      ALA  26  -0.317  -2.824 -10.719
  215    HB3  ALA  26           HB3      ALA  26  -0.520  -4.334 -11.622
  216    H    SER  27           H        SER  27   1.867  -2.018  -9.502
  217    HA   SER  27           HA       SER  27   1.903  -2.405  -6.551
  218    HB2  SER  27           HB2      SER  27   4.101  -3.102  -7.456
  219    HB3  SER  27           HB3      SER  27   4.241  -1.543  -8.299
  220    HG   SER  27           HG       SER  27   5.297  -1.350  -6.360
  221    H    GLN  28           H        GLN  28   1.328  -0.529  -5.444
  222    HA   GLN  28           HA       GLN  28   1.637   2.093  -6.699
  223    HB2  GLN  28           HB2      GLN  28  -0.545   0.905  -7.552
  224    HB3  GLN  28           HB3      GLN  28  -1.182   1.226  -5.939
  225    HG2  GLN  28           HG2      GLN  28  -0.832   3.657  -6.306
  226    HG3  GLN  28           HG3      GLN  28  -0.066   3.330  -7.861
  227   HE21  GLN  28          HE22      GLN  28  -2.329   5.094  -7.706
  228   HE22  GLN  28          HE21      GLN  28  -3.637   4.209  -8.475
  229    H    PHE  29           H        PHE  29   1.251   3.865  -5.151
  230    HA   PHE  29           HA       PHE  29   1.502   3.070  -2.342
  231    HB2  PHE  29           HB2      PHE  29   1.353   5.811  -3.606
  232    HB3  PHE  29           HB3      PHE  29   1.785   5.457  -1.937
  233    HD1  PHE  29           HD2      PHE  29   3.753   3.502  -1.779
  234    HD2  PHE  29           HD1      PHE  29   3.190   6.321  -5.000
  235    HE1  PHE  29           HE2      PHE  29   6.129   3.254  -2.413
  236    HE2  PHE  29           HE1      PHE  29   5.573   6.061  -5.632
  237    HZ   PHE  29           HZ       PHE  29   7.046   4.529  -4.343
  238    H    GLU  30           H        GLU  30  -1.163   3.892  -4.407
  239    HA   GLU  30           HA       GLU  30  -3.040   4.706  -2.337
  240    HB2  GLU  30           HB2      GLU  30  -3.751   5.362  -4.426
  241    HB3  GLU  30           HB3      GLU  30  -3.097   3.947  -5.224
  242    HG2  GLU  30           HG2      GLU  30  -5.483   4.017  -5.417
  243    HG3  GLU  30           HG3      GLU  30  -4.950   2.567  -4.584
  244    H    ARG  31           H        ARG  31  -4.170   3.477  -1.059
  245    HA   ARG  31           HA       ARG  31  -3.768   0.539  -0.834
  246    HB2  ARG  31           HB2      ARG  31  -3.181   1.838   1.101
  247    HB3  ARG  31           HB3      ARG  31  -4.718   2.703   1.098
  248    HG2  ARG  31           HG2      ARG  31  -4.943  -0.257   1.259
  249    HG3  ARG  31           HG3      ARG  31  -4.061   0.518   2.596
  250    HD2  ARG  31           HD2      ARG  31  -5.998   1.995   2.978
  251    HD3  ARG  31           HD3      ARG  31  -6.921   1.023   1.803
  252    HE   ARG  31           HE       ARG  31  -5.784   0.081   4.405
  253   HH11  ARG  31          HH21      ARG  31  -8.007  -0.762   1.687
  254   HH12  ARG  31          HH22      ARG  31  -8.465  -2.179   2.634
  255   HH21  ARG  31          HH11      ARG  31  -6.420  -1.957   5.176
  256   HH22  ARG  31          HH12      ARG  31  -7.595  -2.820   4.184
  257    HA   PRO  32           HA       PRO  32  -7.983   0.783  -2.595
  258    HB2  PRO  32           HB2      PRO  32  -7.571  -2.056  -3.490
  259    HB3  PRO  32           HB3      PRO  32  -8.086  -0.616  -4.353
  260    HG2  PRO  32           HG2      PRO  32  -5.661  -1.644  -4.685
  261    HG3  PRO  32           HG3      PRO  32  -5.845   0.076  -4.685
  262    HD2  PRO  32           HD2      PRO  32  -5.124  -1.647  -2.273
  263    HD3  PRO  32           HD3      PRO  32  -4.251  -0.220  -2.876
  264    H    SER  33           H        SER  33  -9.512  -1.561  -2.763
  265    HA   SER  33           HA       SER  33 -10.951  -1.631  -0.380
  266    HB2  SER  33           HB2      SER  33 -11.106  -3.711  -2.574
  267    HB3  SER  33           HB3      SER  33 -12.416  -2.994  -1.625
  268    HG   SER  33           HG       SER  33 -11.110  -2.118  -3.932
  269    H    GLY  34           H        GLY  34  -8.062  -2.858  -0.155
  270    HA2  GLY  34           HA2      GLY  34  -8.779  -5.514   1.050
  271    HA3  GLY  34           HA3      GLY  34  -7.216  -5.147   0.304
  Start of MODEL    5
    1    H1   LYS   1           H1       LYS   1 -12.892   1.356  -3.600
    2    H2   LYS   1           H2       LYS   1 -12.692   2.154  -2.160
    3    H3   LYS   1           H3       LYS   1 -12.018   0.667  -2.392
    4    HA   LYS   1           HA       LYS   1 -11.274   3.188  -3.724
    5    HB2  LYS   1           HB2      LYS   1  -9.607   1.266  -2.049
    6    HB3  LYS   1           HB3      LYS   1  -9.051   2.788  -2.765
    7    HG2  LYS   1           HG2      LYS   1 -10.717   4.022  -1.338
    8    HG3  LYS   1           HG3      LYS   1 -11.167   2.483  -0.594
    9    HD2  LYS   1           HD2      LYS   1  -9.685   3.440   0.934
   10    HD3  LYS   1           HD3      LYS   1  -8.724   2.213   0.102
   11    HE2  LYS   1           HE2      LYS   1  -7.785   4.036  -1.373
   12    HE3  LYS   1           HE3      LYS   1  -8.721   5.225  -0.451
   13    HZ1  LYS   1           HZ1      LYS   1  -6.595   3.451   0.588
   14    HZ2  LYS   1           HZ2      LYS   1  -6.444   5.065   0.358
   15    HZ3  LYS   1           HZ3      LYS   1  -7.462   4.509   1.534
   16    H    LEU   2           H        LEU   2  -8.607   1.616  -4.424
   17    HA   LEU   2           HA       LEU   2  -9.485   0.569  -6.932
   18    HB2  LEU   2           HB2      LEU   2  -6.832  -0.145  -5.700
   19    HB3  LEU   2           HB3      LEU   2  -7.232  -0.156  -7.300
   20    HG   LEU   2           HG       LEU   2  -7.291   2.246  -7.528
   21   HD11  LEU   2          HD11      LEU   2  -6.489   2.341  -4.588
   22   HD12  LEU   2          HD12      LEU   2  -6.136   3.633  -5.741
   23   HD13  LEU   2          HD13      LEU   2  -7.805   3.227  -5.415
   24   HD21  LEU   2          HD21      LEU   2  -4.767   1.064  -6.273
   25   HD22  LEU   2          HD22      LEU   2  -5.268   0.924  -7.963
   26   HD23  LEU   2          HD23      LEU   2  -4.834   2.507  -7.310
   27    HA   PRO   3           HA       PRO   3 -10.961  -3.389  -6.543
   28    HB2  PRO   3           HB2      PRO   3  -8.373  -4.471  -7.719
   29    HB3  PRO   3           HB3      PRO   3 -10.050  -4.955  -8.171
   30    HG2  PRO   3           HG2      PRO   3  -8.784  -3.199  -9.716
   31    HG3  PRO   3           HG3      PRO   3 -10.434  -2.743  -9.141
   32    HD2  PRO   3           HD2      PRO   3  -7.746  -2.007  -7.920
   33    HD3  PRO   3           HD3      PRO   3  -9.089  -0.919  -8.326
   34    HA   PRO   4           HA       PRO   4  -9.473  -6.199  -3.371
   35    HB2  PRO   4           HB2      PRO   4 -10.842  -8.506  -4.008
   36    HB3  PRO   4           HB3      PRO   4 -11.609  -7.098  -3.207
   37    HG2  PRO   4           HG2      PRO   4 -11.602  -7.790  -6.158
   38    HG3  PRO   4           HG3      PRO   4 -12.992  -7.293  -5.139
   39    HD2  PRO   4           HD2      PRO   4 -11.680  -5.529  -6.723
   40    HD3  PRO   4           HD3      PRO   4 -12.278  -5.039  -5.112
   41    H    GLY   5           H        GLY   5  -7.783  -7.643  -3.249
   42    HA2  GLY   5           HA2      GLY   5  -6.236  -9.281  -4.416
   43    HA3  GLY   5           HA3      GLY   5  -6.511  -8.373  -5.886
   44    H    TRP   6           H        TRP   6  -6.374  -5.566  -4.559
   45    HA   TRP   6           HA       TRP   6  -3.484  -5.338  -4.433
   46    HB2  TRP   6           HB2      TRP   6  -5.827  -3.519  -3.819
   47    HB3  TRP   6           HB3      TRP   6  -4.143  -3.060  -3.635
   48    HD1  TRP   6           HD1      TRP   6  -6.755  -3.356  -6.296
   49    HE1  TRP   6           HE1      TRP   6  -5.809  -2.305  -8.439
   50    HE3  TRP   6           HE3      TRP   6  -1.902  -2.964  -4.884
   51    HZ2  TRP   6           HZ2      TRP   6  -3.209  -1.556  -9.486
   52    HZ3  TRP   6           HZ3      TRP   6  -0.249  -2.025  -6.376
   53    HH2  TRP   6           HH2      TRP   6  -0.836  -1.333  -8.724
   54    H    GLU   7           H        GLU   7  -2.192  -5.877  -2.731
   55    HA   GLU   7           HA       GLU   7  -3.328  -5.824   0.024
   56    HB2  GLU   7           HB2      GLU   7  -3.234  -8.046  -1.403
   57    HB3  GLU   7           HB3      GLU   7  -1.525  -8.033  -1.006
   58    HG2  GLU   7           HG2      GLU   7  -3.822  -7.945   1.014
   59    HG3  GLU   7           HG3      GLU   7  -3.026  -9.423   0.476
   60    H    LYS   8           H        LYS   8  -1.799  -5.599   1.707
   61    HA   LYS   8           HA       LYS   8   0.011  -3.471   1.289
   62    HB2  LYS   8           HB2      LYS   8  -1.061  -3.423   3.289
   63    HB3  LYS   8           HB3      LYS   8  -1.001  -5.118   3.571
   64    HG2  LYS   8           HG2      LYS   8   1.415  -3.281   3.869
   65    HG3  LYS   8           HG3      LYS   8   0.244  -3.593   5.142
   66    HD2  LYS   8           HD2      LYS   8   2.311  -5.505   4.058
   67    HD3  LYS   8           HD3      LYS   8   2.029  -4.947   5.675
   68    HE2  LYS   8           HE2      LYS   8   1.360  -7.152   5.746
   69    HE3  LYS   8           HE3      LYS   8  -0.169  -6.274   5.678
   70    HZ1  LYS   8           HZ1      LYS   8   0.974  -7.168   3.124
   71    HZ2  LYS   8           HZ2      LYS   8   0.316  -8.335   4.093
   72    HZ3  LYS   8           HZ3      LYS   8  -0.587  -7.120   3.547
   73    H    ARG   9           H        ARG   9   2.142  -3.193   1.253
   74    HA   ARG   9           HA       ARG   9   4.044  -5.355   1.917
   75    HB2  ARG   9           HB2      ARG   9   4.133  -3.699  -0.646
   76    HB3  ARG   9           HB3      ARG   9   5.412  -4.780  -0.102
   77    HG2  ARG   9           HG2      ARG   9   2.614  -5.619  -0.939
   78    HG3  ARG   9           HG3      ARG   9   4.078  -5.702  -1.925
   79    HD2  ARG   9           HD2      ARG   9   5.074  -7.354  -0.475
   80    HD3  ARG   9           HD3      ARG   9   3.736  -7.251   0.664
   81    HE   ARG   9           HE       ARG   9   3.729  -8.538  -2.011
   82   HH11  ARG   9          HH11      ARG   9   1.724  -7.569   0.675
   83   HH12  ARG   9          HH12      ARG   9   0.550  -8.813   0.534
   84   HH21  ARG   9          HH21      ARG   9   2.125 -10.117  -2.383
   85   HH22  ARG   9          HH22      ARG   9   0.760 -10.160  -1.286
   86    H    MET  10           H        MET  10   6.322  -4.314   2.072
   87    HA   MET  10           HA       MET  10   6.192  -1.439   2.811
   88    HB2  MET  10           HB2      MET  10   6.124  -2.775   4.889
   89    HB3  MET  10           HB3      MET  10   7.616  -3.601   4.402
   90    HG2  MET  10           HG2      MET  10   8.775  -1.389   4.336
   91    HG3  MET  10           HG3      MET  10   7.315  -0.600   4.902
   92    HE1  MET  10           HE1      MET  10   7.059  -1.509   8.601
   93    HE2  MET  10           HE2      MET  10   6.644  -0.342   7.327
   94    HE3  MET  10           HE3      MET  10   6.085  -2.031   7.210
   95    H    PHE  11           H        PHE  11   7.736  -0.232   1.910
   96    HA   PHE  11           HA       PHE  11   9.450  -1.479  -0.019
   97    HB2  PHE  11           HB2      PHE  11   8.147   0.773  -0.095
   98    HB3  PHE  11           HB3      PHE  11   9.557   1.446   0.690
   99    HD1  PHE  11           HD2      PHE  11  11.911   0.650  -0.519
  100    HD2  PHE  11           HD1      PHE  11   8.027   0.785  -2.403
  101    HE1  PHE  11           HE2      PHE  11  12.988   0.646  -2.745
  102    HE2  PHE  11           HE1      PHE  11   9.119   0.809  -4.631
  103    HZ   PHE  11           HZ       PHE  11  11.597   0.727  -4.807
  104    H    ARG  12           H        ARG  12  10.722  -2.838   1.313
  105    HA   ARG  12           HA       ARG  12  12.618  -2.098   3.192
  106    HB2  ARG  12           HB2      ARG  12  13.957  -3.940   2.564
  107    HB3  ARG  12           HB3      ARG  12  12.275  -4.415   2.461
  108    HG2  ARG  12           HG2      ARG  12  14.027  -3.722   0.039
  109    HG3  ARG  12           HG3      ARG  12  13.801  -5.324   0.708
  110    HD2  ARG  12           HD2      ARG  12  12.310  -5.385  -1.008
  111    HD3  ARG  12           HD3      ARG  12  11.265  -4.959   0.353
  112    HE   ARG  12           HE       ARG  12  12.258  -2.607  -1.030
  113   HH11  ARG  12          HH11      ARG  12   9.794  -5.095  -1.207
  114   HH12  ARG  12          HH12      ARG  12   8.725  -4.152  -2.227
  115   HH21  ARG  12          HH21      ARG  12  10.847  -1.443  -2.478
  116   HH22  ARG  12          HH22      ARG  12   9.374  -2.212  -2.972
  117    H    SER  13           H        SER  13  14.520  -1.194   3.275
  118    HA   SER  13           HA       SER  13  16.347   0.056   2.815
  119    HB2  SER  13           HB2      SER  13  16.479  -0.720   0.441
  120    HB3  SER  13           HB3      SER  13  15.383   0.613  -0.004
  121    HG   SER  13           HG       SER  13  16.957   1.944   1.248
  122    H    ASN  14           H        ASN  14  13.046   1.040   2.724
  123    HA   ASN  14           HA       ASN  14  13.974   3.509   4.006
  124    HB2  ASN  14           HB2      ASN  14  12.566   5.024   2.741
  125    HB3  ASN  14           HB3      ASN  14  13.766   4.266   1.708
  126   HD21  ASN  14          HD22      ASN  14  12.970   3.542  -0.264
  127   HD22  ASN  14          HD21      ASN  14  11.281   3.151  -0.515
  128    H    GLY  15           H        GLY  15  11.244   1.293   3.379
  129    HA2  GLY  15           HA2      GLY  15  10.019   0.403   5.183
  130    HA3  GLY  15           HA3      GLY  15  10.291   1.844   6.146
  131    H    THR  16           H        THR  16   9.377   2.834   3.022
  132    HA   THR  16           HA       THR  16   6.848   3.856   3.782
  133    HB   THR  16           HB       THR  16   7.774   3.181   0.957
  134    HG1  THR  16           HG1      THR  16   9.309   4.432   1.803
  135   HG21  THR  16          HG21      THR  16   5.397   3.820   1.045
  136   HG22  THR  16          HG22      THR  16   5.805   5.257   2.017
  137   HG23  THR  16          HG23      THR  16   6.361   5.123   0.336
  138    H    VAL  17           H        VAL  17   5.006   2.716   4.248
  139    HA   VAL  17           HA       VAL  17   4.628   0.021   3.156
  140    HB   VAL  17           HB       VAL  17   2.906   1.761   4.907
  141   HG11  VAL  17          HG11      VAL  17   1.276   0.544   3.555
  142   HG12  VAL  17          HG12      VAL  17   2.170  -0.974   3.788
  143   HG13  VAL  17          HG13      VAL  17   1.360  -0.186   5.156
  144   HG21  VAL  17          HG21      VAL  17   3.343  -0.069   6.527
  145   HG22  VAL  17          HG22      VAL  17   4.199  -0.987   5.266
  146   HG23  VAL  17          HG23      VAL  17   4.881   0.539   5.887
  147    H    TYR  18           H        TYR  18   3.435  -0.588   1.591
  148    HA   TYR  18           HA       TYR  18   2.024   1.286  -0.206
  149    HB2  TYR  18           HB2      TYR  18   3.390   0.978  -2.055
  150    HB3  TYR  18           HB3      TYR  18   4.509   1.337  -0.771
  151    HD1  TYR  18           HD1      TYR  18   5.963  -0.544   0.126
  152    HD2  TYR  18           HD2      TYR  18   3.468  -1.003  -3.357
  153    HE1  TYR  18           HE1      TYR  18   7.411  -2.430  -0.693
  154    HE2  TYR  18           HE2      TYR  18   4.880  -2.857  -4.156
  155    HH   TYR  18           HH       TYR  18   6.725  -4.090  -3.766
  156    H    TYR  19           H        TYR  19   1.387  -0.235  -2.319
  157    HA   TYR  19           HA       TYR  19   0.489  -2.853  -1.192
  158    HB2  TYR  19           HB2      TYR  19  -1.205  -0.598  -2.151
  159    HB3  TYR  19           HB3      TYR  19  -1.656  -2.200  -2.665
  160    HD1  TYR  19           HD1      TYR  19  -0.572  -0.632   0.636
  161    HD2  TYR  19           HD2      TYR  19  -3.298  -3.209  -1.434
  162    HE1  TYR  19           HE1      TYR  19  -1.788  -1.080   2.761
  163    HE2  TYR  19           HE2      TYR  19  -4.547  -3.620   0.641
  164    HH   TYR  19           HH       TYR  19  -4.704  -3.106   2.885
  165    H    PHE  20           H        PHE  20   0.014  -4.429  -2.544
  166    HA   PHE  20           HA       PHE  20   1.240  -4.398  -5.268
  167    HB2  PHE  20           HB2      PHE  20   2.801  -5.231  -3.677
  168    HB3  PHE  20           HB3      PHE  20   1.583  -6.243  -2.883
  169    HD1  PHE  20           HD1      PHE  20   0.780  -8.372  -3.946
  170    HD2  PHE  20           HD2      PHE  20   3.997  -6.013  -5.597
  171    HE1  PHE  20           HE1      PHE  20   1.549 -10.322  -5.293
  172    HE2  PHE  20           HE2      PHE  20   4.669  -7.929  -7.015
  173    HZ   PHE  20           HZ       PHE  20   3.415 -10.082  -6.879
  174    H    ASN  21           H        ASN  21  -0.106  -5.254  -6.797
  175    HA   ASN  21           HA       ASN  21  -2.675  -6.395  -5.911
  176    HB2  ASN  21           HB2      ASN  21  -2.533  -4.776  -7.821
  177    HB3  ASN  21           HB3      ASN  21  -1.618  -5.986  -8.698
  178   HD21  ASN  21          HD22      ASN  21  -4.841  -5.063  -7.487
  179   HD22  ASN  21          HD21      ASN  21  -5.648  -6.430  -8.238
  180    H    HIS  22           H        HIS  22  -2.475  -8.379  -5.045
  181    HA   HIS  22           HA       HIS  22  -0.461 -10.221  -5.901
  182    HB2  HIS  22           HB2      HIS  22  -1.065 -11.466  -4.084
  183    HB3  HIS  22           HB3      HIS  22  -1.575  -9.874  -3.573
  184    HD1  HIS  22           HD1      HIS  22  -3.227 -12.907  -5.306
  185    HD2  HIS  22           HD2      HIS  22  -4.026  -9.814  -2.578
  186    HE1  HIS  22           HE1      HIS  22  -5.615 -13.326  -4.374
  187    H    ILE  23           H        ILE  23  -3.140  -9.455  -7.622
  188    HA   ILE  23           HA       ILE  23  -3.649 -12.216  -8.621
  189    HB   ILE  23           HB       ILE  23  -5.268  -9.648  -8.861
  190   HG12  ILE  23          HG12      ILE  23  -5.620 -12.112  -7.092
  191   HG13  ILE  23          HG13      ILE  23  -5.267 -10.474  -6.553
  192   HG21  ILE  23          HG21      ILE  23  -7.054 -11.037  -9.769
  193   HG22  ILE  23          HG22      ILE  23  -5.633 -11.178 -10.788
  194   HG23  ILE  23          HG23      ILE  23  -6.030 -12.487  -9.646
  195   HD11  ILE  23          HD11      ILE  23  -7.515  -9.757  -7.479
  196   HD12  ILE  23          HD12      ILE  23  -7.883 -11.487  -7.693
  197   HD13  ILE  23          HD13      ILE  23  -7.550 -10.851  -6.079
  198    H    THR  24           H        THR  24  -2.385  -9.066  -9.492
  199    HA   THR  24           HA       THR  24  -1.808  -9.974 -12.295
  200    HB   THR  24           HB       THR  24  -1.695  -7.578 -12.843
  201    HG1  THR  24           HG1      THR  24  -2.716  -7.184 -10.253
  202   HG21  THR  24          HG21      THR  24  -4.309  -8.233 -11.405
  203   HG22  THR  24          HG22      THR  24  -4.056  -6.969 -12.623
  204   HG23  THR  24          HG23      THR  24  -3.911  -8.681 -13.080
  205    H    ASN  25           H        ASN  25  -0.248  -9.029  -9.346
  206    HA   ASN  25           HA       ASN  25   1.839  -8.733  -8.716
  207    HB2  ASN  25           HB2      ASN  25   2.325 -10.480 -10.600
  208    HB3  ASN  25           HB3      ASN  25   2.988  -9.103 -11.476
  209   HD21  ASN  25          HD22      ASN  25   4.546  -7.727  -9.894
  210   HD22  ASN  25          HD21      ASN  25   5.777  -8.797  -9.173
  211    H    ALA  26           H        ALA  26   0.026  -6.576 -10.277
  212    HA   ALA  26           HA       ALA  26   1.928  -4.494 -10.861
  213    HB1  ALA  26           HB1      ALA  26  -0.435  -4.531 -11.647
  214    HB2  ALA  26           HB2      ALA  26  -0.977  -4.234  -9.982
  215    HB3  ALA  26           HB3      ALA  26  -0.002  -3.021 -10.828
  216    H    SER  27           H        SER  27   1.972  -2.343  -9.529
  217    HA   SER  27           HA       SER  27   1.734  -2.703  -6.620
  218    HB2  SER  27           HB2      SER  27   4.370  -2.168  -7.997
  219    HB3  SER  27           HB3      SER  27   4.052  -1.797  -6.284
  220    HG   SER  27           HG       SER  27   3.260  -4.303  -7.192
  221    H    GLN  28           H        GLN  28   1.596  -0.759  -5.458
  222    HA   GLN  28           HA       GLN  28   1.583   1.840  -6.827
  223    HB2  GLN  28           HB2      GLN  28  -0.601   0.899  -7.412
  224    HB3  GLN  28           HB3      GLN  28  -0.895   0.423  -5.740
  225    HG2  GLN  28           HG2      GLN  28  -2.206   2.394  -6.470
  226    HG3  GLN  28           HG3      GLN  28  -1.220   2.683  -5.048
  227   HE21  GLN  28          HE22      GLN  28  -1.199   3.211  -8.673
  228   HE22  GLN  28          HE21      GLN  28  -0.244   4.674  -8.493
  229    H    PHE  29           H        PHE  29   1.484   3.600  -5.232
  230    HA   PHE  29           HA       PHE  29   2.552   2.778  -2.618
  231    HB2  PHE  29           HB2      PHE  29   2.127   5.505  -3.834
  232    HB3  PHE  29           HB3      PHE  29   2.927   5.174  -2.299
  233    HD1  PHE  29           HD1      PHE  29   4.668   2.850  -2.865
  234    HD2  PHE  29           HD2      PHE  29   3.789   6.300  -5.316
  235    HE1  PHE  29           HE1      PHE  29   6.835   2.586  -4.023
  236    HE2  PHE  29           HE2      PHE  29   5.965   6.018  -6.472
  237    HZ   PHE  29           HZ       PHE  29   7.490   4.165  -5.829
  238    H    GLU  30           H        GLU  30  -0.420   4.404  -3.853
  239    HA   GLU  30           HA       GLU  30  -1.387   4.575  -1.131
  240    HB2  GLU  30           HB2      GLU  30  -2.093   6.287  -2.618
  241    HB3  GLU  30           HB3      GLU  30  -2.735   5.117  -3.769
  242    HG2  GLU  30           HG2      GLU  30  -4.507   6.286  -2.551
  243    HG3  GLU  30           HG3      GLU  30  -4.570   4.552  -2.312
  244    H    ARG  31           H        ARG  31  -3.000   3.536  -0.152
  245    HA   ARG  31           HA       ARG  31  -2.988   0.626  -0.580
  246    HB2  ARG  31           HB2      ARG  31  -3.995   2.298   1.767
  247    HB3  ARG  31           HB3      ARG  31  -3.726   0.567   1.746
  248    HG2  ARG  31           HG2      ARG  31  -1.648   1.050   2.565
  249    HG3  ARG  31           HG3      ARG  31  -1.242   1.521   0.915
  250    HD2  ARG  31           HD2      ARG  31  -2.312   3.837   1.809
  251    HD3  ARG  31           HD3      ARG  31  -1.830   3.137   3.352
  252    HE   ARG  31           HE       ARG  31   0.491   2.869   2.267
  253   HH11  ARG  31          HH11      ARG  31  -1.574   5.483   0.955
  254   HH12  ARG  31          HH12      ARG  31  -0.167   6.491   0.749
  255   HH21  ARG  31          HH22      ARG  31   2.117   4.033   1.641
  256   HH22  ARG  31          HH21      ARG  31   1.905   5.664   1.032
  257    HA   PRO  32           HA       PRO  32  -7.332   1.036  -1.884
  258    HB2  PRO  32           HB2      PRO  32  -7.107  -1.669  -3.110
  259    HB3  PRO  32           HB3      PRO  32  -7.576  -0.116  -3.766
  260    HG2  PRO  32           HG2      PRO  32  -5.231  -1.229  -4.389
  261    HG3  PRO  32           HG3      PRO  32  -5.326   0.480  -4.225
  262    HD2  PRO  32           HD2      PRO  32  -4.499  -1.428  -2.031
  263    HD3  PRO  32           HD3      PRO  32  -3.635   0.030  -2.590
  264    H    SER  33           H        SER  33  -9.045  -1.178  -2.066
  265    HA   SER  33           HA       SER  33  -9.324  -1.978   0.791
  266    HB2  SER  33           HB2      SER  33 -11.679  -1.338   0.628
  267    HB3  SER  33           HB3      SER  33 -10.637   0.060   0.291
  268    HG   SER  33           HG       SER  33 -11.658  -1.695  -1.666
  269    H    GLY  34           H        GLY  34  -8.636  -4.165   0.297
  270    HA2  GLY  34           HA2      GLY  34 -10.362  -6.120   0.222
  271    HA3  GLY  34           HA3      GLY  34 -10.265  -5.798  -1.512
  Start of MODEL    6
    1    H1   LYS   1           H1       LYS   1  -8.950   4.301  -3.731
    2    H2   LYS   1           H2       LYS   1 -10.433   4.216  -4.503
    3    H3   LYS   1           H3       LYS   1  -9.043   3.944  -5.336
    4    HA   LYS   1           HA       LYS   1  -8.601   2.126  -3.670
    5    HB2  LYS   1           HB2      LYS   1 -11.559   2.602  -3.260
    6    HB3  LYS   1           HB3      LYS   1 -10.900   0.970  -3.188
    7    HG2  LYS   1           HG2      LYS   1 -10.758   1.593  -0.976
    8    HG3  LYS   1           HG3      LYS   1  -9.129   1.867  -1.570
    9    HD2  LYS   1           HD2      LYS   1  -9.905   4.376  -1.844
   10    HD3  LYS   1           HD3      LYS   1 -11.278   3.888  -0.866
   11    HE2  LYS   1           HE2      LYS   1  -9.598   4.877   0.549
   12    HE3  LYS   1           HE3      LYS   1  -9.720   3.156   0.945
   13    HZ1  LYS   1           HZ1      LYS   1  -7.652   2.749  -0.150
   14    HZ2  LYS   1           HZ2      LYS   1  -7.667   4.161  -0.966
   15    HZ3  LYS   1           HZ3      LYS   1  -7.377   4.156   0.643
   16    H    LEU   2           H        LEU   2  -9.261  -0.144  -4.363
   17    HA   LEU   2           HA       LEU   2  -9.632  -0.432  -7.213
   18    HB2  LEU   2           HB2      LEU   2  -6.952  -1.249  -6.027
   19    HB3  LEU   2           HB3      LEU   2  -7.436  -1.364  -7.622
   20    HG   LEU   2           HG       LEU   2  -7.475   1.093  -7.917
   21   HD11  LEU   2          HD11      LEU   2  -7.044   1.624  -5.359
   22   HD12  LEU   2          HD12      LEU   2  -5.386   1.146  -5.717
   23   HD13  LEU   2          HD13      LEU   2  -6.117   2.476  -6.604
   24   HD21  LEU   2          HD21      LEU   2  -4.920  -0.488  -7.338
   25   HD22  LEU   2          HD22      LEU   2  -5.815  -0.456  -8.879
   26   HD23  LEU   2          HD23      LEU   2  -4.996   1.000  -8.313
   27    HA   PRO   3           HA       PRO   3 -11.114  -4.502  -6.499
   28    HB2  PRO   3           HB2      PRO   3  -8.592  -5.533  -7.863
   29    HB3  PRO   3           HB3      PRO   3 -10.266  -6.068  -8.205
   30    HG2  PRO   3           HG2      PRO   3  -9.184  -4.341  -9.862
   31    HG3  PRO   3           HG3      PRO   3 -10.780  -3.855  -9.153
   32    HD2  PRO   3           HD2      PRO   3  -7.985  -3.211  -8.123
   33    HD3  PRO   3           HD3      PRO   3  -9.288  -2.054  -8.477
   34    HA   PRO   4           HA       PRO   4  -9.248  -7.494  -3.594
   35    HB2  PRO   4           HB2      PRO   4 -10.520  -9.808  -4.366
   36    HB3  PRO   4           HB3      PRO   4 -11.319  -8.527  -3.403
   37    HG2  PRO   4           HG2      PRO   4 -11.447  -8.961  -6.401
   38    HG3  PRO   4           HG3      PRO   4 -12.802  -8.653  -5.267
   39    HD2  PRO   4           HD2      PRO   4 -11.743  -6.664  -6.736
   40    HD3  PRO   4           HD3      PRO   4 -12.210  -6.369  -5.041
   41    H    GLY   5           H        GLY   5  -7.435  -8.808  -3.714
   42    HA2  GLY   5           HA2      GLY   5  -5.886 -10.249  -5.057
   43    HA3  GLY   5           HA3      GLY   5  -6.303  -9.244  -6.443
   44    H    TRP   6           H        TRP   6  -6.341  -6.624  -4.858
   45    HA   TRP   6           HA       TRP   6  -3.447  -6.136  -4.790
   46    HB2  TRP   6           HB2      TRP   6  -5.931  -4.553  -4.091
   47    HB3  TRP   6           HB3      TRP   6  -4.289  -3.951  -3.914
   48    HD1  TRP   6           HD1      TRP   6  -6.855  -4.507  -6.606
   49    HE1  TRP   6           HE1      TRP   6  -6.065  -3.285  -8.688
   50    HE3  TRP   6           HE3      TRP   6  -2.093  -3.563  -5.150
   51    HZ2  TRP   6           HZ2      TRP   6  -3.545  -2.180  -9.710
   52    HZ3  TRP   6           HZ3      TRP   6  -0.537  -2.418  -6.616
   53    HH2  TRP   6           HH2      TRP   6  -1.215  -1.707  -8.935
   54    H    GLU   7           H        GLU   7  -2.116  -6.373  -3.023
   55    HA   GLU   7           HA       GLU   7  -3.303  -6.514  -0.301
   56    HB2  GLU   7           HB2      GLU   7  -2.674  -8.780  -1.634
   57    HB3  GLU   7           HB3      GLU   7  -1.073  -8.395  -1.023
   58    HG2  GLU   7           HG2      GLU   7  -3.636  -8.732   0.617
   59    HG3  GLU   7           HG3      GLU   7  -2.357  -9.936   0.444
   60    H    LYS   8           H        LYS   8  -1.846  -5.917   1.377
   61    HA   LYS   8           HA       LYS   8  -0.336  -3.561   0.686
   62    HB2  LYS   8           HB2      LYS   8  -1.830  -3.865   2.622
   63    HB3  LYS   8           HB3      LYS   8  -0.702  -5.026   3.335
   64    HG2  LYS   8           HG2      LYS   8   1.029  -3.183   3.394
   65    HG3  LYS   8           HG3      LYS   8  -0.186  -2.064   2.777
   66    HD2  LYS   8           HD2      LYS   8  -0.458  -3.620   5.402
   67    HD3  LYS   8           HD3      LYS   8   0.240  -2.012   5.261
   68    HE2  LYS   8           HE2      LYS   8  -1.933  -1.510   5.885
   69    HE3  LYS   8           HE3      LYS   8  -1.957  -1.283   4.139
   70    HZ1  LYS   8           HZ1      LYS   8  -3.105  -3.531   5.678
   71    HZ2  LYS   8           HZ2      LYS   8  -3.846  -2.462   4.637
   72    HZ3  LYS   8           HZ3      LYS   8  -2.867  -3.623   4.047
   73    H    ARG   9           H        ARG   9   1.779  -3.110   0.922
   74    HA   ARG   9           HA       ARG   9   3.751  -5.167   1.725
   75    HB2  ARG   9           HB2      ARG   9   3.755  -3.789  -1.002
   76    HB3  ARG   9           HB3      ARG   9   5.120  -4.697  -0.356
   77    HG2  ARG   9           HG2      ARG   9   2.390  -5.825  -1.065
   78    HG3  ARG   9           HG3      ARG   9   3.872  -5.973  -1.999
   79    HD2  ARG   9           HD2      ARG   9   4.501  -7.798  -0.910
   80    HD3  ARG   9           HD3      ARG   9   4.436  -6.972   0.636
   81    HE   ARG   9           HE       ARG   9   2.049  -7.508   0.814
   82   HH11  ARG   9          HH12      ARG   9   3.742  -9.468  -1.553
   83   HH12  ARG   9          HH11      ARG   9   2.601 -10.782  -1.421
   84   HH21  ARG   9          HH22      ARG   9   0.597  -9.204   0.950
   85   HH22  ARG   9          HH21      ARG   9   0.871 -10.628  -0.011
   86    H    MET  10           H        MET  10   6.021  -4.153   1.754
   87    HA   MET  10           HA       MET  10   5.936  -1.271   2.445
   88    HB2  MET  10           HB2      MET  10   5.611  -2.611   4.516
   89    HB3  MET  10           HB3      MET  10   7.131  -3.461   4.187
   90    HG2  MET  10           HG2      MET  10   8.322  -1.261   4.248
   91    HG3  MET  10           HG3      MET  10   6.805  -0.468   4.659
   92    HE1  MET  10           HE1      MET  10   5.327  -1.821   6.817
   93    HE2  MET  10           HE2      MET  10   6.172  -1.373   8.317
   94    HE3  MET  10           HE3      MET  10   5.948  -0.164   7.034
   95    H    PHE  11           H        PHE  11   7.576  -0.166   1.581
   96    HA   PHE  11           HA       PHE  11   9.535  -1.457  -0.061
   97    HB2  PHE  11           HB2      PHE  11   8.379   0.811  -0.360
   98    HB3  PHE  11           HB3      PHE  11   9.522   1.439   0.810
   99    HD1  PHE  11           HD1      PHE  11  12.062   1.140   0.285
  100    HD2  PHE  11           HD2      PHE  11   8.955   0.558  -2.647
  101    HE1  PHE  11           HE1      PHE  11  13.730   1.386  -1.526
  102    HE2  PHE  11           HE2      PHE  11  10.626   0.822  -4.462
  103    HZ   PHE  11           HZ       PHE  11  13.014   1.237  -3.910
  104    H    ARG  12           H        ARG  12  10.925  -2.739   1.020
  105    HA   ARG  12           HA       ARG  12  12.216  -2.401   3.435
  106    HB2  ARG  12           HB2      ARG  12  13.863  -3.998   2.638
  107    HB3  ARG  12           HB3      ARG  12  12.263  -4.423   2.058
  108    HG2  ARG  12           HG2      ARG  12  13.472  -4.789   0.140
  109    HG3  ARG  12           HG3      ARG  12  12.994  -3.114  -0.135
  110    HD2  ARG  12           HD2      ARG  12  15.251  -2.499   0.979
  111    HD3  ARG  12           HD3      ARG  12  15.680  -4.197   0.804
  112    HE   ARG  12           HE       ARG  12  15.041  -3.728  -1.702
  113   HH11  ARG  12          HH11      ARG  12  16.795  -1.433   0.368
  114   HH12  ARG  12          HH12      ARG  12  17.571  -0.692  -1.004
  115   HH21  ARG  12          HH21      ARG  12  16.066  -2.693  -3.388
  116   HH22  ARG  12          HH22      ARG  12  17.166  -1.389  -3.065
  117    H    SER  13           H        SER  13  14.175  -1.613   4.157
  118    HA   SER  13           HA       SER  13  15.863  -0.181   4.469
  119    HB2  SER  13           HB2      SER  13  15.893   0.511   1.520
  120    HB3  SER  13           HB3      SER  13  17.154   0.820   2.711
  121    HG   SER  13           HG       SER  13  17.454  -1.399   2.932
  122    H    ASN  14           H        ASN  14  12.814   1.008   3.358
  123    HA   ASN  14           HA       ASN  14  13.501   3.413   4.939
  124    HB2  ASN  14           HB2      ASN  14  12.531   4.998   3.440
  125    HB3  ASN  14           HB3      ASN  14  13.813   4.119   2.623
  126   HD21  ASN  14          HD22      ASN  14  13.183   4.169   0.450
  127   HD22  ASN  14          HD21      ASN  14  11.593   3.639  -0.065
  128    H    GLY  15           H        GLY  15  10.939   1.175   3.893
  129    HA2  GLY  15           HA2      GLY  15   9.375   0.420   5.460
  130    HA3  GLY  15           HA3      GLY  15   9.537   1.892   6.408
  131    H    THR  16           H        THR  16   9.202   2.681   3.091
  132    HA   THR  16           HA       THR  16   6.669   3.930   3.415
  133    HB   THR  16           HB       THR  16   7.940   3.053   0.790
  134    HG1  THR  16           HG1      THR  16   9.404   4.270   1.858
  135   HG21  THR  16          HG21      THR  16   6.735   5.013  -0.120
  136   HG22  THR  16          HG22      THR  16   5.607   3.808   0.525
  137   HG23  THR  16          HG23      THR  16   5.968   5.279   1.461
  138    H    VAL  17           H        VAL  17   4.745   2.884   3.773
  139    HA   VAL  17           HA       VAL  17   4.321   0.184   2.732
  140    HB   VAL  17           HB       VAL  17   2.608   2.085   4.334
  141   HG11  VAL  17          HG11      VAL  17   0.980   0.900   2.940
  142   HG12  VAL  17          HG12      VAL  17   1.767  -0.654   3.311
  143   HG13  VAL  17          HG13      VAL  17   0.934   0.269   4.584
  144   HG21  VAL  17          HG21      VAL  17   2.850   0.300   6.039
  145   HG22  VAL  17          HG22      VAL  17   3.727  -0.709   4.866
  146   HG23  VAL  17          HG23      VAL  17   4.447   0.807   5.464
  147    H    TYR  18           H        TYR  18   3.011  -0.465   1.193
  148    HA   TYR  18           HA       TYR  18   1.526   1.339  -0.561
  149    HB2  TYR  18           HB2      TYR  18   2.813   1.049  -2.506
  150    HB3  TYR  18           HB3      TYR  18   3.948   1.527  -1.269
  151    HD1  TYR  18           HD1      TYR  18   5.423  -0.294  -0.182
  152    HD2  TYR  18           HD2      TYR  18   3.172  -0.862  -3.806
  153    HE1  TYR  18           HE1      TYR  18   6.884  -2.245  -0.805
  154    HE2  TYR  18           HE2      TYR  18   4.587  -2.812  -4.400
  155    HH   TYR  18           HH       TYR  18   6.420  -4.054  -3.825
  156    H    TYR  19           H        TYR  19   0.985  -0.334  -2.689
  157    HA   TYR  19           HA       TYR  19   0.290  -2.984  -1.520
  158    HB2  TYR  19           HB2      TYR  19  -1.483  -0.869  -2.627
  159    HB3  TYR  19           HB3      TYR  19  -1.769  -2.465  -3.239
  160    HD1  TYR  19           HD1      TYR  19  -1.364  -0.697   0.044
  161    HD2  TYR  19           HD2      TYR  19  -3.064  -3.965  -2.104
  162    HE1  TYR  19           HE1      TYR  19  -2.897  -1.156   1.971
  163    HE2  TYR  19           HE2      TYR  19  -4.580  -4.484  -0.212
  164    HH   TYR  19           HH       TYR  19  -4.792  -2.364   2.717
  165    H    PHE  20           H        PHE  20  -0.004  -4.628  -2.906
  166    HA   PHE  20           HA       PHE  20   1.275  -4.509  -5.596
  167    HB2  PHE  20           HB2      PHE  20   2.874  -5.278  -4.016
  168    HB3  PHE  20           HB3      PHE  20   1.705  -6.346  -3.227
  169    HD1  PHE  20           HD1      PHE  20   3.947  -5.939  -6.119
  170    HD2  PHE  20           HD2      PHE  20   1.184  -8.584  -4.116
  171    HE1  PHE  20           HE1      PHE  20   4.749  -7.828  -7.507
  172    HE2  PHE  20           HE2      PHE  20   2.080 -10.486  -5.431
  173    HZ   PHE  20           HZ       PHE  20   3.824 -10.112  -7.151
  174    H    ASN  21           H        ASN  21   0.097  -5.535  -7.164
  175    HA   ASN  21           HA       ASN  21  -2.443  -6.836  -6.379
  176    HB2  ASN  21           HB2      ASN  21  -2.374  -5.212  -8.288
  177    HB3  ASN  21           HB3      ASN  21  -1.301  -6.317  -9.124
  178   HD21  ASN  21          HD22      ASN  21  -4.667  -5.766  -8.037
  179   HD22  ASN  21          HD21      ASN  21  -5.277  -7.177  -8.886
  180    H    HIS  22           H        HIS  22  -2.116  -8.835  -5.528
  181    HA   HIS  22           HA       HIS  22   0.082 -10.487  -6.361
  182    HB2  HIS  22           HB2      HIS  22  -0.435 -11.786  -4.556
  183    HB3  HIS  22           HB3      HIS  22  -1.071 -10.245  -4.042
  184    HD1  HIS  22           HD1      HIS  22  -2.523 -13.336  -5.857
  185    HD2  HIS  22           HD2      HIS  22  -3.471 -10.429  -2.979
  186    HE1  HIS  22           HE1      HIS  22  -4.866 -13.951  -4.914
  187    H    ILE  23           H        ILE  23  -2.611  -9.904  -8.138
  188    HA   ILE  23           HA       ILE  23  -2.904 -12.694  -9.146
  189    HB   ILE  23           HB       ILE  23  -4.650 -10.228  -9.519
  190   HG12  ILE  23          HG12      ILE  23  -5.008 -12.710  -7.772
  191   HG13  ILE  23          HG13      ILE  23  -4.748 -11.065  -7.205
  192   HG21  ILE  23          HG21      ILE  23  -5.168 -13.113 -10.346
  193   HG22  ILE  23          HG22      ILE  23  -6.287 -11.744 -10.539
  194   HG23  ILE  23          HG23      ILE  23  -4.794 -11.774 -11.457
  195   HD11  ILE  23          HD11      ILE  23  -7.056 -11.527  -6.891
  196   HD12  ILE  23          HD12      ILE  23  -6.958 -10.414  -8.266
  197   HD13  ILE  23          HD13      ILE  23  -7.252 -12.151  -8.531
  198    H    THR  24           H        THR  24  -1.764  -9.490  -9.970
  199    HA   THR  24           HA       THR  24  -1.008 -10.377 -12.738
  200    HB   THR  24           HB       THR  24  -1.011  -7.978 -13.314
  201    HG1  THR  24           HG1      THR  24  -2.168  -7.626 -10.765
  202   HG21  THR  24          HG21      THR  24  -3.405  -7.507 -13.194
  203   HG22  THR  24          HG22      THR  24  -3.142  -9.211 -13.629
  204   HG23  THR  24          HG23      THR  24  -3.640  -8.774 -11.979
  205    H    ASN  25           H        ASN  25   0.286  -9.089  -9.747
  206    HA   ASN  25           HA       ASN  25   2.313  -8.793  -8.957
  207    HB2  ASN  25           HB2      ASN  25   3.587  -9.021 -11.692
  208    HB3  ASN  25           HB3      ASN  25   4.396  -8.983 -10.138
  209   HD21  ASN  25          HD22      ASN  25   2.451 -10.941 -12.287
  210   HD22  ASN  25          HD21      ASN  25   2.812 -12.475 -11.463
  211    H    ALA  26           H        ALA  26   0.472  -6.730 -10.659
  212    HA   ALA  26           HA       ALA  26   2.214  -4.497 -11.058
  213    HB1  ALA  26           HB1      ALA  26  -0.074  -4.739 -12.013
  214    HB2  ALA  26           HB2      ALA  26  -0.760  -4.499 -10.392
  215    HB3  ALA  26           HB3      ALA  26   0.157  -3.199 -11.170
  216    H    SER  27           H        SER  27   1.925  -2.332  -9.738
  217    HA   SER  27           HA       SER  27   1.526  -2.734  -6.853
  218    HB2  SER  27           HB2      SER  27   4.166  -1.875  -8.048
  219    HB3  SER  27           HB3      SER  27   3.691  -1.557  -6.361
  220    HG   SER  27           HG       SER  27   3.275  -4.132  -7.328
  221    H    GLN  28           H        GLN  28   1.105  -0.770  -5.701
  222    HA   GLN  28           HA       GLN  28   1.261   1.798  -7.033
  223    HB2  GLN  28           HB2      GLN  28  -0.907   0.641  -7.884
  224    HB3  GLN  28           HB3      GLN  28  -1.536   0.857  -6.250
  225    HG2  GLN  28           HG2      GLN  28  -1.322   3.297  -6.468
  226    HG3  GLN  28           HG3      GLN  28  -0.446   3.120  -7.996
  227   HE21  GLN  28          HE22      GLN  28  -1.734   2.059  -9.879
  228   HE22  GLN  28          HE21      GLN  28  -3.449   2.446  -9.850
  229    H    PHE  29           H        PHE  29   0.702   3.589  -5.500
  230    HA   PHE  29           HA       PHE  29   1.286   2.837  -2.730
  231    HB2  PHE  29           HB2      PHE  29   0.883   5.570  -3.952
  232    HB3  PHE  29           HB3      PHE  29   1.612   5.202  -2.392
  233    HD1  PHE  29           HD2      PHE  29   3.627   3.316  -2.625
  234    HD2  PHE  29           HD1      PHE  29   2.408   6.129  -5.660
  235    HE1  PHE  29           HE2      PHE  29   5.844   3.108  -3.709
  236    HE2  PHE  29           HE1      PHE  29   4.626   5.908  -6.745
  237    HZ   PHE  29           HZ       PHE  29   6.346   4.399  -5.775
  238    H    GLU  30           H        GLU  30  -1.614   3.836  -4.513
  239    HA   GLU  30           HA       GLU  30  -3.191   4.459  -2.166
  240    HB2  GLU  30           HB2      GLU  30  -4.051   5.330  -4.159
  241    HB3  GLU  30           HB3      GLU  30  -3.772   3.837  -5.046
  242    HG2  GLU  30           HG2      GLU  30  -6.130   4.162  -4.769
  243    HG3  GLU  30           HG3      GLU  30  -5.613   2.729  -3.893
  244    H    ARG  31           H        ARG  31  -4.316   3.190  -0.941
  245    HA   ARG  31           HA       ARG  31  -3.640   0.292  -0.808
  246    HB2  ARG  31           HB2      ARG  31  -4.597   2.343   1.231
  247    HB3  ARG  31           HB3      ARG  31  -4.413   0.629   1.597
  248    HG2  ARG  31           HG2      ARG  31  -2.077   0.735   1.594
  249    HG3  ARG  31           HG3      ARG  31  -2.016   1.961   0.368
  250    HD2  ARG  31           HD2      ARG  31  -1.155   2.809   2.379
  251    HD3  ARG  31           HD3      ARG  31  -2.693   3.648   2.066
  252    HE   ARG  31           HE       ARG  31  -3.429   1.560   3.756
  253   HH11  ARG  31          HH11      ARG  31  -1.025   4.086   4.185
  254   HH12  ARG  31          HH12      ARG  31  -1.151   3.981   5.927
  255   HH21  ARG  31          HH21      ARG  31  -3.572   1.469   5.707
  256   HH22  ARG  31          HH22      ARG  31  -2.651   2.468   6.861
  257    HA   PRO  32           HA       PRO  32  -7.820   0.325  -2.422
  258    HB2  PRO  32           HB2      PRO  32  -7.541  -2.611  -3.055
  259    HB3  PRO  32           HB3      PRO  32  -7.990  -1.267  -4.017
  260    HG2  PRO  32           HG2      PRO  32  -5.630  -2.268  -4.357
  261    HG3  PRO  32           HG3      PRO  32  -5.809  -0.542  -4.409
  262    HD2  PRO  32           HD2      PRO  32  -5.035  -2.119  -1.951
  263    HD3  PRO  32           HD3      PRO  32  -4.178  -0.715  -2.645
  264    H    SER  33           H        SER  33  -6.785  -1.737  -0.188
  265    HA   SER  33           HA       SER  33  -9.433  -2.036   1.210
  266    HB2  SER  33           HB2      SER  33  -8.457  -4.207   2.162
  267    HB3  SER  33           HB3      SER  33  -8.905  -4.174   0.456
  268    HG   SER  33           HG       SER  33  -6.228  -3.823   1.422
  269    H    GLY  34           H        GLY  34  -7.019  -0.052   1.561
  270    HA2  GLY  34           HA2      GLY  34  -6.484   1.264   3.429
  271    HA3  GLY  34           HA3      GLY  34  -7.232   0.073   4.492
  Start of MODEL    7
    1    H1   LYS   1           H1       LYS   1 -13.619  -2.727   1.777
    2    H2   LYS   1           H2       LYS   1 -14.634  -3.943   2.273
    3    H3   LYS   1           H3       LYS   1 -14.284  -3.714   0.667
    4    HA   LYS   1           HA       LYS   1 -12.313  -4.483   2.709
    5    HB2  LYS   1           HB2      LYS   1 -12.280  -6.698   1.669
    6    HB3  LYS   1           HB3      LYS   1 -13.871  -6.335   2.318
    7    HG2  LYS   1           HG2      LYS   1 -14.825  -5.992   0.157
    8    HG3  LYS   1           HG3      LYS   1 -13.232  -5.819  -0.586
    9    HD2  LYS   1           HD2      LYS   1 -12.756  -8.216  -0.182
   10    HD3  LYS   1           HD3      LYS   1 -14.391  -8.406   0.473
   11    HE2  LYS   1           HE2      LYS   1 -14.273  -9.119  -1.877
   12    HE3  LYS   1           HE3      LYS   1 -15.371  -7.745  -1.684
   13    HZ1  LYS   1           HZ1      LYS   1 -12.547  -7.344  -2.497
   14    HZ2  LYS   1           HZ2      LYS   1 -13.765  -7.589  -3.610
   15    HZ3  LYS   1           HZ3      LYS   1 -13.751  -6.283  -2.619
   16    H    LEU   2           H        LEU   2 -10.970  -5.990   0.356
   17    HA   LEU   2           HA       LEU   2  -9.929  -3.669  -1.172
   18    HB2  LEU   2           HB2      LEU   2  -8.487  -6.247  -0.447
   19    HB3  LEU   2           HB3      LEU   2  -7.827  -4.893  -1.354
   20    HG   LEU   2           HG       LEU   2  -8.610  -4.816   1.592
   21   HD11  LEU   2          HD11      LEU   2  -6.212  -4.763   2.006
   22   HD12  LEU   2          HD12      LEU   2  -6.631  -6.226   1.103
   23   HD13  LEU   2          HD13      LEU   2  -5.876  -4.865   0.255
   24   HD21  LEU   2          HD21      LEU   2  -7.200  -2.742  -0.150
   25   HD22  LEU   2          HD22      LEU   2  -8.814  -2.578   0.580
   26   HD23  LEU   2          HD23      LEU   2  -7.385  -2.653   1.612
   27    HA   PRO   3           HA       PRO   3 -11.262  -6.149  -4.701
   28    HB2  PRO   3           HB2      PRO   3  -8.932  -5.236  -6.285
   29    HB3  PRO   3           HB3      PRO   3 -10.665  -4.969  -6.571
   30    HG2  PRO   3           HG2      PRO   3  -8.980  -2.955  -5.717
   31    HG3  PRO   3           HG3      PRO   3 -10.717  -3.040  -5.286
   32    HD2  PRO   3           HD2      PRO   3  -8.337  -3.847  -3.617
   33    HD3  PRO   3           HD3      PRO   3  -9.823  -2.975  -3.156
   34    HA   PRO   4           HA       PRO   4  -9.158  -9.899  -4.409
   35    HB2  PRO   4           HB2      PRO   4  -9.108 -11.057  -6.927
   36    HB3  PRO   4           HB3      PRO   4 -10.558 -10.907  -5.891
   37    HG2  PRO   4           HG2      PRO   4  -9.675  -9.081  -8.139
   38    HG3  PRO   4           HG3      PRO   4 -11.309  -9.755  -7.833
   39    HD2  PRO   4           HD2      PRO   4 -10.663  -7.244  -7.080
   40    HD3  PRO   4           HD3      PRO   4 -11.673  -8.269  -6.017
   41    H    GLY   5           H        GLY   5  -7.133 -10.354  -3.950
   42    HA2  GLY   5           HA2      GLY   5  -4.950 -11.034  -4.533
   43    HA3  GLY   5           HA3      GLY   5  -4.973  -9.972  -5.932
   44    H    TRP   6           H        TRP   6  -6.098  -7.772  -3.769
   45    HA   TRP   6           HA       TRP   6  -3.439  -6.622  -3.592
   46    HB2  TRP   6           HB2      TRP   6  -6.149  -5.700  -2.655
   47    HB3  TRP   6           HB3      TRP   6  -4.673  -4.781  -2.397
   48    HD1  TRP   6           HD1      TRP   6  -7.247  -5.421  -4.945
   49    HE1  TRP   6           HE1      TRP   6  -6.797  -3.981  -7.044
   50    HE3  TRP   6           HE3      TRP   6  -2.475  -4.047  -3.904
   51    HZ2  TRP   6           HZ2      TRP   6  -4.594  -2.443  -8.119
   52    HZ3  TRP   6           HZ3      TRP   6  -1.213  -2.579  -5.454
   53    HH2  TRP   6           HH2      TRP   6  -2.269  -1.754  -7.544
   54    H    GLU   7           H        GLU   7  -1.953  -6.689  -2.067
   55    HA   GLU   7           HA       GLU   7  -2.739  -7.096   0.769
   56    HB2  GLU   7           HB2      GLU   7  -1.781  -9.140  -0.741
   57    HB3  GLU   7           HB3      GLU   7  -0.247  -8.420  -0.282
   58    HG2  GLU   7           HG2      GLU   7  -2.447  -9.281   1.663
   59    HG3  GLU   7           HG3      GLU   7  -1.100 -10.303   1.170
   60    H    LYS   8           H        LYS   8  -1.195  -6.249   2.265
   61    HA   LYS   8           HA       LYS   8   0.146  -3.770   1.561
   62    HB2  LYS   8           HB2      LYS   8  -0.766  -3.757   3.660
   63    HB3  LYS   8           HB3      LYS   8  -0.438  -5.413   4.010
   64    HG2  LYS   8           HG2      LYS   8   2.010  -3.697   3.894
   65    HG3  LYS   8           HG3      LYS   8   0.824  -3.226   5.078
   66    HD2  LYS   8           HD2      LYS   8   2.476  -4.687   6.059
   67    HD3  LYS   8           HD3      LYS   8   0.869  -5.384   6.181
   68    HE2  LYS   8           HE2      LYS   8   2.708  -6.187   3.912
   69    HE3  LYS   8           HE3      LYS   8   2.989  -6.838   5.519
   70    HZ1  LYS   8           HZ1      LYS   8   0.893  -7.922   5.500
   71    HZ2  LYS   8           HZ2      LYS   8   0.337  -7.139   4.170
   72    HZ3  LYS   8           HZ3      LYS   8   1.453  -8.187   3.958
   73    H    ARG   9           H        ARG   9   2.302  -3.354   1.408
   74    HA   ARG   9           HA       ARG   9   4.327  -5.489   1.785
   75    HB2  ARG   9           HB2      ARG   9   3.970  -3.877  -0.779
   76    HB3  ARG   9           HB3      ARG   9   5.440  -4.769  -0.393
   77    HG2  ARG   9           HG2      ARG   9   2.695  -5.995  -0.811
   78    HG3  ARG   9           HG3      ARG   9   4.030  -5.970  -1.962
   79    HD2  ARG   9           HD2      ARG   9   4.886  -7.833  -1.152
   80    HD3  ARG   9           HD3      ARG   9   5.067  -7.120   0.441
   81    HE   ARG   9           HE       ARG   9   2.694  -7.768   0.912
   82   HH11  ARG   9          HH11      ARG   9   4.265  -9.580  -1.661
   83   HH12  ARG   9          HH12      ARG   9   3.305 -11.006  -1.373
   84   HH21  ARG   9          HH22      ARG   9   1.575  -9.650   1.320
   85   HH22  ARG   9          HH21      ARG   9   1.802 -11.035   0.279
   86    H    MET  10           H        MET  10   6.601  -4.464   1.548
   87    HA   MET  10           HA       MET  10   6.633  -1.667   2.526
   88    HB2  MET  10           HB2      MET  10   6.619  -3.236   4.463
   89    HB3  MET  10           HB3      MET  10   8.104  -3.982   3.842
   90    HG2  MET  10           HG2      MET  10   9.238  -1.788   3.978
   91    HG3  MET  10           HG3      MET  10   7.759  -1.052   4.592
   92    HE1  MET  10           HE1      MET  10   7.514  -2.119   8.226
   93    HE2  MET  10           HE2      MET  10   7.164  -0.859   7.023
   94    HE3  MET  10           HE3      MET  10   6.522  -2.506   6.801
   95    H    PHE  11           H        PHE  11   8.231  -0.452   1.742
   96    HA   PHE  11           HA       PHE  11   9.669  -1.449  -0.532
   97    HB2  PHE  11           HB2      PHE  11   8.327   0.753  -0.163
   98    HB3  PHE  11           HB3      PHE  11   9.819   1.369   0.524
   99    HD1  PHE  11           HD1      PHE  11  11.969   1.071  -1.007
  100    HD2  PHE  11           HD2      PHE  11   7.924   0.796  -2.461
  101    HE1  PHE  11           HE1      PHE  11  12.771   1.532  -3.308
  102    HE2  PHE  11           HE2      PHE  11   8.727   1.252  -4.765
  103    HZ   PHE  11           HZ       PHE  11  11.147   1.626  -5.192
  104    H    ARG  12           H        ARG  12  11.483  -2.533  -0.273
  105    HA   ARG  12           HA       ARG  12  13.344  -2.459   1.840
  106    HB2  ARG  12           HB2      ARG  12  13.711  -3.197  -1.106
  107    HB3  ARG  12           HB3      ARG  12  14.902  -3.487   0.148
  108    HG2  ARG  12           HG2      ARG  12  13.808  -5.544  -0.219
  109    HG3  ARG  12           HG3      ARG  12  13.311  -4.959   1.362
  110    HD2  ARG  12           HD2      ARG  12  11.468  -6.019   0.141
  111    HD3  ARG  12           HD3      ARG  12  11.116  -4.337   0.490
  112    HE   ARG  12           HE       ARG  12  12.308  -4.930  -2.151
  113   HH11  ARG  12          HH21      ARG  12   9.235  -4.226  -0.505
  114   HH12  ARG  12          HH22      ARG  12   8.379  -4.175  -2.039
  115   HH21  ARG  12          HH11      ARG  12  11.115  -4.691  -4.038
  116   HH22  ARG  12          HH12      ARG  12   9.419  -4.328  -3.923
  117    H    SER  13           H        SER  13  15.289  -1.462   2.115
  118    HA   SER  13           HA       SER  13  16.989   0.050   1.999
  119    HB2  SER  13           HB2      SER  13  17.219   1.865   0.460
  120    HB3  SER  13           HB3      SER  13  16.804   0.409  -0.460
  121    HG   SER  13           HG       SER  13  14.670   1.080  -0.481
  122    H    ASN  14           H        ASN  14  13.580   0.941   2.362
  123    HA   ASN  14           HA       ASN  14  14.458   3.039   4.297
  124    HB2  ASN  14           HB2      ASN  14  12.948   4.675   3.239
  125    HB3  ASN  14           HB3      ASN  14  14.258   4.178   2.174
  126   HD21  ASN  14          HD22      ASN  14  13.734   3.193   0.152
  127   HD22  ASN  14          HD21      ASN  14  12.043   3.037  -0.309
  128    H    GLY  15           H        GLY  15  11.754   0.904   3.253
  129    HA2  GLY  15           HA2      GLY  15  10.502  -0.222   4.907
  130    HA3  GLY  15           HA3      GLY  15  10.828   1.046   6.080
  131    H    THR  16           H        THR  16   9.896   2.465   3.097
  132    HA   THR  16           HA       THR  16   7.413   3.462   4.018
  133    HB   THR  16           HB       THR  16   8.261   3.069   1.117
  134    HG1  THR  16           HG1      THR  16   9.843   4.210   2.049
  135   HG21  THR  16          HG21      THR  16   5.912   3.726   1.298
  136   HG22  THR  16          HG22      THR  16   6.329   5.009   2.461
  137   HG23  THR  16          HG23      THR  16   6.873   5.118   0.777
  138    H    VAL  17           H        VAL  17   5.492   2.445   4.274
  139    HA   VAL  17           HA       VAL  17   5.075  -0.229   3.134
  140    HB   VAL  17           HB       VAL  17   3.376   1.555   4.889
  141   HG11  VAL  17          HG11      VAL  17   1.736   0.345   3.535
  142   HG12  VAL  17          HG12      VAL  17   2.594  -1.188   3.811
  143   HG13  VAL  17          HG13      VAL  17   1.795  -0.347   5.155
  144   HG21  VAL  17          HG21      VAL  17   5.315   0.333   5.905
  145   HG22  VAL  17          HG22      VAL  17   3.766  -0.263   6.525
  146   HG23  VAL  17          HG23      VAL  17   4.641  -1.197   5.290
  147    H    TYR  18           H        TYR  18   3.645  -0.816   1.620
  148    HA   TYR  18           HA       TYR  18   2.067   1.119   0.101
  149    HB2  TYR  18           HB2      TYR  18   3.077   0.731  -2.011
  150    HB3  TYR  18           HB3      TYR  18   4.336   1.244  -0.926
  151    HD1  TYR  18           HD2      TYR  18   6.038  -0.467  -0.126
  152    HD2  TYR  18           HD1      TYR  18   3.150  -1.283  -3.216
  153    HE1  TYR  18           HE2      TYR  18   7.470  -2.313  -1.006
  154    HE2  TYR  18           HE1      TYR  18   4.539  -3.138  -4.065
  155    HH   TYR  18           HH       TYR  18   6.442  -4.299  -3.792
  156    H    TYR  19           H        TYR  19   1.063  -0.374  -1.914
  157    HA   TYR  19           HA       TYR  19   0.428  -3.064  -0.814
  158    HB2  TYR  19           HB2      TYR  19  -1.439  -0.877  -1.650
  159    HB3  TYR  19           HB3      TYR  19  -1.858  -2.516  -2.074
  160    HD1  TYR  19           HD1      TYR  19  -0.772  -0.540   0.980
  161    HD2  TYR  19           HD2      TYR  19  -2.993  -3.899  -0.587
  162    HE1  TYR  19           HE1      TYR  19  -1.748  -0.932   3.209
  163    HE2  TYR  19           HE2      TYR  19  -3.978  -4.279   1.658
  164    HH   TYR  19           HH       TYR  19  -3.201  -2.205   4.452
  165    H    PHE  20           H        PHE  20  -0.041  -4.630  -2.212
  166    HA   PHE  20           HA       PHE  20   0.839  -4.366  -5.056
  167    HB2  PHE  20           HB2      PHE  20   2.722  -4.971  -3.639
  168    HB3  PHE  20           HB3      PHE  20   1.781  -6.263  -2.881
  169    HD1  PHE  20           HD1      PHE  20   3.376  -5.171  -6.038
  170    HD2  PHE  20           HD2      PHE  20   1.697  -8.503  -3.867
  171    HE1  PHE  20           HE1      PHE  20   4.310  -6.737  -7.722
  172    HE2  PHE  20           HE2      PHE  20   2.716 -10.057  -5.503
  173    HZ   PHE  20           HZ       PHE  20   3.971  -9.188  -7.453
  174    H    ASN  21           H        ASN  21  -0.526  -5.403  -6.409
  175    HA   ASN  21           HA       ASN  21  -2.508  -7.294  -5.364
  176    HB2  ASN  21           HB2      ASN  21  -3.034  -5.567  -7.130
  177    HB3  ASN  21           HB3      ASN  21  -2.015  -6.484  -8.234
  178   HD21  ASN  21          HD22      ASN  21  -5.179  -6.248  -6.829
  179   HD22  ASN  21          HD21      ASN  21  -5.741  -7.849  -7.277
  180    H    HIS  22           H        HIS  22  -1.716  -9.231  -4.824
  181    HA   HIS  22           HA       HIS  22   0.621 -10.359  -6.061
  182    HB2  HIS  22           HB2      HIS  22   0.557 -11.905  -4.356
  183    HB3  HIS  22           HB3      HIS  22  -0.180 -10.507  -3.618
  184    HD1  HIS  22           HD1      HIS  22  -1.484 -13.631  -5.484
  185    HD2  HIS  22           HD2      HIS  22  -2.383 -11.056  -2.284
  186    HE1  HIS  22           HE1      HIS  22  -3.600 -14.590  -4.323
  187    H    ILE  23           H        ILE  23  -2.335 -10.161  -7.470
  188    HA   ILE  23           HA       ILE  23  -2.063 -12.786  -8.860
  189    HB   ILE  23           HB       ILE  23  -4.443 -10.896  -8.719
  190   HG12  ILE  23          HG12      ILE  23  -4.016 -13.644  -7.452
  191   HG13  ILE  23          HG13      ILE  23  -4.002 -12.114  -6.582
  192   HG21  ILE  23          HG21      ILE  23  -5.672 -12.659  -9.913
  193   HG22  ILE  23          HG22      ILE  23  -4.330 -12.088 -10.884
  194   HG23  ILE  23          HG23      ILE  23  -4.189 -13.636 -10.023
  195   HD11  ILE  23          HD11      ILE  23  -6.386 -11.724  -7.315
  196   HD12  ILE  23          HD12      ILE  23  -6.401 -13.404  -7.909
  197   HD13  ILE  23          HD13      ILE  23  -6.126 -13.076  -6.193
  198    H    THR  24           H        THR  24  -2.153  -9.220  -9.328
  199    HA   THR  24           HA       THR  24  -1.475  -9.666 -12.214
  200    HB   THR  24           HB       THR  24  -2.244  -7.443 -12.617
  201    HG1  THR  24           HG1      THR  24  -3.277  -6.348 -10.835
  202   HG21  THR  24          HG21      THR  24  -4.300  -8.800 -10.818
  203   HG22  THR  24          HG22      THR  24  -4.613  -7.647 -12.134
  204   HG23  THR  24          HG23      THR  24  -3.975  -9.258 -12.505
  205    H    ASN  25           H        ASN  25  -0.055  -8.398  -9.336
  206    HA   ASN  25           HA       ASN  25   1.938  -7.596  -8.813
  207    HB2  ASN  25           HB2      ASN  25   2.739  -7.246 -11.708
  208    HB3  ASN  25           HB3      ASN  25   3.772  -7.186 -10.295
  209   HD21  ASN  25          HD22      ASN  25   1.937  -9.304 -12.409
  210   HD22  ASN  25          HD21      ASN  25   2.765 -10.787 -11.888
  211    H    ALA  26           H        ALA  26  -0.568  -5.968 -10.192
  212    HA   ALA  26           HA       ALA  26   0.348  -3.333 -10.569
  213    HB1  ALA  26           HB1      ALA  26  -1.959  -4.080 -11.010
  214    HB2  ALA  26           HB2      ALA  26  -2.238  -4.281  -9.263
  215    HB3  ALA  26           HB3      ALA  26  -1.937  -2.668  -9.939
  216    H    SER  27           H        SER  27   0.977  -1.657  -9.204
  217    HA   SER  27           HA       SER  27   1.304  -2.293  -6.299
  218    HB2  SER  27           HB2      SER  27   3.404  -1.346  -8.289
  219    HB3  SER  27           HB3      SER  27   3.623  -1.464  -6.534
  220    HG   SER  27           HG       SER  27   2.991  -3.677  -8.260
  221    H    GLN  28           H        GLN  28   0.829  -0.559  -4.977
  222    HA   GLN  28           HA       GLN  28   1.086   2.196  -5.999
  223    HB2  GLN  28           HB2      GLN  28  -1.246   2.762  -5.310
  224    HB3  GLN  28           HB3      GLN  28  -1.139   1.739  -6.740
  225    HG2  GLN  28           HG2      GLN  28  -1.747  -0.244  -5.428
  226    HG3  GLN  28           HG3      GLN  28  -1.775   0.699  -3.942
  227   HE21  GLN  28          HE22      GLN  28  -3.496   2.271  -3.638
  228   HE22  GLN  28          HE21      GLN  28  -4.951   2.175  -4.655
  229    H    PHE  29           H        PHE  29   1.281   3.781  -4.326
  230    HA   PHE  29           HA       PHE  29   2.245   2.660  -1.814
  231    HB2  PHE  29           HB2      PHE  29   2.201   5.393  -3.059
  232    HB3  PHE  29           HB3      PHE  29   2.468   5.212  -1.333
  233    HD1  PHE  29           HD2      PHE  29   3.807   2.661  -3.768
  234    HD2  PHE  29           HD1      PHE  29   4.670   6.125  -1.329
  235    HE1  PHE  29           HE2      PHE  29   6.212   2.266  -4.054
  236    HE2  PHE  29           HE1      PHE  29   7.094   5.719  -1.643
  237    HZ   PHE  29           HZ       PHE  29   7.872   3.786  -2.994
  238    H    GLU  30           H        GLU  30  -0.556   4.852  -2.582
  239    HA   GLU  30           HA       GLU  30  -1.570   4.475   0.147
  240    HB2  GLU  30           HB2      GLU  30  -2.098   6.292  -1.902
  241    HB3  GLU  30           HB3      GLU  30  -3.544   5.306  -1.895
  242    HG2  GLU  30           HG2      GLU  30  -2.334   6.755   0.509
  243    HG3  GLU  30           HG3      GLU  30  -3.683   7.342  -0.463
  244    H    ARG  31           H        ARG  31  -3.430   3.286   0.614
  245    HA   ARG  31           HA       ARG  31  -3.302   0.662  -0.707
  246    HB2  ARG  31           HB2      ARG  31  -5.506   0.657   1.164
  247    HB3  ARG  31           HB3      ARG  31  -4.091  -0.311   1.079
  248    HG2  ARG  31           HG2      ARG  31  -3.539   0.543   3.052
  249    HG3  ARG  31           HG3      ARG  31  -3.025   1.987   2.230
  250    HD2  ARG  31           HD2      ARG  31  -5.684   1.372   3.593
  251    HD3  ARG  31           HD3      ARG  31  -4.496   2.586   4.051
  252    HE   ARG  31           HE       ARG  31  -5.078   3.916   2.104
  253   HH11  ARG  31          HH21      ARG  31  -7.381   1.312   2.597
  254   HH12  ARG  31          HH22      ARG  31  -8.602   2.034   1.575
  255   HH21  ARG  31          HH12      ARG  31  -6.626   4.847   0.930
  256   HH22  ARG  31          HH11      ARG  31  -8.186   4.062   0.665
  257    HA   PRO  32           HA       PRO  32  -6.987   1.274  -3.245
  258    HB2  PRO  32           HB2      PRO  32  -7.492  -1.320  -3.983
  259    HB3  PRO  32           HB3      PRO  32  -6.161  -0.347  -4.667
  260    HG2  PRO  32           HG2      PRO  32  -6.013  -2.465  -2.527
  261    HG3  PRO  32           HG3      PRO  32  -4.884  -2.095  -3.864
  262    HD2  PRO  32           HD2      PRO  32  -4.523  -1.276  -1.246
  263    HD3  PRO  32           HD3      PRO  32  -3.784  -0.500  -2.681
  264    H    SER  33           H        SER  33  -9.387   0.113  -3.225
  265    HA   SER  33           HA       SER  33 -10.130  -1.189  -0.815
  266    HB2  SER  33           HB2      SER  33 -10.945   1.727  -1.203
  267    HB3  SER  33           HB3      SER  33 -11.720   0.602  -0.065
  268    HG   SER  33           HG       SER  33  -8.973   0.618   0.067
  269    H    GLY  34           H        GLY  34 -12.129  -2.052  -1.067
  270    HA2  GLY  34           HA2      GLY  34 -14.231  -1.613  -2.823
  271    HA3  GLY  34           HA3      GLY  34 -13.039  -2.497  -3.794
  Start of MODEL    8
    1    H1   LYS   1           H1       LYS   1 -12.546   0.920  -3.423
    2    H2   LYS   1           H2       LYS   1 -13.103   1.660  -4.762
    3    H3   LYS   1           H3       LYS   1 -13.225   2.413  -3.295
    4    HA   LYS   1           HA       LYS   1 -11.458   3.378  -4.602
    5    HB2  LYS   1           HB2      LYS   1 -11.395   3.047  -2.009
    6    HB3  LYS   1           HB3      LYS   1 -10.104   1.892  -2.358
    7    HG2  LYS   1           HG2      LYS   1  -8.866   3.699  -3.574
    8    HG3  LYS   1           HG3      LYS   1 -10.194   4.812  -3.259
    9    HD2  LYS   1           HD2      LYS   1  -8.318   5.171  -1.704
   10    HD3  LYS   1           HD3      LYS   1  -9.794   4.696  -0.846
   11    HE2  LYS   1           HE2      LYS   1  -8.967   2.369  -0.676
   12    HE3  LYS   1           HE3      LYS   1  -7.519   2.807  -1.600
   13    HZ1  LYS   1           HZ1      LYS   1  -6.850   4.262   0.167
   14    HZ2  LYS   1           HZ2      LYS   1  -8.222   3.931   1.053
   15    HZ3  LYS   1           HZ3      LYS   1  -7.081   2.756   0.735
   16    H    LEU   2           H        LEU   2 -10.213   0.056  -3.678
   17    HA   LEU   2           HA       LEU   2  -9.844  -0.437  -6.449
   18    HB2  LEU   2           HB2      LEU   2  -7.196  -0.902  -5.149
   19    HB3  LEU   2           HB3      LEU   2  -7.597  -0.883  -6.753
   20    HG   LEU   2           HG       LEU   2  -7.856   1.589  -6.774
   21   HD11  LEU   2          HD11      LEU   2  -6.062   1.830  -4.374
   22   HD12  LEU   2          HD12      LEU   2  -7.161   2.990  -5.104
   23   HD13  LEU   2          HD13      LEU   2  -7.790   1.700  -4.056
   24   HD21  LEU   2          HD21      LEU   2  -5.912   0.428  -7.665
   25   HD22  LEU   2          HD22      LEU   2  -5.384   1.898  -6.836
   26   HD23  LEU   2          HD23      LEU   2  -5.183   0.309  -6.051
   27    HA   PRO   3           HA       PRO   3 -11.039  -4.431  -5.759
   28    HB2  PRO   3           HB2      PRO   3  -8.462  -5.357  -7.086
   29    HB3  PRO   3           HB3      PRO   3 -10.127  -5.924  -7.447
   30    HG2  PRO   3           HG2      PRO   3  -8.996  -4.136  -9.059
   31    HG3  PRO   3           HG3      PRO   3 -10.661  -3.784  -8.455
   32    HD2  PRO   3           HD2      PRO   3  -8.014  -2.798  -7.312
   33    HD3  PRO   3           HD3      PRO   3  -9.453  -1.863  -7.738
   34    HA   PRO   4           HA       PRO   4  -9.092  -7.205  -2.732
   35    HB2  PRO   4           HB2      PRO   4 -10.314  -9.581  -3.386
   36    HB3  PRO   4           HB3      PRO   4 -11.140  -8.273  -2.483
   37    HG2  PRO   4           HG2      PRO   4 -11.273  -8.863  -5.453
   38    HG3  PRO   4           HG3      PRO   4 -12.627  -8.520  -4.328
   39    HD2  PRO   4           HD2      PRO   4 -11.586  -6.601  -5.921
   40    HD3  PRO   4           HD3      PRO   4 -12.097  -6.217  -4.254
   41    H    GLY   5           H        GLY   5  -7.228  -8.494  -2.858
   42    HA2  GLY   5           HA2      GLY   5  -5.679  -9.937  -4.187
   43    HA3  GLY   5           HA3      GLY   5  -6.156  -9.010  -5.603
   44    H    TRP   6           H        TRP   6  -6.174  -6.258  -4.194
   45    HA   TRP   6           HA       TRP   6  -3.315  -5.764  -4.200
   46    HB2  TRP   6           HB2      TRP   6  -5.770  -4.185  -3.381
   47    HB3  TRP   6           HB3      TRP   6  -4.126  -3.579  -3.284
   48    HD1  TRP   6           HD1      TRP   6  -6.861  -4.041  -5.788
   49    HE1  TRP   6           HE1      TRP   6  -6.151  -2.903  -7.978
   50    HE3  TRP   6           HE3      TRP   6  -1.977  -3.236  -4.688
   51    HZ2  TRP   6           HZ2      TRP   6  -3.707  -1.895  -9.167
   52    HZ3  TRP   6           HZ3      TRP   6  -0.495  -2.181  -6.295
   53    HH2  TRP   6           HH2      TRP   6  -1.309  -1.508  -8.575
   54    H    GLU   7           H        GLU   7  -1.895  -6.134  -2.574
   55    HA   GLU   7           HA       GLU   7  -2.860  -6.275   0.242
   56    HB2  GLU   7           HB2      GLU   7  -2.568  -8.474  -1.178
   57    HB3  GLU   7           HB3      GLU   7  -0.848  -8.214  -0.941
   58    HG2  GLU   7           HG2      GLU   7  -2.959  -8.486   1.256
   59    HG3  GLU   7           HG3      GLU   7  -1.941  -9.798   0.666
   60    H    LYS   8           H        LYS   8  -1.269  -5.819   1.827
   61    HA   LYS   8           HA       LYS   8   0.382  -3.572   1.286
   62    HB2  LYS   8           HB2      LYS   8  -0.610  -3.615   3.346
   63    HB3  LYS   8           HB3      LYS   8  -0.363  -5.295   3.631
   64    HG2  LYS   8           HG2      LYS   8   1.873  -3.240   3.750
   65    HG3  LYS   8           HG3      LYS   8   0.838  -3.647   5.107
   66    HD2  LYS   8           HD2      LYS   8   2.972  -5.383   3.849
   67    HD3  LYS   8           HD3      LYS   8   2.821  -4.788   5.473
   68    HE2  LYS   8           HE2      LYS   8   2.355  -7.030   5.691
   69    HE3  LYS   8           HE3      LYS   8   0.753  -6.290   5.751
   70    HZ1  LYS   8           HZ1      LYS   8   1.725  -7.215   3.125
   71    HZ2  LYS   8           HZ2      LYS   8   1.243  -8.366   4.203
   72    HZ3  LYS   8           HZ3      LYS   8   0.218  -7.237   3.672
   73    H    ARG   9           H        ARG   9   2.490  -3.251   1.024
   74    HA   ARG   9           HA       ARG   9   4.489  -5.345   1.580
   75    HB2  ARG   9           HB2      ARG   9   4.301  -3.844  -1.069
   76    HB3  ARG   9           HB3      ARG   9   5.654  -4.869  -0.590
   77    HG2  ARG   9           HG2      ARG   9   2.805  -5.771  -1.126
   78    HG3  ARG   9           HG3      ARG   9   4.186  -5.974  -2.197
   79    HD2  ARG   9           HD2      ARG   9   4.924  -7.827  -1.161
   80    HD3  ARG   9           HD3      ARG   9   4.715  -7.143   0.440
   81    HE   ARG   9           HE       ARG   9   2.408  -7.749   0.472
   82   HH11  ARG   9          HH11      ARG   9   3.999  -9.188  -2.313
   83   HH12  ARG   9          HH12      ARG   9   2.870 -10.517  -2.390
   84   HH21  ARG   9          HH22      ARG   9   1.033  -9.434   0.359
   85   HH22  ARG   9          HH21      ARG   9   1.152 -10.621  -0.930
   86    H    MET  10           H        MET  10   6.757  -4.296   1.403
   87    HA   MET  10           HA       MET  10   6.688  -1.453   2.244
   88    HB2  MET  10           HB2      MET  10   6.524  -2.642   4.287
   89    HB3  MET  10           HB3      MET  10   7.785  -3.789   3.836
   90    HG2  MET  10           HG2      MET  10   8.442  -0.850   3.956
   91    HG3  MET  10           HG3      MET  10   8.259  -1.716   5.459
   92    HE1  MET  10           HE1      MET  10   9.487  -4.522   5.254
   93    HE2  MET  10           HE2      MET  10  11.190  -4.184   5.632
   94    HE3  MET  10           HE3      MET  10   9.903  -3.329   6.507
   95    H    PHE  11           H        PHE  11   8.362  -0.245   1.704
   96    HA   PHE  11           HA       PHE  11  10.238  -1.157  -0.307
   97    HB2  PHE  11           HB2      PHE  11   8.941   0.988  -0.270
   98    HB3  PHE  11           HB3      PHE  11   9.919   1.506   1.085
   99    HD1  PHE  11           HD2      PHE  11  12.316  -0.130  -0.962
  100    HD2  PHE  11           HD1      PHE  11   9.779   3.378  -0.872
  101    HE1  PHE  11           HE2      PHE  11  13.851   1.026  -2.470
  102    HE2  PHE  11           HE1      PHE  11  11.346   4.525  -2.404
  103    HZ   PHE  11           HZ       PHE  11  13.390   3.355  -3.206
  104    H    ARG  12           H        ARG  12  11.822  -2.441   0.455
  105    HA   ARG  12           HA       ARG  12  13.144  -2.425   2.927
  106    HB2  ARG  12           HB2      ARG  12  13.634  -3.510   0.179
  107    HB3  ARG  12           HB3      ARG  12  15.073  -3.308   1.149
  108    HG2  ARG  12           HG2      ARG  12  14.113  -5.573   1.291
  109    HG3  ARG  12           HG3      ARG  12  14.340  -4.785   2.839
  110    HD2  ARG  12           HD2      ARG  12  12.236  -6.132   2.671
  111    HD3  ARG  12           HD3      ARG  12  12.019  -4.465   3.179
  112    HE   ARG  12           HE       ARG  12  10.566  -4.194   1.453
  113   HH11  ARG  12          HH12      ARG  12  12.674  -6.756   0.321
  114   HH12  ARG  12          HH11      ARG  12  11.815  -6.897  -1.194
  115   HH21  ARG  12          HH21      ARG  12   9.567  -4.368  -0.332
  116   HH22  ARG  12          HH22      ARG  12  10.028  -5.504  -1.596
  117    H    SER  13           H        SER  13  15.136  -1.726   3.612
  118    HA   SER  13           HA       SER  13  16.679  -0.235   4.146
  119    HB2  SER  13           HB2      SER  13  17.620  -0.745   1.907
  120    HB3  SER  13           HB3      SER  13  16.763   0.673   1.258
  121    HG   SER  13           HG       SER  13  17.809   1.806   3.095
  122    H    ASN  14           H        ASN  14  13.590   0.888   3.383
  123    HA   ASN  14           HA       ASN  14  14.295   3.261   5.001
  124    HB2  ASN  14           HB2      ASN  14  13.008   4.811   3.609
  125    HB3  ASN  14           HB3      ASN  14  14.402   4.160   2.760
  126   HD21  ASN  14          HD21      ASN  14  14.062   3.113   0.784
  127   HD22  ASN  14          HD22      ASN  14  12.463   2.829   0.148
  128    H    GLY  15           H        GLY  15  11.665   1.102   3.824
  129    HA2  GLY  15           HA2      GLY  15  10.250   0.123   5.461
  130    HA3  GLY  15           HA3      GLY  15  10.361   1.555   6.468
  131    H    THR  16           H        THR  16   9.882   2.621   3.273
  132    HA   THR  16           HA       THR  16   7.313   3.667   3.798
  133    HB   THR  16           HB       THR  16   8.458   3.120   1.034
  134    HG1  THR  16           HG1      THR  16   9.981   4.265   2.106
  135   HG21  THR  16          HG21      THR  16   6.110   3.828   0.987
  136   HG22  THR  16          HG22      THR  16   6.486   5.196   2.062
  137   HG23  THR  16          HG23      THR  16   7.165   5.134   0.422
  138    H    VAL  17           H        VAL  17   5.427   2.579   4.053
  139    HA   VAL  17           HA       VAL  17   5.035  -0.053   2.840
  140    HB   VAL  17           HB       VAL  17   3.287   1.704   4.573
  141   HG11  VAL  17          HG11      VAL  17   2.587  -1.026   3.420
  142   HG12  VAL  17          HG12      VAL  17   1.735  -0.249   4.771
  143   HG13  VAL  17          HG13      VAL  17   1.699   0.495   3.174
  144   HG21  VAL  17          HG21      VAL  17   4.566  -1.037   5.006
  145   HG22  VAL  17          HG22      VAL  17   5.210   0.493   5.646
  146   HG23  VAL  17          HG23      VAL  17   3.647  -0.112   6.213
  147    H    TYR  18           H        TYR  18   3.688  -0.626   1.285
  148    HA   TYR  18           HA       TYR  18   2.081   1.277  -0.245
  149    HB2  TYR  18           HB2      TYR  18   3.194   0.993  -2.326
  150    HB3  TYR  18           HB3      TYR  18   4.392   1.511  -1.164
  151    HD1  TYR  18           HD1      TYR  18   6.150  -0.049  -0.361
  152    HD2  TYR  18           HD2      TYR  18   3.365  -1.110  -3.466
  153    HE1  TYR  18           HE1      TYR  18   7.643  -1.940  -1.082
  154    HE2  TYR  18           HE2      TYR  18   4.809  -3.002  -4.147
  155    HH   TYR  18           HH       TYR  18   6.815  -4.046  -3.815
  156    H    TYR  19           H        TYR  19   1.247  -0.269  -2.350
  157    HA   TYR  19           HA       TYR  19   0.610  -2.938  -1.190
  158    HB2  TYR  19           HB2      TYR  19  -1.274  -0.779  -2.009
  159    HB3  TYR  19           HB3      TYR  19  -1.657  -2.389  -2.541
  160    HD1  TYR  19           HD1      TYR  19  -0.510  -0.809   0.720
  161    HD2  TYR  19           HD2      TYR  19  -3.116  -3.595  -1.249
  162    HE1  TYR  19           HE1      TYR  19  -1.627  -1.343   2.893
  163    HE2  TYR  19           HE2      TYR  19  -4.285  -4.052   0.864
  164    HH   TYR  19           HH       TYR  19  -4.471  -3.447   3.093
  165    H    PHE  20           H        PHE  20   0.121  -4.528  -2.573
  166    HA   PHE  20           HA       PHE  20   1.110  -4.328  -5.387
  167    HB2  PHE  20           HB2      PHE  20   2.874  -5.091  -3.900
  168    HB3  PHE  20           HB3      PHE  20   1.792  -6.268  -3.150
  169    HD1  PHE  20           HD1      PHE  20   3.555  -5.398  -6.310
  170    HD2  PHE  20           HD2      PHE  20   1.452  -8.468  -4.111
  171    HE1  PHE  20           HE1      PHE  20   4.343  -7.103  -7.922
  172    HE2  PHE  20           HE2      PHE  20   2.289 -10.171  -5.712
  173    HZ   PHE  20           HZ       PHE  20   3.724  -9.500  -7.611
  174    H    ASN  21           H        ASN  21  -0.253  -5.263  -6.817
  175    HA   ASN  21           HA       ASN  21  -2.607  -6.719  -5.829
  176    HB2  ASN  21           HB2      ASN  21  -2.735  -5.001  -7.670
  177    HB3  ASN  21           HB3      ASN  21  -1.792  -6.091  -8.662
  178   HD21  ASN  21          HD22      ASN  21  -4.973  -5.468  -7.226
  179   HD22  ASN  21          HD21      ASN  21  -5.724  -6.882  -7.954
  180    H    HIS  22           H        HIS  22  -2.046  -8.679  -5.055
  181    HA   HIS  22           HA       HIS  22   0.055 -10.255  -6.214
  182    HB2  HIS  22           HB2      HIS  22  -0.229 -11.650  -4.410
  183    HB3  HIS  22           HB3      HIS  22  -0.767 -10.116  -3.770
  184    HD1  HIS  22           HD1      HIS  22  -2.437 -13.200  -5.393
  185    HD2  HIS  22           HD2      HIS  22  -3.081 -10.223  -2.503
  186    HE1  HIS  22           HE1      HIS  22  -4.674 -13.778  -4.209
  187    H    ILE  23           H        ILE  23  -2.855  -9.713  -7.618
  188    HA   ILE  23           HA       ILE  23  -3.198 -12.477  -8.678
  189    HB   ILE  23           HB       ILE  23  -5.095 -10.095  -8.659
  190   HG12  ILE  23          HG12      ILE  23  -5.027 -12.640  -6.970
  191   HG13  ILE  23          HG13      ILE  23  -4.782 -10.992  -6.397
  192   HG21  ILE  23          HG21      ILE  23  -5.603 -12.975  -9.508
  193   HG22  ILE  23          HG22      ILE  23  -6.800 -11.660  -9.464
  194   HG23  ILE  23          HG23      ILE  23  -5.475 -11.584 -10.609
  195   HD11  ILE  23          HD11      ILE  23  -7.167 -10.471  -7.087
  196   HD12  ILE  23          HD12      ILE  23  -7.388 -12.221  -7.334
  197   HD13  ILE  23          HD13      ILE  23  -6.965 -11.601  -5.733
  198    H    THR  24           H        THR  24  -2.370  -9.177  -9.527
  199    HA   THR  24           HA       THR  24  -2.017  -9.925 -12.416
  200    HB   THR  24           HB       THR  24  -2.222  -7.520 -12.877
  201    HG1  THR  24           HG1      THR  24  -2.956  -7.315 -10.171
  202   HG21  THR  24          HG21      THR  24  -4.325  -8.839 -12.912
  203   HG22  THR  24          HG22      THR  24  -4.575  -8.493 -11.187
  204   HG23  THR  24          HG23      THR  24  -4.593  -7.169 -12.366
  205    H    ASN  25           H        ASN  25  -0.270  -8.901  -9.613
  206    HA   ASN  25           HA       ASN  25   1.838  -8.418  -9.185
  207    HB2  ASN  25           HB2      ASN  25   2.287 -10.037 -11.192
  208    HB3  ASN  25           HB3      ASN  25   2.720  -8.568 -12.063
  209   HD21  ASN  25          HD22      ASN  25   4.302  -7.112 -10.594
  210   HD22  ASN  25          HD21      ASN  25   5.693  -8.078 -10.041
  211    H    ALA  26           H        ALA  26  -0.329  -6.397 -10.463
  212    HA   ALA  26           HA       ALA  26   1.316  -4.106 -11.093
  213    HB1  ALA  26           HB1      ALA  26  -1.080  -4.333 -11.712
  214    HB2  ALA  26           HB2      ALA  26  -1.525  -4.223  -9.996
  215    HB3  ALA  26           HB3      ALA  26  -0.753  -2.846 -10.804
  216    H    SER  27           H        SER  27   1.445  -2.092  -9.690
  217    HA   SER  27           HA       SER  27   1.602  -2.607  -6.772
  218    HB2  SER  27           HB2      SER  27   3.796  -3.155  -7.863
  219    HB3  SER  27           HB3      SER  27   3.907  -1.461  -8.383
  220    HG   SER  27           HG       SER  27   4.053  -0.847  -6.269
  221    H    GLN  28           H        GLN  28   1.277  -0.742  -5.505
  222    HA   GLN  28           HA       GLN  28   0.929   1.895  -6.777
  223    HB2  GLN  28           HB2      GLN  28  -1.113   0.646  -7.345
  224    HB3  GLN  28           HB3      GLN  28  -1.349   0.200  -5.655
  225    HG2  GLN  28           HG2      GLN  28  -2.884   1.953  -6.506
  226    HG3  GLN  28           HG3      GLN  28  -1.997   2.400  -5.069
  227   HE21  GLN  28          HE22      GLN  28  -2.219   2.986  -8.644
  228   HE22  GLN  28          HE21      GLN  28  -1.327   4.490  -8.514
  229    H    PHE  29           H        PHE  29   0.669   3.596  -5.206
  230    HA   PHE  29           HA       PHE  29   1.694   2.912  -2.510
  231    HB2  PHE  29           HB2      PHE  29   1.385   5.585  -3.888
  232    HB3  PHE  29           HB3      PHE  29   2.171   5.293  -2.336
  233    HD1  PHE  29           HD1      PHE  29   4.039   3.298  -2.444
  234    HD2  PHE  29           HD2      PHE  29   2.812   5.763  -5.766
  235    HE1  PHE  29           HE1      PHE  29   6.164   2.786  -3.609
  236    HE2  PHE  29           HE2      PHE  29   4.942   5.245  -6.929
  237    HZ   PHE  29           HZ       PHE  29   6.619   3.757  -5.854
  238    H    GLU  30           H        GLU  30  -1.297   3.836  -4.063
  239    HA   GLU  30           HA       GLU  30  -2.538   4.526  -1.519
  240    HB2  GLU  30           HB2      GLU  30  -3.291   5.588  -3.556
  241    HB3  GLU  30           HB3      GLU  30  -3.867   4.037  -4.183
  242    HG2  GLU  30           HG2      GLU  30  -5.669   5.493  -3.193
  243    HG3  GLU  30           HG3      GLU  30  -5.544   3.907  -2.434
  244    H    ARG  31           H        ARG  31  -3.586   3.291  -0.192
  245    HA   ARG  31           HA       ARG  31  -3.127   0.366  -0.358
  246    HB2  ARG  31           HB2      ARG  31  -3.949   2.211   1.928
  247    HB3  ARG  31           HB3      ARG  31  -3.668   0.492   2.080
  248    HG2  ARG  31           HG2      ARG  31  -1.501   0.808   2.403
  249    HG3  ARG  31           HG3      ARG  31  -1.298   1.588   0.849
  250    HD2  ARG  31           HD2      ARG  31  -2.271   3.123   3.302
  251    HD3  ARG  31           HD3      ARG  31  -0.571   2.737   3.077
  252    HE   ARG  31           HE       ARG  31  -0.409   4.124   1.190
  253   HH11  ARG  31          HH11      ARG  31  -3.724   4.262   2.334
  254   HH12  ARG  31          HH12      ARG  31  -4.181   5.327   1.009
  255   HH21  ARG  31          HH22      ARG  31  -0.978   5.695  -0.151
  256   HH22  ARG  31          HH21      ARG  31  -2.630   6.328  -0.134
  257    HA   PRO  32           HA       PRO  32  -7.632   0.370  -1.193
  258    HB2  PRO  32           HB2      PRO  32  -7.408  -2.235  -2.541
  259    HB3  PRO  32           HB3      PRO  32  -7.853  -0.664  -3.192
  260    HG2  PRO  32           HG2      PRO  32  -5.535  -1.888  -3.828
  261    HG3  PRO  32           HG3      PRO  32  -5.600  -0.168  -3.758
  262    HD2  PRO  32           HD2      PRO  32  -4.726  -1.978  -1.514
  263    HD3  PRO  32           HD3      PRO  32  -3.869  -0.553  -2.162
  264    H    SER  33           H        SER  33  -9.436  -1.138  -0.825
  265    HA   SER  33           HA       SER  33  -9.271  -3.671   0.405
  266    HB2  SER  33           HB2      SER  33  -9.875  -1.362   2.308
  267    HB3  SER  33           HB3      SER  33 -10.353  -3.043   2.627
  268    HG   SER  33           HG       SER  33  -7.687  -2.465   1.913
  269    H    GLY  34           H        GLY  34 -10.424  -2.663  -1.870
  270    HA2  GLY  34           HA2      GLY  34 -12.620  -3.132  -2.777
  271    HA3  GLY  34           HA3      GLY  34 -13.342  -2.386  -1.337
  Start of MODEL    9
    1    H1   LYS   1           H1       LYS   1  -9.876   4.942  -4.537
    2    H2   LYS   1           H2       LYS   1  -9.945   4.424  -6.108
    3    H3   LYS   1           H3       LYS   1  -8.570   4.236  -5.191
    4    HA   LYS   1           HA       LYS   1  -9.476   2.626  -3.842
    5    HB2  LYS   1           HB2      LYS   1 -11.652   3.843  -3.628
    6    HB3  LYS   1           HB3      LYS   1 -12.200   3.101  -5.127
    7    HG2  LYS   1           HG2      LYS   1 -11.177   1.458  -2.773
    8    HG3  LYS   1           HG3      LYS   1 -12.839   2.050  -2.820
    9    HD2  LYS   1           HD2      LYS   1 -13.326   0.784  -4.846
   10    HD3  LYS   1           HD3      LYS   1 -11.643   0.282  -4.981
   11    HE2  LYS   1           HE2      LYS   1 -12.028  -0.630  -2.516
   12    HE3  LYS   1           HE3      LYS   1 -13.727  -0.631  -3.010
   13    HZ1  LYS   1           HZ1      LYS   1 -12.956  -2.004  -4.960
   14    HZ2  LYS   1           HZ2      LYS   1 -11.439  -2.049  -4.255
   15    HZ3  LYS   1           HZ3      LYS   1 -12.673  -2.745  -3.500
   16    H    LEU   2           H        LEU   2  -8.128   1.230  -4.857
   17    HA   LEU   2           HA       LEU   2  -8.975   0.055  -7.438
   18    HB2  LEU   2           HB2      LEU   2  -6.458  -0.708  -5.942
   19    HB3  LEU   2           HB3      LEU   2  -6.859  -1.029  -7.546
   20    HG   LEU   2           HG       LEU   2  -6.743   1.253  -8.289
   21   HD11  LEU   2          HD11      LEU   2  -6.851   2.642  -6.340
   22   HD12  LEU   2          HD12      LEU   2  -5.527   1.753  -5.549
   23   HD13  LEU   2          HD13      LEU   2  -5.225   2.777  -6.969
   24   HD21  LEU   2          HD21      LEU   2  -4.991  -0.371  -8.675
   25   HD22  LEU   2          HD22      LEU   2  -4.231   1.165  -8.276
   26   HD23  LEU   2          HD23      LEU   2  -4.329  -0.128  -7.045
   27    HA   PRO   3           HA       PRO   3 -10.797  -3.788  -6.302
   28    HB2  PRO   3           HB2      PRO   3  -8.381  -5.148  -7.550
   29    HB3  PRO   3           HB3      PRO   3 -10.103  -5.518  -7.875
   30    HG2  PRO   3           HG2      PRO   3  -8.764  -4.071  -9.627
   31    HG3  PRO   3           HG3      PRO   3 -10.344  -3.394  -9.052
   32    HD2  PRO   3           HD2      PRO   3  -7.553  -2.840  -7.961
   33    HD3  PRO   3           HD3      PRO   3  -8.772  -1.667  -8.511
   34    HA   PRO   4           HA       PRO   4  -9.247  -6.789  -3.227
   35    HB2  PRO   4           HB2      PRO   4 -10.765  -8.800  -4.890
   36    HB3  PRO   4           HB3      PRO   4 -10.819  -8.539  -3.119
   37    HG2  PRO   4           HG2      PRO   4 -12.832  -7.651  -4.709
   38    HG3  PRO   4           HG3      PRO   4 -12.223  -6.638  -3.363
   39    HD2  PRO   4           HD2      PRO   4 -11.575  -6.439  -6.311
   40    HD3  PRO   4           HD3      PRO   4 -11.945  -5.140  -5.132
   41    H    GLY   5           H        GLY   5  -7.439  -8.186  -3.208
   42    HA2  GLY   5           HA2      GLY   5  -5.897  -9.744  -4.411
   43    HA3  GLY   5           HA3      GLY   5  -6.209  -8.805  -5.866
   44    H    TRP   6           H        TRP   6  -6.150  -6.093  -4.403
   45    HA   TRP   6           HA       TRP   6  -3.269  -5.752  -4.297
   46    HB2  TRP   6           HB2      TRP   6  -5.695  -4.067  -3.689
   47    HB3  TRP   6           HB3      TRP   6  -4.036  -3.503  -3.504
   48    HD1  TRP   6           HD1      TRP   6  -6.600  -4.018  -6.239
   49    HE1  TRP   6           HE1      TRP   6  -5.722  -3.006  -8.361
   50    HE3  TRP   6           HE3      TRP   6  -1.815  -3.261  -4.752
   51    HZ2  TRP   6           HZ2      TRP   6  -3.144  -2.107  -9.417
   52    HZ3  TRP   6           HZ3      TRP   6  -0.189  -2.309  -6.271
   53    HH2  TRP   6           HH2      TRP   6  -0.812  -1.701  -8.639
   54    H    GLU   7           H        GLU   7  -1.933  -5.994  -2.586
   55    HA   GLU   7           HA       GLU   7  -3.022  -6.056   0.181
   56    HB2  GLU   7           HB2      GLU   7  -2.544  -8.330  -1.219
   57    HB3  GLU   7           HB3      GLU   7  -0.913  -8.045  -0.642
   58    HG2  GLU   7           HG2      GLU   7  -3.417  -8.228   1.109
   59    HG3  GLU   7           HG3      GLU   7  -2.337  -9.576   0.759
   60    H    LYS   8           H        LYS   8  -1.484  -5.565   1.800
   61    HA   LYS   8           HA       LYS   8   0.261  -3.380   1.211
   62    HB2  LYS   8           HB2      LYS   8  -0.704  -3.167   3.234
   63    HB3  LYS   8           HB3      LYS   8  -0.747  -4.850   3.595
   64    HG2  LYS   8           HG2      LYS   8   1.994  -3.617   3.705
   65    HG3  LYS   8           HG3      LYS   8   0.811  -2.955   4.793
   66    HD2  LYS   8           HD2      LYS   8   2.086  -4.708   5.875
   67    HD3  LYS   8           HD3      LYS   8   0.364  -5.031   5.892
   68    HE2  LYS   8           HE2      LYS   8   2.180  -6.309   3.823
   69    HE3  LYS   8           HE3      LYS   8   2.090  -6.951   5.451
   70    HZ1  LYS   8           HZ1      LYS   8  -0.205  -7.464   5.181
   71    HZ2  LYS   8           HZ2      LYS   8  -0.364  -6.680   3.758
   72    HZ3  LYS   8           HZ3      LYS   8   0.478  -7.991   3.773
   73    H    ARG   9           H        ARG   9   2.439  -3.158   1.104
   74    HA   ARG   9           HA       ARG   9   4.280  -5.362   1.763
   75    HB2  ARG   9           HB2      ARG   9   4.189  -3.997  -0.963
   76    HB3  ARG   9           HB3      ARG   9   5.537  -4.985  -0.404
   77    HG2  ARG   9           HG2      ARG   9   2.700  -5.976  -0.885
   78    HG3  ARG   9           HG3      ARG   9   4.079  -6.174  -1.969
   79    HD2  ARG   9           HD2      ARG   9   5.239  -7.580  -0.376
   80    HD3  ARG   9           HD3      ARG   9   3.984  -7.345   0.835
   81    HE   ARG   9           HE       ARG   9   3.825  -8.997  -1.621
   82   HH11  ARG   9          HH21      ARG   9   1.975  -7.696   1.040
   83   HH12  ARG   9          HH22      ARG   9   0.841  -8.972   1.167
   84   HH21  ARG   9          HH12      ARG   9   2.269 -10.670  -1.625
   85   HH22  ARG   9          HH11      ARG   9   0.985 -10.587  -0.442
   86    H    MET  10           H        MET  10   6.634  -4.419   1.580
   87    HA   MET  10           HA       MET  10   6.624  -1.569   2.437
   88    HB2  MET  10           HB2      MET  10   6.560  -3.085   4.413
   89    HB3  MET  10           HB3      MET  10   8.061  -3.840   3.852
   90    HG2  MET  10           HG2      MET  10   9.170  -1.591   3.953
   91    HG3  MET  10           HG3      MET  10   7.683  -0.909   4.603
   92    HE1  MET  10           HE1      MET  10   7.524  -2.179   8.215
   93    HE2  MET  10           HE2      MET  10   7.061  -0.894   7.080
   94    HE3  MET  10           HE3      MET  10   6.539  -2.573   6.788
   95    H    PHE  11           H        PHE  11   8.108  -0.363   1.491
   96    HA   PHE  11           HA       PHE  11   9.924  -1.407  -0.449
   97    HB2  PHE  11           HB2      PHE  11   8.670   0.768  -0.464
   98    HB3  PHE  11           HB3      PHE  11   9.742   1.339   0.799
   99    HD1  PHE  11           HD1      PHE  11  11.812  -0.561  -1.437
  100    HD2  PHE  11           HD2      PHE  11   9.646   3.167  -1.122
  101    HE1  PHE  11           HE1      PHE  11  13.275   0.440  -3.141
  102    HE2  PHE  11           HE2      PHE  11  11.135   4.160  -2.833
  103    HZ   PHE  11           HZ       PHE  11  12.956   2.802  -3.842
  104    H    ARG  12           H        ARG  12  11.285  -2.846   0.601
  105    HA   ARG  12           HA       ARG  12  12.831  -2.618   2.815
  106    HB2  ARG  12           HB2      ARG  12  14.184  -4.306   2.007
  107    HB3  ARG  12           HB3      ARG  12  12.691  -4.538   1.116
  108    HG2  ARG  12           HG2      ARG  12  15.284  -3.299   0.089
  109    HG3  ARG  12           HG3      ARG  12  14.657  -4.892  -0.300
  110    HD2  ARG  12           HD2      ARG  12  12.817  -3.975  -1.563
  111    HD3  ARG  12           HD3      ARG  12  13.180  -2.332  -1.043
  112    HE   ARG  12           HE       ARG  12  14.532  -3.858  -3.121
  113   HH11  ARG  12          HH11      ARG  12  14.880  -1.016  -1.011
  114   HH12  ARG  12          HH12      ARG  12  16.036  -0.282  -2.091
  115   HH21  ARG  12          HH21      ARG  12  16.017  -2.830  -4.426
  116   HH22  ARG  12          HH22      ARG  12  16.658  -1.285  -3.965
  117    H    SER  13           H        SER  13  14.774  -1.853   3.483
  118    HA   SER  13           HA       SER  13  16.523  -0.520   3.767
  119    HB2  SER  13           HB2      SER  13  17.339  -1.247   1.540
  120    HB3  SER  13           HB3      SER  13  16.545   0.175   0.820
  121    HG   SER  13           HG       SER  13  17.732   1.365   2.535
  122    H    ASN  14           H        ASN  14  13.502   0.702   3.038
  123    HA   ASN  14           HA       ASN  14  14.334   3.157   4.443
  124    HB2  ASN  14           HB2      ASN  14  13.058   4.662   3.017
  125    HB3  ASN  14           HB3      ASN  14  14.368   3.895   2.130
  126   HD21  ASN  14          HD22      ASN  14  13.854   2.839   0.217
  127   HD22  ASN  14          HD21      ASN  14  12.203   2.562  -0.294
  128    H    GLY  15           H        GLY  15  11.633   1.000   3.460
  129    HA2  GLY  15           HA2      GLY  15  10.276   0.071   5.146
  130    HA3  GLY  15           HA3      GLY  15  10.498   1.480   6.169
  131    H    THR  16           H        THR  16   9.827   2.502   2.965
  132    HA   THR  16           HA       THR  16   7.300   3.625   3.608
  133    HB   THR  16           HB       THR  16   8.284   2.924   0.814
  134    HG1  THR  16           HG1      THR  16   9.860   4.125   1.743
  135   HG21  THR  16          HG21      THR  16   6.956   4.895   0.152
  136   HG22  THR  16          HG22      THR  16   5.936   3.625   0.841
  137   HG23  THR  16          HG23      THR  16   6.360   5.053   1.818
  138    H    VAL  17           H        VAL  17   5.513   2.411   4.201
  139    HA   VAL  17           HA       VAL  17   5.010  -0.170   2.929
  140    HB   VAL  17           HB       VAL  17   3.394   1.450   4.900
  141   HG11  VAL  17          HG11      VAL  17   2.737  -1.296   3.756
  142   HG12  VAL  17          HG12      VAL  17   1.953  -0.565   5.170
  143   HG13  VAL  17          HG13      VAL  17   1.755   0.171   3.580
  144   HG21  VAL  17          HG21      VAL  17   4.846  -1.234   5.084
  145   HG22  VAL  17          HG22      VAL  17   5.466   0.304   5.739
  146   HG23  VAL  17          HG23      VAL  17   4.001  -0.420   6.421
  147    H    TYR  18           H        TYR  18   3.629  -0.651   1.421
  148    HA   TYR  18           HA       TYR  18   2.002   1.334  -0.025
  149    HB2  TYR  18           HB2      TYR  18   3.160   1.236  -2.057
  150    HB3  TYR  18           HB3      TYR  18   4.394   1.565  -0.865
  151    HD1  TYR  18           HD1      TYR  18   5.870  -0.415  -0.065
  152    HD2  TYR  18           HD2      TYR  18   3.330  -0.582  -3.543
  153    HE1  TYR  18           HE1      TYR  18   7.144  -2.406  -0.924
  154    HE2  TYR  18           HE2      TYR  18   4.541  -2.576  -4.351
  155    HH   TYR  18           HH       TYR  18   6.306  -4.009  -3.977
  156    H    TYR  19           H        TYR  19   1.250  -0.141  -2.269
  157    HA   TYR  19           HA       TYR  19   0.550  -2.818  -1.171
  158    HB2  TYR  19           HB2      TYR  19  -1.257  -0.677  -2.206
  159    HB3  TYR  19           HB3      TYR  19  -1.604  -2.323  -2.660
  160    HD1  TYR  19           HD1      TYR  19  -0.644  -0.553   0.563
  161    HD2  TYR  19           HD2      TYR  19  -3.179  -3.420  -1.396
  162    HE1  TYR  19           HE1      TYR  19  -1.836  -0.976   2.698
  163    HE2  TYR  19           HE2      TYR  19  -4.402  -3.811   0.702
  164    HH   TYR  19           HH       TYR  19  -4.597  -3.207   2.924
  165    H    PHE  20           H        PHE  20   0.201  -4.417  -2.563
  166    HA   PHE  20           HA       PHE  20   1.344  -4.227  -5.311
  167    HB2  PHE  20           HB2      PHE  20   3.013  -5.067  -3.782
  168    HB3  PHE  20           HB3      PHE  20   1.845  -6.146  -3.010
  169    HD1  PHE  20           HD2      PHE  20   3.756  -5.557  -6.149
  170    HD2  PHE  20           HD1      PHE  20   1.421  -8.397  -3.856
  171    HE1  PHE  20           HE2      PHE  20   4.562  -7.398  -7.583
  172    HE2  PHE  20           HE1      PHE  20   2.276 -10.225  -5.285
  173    HZ   PHE  20           HZ       PHE  20   3.832  -9.743  -7.147
  174    H    ASN  21           H        ASN  21   0.105  -5.345  -6.834
  175    HA   ASN  21           HA       ASN  21  -2.354  -6.660  -5.853
  176    HB2  ASN  21           HB2      ASN  21  -2.347  -5.115  -7.843
  177    HB3  ASN  21           HB3      ASN  21  -1.451  -6.357  -8.705
  178   HD21  ASN  21          HD22      ASN  21  -4.644  -5.328  -7.716
  179   HD22  ASN  21          HD21      ASN  21  -5.421  -6.846  -8.150
  180    H    HIS  22           H        HIS  22  -2.088  -8.620  -5.010
  181    HA   HIS  22           HA       HIS  22   0.098 -10.324  -5.825
  182    HB2  HIS  22           HB2      HIS  22  -0.390 -11.544  -3.967
  183    HB3  HIS  22           HB3      HIS  22  -1.007  -9.987  -3.491
  184    HD1  HIS  22           HD1      HIS  22  -2.515 -13.141  -5.149
  185    HD2  HIS  22           HD2      HIS  22  -3.433 -10.043  -2.466
  186    HE1  HIS  22           HE1      HIS  22  -4.873 -13.651  -4.197
  187    H    ILE  23           H        ILE  23  -2.696  -9.725  -7.493
  188    HA   ILE  23           HA       ILE  23  -2.955 -12.487  -8.556
  189    HB   ILE  23           HB       ILE  23  -4.862 -10.144  -8.910
  190   HG12  ILE  23          HG12      ILE  23  -5.015 -12.436  -6.897
  191   HG13  ILE  23          HG13      ILE  23  -4.770 -10.734  -6.509
  192   HG21  ILE  23          HG21      ILE  23  -6.436 -11.840  -9.681
  193   HG22  ILE  23          HG22      ILE  23  -4.976 -11.929 -10.648
  194   HG23  ILE  23          HG23      ILE  23  -5.252 -13.128  -9.364
  195   HD11  ILE  23          HD11      ILE  23  -7.311 -11.979  -7.599
  196   HD12  ILE  23          HD12      ILE  23  -7.044 -11.218  -6.028
  197   HD13  ILE  23          HD13      ILE  23  -7.036 -10.222  -7.493
  198    H    THR  24           H        THR  24  -2.201  -9.102  -9.451
  199    HA   THR  24           HA       THR  24  -1.539 -10.003 -12.229
  200    HB   THR  24           HB       THR  24  -1.786  -7.743 -12.895
  201    HG1  THR  24           HG1      THR  24  -2.419  -6.154 -11.422
  202   HG21  THR  24          HG21      THR  24  -4.142  -7.306 -12.503
  203   HG22  THR  24          HG22      THR  24  -3.905  -9.056 -12.664
  204   HG23  THR  24          HG23      THR  24  -4.141  -8.338 -11.057
  205    H    ASN  25           H        ASN  25   0.030  -8.885  -9.406
  206    HA   ASN  25           HA       ASN  25   2.148  -8.463  -8.870
  207    HB2  ASN  25           HB2      ASN  25   2.647 -10.115 -10.823
  208    HB3  ASN  25           HB3      ASN  25   3.136  -8.675 -11.711
  209   HD21  ASN  25          HD22      ASN  25   4.739  -7.230 -10.290
  210   HD22  ASN  25          HD21      ASN  25   6.076  -8.219  -9.651
  211    H    ALA  26           H        ALA  26   0.116  -6.407 -10.282
  212    HA   ALA  26           HA       ALA  26   1.831  -4.174 -10.908
  213    HB1  ALA  26           HB1      ALA  26  -1.063  -4.245  -9.963
  214    HB2  ALA  26           HB2      ALA  26  -0.248  -2.876 -10.751
  215    HB3  ALA  26           HB3      ALA  26  -0.511  -4.379 -11.648
  216    H    SER  27           H        SER  27   1.749  -2.048  -9.604
  217    HA   SER  27           HA       SER  27   2.038  -2.440  -6.661
  218    HB2  SER  27           HB2      SER  27   4.252  -2.626  -7.748
  219    HB3  SER  27           HB3      SER  27   3.998  -1.043  -8.517
  220    HG   SER  27           HG       SER  27   5.143  -0.756  -6.610
  221    H    GLN  28           H        GLN  28   1.509  -0.595  -5.418
  222    HA   GLN  28           HA       GLN  28   0.648   1.910  -6.713
  223    HB2  GLN  28           HB2      GLN  28  -1.227   0.388  -7.077
  224    HB3  GLN  28           HB3      GLN  28  -1.219  -0.097  -5.375
  225    HG2  GLN  28           HG2      GLN  28  -3.076   1.418  -5.975
  226    HG3  GLN  28           HG3      GLN  28  -2.063   2.000  -4.683
  227   HE21  GLN  28          HE22      GLN  28  -2.296   2.309  -8.340
  228   HE22  GLN  28          HE21      GLN  28  -1.881   4.015  -8.256
  229    H    PHE  29           H        PHE  29   0.295   3.636  -5.212
  230    HA   PHE  29           HA       PHE  29   1.381   3.187  -2.497
  231    HB2  PHE  29           HB2      PHE  29   0.873   5.770  -3.964
  232    HB3  PHE  29           HB3      PHE  29   1.630   5.597  -2.382
  233    HD1  PHE  29           HD2      PHE  29   3.627   3.504  -2.572
  234    HD2  PHE  29           HD1      PHE  29   2.448   6.371  -5.594
  235    HE1  PHE  29           HE2      PHE  29   5.818   3.262  -3.666
  236    HE2  PHE  29           HE1      PHE  29   4.661   6.113  -6.677
  237    HZ   PHE  29           HZ       PHE  29   6.349   4.560  -5.719
  238    H    GLU  30           H        GLU  30  -1.711   3.980  -4.096
  239    HA   GLU  30           HA       GLU  30  -3.113   4.660  -1.652
  240    HB2  GLU  30           HB2      GLU  30  -4.064   5.028  -3.911
  241    HB3  GLU  30           HB3      GLU  30  -4.127   3.279  -4.161
  242    HG2  GLU  30           HG2      GLU  30  -5.665   3.245  -2.041
  243    HG3  GLU  30           HG3      GLU  30  -5.761   4.983  -2.247
  244    H    ARG  31           H        ARG  31  -4.220   3.291  -0.239
  245    HA   ARG  31           HA       ARG  31  -3.548   0.370  -0.254
  246    HB2  ARG  31           HB2      ARG  31  -4.806   2.081   1.955
  247    HB3  ARG  31           HB3      ARG  31  -4.449   0.360   2.021
  248    HG2  ARG  31           HG2      ARG  31  -2.588   1.127   3.084
  249    HG3  ARG  31           HG3      ARG  31  -1.982   1.143   1.435
  250    HD2  ARG  31           HD2      ARG  31  -3.180   3.698   1.953
  251    HD3  ARG  31           HD3      ARG  31  -2.167   3.268   3.334
  252    HE   ARG  31           HE       ARG  31  -1.277   3.800   0.550
  253   HH11  ARG  31          HH21      ARG  31  -0.105   2.459   3.634
  254   HH12  ARG  31          HH22      ARG  31   1.551   2.617   3.018
  255   HH21  ARG  31          HH11      ARG  31   0.732   3.942   0.037
  256   HH22  ARG  31          HH12      ARG  31   2.026   3.387   1.154
  257    HA   PRO  32           HA       PRO  32  -7.661   0.753  -2.158
  258    HB2  PRO  32           HB2      PRO  32  -7.450  -2.066  -3.092
  259    HB3  PRO  32           HB3      PRO  32  -7.702  -0.569  -3.985
  260    HG2  PRO  32           HG2      PRO  32  -5.387  -1.833  -4.146
  261    HG3  PRO  32           HG3      PRO  32  -5.431  -0.107  -4.190
  262    HD2  PRO  32           HD2      PRO  32  -4.937  -1.841  -1.737
  263    HD3  PRO  32           HD3      PRO  32  -3.988  -0.435  -2.281
  264    H    SER  33           H        SER  33  -9.431   0.669  -0.935
  265    HA   SER  33           HA       SER  33  -9.650  -1.078   1.340
  266    HB2  SER  33           HB2      SER  33 -11.631   0.216   1.843
  267    HB3  SER  33           HB3      SER  33 -10.347   1.319   1.306
  268    HG   SER  33           HG       SER  33 -12.364   0.190  -0.306
  269    H    GLY  34           H        GLY  34  -9.528  -3.060  -0.045
  270    HA2  GLY  34           HA2      GLY  34 -10.523  -5.068  -0.661
  271    HA3  GLY  34           HA3      GLY  34 -12.107  -4.418  -0.188
  Start of MODEL   10
    1    H1   LYS   1           H1       LYS   1 -13.227   0.801  -5.004
    2    H2   LYS   1           H2       LYS   1 -12.905   1.780  -6.272
    3    H3   LYS   1           H3       LYS   1 -13.008   2.417  -4.745
    4    HA   LYS   1           HA       LYS   1 -10.704   2.253  -5.434
    5    HB2  LYS   1           HB2      LYS   1 -11.777   0.597  -3.163
    6    HB3  LYS   1           HB3      LYS   1 -10.076   0.451  -3.549
    7    HG2  LYS   1           HG2      LYS   1 -11.429   3.095  -2.906
    8    HG3  LYS   1           HG3      LYS   1 -10.538   2.079  -1.769
    9    HD2  LYS   1           HD2      LYS   1  -8.501   2.280  -3.294
   10    HD3  LYS   1           HD3      LYS   1  -9.407   3.470  -4.234
   11    HE2  LYS   1           HE2      LYS   1  -7.947   4.623  -2.720
   12    HE3  LYS   1           HE3      LYS   1  -9.613   4.895  -2.188
   13    HZ1  LYS   1           HZ1      LYS   1  -7.907   4.279  -0.413
   14    HZ2  LYS   1           HZ2      LYS   1  -9.292   3.369  -0.384
   15    HZ3  LYS   1           HZ3      LYS   1  -7.913   2.761  -1.002
   16    H    LEU   2           H        LEU   2  -8.844   0.461  -5.474
   17    HA   LEU   2           HA       LEU   2  -9.299  -0.962  -7.872
   18    HB2  LEU   2           HB2      LEU   2  -6.831  -1.337  -6.182
   19    HB3  LEU   2           HB3      LEU   2  -6.982  -1.477  -7.841
   20    HG   LEU   2           HG       LEU   2  -7.180   0.907  -8.220
   21   HD11  LEU   2          HD11      LEU   2  -6.789   1.183  -5.209
   22   HD12  LEU   2          HD12      LEU   2  -6.288   2.426  -6.356
   23   HD13  LEU   2          HD13      LEU   2  -7.978   2.005  -6.266
   24   HD21  LEU   2          HD21      LEU   2  -5.044  -0.291  -8.332
   25   HD22  LEU   2          HD22      LEU   2  -4.785   1.336  -7.702
   26   HD23  LEU   2          HD23      LEU   2  -4.787  -0.059  -6.593
   27    HA   PRO   3           HA       PRO   3 -10.466  -5.014  -7.136
   28    HB2  PRO   3           HB2      PRO   3  -7.731  -5.926  -8.108
   29    HB3  PRO   3           HB3      PRO   3  -9.324  -6.544  -8.645
   30    HG2  PRO   3           HG2      PRO   3  -8.057  -4.796 -10.176
   31    HG3  PRO   3           HG3      PRO   3  -9.781  -4.434  -9.770
   32    HD2  PRO   3           HD2      PRO   3  -7.267  -3.428  -8.380
   33    HD3  PRO   3           HD3      PRO   3  -8.650  -2.495  -8.981
   34    HA   PRO   4           HA       PRO   4  -8.899  -7.778  -3.863
   35    HB2  PRO   4           HB2      PRO   4  -9.939  -9.974  -5.647
   36    HB3  PRO   4           HB3      PRO   4 -10.258  -9.697  -3.906
   37    HG2  PRO   4           HG2      PRO   4 -12.143  -9.109  -5.772
   38    HG3  PRO   4           HG3      PRO   4 -11.854  -8.001  -4.390
   39    HD2  PRO   4           HD2      PRO   4 -10.823  -7.770  -7.226
   40    HD3  PRO   4           HD3      PRO   4 -11.557  -6.519  -6.174
   41    H    GLY   5           H        GLY   5  -6.922  -8.949  -3.660
   42    HA2  GLY   5           HA2      GLY   5  -5.083 -10.261  -4.692
   43    HA3  GLY   5           HA3      GLY   5  -5.365  -9.370  -6.184
   44    H    TRP   6           H        TRP   6  -5.769  -6.633  -4.841
   45    HA   TRP   6           HA       TRP   6  -2.999  -5.948  -4.397
   46    HB2  TRP   6           HB2      TRP   6  -5.657  -4.596  -3.984
   47    HB3  TRP   6           HB3      TRP   6  -4.105  -3.858  -3.604
   48    HD1  TRP   6           HD1      TRP   6  -6.311  -4.564  -6.573
   49    HE1  TRP   6           HE1      TRP   6  -5.361  -3.389  -8.608
   50    HE3  TRP   6           HE3      TRP   6  -1.774  -3.330  -4.656
   51    HZ2  TRP   6           HZ2      TRP   6  -2.866  -2.065  -9.352
   52    HZ3  TRP   6           HZ3      TRP   6  -0.150  -2.108  -5.998
   53    HH2  TRP   6           HH2      TRP   6  -0.659  -1.442  -8.362
   54    H    GLU   7           H        GLU   7  -1.805  -6.031  -2.619
   55    HA   GLU   7           HA       GLU   7  -2.977  -6.654   0.046
   56    HB2  GLU   7           HB2      GLU   7  -2.148  -8.600  -1.350
   57    HB3  GLU   7           HB3      GLU   7  -0.581  -7.811  -1.440
   58    HG2  GLU   7           HG2      GLU   7  -0.851  -7.940   1.270
   59    HG3  GLU   7           HG3      GLU   7  -1.854  -9.312   0.815
   60    H    LYS   8           H        LYS   8  -1.950  -5.656   1.774
   61    HA   LYS   8           HA       LYS   8  -0.161  -3.470   1.550
   62    HB2  LYS   8           HB2      LYS   8  -1.553  -3.719   3.432
   63    HB3  LYS   8           HB3      LYS   8  -0.968  -5.317   3.834
   64    HG2  LYS   8           HG2      LYS   8   0.776  -2.819   3.956
   65    HG3  LYS   8           HG3      LYS   8  -0.307  -3.262   5.260
   66    HD2  LYS   8           HD2      LYS   8   2.200  -4.741   4.407
   67    HD3  LYS   8           HD3      LYS   8   1.830  -3.946   5.916
   68    HE2  LYS   8           HE2      LYS   8   1.294  -5.969   6.720
   69    HE3  LYS   8           HE3      LYS   8  -0.220  -5.766   5.840
   70    HZ1  LYS   8           HZ1      LYS   8   2.184  -7.263   4.981
   71    HZ2  LYS   8           HZ2      LYS   8   0.656  -7.846   5.171
   72    HZ3  LYS   8           HZ3      LYS   8   1.037  -6.851   3.906
   73    H    ARG   9           H        ARG   9   1.948  -3.301   1.357
   74    HA   ARG   9           HA       ARG   9   3.753  -5.396   2.383
   75    HB2  ARG   9           HB2      ARG   9   3.877  -4.650  -0.575
   76    HB3  ARG   9           HB3      ARG   9   5.142  -5.515   0.310
   77    HG2  ARG   9           HG2      ARG   9   3.261  -7.189   0.978
   78    HG3  ARG   9           HG3      ARG   9   2.339  -6.472  -0.331
   79    HD2  ARG   9           HD2      ARG   9   4.099  -7.213  -1.915
   80    HD3  ARG   9           HD3      ARG   9   5.057  -7.834  -0.552
   81    HE   ARG   9           HE       ARG   9   2.487  -8.961  -0.288
   82   HH11  ARG   9          HH11      ARG   9   5.237  -9.431  -2.380
   83   HH12  ARG   9          HH12      ARG   9   4.785 -11.076  -2.766
   84   HH21  ARG   9          HH21      ARG   9   1.745 -10.834  -1.059
   85   HH22  ARG   9          HH22      ARG   9   2.812 -11.906  -1.956
   86    H    MET  10           H        MET  10   6.135  -4.670   2.116
   87    HA   MET  10           HA       MET  10   6.295  -1.766   2.789
   88    HB2  MET  10           HB2      MET  10   6.542  -3.270   4.755
   89    HB3  MET  10           HB3      MET  10   7.903  -4.063   3.947
   90    HG2  MET  10           HG2      MET  10   9.048  -1.798   3.850
   91    HG3  MET  10           HG3      MET  10   7.722  -1.136   4.789
   92    HE1  MET  10           HE1      MET  10   9.883  -4.528   5.074
   93    HE2  MET  10           HE2      MET  10  10.991  -3.176   4.731
   94    HE3  MET  10           HE3      MET  10  11.028  -3.980   6.316
   95    H    PHE  11           H        PHE  11   7.693  -0.559   1.649
   96    HA   PHE  11           HA       PHE  11   9.067  -1.745  -0.560
   97    HB2  PHE  11           HB2      PHE  11   7.872   0.548  -0.352
   98    HB3  PHE  11           HB3      PHE  11   9.386   1.129   0.304
   99    HD1  PHE  11           HD2      PHE  11  11.558   0.351  -1.227
  100    HD2  PHE  11           HD1      PHE  11   7.485   0.721  -2.623
  101    HE1  PHE  11           HE2      PHE  11  12.364   0.444  -3.560
  102    HE2  PHE  11           HE1      PHE  11   8.310   0.844  -4.959
  103    HZ   PHE  11           HZ       PHE  11  10.746   0.692  -5.434
  104    H    ARG  12           H        ARG  12  10.459  -3.218   0.503
  105    HA   ARG  12           HA       ARG  12  12.635  -2.655   2.127
  106    HB2  ARG  12           HB2      ARG  12  13.790  -4.502   1.200
  107    HB3  ARG  12           HB3      ARG  12  12.094  -4.913   1.334
  108    HG2  ARG  12           HG2      ARG  12  13.494  -4.148  -1.288
  109    HG3  ARG  12           HG3      ARG  12  13.281  -5.774  -0.677
  110    HD2  ARG  12           HD2      ARG  12  11.555  -5.669  -2.149
  111    HD3  ARG  12           HD3      ARG  12  10.742  -5.273  -0.629
  112    HE   ARG  12           HE       ARG  12  11.645  -2.894  -2.032
  113   HH11  ARG  12          HH11      ARG  12   9.037  -5.261  -1.962
  114   HH12  ARG  12          HH12      ARG  12   7.905  -4.179  -2.760
  115   HH21  ARG  12          HH21      ARG  12  10.082  -1.586  -3.197
  116   HH22  ARG  12          HH22      ARG  12   8.510  -2.275  -3.473
  117    H    SER  13           H        SER  13  14.590  -1.830   1.962
  118    HA   SER  13           HA       SER  13  16.406  -0.638   1.259
  119    HB2  SER  13           HB2      SER  13  15.081   0.475  -1.200
  120    HB3  SER  13           HB3      SER  13  16.800   0.296  -0.826
  121    HG   SER  13           HG       SER  13  14.891  -1.661  -1.485
  122    H    ASN  14           H        ASN  14  13.134   0.498   1.703
  123    HA   ASN  14           HA       ASN  14  14.375   2.804   3.048
  124    HB2  ASN  14           HB2      ASN  14  12.886   4.475   2.108
  125    HB3  ASN  14           HB3      ASN  14  13.893   3.746   0.867
  126   HD21  ASN  14          HD22      ASN  14  12.783   3.262  -1.032
  127   HD22  ASN  14          HD21      ASN  14  11.061   2.935  -1.058
  128    H    GLY  15           H        GLY  15  11.480   0.753   2.693
  129    HA2  GLY  15           HA2      GLY  15  10.469  -0.190   4.599
  130    HA3  GLY  15           HA3      GLY  15  10.951   1.171   5.593
  131    H    THR  16           H        THR  16   9.668   2.418   2.700
  132    HA   THR  16           HA       THR  16   7.310   3.472   3.884
  133    HB   THR  16           HB       THR  16   7.814   3.020   0.912
  134    HG1  THR  16           HG1      THR  16   9.535   4.093   1.616
  135   HG21  THR  16          HG21      THR  16   5.525   3.784   1.405
  136   HG22  THR  16          HG22      THR  16   6.166   5.100   2.417
  137   HG23  THR  16          HG23      THR  16   6.467   5.088   0.666
  138    H    VAL  17           H        VAL  17   5.456   2.372   4.434
  139    HA   VAL  17           HA       VAL  17   4.869  -0.215   3.148
  140    HB   VAL  17           HB       VAL  17   3.458   1.364   5.290
  141   HG11  VAL  17          HG11      VAL  17   1.867  -0.546   5.515
  142   HG12  VAL  17          HG12      VAL  17   1.622   0.362   4.025
  143   HG13  VAL  17          HG13      VAL  17   2.471  -1.200   3.977
  144   HG21  VAL  17          HG21      VAL  17   5.483  -0.039   5.852
  145   HG22  VAL  17          HG22      VAL  17   4.008  -0.652   6.618
  146   HG23  VAL  17          HG23      VAL  17   4.643  -1.453   5.165
  147    H    TYR  18           H        TYR  18   3.344  -0.658   1.758
  148    HA   TYR  18           HA       TYR  18   1.739   1.372   0.387
  149    HB2  TYR  18           HB2      TYR  18   2.888   1.372  -1.638
  150    HB3  TYR  18           HB3      TYR  18   4.146   1.598  -0.455
  151    HD1  TYR  18           HD1      TYR  18   5.494  -0.619   0.238
  152    HD2  TYR  18           HD2      TYR  18   3.097  -0.194  -3.312
  153    HE1  TYR  18           HE1      TYR  18   6.774  -2.477  -0.873
  154    HE2  TYR  18           HE2      TYR  18   4.306  -2.061  -4.368
  155    HH   TYR  18           HH       TYR  18   5.952  -3.514  -4.194
  156    H    TYR  19           H        TYR  19   1.024  -0.018  -1.925
  157    HA   TYR  19           HA       TYR  19   0.294  -2.725  -0.962
  158    HB2  TYR  19           HB2      TYR  19  -1.433  -0.547  -1.977
  159    HB3  TYR  19           HB3      TYR  19  -1.724  -2.120  -2.663
  160    HD1  TYR  19           HD2      TYR  19  -1.150  -0.641   0.814
  161    HD2  TYR  19           HD1      TYR  19  -3.218  -3.529  -1.631
  162    HE1  TYR  19           HE2      TYR  19  -2.360  -1.480   2.789
  163    HE2  TYR  19           HE1      TYR  19  -4.558  -4.244   0.310
  164    HH   TYR  19           HH       TYR  19  -4.992  -3.870   2.555
  165    H    PHE  20           H        PHE  20   0.163  -4.292  -2.322
  166    HA   PHE  20           HA       PHE  20   1.565  -4.092  -4.963
  167    HB2  PHE  20           HB2      PHE  20   3.159  -4.729  -3.279
  168    HB3  PHE  20           HB3      PHE  20   2.030  -5.867  -2.543
  169    HD1  PHE  20           HD2      PHE  20   4.075  -5.235  -5.584
  170    HD2  PHE  20           HD1      PHE  20   1.894  -8.172  -3.282
  171    HE1  PHE  20           HE2      PHE  20   5.048  -7.041  -6.967
  172    HE2  PHE  20           HE1      PHE  20   2.889  -9.968  -4.672
  173    HZ   PHE  20           HZ       PHE  20   4.451  -9.416  -6.520
  174    H    ASN  21           H        ASN  21   0.522  -5.230  -6.579
  175    HA   ASN  21           HA       ASN  21  -1.863  -6.794  -5.802
  176    HB2  ASN  21           HB2      ASN  21  -1.869  -5.211  -7.760
  177    HB3  ASN  21           HB3      ASN  21  -0.794  -6.346  -8.577
  178   HD21  ASN  21          HD22      ASN  21  -4.121  -5.625  -7.900
  179   HD22  ASN  21          HD21      ASN  21  -4.718  -7.212  -8.372
  180    H    HIS  22           H        HIS  22  -1.463  -8.720  -4.940
  181    HA   HIS  22           HA       HIS  22   0.920 -10.197  -5.589
  182    HB2  HIS  22           HB2      HIS  22   0.418 -11.456  -3.763
  183    HB3  HIS  22           HB3      HIS  22  -0.426  -9.993  -3.356
  184    HD1  HIS  22           HD1      HIS  22  -1.409 -13.262  -5.181
  185    HD2  HIS  22           HD2      HIS  22  -2.863 -10.396  -2.482
  186    HE1  HIS  22           HE1      HIS  22  -3.756 -14.072  -4.425
  187    H    ILE  23           H        ILE  23  -1.788  -9.871  -7.465
  188    HA   ILE  23           HA       ILE  23  -1.655 -12.638  -8.557
  189    HB   ILE  23           HB       ILE  23  -3.787 -10.503  -8.958
  190   HG12  ILE  23          HG12      ILE  23  -3.789 -12.968  -7.155
  191   HG13  ILE  23          HG13      ILE  23  -3.776 -11.291  -6.616
  192   HG21  ILE  23          HG21      ILE  23  -3.777 -13.454  -9.702
  193   HG22  ILE  23          HG22      ILE  23  -5.098 -12.296  -9.981
  194   HG23  ILE  23          HG23      ILE  23  -3.583 -12.108 -10.847
  195   HD11  ILE  23          HD11      ILE  23  -6.070 -12.736  -7.970
  196   HD12  ILE  23          HD12      ILE  23  -5.995 -12.060  -6.338
  197   HD13  ILE  23          HD13      ILE  23  -6.023 -10.971  -7.737
  198    H    THR  24           H        THR  24  -1.326  -9.167  -9.427
  199    HA   THR  24           HA       THR  24  -0.350  -9.968 -12.139
  200    HB   THR  24           HB       THR  24  -0.771  -7.730 -12.808
  201    HG1  THR  24           HG1      THR  24  -1.679  -6.244 -11.368
  202   HG21  THR  24          HG21      THR  24  -3.176  -8.591 -11.144
  203   HG22  THR  24          HG22      THR  24  -3.184  -7.540 -12.577
  204   HG23  THR  24          HG23      THR  24  -2.758  -9.254 -12.739
  205    H    ASN  25           H        ASN  25   0.898  -8.762  -9.210
  206    HA   ASN  25           HA       ASN  25   2.896  -8.117  -8.498
  207    HB2  ASN  25           HB2      ASN  25   3.724  -9.710 -10.382
  208    HB3  ASN  25           HB3      ASN  25   4.149  -8.230 -11.237
  209   HD21  ASN  25          HD22      ASN  25   5.462  -6.631  -9.690
  210   HD22  ASN  25          HD21      ASN  25   6.832  -7.481  -8.933
  211    H    ALA  26           H        ALA  26   0.802  -6.269 -10.092
  212    HA   ALA  26           HA       ALA  26   2.290  -3.863 -10.577
  213    HB1  ALA  26           HB1      ALA  26  -0.604  -4.213  -9.698
  214    HB2  ALA  26           HB2      ALA  26   0.105  -2.764 -10.438
  215    HB3  ALA  26           HB3      ALA  26  -0.012  -4.261 -11.376
  216    H    SER  27           H        SER  27   2.109  -1.814  -9.214
  217    HA   SER  27           HA       SER  27   2.158  -2.234  -6.275
  218    HB2  SER  27           HB2      SER  27   4.472  -1.318  -8.018
  219    HB3  SER  27           HB3      SER  27   4.360  -0.935  -6.292
  220    HG   SER  27           HG       SER  27   4.130  -3.569  -7.318
  221    H    GLN  28           H        GLN  28   1.332  -0.473  -5.184
  222    HA   GLN  28           HA       GLN  28   1.210   2.204  -6.346
  223    HB2  GLN  28           HB2      GLN  28  -0.549   0.939  -7.537
  224    HB3  GLN  28           HB3      GLN  28  -1.274   0.456  -6.023
  225    HG2  GLN  28           HG2      GLN  28  -1.002   3.383  -6.861
  226    HG3  GLN  28           HG3      GLN  28  -2.322   2.361  -7.437
  227   HE21  GLN  28          HE22      GLN  28  -3.232   0.918  -5.364
  228   HE22  GLN  28          HE21      GLN  28  -3.507   1.875  -3.929
  229    H    PHE  29           H        PHE  29   0.166   3.753  -4.623
  230    HA   PHE  29           HA       PHE  29   1.338   2.875  -2.103
  231    HB2  PHE  29           HB2      PHE  29   0.174   5.541  -2.902
  232    HB3  PHE  29           HB3      PHE  29   1.129   5.209  -1.459
  233    HD1  PHE  29           HD1      PHE  29   3.447   3.758  -2.146
  234    HD2  PHE  29           HD2      PHE  29   1.387   6.689  -4.559
  235    HE1  PHE  29           HE1      PHE  29   5.531   4.188  -3.410
  236    HE2  PHE  29           HE2      PHE  29   3.480   7.110  -5.818
  237    HZ   PHE  29           HZ       PHE  29   5.553   5.862  -5.249
  238    H    GLU  30           H        GLU  30  -2.016   3.966  -2.993
  239    HA   GLU  30           HA       GLU  30  -2.778   3.732  -0.161
  240    HB2  GLU  30           HB2      GLU  30  -3.679   5.247  -2.353
  241    HB3  GLU  30           HB3      GLU  30  -4.996   4.134  -2.055
  242    HG2  GLU  30           HG2      GLU  30  -3.704   5.950   0.036
  243    HG3  GLU  30           HG3      GLU  30  -5.172   6.329  -0.865
  244    H    ARG  31           H        ARG  31  -4.475   2.490   0.574
  245    HA   ARG  31           HA       ARG  31  -4.310  -0.320  -0.243
  246    HB2  ARG  31           HB2      ARG  31  -6.423   0.632   1.652
  247    HB3  ARG  31           HB3      ARG  31  -5.539  -0.845   1.674
  248    HG2  ARG  31           HG2      ARG  31  -3.940  -0.046   3.063
  249    HG3  ARG  31           HG3      ARG  31  -3.743   1.462   2.228
  250    HD2  ARG  31           HD2      ARG  31  -5.834   0.735   4.313
  251    HD3  ARG  31           HD3      ARG  31  -4.519   1.900   4.469
  252    HE   ARG  31           HE       ARG  31  -5.638   3.261   2.680
  253   HH11  ARG  31          HH12      ARG  31  -7.789   0.980   4.366
  254   HH12  ARG  31          HH11      ARG  31  -9.167   1.578   3.427
  255   HH21  ARG  31          HH21      ARG  31  -7.450   4.014   1.754
  256   HH22  ARG  31          HH22      ARG  31  -8.990   3.154   2.007
  257    HA   PRO  32           HA       PRO  32  -8.040   0.121  -2.772
  258    HB2  PRO  32           HB2      PRO  32  -7.647  -2.777  -3.452
  259    HB3  PRO  32           HB3      PRO  32  -7.998  -1.347  -4.423
  260    HG2  PRO  32           HG2      PRO  32  -5.555  -2.322  -4.426
  261    HG3  PRO  32           HG3      PRO  32  -5.756  -0.608  -4.400
  262    HD2  PRO  32           HD2      PRO  32  -5.347  -2.393  -1.952
  263    HD3  PRO  32           HD3      PRO  32  -4.439  -0.911  -2.391
  264    H    SER  33           H        SER  33  -9.935  -1.895  -3.115
  265    HA   SER  33           HA       SER  33 -11.885  -2.497  -2.275
  266    HB2  SER  33           HB2      SER  33 -12.114  -3.698  -0.229
  267    HB3  SER  33           HB3      SER  33 -10.632  -4.193  -1.058
  268    HG   SER  33           HG       SER  33  -9.627  -2.482   0.380
  269    H    GLY  34           H        GLY  34 -10.359  -0.435   0.291
  270    HA2  GLY  34           HA2      GLY  34 -12.323   1.668  -0.079
  271    HA3  GLY  34           HA3      GLY  34 -12.635   0.724   1.383
  Start of MODEL   11
    1    H1   LYS   1           H1       LYS   1 -14.419  -6.468   0.411
    2    H2   LYS   1           H2       LYS   1 -14.424  -5.051   1.215
    3    H3   LYS   1           H3       LYS   1 -14.650  -6.444   2.061
    4    HA   LYS   1           HA       LYS   1 -12.441  -5.459   2.315
    5    HB2  LYS   1           HB2      LYS   1 -11.166  -7.474   2.118
    6    HB3  LYS   1           HB3      LYS   1 -12.779  -7.929   2.653
    7    HG2  LYS   1           HG2      LYS   1 -13.362  -8.813   0.485
    8    HG3  LYS   1           HG3      LYS   1 -11.996  -8.029  -0.290
    9    HD2  LYS   1           HD2      LYS   1 -10.504  -9.518   1.288
   10    HD3  LYS   1           HD3      LYS   1 -11.986 -10.461   1.491
   11    HE2  LYS   1           HE2      LYS   1 -10.834 -11.495  -0.306
   12    HE3  LYS   1           HE3      LYS   1 -12.125 -10.555  -1.068
   13    HZ1  LYS   1           HZ1      LYS   1  -9.274  -9.750  -0.844
   14    HZ2  LYS   1           HZ2      LYS   1 -10.045 -10.201  -2.222
   15    HZ3  LYS   1           HZ3      LYS   1 -10.426  -8.783  -1.483
   16    H    LEU   2           H        LEU   2 -10.163  -5.590   1.216
   17    HA   LEU   2           HA       LEU   2 -10.006  -3.964  -1.017
   18    HB2  LEU   2           HB2      LEU   2  -7.977  -6.131  -0.394
   19    HB3  LEU   2           HB3      LEU   2  -7.694  -4.565  -1.138
   20    HG   LEU   2           HG       LEU   2  -8.370  -5.122   1.780
   21   HD11  LEU   2          HD11      LEU   2  -6.114  -4.258   2.185
   22   HD12  LEU   2          HD12      LEU   2  -6.053  -5.637   1.070
   23   HD13  LEU   2          HD13      LEU   2  -5.884  -3.981   0.443
   24   HD21  LEU   2          HD21      LEU   2  -7.826  -2.433   0.472
   25   HD22  LEU   2          HD22      LEU   2  -9.406  -2.963   1.099
   26   HD23  LEU   2          HD23      LEU   2  -8.045  -2.727   2.201
   27    HA   PRO   3           HA       PRO   3 -11.136  -6.463  -4.483
   28    HB2  PRO   3           HB2      PRO   3  -8.897  -5.226  -6.063
   29    HB3  PRO   3           HB3      PRO   3 -10.634  -5.332  -6.457
   30    HG2  PRO   3           HG2      PRO   3  -9.532  -3.007  -5.564
   31    HG3  PRO   3           HG3      PRO   3 -11.164  -3.525  -5.031
   32    HD2  PRO   3           HD2      PRO   3  -8.541  -3.781  -3.552
   33    HD3  PRO   3           HD3      PRO   3 -10.138  -3.257  -2.963
   34    HA   PRO   4           HA       PRO   4  -8.883 -10.188  -4.737
   35    HB2  PRO   4           HB2      PRO   4  -8.878 -10.037  -7.739
   36    HB3  PRO   4           HB3      PRO   4  -9.327 -11.408  -6.682
   37    HG2  PRO   4           HG2      PRO   4 -11.258  -9.872  -7.813
   38    HG3  PRO   4           HG3      PRO   4 -11.405 -10.397  -6.105
   39    HD2  PRO   4           HD2      PRO   4 -10.521  -7.719  -7.182
   40    HD3  PRO   4           HD3      PRO   4 -11.590  -8.092  -5.796
   41    H    GLY   5           H        GLY   5  -6.844 -10.542  -4.278
   42    HA2  GLY   5           HA2      GLY   5  -4.611 -10.946  -4.731
   43    HA3  GLY   5           HA3      GLY   5  -4.675  -9.874  -6.127
   44    H    TRP   6           H        TRP   6  -5.917  -7.750  -3.933
   45    HA   TRP   6           HA       TRP   6  -3.333  -6.494  -3.715
   46    HB2  TRP   6           HB2      TRP   6  -6.032  -5.709  -2.602
   47    HB3  TRP   6           HB3      TRP   6  -4.551  -4.810  -2.326
   48    HD1  TRP   6           HD1      TRP   6  -7.251  -5.201  -4.731
   49    HE1  TRP   6           HE1      TRP   6  -6.876  -3.682  -6.795
   50    HE3  TRP   6           HE3      TRP   6  -2.371  -4.060  -3.941
   51    HZ2  TRP   6           HZ2      TRP   6  -4.616  -2.319  -8.032
   52    HZ3  TRP   6           HZ3      TRP   6  -1.114  -2.652  -5.554
   53    HH2  TRP   6           HH2      TRP   6  -2.222  -1.810  -7.616
   54    H    GLU   7           H        GLU   7  -1.787  -6.654  -2.296
   55    HA   GLU   7           HA       GLU   7  -2.415  -7.139   0.555
   56    HB2  GLU   7           HB2      GLU   7  -1.566  -9.181  -0.999
   57    HB3  GLU   7           HB3      GLU   7   0.001  -8.472  -0.642
   58    HG2  GLU   7           HG2      GLU   7  -2.088  -9.304   1.439
   59    HG3  GLU   7           HG3      GLU   7  -0.768 -10.334   0.883
   60    H    LYS   8           H        LYS   8  -0.830  -6.302   1.975
   61    HA   LYS   8           HA       LYS   8   0.339  -3.750   1.227
   62    HB2  LYS   8           HB2      LYS   8  -0.610  -3.780   3.305
   63    HB3  LYS   8           HB3      LYS   8  -0.146  -5.401   3.696
   64    HG2  LYS   8           HG2      LYS   8   1.787  -3.067   3.659
   65    HG3  LYS   8           HG3      LYS   8   0.851  -3.551   5.061
   66    HD2  LYS   8           HD2      LYS   8   3.178  -5.033   3.808
   67    HD3  LYS   8           HD3      LYS   8   3.007  -4.359   5.400
   68    HE2  LYS   8           HE2      LYS   8   2.863  -6.620   5.777
   69    HE3  LYS   8           HE3      LYS   8   1.175  -6.108   5.853
   70    HZ1  LYS   8           HZ1      LYS   8   2.198  -7.070   3.255
   71    HZ2  LYS   8           HZ2      LYS   8   1.903  -8.195   4.415
   72    HZ3  LYS   8           HZ3      LYS   8   0.723  -7.255   3.846
   73    H    ARG   9           H        ARG   9   2.459  -3.192   0.999
   74    HA   ARG   9           HA       ARG   9   4.591  -5.225   1.407
   75    HB2  ARG   9           HB2      ARG   9   4.149  -3.654  -1.173
   76    HB3  ARG   9           HB3      ARG   9   5.653  -4.491  -0.787
   77    HG2  ARG   9           HG2      ARG   9   2.935  -5.791  -1.155
   78    HG3  ARG   9           HG3      ARG   9   4.267  -5.775  -2.310
   79    HD2  ARG   9           HD2      ARG   9   5.249  -7.546  -1.406
   80    HD3  ARG   9           HD3      ARG   9   5.250  -6.842   0.195
   81    HE   ARG   9           HE       ARG   9   2.978  -7.669   0.569
   82   HH11  ARG   9          HH11      ARG   9   4.520  -9.144  -2.227
   83   HH12  ARG   9          HH12      ARG   9   3.647 -10.644  -2.042
   84   HH21  ARG   9          HH21      ARG   9   1.924  -9.599   0.790
   85   HH22  ARG   9          HH22      ARG   9   2.142 -10.875  -0.394
   86    H    MET  10           H        MET  10   6.824  -4.186   1.282
   87    HA   MET  10           HA       MET  10   6.748  -1.429   2.375
   88    HB2  MET  10           HB2      MET  10   6.603  -3.066   4.240
   89    HB3  MET  10           HB3      MET  10   8.128  -3.792   3.699
   90    HG2  MET  10           HG2      MET  10   9.253  -1.597   4.012
   91    HG3  MET  10           HG3      MET  10   7.739  -0.896   4.571
   92    HE1  MET  10           HE1      MET  10   6.367  -2.528   6.600
   93    HE2  MET  10           HE2      MET  10   7.254  -2.218   8.111
   94    HE3  MET  10           HE3      MET  10   6.955  -0.887   6.973
   95    H    PHE  11           H        PHE  11   8.256  -0.151   1.597
   96    HA   PHE  11           HA       PHE  11  10.130  -1.019  -0.367
   97    HB2  PHE  11           HB2      PHE  11   8.847   1.135  -0.260
   98    HB3  PHE  11           HB3      PHE  11   9.859   1.626   1.080
   99    HD1  PHE  11           HD2      PHE  11  11.989  -0.096  -1.288
  100    HD2  PHE  11           HD1      PHE  11   9.849   3.608  -0.640
  101    HE1  PHE  11           HE2      PHE  11  13.470   1.050  -2.881
  102    HE2  PHE  11           HE1      PHE  11  11.368   4.746  -2.230
  103    HZ   PHE  11           HZ       PHE  11  13.184   3.472  -3.349
  104    H    ARG  12           H        ARG  12  11.466  -2.520   0.617
  105    HA   ARG  12           HA       ARG  12  12.952  -2.377   2.896
  106    HB2  ARG  12           HB2      ARG  12  14.704  -3.799   1.655
  107    HB3  ARG  12           HB3      ARG  12  13.065  -4.360   1.856
  108    HG2  ARG  12           HG2      ARG  12  13.525  -5.066  -0.243
  109    HG3  ARG  12           HG3      ARG  12  12.607  -3.619  -0.576
  110    HD2  ARG  12           HD2      ARG  12  15.636  -3.945  -0.727
  111    HD3  ARG  12           HD3      ARG  12  14.508  -3.895  -2.095
  112    HE   ARG  12           HE       ARG  12  14.288  -1.538  -0.433
  113   HH11  ARG  12          HH11      ARG  12  16.305  -2.744  -3.024
  114   HH12  ARG  12          HH12      ARG  12  16.996  -1.168  -3.318
  115   HH21  ARG  12          HH21      ARG  12  15.187   0.263  -0.688
  116   HH22  ARG  12          HH22      ARG  12  16.326   0.602  -1.992
  117    H    SER  13           H        SER  13  15.041  -1.866   3.539
  118    HA   SER  13           HA       SER  13  16.676  -0.460   4.026
  119    HB2  SER  13           HB2      SER  13  17.559  -0.968   1.771
  120    HB3  SER  13           HB3      SER  13  16.724   0.474   1.148
  121    HG   SER  13           HG       SER  13  17.845   1.564   2.983
  122    H    ASN  14           H        ASN  14  13.622   0.774   3.353
  123    HA   ASN  14           HA       ASN  14  14.405   3.090   4.996
  124    HB2  ASN  14           HB2      ASN  14  13.160   4.719   3.687
  125    HB3  ASN  14           HB3      ASN  14  14.494   4.041   2.767
  126   HD21  ASN  14          HD22      ASN  14  14.026   3.252   0.728
  127   HD22  ASN  14          HD21      ASN  14  12.391   2.984   0.162
  128    H    GLY  15           H        GLY  15  11.727   1.030   3.774
  129    HA2  GLY  15           HA2      GLY  15  10.322  -0.029   5.347
  130    HA3  GLY  15           HA3      GLY  15  10.507   1.304   6.475
  131    H    THR  16           H        THR  16   9.941   2.563   3.332
  132    HA   THR  16           HA       THR  16   7.405   3.630   4.060
  133    HB   THR  16           HB       THR  16   8.447   3.334   1.217
  134    HG1  THR  16           HG1      THR  16  10.041   4.333   2.346
  135   HG21  THR  16          HG21      THR  16   6.115   4.070   1.366
  136   HG22  THR  16          HG22      THR  16   6.561   5.310   2.563
  137   HG23  THR  16          HG23      THR  16   7.156   5.434   0.897
  138    H    VAL  17           H        VAL  17   5.510   2.524   4.250
  139    HA   VAL  17           HA       VAL  17   5.169  -0.020   2.878
  140    HB   VAL  17           HB       VAL  17   3.375   1.605   4.693
  141   HG11  VAL  17          HG11      VAL  17   1.798   0.440   3.240
  142   HG12  VAL  17          HG12      VAL  17   2.715  -1.066   3.411
  143   HG13  VAL  17          HG13      VAL  17   1.855  -0.377   4.802
  144   HG21  VAL  17          HG21      VAL  17   4.714  -1.126   4.976
  145   HG22  VAL  17          HG22      VAL  17   5.317   0.385   5.700
  146   HG23  VAL  17          HG23      VAL  17   3.772  -0.295   6.234
  147    H    TYR  18           H        TYR  18   3.842  -0.562   1.300
  148    HA   TYR  18           HA       TYR  18   2.150   1.319  -0.177
  149    HB2  TYR  18           HB2      TYR  18   3.216   1.000  -2.286
  150    HB3  TYR  18           HB3      TYR  18   4.402   1.608  -1.167
  151    HD1  TYR  18           HD1      TYR  18   6.211   0.070  -0.288
  152    HD2  TYR  18           HD2      TYR  18   3.508  -1.078  -3.453
  153    HE1  TYR  18           HE1      TYR  18   7.806  -1.719  -1.049
  154    HE2  TYR  18           HE2      TYR  18   5.083  -2.850  -4.163
  155    HH   TYR  18           HH       TYR  18   7.154  -3.778  -3.849
  156    H    TYR  19           H        TYR  19   1.403  -0.322  -2.327
  157    HA   TYR  19           HA       TYR  19   0.767  -2.973  -1.116
  158    HB2  TYR  19           HB2      TYR  19  -1.128  -0.860  -2.087
  159    HB3  TYR  19           HB3      TYR  19  -1.491  -2.519  -2.479
  160    HD1  TYR  19           HD1      TYR  19  -0.638  -0.376   0.478
  161    HD2  TYR  19           HD2      TYR  19  -2.528  -3.972  -0.938
  162    HE1  TYR  19           HE1      TYR  19  -1.789  -0.647   2.684
  163    HE2  TYR  19           HE2      TYR  19  -3.603  -4.287   1.266
  164    HH   TYR  19           HH       TYR  19  -3.922  -3.411   3.366
  165    H    PHE  20           H        PHE  20   0.224  -4.614  -2.523
  166    HA   PHE  20           HA       PHE  20   1.096  -4.367  -5.361
  167    HB2  PHE  20           HB2      PHE  20   2.963  -5.077  -4.047
  168    HB3  PHE  20           HB3      PHE  20   1.999  -6.325  -3.228
  169    HD1  PHE  20           HD1      PHE  20   3.505  -5.296  -6.455
  170    HD2  PHE  20           HD2      PHE  20   1.752  -8.558  -4.221
  171    HE1  PHE  20           HE1      PHE  20   4.277  -6.901  -8.175
  172    HE2  PHE  20           HE2      PHE  20   2.606 -10.152  -5.905
  173    HZ   PHE  20           HZ       PHE  20   3.838  -9.341  -7.895
  174    H    ASN  21           H        ASN  21  -0.035  -5.663  -6.768
  175    HA   ASN  21           HA       ASN  21  -2.326  -7.182  -5.651
  176    HB2  ASN  21           HB2      ASN  21  -2.797  -5.330  -7.292
  177    HB3  ASN  21           HB3      ASN  21  -1.860  -6.216  -8.475
  178   HD21  ASN  21          HD22      ASN  21  -4.899  -6.086  -6.662
  179   HD22  ASN  21          HD21      ASN  21  -5.587  -7.554  -7.331
  180    H    HIS  22           H        HIS  22  -1.623  -9.193  -5.202
  181    HA   HIS  22           HA       HIS  22   0.513 -10.429  -6.664
  182    HB2  HIS  22           HB2      HIS  22   0.569 -11.923  -4.923
  183    HB3  HIS  22           HB3      HIS  22  -0.091 -10.514  -4.149
  184    HD1  HIS  22           HD1      HIS  22  -1.592 -13.632  -5.864
  185    HD2  HIS  22           HD2      HIS  22  -2.180 -11.009  -2.629
  186    HE1  HIS  22           HE1      HIS  22  -3.628 -14.536  -4.526
  187    H    ILE  23           H        ILE  23  -2.521 -10.099  -7.825
  188    HA   ILE  23           HA       ILE  23  -2.533 -12.784  -9.158
  189    HB   ILE  23           HB       ILE  23  -4.751 -10.756  -8.701
  190   HG12  ILE  23          HG12      ILE  23  -4.335 -13.645  -7.784
  191   HG13  ILE  23          HG13      ILE  23  -4.185 -12.210  -6.777
  192   HG21  ILE  23          HG21      ILE  23  -5.010 -11.682 -10.979
  193   HG22  ILE  23          HG22      ILE  23  -4.856 -13.332 -10.337
  194   HG23  ILE  23          HG23      ILE  23  -6.252 -12.311  -9.919
  195   HD11  ILE  23          HD11      ILE  23  -6.288 -13.138  -6.250
  196   HD12  ILE  23          HD12      ILE  23  -6.640 -11.725  -7.269
  197   HD13  ILE  23          HD13      ILE  23  -6.728 -13.365  -7.949
  198    H    THR  24           H        THR  24  -2.368  -9.292  -9.669
  199    HA   THR  24           HA       THR  24  -2.080  -9.692 -12.629
  200    HB   THR  24           HB       THR  24  -2.454  -7.262 -12.758
  201    HG1  THR  24           HG1      THR  24  -3.011  -7.428 -10.003
  202   HG21  THR  24          HG21      THR  24  -4.605  -8.599 -11.049
  203   HG22  THR  24          HG22      THR  24  -4.796  -7.149 -12.050
  204   HG23  THR  24          HG23      THR  24  -4.468  -8.717 -12.819
  205    H    ASN  25           H        ASN  25  -0.206  -8.942  -9.846
  206    HA   ASN  25           HA       ASN  25   1.860  -8.330  -9.442
  207    HB2  ASN  25           HB2      ASN  25   2.320  -9.833 -11.533
  208    HB3  ASN  25           HB3      ASN  25   2.665  -8.307 -12.346
  209   HD21  ASN  25          HD22      ASN  25   4.213  -6.844 -10.855
  210   HD22  ASN  25          HD21      ASN  25   5.650  -7.762 -10.340
  211    H    ALA  26           H        ALA  26  -0.439  -6.365 -10.406
  212    HA   ALA  26           HA       ALA  26   1.056  -3.960 -11.055
  213    HB1  ALA  26           HB1      ALA  26  -1.702  -4.305  -9.793
  214    HB2  ALA  26           HB2      ALA  26  -1.060  -2.837 -10.547
  215    HB3  ALA  26           HB3      ALA  26  -1.374  -4.273 -11.541
  216    H    SER  27           H        SER  27   1.169  -2.056  -9.491
  217    HA   SER  27           HA       SER  27   0.957  -2.699  -6.654
  218    HB2  SER  27           HB2      SER  27   3.515  -2.799  -7.841
  219    HB3  SER  27           HB3      SER  27   3.429  -1.199  -7.089
  220    HG   SER  27           HG       SER  27   2.513  -2.485  -5.186
  221    H    GLN  28           H        GLN  28   0.823  -0.757  -5.335
  222    HA   GLN  28           HA       GLN  28   0.699   1.865  -6.673
  223    HB2  GLN  28           HB2      GLN  28  -1.668   0.454  -5.358
  224    HB3  GLN  28           HB3      GLN  28  -1.545   2.210  -5.404
  225    HG2  GLN  28           HG2      GLN  28  -1.422   2.179  -7.870
  226    HG3  GLN  28           HG3      GLN  28  -1.576   0.421  -7.863
  227   HE21  GLN  28          HE22      GLN  28  -3.314   3.496  -7.300
  228   HE22  GLN  28          HE21      GLN  28  -4.904   2.701  -7.300
  229    H    PHE  29           H        PHE  29   0.771   3.603  -5.101
  230    HA   PHE  29           HA       PHE  29   1.794   2.757  -2.411
  231    HB2  PHE  29           HB2      PHE  29   2.265   5.190  -4.104
  232    HB3  PHE  29           HB3      PHE  29   2.256   5.346  -2.353
  233    HD1  PHE  29           HD2      PHE  29   3.655   2.787  -4.798
  234    HD2  PHE  29           HD1      PHE  29   4.371   5.306  -1.364
  235    HE1  PHE  29           HE2      PHE  29   5.948   1.885  -4.610
  236    HE2  PHE  29           HE1      PHE  29   6.674   4.403  -1.201
  237    HZ   PHE  29           HZ       PHE  29   7.462   2.685  -2.811
  238    H    GLU  30           H        GLU  30  -0.829   4.107  -4.153
  239    HA   GLU  30           HA       GLU  30  -2.431   5.065  -1.959
  240    HB2  GLU  30           HB2      GLU  30  -3.545   3.899  -4.517
  241    HB3  GLU  30           HB3      GLU  30  -4.136   5.230  -3.541
  242    HG2  GLU  30           HG2      GLU  30  -3.338   6.364  -5.379
  243    HG3  GLU  30           HG3      GLU  30  -1.925   6.461  -4.336
  244    H    ARG  31           H        ARG  31  -3.701   3.793  -0.522
  245    HA   ARG  31           HA       ARG  31  -3.426   0.860  -0.745
  246    HB2  ARG  31           HB2      ARG  31  -4.822   2.487   1.429
  247    HB3  ARG  31           HB3      ARG  31  -4.519   0.749   1.411
  248    HG2  ARG  31           HG2      ARG  31  -2.796   1.405   2.734
  249    HG3  ARG  31           HG3      ARG  31  -2.005   1.389   1.163
  250    HD2  ARG  31           HD2      ARG  31  -3.075   4.024   1.555
  251    HD3  ARG  31           HD3      ARG  31  -2.324   3.538   3.072
  252    HE   ARG  31           HE       ARG  31  -0.980   3.919   0.437
  253   HH11  ARG  31          HH11      ARG  31  -0.412   2.831   3.749
  254   HH12  ARG  31          HH12      ARG  31   1.321   2.938   3.500
  255   HH21  ARG  31          HH21      ARG  31   1.031   3.982   0.240
  256   HH22  ARG  31          HH22      ARG  31   2.171   3.435   1.477
  257    HA   PRO  32           HA       PRO  32  -7.536   0.670  -2.681
  258    HB2  PRO  32           HB2      PRO  32  -7.761  -2.129  -1.805
  259    HB3  PRO  32           HB3      PRO  32  -7.698  -1.468  -3.457
  260    HG2  PRO  32           HG2      PRO  32  -5.648  -2.903  -2.221
  261    HG3  PRO  32           HG3      PRO  32  -5.430  -1.813  -3.600
  262    HD2  PRO  32           HD2      PRO  32  -4.809  -1.350  -0.708
  263    HD3  PRO  32           HD3      PRO  32  -4.042  -0.653  -2.169
  264    H    SER  33           H        SER  33  -9.879  -0.071  -1.857
  265    HA   SER  33           HA       SER  33 -10.209  -0.767   0.856
  266    HB2  SER  33           HB2      SER  33 -10.766   2.109   0.028
  267    HB3  SER  33           HB3      SER  33 -11.597   1.319   1.388
  268    HG   SER  33           HG       SER  33  -8.798   1.112   1.230
  269    H    GLY  34           H        GLY  34 -12.304  -1.360   1.210
  270    HA2  GLY  34           HA2      GLY  34 -14.730  -1.079   0.050
  271    HA3  GLY  34           HA3      GLY  34 -13.883  -2.146  -1.086
  Start of MODEL   12
    1    H1   LYS   1           H1       LYS   1 -12.493   2.997  -3.573
    2    H2   LYS   1           H2       LYS   1 -12.439   1.452  -4.105
    3    H3   LYS   1           H3       LYS   1 -12.360   2.677  -5.200
    4    HA   LYS   1           HA       LYS   1 -10.235   3.390  -4.324
    5    HB2  LYS   1           HB2      LYS   1 -10.555   0.962  -2.517
    6    HB3  LYS   1           HB3      LYS   1  -9.048   1.849  -2.778
    7    HG2  LYS   1           HG2      LYS   1  -9.882   3.824  -1.751
    8    HG3  LYS   1           HG3      LYS   1 -11.528   3.189  -1.656
    9    HD2  LYS   1           HD2      LYS   1 -11.090   1.783   0.090
   10    HD3  LYS   1           HD3      LYS   1  -9.409   1.506  -0.344
   11    HE2  LYS   1           HE2      LYS   1 -10.346   4.168   0.768
   12    HE3  LYS   1           HE3      LYS   1  -9.882   2.804   1.802
   13    HZ1  LYS   1           HZ1      LYS   1  -8.107   4.088  -0.220
   14    HZ2  LYS   1           HZ2      LYS   1  -7.959   4.228   1.401
   15    HZ3  LYS   1           HZ3      LYS   1  -7.707   2.776   0.657
   16    H    LEU   2           H        LEU   2  -9.697  -0.078  -4.073
   17    HA   LEU   2           HA       LEU   2  -9.535  -0.492  -6.872
   18    HB2  LEU   2           HB2      LEU   2  -6.910  -1.017  -5.461
   19    HB3  LEU   2           HB3      LEU   2  -7.257  -1.117  -7.091
   20    HG   LEU   2           HG       LEU   2  -7.483   1.339  -7.315
   21   HD11  LEU   2          HD11      LEU   2  -6.573   2.842  -5.801
   22   HD12  LEU   2          HD12      LEU   2  -7.436   1.792  -4.674
   23   HD13  LEU   2          HD13      LEU   2  -5.697   1.618  -4.890
   24   HD21  LEU   2          HD21      LEU   2  -4.867   0.000  -6.470
   25   HD22  LEU   2          HD22      LEU   2  -5.569   0.041  -8.102
   26   HD23  LEU   2          HD23      LEU   2  -4.976   1.539  -7.375
   27    HA   PRO   3           HA       PRO   3 -10.793  -4.532  -6.144
   28    HB2  PRO   3           HB2      PRO   3  -8.156  -5.461  -7.357
   29    HB3  PRO   3           HB3      PRO   3  -9.790  -6.069  -7.778
   30    HG2  PRO   3           HG2      PRO   3  -8.669  -4.304  -9.388
   31    HG3  PRO   3           HG3      PRO   3 -10.335  -3.918  -8.803
   32    HD2  PRO   3           HD2      PRO   3  -7.680  -3.006  -7.622
   33    HD3  PRO   3           HD3      PRO   3  -9.067  -2.013  -8.090
   34    HA   PRO   4           HA       PRO   4  -8.963  -7.382  -3.096
   35    HB2  PRO   4           HB2      PRO   4 -10.088  -9.767  -3.892
   36    HB3  PRO   4           HB3      PRO   4 -10.991  -8.507  -2.992
   37    HG2  PRO   4           HG2      PRO   4 -10.949  -8.994  -5.983
   38    HG3  PRO   4           HG3      PRO   4 -12.371  -8.726  -4.923
   39    HD2  PRO   4           HD2      PRO   4 -11.320  -6.720  -6.379
   40    HD3  PRO   4           HD3      PRO   4 -11.892  -6.416  -4.718
   41    H    GLY   5           H        GLY   5  -7.072  -8.632  -3.130
   42    HA2  GLY   5           HA2      GLY   5  -5.408 -10.004  -4.391
   43    HA3  GLY   5           HA3      GLY   5  -5.815  -9.052  -5.812
   44    H    TRP   6           H        TRP   6  -6.010  -6.367  -4.294
   45    HA   TRP   6           HA       TRP   6  -3.164  -5.795  -4.121
   46    HB2  TRP   6           HB2      TRP   6  -5.710  -4.281  -3.482
   47    HB3  TRP   6           HB3      TRP   6  -4.092  -3.627  -3.271
   48    HD1  TRP   6           HD1      TRP   6  -6.620  -4.185  -5.976
   49    HE1  TRP   6           HE1      TRP   6  -5.787  -3.037  -8.104
   50    HE3  TRP   6           HE3      TRP   6  -1.859  -3.242  -4.509
   51    HZ2  TRP   6           HZ2      TRP   6  -3.293  -1.920  -9.098
   52    HZ3  TRP   6           HZ3      TRP   6  -0.297  -2.132  -5.994
   53    HH2  TRP   6           HH2      TRP   6  -0.963  -1.455  -8.323
   54    H    GLU   7           H        GLU   7  -1.856  -6.033  -2.367
   55    HA   GLU   7           HA       GLU   7  -3.046  -6.176   0.362
   56    HB2  GLU   7           HB2      GLU   7  -2.441  -8.426  -0.975
   57    HB3  GLU   7           HB3      GLU   7  -0.812  -8.048  -0.440
   58    HG2  GLU   7           HG2      GLU   7  -3.268  -8.369   1.356
   59    HG3  GLU   7           HG3      GLU   7  -2.099  -9.640   1.009
   60    H    LYS   8           H        LYS   8  -1.575  -5.628   2.044
   61    HA   LYS   8           HA       LYS   8   0.178  -3.419   1.519
   62    HB2  LYS   8           HB2      LYS   8  -0.914  -3.264   3.514
   63    HB3  LYS   8           HB3      LYS   8  -0.859  -4.944   3.880
   64    HG2  LYS   8           HG2      LYS   8   1.812  -3.598   4.014
   65    HG3  LYS   8           HG3      LYS   8   0.592  -2.938   5.069
   66    HD2  LYS   8           HD2      LYS   8   1.895  -4.612   6.226
   67    HD3  LYS   8           HD3      LYS   8   0.195  -5.048   6.183
   68    HE2  LYS   8           HE2      LYS   8   2.141  -6.183   4.154
   69    HE3  LYS   8           HE3      LYS   8   2.087  -6.843   5.779
   70    HZ1  LYS   8           HZ1      LYS   8  -0.117  -7.593   5.468
   71    HZ2  LYS   8           HZ2      LYS   8  -0.391  -6.716   4.112
   72    HZ3  LYS   8           HZ3      LYS   8   0.566  -7.926   3.992
   73    H    ARG   9           H        ARG   9   2.346  -3.251   1.477
   74    HA   ARG   9           HA       ARG   9   4.141  -5.476   2.162
   75    HB2  ARG   9           HB2      ARG   9   4.137  -4.112  -0.572
   76    HB3  ARG   9           HB3      ARG   9   5.459  -5.112   0.024
   77    HG2  ARG   9           HG2      ARG   9   2.632  -6.055  -0.556
   78    HG3  ARG   9           HG3      ARG   9   4.051  -6.306  -1.566
   79    HD2  ARG   9           HD2      ARG   9   4.666  -8.138  -0.467
   80    HD3  ARG   9           HD3      ARG   9   4.617  -7.324   1.086
   81    HE   ARG   9           HE       ARG   9   2.197  -7.737   1.203
   82   HH11  ARG   9          HH11      ARG   9   3.860  -9.789  -1.112
   83   HH12  ARG   9          HH12      ARG   9   2.674 -11.061  -0.991
   84   HH21  ARG   9          HH22      ARG   9   0.749  -9.405   1.397
   85   HH22  ARG   9          HH21      ARG   9   0.926 -10.834   0.404
   86    H    MET  10           H        MET  10   6.509  -4.569   1.972
   87    HA   MET  10           HA       MET  10   6.563  -1.707   2.800
   88    HB2  MET  10           HB2      MET  10   6.670  -3.248   4.764
   89    HB3  MET  10           HB3      MET  10   8.113  -3.996   4.059
   90    HG2  MET  10           HG2      MET  10   9.224  -1.745   4.095
   91    HG3  MET  10           HG3      MET  10   7.786  -1.072   4.851
   92    HE1  MET  10           HE1      MET  10  10.871  -3.871   6.860
   93    HE2  MET  10           HE2      MET  10   9.876  -4.452   5.509
   94    HE3  MET  10           HE3      MET  10  11.036  -3.125   5.254
   95    H    PHE  11           H        PHE  11   7.992  -0.499   1.703
   96    HA   PHE  11           HA       PHE  11   9.353  -1.664  -0.504
   97    HB2  PHE  11           HB2      PHE  11   8.202   0.605  -0.283
   98    HB3  PHE  11           HB3      PHE  11   9.676   1.174   0.473
   99    HD1  PHE  11           HD1      PHE  11  11.923   0.732  -0.932
  100    HD2  PHE  11           HD2      PHE  11   7.943   0.608  -2.601
  101    HE1  PHE  11           HE1      PHE  11  12.861   1.047  -3.198
  102    HE2  PHE  11           HE2      PHE  11   8.892   0.937  -4.867
  103    HZ   PHE  11           HZ       PHE  11  11.350   1.159  -5.172
  104    H    ARG  12           H        ARG  12  10.906  -3.049   0.061
  105    HA   ARG  12           HA       ARG  12  12.999  -2.966   1.837
  106    HB2  ARG  12           HB2      ARG  12  12.371  -4.791   0.290
  107    HB3  ARG  12           HB3      ARG  12  13.026  -3.899  -1.070
  108    HG2  ARG  12           HG2      ARG  12  14.666  -4.959   1.282
  109    HG3  ARG  12           HG3      ARG  12  14.432  -5.779  -0.267
  110    HD2  ARG  12           HD2      ARG  12  15.410  -3.660  -1.368
  111    HD3  ARG  12           HD3      ARG  12  15.943  -3.225   0.275
  112    HE   ARG  12           HE       ARG  12  16.804  -5.862  -0.362
  113   HH11  ARG  12          HH21      ARG  12  17.571  -2.467  -1.067
  114   HH12  ARG  12          HH22      ARG  12  19.236  -2.838  -1.424
  115   HH21  ARG  12          HH11      ARG  12  18.972  -6.239  -0.829
  116   HH22  ARG  12          HH12      ARG  12  20.003  -4.918  -1.282
  117    H    SER  13           H        SER  13  14.708  -1.774   2.174
  118    HA   SER  13           HA       SER  13  16.593  -0.539   1.910
  119    HB2  SER  13           HB2      SER  13  15.873   0.839  -0.634
  120    HB3  SER  13           HB3      SER  13  17.453   0.385   0.011
  121    HG   SER  13           HG       SER  13  15.458  -1.181  -1.194
  122    H    ASN  14           H        ASN  14  13.346   0.616   1.967
  123    HA   ASN  14           HA       ASN  14  14.463   2.890   3.485
  124    HB2  ASN  14           HB2      ASN  14  13.038   4.573   2.482
  125    HB3  ASN  14           HB3      ASN  14  14.127   3.871   1.296
  126   HD21  ASN  14          HD22      ASN  14  13.097   3.673  -0.687
  127   HD22  ASN  14          HD21      ASN  14  11.414   3.216  -0.838
  128    H    GLY  15           H        GLY  15  11.671   0.743   2.945
  129    HA2  GLY  15           HA2      GLY  15  10.565  -0.189   4.805
  130    HA3  GLY  15           HA3      GLY  15  10.987   1.186   5.808
  131    H    THR  16           H        THR  16   9.819   2.350   2.827
  132    HA   THR  16           HA       THR  16   7.420   3.439   3.891
  133    HB   THR  16           HB       THR  16   8.031   2.883   0.957
  134    HG1  THR  16           HG1      THR  16   9.699   4.026   1.718
  135   HG21  THR  16          HG21      THR  16   6.274   4.974   2.315
  136   HG22  THR  16          HG22      THR  16   6.641   4.897   0.580
  137   HG23  THR  16          HG23      THR  16   5.701   3.601   1.335
  138    H    VAL  17           H        VAL  17   5.639   2.266   4.560
  139    HA   VAL  17           HA       VAL  17   5.018  -0.298   3.290
  140    HB   VAL  17           HB       VAL  17   3.580   1.286   5.403
  141   HG11  VAL  17          HG11      VAL  17   2.754  -1.391   4.212
  142   HG12  VAL  17          HG12      VAL  17   2.107  -0.703   5.715
  143   HG13  VAL  17          HG13      VAL  17   1.807   0.110   4.180
  144   HG21  VAL  17          HG21      VAL  17   5.686   0.040   6.032
  145   HG22  VAL  17          HG22      VAL  17   4.253  -0.650   6.813
  146   HG23  VAL  17          HG23      VAL  17   4.950  -1.449   5.387
  147    H    TYR  18           H        TYR  18   3.638  -0.715   1.824
  148    HA   TYR  18           HA       TYR  18   1.971   1.294   0.444
  149    HB2  TYR  18           HB2      TYR  18   3.134   1.302  -1.568
  150    HB3  TYR  18           HB3      TYR  18   4.394   1.510  -0.378
  151    HD1  TYR  18           HD1      TYR  18   5.730  -0.654   0.327
  152    HD2  TYR  18           HD2      TYR  18   3.280  -0.376  -3.211
  153    HE1  TYR  18           HE1      TYR  18   6.923  -2.623  -0.682
  154    HE2  TYR  18           HE2      TYR  18   4.434  -2.340  -4.173
  155    HH   TYR  18           HH       TYR  18   6.138  -3.836  -3.922
  156    H    TYR  19           H        TYR  19   1.214  -0.092  -1.839
  157    HA   TYR  19           HA       TYR  19   0.533  -2.818  -0.849
  158    HB2  TYR  19           HB2      TYR  19  -1.269  -0.677  -1.883
  159    HB3  TYR  19           HB3      TYR  19  -1.580  -2.315  -2.390
  160    HD1  TYR  19           HD2      TYR  19  -0.727  -0.625   0.901
  161    HD2  TYR  19           HD1      TYR  19  -3.159  -3.483  -1.199
  162    HE1  TYR  19           HE2      TYR  19  -2.023  -1.066   2.975
  163    HE2  TYR  19           HE1      TYR  19  -4.483  -3.890   0.839
  164    HH   TYR  19           HH       TYR  19  -4.819  -3.264   3.033
  165    H    PHE  20           H        PHE  20   0.266  -4.388  -2.272
  166    HA   PHE  20           HA       PHE  20   1.469  -4.111  -4.993
  167    HB2  PHE  20           HB2      PHE  20   3.113  -4.927  -3.433
  168    HB3  PHE  20           HB3      PHE  20   1.961  -6.070  -2.733
  169    HD1  PHE  20           HD1      PHE  20   4.095  -5.368  -5.672
  170    HD2  PHE  20           HD2      PHE  20   1.579  -8.284  -3.707
  171    HE1  PHE  20           HE1      PHE  20   4.993  -7.140  -7.138
  172    HE2  PHE  20           HE2      PHE  20   2.550 -10.056  -5.138
  173    HZ   PHE  20           HZ       PHE  20   4.221  -9.494  -6.874
  174    H    ASN  21           H        ASN  21   0.337  -5.254  -6.579
  175    HA   ASN  21           HA       ASN  21  -2.149  -6.616  -5.691
  176    HB2  ASN  21           HB2      ASN  21  -2.228  -4.949  -7.558
  177    HB3  ASN  21           HB3      ASN  21  -1.190  -6.016  -8.480
  178   HD21  ASN  21          HD22      ASN  21  -4.491  -5.542  -7.190
  179   HD22  ASN  21          HD21      ASN  21  -5.127  -6.965  -8.000
  180    H    HIS  22           H        HIS  22  -1.739  -8.610  -4.921
  181    HA   HIS  22           HA       HIS  22   0.487 -10.164  -5.867
  182    HB2  HIS  22           HB2      HIS  22   0.062 -11.543  -4.086
  183    HB3  HIS  22           HB3      HIS  22  -0.556 -10.019  -3.506
  184    HD1  HIS  22           HD1      HIS  22  -2.047 -13.112  -5.285
  185    HD2  HIS  22           HD2      HIS  22  -2.948 -10.182  -2.413
  186    HE1  HIS  22           HE1      HIS  22  -4.363 -13.730  -4.288
  187    H    ILE  23           H        ILE  23  -2.274  -9.649  -7.534
  188    HA   ILE  23           HA       ILE  23  -2.467 -12.414  -8.634
  189    HB   ILE  23           HB       ILE  23  -4.398 -10.066  -8.812
  190   HG12  ILE  23          HG12      ILE  23  -4.474 -12.610  -7.123
  191   HG13  ILE  23          HG13      ILE  23  -4.301 -10.961  -6.525
  192   HG21  ILE  23          HG21      ILE  23  -4.540 -11.565 -10.787
  193   HG22  ILE  23          HG22      ILE  23  -4.759 -12.957  -9.698
  194   HG23  ILE  23          HG23      ILE  23  -5.977 -11.662  -9.788
  195   HD11  ILE  23          HD11      ILE  23  -6.604 -10.451  -7.456
  196   HD12  ILE  23          HD12      ILE  23  -6.789 -12.202  -7.731
  197   HD13  ILE  23          HD13      ILE  23  -6.538 -11.586  -6.094
  198    H    THR  24           H        THR  24  -1.625  -9.088  -9.396
  199    HA   THR  24           HA       THR  24  -0.985  -9.813 -12.238
  200    HB   THR  24           HB       THR  24  -1.220  -7.410 -12.704
  201    HG1  THR  24           HG1      THR  24  -2.204  -7.244 -10.075
  202   HG21  THR  24          HG21      THR  24  -3.684  -8.459 -11.232
  203   HG22  THR  24          HG22      THR  24  -3.634  -7.132 -12.407
  204   HG23  THR  24          HG23      THR  24  -3.272  -8.792 -12.930
  205    H    ASN  25           H        ASN  25   0.480  -8.763  -9.287
  206    HA   ASN  25           HA       ASN  25   2.523  -8.208  -8.672
  207    HB2  ASN  25           HB2      ASN  25   3.209  -9.799 -10.623
  208    HB3  ASN  25           HB3      ASN  25   3.650  -8.316 -11.465
  209   HD21  ASN  25          HD22      ASN  25   5.067  -6.794  -9.925
  210   HD22  ASN  25          HD21      ASN  25   6.441  -7.699  -9.242
  211    H    ALA  26           H        ALA  26   0.406  -6.251 -10.097
  212    HA   ALA  26           HA       ALA  26   1.994  -3.907 -10.617
  213    HB1  ALA  26           HB1      ALA  26  -0.362  -4.230 -11.348
  214    HB2  ALA  26           HB2      ALA  26  -0.890  -4.089  -9.659
  215    HB3  ALA  26           HB3      ALA  26  -0.117  -2.714 -10.465
  216    H    SER  27           H        SER  27   1.732  -1.823  -9.168
  217    HA   SER  27           HA       SER  27   1.818  -2.354  -6.265
  218    HB2  SER  27           HB2      SER  27   4.162  -1.326  -7.877
  219    HB3  SER  27           HB3      SER  27   3.982  -1.060  -6.126
  220    HG   SER  27           HG       SER  27   3.549  -3.636  -7.119
  221    H    GLN  28           H        GLN  28   1.418  -0.507  -4.992
  222    HA   GLN  28           HA       GLN  28   0.702   2.050  -6.281
  223    HB2  GLN  28           HB2      GLN  28  -1.175   0.559  -6.739
  224    HB3  GLN  28           HB3      GLN  28  -1.237   0.041  -5.051
  225    HG2  GLN  28           HG2      GLN  28  -3.068   1.556  -5.713
  226    HG3  GLN  28           HG3      GLN  28  -2.121   2.120  -4.354
  227   HE21  GLN  28          HE22      GLN  28  -2.454   2.579  -7.968
  228   HE22  GLN  28          HE21      GLN  28  -1.926   4.249  -7.845
  229    H    PHE  29           H        PHE  29   0.285   3.736  -4.735
  230    HA   PHE  29           HA       PHE  29   1.409   3.247  -2.040
  231    HB2  PHE  29           HB2      PHE  29   0.763   5.850  -3.423
  232    HB3  PHE  29           HB3      PHE  29   1.619   5.652  -1.896
  233    HD1  PHE  29           HD2      PHE  29   3.644   3.631  -2.284
  234    HD2  PHE  29           HD1      PHE  29   2.217   6.560  -5.124
  235    HE1  PHE  29           HE2      PHE  29   5.781   3.486  -3.514
  236    HE2  PHE  29           HE1      PHE  29   4.363   6.399  -6.351
  237    HZ   PHE  29           HZ       PHE  29   6.148   4.866  -5.550
  238    H    GLU  30           H        GLU  30  -1.671   4.053  -3.624
  239    HA   GLU  30           HA       GLU  30  -3.130   4.605  -1.173
  240    HB2  GLU  30           HB2      GLU  30  -4.114   5.348  -3.177
  241    HB3  GLU  30           HB3      GLU  30  -3.822   3.826  -4.001
  242    HG2  GLU  30           HG2      GLU  30  -6.151   4.078  -3.665
  243    HG3  GLU  30           HG3      GLU  30  -5.584   2.714  -2.716
  244    H    ARG  31           H        ARG  31  -4.404   3.207   0.011
  245    HA   ARG  31           HA       ARG  31  -3.688   0.297   0.051
  246    HB2  ARG  31           HB2      ARG  31  -4.964   2.026   2.228
  247    HB3  ARG  31           HB3      ARG  31  -4.632   0.300   2.312
  248    HG2  ARG  31           HG2      ARG  31  -2.758   1.016   3.373
  249    HG3  ARG  31           HG3      ARG  31  -2.147   1.070   1.723
  250    HD2  ARG  31           HD2      ARG  31  -3.301   3.618   2.240
  251    HD3  ARG  31           HD3      ARG  31  -2.394   3.162   3.688
  252    HE   ARG  31           HE       ARG  31  -1.327   3.720   0.982
  253   HH11  ARG  31          HH21      ARG  31  -0.308   2.310   4.096
  254   HH12  ARG  31          HH22      ARG  31   1.374   2.470   3.563
  255   HH21  ARG  31          HH11      ARG  31   0.692   3.858   0.572
  256   HH22  ARG  31          HH12      ARG  31   1.936   3.272   1.729
  257    HA   PRO  32           HA       PRO  32  -7.890   0.385  -1.690
  258    HB2  PRO  32           HB2      PRO  32  -7.467  -2.356  -2.739
  259    HB3  PRO  32           HB3      PRO  32  -7.863  -0.855  -3.562
  260    HG2  PRO  32           HG2      PRO  32  -5.489  -1.983  -3.845
  261    HG3  PRO  32           HG3      PRO  32  -5.629  -0.268  -3.860
  262    HD2  PRO  32           HD2      PRO  32  -4.931  -1.949  -1.439
  263    HD3  PRO  32           HD3      PRO  32  -4.103  -0.474  -2.018
  264    H    SER  33           H        SER  33  -9.854  -0.715  -1.366
  265    HA   SER  33           HA       SER  33 -10.102  -3.211   0.029
  266    HB2  SER  33           HB2      SER  33 -11.199  -2.450   2.022
  267    HB3  SER  33           HB3      SER  33  -9.675  -1.554   1.932
  268    HG   SER  33           HG       SER  33 -12.230  -0.691   1.075
  269    H    GLY  34           H        GLY  34 -10.852  -2.304  -2.589
  270    HA2  GLY  34           HA2      GLY  34 -12.835  -2.602  -3.852
  271    HA3  GLY  34           HA3      GLY  34 -13.822  -2.084  -2.466
  Start of MODEL   13
    1    H1   LYS   1           H1       LYS   1 -13.166   1.513  -2.350
    2    H2   LYS   1           H2       LYS   1 -12.335   0.092  -2.565
    3    H3   LYS   1           H3       LYS   1 -13.467   0.537  -3.653
    4    HA   LYS   1           HA       LYS   1 -12.214   2.419  -4.368
    5    HB2  LYS   1           HB2      LYS   1 -10.141   1.429  -2.372
    6    HB3  LYS   1           HB3      LYS   1  -9.868   2.668  -3.614
    7    HG2  LYS   1           HG2      LYS   1 -11.848   3.946  -2.602
    8    HG3  LYS   1           HG3      LYS   1 -11.720   2.857  -1.212
    9    HD2  LYS   1           HD2      LYS   1  -9.510   4.656  -2.304
   10    HD3  LYS   1           HD3      LYS   1 -10.500   5.013  -0.884
   11    HE2  LYS   1           HE2      LYS   1  -9.545   3.208   0.382
   12    HE3  LYS   1           HE3      LYS   1  -8.844   2.475  -1.067
   13    HZ1  LYS   1           HZ1      LYS   1  -7.399   4.396  -1.311
   14    HZ2  LYS   1           HZ2      LYS   1  -7.893   4.994   0.153
   15    HZ3  LYS   1           HZ3      LYS   1  -7.105   3.527  -0.010
   16    H    LEU   2           H        LEU   2  -9.226   1.051  -4.687
   17    HA   LEU   2           HA       LEU   2  -9.960  -0.364  -7.021
   18    HB2  LEU   2           HB2      LEU   2  -7.265  -0.792  -5.768
   19    HB3  LEU   2           HB3      LEU   2  -7.693  -0.888  -7.366
   20    HG   LEU   2           HG       LEU   2  -7.912   1.491  -7.682
   21   HD11  LEU   2          HD11      LEU   2  -7.096   1.756  -4.755
   22   HD12  LEU   2          HD12      LEU   2  -6.780   3.007  -5.957
   23   HD13  LEU   2          HD13      LEU   2  -8.432   2.564  -5.626
   24   HD21  LEU   2          HD21      LEU   2  -5.814   0.277  -8.100
   25   HD22  LEU   2          HD22      LEU   2  -5.478   1.917  -7.537
   26   HD23  LEU   2          HD23      LEU   2  -5.291   0.540  -6.430
   27    HA   PRO   3           HA       PRO   3 -11.145  -4.370  -6.257
   28    HB2  PRO   3           HB2      PRO   3  -8.521  -5.324  -7.474
   29    HB3  PRO   3           HB3      PRO   3 -10.167  -5.944  -7.849
   30    HG2  PRO   3           HG2      PRO   3  -9.070  -4.202  -9.519
   31    HG3  PRO   3           HG3      PRO   3 -10.734  -3.827  -8.923
   32    HD2  PRO   3           HD2      PRO   3  -8.077  -2.832  -7.824
   33    HD3  PRO   3           HD3      PRO   3  -9.502  -1.881  -8.260
   34    HA   PRO   4           HA       PRO   4  -9.302  -7.024  -3.062
   35    HB2  PRO   4           HB2      PRO   4 -10.501  -9.425  -3.656
   36    HB3  PRO   4           HB3      PRO   4 -11.363  -8.082  -2.845
   37    HG2  PRO   4           HG2      PRO   4 -11.379  -8.800  -5.788
   38    HG3  PRO   4           HG3      PRO   4 -12.776  -8.416  -4.734
   39    HD2  PRO   4           HD2      PRO   4 -11.679  -6.561  -6.364
   40    HD3  PRO   4           HD3      PRO   4 -12.257  -6.110  -4.736
   41    H    GLY   5           H        GLY   5  -7.435  -8.312  -3.077
   42    HA2  GLY   5           HA2      GLY   5  -5.847  -9.804  -4.292
   43    HA3  GLY   5           HA3      GLY   5  -6.281  -8.946  -5.765
   44    H    TRP   6           H        TRP   6  -6.342  -6.122  -4.516
   45    HA   TRP   6           HA       TRP   6  -3.494  -5.631  -4.446
   46    HB2  TRP   6           HB2      TRP   6  -5.959  -3.998  -3.766
   47    HB3  TRP   6           HB3      TRP   6  -4.315  -3.408  -3.642
   48    HD1  TRP   6           HD1      TRP   6  -6.964  -4.004  -6.214
   49    HE1  TRP   6           HE1      TRP   6  -6.182  -2.943  -8.425
   50    HE3  TRP   6           HE3      TRP   6  -2.123  -3.148  -4.985
   51    HZ2  TRP   6           HZ2      TRP   6  -3.683  -2.018  -9.582
   52    HZ3  TRP   6           HZ3      TRP   6  -0.591  -2.140  -6.573
   53    HH2  TRP   6           HH2      TRP   6  -1.311  -1.591  -8.916
   54    H    GLU   7           H        GLU   7  -2.104  -5.925  -2.802
   55    HA   GLU   7           HA       GLU   7  -3.085  -5.998   0.005
   56    HB2  GLU   7           HB2      GLU   7  -2.746  -8.228  -1.376
   57    HB3  GLU   7           HB3      GLU   7  -1.036  -7.940  -1.103
   58    HG2  GLU   7           HG2      GLU   7  -3.195  -8.189   1.049
   59    HG3  GLU   7           HG3      GLU   7  -2.146  -9.500   0.514
   60    H    LYS   8           H        LYS   8  -1.551  -5.433   1.549
   61    HA   LYS   8           HA       LYS   8   0.157  -3.245   0.969
   62    HB2  LYS   8           HB2      LYS   8  -0.873  -3.208   3.008
   63    HB3  LYS   8           HB3      LYS   8  -0.655  -4.884   3.355
   64    HG2  LYS   8           HG2      LYS   8   1.590  -2.841   3.468
   65    HG3  LYS   8           HG3      LYS   8   0.528  -3.218   4.811
   66    HD2  LYS   8           HD2      LYS   8   2.681  -4.985   3.629
   67    HD3  LYS   8           HD3      LYS   8   2.520  -4.335   5.230
   68    HE2  LYS   8           HE2      LYS   8   2.050  -6.570   5.513
   69    HE3  LYS   8           HE3      LYS   8   0.451  -5.823   5.548
   70    HZ1  LYS   8           HZ1      LYS   8  -0.080  -6.817   3.485
   71    HZ2  LYS   8           HZ2      LYS   8   1.432  -6.843   2.958
   72    HZ3  LYS   8           HZ3      LYS   8   0.913  -7.945   4.069
   73    H    ARG   9           H        ARG   9   2.275  -2.962   0.752
   74    HA   ARG   9           HA       ARG   9   4.217  -5.095   1.395
   75    HB2  ARG   9           HB2      ARG   9   4.127  -3.607  -1.272
   76    HB3  ARG   9           HB3      ARG   9   5.481  -4.603  -0.732
   77    HG2  ARG   9           HG2      ARG   9   2.662  -5.561  -1.319
   78    HG3  ARG   9           HG3      ARG   9   4.075  -5.759  -2.353
   79    HD2  ARG   9           HD2      ARG   9   4.767  -7.604  -1.303
   80    HD3  ARG   9           HD3      ARG   9   4.614  -6.877   0.284
   81    HE   ARG   9           HE       ARG   9   2.259  -7.430   0.348
   82   HH11  ARG   9          HH21      ARG   9   3.905  -9.088  -2.280
   83   HH12  ARG   9          HH22      ARG   9   2.788 -10.428  -2.262
   84   HH21  ARG   9          HH11      ARG   9   0.882  -9.141   0.349
   85   HH22  ARG   9          HH12      ARG   9   1.056 -10.433  -0.823
   86    H    MET  10           H        MET  10   6.508  -4.115   1.384
   87    HA   MET  10           HA       MET  10   6.428  -1.295   2.309
   88    HB2  MET  10           HB2      MET  10   6.091  -2.824   4.240
   89    HB3  MET  10           HB3      MET  10   7.630  -3.616   3.861
   90    HG2  MET  10           HG2      MET  10   8.794  -1.439   4.170
   91    HG3  MET  10           HG3      MET  10   7.263  -0.672   4.572
   92    HE1  MET  10           HE1      MET  10   6.298  -0.524   6.897
   93    HE2  MET  10           HE2      MET  10   5.673  -2.156   6.544
   94    HE3  MET  10           HE3      MET  10   6.447  -1.815   8.109
   95    H    PHE  11           H        PHE  11   8.071  -0.093   1.656
   96    HA   PHE  11           HA       PHE  11  10.157  -1.118  -0.029
   97    HB2  PHE  11           HB2      PHE  11   8.963   1.144  -0.091
   98    HB3  PHE  11           HB3      PHE  11   9.965   1.623   1.257
   99    HD1  PHE  11           HD2      PHE  11  12.626   1.367   0.859
  100    HD2  PHE  11           HD1      PHE  11   9.661   1.524  -2.277
  101    HE1  PHE  11           HE2      PHE  11  14.367   2.041  -0.752
  102    HE2  PHE  11           HE1      PHE  11  11.415   2.225  -3.884
  103    HZ   PHE  11           HZ       PHE  11  13.770   2.481  -3.129
  104    H    ARG  12           H        ARG  12  11.079  -2.739   1.373
  105    HA   ARG  12           HA       ARG  12  12.504  -2.275   3.721
  106    HB2  ARG  12           HB2      ARG  12  13.794  -4.159   3.300
  107    HB3  ARG  12           HB3      ARG  12  12.235  -4.484   2.573
  108    HG2  ARG  12           HG2      ARG  12  14.804  -3.744   1.082
  109    HG3  ARG  12           HG3      ARG  12  14.129  -5.349   1.285
  110    HD2  ARG  12           HD2      ARG  12  13.521  -4.800  -0.874
  111    HD3  ARG  12           HD3      ARG  12  12.038  -4.512   0.053
  112    HE   ARG  12           HE       ARG  12  13.510  -2.083  -0.037
  113   HH11  ARG  12          HH21      ARG  12  11.752  -4.086  -2.321
  114   HH12  ARG  12          HH22      ARG  12  11.399  -2.749  -3.383
  115   HH21  ARG  12          HH12      ARG  12  13.039  -0.416  -1.396
  116   HH22  ARG  12          HH11      ARG  12  12.135  -0.677  -2.845
  117    H    SER  13           H        SER  13  14.476  -1.590   4.291
  118    HA   SER  13           HA       SER  13  16.374  -0.384   4.357
  119    HB2  SER  13           HB2      SER  13  16.024   0.488   1.478
  120    HB3  SER  13           HB3      SER  13  17.408   0.790   2.536
  121    HG   SER  13           HG       SER  13  17.765  -1.037   1.229
  122    H    ASN  14           H        ASN  14  13.218   0.900   3.631
  123    HA   ASN  14           HA       ASN  14  13.980   3.057   5.477
  124    HB2  ASN  14           HB2      ASN  14  13.050   4.872   4.240
  125    HB3  ASN  14           HB3      ASN  14  14.312   4.099   3.296
  126   HD21  ASN  14          HD22      ASN  14  13.657   4.624   1.186
  127   HD22  ASN  14          HD21      ASN  14  12.082   4.159   0.576
  128    H    GLY  15           H        GLY  15  11.387   1.052   4.142
  129    HA2  GLY  15           HA2      GLY  15   9.797   0.114   5.584
  130    HA3  GLY  15           HA3      GLY  15   9.932   1.463   6.699
  131    H    THR  16           H        THR  16   9.685   2.691   3.528
  132    HA   THR  16           HA       THR  16   7.118   3.834   3.928
  133    HB   THR  16           HB       THR  16   8.470   3.372   1.239
  134    HG1  THR  16           HG1      THR  16   9.910   4.408   2.517
  135   HG21  THR  16          HG21      THR  16   6.144   4.152   1.056
  136   HG22  THR  16          HG22      THR  16   6.468   5.448   2.231
  137   HG23  THR  16          HG23      THR  16   7.270   5.465   0.647
  138    H    VAL  17           H        VAL  17   5.174   2.826   3.946
  139    HA   VAL  17           HA       VAL  17   4.851   0.215   2.685
  140    HB   VAL  17           HB       VAL  17   2.983   2.012   4.253
  141   HG11  VAL  17          HG11      VAL  17   2.328  -0.709   3.059
  142   HG12  VAL  17          HG12      VAL  17   1.385   0.088   4.335
  143   HG13  VAL  17          HG13      VAL  17   1.492   0.827   2.738
  144   HG21  VAL  17          HG21      VAL  17   3.165   0.191   5.922
  145   HG22  VAL  17          HG22      VAL  17   4.194  -0.738   4.808
  146   HG23  VAL  17          HG23      VAL  17   4.774   0.796   5.502
  147    H    TYR  18           H        TYR  18   3.581  -0.351   1.035
  148    HA   TYR  18           HA       TYR  18   2.063   1.547  -0.573
  149    HB2  TYR  18           HB2      TYR  18   3.213   1.148  -2.638
  150    HB3  TYR  18           HB3      TYR  18   4.348   1.794  -1.479
  151    HD1  TYR  18           HD1      TYR  18   6.106   0.294  -0.457
  152    HD2  TYR  18           HD2      TYR  18   3.535  -0.988  -3.674
  153    HE1  TYR  18           HE1      TYR  18   7.697  -1.569  -1.020
  154    HE2  TYR  18           HE2      TYR  18   5.095  -2.831  -4.204
  155    HH   TYR  18           HH       TYR  18   7.092  -3.815  -3.701
  156    H    TYR  19           H        TYR  19   1.351  -0.081  -2.730
  157    HA   TYR  19           HA       TYR  19   0.556  -2.664  -1.508
  158    HB2  TYR  19           HB2      TYR  19  -1.138  -0.432  -2.508
  159    HB3  TYR  19           HB3      TYR  19  -1.581  -2.022  -3.059
  160    HD1  TYR  19           HD2      TYR  19  -0.748  -0.252   0.208
  161    HD2  TYR  19           HD1      TYR  19  -3.002  -3.323  -1.787
  162    HE1  TYR  19           HE2      TYR  19  -1.869  -0.825   2.326
  163    HE2  TYR  19           HE1      TYR  19  -4.217  -3.815   0.309
  164    HH   TYR  19           HH       TYR  19  -4.549  -3.257   2.502
  165    H    PHE  20           H        PHE  20  -0.001  -4.288  -2.862
  166    HA   PHE  20           HA       PHE  20   1.099  -4.274  -5.628
  167    HB2  PHE  20           HB2      PHE  20   2.828  -5.005  -4.131
  168    HB3  PHE  20           HB3      PHE  20   1.722  -6.110  -3.300
  169    HD1  PHE  20           HD1      PHE  20   3.533  -5.501  -6.487
  170    HD2  PHE  20           HD2      PHE  20   1.338  -8.358  -4.106
  171    HE1  PHE  20           HE1      PHE  20   4.261  -7.331  -8.003
  172    HE2  PHE  20           HE2      PHE  20   2.134 -10.186  -5.592
  173    HZ   PHE  20           HZ       PHE  20   3.563  -9.679  -7.542
  174    H    ASN  21           H        ASN  21  -0.304  -5.309  -7.024
  175    HA   ASN  21           HA       ASN  21  -2.667  -6.685  -5.945
  176    HB2  ASN  21           HB2      ASN  21  -2.761  -5.145  -7.939
  177    HB3  ASN  21           HB3      ASN  21  -1.844  -6.354  -8.831
  178   HD21  ASN  21          HD22      ASN  21  -5.026  -5.383  -7.909
  179   HD22  ASN  21          HD21      ASN  21  -5.783  -6.929  -8.278
  180    H    HIS  22           H        HIS  22  -2.264  -8.613  -5.067
  181    HA   HIS  22           HA       HIS  22  -0.067 -10.261  -5.955
  182    HB2  HIS  22           HB2      HIS  22  -0.446 -11.497  -4.070
  183    HB3  HIS  22           HB3      HIS  22  -1.064  -9.941  -3.576
  184    HD1  HIS  22           HD1      HIS  22  -2.544 -13.170  -5.099
  185    HD2  HIS  22           HD2      HIS  22  -3.463 -10.031  -2.467
  186    HE1  HIS  22           HE1      HIS  22  -4.841 -13.737  -4.030
  187    H    ILE  23           H        ILE  23  -2.944  -9.808  -7.506
  188    HA   ILE  23           HA       ILE  23  -3.181 -12.621  -8.448
  189    HB   ILE  23           HB       ILE  23  -5.158 -10.320  -8.691
  190   HG12  ILE  23          HG12      ILE  23  -5.122 -12.700  -6.779
  191   HG13  ILE  23          HG13      ILE  23  -4.911 -11.009  -6.333
  192   HG21  ILE  23          HG21      ILE  23  -5.337 -12.016 -10.505
  193   HG22  ILE  23          HG22      ILE  23  -5.499 -13.288  -9.272
  194   HG23  ILE  23          HG23      ILE  23  -6.738 -12.023  -9.447
  195   HD11  ILE  23          HD11      ILE  23  -7.252 -10.551  -7.177
  196   HD12  ILE  23          HD12      ILE  23  -7.466 -12.315  -7.311
  197   HD13  ILE  23          HD13      ILE  23  -7.127 -11.583  -5.738
  198    H    THR  24           H        THR  24  -2.657  -9.233  -9.531
  199    HA   THR  24           HA       THR  24  -2.083 -10.249 -12.284
  200    HB   THR  24           HB       THR  24  -2.223  -7.991 -13.028
  201    HG1  THR  24           HG1      THR  24  -2.808  -6.360 -11.530
  202   HG21  THR  24          HG21      THR  24  -4.386  -9.199 -12.705
  203   HG22  THR  24          HG22      THR  24  -4.546  -8.439 -11.107
  204   HG23  THR  24          HG23      THR  24  -4.541  -7.438 -12.576
  205    H    ASN  25           H        ASN  25  -0.405  -8.907  -9.541
  206    HA   ASN  25           HA       ASN  25   1.723  -8.643  -9.037
  207    HB2  ASN  25           HB2      ASN  25   2.627  -9.052 -11.893
  208    HB3  ASN  25           HB3      ASN  25   3.620  -9.017 -10.450
  209   HD21  ASN  25          HD22      ASN  25   1.294 -10.907 -12.267
  210   HD22  ASN  25          HD21      ASN  25   1.655 -12.435 -11.434
  211    H    ALA  26           H        ALA  26  -0.216  -6.590 -10.617
  212    HA   ALA  26           HA       ALA  26   1.572  -4.412 -11.241
  213    HB1  ALA  26           HB1      ALA  26  -0.783  -4.551 -12.005
  214    HB2  ALA  26           HB2      ALA  26  -1.338  -4.382 -10.321
  215    HB3  ALA  26           HB3      ALA  26  -0.475  -3.049 -11.116
  216    H    SER  27           H        SER  27   1.706  -2.315  -9.928
  217    HA   SER  27           HA       SER  27   1.324  -2.653  -7.032
  218    HB2  SER  27           HB2      SER  27   3.647  -3.334  -7.492
  219    HB3  SER  27           HB3      SER  27   3.967  -1.709  -8.132
  220    HG   SER  27           HG       SER  27   2.780  -2.039  -5.549
  221    H    GLN  28           H        GLN  28   1.226  -0.632  -5.865
  222    HA   GLN  28           HA       GLN  28   0.949   1.909  -7.250
  223    HB2  GLN  28           HB2      GLN  28  -1.126   0.758  -7.893
  224    HB3  GLN  28           HB3      GLN  28  -1.423   0.273  -6.225
  225    HG2  GLN  28           HG2      GLN  28  -2.879   2.107  -7.091
  226    HG3  GLN  28           HG3      GLN  28  -2.056   2.436  -5.579
  227   HE21  GLN  28          HE22      GLN  28  -1.797   3.110  -9.172
  228   HE22  GLN  28          HE21      GLN  28  -0.982   4.633  -8.864
  229    H    PHE  29           H        PHE  29   0.678   3.633  -5.591
  230    HA   PHE  29           HA       PHE  29   1.484   2.738  -2.861
  231    HB2  PHE  29           HB2      PHE  29   1.846   5.285  -4.404
  232    HB3  PHE  29           HB3      PHE  29   1.742   5.331  -2.651
  233    HD1  PHE  29           HD1      PHE  29   3.475   2.945  -5.088
  234    HD2  PHE  29           HD2      PHE  29   3.812   5.503  -1.619
  235    HE1  PHE  29           HE1      PHE  29   5.832   2.297  -4.835
  236    HE2  PHE  29           HE2      PHE  29   6.186   4.854  -1.394
  237    HZ   PHE  29           HZ       PHE  29   7.204   3.246  -2.992
  238    H    GLU  30           H        GLU  30  -1.244   4.160  -4.633
  239    HA   GLU  30           HA       GLU  30  -2.769   4.845  -2.295
  240    HB2  GLU  30           HB2      GLU  30  -3.175   5.177  -4.900
  241    HB3  GLU  30           HB3      GLU  30  -4.163   3.736  -4.721
  242    HG2  GLU  30           HG2      GLU  30  -4.432   6.429  -3.313
  243    HG3  GLU  30           HG3      GLU  30  -5.488   5.787  -4.566
  244    H    ARG  31           H        ARG  31  -4.008   3.678  -1.104
  245    HA   ARG  31           HA       ARG  31  -3.441   0.740  -0.802
  246    HB2  ARG  31           HB2      ARG  31  -2.670   2.101   1.004
  247    HB3  ARG  31           HB3      ARG  31  -4.235   2.900   1.198
  248    HG2  ARG  31           HG2      ARG  31  -4.289  -0.061   1.413
  249    HG3  ARG  31           HG3      ARG  31  -3.264   0.761   2.607
  250    HD2  ARG  31           HD2      ARG  31  -5.183   2.141   3.292
  251    HD3  ARG  31           HD3      ARG  31  -6.228   1.197   2.207
  252    HE   ARG  31           HE       ARG  31  -4.773   0.182   4.617
  253   HH11  ARG  31          HH11      ARG  31  -7.305  -0.617   2.141
  254   HH12  ARG  31          HH12      ARG  31  -7.620  -2.059   3.102
  255   HH21  ARG  31          HH21      ARG  31  -5.311  -1.892   5.404
  256   HH22  ARG  31          HH22      ARG  31  -6.594  -2.733   4.528
  257    HA   PRO  32           HA       PRO  32  -7.776   0.845  -2.141
  258    HB2  PRO  32           HB2      PRO  32  -7.500  -2.011  -3.001
  259    HB3  PRO  32           HB3      PRO  32  -7.999  -0.564  -3.853
  260    HG2  PRO  32           HG2      PRO  32  -5.646  -1.708  -4.299
  261    HG3  PRO  32           HG3      PRO  32  -5.749   0.018  -4.336
  262    HD2  PRO  32           HD2      PRO  32  -4.946  -1.638  -1.914
  263    HD3  PRO  32           HD3      PRO  32  -4.075  -0.253  -2.615
  264    H    SER  33           H        SER  33  -9.387  -1.397  -2.171
  265    HA   SER  33           HA       SER  33 -10.663  -1.419   0.302
  266    HB2  SER  33           HB2      SER  33 -11.052  -3.495  -1.864
  267    HB3  SER  33           HB3      SER  33 -12.264  -2.708  -0.845
  268    HG   SER  33           HG       SER  33 -11.053  -1.909  -3.236
  269    H    GLY  34           H        GLY  34  -7.818  -2.736   0.337
  270    HA2  GLY  34           HA2      GLY  34  -8.530  -5.303   1.707
  271    HA3  GLY  34           HA3      GLY  34  -7.129  -5.163   0.628
  Start of MODEL   14
    1    H1   LYS   1           H1       LYS   1 -10.083   1.741  -2.302
    2    H2   LYS   1           H2       LYS   1 -11.460   1.767  -1.456
    3    H3   LYS   1           H3       LYS   1 -11.406   2.495  -2.947
    4    HA   LYS   1           HA       LYS   1 -11.146  -0.390  -2.427
    5    HB2  LYS   1           HB2      LYS   1 -13.470   1.186  -3.588
    6    HB3  LYS   1           HB3      LYS   1 -13.306  -0.560  -3.733
    7    HG2  LYS   1           HG2      LYS   1 -13.572   0.967  -1.123
    8    HG3  LYS   1           HG3      LYS   1 -14.840   0.075  -1.936
    9    HD2  LYS   1           HD2      LYS   1 -13.761  -2.043  -1.607
   10    HD3  LYS   1           HD3      LYS   1 -12.282  -1.304  -0.980
   11    HE2  LYS   1           HE2      LYS   1 -14.956  -0.810   0.352
   12    HE3  LYS   1           HE3      LYS   1 -14.032  -2.281   0.702
   13    HZ1  LYS   1           HZ1      LYS   1 -12.271  -1.045   1.582
   14    HZ2  LYS   1           HZ2      LYS   1 -12.729   0.363   0.898
   15    HZ3  LYS   1           HZ3      LYS   1 -13.592  -0.264   2.177
   16    H    LEU   2           H        LEU   2 -10.034  -1.438  -3.830
   17    HA   LEU   2           HA       LEU   2 -10.257  -1.079  -6.672
   18    HB2  LEU   2           HB2      LEU   2  -7.436  -1.451  -5.658
   19    HB3  LEU   2           HB3      LEU   2  -7.933  -1.377  -7.204
   20    HG   LEU   2           HG       LEU   2  -8.424   0.987  -7.190
   21   HD11  LEU   2          HD11      LEU   2  -8.852   1.710  -4.955
   22   HD12  LEU   2          HD12      LEU   2  -7.362   0.975  -4.334
   23   HD13  LEU   2          HD13      LEU   2  -7.307   2.386  -5.392
   24   HD21  LEU   2          HD21      LEU   2  -6.290   0.081  -7.942
   25   HD22  LEU   2          HD22      LEU   2  -5.991   1.595  -7.088
   26   HD23  LEU   2          HD23      LEU   2  -5.653   0.043  -6.296
   27    HA   PRO   3           HA       PRO   3 -10.918  -5.298  -6.773
   28    HB2  PRO   3           HB2      PRO   3  -8.183  -5.795  -7.992
   29    HB3  PRO   3           HB3      PRO   3  -9.754  -6.535  -8.507
   30    HG2  PRO   3           HG2      PRO   3  -8.837  -4.444  -9.878
   31    HG3  PRO   3           HG3      PRO   3 -10.533  -4.326  -9.262
   32    HD2  PRO   3           HD2      PRO   3  -7.977  -3.287  -7.989
   33    HD3  PRO   3           HD3      PRO   3  -9.485  -2.387  -8.231
   34    HA   PRO   4           HA       PRO   4  -9.087  -8.183  -3.791
   35    HB2  PRO   4           HB2      PRO   4 -10.077 -10.291  -5.712
   36    HB3  PRO   4           HB3      PRO   4 -10.319 -10.183  -3.940
   37    HG2  PRO   4           HG2      PRO   4 -12.328  -9.549  -5.654
   38    HG3  PRO   4           HG3      PRO   4 -12.027  -8.546  -4.197
   39    HD2  PRO   4           HD2      PRO   4 -11.167  -8.013  -7.051
   40    HD3  PRO   4           HD3      PRO   4 -11.897  -6.901  -5.851
   41    H    GLY   5           H        GLY   5  -7.061  -9.244  -3.726
   42    HA2  GLY   5           HA2      GLY   5  -5.192 -10.386  -4.893
   43    HA3  GLY   5           HA3      GLY   5  -5.564  -9.424  -6.315
   44    H    TRP   6           H        TRP   6  -6.007  -6.746  -4.924
   45    HA   TRP   6           HA       TRP   6  -3.264  -6.018  -4.462
   46    HB2  TRP   6           HB2      TRP   6  -5.920  -4.654  -3.951
   47    HB3  TRP   6           HB3      TRP   6  -4.344  -3.928  -3.688
   48    HD1  TRP   6           HD1      TRP   6  -6.793  -4.523  -6.430
   49    HE1  TRP   6           HE1      TRP   6  -5.940  -3.300  -8.531
   50    HE3  TRP   6           HE3      TRP   6  -2.068  -3.463  -4.885
   51    HZ2  TRP   6           HZ2      TRP   6  -3.457  -2.194  -9.495
   52    HZ3  TRP   6           HZ3      TRP   6  -0.502  -2.292  -6.366
   53    HH2  TRP   6           HH2      TRP   6  -1.168  -1.660  -8.688
   54    H    GLU   7           H        GLU   7  -2.038  -6.394  -2.718
   55    HA   GLU   7           HA       GLU   7  -3.266  -6.370  -0.004
   56    HB2  GLU   7           HB2      GLU   7  -2.821  -8.690  -1.156
   57    HB3  GLU   7           HB3      GLU   7  -1.131  -8.367  -0.813
   58    HG2  GLU   7           HG2      GLU   7  -3.394  -8.431   1.246
   59    HG3  GLU   7           HG3      GLU   7  -2.369  -9.807   0.851
   60    H    LYS   8           H        LYS   8  -1.716  -5.856   1.701
   61    HA   LYS   8           HA       LYS   8  -0.140  -3.558   1.062
   62    HB2  LYS   8           HB2      LYS   8  -1.186  -3.453   3.093
   63    HB3  LYS   8           HB3      LYS   8  -1.000  -5.120   3.456
   64    HG2  LYS   8           HG2      LYS   8   1.631  -3.766   3.605
   65    HG3  LYS   8           HG3      LYS   8   0.399  -2.913   4.488
   66    HD2  LYS   8           HD2      LYS   8   1.313  -4.395   6.041
   67    HD3  LYS   8           HD3      LYS   8  -0.284  -5.004   5.673
   68    HE2  LYS   8           HE2      LYS   8   2.381  -6.141   4.717
   69    HE3  LYS   8           HE3      LYS   8   1.350  -6.784   5.993
   70    HZ1  LYS   8           HZ1      LYS   8   0.868  -8.106   4.121
   71    HZ2  LYS   8           HZ2      LYS   8  -0.390  -7.069   4.038
   72    HZ3  LYS   8           HZ3      LYS   8   0.878  -6.878   3.083
   73    H    ARG   9           H        ARG   9   2.002  -3.206   0.971
   74    HA   ARG   9           HA       ARG   9   3.945  -5.329   1.683
   75    HB2  ARG   9           HB2      ARG   9   3.907  -3.916  -1.017
   76    HB3  ARG   9           HB3      ARG   9   5.272  -4.868  -0.426
   77    HG2  ARG   9           HG2      ARG   9   2.493  -5.906  -1.043
   78    HG3  ARG   9           HG3      ARG   9   3.933  -6.106  -2.039
   79    HD2  ARG   9           HD2      ARG   9   4.633  -7.905  -0.911
   80    HD3  ARG   9           HD3      ARG   9   4.437  -7.124   0.646
   81    HE   ARG   9           HE       ARG   9   2.097  -7.713   0.690
   82   HH11  ARG   9          HH11      ARG   9   3.792  -9.395  -1.881
   83   HH12  ARG   9          HH12      ARG   9   2.636 -10.701  -1.928
   84   HH21  ARG   9          HH21      ARG   9   0.687  -9.389   0.651
   85   HH22  ARG   9          HH22      ARG   9   0.858 -10.675  -0.531
   86    H    MET  10           H        MET  10   6.269  -4.344   1.508
   87    HA   MET  10           HA       MET  10   6.250  -1.520   2.405
   88    HB2  MET  10           HB2      MET  10   6.093  -3.019   4.389
   89    HB3  MET  10           HB3      MET  10   7.599  -3.809   3.886
   90    HG2  MET  10           HG2      MET  10   8.754  -1.599   4.013
   91    HG3  MET  10           HG3      MET  10   7.254  -0.861   4.573
   92    HE1  MET  10           HE1      MET  10   6.895  -1.969   8.205
   93    HE2  MET  10           HE2      MET  10   6.574  -0.693   7.013
   94    HE3  MET  10           HE3      MET  10   5.951  -2.342   6.745
   95    H    PHE  11           H        PHE  11   7.776  -0.348   1.507
   96    HA   PHE  11           HA       PHE  11   9.682  -1.396  -0.346
   97    HB2  PHE  11           HB2      PHE  11   8.445   0.779  -0.450
   98    HB3  PHE  11           HB3      PHE  11   9.401   1.344   0.903
   99    HD1  PHE  11           HD2      PHE  11  11.667  -0.525  -1.182
  100    HD2  PHE  11           HD1      PHE  11   9.486   3.206  -0.962
  101    HE1  PHE  11           HE2      PHE  11  13.302   0.526  -2.674
  102    HE2  PHE  11           HE1      PHE  11  11.138   4.242  -2.485
  103    HZ   PHE  11           HZ       PHE  11  13.056   2.908  -3.338
  104    H    ARG  12           H        ARG  12  10.967  -2.860   0.833
  105    HA   ARG  12           HA       ARG  12  12.623  -2.400   3.022
  106    HB2  ARG  12           HB2      ARG  12  14.162  -4.040   2.066
  107    HB3  ARG  12           HB3      ARG  12  12.483  -4.546   1.878
  108    HG2  ARG  12           HG2      ARG  12  12.537  -3.797  -0.512
  109    HG3  ARG  12           HG3      ARG  12  14.239  -3.337  -0.313
  110    HD2  ARG  12           HD2      ARG  12  14.803  -5.692   0.263
  111    HD3  ARG  12           HD3      ARG  12  13.104  -6.135   0.093
  112    HE   ARG  12           HE       ARG  12  13.271  -6.082  -2.206
  113   HH11  ARG  12          HH11      ARG  12  16.245  -4.727  -0.959
  114   HH12  ARG  12          HH12      ARG  12  17.048  -4.768  -2.505
  115   HH21  ARG  12          HH21      ARG  12  14.327  -6.134  -4.170
  116   HH22  ARG  12          HH22      ARG  12  15.963  -5.569  -4.287
  117    H    SER  13           H        SER  13  14.650  -1.597   3.359
  118    HA   SER  13           HA       SER  13  16.516  -0.279   3.195
  119    HB2  SER  13           HB2      SER  13  17.071   1.223   1.417
  120    HB3  SER  13           HB3      SER  13  16.620  -0.333   0.701
  121    HG   SER  13           HG       SER  13  14.572   0.482   0.311
  122    H    ASN  14           H        ASN  14  13.193   0.861   3.000
  123    HA   ASN  14           HA       ASN  14  13.968   3.158   4.739
  124    HB2  ASN  14           HB2      ASN  14  12.595   4.674   3.336
  125    HB3  ASN  14           HB3      ASN  14  14.012   4.046   2.496
  126   HD21  ASN  14          HD22      ASN  14  13.729   2.628   0.660
  127   HD22  ASN  14          HD21      ASN  14  12.126   2.448  -0.022
  128    H    GLY  15           H        GLY  15  11.290   1.038   3.593
  129    HA2  GLY  15           HA2      GLY  15   9.870   0.056   5.207
  130    HA3  GLY  15           HA3      GLY  15  10.049   1.445   6.271
  131    H    THR  16           H        THR  16   9.498   2.495   3.029
  132    HA   THR  16           HA       THR  16   6.975   3.648   3.637
  133    HB   THR  16           HB       THR  16   8.018   3.013   0.850
  134    HG1  THR  16           HG1      THR  16   9.605   4.157   1.843
  135   HG21  THR  16          HG21      THR  16   5.677   3.768   0.891
  136   HG22  THR  16          HG22      THR  16   6.137   5.164   1.894
  137   HG23  THR  16          HG23      THR  16   6.736   5.024   0.227
  138    H    VAL  17           H        VAL  17   5.090   2.549   4.026
  139    HA   VAL  17           HA       VAL  17   4.664  -0.089   2.834
  140    HB   VAL  17           HB       VAL  17   3.019   1.638   4.690
  141   HG11  VAL  17          HG11      VAL  17   1.330   0.483   3.339
  142   HG12  VAL  17          HG12      VAL  17   2.184  -1.065   3.548
  143   HG13  VAL  17          HG13      VAL  17   1.429  -0.255   4.936
  144   HG21  VAL  17          HG21      VAL  17   4.978   0.363   5.589
  145   HG22  VAL  17          HG22      VAL  17   3.446  -0.243   6.240
  146   HG23  VAL  17          HG23      VAL  17   4.268  -1.138   4.941
  147    H    TYR  18           H        TYR  18   3.135  -0.687   1.391
  148    HA   TYR  18           HA       TYR  18   1.671   1.275  -0.208
  149    HB2  TYR  18           HB2      TYR  18   2.878   1.070  -2.204
  150    HB3  TYR  18           HB3      TYR  18   4.085   1.386  -0.985
  151    HD1  TYR  18           HD1      TYR  18   5.562  -0.511  -0.172
  152    HD2  TYR  18           HD2      TYR  18   3.018  -0.774  -3.625
  153    HE1  TYR  18           HE1      TYR  18   6.914  -2.460  -1.036
  154    HE2  TYR  18           HE2      TYR  18   4.315  -2.717  -4.468
  155    HH   TYR  18           HH       TYR  18   6.138  -4.056  -4.118
  156    H    TYR  19           H        TYR  19   0.891  -0.245  -2.378
  157    HA   TYR  19           HA       TYR  19   0.222  -2.934  -1.283
  158    HB2  TYR  19           HB2      TYR  19  -1.624  -0.803  -2.208
  159    HB3  TYR  19           HB3      TYR  19  -1.951  -2.403  -2.800
  160    HD1  TYR  19           HD1      TYR  19  -1.265  -0.677   0.527
  161    HD2  TYR  19           HD2      TYR  19  -3.286  -3.826  -1.587
  162    HE1  TYR  19           HE1      TYR  19  -2.441  -1.324   2.595
  163    HE2  TYR  19           HE2      TYR  19  -4.601  -4.360   0.435
  164    HH   TYR  19           HH       TYR  19  -5.238  -3.478   2.518
  165    H    PHE  20           H        PHE  20  -0.113  -4.539  -2.659
  166    HA   PHE  20           HA       PHE  20   1.061  -4.359  -5.405
  167    HB2  PHE  20           HB2      PHE  20   2.756  -4.995  -3.777
  168    HB3  PHE  20           HB3      PHE  20   1.679  -6.218  -3.093
  169    HD1  PHE  20           HD2      PHE  20   3.655  -5.330  -6.112
  170    HD2  PHE  20           HD1      PHE  20   1.586  -8.458  -3.983
  171    HE1  PHE  20           HE2      PHE  20   4.713  -7.026  -7.582
  172    HE2  PHE  20           HE1      PHE  20   2.699 -10.153  -5.420
  173    HZ   PHE  20           HZ       PHE  20   4.246  -9.445  -7.219
  174    H    ASN  21           H        ASN  21  -0.207  -5.328  -6.879
  175    HA   ASN  21           HA       ASN  21  -2.461  -7.011  -6.079
  176    HB2  ASN  21           HB2      ASN  21  -2.570  -5.338  -7.971
  177    HB3  ASN  21           HB3      ASN  21  -1.431  -6.339  -8.835
  178   HD21  ASN  21          HD22      ASN  21  -4.783  -6.068  -7.675
  179   HD22  ASN  21          HD21      ASN  21  -5.323  -7.542  -8.464
  180    H    HIS  22           H        HIS  22  -1.771  -8.918  -5.222
  181    HA   HIS  22           HA       HIS  22   0.556 -10.296  -6.174
  182    HB2  HIS  22           HB2      HIS  22   0.205 -11.756  -4.412
  183    HB3  HIS  22           HB3      HIS  22  -0.450 -10.247  -3.817
  184    HD1  HIS  22           HD1      HIS  22  -1.844 -13.399  -5.565
  185    HD2  HIS  22           HD2      HIS  22  -2.834 -10.478  -2.713
  186    HE1  HIS  22           HE1      HIS  22  -4.140 -14.081  -4.561
  187    H    ILE  23           H        ILE  23  -2.198 -10.026  -7.898
  188    HA   ILE  23           HA       ILE  23  -2.173 -12.823  -8.936
  189    HB   ILE  23           HB       ILE  23  -4.252 -10.615  -9.198
  190   HG12  ILE  23          HG12      ILE  23  -4.224 -13.153  -7.496
  191   HG13  ILE  23          HG13      ILE  23  -4.134 -11.499  -6.896
  192   HG21  ILE  23          HG21      ILE  23  -4.386 -13.530 -10.074
  193   HG22  ILE  23          HG22      ILE  23  -5.698 -12.334 -10.195
  194   HG23  ILE  23          HG23      ILE  23  -4.251 -12.129 -11.162
  195   HD11  ILE  23          HD11      ILE  23  -6.345 -12.225  -6.506
  196   HD12  ILE  23          HD12      ILE  23  -6.430 -11.078  -7.860
  197   HD13  ILE  23          HD13      ILE  23  -6.544 -12.832  -8.154
  198    H    THR  24           H        THR  24  -1.516  -9.468  -9.704
  199    HA   THR  24           HA       THR  24  -0.771 -10.192 -12.525
  200    HB   THR  24           HB       THR  24  -1.166  -7.823 -13.067
  201    HG1  THR  24           HG1      THR  24  -2.258  -7.667 -10.473
  202   HG21  THR  24          HG21      THR  24  -3.581  -9.018 -11.627
  203   HG22  THR  24          HG22      THR  24  -3.596  -7.725 -12.838
  204   HG23  THR  24          HG23      THR  24  -3.097  -9.368 -13.303
  205    H    ASN  25           H        ASN  25   0.460  -8.784  -9.566
  206    HA   ASN  25           HA       ASN  25   2.460  -8.192  -8.870
  207    HB2  ASN  25           HB2      ASN  25   3.618  -8.187 -11.664
  208    HB3  ASN  25           HB3      ASN  25   4.486  -8.064 -10.149
  209   HD21  ASN  25          HD22      ASN  25   2.734 -10.236 -12.264
  210   HD22  ASN  25          HD21      ASN  25   3.360 -11.719 -11.509
  211    H    ALA  26           H        ALA  26   0.280  -6.419 -10.578
  212    HA   ALA  26           HA       ALA  26   1.627  -3.960 -11.023
  213    HB1  ALA  26           HB1      ALA  26  -0.608  -2.970 -10.917
  214    HB2  ALA  26           HB2      ALA  26  -0.661  -4.496 -11.819
  215    HB3  ALA  26           HB3      ALA  26  -1.253  -4.429 -10.145
  216    H    SER  27           H        SER  27   1.791  -2.034  -9.706
  217    HA   SER  27           HA       SER  27   1.802  -2.478  -6.755
  218    HB2  SER  27           HB2      SER  27   4.111  -1.543  -8.504
  219    HB3  SER  27           HB3      SER  27   4.076  -1.476  -6.733
  220    HG   SER  27           HG       SER  27   3.797  -3.856  -8.284
  221    H    GLN  28           H        GLN  28   0.987  -0.734  -5.668
  222    HA   GLN  28           HA       GLN  28   1.085   1.979  -6.833
  223    HB2  GLN  28           HB2      GLN  28  -1.437   0.370  -6.281
  224    HB3  GLN  28           HB3      GLN  28  -1.437   2.113  -6.048
  225    HG2  GLN  28           HG2      GLN  28  -0.771   2.511  -8.361
  226    HG3  GLN  28           HG3      GLN  28  -0.625   0.777  -8.660
  227   HE21  GLN  28          HE22      GLN  28  -3.092   3.381  -7.875
  228   HE22  GLN  28          HE21      GLN  28  -4.364   2.411  -8.626
  229    H    PHE  29           H        PHE  29   0.445   3.631  -5.124
  230    HA   PHE  29           HA       PHE  29   1.391   2.695  -2.447
  231    HB2  PHE  29           HB2      PHE  29   0.975   5.478  -3.551
  232    HB3  PHE  29           HB3      PHE  29   1.582   5.082  -1.945
  233    HD1  PHE  29           HD2      PHE  29   3.649   3.317  -1.976
  234    HD2  PHE  29           HD1      PHE  29   2.599   5.985  -5.195
  235    HE1  PHE  29           HE2      PHE  29   5.961   3.159  -2.857
  236    HE2  PHE  29           HE1      PHE  29   4.916   5.826  -6.075
  237    HZ   PHE  29           HZ       PHE  29   6.599   4.414  -4.909
  238    H    GLU  30           H        GLU  30  -1.362   3.793  -4.231
  239    HA   GLU  30           HA       GLU  30  -3.139   4.348  -2.082
  240    HB2  GLU  30           HB2      GLU  30  -3.931   3.234  -4.790
  241    HB3  GLU  30           HB3      GLU  30  -4.841   4.299  -3.728
  242    HG2  GLU  30           HG2      GLU  30  -4.147   5.808  -5.314
  243    HG3  GLU  30           HG3      GLU  30  -2.847   5.998  -4.147
  244    H    ARG  31           H        ARG  31  -4.187   3.084  -0.786
  245    HA   ARG  31           HA       ARG  31  -3.696   0.219  -0.644
  246    HB2  ARG  31           HB2      ARG  31  -3.041   1.542   1.147
  247    HB3  ARG  31           HB3      ARG  31  -4.497   2.494   1.182
  248    HG2  ARG  31           HG2      ARG  31  -4.911  -0.388   1.726
  249    HG3  ARG  31           HG3      ARG  31  -3.810   0.384   2.834
  250    HD2  ARG  31           HD2      ARG  31  -6.267   0.388   3.572
  251    HD3  ARG  31           HD3      ARG  31  -5.270   1.823   3.783
  252    HE   ARG  31           HE       ARG  31  -6.987   1.653   1.356
  253   HH11  ARG  31          HH11      ARG  31  -6.198   3.501   4.214
  254   HH12  ARG  31          HH12      ARG  31  -7.157   4.860   3.685
  255   HH21  ARG  31          HH21      ARG  31  -8.460   3.218   0.906
  256   HH22  ARG  31          HH22      ARG  31  -8.330   4.723   1.781
  257    HA   PRO  32           HA       PRO  32  -7.844   0.014  -2.282
  258    HB2  PRO  32           HB2      PRO  32  -7.372  -2.921  -2.902
  259    HB3  PRO  32           HB3      PRO  32  -8.096  -1.656  -3.770
  260    HG2  PRO  32           HG2      PRO  32  -5.631  -2.299  -4.372
  261    HG3  PRO  32           HG3      PRO  32  -5.915  -0.606  -4.249
  262    HD2  PRO  32           HD2      PRO  32  -4.978  -2.324  -1.952
  263    HD3  PRO  32           HD3      PRO  32  -4.195  -0.842  -2.564
  264    H    SER  33           H        SER  33  -6.895  -1.919   0.097
  265    HA   SER  33           HA       SER  33  -9.242  -3.300   1.001
  266    HB2  SER  33           HB2      SER  33  -7.177  -1.982   2.811
  267    HB3  SER  33           HB3      SER  33  -8.305  -3.271   3.268
  268    HG   SER  33           HG       SER  33  -7.266  -4.623   1.755
  269    H    GLY  34           H        GLY  34  -8.350   0.082   1.363
  270    HA2  GLY  34           HA2      GLY  34 -10.997   0.803   2.559
  271    HA3  GLY  34           HA3      GLY  34  -9.559   1.809   2.608
  Start of MODEL   15
    1    H1   LYS   1           H1       LYS   1  -9.192  -4.726   4.585
    2    H2   LYS   1           H2       LYS   1 -10.396  -4.079   3.641
    3    H3   LYS   1           H3       LYS   1  -8.870  -3.468   3.587
    4    HA   LYS   1           HA       LYS   1  -7.980  -5.301   2.539
    5    HB2  LYS   1           HB2      LYS   1  -9.315  -6.943   3.893
    6    HB3  LYS   1           HB3      LYS   1 -10.693  -6.650   2.838
    7    HG2  LYS   1           HG2      LYS   1  -9.536  -8.737   2.300
    8    HG3  LYS   1           HG3      LYS   1  -9.493  -7.631   0.937
    9    HD2  LYS   1           HD2      LYS   1  -7.135  -7.056   1.472
   10    HD3  LYS   1           HD3      LYS   1  -7.181  -8.118   2.885
   11    HE2  LYS   1           HE2      LYS   1  -7.480 -10.067   1.516
   12    HE3  LYS   1           HE3      LYS   1  -7.771  -9.100   0.062
   13    HZ1  LYS   1           HZ1      LYS   1  -5.451 -10.078   0.351
   14    HZ2  LYS   1           HZ2      LYS   1  -5.508  -8.494  -0.045
   15    HZ3  LYS   1           HZ3      LYS   1  -5.167  -8.920   1.493
   16    H    LEU   2           H        LEU   2  -8.316  -5.887   0.211
   17    HA   LEU   2           HA       LEU   2  -9.901  -3.871  -1.244
   18    HB2  LEU   2           HB2      LEU   2  -7.483  -4.288  -2.614
   19    HB3  LEU   2           HB3      LEU   2  -8.069  -2.852  -1.884
   20    HG   LEU   2           HG       LEU   2  -5.708  -3.474  -1.474
   21   HD11  LEU   2          HD11      LEU   2  -6.777  -1.751  -0.232
   22   HD12  LEU   2          HD12      LEU   2  -7.455  -2.933   0.918
   23   HD13  LEU   2          HD13      LEU   2  -5.707  -2.662   0.833
   24   HD21  LEU   2          HD21      LEU   2  -4.994  -5.250  -0.432
   25   HD22  LEU   2          HD22      LEU   2  -6.209  -5.148   0.847
   26   HD23  LEU   2          HD23      LEU   2  -6.566  -5.956  -0.719
   27    HA   PRO   3           HA       PRO   3 -11.126  -6.748  -4.237
   28    HB2  PRO   3           HB2      PRO   3  -9.379  -5.615  -6.424
   29    HB3  PRO   3           HB3      PRO   3 -11.136  -5.949  -6.446
   30    HG2  PRO   3           HG2      PRO   3 -10.244  -3.420  -6.131
   31    HG3  PRO   3           HG3      PRO   3 -11.618  -4.026  -5.148
   32    HD2  PRO   3           HD2      PRO   3  -8.721  -3.727  -4.362
   33    HD3  PRO   3           HD3      PRO   3 -10.187  -3.320  -3.449
   34    HA   PRO   4           HA       PRO   4  -8.924 -10.426  -4.649
   35    HB2  PRO   4           HB2      PRO   4  -9.289 -10.431  -7.639
   36    HB3  PRO   4           HB3      PRO   4  -9.508 -11.778  -6.480
   37    HG2  PRO   4           HG2      PRO   4 -11.670 -10.395  -7.339
   38    HG3  PRO   4           HG3      PRO   4 -11.510 -10.810  -5.601
   39    HD2  PRO   4           HD2      PRO   4 -10.952  -8.185  -6.973
   40    HD3  PRO   4           HD3      PRO   4 -11.745  -8.496  -5.398
   41    H    GLY   5           H        GLY   5  -6.911 -10.813  -4.388
   42    HA2  GLY   5           HA2      GLY   5  -4.683 -11.207  -4.922
   43    HA3  GLY   5           HA3      GLY   5  -4.844 -10.224  -6.380
   44    H    TRP   6           H        TRP   6  -6.033  -7.905  -4.412
   45    HA   TRP   6           HA       TRP   6  -3.387  -6.716  -4.145
   46    HB2  TRP   6           HB2      TRP   6  -6.052  -5.750  -3.119
   47    HB3  TRP   6           HB3      TRP   6  -4.542  -4.884  -3.015
   48    HD1  TRP   6           HD1      TRP   6  -7.383  -5.489  -5.316
   49    HE1  TRP   6           HE1      TRP   6  -7.098  -4.037  -7.403
   50    HE3  TRP   6           HE3      TRP   6  -2.576  -4.029  -4.563
   51    HZ2  TRP   6           HZ2      TRP   6  -4.909  -2.619  -8.734
   52    HZ3  TRP   6           HZ3      TRP   6  -1.448  -2.554  -6.168
   53    HH2  TRP   6           HH2      TRP   6  -2.564  -1.904  -8.310
   54    H    GLU   7           H        GLU   7  -1.950  -6.897  -2.537
   55    HA   GLU   7           HA       GLU   7  -2.944  -6.780   0.181
   56    HB2  GLU   7           HB2      GLU   7  -2.814  -9.238  -0.262
   57    HB3  GLU   7           HB3      GLU   7  -1.085  -9.074  -0.546
   58    HG2  GLU   7           HG2      GLU   7  -1.782  -9.899   1.755
   59    HG3  GLU   7           HG3      GLU   7  -0.665  -8.547   1.742
   60    H    LYS   8           H        LYS   8  -1.214  -6.386   1.724
   61    HA   LYS   8           HA       LYS   8   0.108  -4.022   0.976
   62    HB2  LYS   8           HB2      LYS   8  -1.151  -4.720   2.945
   63    HB3  LYS   8           HB3      LYS   8   0.183  -5.788   3.443
   64    HG2  LYS   8           HG2      LYS   8   1.549  -3.640   3.704
   65    HG3  LYS   8           HG3      LYS   8   0.044  -2.757   3.383
   66    HD2  LYS   8           HD2      LYS   8   0.558  -4.724   5.671
   67    HD3  LYS   8           HD3      LYS   8   0.307  -2.990   5.785
   68    HE2  LYS   8           HE2      LYS   8  -1.742  -3.783   6.470
   69    HE3  LYS   8           HE3      LYS   8  -2.049  -3.424   4.775
   70    HZ1  LYS   8           HZ1      LYS   8  -1.907  -5.851   4.296
   71    HZ2  LYS   8           HZ2      LYS   8  -1.475  -6.142   5.850
   72    HZ3  LYS   8           HZ3      LYS   8  -2.969  -5.568   5.476
   73    H    ARG   9           H        ARG   9   2.156  -3.455   0.965
   74    HA   ARG   9           HA       ARG   9   4.387  -5.411   1.328
   75    HB2  ARG   9           HB2      ARG   9   3.934  -3.695  -1.153
   76    HB3  ARG   9           HB3      ARG   9   5.458  -4.512  -0.799
   77    HG2  ARG   9           HG2      ARG   9   2.793  -5.898  -1.285
   78    HG3  ARG   9           HG3      ARG   9   4.098  -5.687  -2.454
   79    HD2  ARG   9           HD2      ARG   9   5.617  -7.063  -1.110
   80    HD3  ARG   9           HD3      ARG   9   4.400  -7.208   0.162
   81    HE   ARG   9           HE       ARG   9   3.343  -8.845  -0.972
   82   HH11  ARG   9          HH21      ARG   9   5.352  -7.253  -3.366
   83   HH12  ARG   9          HH22      ARG   9   4.918  -8.368  -4.634
   84   HH21  ARG   9          HH11      ARG   9   2.966 -10.362  -2.575
   85   HH22  ARG   9          HH12      ARG   9   3.675 -10.135  -4.151
   86    H    MET  10           H        MET  10   6.570  -4.255   1.316
   87    HA   MET  10           HA       MET  10   6.358  -1.521   2.445
   88    HB2  MET  10           HB2      MET  10   6.280  -3.206   4.283
   89    HB3  MET  10           HB3      MET  10   7.849  -3.830   3.747
   90    HG2  MET  10           HG2      MET  10   8.843  -1.585   4.119
   91    HG3  MET  10           HG3      MET  10   7.279  -0.980   4.658
   92    HE1  MET  10           HE1      MET  10   6.813  -2.374   8.171
   93    HE2  MET  10           HE2      MET  10   6.462  -1.043   7.049
   94    HE3  MET  10           HE3      MET  10   5.969  -2.706   6.642
   95    H    PHE  11           H        PHE  11   7.920  -0.155   1.819
   96    HA   PHE  11           HA       PHE  11   9.830  -0.998  -0.164
   97    HB2  PHE  11           HB2      PHE  11   8.494   1.159  -0.103
   98    HB3  PHE  11           HB3      PHE  11   9.582   1.713   1.157
   99    HD1  PHE  11           HD2      PHE  11  12.028   2.050   0.632
  100    HD2  PHE  11           HD1      PHE  11   9.184   0.984  -2.425
  101    HE1  PHE  11           HE2      PHE  11  13.629   2.784  -1.110
  102    HE2  PHE  11           HE1      PHE  11  10.797   1.695  -4.170
  103    HZ   PHE  11           HZ       PHE  11  13.019   2.603  -3.520
  104    H    ARG  12           H        ARG  12  11.400  -2.274   0.601
  105    HA   ARG  12           HA       ARG  12  12.918  -2.206   2.878
  106    HB2  ARG  12           HB2      ARG  12  14.511  -3.474   1.764
  107    HB3  ARG  12           HB3      ARG  12  13.032  -3.812   0.885
  108    HG2  ARG  12           HG2      ARG  12  15.341  -2.022   0.033
  109    HG3  ARG  12           HG3      ARG  12  14.920  -3.586  -0.635
  110    HD2  ARG  12           HD2      ARG  12  12.905  -2.726  -1.660
  111    HD3  ARG  12           HD3      ARG  12  13.080  -1.159  -0.876
  112    HE   ARG  12           HE       ARG  12  14.422  -2.057  -3.259
  113   HH11  ARG  12          HH11      ARG  12  14.786   0.211  -0.557
  114   HH12  ARG  12          HH12      ARG  12  16.009   1.125  -1.396
  115   HH21  ARG  12          HH21      ARG  12  15.895  -0.747  -4.307
  116   HH22  ARG  12          HH22      ARG  12  16.528   0.656  -3.502
  117    H    SER  13           H        SER  13  14.650  -1.167   3.707
  118    HA   SER  13           HA       SER  13  16.284   0.319   4.092
  119    HB2  SER  13           HB2      SER  13  15.951   1.595   1.370
  120    HB3  SER  13           HB3      SER  13  17.328   1.702   2.465
  121    HG   SER  13           HG       SER  13  17.796  -0.439   2.075
  122    H    ASN  14           H        ASN  14  13.048   1.334   3.430
  123    HA   ASN  14           HA       ASN  14  13.592   3.454   5.408
  124    HB2  ASN  14           HB2      ASN  14  12.383   5.193   4.289
  125    HB3  ASN  14           HB3      ASN  14  13.716   4.642   3.287
  126   HD21  ASN  14          HD22      ASN  14  12.919   5.224   1.234
  127   HD22  ASN  14          HD21      ASN  14  11.413   4.571   0.623
  128    H    GLY  15           H        GLY  15  11.237   1.165   4.065
  129    HA2  GLY  15           HA2      GLY  15   9.810   0.008   5.510
  130    HA3  GLY  15           HA3      GLY  15   9.864   1.313   6.688
  131    H    THR  16           H        THR  16   9.331   2.595   3.550
  132    HA   THR  16           HA       THR  16   6.718   3.522   4.171
  133    HB   THR  16           HB       THR  16   7.901   3.254   1.377
  134    HG1  THR  16           HG1      THR  16   9.334   4.377   2.607
  135   HG21  THR  16          HG21      THR  16   5.796   5.104   2.581
  136   HG22  THR  16          HG22      THR  16   6.484   5.262   0.954
  137   HG23  THR  16          HG23      THR  16   5.515   3.832   1.368
  138    H    VAL  17           H        VAL  17   4.889   2.313   4.332
  139    HA   VAL  17           HA       VAL  17   4.686  -0.246   2.957
  140    HB   VAL  17           HB       VAL  17   2.810   1.316   4.745
  141   HG11  VAL  17          HG11      VAL  17   1.334  -0.684   4.824
  142   HG12  VAL  17          HG12      VAL  17   1.293   0.108   3.250
  143   HG13  VAL  17          HG13      VAL  17   2.237  -1.380   3.464
  144   HG21  VAL  17          HG21      VAL  17   4.225  -1.377   5.032
  145   HG22  VAL  17          HG22      VAL  17   4.769   0.147   5.774
  146   HG23  VAL  17          HG23      VAL  17   3.238  -0.582   6.280
  147    H    TYR  18           H        TYR  18   3.322  -0.840   1.364
  148    HA   TYR  18           HA       TYR  18   1.682   1.040  -0.160
  149    HB2  TYR  18           HB2      TYR  18   2.832   0.819  -2.234
  150    HB3  TYR  18           HB3      TYR  18   3.961   1.429  -1.055
  151    HD1  TYR  18           HD1      TYR  18   5.835  -0.015  -0.238
  152    HD2  TYR  18           HD2      TYR  18   3.163  -1.280  -3.386
  153    HE1  TYR  18           HE1      TYR  18   7.496  -1.719  -0.989
  154    HE2  TYR  18           HE2      TYR  18   4.818  -2.972  -4.116
  155    HH   TYR  18           HH       TYR  18   7.963  -3.380  -2.477
  156    H    TYR  19           H        TYR  19   1.029  -0.538  -2.377
  157    HA   TYR  19           HA       TYR  19   0.454  -3.248  -1.271
  158    HB2  TYR  19           HB2      TYR  19  -1.501  -1.156  -2.180
  159    HB3  TYR  19           HB3      TYR  19  -1.830  -2.827  -2.558
  160    HD1  TYR  19           HD1      TYR  19  -0.996  -0.644   0.395
  161    HD2  TYR  19           HD2      TYR  19  -2.797  -4.282  -1.009
  162    HE1  TYR  19           HE1      TYR  19  -2.169  -0.916   2.589
  163    HE2  TYR  19           HE2      TYR  19  -3.798  -4.644   1.271
  164    HH   TYR  19           HH       TYR  19  -4.500  -2.305   3.309
  165    H    PHE  20           H        PHE  20  -0.041  -4.854  -2.723
  166    HA   PHE  20           HA       PHE  20   0.803  -4.473  -5.550
  167    HB2  PHE  20           HB2      PHE  20   2.718  -5.067  -4.222
  168    HB3  PHE  20           HB3      PHE  20   1.860  -6.421  -3.479
  169    HD1  PHE  20           HD2      PHE  20   1.448  -8.533  -4.773
  170    HD2  PHE  20           HD1      PHE  20   3.697  -5.226  -6.404
  171    HE1  PHE  20           HE2      PHE  20   2.513 -10.050  -6.444
  172    HE2  PHE  20           HE1      PHE  20   4.654  -6.738  -8.134
  173    HZ   PHE  20           HZ       PHE  20   4.057  -9.167  -8.123
  174    H    ASN  21           H        ASN  21  -0.448  -5.640  -6.958
  175    HA   ASN  21           HA       ASN  21  -2.557  -7.406  -5.921
  176    HB2  ASN  21           HB2      ASN  21  -3.050  -5.643  -7.672
  177    HB3  ASN  21           HB3      ASN  21  -2.000  -6.518  -8.756
  178   HD21  ASN  21          HD22      ASN  21  -5.115  -6.535  -7.059
  179   HD22  ASN  21          HD21      ASN  21  -5.709  -8.042  -7.706
  180    H    HIS  22           H        HIS  22  -1.656  -9.324  -5.320
  181    HA   HIS  22           HA       HIS  22   0.515 -10.546  -6.763
  182    HB2  HIS  22           HB2      HIS  22   0.597 -12.042  -4.977
  183    HB3  HIS  22           HB3      HIS  22   0.078 -10.543  -4.249
  184    HD1  HIS  22           HD1      HIS  22  -1.712 -13.653  -5.671
  185    HD2  HIS  22           HD2      HIS  22  -1.898 -10.852  -2.539
  186    HE1  HIS  22           HE1      HIS  22  -3.693 -14.363  -4.145
  187    H    ILE  23           H        ILE  23  -2.436 -10.335  -8.003
  188    HA   ILE  23           HA       ILE  23  -2.359 -13.090  -9.180
  189    HB   ILE  23           HB       ILE  23  -4.604 -11.056  -8.967
  190   HG12  ILE  23          HG12      ILE  23  -4.293 -13.925  -7.944
  191   HG13  ILE  23          HG13      ILE  23  -4.151 -12.473  -6.962
  192   HG21  ILE  23          HG21      ILE  23  -4.594 -13.684 -10.521
  193   HG22  ILE  23          HG22      ILE  23  -6.022 -12.664 -10.225
  194   HG23  ILE  23          HG23      ILE  23  -4.718 -12.055 -11.219
  195   HD11  ILE  23          HD11      ILE  23  -6.562 -11.921  -7.590
  196   HD12  ILE  23          HD12      ILE  23  -6.667 -13.572  -8.246
  197   HD13  ILE  23          HD13      ILE  23  -6.310 -13.325  -6.531
  198    H    THR  24           H        THR  24  -2.082  -9.641  -9.816
  199    HA   THR  24           HA       THR  24  -1.632 -10.177 -12.739
  200    HB   THR  24           HB       THR  24  -2.160  -7.786 -13.045
  201    HG1  THR  24           HG1      THR  24  -2.921  -7.837 -10.332
  202   HG21  THR  24          HG21      THR  24  -4.321  -9.182 -11.398
  203   HG22  THR  24          HG22      THR  24  -4.541  -7.804 -12.488
  204   HG23  THR  24          HG23      THR  24  -4.058  -9.382 -13.145
  205    H    ASN  25           H        ASN  25  -0.083  -8.917  -9.880
  206    HA   ASN  25           HA       ASN  25   1.937  -8.246  -9.373
  207    HB2  ASN  25           HB2      ASN  25   2.840  -8.233 -12.258
  208    HB3  ASN  25           HB3      ASN  25   3.839  -8.146 -10.820
  209   HD21  ASN  25          HD22      ASN  25   1.886 -10.252 -12.821
  210   HD22  ASN  25          HD21      ASN  25   2.523 -11.758 -12.129
  211    H    ALA  26           H        ALA  26  -0.446  -6.488 -10.641
  212    HA   ALA  26           HA       ALA  26   0.870  -3.973 -11.167
  213    HB1  ALA  26           HB1      ALA  26  -1.366  -3.031 -10.782
  214    HB2  ALA  26           HB2      ALA  26  -1.482  -4.481 -11.796
  215    HB3  ALA  26           HB3      ALA  26  -1.921  -4.560 -10.075
  216    H    SER  27           H        SER  27   0.872  -2.053  -9.629
  217    HA   SER  27           HA       SER  27   0.661  -2.716  -6.781
  218    HB2  SER  27           HB2      SER  27   3.002  -3.248  -7.400
  219    HB3  SER  27           HB3      SER  27   3.223  -1.574  -7.935
  220    HG   SER  27           HG       SER  27   2.235  -2.115  -5.309
  221    H    GLN  28           H        GLN  28   0.509  -0.837  -5.423
  222    HA   GLN  28           HA       GLN  28   0.311   1.828  -6.656
  223    HB2  GLN  28           HB2      GLN  28  -1.981   0.374  -5.248
  224    HB3  GLN  28           HB3      GLN  28  -1.882   2.129  -5.369
  225    HG2  GLN  28           HG2      GLN  28  -1.888   1.999  -7.832
  226    HG3  GLN  28           HG3      GLN  28  -2.044   0.241  -7.738
  227   HE21  GLN  28          HE22      GLN  28  -3.706   3.353  -7.113
  228   HE22  GLN  28          HE21      GLN  28  -5.306   2.585  -6.995
  229    H    PHE  29           H        PHE  29   0.478   3.489  -5.055
  230    HA   PHE  29           HA       PHE  29   1.476   2.568  -2.376
  231    HB2  PHE  29           HB2      PHE  29   2.008   5.025  -4.017
  232    HB3  PHE  29           HB3      PHE  29   2.004   5.140  -2.262
  233    HD1  PHE  29           HD1      PHE  29   3.334   2.592  -4.760
  234    HD2  PHE  29           HD2      PHE  29   4.121   5.034  -1.284
  235    HE1  PHE  29           HE1      PHE  29   5.596   1.623  -4.588
  236    HE2  PHE  29           HE2      PHE  29   6.401   4.065  -1.142
  237    HZ   PHE  29           HZ       PHE  29   7.136   2.356  -2.780
  238    H    GLU  30           H        GLU  30  -1.096   4.046  -4.111
  239    HA   GLU  30           HA       GLU  30  -2.686   4.937  -1.855
  240    HB2  GLU  30           HB2      GLU  30  -3.933   3.997  -4.431
  241    HB3  GLU  30           HB3      GLU  30  -4.324   5.371  -3.418
  242    HG2  GLU  30           HG2      GLU  30  -3.508   6.384  -5.334
  243    HG3  GLU  30           HG3      GLU  30  -2.076   6.400  -4.312
  244    H    ARG  31           H        ARG  31  -4.002   3.543  -0.534
  245    HA   ARG  31           HA       ARG  31  -3.756   0.642  -1.010
  246    HB2  ARG  31           HB2      ARG  31  -5.309   2.042   1.213
  247    HB3  ARG  31           HB3      ARG  31  -4.881   0.330   1.078
  248    HG2  ARG  31           HG2      ARG  31  -3.315   1.047   2.573
  249    HG3  ARG  31           HG3      ARG  31  -2.431   1.090   1.055
  250    HD2  ARG  31           HD2      ARG  31  -3.601   3.687   1.427
  251    HD3  ARG  31           HD3      ARG  31  -2.933   3.205   2.977
  252    HE   ARG  31           HE       ARG  31  -1.432   3.649   0.434
  253   HH11  ARG  31          HH11      ARG  31  -1.057   2.507   3.747
  254   HH12  ARG  31          HH12      ARG  31   0.685   2.676   3.630
  255   HH21  ARG  31          HH21      ARG  31   0.583   3.772   0.368
  256   HH22  ARG  31          HH22      ARG  31   1.656   3.195   1.639
  257    HA   PRO  32           HA       PRO  32  -7.399   1.306  -3.537
  258    HB2  PRO  32           HB2      PRO  32  -7.672  -1.046  -4.769
  259    HB3  PRO  32           HB3      PRO  32  -6.344   0.115  -5.000
  260    HG2  PRO  32           HG2      PRO  32  -6.316  -2.377  -3.284
  261    HG3  PRO  32           HG3      PRO  32  -5.117  -1.965  -4.480
  262    HD2  PRO  32           HD2      PRO  32  -4.791  -1.330  -1.835
  263    HD3  PRO  32           HD3      PRO  32  -4.196  -0.265  -3.136
  264    H    SER  33           H        SER  33  -8.033   1.219  -1.388
  265    HA   SER  33           HA       SER  33 -10.529   1.040  -0.420
  266    HB2  SER  33           HB2      SER  33 -11.000  -1.187  -1.128
  267    HB3  SER  33           HB3      SER  33  -9.521  -1.805  -0.372
  268    HG   SER  33           HG       SER  33 -10.913  -2.342   1.074
  269    H    GLY  34           H        GLY  34  -8.022  -1.066   1.074
  270    HA2  GLY  34           HA2      GLY  34  -6.720   0.663   2.822
  271    HA3  GLY  34           HA3      GLY  34  -8.205   0.162   3.646
  Start of MODEL   16
    1    H1   LYS   1           H1       LYS   1 -11.371 -10.592   1.559
    2    H2   LYS   1           H2       LYS   1 -11.073 -10.457  -0.062
    3    H3   LYS   1           H3       LYS   1 -12.263  -9.562   0.613
    4    HA   LYS   1           HA       LYS   1 -10.674  -8.368   1.962
    5    HB2  LYS   1           HB2      LYS   1  -8.301  -8.528   1.461
    6    HB3  LYS   1           HB3      LYS   1  -8.918 -10.059   2.044
    7    HG2  LYS   1           HG2      LYS   1  -8.819 -11.064  -0.153
    8    HG3  LYS   1           HG3      LYS   1  -8.516  -9.502  -0.926
    9    HD2  LYS   1           HD2      LYS   1  -6.365  -9.301   0.264
   10    HD3  LYS   1           HD3      LYS   1  -6.614 -10.892   1.005
   11    HE2  LYS   1           HE2      LYS   1  -6.499 -12.005  -1.135
   12    HE3  LYS   1           HE3      LYS   1  -6.610 -10.465  -2.009
   13    HZ1  LYS   1           HZ1      LYS   1  -4.496  -9.833  -1.220
   14    HZ2  LYS   1           HZ2      LYS   1  -4.339 -11.159  -0.251
   15    HZ3  LYS   1           HZ3      LYS   1  -4.296 -11.349  -1.880
   16    H    LEU   2           H        LEU   2  -8.676  -7.080   0.175
   17    HA   LEU   2           HA       LEU   2 -10.276  -5.351  -1.443
   18    HB2  LEU   2           HB2      LEU   2  -7.289  -5.994  -1.320
   19    HB3  LEU   2           HB3      LEU   2  -7.989  -4.651  -2.197
   20    HG   LEU   2           HG       LEU   2  -8.987  -3.955   0.159
   21   HD11  LEU   2          HD11      LEU   2  -7.269  -4.395   1.962
   22   HD12  LEU   2          HD12      LEU   2  -8.242  -5.794   1.572
   23   HD13  LEU   2          HD13      LEU   2  -6.577  -5.668   0.940
   24   HD21  LEU   2          HD21      LEU   2  -6.873  -2.637   0.522
   25   HD22  LEU   2          HD22      LEU   2  -6.104  -3.637  -0.742
   26   HD23  LEU   2          HD23      LEU   2  -7.478  -2.604  -1.133
   27    HA   PRO   3           HA       PRO   3 -10.805  -7.394  -5.209
   28    HB2  PRO   3           HB2      PRO   3  -8.888  -5.768  -6.868
   29    HB3  PRO   3           HB3      PRO   3 -10.616  -6.113  -7.148
   30    HG2  PRO   3           HG2      PRO   3  -9.830  -3.701  -6.177
   31    HG3  PRO   3           HG3      PRO   3 -11.298  -4.512  -5.542
   32    HD2  PRO   3           HD2      PRO   3  -8.533  -4.414  -4.338
   33    HD3  PRO   3           HD3      PRO   3 -10.108  -4.192  -3.559
   34    HA   PRO   4           HA       PRO   4  -8.431 -10.856  -5.750
   35    HB2  PRO   4           HB2      PRO   4  -8.292 -10.563  -8.723
   36    HB3  PRO   4           HB3      PRO   4  -8.704 -12.011  -7.759
   37    HG2  PRO   4           HG2      PRO   4 -10.688 -10.513  -8.865
   38    HG3  PRO   4           HG3      PRO   4 -10.850 -11.150  -7.199
   39    HD2  PRO   4           HD2      PRO   4 -10.152  -8.362  -8.087
   40    HD3  PRO   4           HD3      PRO   4 -11.164  -8.902  -6.715
   41    H    GLY   5           H        GLY   5  -6.545 -10.924  -5.027
   42    HA2  GLY   5           HA2      GLY   5  -4.200 -11.254  -5.194
   43    HA3  GLY   5           HA3      GLY   5  -4.133 -10.144  -6.557
   44    H    TRP   6           H        TRP   6  -5.802  -8.088  -4.618
   45    HA   TRP   6           HA       TRP   6  -3.327  -6.750  -3.984
   46    HB2  TRP   6           HB2      TRP   6  -6.184  -6.112  -3.274
   47    HB3  TRP   6           HB3      TRP   6  -4.818  -5.099  -2.831
   48    HD1  TRP   6           HD1      TRP   6  -7.195  -5.694  -5.513
   49    HE1  TRP   6           HE1      TRP   6  -6.784  -4.083  -7.435
   50    HE3  TRP   6           HE3      TRP   6  -2.530  -4.170  -4.197
   51    HZ2  TRP   6           HZ2      TRP   6  -4.535  -2.478  -8.435
   52    HZ3  TRP   6           HZ3      TRP   6  -1.307  -2.528  -5.579
   53    HH2  TRP   6           HH2      TRP   6  -2.269  -1.705  -7.716
   54    H    GLU   7           H        GLU   7  -2.060  -6.614  -2.236
   55    HA   GLU   7           HA       GLU   7  -3.220  -7.025   0.444
   56    HB2  GLU   7           HB2      GLU   7  -1.847  -9.098  -0.750
   57    HB3  GLU   7           HB3      GLU   7  -0.519  -8.258   0.030
   58    HG2  GLU   7           HG2      GLU   7  -3.079  -9.203   1.411
   59    HG3  GLU   7           HG3      GLU   7  -1.588 -10.132   1.332
   60    H    LYS   8           H        LYS   8  -1.994  -6.013   2.085
   61    HA   LYS   8           HA       LYS   8  -0.524  -3.582   1.425
   62    HB2  LYS   8           HB2      LYS   8  -1.812  -3.364   3.309
   63    HB3  LYS   8           HB3      LYS   8  -1.615  -4.983   3.850
   64    HG2  LYS   8           HG2      LYS   8   0.892  -3.379   4.053
   65    HG3  LYS   8           HG3      LYS   8  -0.466  -2.697   4.905
   66    HD2  LYS   8           HD2      LYS   8   0.870  -4.113   6.354
   67    HD3  LYS   8           HD3      LYS   8  -0.788  -4.682   6.252
   68    HE2  LYS   8           HE2      LYS   8   1.336  -5.891   4.461
   69    HE3  LYS   8           HE3      LYS   8   1.293  -6.339   6.161
   70    HZ1  LYS   8           HZ1      LYS   8  -0.048  -7.808   4.585
   71    HZ2  LYS   8           HZ2      LYS   8  -0.896  -7.236   5.899
   72    HZ3  LYS   8           HZ3      LYS   8  -1.074  -6.676   4.360
   73    H    ARG   9           H        ARG   9   1.654  -3.240   1.637
   74    HA   ARG   9           HA       ARG   9   3.511  -5.451   2.372
   75    HB2  ARG   9           HB2      ARG   9   3.446  -3.991  -0.303
   76    HB3  ARG   9           HB3      ARG   9   4.861  -4.866   0.269
   77    HG2  ARG   9           HG2      ARG   9   2.163  -6.136  -0.354
   78    HG3  ARG   9           HG3      ARG   9   3.601  -6.097  -1.369
   79    HD2  ARG   9           HD2      ARG   9   3.966  -8.121  -0.558
   80    HD3  ARG   9           HD3      ARG   9   4.756  -7.236   0.752
   81    HE   ARG   9           HE       ARG   9   2.091  -7.494   1.567
   82   HH11  ARG   9          HH11      ARG   9   4.631  -9.756   0.744
   83   HH12  ARG   9          HH12      ARG   9   3.931 -11.059   1.670
   84   HH21  ARG   9          HH21      ARG   9   1.125  -9.262   2.661
   85   HH22  ARG   9          HH22      ARG   9   2.023 -10.747   2.757
   86    H    MET  10           H        MET  10   5.825  -4.580   2.358
   87    HA   MET  10           HA       MET  10   5.943  -1.699   3.110
   88    HB2  MET  10           HB2      MET  10   6.208  -3.224   5.076
   89    HB3  MET  10           HB3      MET  10   7.596  -3.968   4.263
   90    HG2  MET  10           HG2      MET  10   8.628  -1.640   4.151
   91    HG3  MET  10           HG3      MET  10   7.296  -1.060   5.133
   92    HE1  MET  10           HE1      MET  10   9.572  -4.389   5.367
   93    HE2  MET  10           HE2      MET  10  10.632  -3.014   4.967
   94    HE3  MET  10           HE3      MET  10  10.745  -3.798   6.560
   95    H    PHE  11           H        PHE  11   7.306  -0.511   1.916
   96    HA   PHE  11           HA       PHE  11   8.517  -1.676  -0.390
   97    HB2  PHE  11           HB2      PHE  11   7.311   0.555  -0.136
   98    HB3  PHE  11           HB3      PHE  11   8.773   1.180   0.596
   99    HD1  PHE  11           HD1      PHE  11  10.917   1.219  -0.840
  100    HD2  PHE  11           HD2      PHE  11   7.025   0.300  -2.462
  101    HE1  PHE  11           HE1      PHE  11  11.767   1.657  -3.131
  102    HE2  PHE  11           HE2      PHE  11   7.888   0.723  -4.755
  103    HZ   PHE  11           HZ       PHE  11  10.258   1.392  -5.091
  104    H    ARG  12           H        ARG  12   9.970  -3.147   0.581
  105    HA   ARG  12           HA       ARG  12  12.214  -2.654   2.093
  106    HB2  ARG  12           HB2      ARG  12  13.356  -4.373   0.373
  107    HB3  ARG  12           HB3      ARG  12  12.244  -4.813   1.647
  108    HG2  ARG  12           HG2      ARG  12  11.720  -6.047  -0.316
  109    HG3  ARG  12           HG3      ARG  12  10.379  -4.998   0.078
  110    HD2  ARG  12           HD2      ARG  12  12.222  -3.719  -1.837
  111    HD3  ARG  12           HD3      ARG  12  11.739  -5.306  -2.390
  112    HE   ARG  12           HE       ARG  12   9.402  -4.667  -2.283
  113   HH11  ARG  12          HH11      ARG  12  11.561  -1.863  -2.076
  114   HH12  ARG  12          HH12      ARG  12  10.416  -0.841  -2.896
  115   HH21  ARG  12          HH21      ARG  12   7.893  -3.200  -3.111
  116   HH22  ARG  12          HH22      ARG  12   8.445  -1.574  -3.428
  117    H    SER  13           H        SER  13  14.104  -1.771   1.964
  118    HA   SER  13           HA       SER  13  15.920  -0.561   1.299
  119    HB2  SER  13           HB2      SER  13  14.607   0.550  -1.170
  120    HB3  SER  13           HB3      SER  13  16.325   0.422  -0.765
  121    HG   SER  13           HG       SER  13  14.493  -1.593  -1.466
  122    H    ASN  14           H        ASN  14  12.603   0.623   1.654
  123    HA   ASN  14           HA       ASN  14  13.889   2.859   3.068
  124    HB2  ASN  14           HB2      ASN  14  12.585   4.615   2.149
  125    HB3  ASN  14           HB3      ASN  14  13.450   3.803   0.857
  126   HD21  ASN  14          HD22      ASN  14  12.100   4.292  -0.902
  127   HD22  ASN  14          HD21      ASN  14  10.405   3.838  -0.911
  128    H    GLY  15           H        GLY  15  11.033   0.797   2.762
  129    HA2  GLY  15           HA2      GLY  15  10.025  -0.076   4.704
  130    HA3  GLY  15           HA3      GLY  15  10.530   1.308   5.650
  131    H    THR  16           H        THR  16   9.211   2.532   2.782
  132    HA   THR  16           HA       THR  16   6.866   3.608   3.959
  133    HB   THR  16           HB       THR  16   7.330   3.070   0.993
  134    HG1  THR  16           HG1      THR  16   9.082   4.142   1.655
  135   HG21  THR  16          HG21      THR  16   6.002   5.137   0.700
  136   HG22  THR  16          HG22      THR  16   5.061   3.873   1.507
  137   HG23  THR  16          HG23      THR  16   5.737   5.219   2.455
  138    H    VAL  17           H        VAL  17   4.916   2.632   4.391
  139    HA   VAL  17           HA       VAL  17   4.442  -0.089   3.367
  140    HB   VAL  17           HB       VAL  17   2.833   1.714   5.167
  141   HG11  VAL  17          HG11      VAL  17   1.221  -0.150   5.495
  142   HG12  VAL  17          HG12      VAL  17   1.110   0.543   3.879
  143   HG13  VAL  17          HG13      VAL  17   1.947  -1.008   4.121
  144   HG21  VAL  17          HG21      VAL  17   4.801   0.423   6.071
  145   HG22  VAL  17          HG22      VAL  17   3.268  -0.119   6.776
  146   HG23  VAL  17          HG23      VAL  17   4.036  -1.077   5.490
  147    H    TYR  18           H        TYR  18   3.016  -0.728   1.914
  148    HA   TYR  18           HA       TYR  18   1.610   1.175   0.169
  149    HB2  TYR  18           HB2      TYR  18   2.953   0.987  -1.685
  150    HB3  TYR  18           HB3      TYR  18   4.144   1.058  -0.408
  151    HD1  TYR  18           HD1      TYR  18   5.282  -1.038   0.344
  152    HD2  TYR  18           HD2      TYR  18   2.985  -0.724  -3.256
  153    HE1  TYR  18           HE1      TYR  18   6.542  -3.007  -0.640
  154    HE2  TYR  18           HE2      TYR  18   4.184  -2.675  -4.235
  155    HH   TYR  18           HH       TYR  18   5.709  -4.365  -3.800
  156    H    TYR  19           H        TYR  19   0.920  -0.320  -1.926
  157    HA   TYR  19           HA       TYR  19   0.077  -2.991  -0.887
  158    HB2  TYR  19           HB2      TYR  19  -1.645  -0.830  -2.041
  159    HB3  TYR  19           HB3      TYR  19  -2.011  -2.487  -2.441
  160    HD1  TYR  19           HD1      TYR  19  -1.285  -0.422   0.657
  161    HD2  TYR  19           HD2      TYR  19  -3.366  -3.783  -1.069
  162    HE1  TYR  19           HE1      TYR  19  -2.647  -0.652   2.721
  163    HE2  TYR  19           HE2      TYR  19  -4.708  -4.000   1.032
  164    HH   TYR  19           HH       TYR  19  -5.310  -1.593   3.037
  165    H    PHE  20           H        PHE  20  -0.152  -4.591  -2.258
  166    HA   PHE  20           HA       PHE  20   1.018  -4.361  -5.002
  167    HB2  PHE  20           HB2      PHE  20   2.743  -4.902  -3.366
  168    HB3  PHE  20           HB3      PHE  20   1.764  -6.239  -2.738
  169    HD1  PHE  20           HD2      PHE  20   3.663  -5.022  -5.671
  170    HD2  PHE  20           HD1      PHE  20   1.884  -8.465  -3.775
  171    HE1  PHE  20           HE2      PHE  20   4.879  -6.513  -7.243
  172    HE2  PHE  20           HE1      PHE  20   3.153  -9.941  -5.300
  173    HZ   PHE  20           HZ       PHE  20   4.629  -8.983  -7.044
  174    H    ASN  21           H        ASN  21  -0.141  -5.436  -6.471
  175    HA   ASN  21           HA       ASN  21  -2.220  -7.345  -5.669
  176    HB2  ASN  21           HB2      ASN  21  -2.609  -5.582  -7.437
  177    HB3  ASN  21           HB3      ASN  21  -1.387  -6.378  -8.410
  178   HD21  ASN  21          HD22      ASN  21  -4.699  -6.543  -7.153
  179   HD22  ASN  21          HD21      ASN  21  -5.099  -8.067  -7.930
  180    H    HIS  22           H        HIS  22  -1.295  -9.221  -4.975
  181    HA   HIS  22           HA       HIS  22   1.089 -10.323  -6.125
  182    HB2  HIS  22           HB2      HIS  22   0.965 -11.912  -4.405
  183    HB3  HIS  22           HB3      HIS  22   0.381 -10.421  -3.721
  184    HD1  HIS  22           HD1      HIS  22  -1.362 -13.451  -5.399
  185    HD2  HIS  22           HD2      HIS  22  -1.657 -10.768  -2.192
  186    HE1  HIS  22           HE1      HIS  22  -3.516 -14.088  -4.098
  187    H    ILE  23           H        ILE  23  -1.640 -10.204  -7.786
  188    HA   ILE  23           HA       ILE  23  -1.250 -12.909  -9.011
  189    HB   ILE  23           HB       ILE  23  -3.628 -11.024  -9.070
  190   HG12  ILE  23          HG12      ILE  23  -3.241 -13.895  -8.078
  191   HG13  ILE  23          HG13      ILE  23  -3.406 -12.469  -7.065
  192   HG21  ILE  23          HG21      ILE  23  -3.337 -11.943 -11.345
  193   HG22  ILE  23          HG22      ILE  23  -3.219 -13.586 -10.681
  194   HG23  ILE  23          HG23      ILE  23  -4.735 -12.660 -10.577
  195   HD11  ILE  23          HD11      ILE  23  -5.551 -13.778  -8.755
  196   HD12  ILE  23          HD12      ILE  23  -5.510 -13.533  -7.004
  197   HD13  ILE  23          HD13      ILE  23  -5.729 -12.141  -8.087
  198    H    THR  24           H        THR  24  -1.098  -9.424  -9.491
  199    HA   THR  24           HA       THR  24  -0.264  -9.830 -12.352
  200    HB   THR  24           HB       THR  24  -1.085  -7.548 -12.728
  201    HG1  THR  24           HG1      THR  24  -2.115  -7.700 -10.113
  202   HG21  THR  24          HG21      THR  24  -3.214  -9.185 -11.271
  203   HG22  THR  24          HG22      THR  24  -3.485  -7.861 -12.411
  204   HG23  THR  24          HG23      THR  24  -2.754  -9.381 -12.979
  205    H    ASN  25           H        ASN  25   0.815  -8.493  -9.329
  206    HA   ASN  25           HA       ASN  25   2.703  -7.599  -8.617
  207    HB2  ASN  25           HB2      ASN  25   3.766  -7.193 -11.419
  208    HB3  ASN  25           HB3      ASN  25   4.646  -7.068  -9.910
  209   HD21  ASN  25          HD22      ASN  25   3.191  -9.294 -12.193
  210   HD22  ASN  25          HD21      ASN  25   4.065 -10.718 -11.589
  211    H    ALA  26           H        ALA  26   0.230  -6.096 -10.221
  212    HA   ALA  26           HA       ALA  26   1.121  -3.449 -10.587
  213    HB1  ALA  26           HB1      ALA  26  -1.581  -4.376  -9.518
  214    HB2  ALA  26           HB2      ALA  26  -1.219  -2.814 -10.267
  215    HB3  ALA  26           HB3      ALA  26  -1.123  -4.299 -11.234
  216    H    SER  27           H        SER  27   1.576  -1.743  -9.211
  217    HA   SER  27           HA       SER  27   1.627  -2.311  -6.270
  218    HB2  SER  27           HB2      SER  27   3.862  -1.332  -8.095
  219    HB3  SER  27           HB3      SER  27   3.931  -1.390  -6.328
  220    HG   SER  27           HG       SER  27   3.539  -3.671  -8.039
  221    H    GLN  28           H        GLN  28   0.975  -0.562  -5.041
  222    HA   GLN  28           HA       GLN  28   1.323   2.164  -6.088
  223    HB2  GLN  28           HB2      GLN  28  -0.847   1.371  -7.026
  224    HB3  GLN  28           HB3      GLN  28  -1.423   1.004  -5.404
  225    HG2  GLN  28           HG2      GLN  28  -2.300   3.139  -6.402
  226    HG3  GLN  28           HG3      GLN  28  -1.540   3.327  -4.833
  227   HE21  GLN  28          HE22      GLN  28  -0.872   3.768  -8.390
  228   HE22  GLN  28          HE21      GLN  28   0.301   5.033  -8.057
  229    H    PHE  29           H        PHE  29   1.083   3.808  -4.391
  230    HA   PHE  29           HA       PHE  29   1.623   2.744  -1.683
  231    HB2  PHE  29           HB2      PHE  29   1.705   5.529  -2.861
  232    HB3  PHE  29           HB3      PHE  29   2.014   5.156  -1.167
  233    HD1  PHE  29           HD2      PHE  29   3.734   3.103  -0.813
  234    HD2  PHE  29           HD1      PHE  29   3.640   5.702  -4.244
  235    HE1  PHE  29           HE2      PHE  29   6.126   2.597  -1.256
  236    HE2  PHE  29           HE1      PHE  29   6.025   5.180  -4.703
  237    HZ   PHE  29           HZ       PHE  29   7.273   3.630  -3.209
  238    H    GLU  30           H        GLU  30  -0.870   4.759  -3.335
  239    HA   GLU  30           HA       GLU  30  -2.542   4.845  -0.980
  240    HB2  GLU  30           HB2      GLU  30  -2.822   6.511  -2.708
  241    HB3  GLU  30           HB3      GLU  30  -3.121   5.271  -3.920
  242    HG2  GLU  30           HG2      GLU  30  -5.180   6.407  -3.320
  243    HG3  GLU  30           HG3      GLU  30  -5.270   4.705  -2.902
  244    H    ARG  31           H        ARG  31  -4.376   3.601  -0.524
  245    HA   ARG  31           HA       ARG  31  -3.940   0.764  -1.248
  246    HB2  ARG  31           HB2      ARG  31  -6.064   1.621   0.698
  247    HB3  ARG  31           HB3      ARG  31  -5.173   0.124   0.586
  248    HG2  ARG  31           HG2      ARG  31  -4.133   0.980   2.412
  249    HG3  ARG  31           HG3      ARG  31  -3.056   1.630   1.186
  250    HD2  ARG  31           HD2      ARG  31  -3.655   3.253   2.974
  251    HD3  ARG  31           HD3      ARG  31  -4.143   3.822   1.388
  252    HE   ARG  31           HE       ARG  31  -6.109   2.334   3.096
  253   HH11  ARG  31          HH12      ARG  31  -5.646   5.258   1.101
  254   HH12  ARG  31          HH11      ARG  31  -7.240   5.785   1.480
  255   HH21  ARG  31          HH21      ARG  31  -7.963   2.843   3.210
  256   HH22  ARG  31          HH22      ARG  31  -8.650   4.398   2.673
  257    HA   PRO  32           HA       PRO  32  -7.134   1.089  -4.228
  258    HB2  PRO  32           HB2      PRO  32  -7.640  -1.594  -4.828
  259    HB3  PRO  32           HB3      PRO  32  -6.221  -0.656  -5.348
  260    HG2  PRO  32           HG2      PRO  32  -6.392  -2.618  -3.094
  261    HG3  PRO  32           HG3      PRO  32  -5.074  -2.333  -4.228
  262    HD2  PRO  32           HD2      PRO  32  -5.074  -1.307  -1.687
  263    HD3  PRO  32           HD3      PRO  32  -4.238  -0.540  -3.070
  264    H    SER  33           H        SER  33  -7.746  -0.581  -1.573
  265    HA   SER  33           HA       SER  33 -10.670  -0.023  -1.391
  266    HB2  SER  33           HB2      SER  33 -10.652  -1.896  -2.951
  267    HB3  SER  33           HB3      SER  33  -9.679  -2.858  -1.832
  268    HG   SER  33           HG       SER  33 -11.508  -2.399  -0.329
  269    H    GLY  34           H        GLY  34  -8.132   0.159   0.488
  270    HA2  GLY  34           HA2      GLY  34  -9.433  -0.261   2.966
  271    HA3  GLY  34           HA3      GLY  34  -8.471  -1.702   2.624
  Start of MODEL   17
    1    H1   LYS   1           H1       LYS   1 -11.361  -1.114  -3.004
    2    H2   LYS   1           H2       LYS   1 -12.733  -1.467  -3.855
    3    H3   LYS   1           H3       LYS   1 -12.738  -0.284  -2.699
    4    HA   LYS   1           HA       LYS   1 -12.718   0.789  -4.792
    5    HB2  LYS   1           HB2      LYS   1  -9.861   0.874  -3.800
    6    HB3  LYS   1           HB3      LYS   1 -10.728   2.134  -4.666
    7    HG2  LYS   1           HG2      LYS   1 -12.054   2.636  -2.672
    8    HG3  LYS   1           HG3      LYS   1 -11.419   1.201  -1.842
    9    HD2  LYS   1           HD2      LYS   1  -9.070   2.198  -2.243
   10    HD3  LYS   1           HD3      LYS   1  -9.892   3.721  -2.595
   11    HE2  LYS   1           HE2      LYS   1 -10.729   3.880  -0.363
   12    HE3  LYS   1           HE3      LYS   1 -10.473   2.147  -0.059
   13    HZ1  LYS   1           HZ1      LYS   1  -8.721   3.475   0.990
   14    HZ2  LYS   1           HZ2      LYS   1  -8.105   2.495  -0.172
   15    HZ3  LYS   1           HZ3      LYS   1  -8.245   4.089  -0.479
   16    H    LEU   2           H        LEU   2  -9.321  -0.096  -5.223
   17    HA   LEU   2           HA       LEU   2  -9.800  -1.262  -7.779
   18    HB2  LEU   2           HB2      LEU   2  -7.198  -1.541  -6.275
   19    HB3  LEU   2           HB3      LEU   2  -7.439  -1.617  -7.915
   20    HG   LEU   2           HG       LEU   2  -7.854   0.734  -8.196
   21   HD11  LEU   2          HD11      LEU   2  -7.070   2.308  -6.378
   22   HD12  LEU   2          HD12      LEU   2  -8.668   1.643  -6.140
   23   HD13  LEU   2          HD13      LEU   2  -7.282   0.997  -5.214
   24   HD21  LEU   2          HD21      LEU   2  -5.287  -0.048  -6.732
   25   HD22  LEU   2          HD22      LEU   2  -5.630  -0.264  -8.454
   26   HD23  LEU   2          HD23      LEU   2  -5.486   1.366  -7.790
   27    HA   PRO   3           HA       PRO   3 -10.649  -5.428  -7.346
   28    HB2  PRO   3           HB2      PRO   3  -7.831  -6.065  -8.302
   29    HB3  PRO   3           HB3      PRO   3  -9.358  -6.819  -8.887
   30    HG2  PRO   3           HG2      PRO   3  -8.276  -4.890 -10.351
   31    HG3  PRO   3           HG3      PRO   3 -10.018  -4.691  -9.909
   32    HD2  PRO   3           HD2      PRO   3  -7.580  -3.564  -8.475
   33    HD3  PRO   3           HD3      PRO   3  -9.022  -2.686  -8.997
   34    HA   PRO   4           HA       PRO   4  -8.942  -8.069  -4.073
   35    HB2  PRO   4           HB2      PRO   4  -9.799 -10.543  -4.928
   36    HB3  PRO   4           HB3      PRO   4 -10.880  -9.342  -4.153
   37    HG2  PRO   4           HG2      PRO   4 -10.498  -9.873  -7.111
   38    HG3  PRO   4           HG3      PRO   4 -12.035  -9.689  -6.207
   39    HD2  PRO   4           HD2      PRO   4 -10.963  -7.640  -7.603
   40    HD3  PRO   4           HD3      PRO   4 -11.752  -7.347  -6.029
   41    H    GLY   5           H        GLY   5  -6.966  -9.179  -3.904
   42    HA2  GLY   5           HA2      GLY   5  -5.093 -10.442  -4.990
   43    HA3  GLY   5           HA3      GLY   5  -5.431  -9.530  -6.447
   44    H    TRP   6           H        TRP   6  -5.908  -6.811  -5.105
   45    HA   TRP   6           HA       TRP   6  -3.148  -6.059  -4.649
   46    HB2  TRP   6           HB2      TRP   6  -5.825  -4.690  -4.246
   47    HB3  TRP   6           HB3      TRP   6  -4.269  -3.953  -3.907
   48    HD1  TRP   6           HD1      TRP   6  -6.549  -4.657  -6.782
   49    HE1  TRP   6           HE1      TRP   6  -5.607  -3.490  -8.875
   50    HE3  TRP   6           HE3      TRP   6  -1.945  -3.475  -5.002
   51    HZ2  TRP   6           HZ2      TRP   6  -3.123  -2.238  -9.684
   52    HZ3  TRP   6           HZ3      TRP   6  -0.338  -2.294  -6.386
   53    HH2  TRP   6           HH2      TRP   6  -0.877  -1.654  -8.752
   54    H    GLU   7           H        GLU   7  -1.969  -6.407  -2.847
   55    HA   GLU   7           HA       GLU   7  -3.332  -6.470  -0.195
   56    HB2  GLU   7           HB2      GLU   7  -2.799  -8.722  -1.462
   57    HB3  GLU   7           HB3      GLU   7  -1.140  -8.415  -0.972
   58    HG2  GLU   7           HG2      GLU   7  -3.559  -8.616   0.891
   59    HG3  GLU   7           HG3      GLU   7  -2.473  -9.951   0.511
   60    H    LYS   8           H        LYS   8  -1.967  -5.967   1.593
   61    HA   LYS   8           HA       LYS   8  -0.293  -3.690   1.199
   62    HB2  LYS   8           HB2      LYS   8  -1.564  -3.665   3.098
   63    HB3  LYS   8           HB3      LYS   8  -1.350  -5.333   3.484
   64    HG2  LYS   8           HG2      LYS   8   0.826  -3.239   3.842
   65    HG3  LYS   8           HG3      LYS   8  -0.384  -3.625   5.054
   66    HD2  LYS   8           HD2      LYS   8   1.924  -5.366   4.161
   67    HD3  LYS   8           HD3      LYS   8   1.551  -4.713   5.725
   68    HE2  LYS   8           HE2      LYS   8   1.087  -6.950   5.970
   69    HE3  LYS   8           HE3      LYS   8  -0.517  -6.238   5.788
   70    HZ1  LYS   8           HZ1      LYS   8  -0.761  -7.274   3.697
   71    HZ2  LYS   8           HZ2      LYS   8   0.804  -7.247   3.352
   72    HZ3  LYS   8           HZ3      LYS   8   0.199  -8.364   4.405
   73    H    ARG   9           H        ARG   9   1.853  -3.365   1.248
   74    HA   ARG   9           HA       ARG   9   3.736  -5.462   2.105
   75    HB2  ARG   9           HB2      ARG   9   3.872  -4.124  -0.641
   76    HB3  ARG   9           HB3      ARG   9   5.146  -5.129   0.047
   77    HG2  ARG   9           HG2      ARG   9   2.363  -6.053  -0.731
   78    HG3  ARG   9           HG3      ARG   9   3.845  -6.328  -1.636
   79    HD2  ARG   9           HD2      ARG   9   4.496  -8.084  -0.370
   80    HD3  ARG   9           HD3      ARG   9   4.027  -7.320   1.137
   81    HE   ARG   9           HE       ARG   9   1.760  -7.983   0.860
   82   HH11  ARG   9          HH11      ARG   9   3.771  -9.504  -1.585
   83   HH12  ARG   9          HH12      ARG   9   2.663 -10.835  -1.806
   84   HH21  ARG   9          HH21      ARG   9   0.447  -9.674   0.617
   85   HH22  ARG   9          HH22      ARG   9   0.747 -10.921  -0.591
   86    H    MET  10           H        MET  10   6.022  -4.523   2.102
   87    HA   MET  10           HA       MET  10   6.006  -1.615   2.755
   88    HB2  MET  10           HB2      MET  10   6.024  -3.060   4.795
   89    HB3  MET  10           HB3      MET  10   7.521  -3.807   4.214
   90    HG2  MET  10           HG2      MET  10   8.570  -1.511   4.194
   91    HG3  MET  10           HG3      MET  10   7.076  -0.864   4.866
   92    HE1  MET  10           HE1      MET  10  10.183  -3.478   7.082
   93    HE2  MET  10           HE2      MET  10   9.274  -4.138   5.708
   94    HE3  MET  10           HE3      MET  10  10.383  -2.765   5.466
   95    H    PHE  11           H        PHE  11   7.462  -0.451   1.712
   96    HA   PHE  11           HA       PHE  11   9.077  -1.542  -0.358
   97    HB2  PHE  11           HB2      PHE  11   7.841   0.612  -0.377
   98    HB3  PHE  11           HB3      PHE  11   8.958   1.234   0.822
   99    HD1  PHE  11           HD2      PHE  11  10.954  -0.701  -1.478
  100    HD2  PHE  11           HD1      PHE  11   8.791   3.029  -1.108
  101    HE1  PHE  11           HE2      PHE  11  12.373   0.301  -3.201
  102    HE2  PHE  11           HE1      PHE  11  10.224   4.014  -2.864
  103    HZ   PHE  11           HZ       PHE  11  12.026   2.656  -3.911
  104    H    ARG  12           H        ARG  12  10.625  -2.881   0.398
  105    HA   ARG  12           HA       ARG  12  12.451  -2.565   2.475
  106    HB2  ARG  12           HB2      ARG  12  13.120  -3.790  -0.234
  107    HB3  ARG  12           HB3      ARG  12  13.792  -4.196   1.334
  108    HG2  ARG  12           HG2      ARG  12  12.272  -5.823   1.537
  109    HG3  ARG  12           HG3      ARG  12  11.014  -4.627   1.695
  110    HD2  ARG  12           HD2      ARG  12  11.903  -6.167  -0.749
  111    HD3  ARG  12           HD3      ARG  12  10.317  -6.153   0.001
  112    HE   ARG  12           HE       ARG  12  11.498  -4.135  -1.831
  113   HH11  ARG  12          HH11      ARG  12   8.526  -4.642  -0.007
  114   HH12  ARG  12          HH12      ARG  12   7.550  -4.411  -1.459
  115   HH21  ARG  12          HH21      ARG  12  10.080  -3.413  -3.458
  116   HH22  ARG  12          HH22      ARG  12   8.366  -3.485  -3.116
  117    H    SER  13           H        SER  13  14.454  -1.671   2.662
  118    HA   SER  13           HA       SER  13  16.269  -0.312   2.367
  119    HB2  SER  13           HB2      SER  13  16.656   1.206   0.556
  120    HB3  SER  13           HB3      SER  13  16.175  -0.356  -0.127
  121    HG   SER  13           HG       SER  13  14.094   0.421  -0.353
  122    H    ASN  14           H        ASN  14  12.917   0.792   2.477
  123    HA   ASN  14           HA       ASN  14  13.848   3.136   4.075
  124    HB2  ASN  14           HB2      ASN  14  12.367   4.619   2.761
  125    HB3  ASN  14           HB3      ASN  14  13.692   3.953   1.811
  126   HD21  ASN  14          HD22      ASN  14  13.224   2.518   0.040
  127   HD22  ASN  14          HD21      ASN  14  11.561   2.320  -0.478
  128    H    GLY  15           H        GLY  15  11.064   0.997   3.279
  129    HA2  GLY  15           HA2      GLY  15   9.785   0.106   5.060
  130    HA3  GLY  15           HA3      GLY  15  10.090   1.523   6.049
  131    H    THR  16           H        THR  16   9.246   2.518   2.868
  132    HA   THR  16           HA       THR  16   6.764   3.665   3.655
  133    HB   THR  16           HB       THR  16   7.592   2.969   0.811
  134    HG1  THR  16           HG1      THR  16   9.265   4.112   1.611
  135   HG21  THR  16          HG21      THR  16   5.826   5.171   1.946
  136   HG22  THR  16          HG22      THR  16   6.286   4.977   0.241
  137   HG23  THR  16          HG23      THR  16   5.271   3.753   1.023
  138    H    VAL  17           H        VAL  17   4.891   2.559   4.144
  139    HA   VAL  17           HA       VAL  17   4.446  -0.111   3.011
  140    HB   VAL  17           HB       VAL  17   2.846   1.598   4.908
  141   HG11  VAL  17          HG11      VAL  17   1.134   0.417   3.618
  142   HG12  VAL  17          HG12      VAL  17   2.025  -1.115   3.787
  143   HG13  VAL  17          HG13      VAL  17   1.300  -0.331   5.205
  144   HG21  VAL  17          HG21      VAL  17   3.359  -0.274   6.451
  145   HG22  VAL  17          HG22      VAL  17   4.141  -1.164   5.127
  146   HG23  VAL  17          HG23      VAL  17   4.863   0.342   5.747
  147    H    TYR  18           H        TYR  18   3.001  -0.731   1.578
  148    HA   TYR  18           HA       TYR  18   1.421   1.141  -0.026
  149    HB2  TYR  18           HB2      TYR  18   2.679   1.033  -1.997
  150    HB3  TYR  18           HB3      TYR  18   3.857   1.379  -0.751
  151    HD1  TYR  18           HD1      TYR  18   5.304  -0.527   0.135
  152    HD2  TYR  18           HD2      TYR  18   2.998  -0.733  -3.472
  153    HE1  TYR  18           HE1      TYR  18   6.724  -2.429  -0.663
  154    HE2  TYR  18           HE2      TYR  18   4.357  -2.663  -4.265
  155    HH   TYR  18           HH       TYR  18   6.019  -4.082  -3.742
  156    H    TYR  19           H        TYR  19   0.818  -0.374  -2.222
  157    HA   TYR  19           HA       TYR  19   0.160  -3.090  -1.200
  158    HB2  TYR  19           HB2      TYR  19  -1.659  -1.024  -2.377
  159    HB3  TYR  19           HB3      TYR  19  -1.900  -2.686  -2.840
  160    HD1  TYR  19           HD1      TYR  19  -1.263  -0.856   0.420
  161    HD2  TYR  19           HD2      TYR  19  -3.501  -3.862  -1.688
  162    HE1  TYR  19           HE1      TYR  19  -2.588  -1.295   2.448
  163    HE2  TYR  19           HE2      TYR  19  -4.858  -4.298   0.334
  164    HH   TYR  19           HH       TYR  19  -4.144  -2.716   3.434
  165    H    PHE  20           H        PHE  20   0.037  -4.692  -2.600
  166    HA   PHE  20           HA       PHE  20   1.330  -4.418  -5.281
  167    HB2  PHE  20           HB2      PHE  20   2.961  -5.094  -3.622
  168    HB3  PHE  20           HB3      PHE  20   1.860  -6.314  -2.976
  169    HD1  PHE  20           HD2      PHE  20   3.904  -5.419  -5.961
  170    HD2  PHE  20           HD1      PHE  20   1.782  -8.548  -3.876
  171    HE1  PHE  20           HE2      PHE  20   5.004  -7.119  -7.392
  172    HE2  PHE  20           HE1      PHE  20   2.924 -10.243  -5.281
  173    HZ   PHE  20           HZ       PHE  20   4.529  -9.540  -7.032
  174    H    ASN  21           H        ASN  21   0.182  -5.411  -6.852
  175    HA   ASN  21           HA       ASN  21  -2.171  -7.025  -6.130
  176    HB2  ASN  21           HB2      ASN  21  -2.236  -5.342  -7.991
  177    HB3  ASN  21           HB3      ASN  21  -1.070  -6.323  -8.847
  178   HD21  ASN  21          HD22      ASN  21  -4.459  -6.065  -7.791
  179   HD22  ASN  21          HD21      ASN  21  -4.969  -7.527  -8.620
  180    H    HIS  22           H        HIS  22  -1.592  -8.959  -5.295
  181    HA   HIS  22           HA       HIS  22   0.778 -10.344  -6.134
  182    HB2  HIS  22           HB2      HIS  22   0.337 -11.808  -4.401
  183    HB3  HIS  22           HB3      HIS  22  -0.358 -10.307  -3.833
  184    HD1  HIS  22           HD1      HIS  22  -1.637 -13.457  -5.673
  185    HD2  HIS  22           HD2      HIS  22  -2.803 -10.551  -2.871
  186    HE1  HIS  22           HE1      HIS  22  -3.975 -14.161  -4.793
  187    H    ILE  23           H        ILE  23  -1.900 -10.035  -7.966
  188    HA   ILE  23           HA       ILE  23  -1.867 -12.812  -9.047
  189    HB   ILE  23           HB       ILE  23  -3.921 -10.581  -9.332
  190   HG12  ILE  23          HG12      ILE  23  -3.929 -13.123  -7.639
  191   HG13  ILE  23          HG13      ILE  23  -3.885 -11.466  -7.040
  192   HG21  ILE  23          HG21      ILE  23  -4.083 -13.487 -10.216
  193   HG22  ILE  23          HG22      ILE  23  -5.354 -12.253 -10.379
  194   HG23  ILE  23          HG23      ILE  23  -3.871 -12.095 -11.304
  195   HD11  ILE  23          HD11      ILE  23  -6.161 -11.095  -8.084
  196   HD12  ILE  23          HD12      ILE  23  -6.228 -12.853  -8.365
  197   HD13  ILE  23          HD13      ILE  23  -6.095 -12.229  -6.718
  198    H    THR  24           H        THR  24  -1.229  -9.438  -9.782
  199    HA   THR  24           HA       THR  24  -0.327 -10.112 -12.573
  200    HB   THR  24           HB       THR  24  -0.704  -7.733 -13.055
  201    HG1  THR  24           HG1      THR  24  -1.859  -7.624 -10.497
  202   HG21  THR  24          HG21      THR  24  -2.647  -9.240 -13.410
  203   HG22  THR  24          HG22      THR  24  -3.189  -8.932 -11.745
  204   HG23  THR  24          HG23      THR  24  -3.144  -7.605 -12.920
  205    H    ASN  25           H        ASN  25   0.821  -9.106  -9.550
  206    HA   ASN  25           HA       ASN  25   2.594  -8.286  -8.669
  207    HB2  ASN  25           HB2      ASN  25   4.766  -8.632  -9.447
  208    HB3  ASN  25           HB3      ASN  25   3.806 -10.011  -9.964
  209   HD21  ASN  25          HD22      ASN  25   4.757  -6.764 -11.247
  210   HD22  ASN  25          HD21      ASN  25   5.216  -7.430 -12.833
  211    H    ALA  26           H        ALA  26   0.720  -6.498 -10.392
  212    HA   ALA  26           HA       ALA  26   2.287  -4.118 -10.825
  213    HB1  ALA  26           HB1      ALA  26  -0.669  -4.414 -10.136
  214    HB2  ALA  26           HB2      ALA  26   0.113  -2.996 -10.862
  215    HB3  ALA  26           HB3      ALA  26   0.023  -4.516 -11.770
  216    H    SER  27           H        SER  27   2.097  -2.077  -9.468
  217    HA   SER  27           HA       SER  27   1.875  -2.543  -6.538
  218    HB2  SER  27           HB2      SER  27   4.248  -1.309  -7.979
  219    HB3  SER  27           HB3      SER  27   3.949  -1.199  -6.233
  220    HG   SER  27           HG       SER  27   4.185  -3.616  -7.699
  221    H    GLN  28           H        GLN  28   1.177  -0.734  -5.365
  222    HA   GLN  28           HA       GLN  28   0.870   1.906  -6.606
  223    HB2  GLN  28           HB2      GLN  28  -1.065   0.690  -7.480
  224    HB3  GLN  28           HB3      GLN  28  -1.449   0.060  -5.880
  225    HG2  GLN  28           HG2      GLN  28  -2.977   1.849  -6.662
  226    HG3  GLN  28           HG3      GLN  28  -2.218   2.164  -5.112
  227   HE21  GLN  28          HE22      GLN  28  -1.814   2.996  -8.665
  228   HE22  GLN  28          HE21      GLN  28  -1.186   4.581  -8.252
  229    H    PHE  29           H        PHE  29   0.322   3.531  -4.943
  230    HA   PHE  29           HA       PHE  29   1.083   2.670  -2.206
  231    HB2  PHE  29           HB2      PHE  29   0.815   5.412  -3.449
  232    HB3  PHE  29           HB3      PHE  29   1.341   5.076  -1.802
  233    HD1  PHE  29           HD1      PHE  29   3.356   3.325  -1.594
  234    HD2  PHE  29           HD2      PHE  29   2.505   5.679  -5.103
  235    HE1  PHE  29           HE1      PHE  29   5.697   3.028  -2.355
  236    HE2  PHE  29           HE2      PHE  29   4.849   5.378  -5.865
  237    HZ   PHE  29           HZ       PHE  29   6.446   4.053  -4.495
  238    H    GLU  30           H        GLU  30  -1.706   4.053  -4.010
  239    HA   GLU  30           HA       GLU  30  -3.240   4.367  -1.583
  240    HB2  GLU  30           HB2      GLU  30  -3.794   5.651  -3.522
  241    HB3  GLU  30           HB3      GLU  30  -4.112   4.197  -4.473
  242    HG2  GLU  30           HG2      GLU  30  -6.190   5.315  -3.775
  243    HG3  GLU  30           HG3      GLU  30  -6.077   3.691  -3.110
  244    H    ARG  31           H        ARG  31  -4.385   3.005  -0.488
  245    HA   ARG  31           HA       ARG  31  -3.987   0.130  -0.880
  246    HB2  ARG  31           HB2      ARG  31  -5.564   1.528   1.301
  247    HB3  ARG  31           HB3      ARG  31  -4.877  -0.062   1.379
  248    HG2  ARG  31           HG2      ARG  31  -2.767   0.698   1.951
  249    HG3  ARG  31           HG3      ARG  31  -2.816   2.051   0.933
  250    HD2  ARG  31           HD2      ARG  31  -3.889   1.736   3.735
  251    HD3  ARG  31           HD3      ARG  31  -2.706   2.909   3.146
  252    HE   ARG  31           HE       ARG  31  -5.601   3.077   3.203
  253   HH11  ARG  31          HH11      ARG  31  -2.938   4.359   1.182
  254   HH12  ARG  31          HH12      ARG  31  -4.139   5.316   0.264
  255   HH21  ARG  31          HH21      ARG  31  -6.863   4.393   2.045
  256   HH22  ARG  31          HH22      ARG  31  -6.212   5.210   0.604
  257    HA   PRO  32           HA       PRO  32  -7.956   0.245  -2.971
  258    HB2  PRO  32           HB2      PRO  32  -7.681  -2.749  -3.418
  259    HB3  PRO  32           HB3      PRO  32  -8.151  -1.456  -4.436
  260    HG2  PRO  32           HG2      PRO  32  -5.691  -2.385  -4.628
  261    HG3  PRO  32           HG3      PRO  32  -5.888  -0.667  -4.699
  262    HD2  PRO  32           HD2      PRO  32  -5.222  -2.224  -2.183
  263    HD3  PRO  32           HD3      PRO  32  -4.389  -0.783  -2.839
  264    H    SER  33           H        SER  33  -7.315  -1.476  -0.429
  265    HA   SER  33           HA       SER  33  -9.903  -2.401   0.599
  266    HB2  SER  33           HB2      SER  33  -8.567  -2.658   2.745
  267    HB3  SER  33           HB3      SER  33  -7.913  -3.531   1.345
  268    HG   SER  33           HG       SER  33  -6.166  -2.455   2.217
  269    H    GLY  34           H        GLY  34  -7.826  -0.158   2.395
  270    HA2  GLY  34           HA2      GLY  34 -10.002   1.890   2.645
  271    HA3  GLY  34           HA3      GLY  34  -9.341   1.091   4.077
  Start of MODEL   18
    1    H1   LYS   1           H1       LYS   1 -12.248   0.414  -2.114
    2    H2   LYS   1           H2       LYS   1 -10.987  -0.541  -2.535
    3    H3   LYS   1           H3       LYS   1 -12.459  -0.767  -3.249
    4    HA   LYS   1           HA       LYS   1 -12.338   1.469  -4.209
    5    HB2  LYS   1           HB2      LYS   1  -9.396   1.344  -3.540
    6    HB3  LYS   1           HB3      LYS   1 -10.279   2.670  -4.275
    7    HG2  LYS   1           HG2      LYS   1 -11.326   3.192  -2.108
    8    HG3  LYS   1           HG3      LYS   1 -10.621   1.731  -1.386
    9    HD2  LYS   1           HD2      LYS   1  -8.328   2.660  -2.105
   10    HD3  LYS   1           HD3      LYS   1  -9.139   4.200  -2.362
   11    HE2  LYS   1           HE2      LYS   1  -9.657   4.424  -0.044
   12    HE3  LYS   1           HE3      LYS   1  -9.363   2.698   0.279
   13    HZ1  LYS   1           HZ1      LYS   1  -7.201   4.500  -0.655
   14    HZ2  LYS   1           HZ2      LYS   1  -7.475   4.174   0.960
   15    HZ3  LYS   1           HZ3      LYS   1  -7.065   2.988  -0.114
   16    H    LEU   2           H        LEU   2  -9.090   0.261  -4.964
   17    HA   LEU   2           HA       LEU   2  -9.938  -0.883  -7.441
   18    HB2  LEU   2           HB2      LEU   2  -7.239  -1.340  -6.180
   19    HB3  LEU   2           HB3      LEU   2  -7.619  -1.429  -7.790
   20    HG   LEU   2           HG       LEU   2  -7.866   0.929  -8.114
   21   HD11  LEU   2          HD11      LEU   2  -7.079   1.243  -5.186
   22   HD12  LEU   2          HD12      LEU   2  -6.838   2.493  -6.410
   23   HD13  LEU   2          HD13      LEU   2  -8.465   1.966  -6.054
   24   HD21  LEU   2          HD21      LEU   2  -5.261   0.007  -6.808
   25   HD22  LEU   2          HD22      LEU   2  -5.745  -0.246  -8.489
   26   HD23  LEU   2          HD23      LEU   2  -5.437   1.392  -7.907
   27    HA   PRO   3           HA       PRO   3 -10.988  -4.996  -6.831
   28    HB2  PRO   3           HB2      PRO   3  -8.332  -5.833  -8.066
   29    HB3  PRO   3           HB3      PRO   3  -9.953  -6.485  -8.482
   30    HG2  PRO   3           HG2      PRO   3  -8.912  -4.654 -10.076
   31    HG3  PRO   3           HG3      PRO   3 -10.578  -4.319  -9.453
   32    HD2  PRO   3           HD2      PRO   3  -7.917  -3.399  -8.305
   33    HD3  PRO   3           HD3      PRO   3  -9.321  -2.393  -8.685
   34    HA   PRO   4           HA       PRO   4  -9.144  -7.763  -3.735
   35    HB2  PRO   4           HB2      PRO   4 -10.201 -10.181  -4.531
   36    HB3  PRO   4           HB3      PRO   4 -11.139  -8.937  -3.647
   37    HG2  PRO   4           HG2      PRO   4 -11.061  -9.441  -6.634
   38    HG3  PRO   4           HG3      PRO   4 -12.497  -9.190  -5.589
   39    HD2  PRO   4           HD2      PRO   4 -11.465  -7.178  -7.050
   40    HD3  PRO   4           HD3      PRO   4 -12.063  -6.871  -5.398
   41    H    GLY   5           H        GLY   5  -7.226  -8.983  -3.733
   42    HA2  GLY   5           HA2      GLY   5  -5.520 -10.336  -4.973
   43    HA3  GLY   5           HA3      GLY   5  -5.919  -9.386  -6.391
   44    H    TRP   6           H        TRP   6  -6.142  -6.663  -5.039
   45    HA   TRP   6           HA       TRP   6  -3.312  -6.059  -4.736
   46    HB2  TRP   6           HB2      TRP   6  -5.882  -4.543  -4.193
   47    HB3  TRP   6           HB3      TRP   6  -4.268  -3.898  -3.967
   48    HD1  TRP   6           HD1      TRP   6  -6.762  -4.578  -6.696
   49    HE1  TRP   6           HE1      TRP   6  -5.932  -3.471  -8.852
   50    HE3  TRP   6           HE3      TRP   6  -2.020  -3.489  -5.218
   51    HZ2  TRP   6           HZ2      TRP   6  -3.467  -2.270  -9.829
   52    HZ3  TRP   6           HZ3      TRP   6  -0.456  -2.408  -6.737
   53    HH2  TRP   6           HH2      TRP   6  -1.144  -1.752  -9.055
   54    H    GLU   7           H        GLU   7  -2.093  -6.496  -2.946
   55    HA   GLU   7           HA       GLU   7  -3.385  -6.462  -0.257
   56    HB2  GLU   7           HB2      GLU   7  -2.922  -8.764  -1.565
   57    HB3  GLU   7           HB3      GLU   7  -1.298  -8.532  -0.942
   58    HG2  GLU   7           HG2      GLU   7  -3.865  -8.607   0.719
   59    HG3  GLU   7           HG3      GLU   7  -2.808  -9.989   0.438
   60    H    LYS   8           H        LYS   8  -1.955  -6.009   1.483
   61    HA   LYS   8           HA       LYS   8  -0.248  -3.796   0.980
   62    HB2  LYS   8           HB2      LYS   8  -1.336  -3.577   2.922
   63    HB3  LYS   8           HB3      LYS   8  -1.375  -5.254   3.305
   64    HG2  LYS   8           HG2      LYS   8   1.326  -3.964   3.596
   65    HG3  LYS   8           HG3      LYS   8   0.054  -3.319   4.589
   66    HD2  LYS   8           HD2      LYS   8   1.273  -5.028   5.787
   67    HD3  LYS   8           HD3      LYS   8  -0.435  -5.400   5.666
   68    HE2  LYS   8           HE2      LYS   8   1.585  -6.643   3.772
   69    HE3  LYS   8           HE3      LYS   8   1.370  -7.274   5.393
   70    HZ1  LYS   8           HZ1      LYS   8  -0.055  -8.378   3.602
   71    HZ2  LYS   8           HZ2      LYS   8  -0.880  -7.845   4.930
   72    HZ3  LYS   8           HZ3      LYS   8  -0.935  -7.088   3.491
   73    H    ARG   9           H        ARG   9   1.894  -3.497   0.941
   74    HA   ARG   9           HA       ARG   9   3.823  -5.575   1.750
   75    HB2  ARG   9           HB2      ARG   9   3.829  -4.212  -0.975
   76    HB3  ARG   9           HB3      ARG   9   5.154  -5.191  -0.347
   77    HG2  ARG   9           HG2      ARG   9   2.358  -6.197  -1.017
   78    HG3  ARG   9           HG3      ARG   9   3.805  -6.379  -2.007
   79    HD2  ARG   9           HD2      ARG   9   4.862  -7.803  -0.367
   80    HD3  ARG   9           HD3      ARG   9   3.543  -7.575   0.774
   81    HE   ARG   9           HE       ARG   9   3.506  -9.182  -1.724
   82   HH11  ARG   9          HH11      ARG   9   1.565  -8.010   0.936
   83   HH12  ARG   9          HH12      ARG   9   0.433  -9.296   0.960
   84   HH21  ARG   9          HH22      ARG   9   1.968 -10.866  -1.839
   85   HH22  ARG   9          HH21      ARG   9   0.657 -10.847  -0.684
   86    H    MET  10           H        MET  10   6.145  -4.448   1.621
   87    HA   MET  10           HA       MET  10   5.868  -1.663   2.646
   88    HB2  MET  10           HB2      MET  10   5.704  -3.426   4.434
   89    HB3  MET  10           HB3      MET  10   7.340  -3.941   4.014
   90    HG2  MET  10           HG2      MET  10   8.180  -1.691   4.613
   91    HG3  MET  10           HG3      MET  10   6.542  -1.164   5.000
   92    HE1  MET  10           HE1      MET  10   7.847  -1.400   8.647
   93    HE2  MET  10           HE2      MET  10   8.772  -0.801   7.258
   94    HE3  MET  10           HE3      MET  10   7.038  -0.410   7.412
   95    H    PHE  11           H        PHE  11   7.376  -0.293   1.922
   96    HA   PHE  11           HA       PHE  11   9.164  -1.190  -0.105
   97    HB2  PHE  11           HB2      PHE  11   7.796   0.915  -0.041
   98    HB3  PHE  11           HB3      PHE  11   8.939   1.566   1.122
   99    HD1  PHE  11           HD2      PHE  11  11.375   1.899   0.384
  100    HD2  PHE  11           HD1      PHE  11   8.232   0.866  -2.380
  101    HE1  PHE  11           HE2      PHE  11  12.765   2.715  -1.497
  102    HE2  PHE  11           HE1      PHE  11   9.632   1.667  -4.265
  103    HZ   PHE  11           HZ       PHE  11  11.892   2.603  -3.831
  104    H    ARG  12           H        ARG  12  10.882  -2.347   0.466
  105    HA   ARG  12           HA       ARG  12  12.649  -2.229   2.571
  106    HB2  ARG  12           HB2      ARG  12  12.721  -3.932   0.897
  107    HB3  ARG  12           HB3      ARG  12  13.057  -2.792  -0.386
  108    HG2  ARG  12           HG2      ARG  12  15.174  -2.692   1.668
  109    HG3  ARG  12           HG3      ARG  12  14.899  -4.339   1.124
  110    HD2  ARG  12           HD2      ARG  12  16.650  -3.215  -0.208
  111    HD3  ARG  12           HD3      ARG  12  15.274  -3.734  -1.193
  112    HE   ARG  12           HE       ARG  12  15.589  -0.914  -0.188
  113   HH11  ARG  12          HH11      ARG  12  15.433  -2.837  -3.089
  114   HH12  ARG  12          HH12      ARG  12  14.582  -1.605  -3.990
  115   HH21  ARG  12          HH21      ARG  12  14.090   0.328  -1.173
  116   HH22  ARG  12          HH22      ARG  12  13.942   0.310  -2.923
  117    H    SER  13           H        SER  13  14.086  -0.906   3.353
  118    HA   SER  13           HA       SER  13  15.760   0.571   3.582
  119    HB2  SER  13           HB2      SER  13  15.275   1.716   0.820
  120    HB3  SER  13           HB3      SER  13  16.662   1.989   1.873
  121    HG   SER  13           HG       SER  13  17.385  -0.001   1.509
  122    H    ASN  14           H        ASN  14  12.482   1.439   3.112
  123    HA   ASN  14           HA       ASN  14  13.039   3.630   5.001
  124    HB2  ASN  14           HB2      ASN  14  11.690   5.297   3.880
  125    HB3  ASN  14           HB3      ASN  14  13.053   4.811   2.885
  126   HD21  ASN  14          HD22      ASN  14  12.297   5.155   0.779
  127   HD22  ASN  14          HD21      ASN  14  10.801   4.441   0.208
  128    H    GLY  15           H        GLY  15  10.736   1.253   3.767
  129    HA2  GLY  15           HA2      GLY  15   9.343   0.068   5.170
  130    HA3  GLY  15           HA3      GLY  15   9.407   1.322   6.404
  131    H    THR  16           H        THR  16   8.770   2.703   3.329
  132    HA   THR  16           HA       THR  16   6.147   3.555   3.957
  133    HB   THR  16           HB       THR  16   7.265   3.176   1.147
  134    HG1  THR  16           HG1      THR  16   8.692   4.398   2.261
  135   HG21  THR  16          HG21      THR  16   4.872   3.694   1.139
  136   HG22  THR  16          HG22      THR  16   5.124   5.013   2.310
  137   HG23  THR  16          HG23      THR  16   5.788   5.136   0.671
  138    H    VAL  17           H        VAL  17   4.365   2.292   4.246
  139    HA   VAL  17           HA       VAL  17   4.191  -0.311   2.936
  140    HB   VAL  17           HB       VAL  17   2.316   1.185   4.766
  141   HG11  VAL  17          HG11      VAL  17   0.935  -0.877   4.891
  142   HG12  VAL  17          HG12      VAL  17   0.830  -0.112   3.307
  143   HG13  VAL  17          HG13      VAL  17   1.844  -1.554   3.526
  144   HG21  VAL  17          HG21      VAL  17   3.872  -1.426   5.047
  145   HG22  VAL  17          HG22      VAL  17   4.357   0.132   5.754
  146   HG23  VAL  17          HG23      VAL  17   2.878  -0.665   6.308
  147    H    TYR  18           H        TYR  18   2.892  -0.933   1.351
  148    HA   TYR  18           HA       TYR  18   1.383   0.970  -0.319
  149    HB2  TYR  18           HB2      TYR  18   2.727   0.716  -2.250
  150    HB3  TYR  18           HB3      TYR  18   3.810   1.202  -0.976
  151    HD1  TYR  18           HD1      TYR  18   5.442  -0.494  -0.041
  152    HD2  TYR  18           HD2      TYR  18   2.945  -1.314  -3.454
  153    HE1  TYR  18           HE1      TYR  18   6.957  -2.364  -0.715
  154    HE2  TYR  18           HE2      TYR  18   4.437  -3.206  -4.096
  155    HH   TYR  18           HH       TYR  18   7.378  -4.002  -2.246
  156    H    TYR  19           H        TYR  19   0.695  -0.561  -2.471
  157    HA   TYR  19           HA       TYR  19   0.097  -3.277  -1.399
  158    HB2  TYR  19           HB2      TYR  19  -1.805  -1.265  -2.550
  159    HB3  TYR  19           HB3      TYR  19  -2.046  -2.960  -2.893
  160    HD1  TYR  19           HD2      TYR  19  -1.186  -1.016   0.254
  161    HD2  TYR  19           HD1      TYR  19  -3.711  -3.937  -1.634
  162    HE1  TYR  19           HE2      TYR  19  -2.471  -1.265   2.352
  163    HE2  TYR  19           HE1      TYR  19  -4.987  -4.205   0.473
  164    HH   TYR  19           HH       TYR  19  -4.416  -1.996   3.271
  165    H    PHE  20           H        PHE  20  -0.064  -4.897  -2.770
  166    HA   PHE  20           HA       PHE  20   1.108  -4.635  -5.502
  167    HB2  PHE  20           HB2      PHE  20   2.769  -5.385  -3.889
  168    HB3  PHE  20           HB3      PHE  20   1.651  -6.582  -3.238
  169    HD1  PHE  20           HD1      PHE  20   3.636  -5.678  -6.276
  170    HD2  PHE  20           HD2      PHE  20   1.471  -8.787  -4.192
  171    HE1  PHE  20           HE1      PHE  20   4.633  -7.383  -7.769
  172    HE2  PHE  20           HE2      PHE  20   2.511 -10.486  -5.676
  173    HZ   PHE  20           HZ       PHE  20   4.087  -9.792  -7.455
  174    H    ASN  21           H        ASN  21  -0.169  -5.519  -7.024
  175    HA   ASN  21           HA       ASN  21  -2.533  -7.091  -6.296
  176    HB2  ASN  21           HB2      ASN  21  -2.544  -5.385  -8.146
  177    HB3  ASN  21           HB3      ASN  21  -1.428  -6.410  -9.021
  178   HD21  ASN  21          HD22      ASN  21  -4.786  -6.005  -7.930
  179   HD22  ASN  21          HD21      ASN  21  -5.367  -7.436  -8.768
  180    H    HIS  22           H        HIS  22  -1.954  -9.033  -5.446
  181    HA   HIS  22           HA       HIS  22   0.303 -10.532  -6.392
  182    HB2  HIS  22           HB2      HIS  22  -0.139 -11.977  -4.644
  183    HB3  HIS  22           HB3      HIS  22  -0.733 -10.445  -4.043
  184    HD1  HIS  22           HD1      HIS  22  -2.241 -13.520  -5.832
  185    HD2  HIS  22           HD2      HIS  22  -3.146 -10.572  -2.981
  186    HE1  HIS  22           HE1      HIS  22  -4.574 -14.113  -4.858
  187    H    ILE  23           H        ILE  23  -2.426 -10.080  -8.119
  188    HA   ILE  23           HA       ILE  23  -2.614 -12.864  -9.166
  189    HB   ILE  23           HB       ILE  23  -4.521 -10.502  -9.401
  190   HG12  ILE  23          HG12      ILE  23  -4.631 -13.011  -7.660
  191   HG13  ILE  23          HG13      ILE  23  -4.454 -11.351  -7.096
  192   HG21  ILE  23          HG21      ILE  23  -4.670 -12.044 -11.344
  193   HG22  ILE  23          HG22      ILE  23  -4.920 -13.405 -10.224
  194   HG23  ILE  23          HG23      ILE  23  -6.115 -12.093 -10.352
  195   HD11  ILE  23          HD11      ILE  23  -6.745 -10.847  -8.048
  196   HD12  ILE  23          HD12      ILE  23  -6.937 -12.600  -8.298
  197   HD13  ILE  23          HD13      ILE  23  -6.696 -11.965  -6.669
  198    H    THR  24           H        THR  24  -1.701  -9.576  -9.927
  199    HA   THR  24           HA       THR  24  -1.001 -10.341 -12.751
  200    HB   THR  24           HB       THR  24  -1.159  -7.930 -13.260
  201    HG1  THR  24           HG1      THR  24  -2.269  -7.723 -10.676
  202   HG21  THR  24          HG21      THR  24  -3.578  -7.616 -13.065
  203   HG22  THR  24          HG22      THR  24  -3.214  -9.282 -13.564
  204   HG23  THR  24          HG23      THR  24  -3.697  -8.936 -11.889
  205    H    ASN  25           H        ASN  25   0.296  -9.032  -9.769
  206    HA   ASN  25           HA       ASN  25   2.317  -8.636  -9.029
  207    HB2  ASN  25           HB2      ASN  25   3.537  -8.739 -11.796
  208    HB3  ASN  25           HB3      ASN  25   4.381  -8.683 -10.261
  209   HD21  ASN  25          HD22      ASN  25   2.498 -10.712 -12.405
  210   HD22  ASN  25          HD21      ASN  25   2.974 -12.236 -11.623
  211    H    ALA  26           H        ALA  26   0.316  -6.646 -10.628
  212    HA   ALA  26           HA       ALA  26   1.942  -4.320 -11.030
  213    HB1  ALA  26           HB1      ALA  26  -0.342  -4.646 -11.953
  214    HB2  ALA  26           HB2      ALA  26  -1.014  -4.512 -10.314
  215    HB3  ALA  26           HB3      ALA  26  -0.190  -3.126 -11.054
  216    H    SER  27           H        SER  27   1.973  -2.324  -9.720
  217    HA   SER  27           HA       SER  27   1.895  -2.748  -6.766
  218    HB2  SER  27           HB2      SER  27   4.139  -1.771  -6.657
  219    HB3  SER  27           HB3      SER  27   4.160  -3.240  -7.654
  220    HG   SER  27           HG       SER  27   3.723  -0.698  -8.809
  221    H    GLN  28           H        GLN  28   1.062  -1.000  -5.645
  222    HA   GLN  28           HA       GLN  28   1.157   1.711  -6.824
  223    HB2  GLN  28           HB2      GLN  28  -0.893   0.689  -7.690
  224    HB3  GLN  28           HB3      GLN  28  -1.366   0.169  -6.075
  225    HG2  GLN  28           HG2      GLN  28  -2.634   2.136  -6.922
  226    HG3  GLN  28           HG3      GLN  28  -1.829   2.410  -5.388
  227   HE21  GLN  28          HE22      GLN  28  -1.483   3.104  -8.944
  228   HE22  GLN  28          HE21      GLN  28  -0.543   4.550  -8.611
  229    H    PHE  29           H        PHE  29   0.967   3.384  -5.221
  230    HA   PHE  29           HA       PHE  29   1.679   2.521  -2.476
  231    HB2  PHE  29           HB2      PHE  29   1.862   5.083  -4.037
  232    HB3  PHE  29           HB3      PHE  29   1.781   5.131  -2.284
  233    HD1  PHE  29           HD2      PHE  29   3.604   2.397  -4.158
  234    HD2  PHE  29           HD1      PHE  29   3.929   6.058  -1.883
  235    HE1  PHE  29           HE2      PHE  29   6.017   2.025  -3.902
  236    HE2  PHE  29           HE1      PHE  29   6.367   5.681  -1.659
  237    HZ   PHE  29           HZ       PHE  29   7.415   3.660  -2.652
  238    H    GLU  30           H        GLU  30  -1.044   4.089  -4.198
  239    HA   GLU  30           HA       GLU  30  -2.510   4.419  -1.700
  240    HB2  GLU  30           HB2      GLU  30  -2.900   5.376  -4.234
  241    HB3  GLU  30           HB3      GLU  30  -4.174   4.171  -4.134
  242    HG2  GLU  30           HG2      GLU  30  -3.654   6.464  -2.175
  243    HG3  GLU  30           HG3      GLU  30  -4.880   6.458  -3.438
  244    H    ARG  31           H        ARG  31  -3.977   3.191  -0.887
  245    HA   ARG  31           HA       ARG  31  -3.525   0.246  -1.202
  246    HB2  ARG  31           HB2      ARG  31  -4.705   1.847   1.113
  247    HB3  ARG  31           HB3      ARG  31  -4.362   0.124   1.090
  248    HG2  ARG  31           HG2      ARG  31  -2.369   0.760   2.017
  249    HG3  ARG  31           HG3      ARG  31  -1.888   1.113   0.353
  250    HD2  ARG  31           HD2      ARG  31  -2.556   3.467   0.722
  251    HD3  ARG  31           HD3      ARG  31  -3.105   3.026   2.353
  252    HE   ARG  31           HE       ARG  31  -0.323   3.253   1.384
  253   HH11  ARG  31          HH21      ARG  31  -2.391   2.105   4.083
  254   HH12  ARG  31          HH22      ARG  31  -1.093   2.281   5.223
  255   HH21  ARG  31          HH11      ARG  31   1.319   3.006   2.866
  256   HH22  ARG  31          HH12      ARG  31   0.950   2.894   4.577
  257    HA   PRO  32           HA       PRO  32  -7.651   0.427  -2.881
  258    HB2  PRO  32           HB2      PRO  32  -7.473  -2.584  -3.239
  259    HB3  PRO  32           HB3      PRO  32  -8.059  -1.316  -4.233
  260    HG2  PRO  32           HG2      PRO  32  -5.635  -2.247  -4.692
  261    HG3  PRO  32           HG3      PRO  32  -5.832  -0.526  -4.757
  262    HD2  PRO  32           HD2      PRO  32  -4.859  -2.028  -2.339
  263    HD3  PRO  32           HD3      PRO  32  -4.134  -0.594  -3.137
  264    H    SER  33           H        SER  33  -6.765  -1.146  -0.342
  265    HA   SER  33           HA       SER  33  -9.450  -1.140   1.037
  266    HB2  SER  33           HB2      SER  33  -8.530  -3.399   1.022
  267    HB3  SER  33           HB3      SER  33  -7.031  -2.825   1.775
  268    HG   SER  33           HG       SER  33  -8.456  -3.625   3.350
  269    H    GLY  34           H        GLY  34  -6.284  -1.172   2.742
  270    HA2  GLY  34           HA2      GLY  34  -6.148   1.713   3.129
  271    HA3  GLY  34           HA3      GLY  34  -6.657   0.791   4.550
  Start of MODEL   19
    1    H1   LYS   1           H1       LYS   1  -8.416   4.511  -4.417
    2    H2   LYS   1           H2       LYS   1  -9.808   5.040  -3.756
    3    H3   LYS   1           H3       LYS   1  -9.739   4.708  -5.383
    4    HA   LYS   1           HA       LYS   1  -9.229   2.688  -3.345
    5    HB2  LYS   1           HB2      LYS   1 -11.523   1.783  -3.780
    6    HB3  LYS   1           HB3      LYS   1 -11.381   3.186  -2.755
    7    HG2  LYS   1           HG2      LYS   1 -13.349   3.355  -4.090
    8    HG3  LYS   1           HG3      LYS   1 -12.248   4.658  -4.470
    9    HD2  LYS   1           HD2      LYS   1 -13.499   3.759  -6.414
   10    HD3  LYS   1           HD3      LYS   1 -11.766   3.760  -6.632
   11    HE2  LYS   1           HE2      LYS   1 -12.789   1.740  -7.562
   12    HE3  LYS   1           HE3      LYS   1 -11.658   1.336  -6.274
   13    HZ1  LYS   1           HZ1      LYS   1 -13.464   0.920  -4.784
   14    HZ2  LYS   1           HZ2      LYS   1 -14.611   1.409  -5.913
   15    HZ3  LYS   1           HZ3      LYS   1 -13.644   0.044  -6.037
   16    H    LEU   2           H        LEU   2  -8.884   0.644  -4.083
   17    HA   LEU   2           HA       LEU   2  -9.186   0.061  -6.925
   18    HB2  LEU   2           HB2      LEU   2  -6.574  -0.660  -5.560
   19    HB3  LEU   2           HB3      LEU   2  -7.005  -0.892  -7.166
   20    HG   LEU   2           HG       LEU   2  -6.943   1.490  -7.703
   21   HD11  LEU   2          HD11      LEU   2  -5.443   2.932  -6.368
   22   HD12  LEU   2          HD12      LEU   2  -6.923   2.630  -5.501
   23   HD13  LEU   2          HD13      LEU   2  -5.454   1.762  -5.043
   24   HD21  LEU   2          HD21      LEU   2  -5.187  -0.135  -8.255
   25   HD22  LEU   2          HD22      LEU   2  -4.448   1.401  -7.818
   26   HD23  LEU   2          HD23      LEU   2  -4.461   0.057  -6.644
   27    HA   PRO   3           HA       PRO   3 -10.825  -3.837  -5.934
   28    HB2  PRO   3           HB2      PRO   3  -8.349  -5.102  -7.182
   29    HB3  PRO   3           HB3      PRO   3 -10.052  -5.553  -7.506
   30    HG2  PRO   3           HG2      PRO   3  -8.815  -4.019  -9.257
   31    HG3  PRO   3           HG3      PRO   3 -10.415  -3.432  -8.651
   32    HD2  PRO   3           HD2      PRO   3  -7.641  -2.720  -7.627
   33    HD3  PRO   3           HD3      PRO   3  -8.948  -1.620  -8.120
   34    HA   PRO   4           HA       PRO   4  -9.149  -6.706  -2.804
   35    HB2  PRO   4           HB2      PRO   4 -10.506  -9.013  -3.435
   36    HB3  PRO   4           HB3      PRO   4 -11.268  -7.630  -2.587
   37    HG2  PRO   4           HG2      PRO   4 -11.347  -8.266  -5.552
   38    HG3  PRO   4           HG3      PRO   4 -12.715  -7.838  -4.473
   39    HD2  PRO   4           HD2      PRO   4 -11.568  -5.976  -6.029
   40    HD3  PRO   4           HD3      PRO   4 -12.030  -5.579  -4.354
   41    H    GLY   5           H        GLY   5  -7.386  -8.109  -2.808
   42    HA2  GLY   5           HA2      GLY   5  -5.884  -9.706  -4.050
   43    HA3  GLY   5           HA3      GLY   5  -6.245  -8.768  -5.490
   44    H    TRP   6           H        TRP   6  -6.145  -6.023  -4.091
   45    HA   TRP   6           HA       TRP   6  -3.254  -5.686  -4.060
   46    HB2  TRP   6           HB2      TRP   6  -5.653  -3.996  -3.382
   47    HB3  TRP   6           HB3      TRP   6  -3.985  -3.445  -3.242
   48    HD1  TRP   6           HD1      TRP   6  -6.626  -3.998  -5.900
   49    HE1  TRP   6           HE1      TRP   6  -5.822  -2.866  -8.027
   50    HE3  TRP   6           HE3      TRP   6  -1.819  -3.151  -4.544
   51    HZ2  TRP   6           HZ2      TRP   6  -3.306  -1.910  -9.135
   52    HZ3  TRP   6           HZ3      TRP   6  -0.247  -2.174  -6.099
   53    HH2  TRP   6           HH2      TRP   6  -0.945  -1.499  -8.422
   54    H    GLU   7           H        GLU   7  -1.877  -6.018  -2.393
   55    HA   GLU   7           HA       GLU   7  -2.873  -6.118   0.411
   56    HB2  GLU   7           HB2      GLU   7  -2.517  -8.331  -1.082
   57    HB3  GLU   7           HB3      GLU   7  -0.845  -8.106  -0.605
   58    HG2  GLU   7           HG2      GLU   7  -3.230  -8.313   1.299
   59    HG3  GLU   7           HG3      GLU   7  -2.210  -9.668   0.821
   60    H    LYS   8           H        LYS   8  -1.252  -5.714   2.006
   61    HA   LYS   8           HA       LYS   8   0.442  -3.498   1.459
   62    HB2  LYS   8           HB2      LYS   8  -0.342  -3.434   3.568
   63    HB3  LYS   8           HB3      LYS   8  -0.363  -5.137   3.804
   64    HG2  LYS   8           HG2      LYS   8   2.381  -3.897   3.796
   65    HG3  LYS   8           HG3      LYS   8   1.284  -3.314   5.008
   66    HD2  LYS   8           HD2      LYS   8   2.631  -5.133   5.876
   67    HD3  LYS   8           HD3      LYS   8   0.914  -5.457   6.000
   68    HE2  LYS   8           HE2      LYS   8   2.571  -6.598   3.728
   69    HE3  LYS   8           HE3      LYS   8   2.587  -7.346   5.311
   70    HZ1  LYS   8           HZ1      LYS   8   0.858  -8.268   3.680
   71    HZ2  LYS   8           HZ2      LYS   8   0.278  -7.837   5.165
   72    HZ3  LYS   8           HZ3      LYS   8   0.023  -6.959   3.815
   73    H    ARG   9           H        ARG   9   2.582  -3.211   1.202
   74    HA   ARG   9           HA       ARG   9   4.509  -5.410   1.632
   75    HB2  ARG   9           HB2      ARG   9   4.252  -3.997  -1.060
   76    HB3  ARG   9           HB3      ARG   9   5.647  -4.960  -0.587
   77    HG2  ARG   9           HG2      ARG   9   2.819  -6.020  -0.911
   78    HG3  ARG   9           HG3      ARG   9   4.140  -6.176  -2.076
   79    HD2  ARG   9           HD2      ARG   9   5.418  -7.564  -0.552
   80    HD3  ARG   9           HD3      ARG   9   4.198  -7.395   0.706
   81    HE   ARG   9           HE       ARG   9   4.027  -9.026  -1.755
   82   HH11  ARG   9          HH11      ARG   9   2.163  -7.751   0.909
   83   HH12  ARG   9          HH12      ARG   9   1.053  -9.052   1.037
   84   HH21  ARG   9          HH21      ARG   9   2.501 -10.729  -1.746
   85   HH22  ARG   9          HH22      ARG   9   1.214 -10.656  -0.566
   86    H    MET  10           H        MET  10   6.850  -4.417   1.259
   87    HA   MET  10           HA       MET  10   6.814  -1.730   2.552
   88    HB2  MET  10           HB2      MET  10   7.178  -3.433   4.187
   89    HB3  MET  10           HB3      MET  10   8.473  -4.158   3.227
   90    HG2  MET  10           HG2      MET  10   8.786  -1.245   3.799
   91    HG3  MET  10           HG3      MET  10   8.797  -2.244   5.206
   92    HE1  MET  10           HE1      MET  10  10.267  -4.909   4.552
   93    HE2  MET  10           HE2      MET  10  11.965  -4.460   4.810
   94    HE3  MET  10           HE3      MET  10  10.712  -3.847   5.909
   95    H    PHE  11           H        PHE  11   8.078  -0.155   1.791
   96    HA   PHE  11           HA       PHE  11   9.698  -0.578  -0.577
   97    HB2  PHE  11           HB2      PHE  11   8.526   1.520  -0.057
   98    HB3  PHE  11           HB3      PHE  11   9.673   1.821   1.243
   99    HD1  PHE  11           HD1      PHE  11  11.752   0.499  -1.325
  100    HD2  PHE  11           HD2      PHE  11   9.309   3.951  -0.396
  101    HE1  PHE  11           HE1      PHE  11  13.094   1.862  -2.840
  102    HE2  PHE  11           HE2      PHE  11  10.675   5.310  -1.950
  103    HZ   PHE  11           HZ       PHE  11  12.576   4.272  -3.173
  104    H    ARG  12           H        ARG  12  10.997  -2.196  -0.041
  105    HA   ARG  12           HA       ARG  12  12.969  -2.607   1.815
  106    HB2  ARG  12           HB2      ARG  12  13.058  -3.013  -1.205
  107    HB3  ARG  12           HB3      ARG  12  14.157  -3.803  -0.073
  108    HG2  ARG  12           HG2      ARG  12  12.478  -5.151   0.870
  109    HG3  ARG  12           HG3      ARG  12  11.164  -4.142   0.325
  110    HD2  ARG  12           HD2      ARG  12  12.849  -5.952  -1.408
  111    HD3  ARG  12           HD3      ARG  12  11.180  -6.218  -0.912
  112    HE   ARG  12           HE       ARG  12  12.104  -4.715  -3.155
  113   HH11  ARG  12          HH21      ARG  12   9.405  -4.155  -0.845
  114   HH12  ARG  12          HH22      ARG  12   8.333  -3.900  -2.199
  115   HH21  ARG  12          HH11      ARG  12  10.593  -4.033  -4.678
  116   HH22  ARG  12          HH12      ARG  12   9.002  -3.596  -4.111
  117    H    SER  13           H        SER  13  14.800  -1.704   2.398
  118    HA   SER  13           HA       SER  13  16.749  -0.532   2.450
  119    HB2  SER  13           HB2      SER  13  16.109   1.313   0.175
  120    HB3  SER  13           HB3      SER  13  17.674   0.805   0.819
  121    HG   SER  13           HG       SER  13  15.816  -0.622  -0.735
  122    H    ASN  14           H        ASN  14  13.538   0.775   2.613
  123    HA   ASN  14           HA       ASN  14  14.685   2.659   4.594
  124    HB2  ASN  14           HB2      ASN  14  13.304   4.539   3.872
  125    HB3  ASN  14           HB3      ASN  14  14.465   4.063   2.639
  126   HD21  ASN  14          HD22      ASN  14  13.682   3.678   0.577
  127   HD22  ASN  14          HD21      ASN  14  11.982   3.505   0.216
  128    H    GLY  15           H        GLY  15  11.756   0.907   3.498
  129    HA2  GLY  15           HA2      GLY  15  10.641  -0.359   5.260
  130    HA3  GLY  15           HA3      GLY  15  10.878   0.975   6.366
  131    H    THR  16           H        THR  16   9.986   2.537   3.565
  132    HA   THR  16           HA       THR  16   7.445   3.279   4.621
  133    HB   THR  16           HB       THR  16   8.388   3.652   1.747
  134    HG1  THR  16           HG1      THR  16   9.990   4.454   2.935
  135   HG21  THR  16          HG21      THR  16   6.979   5.663   1.871
  136   HG22  THR  16          HG22      THR  16   6.020   4.201   2.201
  137   HG23  THR  16          HG23      THR  16   6.522   5.259   3.541
  138    H    VAL  17           H        VAL  17   5.650   1.651   4.690
  139    HA   VAL  17           HA       VAL  17   5.605  -0.227   2.679
  140    HB   VAL  17           HB       VAL  17   3.683  -0.949   3.882
  141   HG11  VAL  17          HG11      VAL  17   5.894  -1.456   4.854
  142   HG12  VAL  17          HG12      VAL  17   5.718  -0.045   5.920
  143   HG13  VAL  17          HG13      VAL  17   4.590  -1.407   6.051
  144   HG21  VAL  17          HG21      VAL  17   3.790   1.642   5.367
  145   HG22  VAL  17          HG22      VAL  17   2.523   1.074   4.246
  146   HG23  VAL  17          HG23      VAL  17   2.756   0.244   5.793
  147    H    TYR  18           H        TYR  18   3.725  -0.821   1.469
  148    HA   TYR  18           HA       TYR  18   2.102   1.274   0.244
  149    HB2  TYR  18           HB2      TYR  18   3.083   1.181  -1.923
  150    HB3  TYR  18           HB3      TYR  18   4.345   1.589  -0.798
  151    HD1  TYR  18           HD1      TYR  18   6.154  -0.069  -0.265
  152    HD2  TYR  18           HD2      TYR  18   3.184  -0.773  -3.294
  153    HE1  TYR  18           HE1      TYR  18   7.605  -1.823  -1.305
  154    HE2  TYR  18           HE2      TYR  18   4.572  -2.563  -4.282
  155    HH   TYR  18           HH       TYR  18   6.486  -3.677  -4.142
  156    H    TYR  19           H        TYR  19   1.200  -0.130  -2.024
  157    HA   TYR  19           HA       TYR  19   0.529  -2.835  -0.977
  158    HB2  TYR  19           HB2      TYR  19  -1.322  -0.646  -1.784
  159    HB3  TYR  19           HB3      TYR  19  -1.720  -2.261  -2.306
  160    HD1  TYR  19           HD1      TYR  19  -0.595  -0.598   0.949
  161    HD2  TYR  19           HD2      TYR  19  -3.191  -3.446  -0.963
  162    HE1  TYR  19           HE1      TYR  19  -1.449  -1.287   3.127
  163    HE2  TYR  19           HE2      TYR  19  -4.084  -4.125   1.212
  164    HH   TYR  19           HH       TYR  19  -3.822  -3.941   3.507
  165    H    PHE  20           H        PHE  20   0.102  -4.394  -2.365
  166    HA   PHE  20           HA       PHE  20   1.169  -4.206  -5.150
  167    HB2  PHE  20           HB2      PHE  20   2.896  -4.978  -3.635
  168    HB3  PHE  20           HB3      PHE  20   1.769  -6.096  -2.861
  169    HD1  PHE  20           HD1      PHE  20   3.640  -5.458  -6.020
  170    HD2  PHE  20           HD2      PHE  20   1.399  -8.337  -3.694
  171    HE1  PHE  20           HE1      PHE  20   4.455  -7.286  -7.483
  172    HE2  PHE  20           HE2      PHE  20   2.268 -10.153  -5.135
  173    HZ   PHE  20           HZ       PHE  20   3.781  -9.641  -7.023
  174    H    ASN  21           H        ASN  21  -0.177  -5.151  -6.610
  175    HA   ASN  21           HA       ASN  21  -2.544  -6.607  -5.688
  176    HB2  ASN  21           HB2      ASN  21  -2.490  -5.022  -7.659
  177    HB3  ASN  21           HB3      ASN  21  -1.562  -6.243  -8.517
  178   HD21  ASN  21          HD22      ASN  21  -4.758  -5.206  -7.728
  179   HD22  ASN  21          HD21      ASN  21  -5.536  -6.724  -8.169
  180    H    HIS  22           H        HIS  22  -2.120  -8.546  -4.773
  181    HA   HIS  22           HA       HIS  22   0.059 -10.204  -5.660
  182    HB2  HIS  22           HB2      HIS  22  -0.390 -11.483  -3.827
  183    HB3  HIS  22           HB3      HIS  22  -1.024  -9.943  -3.308
  184    HD1  HIS  22           HD1      HIS  22  -2.486 -13.092  -5.012
  185    HD2  HIS  22           HD2      HIS  22  -3.432 -10.076  -2.247
  186    HE1  HIS  22           HE1      HIS  22  -4.815 -13.682  -4.028
  187    H    ILE  23           H        ILE  23  -2.759  -9.640  -7.286
  188    HA   ILE  23           HA       ILE  23  -3.014 -12.391  -8.369
  189    HB   ILE  23           HB       ILE  23  -4.952 -10.072  -8.698
  190   HG12  ILE  23          HG12      ILE  23  -5.022 -12.293  -6.603
  191   HG13  ILE  23          HG13      ILE  23  -4.788 -10.577  -6.279
  192   HG21  ILE  23          HG21      ILE  23  -6.530 -11.788  -9.361
  193   HG22  ILE  23          HG22      ILE  23  -5.090 -11.938 -10.359
  194   HG23  ILE  23          HG23      ILE  23  -5.348 -13.069  -9.008
  195   HD11  ILE  23          HD11      ILE  23  -7.345 -11.883  -7.264
  196   HD12  ILE  23          HD12      ILE  23  -7.043 -11.091  -5.717
  197   HD13  ILE  23          HD13      ILE  23  -7.086 -10.120  -7.196
  198    H    THR  24           H        THR  24  -2.232  -9.016  -9.242
  199    HA   THR  24           HA       THR  24  -1.566  -9.915 -12.025
  200    HB   THR  24           HB       THR  24  -1.852  -7.676 -12.725
  201    HG1  THR  24           HG1      THR  24  -2.557  -6.087 -11.250
  202   HG21  THR  24          HG21      THR  24  -4.210  -8.273 -10.888
  203   HG22  THR  24          HG22      THR  24  -4.215  -7.260 -12.348
  204   HG23  THR  24          HG23      THR  24  -3.955  -9.009 -12.485
  205    H    ASN  25           H        ASN  25  -0.067  -8.770  -9.205
  206    HA   ASN  25           HA       ASN  25   1.920  -8.235  -8.555
  207    HB2  ASN  25           HB2      ASN  25   3.730  -9.116  -9.428
  208    HB3  ASN  25           HB3      ASN  25   2.655  -9.838 -10.612
  209   HD21  ASN  25          HD22      ASN  25   2.224  -8.077 -12.556
  210   HD22  ASN  25          HD21      ASN  25   3.769  -7.435 -13.160
  211    H    ALA  26           H        ALA  26   0.035  -6.240 -10.249
  212    HA   ALA  26           HA       ALA  26   1.722  -3.988 -10.723
  213    HB1  ALA  26           HB1      ALA  26  -1.193  -4.090  -9.839
  214    HB2  ALA  26           HB2      ALA  26  -0.374  -2.705 -10.593
  215    HB3  ALA  26           HB3      ALA  26  -0.607  -4.199 -11.516
  216    H    SER  27           H        SER  27   1.879  -1.947  -9.417
  217    HA   SER  27           HA       SER  27   1.838  -2.354  -6.463
  218    HB2  SER  27           HB2      SER  27   4.135  -1.309  -8.135
  219    HB3  SER  27           HB3      SER  27   3.991  -1.091  -6.379
  220    HG   SER  27           HG       SER  27   3.925  -3.601  -7.703
  221    H    GLN  28           H        GLN  28   1.314  -0.553  -5.237
  222    HA   GLN  28           HA       GLN  28   0.847   2.094  -6.441
  223    HB2  GLN  28           HB2      GLN  28  -1.149   0.828  -7.061
  224    HB3  GLN  28           HB3      GLN  28  -1.298   0.172  -5.430
  225    HG2  GLN  28           HG2      GLN  28  -2.978   1.899  -5.955
  226    HG3  GLN  28           HG3      GLN  28  -2.015   2.242  -4.538
  227   HE21  GLN  28          HE22      GLN  28  -2.233   3.074  -8.098
  228   HE22  GLN  28          HE21      GLN  28  -1.577   4.675  -7.805
  229    H    PHE  29           H        PHE  29   0.515   3.724  -4.697
  230    HA   PHE  29           HA       PHE  29   1.431   2.754  -2.031
  231    HB2  PHE  29           HB2      PHE  29   1.714   5.365  -3.446
  232    HB3  PHE  29           HB3      PHE  29   1.571   5.352  -1.693
  233    HD1  PHE  29           HD1      PHE  29   3.411   3.244  -4.272
  234    HD2  PHE  29           HD2      PHE  29   3.570   5.318  -0.491
  235    HE1  PHE  29           HE1      PHE  29   5.777   2.584  -4.006
  236    HE2  PHE  29           HE2      PHE  29   5.937   4.646  -0.234
  237    HZ   PHE  29           HZ       PHE  29   7.050   3.280  -1.989
  238    H    GLU  30           H        GLU  30  -1.451   4.107  -3.621
  239    HA   GLU  30           HA       GLU  30  -2.865   4.575  -1.148
  240    HB2  GLU  30           HB2      GLU  30  -3.652   5.270  -3.440
  241    HB3  GLU  30           HB3      GLU  30  -4.073   3.578  -3.745
  242    HG2  GLU  30           HG2      GLU  30  -5.405   3.970  -1.387
  243    HG3  GLU  30           HG3      GLU  30  -5.343   5.627  -1.935
  244    H    ARG  31           H        ARG  31  -3.999   3.222   0.092
  245    HA   ARG  31           HA       ARG  31  -3.508   0.292  -0.026
  246    HB2  ARG  31           HB2      ARG  31  -2.903   1.455   1.986
  247    HB3  ARG  31           HB3      ARG  31  -4.515   2.142   2.175
  248    HG2  ARG  31           HG2      ARG  31  -4.513  -0.811   1.999
  249    HG3  ARG  31           HG3      ARG  31  -3.446  -0.196   3.259
  250    HD2  ARG  31           HD2      ARG  31  -5.651  -0.726   4.172
  251    HD3  ARG  31           HD3      ARG  31  -5.188   0.965   4.405
  252    HE   ARG  31           HE       ARG  31  -6.553   1.353   2.238
  253   HH11  ARG  31          HH12      ARG  31  -7.666  -1.201   4.411
  254   HH12  ARG  31          HH11      ARG  31  -9.124  -1.363   3.440
  255   HH21  ARG  31          HH21      ARG  31  -8.318   1.129   1.273
  256   HH22  ARG  31          HH22      ARG  31  -9.571   0.020   1.854
  257    HA   PRO  32           HA       PRO  32  -7.750   0.427  -1.696
  258    HB2  PRO  32           HB2      PRO  32  -7.230  -2.210  -2.919
  259    HB3  PRO  32           HB3      PRO  32  -7.602  -0.615  -3.626
  260    HG2  PRO  32           HG2      PRO  32  -5.251  -1.728  -3.959
  261    HG3  PRO  32           HG3      PRO  32  -5.413  -0.022  -3.835
  262    HD2  PRO  32           HD2      PRO  32  -4.844  -1.948  -1.521
  263    HD3  PRO  32           HD3      PRO  32  -3.919  -0.494  -1.939
  264    H    SER  33           H        SER  33  -9.456  -1.533  -2.137
  265    HA   SER  33           HA       SER  33  -9.488  -3.714  -0.325
  266    HB2  SER  33           HB2      SER  33 -11.425  -1.465   0.387
  267    HB3  SER  33           HB3      SER  33 -11.514  -3.130   1.003
  268    HG   SER  33           HG       SER  33  -9.011  -2.063   1.226
  269    H    GLY  34           H        GLY  34 -11.672  -1.450  -2.165
  270    HA2  GLY  34           HA2      GLY  34 -12.294  -3.433  -4.114
  271    HA3  GLY  34           HA3      GLY  34 -13.675  -3.058  -3.064