*HEADER    ISOMERASE                               07-JUN-13   2M9E              
*TITLE     NMR SOLUTION STRUCTURE OF PIN1 WW DOMAIN MUTANT 5-1                   
*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, SEE REMARK 999);    
*COMPND   5 SYNONYM: PEPTIDYL-PROLYL CIS-TRANS ISOMERASE PIN1, PPIASE PIN1,      
*COMPND   6 ROTAMASE PIN1;                                                       
*COMPND   7 ENGINEERED: 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    20                                                                    
*AUTHOR    S.ENCK, W.CHEN, J.L.PRICE, E.T.POWERS, C.WONG, H.J.DYSON, J.W.KELLY   
*REVDAT   1   26-JUN-13 2M9E    0                                                


# SEA003  5-residue turn without GlcNAc

# intra-residue distance restraints

 # HA/H

# 5 GLY HA2 5 GLY H 3.00  # 469 0.4381
# 5 GLY HA3 5 GLY H 2.96  # 470 0.4729
# 6 TRP HA 6 TRP H 2.81  # 472 0.6576
# 7 GLU HA 7 GLU H 3.23  # 473 0.2742
# 8 LYS HA 8 LYS H 3.29  # 474 0.2460
# 10 MET HA 10 MET H 3.35  # 252 0.2181 only 003
# 12 ALA HA 12 ALA H 3.61  # 299 0.1326
# 13 ASN HA 13 ASN H 3.18  # 479 0.3045
# 14 GLY HA3 14 GLY H 2.48  # 481 1.4101
# 15 THR HA 15 THR H 3.04  # 482 0.4023 only 003
# 17 TYR HA 17 TYR H 3.46  # 483 0.1777
# 19 PHE HA 19 PHE H 3.60  # 305 0.1349
# 21 HIS HA 21 HIS H 2.74  # 484 0.7687
# 23 THR HA 23 THR H 2.63  # 488 0.9817
# 25 ALA HA 25 ALA H 3.01  # 490 0.4318
# 26 SER HA 26 SER H 3.41  # 491 0.1940
# 27 GLN HA 27 GLN H 3.56  # 492 0.1468
# 28 PHE HA 28 PHE H 3.50  # 493 0.1641 003 slight ol
# 30 ARG HA 30 ARG H 3.31  # 497 0.2365

 # HB/H

6 TRP HB2 6 TRP H 4.00  # 412,414 1.0667
6 TRP HB3 6 TRP H 4.00  # 413,415 0.9153
7 GLU HB2 7 GLU H 4.00  # 416,417 0.3087
8 LYS HB2 8 LYS H 4.00  # 418,420 0.4923
8 LYS HB3 8 LYS H 4.00  # 419,421 0.5709
9 ARG QB 9 ARG H 4.50  # 272 0.2964 2 protons
10 MET HB2 10 MET H 4.00  # 422,423 0.1994
11 PHE HB2 11 PHE H 4.00  # 106,288 0.3064
11 PHE HB3 11 PHE H 4.00  # 107,289 0.2858
12 ALA QB 12 ALA H 5.00  # 296 0.2144
13 ASN HB2 13 ASN H 4.00  # 426 0.0716
13 ASN HB3 13 ASN H 4.00  # 425,427 0.2664
16 VAL HB 16 VAL H 3.00  # 267 0.9991
19 PHE HB3 19 PHE H 4.00  # 85,301 0.3681
19 PHE HB2 19 PHE H 4.00  # 97,303 0.2590
20 ASN HB2 20 ASN H 4.00  # 429,431 0.5075
20 ASN HB3 20 ASN H 4.00  # 430,432 0.6080
22 ILE HB 22 ILE H 3.50  # 433,434 0.7151
27 GLN QB 27 GLN H 4.00  # 437 0.4015 2 protons
28 PHE HB2 28 PHE H 4.00  # 282 0.2622
28 PHE HB3 28 PHE H 4.00  # 283 0.1997

 # HB/HA

2 LEU HB2 2 LEU HA 4.00  # 439 0.3059
2 LEU HB3 2 LEU HA 4.00  # 440 0.5656
6 TRP HB2 6 TRP HA 4.00  # 441 0.2966
6 TRP HB3 6 TRP HA 4.00  # 442 0.2611
7 GLU HB2 7 GLU HA 3.00  # 443 0.8694
8 LYS HB2 8 LYS HA 4.00  # 444 0.3330
8 LYS HB3 8 LYS HA 4.00  # 445 0.3533
9 ARG QB 9 ARG HA 3.50  # 446 0.5149 2 protons
10 MET HB2 10 MET HA 4.00  # 447 0.2776
10 MET HB3 10 MET HA 4.00  # 448 0.3488
11 PHE HB2 11 PHE HA 4.50  # 449 0.0850
11 PHE HB3 11 PHE HA 4.00  # 450 0.2150
13 ASN HB2 13 ASN HA 3.00  # 98 1.4100
13 ASN HB3 13 ASN HA 3.00 # 99 1.1186
16 VAL HB 16 VAL HA 3.50  # 451 0.5660
17 TYR HB2 17 TYR HA 3.00  # 452 1.4827
17 TYR HB3 17 TYR HA 3.00  # 453 0.9995
18 TYR HB2 18 TYR HA 3.50  # 454 0.4787
18 TYR HB3 18 TYR HA 3.50  # 455 0.5662
19 PHE HB3 19 PHE HA 4.00  # 84 0.2441
19 PHE HB2 19 PHE HA 4.00  # 438 0.3530
20 ASN HB2 20 ASN HA 4.00  # 456 0.2854
20 ASN HB3 20 ASN HA 4.00  # 457 0.2346
21 HIS HB2 21 HIS HA 3.50  # 459 0.8734
22 ILE HB 22 ILE HA 4.00  # 460 0.3806
24 ASN HB2 24 ASN HA 3.50  # 461 0.6132
26 SER QB 26 SER HA 4.00  # 121 0.3155 2 protons
27 GLN QB 27 GLN HA 3.50  # 463 0.8542 2 protons
28 PHE HB3 28 PHE HA 3.50  # 465 0.5462
29 GLU HB2 29 GLU HA 3.50  # 466 0.5632
29 GLU HB3 29 GLU HA 4.00  # 467 0.4935
30 ARG QB 30 ARG HA 4.00  # 468 0.5259 2 protons

 # others

9 ARG HG2 9 ARG H 4.50  # 276 0.1317
9 ARG HG3 9 ARG H 4.50  # 277 0.2390
15 THR QG2 15 THR H 5.00  # 244 0.2152
16 VAL QG1 16 VAL H 5.00  # 262 0.2641
16 VAL QG2 16 VAL H 5.00  # 263 0.6573
17 TYR QD 17 TYR H 4.00  # 169,269 0.3612
17 TYR QE 17 TYR H 5.00  # 152,270 0.0272 very weak
17 TYR HB2 17 TYR QD 3.50  # 89 0.6783
17 TYR HB3 17 TYR QD 3.50  # 90 0.8474
18 TYR QD 18 TYR H 4.00  # 381 0.4434
18 TYR QE 18 TYR H 5.50  # 380 0.2197
18 TYR QD 18 TYR HA 4.00  # 375 0.4702
18 TYR QE 18 TYR HA 5.00  # 374 0.1860
19 PHE QD 19 PHE H 5.00  # 190,309 0.1820
28 PHE HB2 28 PHE QD 4.00  # 100,227 0.3541 ol
28 PHE HB3 28 PHE QD 4.00  # 101,228 0.5403
28 PHE QD 28 PHE H 4.00  # 232,284 0.2585
28 PHE QE 28 PHE HA 5.00  # 198 0.0757 003 very weak

 
# sequential distance restraints

# H/H: values of both cross peaks were mediated (in some cases not due to phasing problems)

6 TRP H 7 GLU H 5.00  # 13,14 0.3667 calibration peak
7 GLU H 8 LYS H 5.00  # 15,16 0.0651 calibration peak
8 LYS H 9 ARG H 4.50  # 17,18 0.1636 calibration peak
9 ARG H 10 MET H 4.50  # 19,20 0.0854 calibration peak
10 MET H 11 PHE H 5.00  # 253 0.0469 only 003
13 ASN H 14 GLY H 4.00  # 236,260 0.3482
14 GLY H 15 THR H 3.50  # 249,261 0.6093
15 THR H 16 VAL H 4.50  # 271 0.1261
17 TYR H 18 TYR H 4.50  # 21,22 0.1498 calibration peak
18 TYR H 19 PHE H 4.50  # 23,24 0.0785 calibration peak, only 003
19 PHE H 20 ASN H 5.00  # 25,26 0.0409 calibration peak
25 ALA H 26 SER H 5.00  # 27,28 0.1034 calibration peak, very weak
28 PHE H 29 GLU H 4.00  # 285 0.2699

# HA/H

5 GLY HA3 6 TRP H 4.00  # 471 0.1478
6 TRP HA 7 GLU H 3.00  # 1 0.9138 calibration peak
7 GLU HA 8 LYS H 3.00  # 2 1.3504 calibration peak
8 LYS HA 9 ARG H 3.00  # 3 2.7518 calibration peak, 003 ol, 004 slight ol
9 ARG HA 10 MET H 3.00  # 4 1.2490 calibration peak
10 MET HA 11 PHE H 3.00  # 476 1.5317
13 ASN HA 14 GLY H 4.00  # 259 0.2325
14 GLY HA2 15 THR H 4.00  # 130 0.2453
15 THR HA 16 VAL H 3.00  # 132 1.5824 
16 VAL HA 15 THR H 5.00  # 248 0.0577 only 003
16 VAL HA 17 TYR H 3.00  # 5 1.4646 calibration peak, 004 slight ol
17 TYR HA 18 TYR H 3.00  # 6 1.5739 calibration peak ol?
18 TYR HA 19 PHE H 3.00  # 7 0.9833 calibration peak
19 PHE HA 20 ASN H 3.00  # 8 0.8932 calibration peak
21 HIS HA 22 ILE H 4.00  # 485 0.3187
22 ILE HA 23 THR H 4.00  # 487 0.1492
25 ALA HA 26 SER H 3.00  # 9 2.1920 calibration peak
26 SER HA 27 GLN H 3.50  # 10,11 0.6337 calibration peak
27 GLN HA 28 PHE H 3.50  # 12 0.4004 calibration peak, 004 H2O line
28 PHE HA 29 GLU H 5.00  # 494 0.0291
29 GLU HA 30 ARG H 3.00  # 496 1.3720
31 PRO HA 32 SER H 3.00  # 500 1.2915
32 SER HA 33 GLY H 3.50  # 501 0.8094

# HA/HA

# --

# HB/H

9 ARG QB 10 MET H 5.00  # 53,251 0.3275 2 protons
10 MET HB2 11 PHE H 4.50  # 70,286 0.1225
10 MET HB3 11 PHE H 4.00  # 71,287 0.1705
11 PHE HB2 12 ALA H 5.00  # 297 0.0774
11 PHE HB3 12 ALA H 5.00  # 298 0.0812
12 ALA QB 13 ASN H 5.00  # 61,233 0.1426
15 THR HB 16 VAL H 4.00  # 133 0.3318
16 VAL HB 17 TYR H 4.50  # 268 0.2368
18 TYR HB2 19 PHE H 4.50  # 302 0.1716
19 PHE HB2 20 ASN H 4.50  # 96 0.1069
26 SER QB 27 GLN H 3.50  # 128,310 0.1634 2 protons
27 GLN QB 28 PHE H 5.00  # 281 0.2917 only 003, 2 protons
31 PRO HB3 32 SER H 4.50  # 329 0.2019
31 PRO HB2 32 SER H 4.50  # 330 0.1822

 # HB/HA

# 3 PRO HB2 2 LEU HA 3.62  # 349 0.1319
# 12 ALA QB 13 ASN HA 4.86  # 60 0.0838

 # SC/SC

# 2 LEU QD1 3 PRO HD2 4.85  # 333 0.0866 ol HE?
# 2 LEU QD1 3 PRO HD3 5.37  # 334 0.0316
# 11 PHE HB3 12 ALA QB 4.99  # 117 0.0661
# 16 VAL QG1 17 TYR QD 4.93  # 58,154 0.0739
# 16 VAL QG2 17 TYR QD 5.28  # 59,155 0.0385
# 21 HIS HD2 22 ILE QD1 4.93  # 195 0.0744
# 22 ILE QG2 23 THR HB 4.80  # 320 0.0941
# 30 ARG QB 31 PRO HD3 4.44  # 356 0.1826
# 30 ARG QB 31 PRO HD3 4.42  # 357 0.1913
# 30 ARG HG2 31 PRO HD3 3.70  # 352 0.1130
# 30 ARG HG2 31 PRO HD2 4.02  # 353 0.0621
# 30 ARG HG3 31 PRO HD3 3.57  # 354 0.1434
# 30 ARG HG3 31 PRO HD2 3.57  # 355 0.1434 sic! 004 ol

# others

8 LYS QG 9 ARG H 4.50  # 275 0.2723 2 protons
15 THR QG2 16 VAL H 5.00  # 65,266 0.4461
# 16 VAL QG1 15 THR HA 6.00  # 54 0.1242
16 VAL QG2 15 THR HA 5.40  # 55 0.4548
16 VAL QG1 17 TYR H 5.60  # 264 0.4631
16 VAL QG2 17 TYR H 4.00  # 265 0.4398
17 TYR QD 16 VAL HA 4.00  # 161 0.1778
17 TYR QD 18 TYR HA 4.50  # 163 0.0875
18 TYR QD 19 PHE H 5.00  # 308 0.0915
21 HIS HD2 22 ILE H 4.00  # 197 0.0645
21 HIS HD2 22 ILE HA 5.00  # 196 0.0280
22 ILE QG2 23 THR HA 5.00  # 319 0.3010
28 PHE QD 29 GLU H 5.40  # 230,254 0.0500
31 PRO HG2 32 SER H 5.00  # 318 0.0516
31 PRO HD3 30 ARG HA 4.00  # 498 0.6227
31 PRO HD2 30 ARG HA 4.00  # 499 0.6647





# long-range distances on turn side

 # BB/BB

# 11 PHE H 13 ASN HA 6.00  # 291 0.3483
11 PHE H 15 THR H 5.00  # 250 0.0658
12 ALA HA 14 GLY H 4.00  # 258 0.3627
19 PHE HA 26 SER HA 4.00  # 31,32 0.2330 calibration peak

 # SC/BB

7 GLU HB2 19 PHE H 5.60  # 300 0.0888
9 ARG H 16 VAL QG1 5.00  # 273 0.1345
9 ARG H 16 VAL QG2 5.00  # 274 0.2672 slight ol
9 ARG H 17 TYR QD 5.00  # 170 0.0660
9 ARG H 18 TYR QD 5.50  # 278 0.0505
9 ARG H 18 TYR QE 5.50  # 279 0.0234
10 MET HA 16 VAL QG1 6.00  # 56 0.1578
10 MET HA 16 VAL QG2 5.00  # 57 0.2385
10 MET H 17 TYR QE 5.60  # 150 0.0068
11 PHE H 15 THR HB 4.50  # 290 0.0925
11 PHE H 17 TYR QE 5.00  # 151,292 0.0401
11 PHE HB2 15 THR H 4.50  # 246 0.1971 only 003
11 PHE HB3 15 THR H 4.00  # 116,245 0.1410
12 ALA QB 14 GLY H 5.60  # 255 0.0403
17 TYR QD 19 PHE HA 5.00  # 164 0.0361
17 TYR QD 26 SER HA 4.00  # 165 0.2250
17 TYR QD 27 GLN H 4.50  # 173,312 0.1040
17 TYR QE 19 PHE H 5.00  # 307 0.0534
19 PHE HB2 26 SER HA 4.50  # 95 0.1388
19 PHE HZ 24 ASN H 4.20  # 204 0.1298

 # SC/SC

9 ARG QB 17 TYR QD 5.60  # 153 0.1206 2 protons
9 ARG QB 17 TYR QE 5.00  # 52,136 0.0655 2 protons, 004 stronger
# 9 ARG QB 19 PHE QD 6.00  # 179 0.1158 2 protons 
9 ARG HG2 17 TYR QD 6.00  # 156 0.0014 very weak
9 ARG HG2 19 PHE QD 5.00  # 178 0.2012
11 PHE QD 17 TYR QD 5.00  # 166,218 0.2863
11 PHE HB2 15 THR HB 4.00  # 104 0.2485
11 PHE HB3 15 THR HB 4.00  # 105 0.1480
15 THR QG2 17 TYR QD 6.00  # 67,157 0.0254
15 THR QG2 28 PHE QD 5.00  # 64,224 0.1788
15 THR QG2 28 PHE QE 5.60  # 63,199 0.1081
15 THR QG2 28 PHE HZ 6.00  # 62,222 0.0265
17 TYR HB2 28 PHE QD 3.50  # 91,225 0.1977
17 TYR HB3 28 PHE QE 5.00  # 200 0.0327
17 TYR QD 19 PHE HB3 5.60  # 158 0.0544
17 TYR QD 26 SER QB 4.00  # 122,159 0.2462 2 protons
17 TYR QE 19 PHE QD 4.50  # 147,188 0.0873
17 TYR QE 19 PHE HB2 4.00  # 94 0.2634 004 stronger
17 TYR QE 26 SER QB 4.50  # 120,143 0.0882 2 protons
19 PHE QD 21 HIS HB3 4.00  # 180 0.5108
19 PHE QD 21 HIS HB2 4.50  # 181 0.2029
19 PHE QE 21 HIS HB3 3.00  # 182 0.4349
19 PHE QE 21 HIS HB2 4.50  # 183 0.1096















# long-range distances on beta sheet side

 # BB/BB

7 GLU H 19 PHE H 4.00  # 40,41 0.1755 calibration peak
7 GLU H 18 TYR HA 4.50  # 34 0.1277 calibration peak, only 003
7 GLU H 20 ASN HA 4.00  # 33 0.2343 calibration peak
8 LYS HA 19 PHE H 4.50  # 36 0.0696 calibration peak
9 ARG H 17 TYR H 4.00  # 42,43 0.2961 calibration peak
9 ARG H 18 TYR HA 4.00  # 35 0.2924 calibration peak
9 ARG H 19 PHE H 5.00  # 44,45 0.0538 calibration peak
18 TYR H 27 GLN H 4.50  # 46,47 0.1492 calibration peak, slight ol
19 PHE HA 27 GLN H 5.00  # 39 0.0654 calibration peak
20 ASN H 26 SER HA 4.50  # 37,38 0.1566 calibration peak

 # SC/BB

# 4 PRO HA 22 ILE QD1 6.00  # 323 0.0402
5 GLY H 22 ILE QD1 6.00  # 331 0.0479 004 vw
5 GLY HA2 22 ILE QD1 5.00  # 321 0.2683
5 GLY HA3 22 ILE QD1 5.00  # 322 0.3178
# 6 TRP H 2 LEU QD1 6.00  # 341 0.0686
6 TRP HA 2 LEU QD1 6.00  # 338 0.0756
7 GLU H 2 LEU QD1 6.00  # 342 0.0477
# 7 GLU HA 2 LEU QD2 5.60  # 335 0.0615
# 7 GLU HA 2 LEU QD1 6.00  # 336 0.4488
8 LYS H 18 TYR QD 5.00  # 379 0.0554
8 LYS H 18 TYR QE 5.00  # 378 0.0659
# 19 PHE H 6 TRP HE3 4.00  # 405 0.2158
# 19 PHE HA 6 TRP HE3 5.00  # 403 0.0620
# 20 ASN H 6 TRP HE3 4.00  # 404 0.3136
20 ASN H 25 ALA QB 5.00  # 348 0.1523
25 ALA H 20 ASN HB2 4.00  # 382 0.2835
25 ALA H 20 ASN HB3 4.00  # 383 0.3831
27 GLN H 6 TRP HH2 4.50  # 393 0.1056
30 ARG H 18 TYR QD 5.60  # 377 0.0627
30 ARG HA 18 TYR QD 4.00  # 373 0.2656 ol 004
30 ARG HA 18 TYR QE 4.00  # 372 0.2702 ol 004

 # SC/SC

2 LEU HG 18 TYR QE 5.60  # 369 0.0928
2 LEU QD2 18 TYR QD 5.00  # 325,363 0.6024
2 LEU QD2 18 TYR QE 5.50  # 324,362 0.8047
2 LEU QD1 6 TRP HB3 5.60  # 332 0.1361
2 LEU QD1 18 TYR QD 5.00  # 340 0.5093
2 LEU QD1 18 TYR QE 5.60  # 339 0.4583
# 3 PRO HB2 6 TRP HD1 4.00  # 389 0.1526
# 3 PRO HG3 6 TRP HD1 4.50  # 350,388 0.1312
# 3 PRO HG2 6 TRP HD1 4.00  # 351 0.4887
# 3 PRO HD3 31 PRO HG2 6.00  # 317 0.1283
# 4 PRO HD2 6 TRP HD1 5.60  # 390 0.0269
# 4 PRO HD3 6 TRP HD1 6.00  # 391 0.0289
# 6 TRP HE1 3 PRO HB2 4.50  # 408 0.0846
# 6 TRP HE1 3 PRO HB3 5.00  # 411 0.0632
# 6 TRP HE1 3 PRO HG3 5.00  # 409 0.0562
# 6 TRP HE1 31 PRO HB3 5.00  # 406 0.0672
# 6 TRP HE1 31 PRO HB2 5.50  # 407 0.1186
# 6 TRP HD1 31 PRO HB2 5.00  # 326 0.0872
# 6 TRP HD1 31 PRO HG3 5.00  # 315 0.0932
# 6 TRP HE3 18 TYR QD 5.00  # 376 0.2362
# 6 TRP HE3 31 PRO HG3 4.50  # 316,395 0.1170
# 6 TRP HE3 31 PRO HG2 5.00  # 397 0.0755
# 6 TRP HE3 31 PRO HD3 5.60  # 402 0.0614
# 6 TRP HZ3 25 ALA QB 5.00  # 345,387 0.2262
# 6 TRP HH2 20 ASN HB2 4.50  # 384 0.1437
# 6 TRP HH2 20 ASN HB3 6.00  # 385 0.0667
# 6 TRP HH2 25 ALA QB 5.00  # 346,386 0.3621
# 6 TRP HZ2 25 ALA QB 5.00  # 401 0.2082
# 6 TRP HZ2 20 ASN HB2 4.50  # 394 0.1562
# 6 TRP HZ2 25 ALA QB 5.60  # 347 0.0867
# 6 TRP HZ2 31 PRO HB3 4.50  # 327,399 0.1843
# 6 TRP HZ2 31 PRO HB2 5.60  # 328,400 0.1286
# 6 TRP HZ2 31 PRO HG3 5.50  # 396 0.0996
# 6 TRP HZ2 31 PRO HG2 6.00  # 398 0.0714
18 TYR QD 30 ARG QB 5.00  # 368 0.1773 2 protons
18 TYR QE 30 ARG QB 5.00  # 367 0.2665 2 protons
18 TYR QE 30 ARG HG3 5.60  # 366 0.0474
18 TYR QD 31 PRO HG3 4.50  # 314,360 0.1089
18 TYR QD 31 PRO HG2 5.00  # 361 0.0549
18 TYR QE 31 PRO HG3 5.60  # 313 0.0541
18 TYR QD 31 PRO HD3 4.50  # 359,371 0.1983
18 TYR QE 31 PRO HD3 4.50  # 358,370 0.1320
20 ASN HB2 25 ALA QB 5.00  # 343 0.2163
23 THR HB 25 ALA QB 5.60  # 392 0.0919
23 THR HG1 25 ALA QB 5.60  # 344 0.2717 yes it?s the OH


# Hydrogen bonding restraints SEA003  5-residue turn without GlcNAc


# Hbonds.lol  (lol = lower distance limit)

# 6 TRP  H     3 PRO  O          1.80     # +0.8  OK
# 6 TRP  N     3 PRO  O          2.70     # +0.8
# 7 GLU  H    19 PHE  O          1.80     # -1.7  PDB: big angle
# 7 GLU  N    19 PHE  O          2.70     # -1.7
# 9 ARG  H    17 TYR  O          1.80     # -3.4  OK
# 9 ARG  N    17 TYR  O          2.70     # -3.4
# 11 PHE  H   15 THR  O          1.80     # -2.5  OK
# 11 PHE  N   15 THR  O          2.70     # -2.5
# 14 GLY  H   11 PHE  O          1.80     # -3.2  bridged with THR15 +0.40
# 14 GLY  N   11 PHE  O          2.70     # -3.2
# 15 THR  H   11 PHE  O          1.80     # -4.6  bridged with GLY14 +0.80
# 15 THR  N   11 PHE  O          2.70     # -4.6
# 17 TYR  H    9 ARG  O          1.80     # -2.8  OK but long in pdb +0.30
# 17 TYR  N    9 ARG  O          2.70     # -2.8
# 18 TYR  H   27 GLN  O          1.80     # -4.2  C-terminal mobility or Ar sc? +0.30
# 18 TYR  N   27 GLN  O          2.70     # -4.2
# 19 PHE  H    7 GLU  O          1.80     # +0.5  OK
# 19 PHE  N    7 GLU  O          2.70     # +0.5
# 20 ASN  H   25 ALA  O          1.80     # -3.8  OK +0.30
# 20 ASN  N   25 ALA  O          2.70     # -3.8
# 21 HIS  H    5 GLY  O          1.80     # -0.7  PDB: big angle +0.30
# 21 HIS  N    5 GLY  O          2.70     # -0.7
# 22 ILE  H   20 ASN  OD1        1.80     # -5.3  bridged with THR23 +0.30
# 22 ILE  N   20 ASN  OD1        2.70     # -5.3
# 23 THR  H   20 ASN  OD1        1.80     # -1.1  bridged with ILE22 +0.30
# 23 THR  N   20 ASN  OD1        2.70     # -1.1
# 24 ASN  H   20 ASN  O          1.80     # -1.8  PDB: big angle +0.30
# 24 ASN  N   20 ASN  O          2.70     # -1.8
# 25 ALA  H   23 THR  OG1        1.80     # -1.1  OK +0.20
# 25 ALA  N   23 THR  OG1        2.70     # -1.1
# 27 GLN  H   18 TYR  O          1.80     # -5.4  but present in PDB. Ar sc? +0.40
# 27 GLN  N   18 TYR  O          2.70     # -5.4
# 28 PHE  H   29 GLU  OE1        1.80     # -5.1  high mobility? +0.40
# 28 PHE  N   29 GLU  OE1        2.70     # -5.1


# Hbonds.upl  (upl = upper distance limit)

6 TRP  H     3 PRO  O          2.40     # +0.8  OK
6 TRP  N     3 PRO  O          3.40     # +0.8
7 GLU  H    19 PHE  O          2.20     # -1.7  PDB: big angle
7 GLU  N    19 PHE  O          3.00     # -1.7
9 ARG  H    17 TYR  O          2.00     # -3.4  OK
9 ARG  N    17 TYR  O          3.00     # -3.4
11 PHE  H   15 THR  O          2.00     # -2.5  OK
11 PHE  N   15 THR  O          3.00     # -2.5
14 GLY  H   11 PHE  O          2.40     # -3.2  bridged with THR15 +0.40
14 GLY  N   11 PHE  O          3.40     # -3.2
15 THR  H   11 PHE  O          3.00     # -4.6  bridged with GLY14 +0.80
15 THR  N   11 PHE  O          3.80     # -4.6
17 TYR  H    9 ARG  O          2.30     # -2.8  OK but long in pdb +0.30
17 TYR  N    9 ARG  O          3.30     # -2.8
18 TYR  H   27 GLN  O          2.30     # -4.2  C-terminal mobility or Ar sc? +0.30
18 TYR  N   27 GLN  O          3.30     # -4.2
19 PHE  H    7 GLU  O          2.00     # +0.5  OK
19 PHE  N    7 GLU  O          3.00     # +0.5
20 ASN  H   25 ALA  O          2.30     # -3.8  OK +0.30
20 ASN  N   25 ALA  O          3.30     # -3.8
21 HIS  H    5 GLY  O          2.30     # -0.7  PDB: big angle +0.30
21 HIS  N    5 GLY  O          3.30     # -0.7
22 ILE  H   20 ASN  OD1        2.30     # -5.3  bridged with THR23 +0.30
22 ILE  N   20 ASN  OD1        3.30     # -5.3
23 THR  H   20 ASN  OD1        2.30     # -1.1  bridged with ILE22 +0.30
23 THR  N   20 ASN  OD1        3.30     # -1.1
24 ASN  H   20 ASN  O          2.30     # -1.8  PDB: big angle +0.30
24 ASN  N   20 ASN  O          3.30     # -1.8
25 ALA  H   23 THR  OG1        2.20     # -1.1  OK +0.20
25 ALA  N   23 THR  OG1        3.20     # -1.1
27 GLN  H   18 TYR  O          2.40     # -5.4  but present in PDB. Ar sc? +0.40
27 GLN  N   18 TYR  O          3.40     # -5.4
28 PHE  H   29 GLU  OE1        2.40     # -5.1  high mobility? +0.40
28 PHE  N   29 GLU  OE1        3.40     # -5.1


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           H1       LYS   1 -12.620  -6.595   1.886
    2    H2   LYS   1           H2       LYS   1 -12.391  -7.072   0.319
    3    H3   LYS   1           H3       LYS   1 -12.920  -5.558   0.629
    4    HA   LYS   1           HA       LYS   1 -10.867  -4.999   1.738
    5    HB2  LYS   1           HB2      LYS   1  -8.937  -6.464   1.551
    6    HB3  LYS   1           HB3      LYS   1 -10.209  -7.268   2.435
    7    HG2  LYS   1           HG2      LYS   1 -10.573  -8.865   0.826
    8    HG3  LYS   1           HG3      LYS   1 -10.135  -7.829  -0.523
    9    HD2  LYS   1           HD2      LYS   1  -8.063  -8.925   1.430
   10    HD3  LYS   1           HD3      LYS   1  -8.570  -9.756  -0.051
   11    HE2  LYS   1           HE2      LYS   1  -7.976  -7.704  -1.370
   12    HE3  LYS   1           HE3      LYS   1  -7.290  -6.989   0.093
   13    HZ1  LYS   1           HZ1      LYS   1  -5.575  -8.669   0.119
   14    HZ2  LYS   1           HZ2      LYS   1  -6.363  -9.562  -1.035
   15    HZ3  LYS   1           HZ3      LYS   1  -5.693  -8.111  -1.409
   16    H    LEU   2           H        LEU   2  -8.609  -5.084   0.181
   17    HA   LEU   2           HA       LEU   2  -8.960  -3.415  -1.922
   18    HB2  LEU   2           HB2      LEU   2  -6.845  -5.566  -1.918
   19    HB3  LEU   2           HB3      LEU   2  -6.709  -3.915  -2.498
   20    HG   LEU   2           HG       LEU   2  -6.953  -4.674   0.450
   21   HD11  LEU   2          HD11      LEU   2  -4.532  -4.154   0.547
   22   HD12  LEU   2          HD12      LEU   2  -4.943  -5.616  -0.364
   23   HD13  LEU   2          HD13      LEU   2  -4.509  -4.128  -1.237
   24   HD21  LEU   2          HD21      LEU   2  -7.642  -2.351  -0.116
   25   HD22  LEU   2          HD22      LEU   2  -6.193  -2.420   0.902
   26   HD23  LEU   2          HD23      LEU   2  -6.046  -2.067  -0.827
   27    HA   PRO   3           HA       PRO   3 -10.787  -5.753  -5.267
   28    HB2  PRO   3           HB2      PRO   3  -9.011  -4.210  -7.146
   29    HB3  PRO   3           HB3      PRO   3 -10.787  -4.393  -7.170
   30    HG2  PRO   3           HG2      PRO   3  -9.629  -2.102  -6.291
   31    HG3  PRO   3           HG3      PRO   3 -11.086  -2.780  -5.493
   32    HD2  PRO   3           HD2      PRO   3  -8.208  -2.965  -4.609
   33    HD3  PRO   3           HD3      PRO   3  -9.702  -2.672  -3.663
   34    HA   PRO   4           HA       PRO   4  -8.871  -9.327  -6.716
   35    HB2  PRO   4           HB2      PRO   4  -8.985  -8.294  -9.561
   36    HB3  PRO   4           HB3      PRO   4  -9.288  -9.959  -8.958
   37    HG2  PRO   4           HG2      PRO   4 -11.377  -8.300  -9.344
   38    HG3  PRO   4           HG3      PRO   4 -11.290  -9.256  -7.828
   39    HD2  PRO   4           HD2      PRO   4 -10.611  -6.358  -8.277
   40    HD3  PRO   4           HD3      PRO   4 -11.453  -7.118  -6.893
   41    H    GLY   5           H        GLY   5  -6.926  -9.712  -6.043
   42    HA2  GLY   5           HA2      GLY   5  -4.699 -10.277  -6.381
   43    HA3  GLY   5           HA3      GLY   5  -4.589  -9.137  -7.723
   44    H    TRP   6           H        TRP   6  -5.864  -6.984  -5.697
   45    HA   TRP   6           HA       TRP   6  -3.251  -5.920  -5.060
   46    HB2  TRP   6           HB2      TRP   6  -6.059  -4.998  -4.440
   47    HB3  TRP   6           HB3      TRP   6  -4.618  -4.157  -3.881
   48    HD1  TRP   6           HD1      TRP   6  -6.838  -4.422  -6.811
   49    HE1  TRP   6           HE1      TRP   6  -5.952  -2.972  -8.762
   50    HE3  TRP   6           HE3      TRP   6  -2.124  -3.504  -5.065
   51    HZ2  TRP   6           HZ2      TRP   6  -3.505  -1.604  -9.457
   52    HZ3  TRP   6           HZ3      TRP   6  -0.522  -2.161  -6.419
   53    HH2  TRP   6           HH2      TRP   6  -1.211  -1.210  -8.595
   54    H    GLU   7           H        GLU   7  -2.042  -6.131  -3.350
   55    HA   GLU   7           HA       GLU   7  -3.188  -6.841  -0.714
   56    HB2  GLU   7           HB2      GLU   7  -1.317  -8.370  -2.454
   57    HB3  GLU   7           HB3      GLU   7  -0.762  -8.138  -0.811
   58    HG2  GLU   7           HG2      GLU   7  -3.484  -9.294  -1.549
   59    HG3  GLU   7           HG3      GLU   7  -2.058 -10.241  -1.125
   60    H    LYS   8           H        LYS   8  -2.600  -5.496   0.788
   61    HA   LYS   8           HA       LYS   8  -0.746  -3.400   0.690
   62    HB2  LYS   8           HB2      LYS   8  -1.209  -3.144   3.005
   63    HB3  LYS   8           HB3      LYS   8  -2.705  -3.607   2.222
   64    HG2  LYS   8           HG2      LYS   8  -0.938  -5.345   3.979
   65    HG3  LYS   8           HG3      LYS   8  -2.521  -4.682   4.375
   66    HD2  LYS   8           HD2      LYS   8  -3.515  -6.094   2.514
   67    HD3  LYS   8           HD3      LYS   8  -1.919  -6.854   2.334
   68    HE2  LYS   8           HE2      LYS   8  -2.040  -7.535   4.747
   69    HE3  LYS   8           HE3      LYS   8  -3.721  -6.965   4.760
   70    HZ1  LYS   8           HZ1      LYS   8  -2.598  -9.063   2.958
   71    HZ2  LYS   8           HZ2      LYS   8  -3.672  -9.332   4.204
   72    HZ3  LYS   8           HZ3      LYS   8  -4.048  -8.520   2.784
   73    H    ARG   9           H        ARG   9   1.317  -3.204   1.125
   74    HA   ARG   9           HA       ARG   9   2.980  -5.310   2.379
   75    HB2  ARG   9           HB2      ARG   9   3.375  -4.205  -0.444
   76    HB3  ARG   9           HB3      ARG   9   4.587  -5.148   0.419
   77    HG2  ARG   9           HG2      ARG   9   1.863  -6.184  -0.465
   78    HG3  ARG   9           HG3      ARG   9   3.400  -6.476  -1.242
   79    HD2  ARG   9           HD2      ARG   9   4.245  -7.684   0.707
   80    HD3  ARG   9           HD3      ARG   9   2.793  -7.321   1.628
   81    HE   ARG   9           HE       ARG   9   3.059  -9.245  -0.609
   82   HH11  ARG   9          HH11      ARG   9   0.776  -7.780   1.660
   83   HH12  ARG   9          HH12      ARG   9  -0.373  -9.089   1.460
   84   HH21  ARG   9          HH21      ARG   9   1.505 -10.909  -0.742
   85   HH22  ARG   9          HH22      ARG   9   0.076 -10.769   0.257
   86    H    MET  10           H        MET  10   5.467  -4.239   2.111
   87    HA   MET  10           HA       MET  10   5.342  -1.417   2.864
   88    HB2  MET  10           HB2      MET  10   6.218  -1.783   5.104
   89    HB3  MET  10           HB3      MET  10   4.623  -2.507   4.925
   90    HG2  MET  10           HG2      MET  10   5.676  -4.738   4.608
   91    HG3  MET  10           HG3      MET  10   7.269  -4.019   4.847
   92    HE1  MET  10           HE1      MET  10   7.338  -3.124   8.617
   93    HE2  MET  10           HE2      MET  10   8.246  -3.225   7.092
   94    HE3  MET  10           HE3      MET  10   6.961  -2.008   7.290
   95    H    PHE  11           H        PHE  11   7.214  -0.390   2.831
   96    HA   PHE  11           HA       PHE  11   9.343  -1.718   1.270
   97    HB2  PHE  11           HB2      PHE  11   7.864   0.180   0.397
   98    HB3  PHE  11           HB3      PHE  11   8.640   1.232   1.569
   99    HD1  PHE  11           HD2      PHE  11   9.370  -1.153  -1.226
  100    HD2  PHE  11           HD1      PHE  11  10.609   2.386   0.890
  101    HE1  PHE  11           HE2      PHE  11  11.243  -0.836  -2.845
  102    HE2  PHE  11           HE1      PHE  11  12.478   2.703  -0.725
  103    HZ   PHE  11           HZ       PHE  11  12.796   1.086  -2.584
  104    H    ALA  12           H        ALA  12  11.545  -1.296   1.656
  105    HA   ALA  12           HA       ALA  12  12.334  -1.464   4.320
  106    HB1  ALA  12           HB1      ALA  12  14.613  -1.398   3.382
  107    HB2  ALA  12           HB2      ALA  12  13.544  -2.409   2.393
  108    HB3  ALA  12           HB3      ALA  12  13.978  -0.770   1.847
  109    H    ASN  13           H        ASN  13  11.878   1.491   2.493
  110    HA   ASN  13           HA       ASN  13  13.473   3.165   4.255
  111    HB2  ASN  13           HB2      ASN  13  12.640   3.513   1.756
  112    HB3  ASN  13           HB3      ASN  13  11.217   4.209   2.543
  113   HD21  ASN  13          HD22      ASN  13  12.258   5.715   4.624
  114   HD22  ASN  13          HD21      ASN  13  13.363   6.911   3.918
  115    H    GLY  14           H        GLY  14  10.601   1.476   4.901
  116    HA2  GLY  14           HA2      GLY  14   9.285   1.588   6.808
  117    HA3  GLY  14           HA3      GLY  14   9.961   3.173   7.219
  118    H    THR  15           H        THR  15   7.891   1.608   4.678
  119    HA   THR  15           HA       THR  15   5.781   3.595   5.053
  120    HB   THR  15           HB       THR  15   7.506   3.535   2.547
  121    HG1  THR  15           HG1      THR  15   7.604   4.987   4.625
  122   HG21  THR  15          HG21      THR  15   5.253   3.601   1.655
  123   HG22  THR  15          HG22      THR  15   4.764   4.826   2.857
  124   HG23  THR  15          HG23      THR  15   5.935   5.225   1.585
  125    H    VAL  16           H        VAL  16   3.801   2.905   3.958
  126    HA   VAL  16           HA       VAL  16   3.789   0.015   3.247
  127    HB   VAL  16           HB       VAL  16   1.766   1.908   4.404
  128   HG11  VAL  16          HG11      VAL  16   0.484   1.087   2.471
  129   HG12  VAL  16          HG12      VAL  16   0.946  -0.589   2.852
  130   HG13  VAL  16          HG13      VAL  16  -0.086   0.334   3.958
  131   HG21  VAL  16          HG21      VAL  16   3.109   0.288   5.772
  132   HG22  VAL  16          HG22      VAL  16   1.367  -0.035   5.857
  133   HG23  VAL  16          HG23      VAL  16   2.403  -1.046   4.825
  134    H    TYR  17           H        TYR  17   3.005  -0.739   1.361
  135    HA   TYR  17           HA       TYR  17   1.946   1.138  -0.637
  136    HB2  TYR  17           HB2      TYR  17   3.438   0.619  -2.358
  137    HB3  TYR  17           HB3      TYR  17   4.457   0.947  -0.984
  138    HD1  TYR  17           HD1      TYR  17   5.552  -0.928   0.272
  139    HD2  TYR  17           HD2      TYR  17   3.462  -1.593  -3.456
  140    HE1  TYR  17           HE1      TYR  17   6.747  -3.077  -0.023
  141    HE2  TYR  17           HE2      TYR  17   4.664  -3.738  -3.733
  142    HH   TYR  17           HH       TYR  17   7.131  -4.868  -1.428
  143    H    TYR  18           H        TYR  18   1.378  -0.357  -2.696
  144    HA   TYR  18           HA       TYR  18   0.009  -2.807  -1.698
  145    HB2  TYR  18           HB2      TYR  18  -1.023  -0.573  -3.479
  146    HB3  TYR  18           HB3      TYR  18  -1.841  -2.112  -3.204
  147    HD1  TYR  18           HD2      TYR  18  -2.745  -2.720  -1.036
  148    HD2  TYR  18           HD1      TYR  18  -0.882   1.113  -1.657
  149    HE1  TYR  18           HE2      TYR  18  -3.758  -1.883   1.072
  150    HE2  TYR  18           HE1      TYR  18  -1.822   1.916   0.500
  151    HH   TYR  18           HH       TYR  18  -4.386   0.195   2.181
  152    H    PHE  19           H        PHE  19   0.305  -4.570  -2.904
  153    HA   PHE  19           HA       PHE  19   1.563  -4.352  -5.607
  154    HB2  PHE  19           HB2      PHE  19   3.064  -5.279  -3.910
  155    HB3  PHE  19           HB3      PHE  19   1.834  -6.410  -3.383
  156    HD1  PHE  19           HD2      PHE  19   3.770  -5.390  -6.442
  157    HD2  PHE  19           HD1      PHE  19   1.784  -8.605  -4.349
  158    HE1  PHE  19           HE2      PHE  19   4.601  -6.996  -8.117
  159    HE2  PHE  19           HE1      PHE  19   2.650 -10.215  -6.023
  160    HZ   PHE  19           HZ       PHE  19   4.037  -9.416  -7.930
  161    H    ASN  20           H        ASN  20   0.431  -5.261  -7.274
  162    HA   ASN  20           HA       ASN  20  -2.020  -6.789  -6.618
  163    HB2  ASN  20           HB2      ASN  20  -2.179  -4.823  -8.149
  164    HB3  ASN  20           HB3      ASN  20  -1.135  -5.673  -9.269
  165   HD21  ASN  20          HD22      ASN  20  -4.408  -5.435  -7.987
  166   HD22  ASN  20          HD21      ASN  20  -5.070  -6.816  -8.827
  167    H    HIS  21           H        HIS  21  -1.431  -8.879  -6.178
  168    HA   HIS  21           HA       HIS  21   0.797 -10.124  -7.513
  169    HB2  HIS  21           HB2      HIS  21   0.372 -11.987  -6.103
  170    HB3  HIS  21           HB3      HIS  21   0.128 -10.532  -5.168
  171    HD1  HIS  21           HD1      HIS  21  -2.183 -10.348  -3.943
  172    HD2  HIS  21           HD2      HIS  21  -2.079 -13.177  -7.051
  173    HE1  HIS  21           HE1      HIS  21  -4.345 -11.706  -3.768
  174    H    ILE  22           H        ILE  22  -2.206  -9.587  -8.878
  175    HA   ILE  22           HA       ILE  22  -2.148 -12.088 -10.500
  176    HB   ILE  22           HB       ILE  22  -4.211  -9.884 -10.162
  177   HG12  ILE  22          HG12      ILE  22  -4.105 -11.439  -8.260
  178   HG13  ILE  22          HG13      ILE  22  -5.619 -11.556  -9.130
  179   HG21  ILE  22          HG21      ILE  22  -5.741 -11.342 -11.526
  180   HG22  ILE  22          HG22      ILE  22  -4.450 -10.566 -12.441
  181   HG23  ILE  22          HG23      ILE  22  -4.313 -12.283 -12.022
  182   HD11  ILE  22          HD11      ILE  22  -3.305 -13.541  -9.309
  183   HD12  ILE  22          HD12      ILE  22  -4.818 -13.755  -8.420
  184   HD13  ILE  22          HD13      ILE  22  -4.848 -13.675 -10.188
  185    H    THR  23           H        THR  23  -1.153  -8.786 -10.594
  186    HA   THR  23           HA       THR  23  -0.628  -8.973 -13.554
  187    HB   THR  23           HB       THR  23  -1.022  -6.538 -13.653
  188    HG1  THR  23           HG1      THR  23  -2.026  -6.835 -11.031
  189   HG21  THR  23          HG21      THR  23  -3.437  -6.483 -13.407
  190   HG22  THR  23          HG22      THR  23  -2.952  -8.036 -14.113
  191   HG23  THR  23          HG23      THR  23  -3.424  -7.948 -12.404
  192    H    ASN  24           H        ASN  24   0.803  -8.488 -10.469
  193    HA   ASN  24           HA       ASN  24   2.746  -7.877  -9.721
  194    HB2  ASN  24           HB2      ASN  24   3.526  -9.193 -11.850
  195    HB3  ASN  24           HB3      ASN  24   3.973  -7.604 -12.466
  196   HD21  ASN  24          HD22      ASN  24   5.280  -6.286 -10.649
  197   HD22  ASN  24          HD21      ASN  24   6.630  -7.254 -10.006
  198    H    ALA  25           H        ALA  25   0.593  -5.801 -10.894
  199    HA   ALA  25           HA       ALA  25   2.173  -3.409 -11.197
  200    HB1  ALA  25           HB1      ALA  25   0.063  -2.240 -10.884
  201    HB2  ALA  25           HB2      ALA  25  -0.192  -3.642 -11.940
  202    HB3  ALA  25           HB3      ALA  25  -0.705  -3.699 -10.240
  203    H    SER  26           H        SER  26   2.433  -1.651  -9.657
  204    HA   SER  26           HA       SER  26   2.190  -2.271  -6.770
  205    HB2  SER  26           HB2      SER  26   4.472  -1.613  -6.358
  206    HB3  SER  26           HB3      SER  26   4.443  -3.043  -7.416
  207    HG   SER  26           HG       SER  26   4.485  -0.432  -8.491
  208    H    GLN  27           H        GLN  27   1.473  -0.515  -5.703
  209    HA   GLN  27           HA       GLN  27   2.003   2.240  -6.696
  210    HB2  GLN  27           HB2      GLN  27  -0.756   0.970  -6.385
  211    HB3  GLN  27           HB3      GLN  27  -0.500   2.713  -6.334
  212    HG2  GLN  27           HG2      GLN  27   0.503   2.666  -8.597
  213    HG3  GLN  27           HG3      GLN  27   0.236   0.919  -8.686
  214   HE21  GLN  27          HE22      GLN  27  -1.469   4.108  -8.496
  215   HE22  GLN  27          HE21      GLN  27  -2.956   3.418  -9.183
  216    H    PHE  28           H        PHE  28   1.470   3.895  -5.055
  217    HA   PHE  28           HA       PHE  28   1.626   2.855  -2.249
  218    HB2  PHE  28           HB2      PHE  28   2.037   5.626  -3.425
  219    HB3  PHE  28           HB3      PHE  28   2.080   5.234  -1.708
  220    HD1  PHE  28           HD1      PHE  28   3.754   3.416  -0.916
  221    HD2  PHE  28           HD2      PHE  28   4.038   5.407  -4.728
  222    HE1  PHE  28           HE1      PHE  28   6.139   2.782  -1.065
  223    HE2  PHE  28           HE2      PHE  28   6.431   4.760  -4.882
  224    HZ   PHE  28           HZ       PHE  28   7.490   3.451  -3.051
  225    H    GLU  29           H        GLU  29  -0.276   4.619  -4.564
  226    HA   GLU  29           HA       GLU  29  -2.364   5.717  -3.082
  227    HB2  GLU  29           HB2      GLU  29  -2.687   4.489  -5.850
  228    HB3  GLU  29           HB3      GLU  29  -3.544   5.847  -5.135
  229    HG2  GLU  29           HG2      GLU  29  -2.113   6.953  -6.548
  230    HG3  GLU  29           HG3      GLU  29  -1.149   6.986  -5.076
  231    H    ARG  30           H        ARG  30  -3.580   4.676  -1.605
  232    HA   ARG  30           HA       ARG  30  -3.740   1.917  -1.446
  233    HB2  ARG  30           HB2      ARG  30  -5.020   2.189   0.525
  234    HB3  ARG  30           HB3      ARG  30  -3.719   3.372   0.444
  235    HG2  ARG  30           HG2      ARG  30  -5.579   5.016  -0.429
  236    HG3  ARG  30           HG3      ARG  30  -6.696   3.803   0.223
  237    HD2  ARG  30           HD2      ARG  30  -4.568   5.370   1.722
  238    HD3  ARG  30           HD3      ARG  30  -6.318   5.500   1.907
  239    HE   ARG  30           HE       ARG  30  -6.267   3.083   2.756
  240   HH11  ARG  30          HH21      ARG  30  -3.241   4.853   3.092
  241   HH12  ARG  30          HH22      ARG  30  -2.670   3.706   4.283
  242   HH21  ARG  30          HH12      ARG  30  -5.554   1.800   4.031
  243   HH22  ARG  30          HH11      ARG  30  -3.985   1.906   4.845
  244    HA   PRO  31           HA       PRO  31  -7.179   1.317  -4.271
  245    HB2  PRO  31           HB2      PRO  31  -6.799  -1.273  -4.907
  246    HB3  PRO  31           HB3      PRO  31  -5.625  -0.012  -5.373
  247    HG2  PRO  31           HG2      PRO  31  -5.457  -1.915  -3.020
  248    HG3  PRO  31           HG3      PRO  31  -4.176  -1.501  -4.189
  249    HD2  PRO  31           HD2      PRO  31  -4.504  -0.281  -1.718
  250    HD3  PRO  31           HD3      PRO  31  -3.684   0.471  -3.115
  251    H    SER  32           H        SER  32  -8.497   1.845  -2.405
  252    HA   SER  32           HA       SER  32 -10.264   1.525  -0.993
  253    HB2  SER  32           HB2      SER  32 -10.656  -1.103  -2.457
  254    HB3  SER  32           HB3      SER  32 -11.865  -0.244  -1.495
  255    HG   SER  32           HG       SER  32 -11.814   1.435  -2.992
  256    H    GLY  33           H        GLY  33  -8.022   1.106   0.355
  257    HA2  GLY  33           HA2      GLY  33  -8.876  -0.046   2.715
  258    HA3  GLY  33           HA3      GLY  33  -7.940  -1.322   1.935
  Start of MODEL    2
    1    H1   LYS   1           H1       LYS   1 -13.486   1.115  -4.832
    2    H2   LYS   1           H2       LYS   1 -12.505   0.313  -3.785
    3    H3   LYS   1           H3       LYS   1 -12.948  -0.393  -5.210
    4    HA   LYS   1           HA       LYS   1 -11.783   1.309  -6.457
    5    HB2  LYS   1           HB2      LYS   1 -11.955   3.047  -4.665
    6    HB3  LYS   1           HB3      LYS   1 -10.676   2.207  -3.776
    7    HG2  LYS   1           HG2      LYS   1  -9.134   2.521  -5.712
    8    HG3  LYS   1           HG3      LYS   1 -10.432   3.342  -6.599
    9    HD2  LYS   1           HD2      LYS   1 -10.514   5.071  -4.779
   10    HD3  LYS   1           HD3      LYS   1  -9.141   4.284  -3.993
   11    HE2  LYS   1           HE2      LYS   1  -9.146   5.506  -6.796
   12    HE3  LYS   1           HE3      LYS   1  -8.496   6.263  -5.338
   13    HZ1  LYS   1           HZ1      LYS   1  -6.654   5.314  -6.383
   14    HZ2  LYS   1           HZ2      LYS   1  -6.892   4.418  -5.160
   15    HZ3  LYS   1           HZ3      LYS   1  -7.398   3.840  -6.655
   16    H    LEU   2           H        LEU   2 -10.482  -0.521  -3.568
   17    HA   LEU   2           HA       LEU   2  -8.017  -1.240  -4.695
   18    HB2  LEU   2           HB2      LEU   2  -8.675  -1.558  -2.367
   19    HB3  LEU   2           HB3      LEU   2  -9.917  -2.711  -2.843
   20    HG   LEU   2           HG       LEU   2  -8.156  -4.290  -3.618
   21   HD11  LEU   2          HD11      LEU   2  -5.829  -3.942  -3.026
   22   HD12  LEU   2          HD12      LEU   2  -6.335  -2.654  -4.130
   23   HD13  LEU   2          HD13      LEU   2  -6.186  -2.338  -2.383
   24   HD21  LEU   2          HD21      LEU   2  -7.347  -4.900  -1.386
   25   HD22  LEU   2          HD22      LEU   2  -7.768  -3.288  -0.766
   26   HD23  LEU   2          HD23      LEU   2  -9.045  -4.400  -1.310
   27    HA   PRO   3           HA       PRO   3  -9.959  -3.703  -7.942
   28    HB2  PRO   3           HB2      PRO   3  -7.371  -4.016  -9.303
   29    HB3  PRO   3           HB3      PRO   3  -8.808  -3.108  -9.813
   30    HG2  PRO   3           HG2      PRO   3  -6.474  -1.873  -8.986
   31    HG3  PRO   3           HG3      PRO   3  -8.105  -1.160  -8.775
   32    HD2  PRO   3           HD2      PRO   3  -6.451  -2.670  -6.746
   33    HD3  PRO   3           HD3      PRO   3  -7.368  -1.150  -6.580
   34    HA   PRO   4           HA       PRO   4  -9.326  -8.078  -7.453
   35    HB2  PRO   4           HB2      PRO   4  -8.696  -8.222 -10.409
   36    HB3  PRO   4           HB3      PRO   4  -9.760  -9.282  -9.431
   37    HG2  PRO   4           HG2      PRO   4 -10.838  -7.322 -10.949
   38    HG3  PRO   4           HG3      PRO   4 -11.430  -7.573  -9.273
   39    HD2  PRO   4           HD2      PRO   4  -9.475  -5.503 -10.289
   40    HD3  PRO   4           HD3      PRO   4 -10.836  -5.309  -9.142
   41    H    GLY   5           H        GLY   5  -7.665  -9.161  -6.574
   42    HA2  GLY   5           HA2      GLY   5  -5.640 -10.183  -6.336
   43    HA3  GLY   5           HA3      GLY   5  -5.177  -9.626  -7.944
   44    H    TRP   6           H        TRP   6  -6.058  -6.881  -6.048
   45    HA   TRP   6           HA       TRP   6  -3.202  -6.263  -5.569
   46    HB2  TRP   6           HB2      TRP   6  -5.725  -4.614  -5.457
   47    HB3  TRP   6           HB3      TRP   6  -4.147  -4.027  -4.949
   48    HD1  TRP   6           HD1      TRP   6  -5.884  -5.316  -8.119
   49    HE1  TRP   6           HE1      TRP   6  -4.835  -4.161 -10.179
   50    HE3  TRP   6           HE3      TRP   6  -2.030  -2.908  -5.806
   51    HZ2  TRP   6           HZ2      TRP   6  -2.629  -2.385 -10.722
   52    HZ3  TRP   6           HZ3      TRP   6  -0.453  -1.524  -7.106
   53    HH2  TRP   6           HH2      TRP   6  -0.744  -1.231  -9.553
   54    H    GLU   7           H        GLU   7  -2.238  -6.139  -3.668
   55    HA   GLU   7           HA       GLU   7  -3.766  -6.652  -1.156
   56    HB2  GLU   7           HB2      GLU   7  -2.733  -8.644  -2.384
   57    HB3  GLU   7           HB3      GLU   7  -1.162  -7.878  -2.146
   58    HG2  GLU   7           HG2      GLU   7  -1.778  -7.943   0.397
   59    HG3  GLU   7           HG3      GLU   7  -3.034  -9.091  -0.089
   60    H    LYS   8           H        LYS   8  -2.796  -5.677   0.762
   61    HA   LYS   8           HA       LYS   8  -0.960  -3.482   0.215
   62    HB2  LYS   8           HB2      LYS   8  -1.325  -2.794   2.460
   63    HB3  LYS   8           HB3      LYS   8  -2.856  -3.159   1.680
   64    HG2  LYS   8           HG2      LYS   8  -2.960  -5.342   2.914
   65    HG3  LYS   8           HG3      LYS   8  -1.439  -4.913   3.720
   66    HD2  LYS   8           HD2      LYS   8  -3.173  -4.301   5.244
   67    HD3  LYS   8           HD3      LYS   8  -2.553  -2.801   4.549
   68    HE2  LYS   8           HE2      LYS   8  -4.562  -3.246   2.789
   69    HE3  LYS   8           HE3      LYS   8  -5.212  -4.184   4.132
   70    HZ1  LYS   8           HZ1      LYS   8  -5.980  -1.887   4.171
   71    HZ2  LYS   8           HZ2      LYS   8  -5.013  -2.130   5.491
   72    HZ3  LYS   8           HZ3      LYS   8  -4.468  -1.322   4.138
   73    H    ARG   9           H        ARG   9   1.054  -3.237   0.930
   74    HA   ARG   9           HA       ARG   9   2.578  -5.484   2.175
   75    HB2  ARG   9           HB2      ARG   9   3.082  -4.250  -0.569
   76    HB3  ARG   9           HB3      ARG   9   4.258  -5.267   0.263
   77    HG2  ARG   9           HG2      ARG   9   1.515  -6.157  -0.709
   78    HG3  ARG   9           HG3      ARG   9   3.063  -6.453  -1.498
   79    HD2  ARG   9           HD2      ARG   9   3.838  -7.800   0.424
   80    HD3  ARG   9           HD3      ARG   9   2.316  -7.482   1.266
   81    HE   ARG   9           HE       ARG   9   1.272  -9.119   0.076
   82   HH11  ARG   9          HH11      ARG   9   4.217  -8.454  -1.687
   83   HH12  ARG   9          HH12      ARG   9   3.874  -9.642  -2.918
   84   HH21  ARG   9          HH22      ARG   9   0.785 -10.509  -1.550
   85   HH22  ARG   9          HH21      ARG   9   2.031 -10.951  -2.701
   86    H    MET  10           H        MET  10   4.882  -4.857   2.578
   87    HA   MET  10           HA       MET  10   5.112  -1.998   3.397
   88    HB2  MET  10           HB2      MET  10   5.158  -3.779   5.178
   89    HB3  MET  10           HB3      MET  10   6.589  -4.459   4.388
   90    HG2  MET  10           HG2      MET  10   7.258  -3.132   6.275
   91    HG3  MET  10           HG3      MET  10   7.822  -2.357   4.799
   92    HE1  MET  10           HE1      MET  10   7.240   0.622   7.234
   93    HE2  MET  10           HE2      MET  10   7.680  -1.021   7.759
   94    HE3  MET  10           HE3      MET  10   8.403  -0.342   6.283
   95    H    PHE  11           H        PHE  11   6.812  -0.798   2.677
   96    HA   PHE  11           HA       PHE  11   8.670  -2.023   0.700
   97    HB2  PHE  11           HB2      PHE  11   6.920  -0.170   0.081
   98    HB3  PHE  11           HB3      PHE  11   8.041   0.924   0.855
   99    HD1  PHE  11           HD1      PHE  11   7.497  -1.454  -1.938
  100    HD2  PHE  11           HD2      PHE  11  10.212   1.448  -0.268
  101    HE1  PHE  11           HE1      PHE  11   8.788  -1.443  -4.049
  102    HE2  PHE  11           HE2      PHE  11  11.503   1.453  -2.379
  103    HZ   PHE  11           HZ       PHE  11  10.797   0.008  -4.275
  104    H    ALA  12           H        ALA  12  10.839  -1.459   0.690
  105    HA   ALA  12           HA       ALA  12  12.040  -1.571   3.194
  106    HB1  ALA  12           HB1      ALA  12  14.129  -1.565   1.889
  107    HB2  ALA  12           HB2      ALA  12  12.897  -2.576   1.114
  108    HB3  ALA  12           HB3      ALA  12  13.255  -0.955   0.467
  109    H    ASN  13           H        ASN  13  11.058   1.405   1.710
  110    HA   ASN  13           HA       ASN  13  13.157   3.013   2.999
  111    HB2  ASN  13           HB2      ASN  13  12.077   4.869   1.986
  112    HB3  ASN  13           HB3      ASN  13  12.015   3.595   0.767
  113   HD21  ASN  13          HD22      ASN  13  10.135   5.939   2.384
  114   HD22  ASN  13          HD21      ASN  13   8.573   5.164   2.182
  115    H    GLY  14           H        GLY  14  10.320   1.424   4.080
  116    HA2  GLY  14           HA2      GLY  14   9.368   1.608   6.246
  117    HA3  GLY  14           HA3      GLY  14  10.032   3.232   6.431
  118    H    THR  15           H        THR  15   7.759   1.471   4.174
  119    HA   THR  15           HA       THR  15   5.625   3.403   4.715
  120    HB   THR  15           HB       THR  15   7.039   3.277   2.023
  121    HG1  THR  15           HG1      THR  15   7.340   4.813   4.083
  122   HG21  THR  15          HG21      THR  15   4.721   3.352   1.428
  123   HG22  THR  15          HG22      THR  15   4.379   4.594   2.664
  124   HG23  THR  15          HG23      THR  15   5.380   4.977   1.246
  125    H    VAL  16           H        VAL  16   3.574   2.619   3.941
  126    HA   VAL  16           HA       VAL  16   3.590  -0.209   3.022
  127    HB   VAL  16           HB       VAL  16   1.608   1.455   4.556
  128   HG11  VAL  16          HG11      VAL  16   0.174   0.640   2.730
  129   HG12  VAL  16          HG12      VAL  16   0.818  -1.009   2.932
  130   HG13  VAL  16          HG13      VAL  16  -0.152  -0.254   4.213
  131   HG21  VAL  16          HG21      VAL  16   3.216  -0.116   5.657
  132   HG22  VAL  16          HG22      VAL  16   1.533  -0.618   5.899
  133   HG23  VAL  16          HG23      VAL  16   2.539  -1.449   4.689
  134    H    TYR  17           H        TYR  17   2.632  -0.836   1.200
  135    HA   TYR  17           HA       TYR  17   1.490   1.170  -0.659
  136    HB2  TYR  17           HB2      TYR  17   3.034   0.801  -2.360
  137    HB3  TYR  17           HB3      TYR  17   4.041   0.913  -0.942
  138    HD1  TYR  17           HD1      TYR  17   4.910  -1.251   0.141
  139    HD2  TYR  17           HD2      TYR  17   3.001  -1.188  -3.721
  140    HE1  TYR  17           HE1      TYR  17   6.012  -3.425  -0.463
  141    HE2  TYR  17           HE2      TYR  17   4.080  -3.307  -4.317
  142    HH   TYR  17           HH       TYR  17   5.628  -4.904  -3.666
  143    H    TYR  18           H        TYR  18   0.821  -0.124  -2.772
  144    HA   TYR  18           HA       TYR  18  -0.410  -2.705  -1.984
  145    HB2  TYR  18           HB2      TYR  18  -1.493  -0.361  -3.570
  146    HB3  TYR  18           HB3      TYR  18  -2.171  -1.981  -3.714
  147    HD1  TYR  18           HD1      TYR  18  -1.273   0.586  -1.111
  148    HD2  TYR  18           HD2      TYR  18  -3.775  -2.763  -2.192
  149    HE1  TYR  18           HE1      TYR  18  -2.337   0.669   1.098
  150    HE2  TYR  18           HE2      TYR  18  -5.030  -2.512  -0.073
  151    HH   TYR  18           HH       TYR  18  -5.313  -1.264   1.840
  152    H    PHE  19           H        PHE  19  -0.187  -4.391  -3.179
  153    HA   PHE  19           HA       PHE  19   1.442  -4.320  -5.676
  154    HB2  PHE  19           HB2      PHE  19   2.682  -4.971  -3.657
  155    HB3  PHE  19           HB3      PHE  19   1.429  -6.087  -3.204
  156    HD1  PHE  19           HD1      PHE  19   4.205  -5.473  -5.592
  157    HD2  PHE  19           HD2      PHE  19   1.293  -8.321  -4.173
  158    HE1  PHE  19           HE1      PHE  19   5.442  -7.305  -6.723
  159    HE2  PHE  19           HE2      PHE  19   2.559 -10.151  -5.295
  160    HZ   PHE  19           HZ       PHE  19   4.593  -9.634  -6.606
  161    H    ASN  20           H        ASN  20   0.345  -5.159  -7.379
  162    HA   ASN  20           HA       ASN  20  -1.954  -6.903  -7.094
  163    HB2  ASN  20           HB2      ASN  20  -1.659  -5.250  -8.952
  164    HB3  ASN  20           HB3      ASN  20  -0.301  -6.194  -9.533
  165   HD21  ASN  20          HD22      ASN  20  -3.835  -6.267  -8.952
  166   HD22  ASN  20          HD21      ASN  20  -4.138  -7.656  -9.954
  167    H    HIS  21           H        HIS  21  -1.535  -8.912  -6.200
  168    HA   HIS  21           HA       HIS  21   0.969 -10.267  -6.764
  169    HB2  HIS  21           HB2      HIS  21   0.128 -12.024  -5.287
  170    HB3  HIS  21           HB3      HIS  21   0.073 -10.427  -4.581
  171    HD1  HIS  21           HD1      HIS  21  -1.770 -10.871  -2.820
  172    HD2  HIS  21           HD2      HIS  21  -2.816 -11.904  -6.786
  173    HE1  HIS  21           HE1      HIS  21  -4.281 -11.396  -2.832
  174    H    ILE  22           H        ILE  22  -1.347  -9.864  -8.966
  175    HA   ILE  22           HA       ILE  22  -1.003 -12.591 -10.121
  176    HB   ILE  22           HB       ILE  22  -2.730 -10.309 -11.134
  177   HG12  ILE  22          HG12      ILE  22  -3.611 -10.910  -8.950
  178   HG13  ILE  22          HG13      ILE  22  -4.692 -11.405 -10.230
  179   HG21  ILE  22          HG21      ILE  22  -3.916 -12.152 -12.361
  180   HG22  ILE  22          HG22      ILE  22  -2.265 -11.864 -12.903
  181   HG23  ILE  22          HG23      ILE  22  -2.615 -13.256 -11.863
  182   HD11  ILE  22          HD11      ILE  22  -4.542 -13.086  -8.433
  183   HD12  ILE  22          HD12      ILE  22  -3.994 -13.756  -9.979
  184   HD13  ILE  22          HD13      ILE  22  -2.806 -13.288  -8.739
  185    H    THR  23           H        THR  23   0.193  -9.306 -10.299
  186    HA   THR  23           HA       THR  23   1.699  -9.954 -12.822
  187    HB   THR  23           HB       THR  23   1.221  -7.677 -13.618
  188    HG1  THR  23           HG1      THR  23  -0.640  -7.555 -11.485
  189   HG21  THR  23          HG21      THR  23  -0.324  -9.503 -14.318
  190   HG22  THR  23          HG22      THR  23  -1.400  -9.090 -12.966
  191   HG23  THR  23          HG23      THR  23  -1.095  -7.906 -14.252
  192    H    ASN  24           H        ASN  24   1.911  -8.465  -9.668
  193    HA   ASN  24           HA       ASN  24   3.527  -7.523  -8.536
  194    HB2  ASN  24           HB2      ASN  24   5.358  -7.311 -10.948
  195    HB3  ASN  24           HB3      ASN  24   5.779  -7.130  -9.259
  196   HD21  ASN  24          HD22      ASN  24   4.913  -9.440 -11.755
  197   HD22  ASN  24          HD21      ASN  24   5.554 -10.849 -10.879
  198    H    ALA  25           H        ALA  25   1.729  -6.074 -10.960
  199    HA   ALA  25           HA       ALA  25   2.770  -3.468 -11.160
  200    HB1  ALA  25           HB1      ALA  25   0.450  -2.805 -11.623
  201    HB2  ALA  25           HB2      ALA  25   0.837  -4.327 -12.451
  202    HB3  ALA  25           HB3      ALA  25  -0.147  -4.341 -10.971
  203    H    SER  26           H        SER  26   2.932  -1.727  -9.726
  204    HA   SER  26           HA       SER  26   1.891  -2.197  -6.973
  205    HB2  SER  26           HB2      SER  26   4.714  -1.496  -7.814
  206    HB3  SER  26           HB3      SER  26   4.107  -1.454  -6.150
  207    HG   SER  26           HG       SER  26   4.167  -3.776  -7.854
  208    H    GLN  27           H        GLN  27   1.397  -0.475  -5.731
  209    HA   GLN  27           HA       GLN  27   1.376   2.266  -6.908
  210    HB2  GLN  27           HB2      GLN  27  -0.672   1.021  -7.558
  211    HB3  GLN  27           HB3      GLN  27  -0.965   0.602  -5.867
  212    HG2  GLN  27           HG2      GLN  27  -1.157   3.084  -5.381
  213    HG3  GLN  27           HG3      GLN  27  -1.081   3.373  -7.121
  214   HE21  GLN  27          HE22      GLN  27  -3.141   2.563  -4.417
  215   HE22  GLN  27          HE21      GLN  27  -4.567   2.328  -5.412
  216    H    PHE  28           H        PHE  28   2.122   3.711  -5.327
  217    HA   PHE  28           HA       PHE  28   2.147   2.913  -2.511
  218    HB2  PHE  28           HB2      PHE  28   3.094   5.358  -4.020
  219    HB3  PHE  28           HB3      PHE  28   3.092   5.280  -2.264
  220    HD1  PHE  28           HD1      PHE  28   4.320   3.412  -1.070
  221    HD2  PHE  28           HD2      PHE  28   4.904   4.272  -5.255
  222    HE1  PHE  28           HE1      PHE  28   6.498   2.216  -1.014
  223    HE2  PHE  28           HE2      PHE  28   7.059   3.042  -5.200
  224    HZ   PHE  28           HZ       PHE  28   7.861   2.020  -3.081
  225    H    GLU  29           H        GLU  29  -0.167   4.669  -4.458
  226    HA   GLU  29           HA       GLU  29  -1.472   6.065  -2.288
  227    HB2  GLU  29           HB2      GLU  29  -1.840   6.613  -4.663
  228    HB3  GLU  29           HB3      GLU  29  -2.513   5.018  -4.955
  229    HG2  GLU  29           HG2      GLU  29  -3.988   6.220  -2.762
  230    HG3  GLU  29           HG3      GLU  29  -3.825   7.414  -4.032
  231    H    ARG  30           H        ARG  30  -2.733   5.217  -0.671
  232    HA   ARG  30           HA       ARG  30  -3.395   2.374  -0.623
  233    HB2  ARG  30           HB2      ARG  30  -2.627   3.561   1.392
  234    HB3  ARG  30           HB3      ARG  30  -4.051   4.592   1.349
  235    HG2  ARG  30           HG2      ARG  30  -4.920   1.813   1.253
  236    HG3  ARG  30           HG3      ARG  30  -3.699   1.963   2.515
  237    HD2  ARG  30           HD2      ARG  30  -5.924   2.250   3.448
  238    HD3  ARG  30           HD3      ARG  30  -4.997   3.759   3.587
  239    HE   ARG  30           HE       ARG  30  -6.854   3.296   1.282
  240   HH11  ARG  30          HH11      ARG  30  -6.608   5.089   4.245
  241   HH12  ARG  30          HH12      ARG  30  -7.268   6.553   3.552
  242   HH21  ARG  30          HH22      ARG  30  -7.108   5.263   0.356
  243   HH22  ARG  30          HH21      ARG  30  -7.757   6.589   1.314
  244    HA   PRO  31           HA       PRO  31  -7.413   3.479  -2.514
  245    HB2  PRO  31           HB2      PRO  31  -8.089   1.098  -3.560
  246    HB3  PRO  31           HB3      PRO  31  -6.682   1.991  -4.200
  247    HG2  PRO  31           HG2      PRO  31  -6.675  -0.206  -2.107
  248    HG3  PRO  31           HG3      PRO  31  -5.712  -0.138  -3.627
  249    HD2  PRO  31           HD2      PRO  31  -4.796   0.706  -1.171
  250    HD3  PRO  31           HD3      PRO  31  -4.248   1.425  -2.707
  251    H    SER  32           H        SER  32  -9.550   1.671  -2.321
  252    HA   SER  32           HA       SER  32 -10.405   1.903   0.422
  253    HB2  SER  32           HB2      SER  32 -12.488   0.999  -0.419
  254    HB3  SER  32           HB3      SER  32 -11.886   2.194  -1.586
  255    HG   SER  32           HG       SER  32 -11.412  -0.581  -1.625
  256    H    GLY  33           H        GLY  33  -8.675   0.566   1.466
  257    HA2  GLY  33           HA2      GLY  33  -9.621  -1.677   2.660
  258    HA3  GLY  33           HA3      GLY  33  -8.900  -2.363   1.199
  Start of MODEL    3
    1    H1   LYS   1           H1       LYS   1 -10.630   3.265  -3.523
    2    H2   LYS   1           H2       LYS   1 -10.488   2.648  -5.062
    3    H3   LYS   1           H3       LYS   1  -9.147   3.153  -4.275
    4    HA   LYS   1           HA       LYS   1  -9.439   1.458  -2.594
    5    HB2  LYS   1           HB2      LYS   1 -12.016   1.184  -3.905
    6    HB3  LYS   1           HB3      LYS   1 -11.166  -0.344  -4.058
    7    HG2  LYS   1           HG2      LYS   1 -10.694  -0.365  -1.626
    8    HG3  LYS   1           HG3      LYS   1 -11.554   1.158  -1.439
    9    HD2  LYS   1           HD2      LYS   1 -12.697  -1.534  -2.290
   10    HD3  LYS   1           HD3      LYS   1 -12.986  -0.696  -0.771
   11    HE2  LYS   1           HE2      LYS   1 -13.985   0.119  -3.534
   12    HE3  LYS   1           HE3      LYS   1 -14.937  -0.532  -2.194
   13    HZ1  LYS   1           HZ1      LYS   1 -13.616   2.125  -2.323
   14    HZ2  LYS   1           HZ2      LYS   1 -15.228   1.814  -2.166
   15    HZ3  LYS   1           HZ3      LYS   1 -14.160   1.509  -0.925
   16    H    LEU   2           H        LEU   2  -8.494  -0.660  -2.819
   17    HA   LEU   2           HA       LEU   2  -6.654  -1.072  -4.909
   18    HB2  LEU   2           HB2      LEU   2  -7.927  -3.028  -2.956
   19    HB3  LEU   2           HB3      LEU   2  -6.553  -3.382  -3.976
   20    HG   LEU   2           HG       LEU   2  -6.693  -1.470  -1.643
   21   HD11  LEU   2          HD11      LEU   2  -6.289  -3.910  -1.232
   22   HD12  LEU   2          HD12      LEU   2  -4.857  -3.821  -2.275
   23   HD13  LEU   2          HD13      LEU   2  -4.907  -2.905  -0.762
   24   HD21  LEU   2          HD21      LEU   2  -5.369  -0.272  -3.302
   25   HD22  LEU   2          HD22      LEU   2  -4.305  -0.930  -2.078
   26   HD23  LEU   2          HD23      LEU   2  -4.420  -1.734  -3.655
   27    HA   PRO   3           HA       PRO   3  -9.464  -2.947  -7.972
   28    HB2  PRO   3           HB2      PRO   3  -6.912  -3.409  -9.459
   29    HB3  PRO   3           HB3      PRO   3  -8.406  -2.608 -10.011
   30    HG2  PRO   3           HG2      PRO   3  -6.144  -1.182  -9.432
   31    HG3  PRO   3           HG3      PRO   3  -7.784  -0.553  -9.071
   32    HD2  PRO   3           HD2      PRO   3  -5.823  -1.857  -7.178
   33    HD3  PRO   3           HD3      PRO   3  -6.853  -0.415  -6.947
   34    HA   PRO   4           HA       PRO   4  -8.887  -7.391  -7.482
   35    HB2  PRO   4           HB2      PRO   4  -8.371  -7.599 -10.456
   36    HB3  PRO   4           HB3      PRO   4  -9.409  -8.627  -9.417
   37    HG2  PRO   4           HG2      PRO   4 -10.525  -6.692 -10.940
   38    HG3  PRO   4           HG3      PRO   4 -11.058  -6.897  -9.238
   39    HD2  PRO   4           HD2      PRO   4  -9.113  -4.879 -10.371
   40    HD3  PRO   4           HD3      PRO   4 -10.436  -4.629  -9.190
   41    H    GLY   5           H        GLY   5  -7.205  -8.535  -6.715
   42    HA2  GLY   5           HA2      GLY   5  -5.206  -9.681  -6.716
   43    HA3  GLY   5           HA3      GLY   5  -4.750  -8.895  -8.226
   44    H    TRP   6           H        TRP   6  -5.499  -6.338  -6.139
   45    HA   TRP   6           HA       TRP   6  -2.632  -5.916  -5.556
   46    HB2  TRP   6           HB2      TRP   6  -5.068  -4.156  -5.327
   47    HB3  TRP   6           HB3      TRP   6  -3.441  -3.666  -4.875
   48    HD1  TRP   6           HD1      TRP   6  -5.491  -4.640  -7.971
   49    HE1  TRP   6           HE1      TRP   6  -4.486  -3.526 -10.054
   50    HE3  TRP   6           HE3      TRP   6  -1.205  -2.822  -5.895
   51    HZ2  TRP   6           HZ2      TRP   6  -2.087  -2.094 -10.745
   52    HZ3  TRP   6           HZ3      TRP   6   0.485  -1.728  -7.315
   53    HH2  TRP   6           HH2      TRP   6   0.057  -1.309  -9.724
   54    H    GLU   7           H        GLU   7  -1.688  -6.028  -3.571
   55    HA   GLU   7           HA       GLU   7  -3.390  -6.291  -1.138
   56    HB2  GLU   7           HB2      GLU   7  -2.581  -8.476  -2.392
   57    HB3  GLU   7           HB3      GLU   7  -1.030  -8.127  -1.649
   58    HG2  GLU   7           HG2      GLU   7  -3.679  -8.456  -0.153
   59    HG3  GLU   7           HG3      GLU   7  -2.546  -9.770  -0.460
   60    H    LYS   8           H        LYS   8  -2.181  -5.903   0.896
   61    HA   LYS   8           HA       LYS   8  -0.494  -3.555   0.773
   62    HB2  LYS   8           HB2      LYS   8  -2.097  -3.582   2.428
   63    HB3  LYS   8           HB3      LYS   8  -1.922  -5.251   2.824
   64    HG2  LYS   8           HG2      LYS   8   0.161  -3.162   3.549
   65    HG3  LYS   8           HG3      LYS   8  -1.235  -3.538   4.541
   66    HD2  LYS   8           HD2      LYS   8   1.164  -5.309   4.026
   67    HD3  LYS   8           HD3      LYS   8   0.565  -4.642   5.510
   68    HE2  LYS   8           HE2      LYS   8   0.007  -6.852   5.710
   69    HE3  LYS   8           HE3      LYS   8  -1.528  -6.125   5.231
   70    HZ1  LYS   8           HZ1      LYS   8  -0.610  -8.290   4.046
   71    HZ2  LYS   8           HZ2      LYS   8  -1.400  -7.199   3.138
   72    HZ3  LYS   8           HZ3      LYS   8   0.197  -7.198   3.098
   73    H    ARG   9           H        ARG   9   1.643  -3.412   0.864
   74    HA   ARG   9           HA       ARG   9   3.295  -5.563   2.075
   75    HB2  ARG   9           HB2      ARG   9   3.773  -4.411  -0.707
   76    HB3  ARG   9           HB3      ARG   9   4.880  -5.498   0.132
   77    HG2  ARG   9           HG2      ARG   9   2.079  -6.166  -0.838
   78    HG3  ARG   9           HG3      ARG   9   3.586  -6.653  -1.596
   79    HD2  ARG   9           HD2      ARG   9   4.057  -8.292  -0.038
   80    HD3  ARG   9           HD3      ARG   9   3.209  -7.476   1.262
   81    HE   ARG   9           HE       ARG   9   1.129  -8.320   0.590
   82   HH11  ARG   9          HH11      ARG   9   3.524  -9.457  -1.726
   83   HH12  ARG   9          HH12      ARG   9   2.542 -10.828  -2.179
   84   HH21  ARG   9          HH21      ARG   9   0.016  -9.915   0.052
   85   HH22  ARG   9          HH22      ARG   9   0.474 -11.121  -1.175
   86    H    MET  10           H        MET  10   5.624  -4.886   2.267
   87    HA   MET  10           HA       MET  10   5.773  -2.074   3.229
   88    HB2  MET  10           HB2      MET  10   7.211  -4.632   4.033
   89    HB3  MET  10           HB3      MET  10   7.757  -3.028   4.535
   90    HG2  MET  10           HG2      MET  10   4.975  -4.109   5.107
   91    HG3  MET  10           HG3      MET  10   6.342  -4.217   6.217
   92    HE1  MET  10           HE1      MET  10   4.928  -3.098   8.123
   93    HE2  MET  10           HE2      MET  10   4.073  -1.549   7.944
   94    HE3  MET  10           HE3      MET  10   3.538  -2.969   7.016
   95    H    PHE  11           H        PHE  11   7.125  -0.694   2.244
   96    HA   PHE  11           HA       PHE  11   8.906  -1.640   0.094
   97    HB2  PHE  11           HB2      PHE  11   7.262   0.412   0.034
   98    HB3  PHE  11           HB3      PHE  11   8.518   1.241   0.926
   99    HD1  PHE  11           HD2      PHE  11   7.680  -0.563  -2.229
  100    HD2  PHE  11           HD1      PHE  11  10.555   1.981  -0.259
  101    HE1  PHE  11           HE2      PHE  11   8.841  -0.197  -4.385
  102    HE2  PHE  11           HE1      PHE  11  11.713   2.338  -2.418
  103    HZ   PHE  11           HZ       PHE  11  10.862   1.249  -4.485
  104    H    ALA  12           H        ALA  12  11.126  -0.962  -0.021
  105    HA   ALA  12           HA       ALA  12  12.564  -1.845   2.171
  106    HB1  ALA  12           HB1      ALA  12  14.524  -1.304   0.781
  107    HB2  ALA  12           HB2      ALA  12  13.234  -2.035  -0.189
  108    HB3  ALA  12           HB3      ALA  12  13.516  -0.278  -0.262
  109    H    ASN  13           H        ASN  13  11.482   1.450   1.844
  110    HA   ASN  13           HA       ASN  13  13.651   2.516   3.543
  111    HB2  ASN  13           HB2      ASN  13  12.659   4.644   3.095
  112    HB3  ASN  13           HB3      ASN  13  12.662   3.783   1.556
  113   HD21  ASN  13          HD22      ASN  13  10.712   5.613   3.663
  114   HD22  ASN  13          HD21      ASN  13   9.154   4.993   3.142
  115    H    GLY  14           H        GLY  14  10.766   0.780   4.110
  116    HA2  GLY  14           HA2      GLY  14   9.676   0.433   6.166
  117    HA3  GLY  14           HA3      GLY  14  10.457   1.865   6.857
  118    H    THR  15           H        THR  15   8.021   0.859   4.399
  119    HA   THR  15           HA       THR  15   6.100   2.881   5.228
  120    HB   THR  15           HB       THR  15   7.629   3.095   2.608
  121    HG1  THR  15           HG1      THR  15   7.932   4.234   4.840
  122   HG21  THR  15          HG21      THR  15   4.968   4.422   3.243
  123   HG22  THR  15          HG22      THR  15   6.087   4.943   1.965
  124   HG23  THR  15          HG23      THR  15   5.349   3.342   1.869
  125    H    VAL  16           H        VAL  16   3.984   2.449   4.134
  126    HA   VAL  16           HA       VAL  16   3.859  -0.330   3.093
  127    HB   VAL  16           HB       VAL  16   1.847   1.475   4.429
  128   HG11  VAL  16          HG11      VAL  16   0.575   0.685   2.476
  129   HG12  VAL  16          HG12      VAL  16   1.130  -0.981   2.756
  130   HG13  VAL  16          HG13      VAL  16   0.057  -0.179   3.922
  131   HG21  VAL  16          HG21      VAL  16   2.655  -1.455   4.681
  132   HG22  VAL  16          HG22      VAL  16   3.226  -0.131   5.731
  133   HG23  VAL  16          HG23      VAL  16   1.518  -0.602   5.758
  134    H    TYR  17           H        TYR  17   3.123  -0.863   1.199
  135    HA   TYR  17           HA       TYR  17   1.883   1.123  -0.586
  136    HB2  TYR  17           HB2      TYR  17   3.291   0.821  -2.407
  137    HB3  TYR  17           HB3      TYR  17   4.402   1.033  -1.076
  138    HD1  TYR  17           HD2      TYR  17   5.481  -1.028  -0.019
  139    HD2  TYR  17           HD1      TYR  17   3.296  -1.231  -3.723
  140    HE1  TYR  17           HE2      TYR  17   6.661  -3.149  -0.615
  141    HE2  TYR  17           HE1      TYR  17   4.495  -3.319  -4.324
  142    HH   TYR  17           HH       TYR  17   6.962  -4.770  -2.204
  143    H    TYR  18           H        TYR  18   1.188  -0.239  -2.723
  144    HA   TYR  18           HA       TYR  18   0.067  -2.795  -1.739
  145    HB2  TYR  18           HB2      TYR  18  -1.316  -0.655  -3.357
  146    HB3  TYR  18           HB3      TYR  18  -1.991  -2.215  -2.875
  147    HD1  TYR  18           HD1      TYR  18  -0.873   1.103  -1.674
  148    HD2  TYR  18           HD2      TYR  18  -2.637  -2.656  -0.506
  149    HE1  TYR  18           HE1      TYR  18  -1.323   2.028   0.573
  150    HE2  TYR  18           HE2      TYR  18  -3.084  -1.732   1.739
  151    HH   TYR  18           HH       TYR  18  -2.121   1.559   2.692
  152    H    PHE  19           H        PHE  19   0.374  -4.480  -2.972
  153    HA   PHE  19           HA       PHE  19   1.904  -4.238  -5.514
  154    HB2  PHE  19           HB2      PHE  19   3.174  -5.053  -3.605
  155    HB3  PHE  19           HB3      PHE  19   1.900  -6.165  -3.183
  156    HD1  PHE  19           HD1      PHE  19   4.555  -5.460  -5.710
  157    HD2  PHE  19           HD2      PHE  19   1.750  -8.368  -4.175
  158    HE1  PHE  19           HE1      PHE  19   5.694  -7.243  -6.991
  159    HE2  PHE  19           HE2      PHE  19   2.915 -10.148  -5.445
  160    HZ   PHE  19           HZ       PHE  19   4.869  -9.590  -6.875
  161    H    ASN  20           H        ASN  20   0.979  -5.068  -7.291
  162    HA   ASN  20           HA       ASN  20  -1.479  -6.636  -7.138
  163    HB2  ASN  20           HB2      ASN  20  -1.097  -4.868  -8.867
  164    HB3  ASN  20           HB3      ASN  20   0.169  -5.867  -9.551
  165   HD21  ASN  20          HD22      ASN  20  -3.355  -5.635  -8.959
  166   HD22  ASN  20          HD21      ASN  20  -3.785  -6.971  -9.985
  167    H    HIS  21           H        HIS  21  -1.133  -8.691  -6.355
  168    HA   HIS  21           HA       HIS  21   1.277 -10.174  -7.034
  169    HB2  HIS  21           HB2      HIS  21   0.351 -11.899  -5.590
  170    HB3  HIS  21           HB3      HIS  21   0.306 -10.325  -4.832
  171    HD1  HIS  21           HD1      HIS  21  -1.991  -9.659  -3.806
  172    HD2  HIS  21           HD2      HIS  21  -2.218 -12.628  -6.784
  173    HE1  HIS  21           HE1      HIS  21  -4.415 -10.457  -3.860
  174    H    ILE  22           H        ILE  22  -1.180  -9.530  -9.100
  175    HA   ILE  22           HA       ILE  22  -1.121 -12.222 -10.374
  176    HB   ILE  22           HB       ILE  22  -2.807  -9.762 -10.978
  177   HG12  ILE  22          HG12      ILE  22  -3.532 -12.412  -9.644
  178   HG13  ILE  22          HG13      ILE  22  -3.404 -10.854  -8.832
  179   HG21  ILE  22          HG21      ILE  22  -2.432 -11.064 -13.033
  180   HG22  ILE  22          HG22      ILE  22  -2.915 -12.556 -12.197
  181   HG23  ILE  22          HG23      ILE  22  -4.085 -11.252 -12.504
  182   HD11  ILE  22          HD11      ILE  22  -5.275  -9.992 -10.297
  183   HD12  ILE  22          HD12      ILE  22  -5.522 -11.674 -10.837
  184   HD13  ILE  22          HD13      ILE  22  -5.711 -11.258  -9.130
  185    H    THR  23           H        THR  23   0.320  -9.060 -10.526
  186    HA   THR  23           HA       THR  23   1.595  -9.697 -13.177
  187    HB   THR  23           HB       THR  23   1.479  -7.280 -13.672
  188    HG1  THR  23           HG1      THR  23  -0.262  -7.148 -11.448
  189   HG21  THR  23          HG21      THR  23  -0.895  -7.078 -14.158
  190   HG22  THR  23          HG22      THR  23  -0.348  -8.728 -14.513
  191   HG23  THR  23          HG23      THR  23  -1.287  -8.403 -13.043
  192    H    ASN  24           H        ASN  24   2.139  -8.536  -9.922
  193    HA   ASN  24           HA       ASN  24   3.905  -8.050  -8.760
  194    HB2  ASN  24           HB2      ASN  24   5.736  -8.026 -11.177
  195    HB3  ASN  24           HB3      ASN  24   6.191  -8.051  -9.486
  196   HD21  ASN  24          HD22      ASN  24   4.896  -9.954 -12.121
  197   HD22  ASN  24          HD21      ASN  24   5.210 -11.522 -11.347
  198    H    ALA  25           H        ALA  25   2.246  -6.075 -10.743
  199    HA   ALA  25           HA       ALA  25   3.876  -3.715 -10.749
  200    HB1  ALA  25           HB1      ALA  25   0.838  -3.970 -10.696
  201    HB2  ALA  25           HB2      ALA  25   1.775  -2.553 -11.209
  202    HB3  ALA  25           HB3      ALA  25   1.852  -4.053 -12.152
  203    H    SER  26           H        SER  26   3.656  -1.776  -9.401
  204    HA   SER  26           HA       SER  26   2.788  -2.251  -6.588
  205    HB2  SER  26           HB2      SER  26   4.872  -1.252  -5.836
  206    HB3  SER  26           HB3      SER  26   5.214  -2.717  -6.789
  207    HG   SER  26           HG       SER  26   5.098  -0.160  -7.995
  208    H    GLN  27           H        GLN  27   1.700  -0.543  -5.709
  209    HA   GLN  27           HA       GLN  27   2.159   2.191  -6.676
  210    HB2  GLN  27           HB2      GLN  27   0.543   1.104  -8.278
  211    HB3  GLN  27           HB3      GLN  27  -0.559   0.811  -6.938
  212    HG2  GLN  27           HG2      GLN  27  -1.137   2.762  -8.405
  213    HG3  GLN  27           HG3      GLN  27  -1.008   3.168  -6.706
  214   HE21  GLN  27          HE22      GLN  27   0.493   3.662  -9.924
  215   HE22  GLN  27          HE21      GLN  27   1.581   4.896  -9.309
  216    H    PHE  28           H        PHE  28   1.056   3.812  -5.356
  217    HA   PHE  28           HA       PHE  28   0.762   2.947  -2.551
  218    HB2  PHE  28           HB2      PHE  28   0.958   5.698  -3.803
  219    HB3  PHE  28           HB3      PHE  28   0.935   5.350  -2.075
  220    HD1  PHE  28           HD2      PHE  28   2.748   3.676  -1.157
  221    HD2  PHE  28           HD1      PHE  28   3.046   5.687  -4.967
  222    HE1  PHE  28           HE2      PHE  28   5.187   3.300  -1.164
  223    HE2  PHE  28           HE1      PHE  28   5.496   5.281  -4.978
  224    HZ   PHE  28           HZ       PHE  28   6.573   4.091  -3.077
  225    H    GLU  29           H        GLU  29  -1.466   3.136  -5.009
  226    HA   GLU  29           HA       GLU  29  -3.649   4.463  -3.719
  227    HB2  GLU  29           HB2      GLU  29  -3.870   4.043  -6.052
  228    HB3  GLU  29           HB3      GLU  29  -3.506   2.330  -5.867
  229    HG2  GLU  29           HG2      GLU  29  -5.869   2.715  -6.383
  230    HG3  GLU  29           HG3      GLU  29  -5.652   1.881  -4.855
  231    H    ARG  30           H        ARG  30  -5.207   3.704  -2.348
  232    HA   ARG  30           HA       ARG  30  -4.449   1.267  -0.851
  233    HB2  ARG  30           HB2      ARG  30  -4.480   2.360   1.179
  234    HB3  ARG  30           HB3      ARG  30  -3.640   3.439   0.105
  235    HG2  ARG  30           HG2      ARG  30  -6.548   3.770   0.979
  236    HG3  ARG  30           HG3      ARG  30  -5.166   4.481   1.768
  237    HD2  ARG  30           HD2      ARG  30  -6.019   6.230   0.517
  238    HD3  ARG  30           HD3      ARG  30  -4.603   5.690  -0.379
  239    HE   ARG  30           HE       ARG  30  -6.026   5.358  -2.218
  240   HH11  ARG  30          HH21      ARG  30  -8.260   4.624   0.452
  241   HH12  ARG  30          HH22      ARG  30  -9.548   4.764  -0.754
  242   HH21  ARG  30          HH11      ARG  30  -7.710   5.077  -3.398
  243   HH22  ARG  30          HH12      ARG  30  -9.315   5.093  -2.609
  244    HA   PRO  31           HA       PRO  31  -8.619  -0.254  -0.306
  245    HB2  PRO  31           HB2      PRO  31  -7.973  -0.358   2.636
  246    HB3  PRO  31           HB3      PRO  31  -8.650  -1.639   1.584
  247    HG2  PRO  31           HG2      PRO  31  -6.032  -1.689   2.333
  248    HG3  PRO  31           HG3      PRO  31  -6.503  -2.111   0.665
  249    HD2  PRO  31           HD2      PRO  31  -5.425   0.493   1.721
  250    HD3  PRO  31           HD3      PRO  31  -4.992  -0.401   0.230
  251    H    SER  32           H        SER  32 -10.521  -0.045   1.340
  252    HA   SER  32           HA       SER  32 -12.090   0.974   2.514
  253    HB2  SER  32           HB2      SER  32 -11.883   3.020   3.725
  254    HB3  SER  32           HB3      SER  32 -10.451   2.012   3.968
  255    HG   SER  32           HG       SER  32  -9.478   3.278   2.240
  256    H    GLY  33           H        GLY  33 -11.198   4.083   1.145
  257    HA2  GLY  33           HA2      GLY  33 -13.612   4.192  -0.563
  258    HA3  GLY  33           HA3      GLY  33 -12.405   5.462  -0.341
  Start of MODEL    4
    1    H1   LYS   1           H1       LYS   1  -9.303   4.286  -5.170
    2    H2   LYS   1           H2       LYS   1  -7.999   3.597  -5.914
    3    H3   LYS   1           H3       LYS   1  -8.162   3.417  -4.351
    4    HA   LYS   1           HA       LYS   1 -10.210   2.142  -4.623
    5    HB2  LYS   1           HB2      LYS   1 -11.139   1.583  -6.657
    6    HB3  LYS   1           HB3      LYS   1 -10.810   3.294  -6.825
    7    HG2  LYS   1           HG2      LYS   1  -9.057   1.063  -7.984
    8    HG3  LYS   1           HG3      LYS   1 -10.371   1.815  -8.837
    9    HD2  LYS   1           HD2      LYS   1  -9.212   3.622  -9.431
   10    HD3  LYS   1           HD3      LYS   1  -8.465   3.854  -7.863
   11    HE2  LYS   1           HE2      LYS   1  -7.585   1.679  -9.814
   12    HE3  LYS   1           HE3      LYS   1  -6.900   3.313  -9.809
   13    HZ1  LYS   1           HZ1      LYS   1  -6.211   3.005  -7.520
   14    HZ2  LYS   1           HZ2      LYS   1  -6.872   1.539  -7.428
   15    HZ3  LYS   1           HZ3      LYS   1  -5.575   1.745  -8.402
   16    H    LEU   2           H        LEU   2 -10.199  -0.198  -4.828
   17    HA   LEU   2           HA       LEU   2  -7.492  -1.320  -5.270
   18    HB2  LEU   2           HB2      LEU   2  -8.625  -1.575  -3.025
   19    HB3  LEU   2           HB3      LEU   2  -9.907  -2.476  -3.821
   20    HG   LEU   2           HG       LEU   2  -8.251  -4.209  -4.521
   21   HD11  LEU   2          HD11      LEU   2  -5.998  -4.148  -3.464
   22   HD12  LEU   2          HD12      LEU   2  -6.197  -2.879  -4.668
   23   HD13  LEU   2          HD13      LEU   2  -6.314  -2.477  -2.942
   24   HD21  LEU   2          HD21      LEU   2  -7.812  -5.127  -2.291
   25   HD22  LEU   2          HD22      LEU   2  -8.123  -3.545  -1.547
   26   HD23  LEU   2          HD23      LEU   2  -9.442  -4.432  -2.355
   27    HA   PRO   3           HA       PRO   3  -9.712  -3.357  -8.705
   28    HB2  PRO   3           HB2      PRO   3  -7.165  -3.809 -10.054
   29    HB3  PRO   3           HB3      PRO   3  -8.503  -2.745 -10.530
   30    HG2  PRO   3           HG2      PRO   3  -6.032  -1.793  -9.660
   31    HG3  PRO   3           HG3      PRO   3  -7.574  -0.898  -9.509
   32    HD2  PRO   3           HD2      PRO   3  -6.179  -2.572  -7.412
   33    HD3  PRO   3           HD3      PRO   3  -6.924  -0.957  -7.277
   34    HA   PRO   4           HA       PRO   4  -9.123  -7.723  -7.975
   35    HB2  PRO   4           HB2      PRO   4  -8.538  -8.077 -10.921
   36    HB3  PRO   4           HB3      PRO   4  -9.641  -9.019  -9.869
   37    HG2  PRO   4           HG2      PRO   4 -10.635  -7.128 -11.528
   38    HG3  PRO   4           HG3      PRO   4 -11.246  -7.244  -9.844
   39    HD2  PRO   4           HD2      PRO   4  -9.202  -5.321 -10.976
   40    HD3  PRO   4           HD3      PRO   4 -10.572  -5.000  -9.868
   41    H    GLY   5           H        GLY   5  -7.468  -8.910  -7.155
   42    HA2  GLY   5           HA2      GLY   5  -5.466 -10.022  -7.009
   43    HA3  GLY   5           HA3      GLY   5  -5.017  -9.407  -8.603
   44    H    TRP   6           H        TRP   6  -5.768  -6.680  -6.785
   45    HA   TRP   6           HA       TRP   6  -2.935  -6.132  -6.143
   46    HB2  TRP   6           HB2      TRP   6  -5.444  -4.452  -6.114
   47    HB3  TRP   6           HB3      TRP   6  -3.849  -3.871  -5.644
   48    HD1  TRP   6           HD1      TRP   6  -5.779  -5.075  -8.718
   49    HE1  TRP   6           HE1      TRP   6  -4.687  -4.147 -10.852
   50    HE3  TRP   6           HE3      TRP   6  -1.517  -3.224  -6.653
   51    HZ2  TRP   6           HZ2      TRP   6  -2.265  -2.753 -11.558
   52    HZ3  TRP   6           HZ3      TRP   6   0.234  -2.280  -8.088
   53    HH2  TRP   6           HH2      TRP   6  -0.138  -1.943 -10.524
   54    H    GLU   7           H        GLU   7  -2.106  -6.037  -4.112
   55    HA   GLU   7           HA       GLU   7  -3.929  -6.499  -1.794
   56    HB2  GLU   7           HB2      GLU   7  -2.996  -8.528  -3.123
   57    HB3  GLU   7           HB3      GLU   7  -1.417  -8.035  -2.531
   58    HG2  GLU   7           HG2      GLU   7  -2.998  -8.161  -0.215
   59    HG3  GLU   7           HG3      GLU   7  -3.642  -9.473  -1.199
   60    H    LYS   8           H        LYS   8  -3.218  -5.606   0.166
   61    HA   LYS   8           HA       LYS   8  -1.313  -3.626   0.200
   62    HB2  LYS   8           HB2      LYS   8  -1.851  -3.191   2.317
   63    HB3  LYS   8           HB3      LYS   8  -3.290  -4.015   1.785
   64    HG2  LYS   8           HG2      LYS   8  -1.141  -5.402   3.463
   65    HG3  LYS   8           HG3      LYS   8  -2.370  -4.380   4.139
   66    HD2  LYS   8           HD2      LYS   8  -3.102  -6.594   4.442
   67    HD3  LYS   8           HD3      LYS   8  -4.165  -5.806   3.291
   68    HE2  LYS   8           HE2      LYS   8  -3.769  -8.114   2.643
   69    HE3  LYS   8           HE3      LYS   8  -3.103  -7.015   1.438
   70    HZ1  LYS   8           HZ1      LYS   8  -1.515  -8.430   3.502
   71    HZ2  LYS   8           HZ2      LYS   8  -1.547  -8.773   1.871
   72    HZ3  LYS   8           HZ3      LYS   8  -0.922  -7.367   2.364
   73    H    ARG   9           H        ARG   9   0.810  -3.484   0.288
   74    HA   ARG   9           HA       ARG   9   2.479  -5.654   1.426
   75    HB2  ARG   9           HB2      ARG   9   1.937  -5.624  -1.108
   76    HB3  ARG   9           HB3      ARG   9   2.791  -4.092  -1.182
   77    HG2  ARG   9           HG2      ARG   9   4.236  -5.744  -1.915
   78    HG3  ARG   9           HG3      ARG   9   4.851  -5.289  -0.330
   79    HD2  ARG   9           HD2      ARG   9   5.014  -7.656  -0.436
   80    HD3  ARG   9           HD3      ARG   9   3.637  -7.350   0.607
   81    HE   ARG   9           HE       ARG   9   3.606  -8.363  -2.203
   82   HH11  ARG   9          HH11      ARG   9   1.415  -7.547   0.506
   83   HH12  ARG   9          HH12      ARG   9   0.418  -8.931   0.146
   84   HH21  ARG   9          HH22      ARG   9   2.076  -9.926  -2.675
   85   HH22  ARG   9          HH21      ARG   9   0.602  -9.997  -1.719
   86    H    MET  10           H        MET  10   4.540  -5.006   2.165
   87    HA   MET  10           HA       MET  10   4.613  -2.236   3.127
   88    HB2  MET  10           HB2      MET  10   6.185  -4.747   3.832
   89    HB3  MET  10           HB3      MET  10   6.515  -3.147   4.505
   90    HG2  MET  10           HG2      MET  10   5.161  -4.280   6.084
   91    HG3  MET  10           HG3      MET  10   4.181  -3.018   5.348
   92    HE1  MET  10           HE1      MET  10   1.466  -5.646   6.213
   93    HE2  MET  10           HE2      MET  10   2.885  -5.161   7.168
   94    HE3  MET  10           HE3      MET  10   1.949  -3.936   6.276
   95    H    PHE  11           H        PHE  11   5.867  -0.695   2.371
   96    HA   PHE  11           HA       PHE  11   8.012  -1.237   0.403
   97    HB2  PHE  11           HB2      PHE  11   6.295   0.552  -0.016
   98    HB3  PHE  11           HB3      PHE  11   6.840   1.374   1.432
   99    HD1  PHE  11           HD2      PHE  11   8.251  -0.107  -1.744
  100    HD2  PHE  11           HD1      PHE  11   8.382   3.146   1.093
  101    HE1  PHE  11           HE2      PHE  11   9.954   1.045  -3.134
  102    HE2  PHE  11           HE1      PHE  11  10.055   4.305  -0.330
  103    HZ   PHE  11           HZ       PHE  11  10.852   3.251  -2.427
  104    H    ALA  12           H        ALA  12  10.009  -1.562   1.204
  105    HA   ALA  12           HA       ALA  12  10.606  -1.673   3.881
  106    HB1  ALA  12           HB1      ALA  12  11.729  -2.922   2.083
  107    HB2  ALA  12           HB2      ALA  12  12.517  -1.426   1.522
  108    HB3  ALA  12           HB3      ALA  12  12.906  -2.097   3.120
  109    H    ASN  13           H        ASN  13  10.747   1.298   2.035
  110    HA   ASN  13           HA       ASN  13  12.594   2.646   3.833
  111    HB2  ASN  13           HB2      ASN  13  11.850   3.164   1.329
  112    HB3  ASN  13           HB3      ASN  13  10.568   4.085   2.127
  113   HD21  ASN  13          HD22      ASN  13  11.880   5.318   4.262
  114   HD22  ASN  13          HD21      ASN  13  13.162   6.331   3.566
  115    H    GLY  14           H        GLY  14   9.404   1.536   4.314
  116    HA2  GLY  14           HA2      GLY  14   8.370   1.767   6.459
  117    HA3  GLY  14           HA3      GLY  14   8.985   3.418   6.601
  118    H    THR  15           H        THR  15   6.898   1.448   4.362
  119    HA   THR  15           HA       THR  15   4.652   3.270   4.696
  120    HB   THR  15           HB       THR  15   6.436   3.378   2.272
  121    HG1  THR  15           HG1      THR  15   6.197   4.886   4.116
  122   HG21  THR  15          HG21      THR  15   4.737   4.541   0.949
  123   HG22  THR  15          HG22      THR  15   4.329   2.838   1.149
  124   HG23  THR  15          HG23      THR  15   3.481   4.084   2.113
  125    H    VAL  16           H        VAL  16   2.738   2.471   3.349
  126    HA   VAL  16           HA       VAL  16   3.009  -0.373   2.559
  127    HB   VAL  16           HB       VAL  16   0.889   0.863   4.295
  128   HG11  VAL  16          HG11      VAL  16  -0.469   0.004   2.421
  129   HG12  VAL  16          HG12      VAL  16   0.409  -1.542   2.471
  130   HG13  VAL  16          HG13      VAL  16  -0.628  -1.045   3.825
  131   HG21  VAL  16          HG21      VAL  16   2.225  -1.875   4.140
  132   HG22  VAL  16          HG22      VAL  16   2.740  -0.552   5.214
  133   HG23  VAL  16          HG23      VAL  16   1.152  -1.310   5.444
  134    H    TYR  17           H        TYR  17   2.204  -0.926   0.714
  135    HA   TYR  17           HA       TYR  17   0.799   1.035  -1.011
  136    HB2  TYR  17           HB2      TYR  17   2.364   0.877  -2.743
  137    HB3  TYR  17           HB3      TYR  17   3.336   1.101  -1.317
  138    HD1  TYR  17           HD1      TYR  17   4.590  -0.864  -0.325
  139    HD2  TYR  17           HD2      TYR  17   2.520  -1.169  -4.088
  140    HE1  TYR  17           HE1      TYR  17   6.040  -2.781  -0.964
  141    HE2  TYR  17           HE2      TYR  17   3.961  -3.085  -4.728
  142    HH   TYR  17           HH       TYR  17   6.596  -4.257  -2.633
  143    H    TYR  18           H        TYR  18   0.307  -0.268  -3.209
  144    HA   TYR  18           HA       TYR  18  -0.777  -2.915  -2.415
  145    HB2  TYR  18           HB2      TYR  18  -1.950  -0.663  -4.033
  146    HB3  TYR  18           HB3      TYR  18  -2.474  -2.335  -4.276
  147    HD1  TYR  18           HD2      TYR  18  -1.918   0.222  -1.559
  148    HD2  TYR  18           HD1      TYR  18  -3.987  -3.365  -2.779
  149    HE1  TYR  18           HE2      TYR  18  -2.871  -0.021   0.705
  150    HE2  TYR  18           HE1      TYR  18  -5.177  -3.418  -0.596
  151    HH   TYR  18           HH       TYR  18  -4.360  -1.066   2.044
  152    H    PHE  19           H        PHE  19  -0.050  -4.598  -3.300
  153    HA   PHE  19           HA       PHE  19   1.680  -4.444  -5.723
  154    HB2  PHE  19           HB2      PHE  19   2.791  -5.062  -3.674
  155    HB3  PHE  19           HB3      PHE  19   1.536  -6.203  -3.260
  156    HD1  PHE  19           HD2      PHE  19   1.352  -8.406  -4.474
  157    HD2  PHE  19           HD1      PHE  19   4.605  -5.649  -5.165
  158    HE1  PHE  19           HE2      PHE  19   2.721 -10.240  -5.463
  159    HE2  PHE  19           HE1      PHE  19   5.931  -7.479  -6.169
  160    HZ   PHE  19           HZ       PHE  19   4.968  -9.759  -6.377
  161    H    ASN  20           H        ASN  20   0.898  -5.392  -7.540
  162    HA   ASN  20           HA       ASN  20  -1.566  -6.972  -7.417
  163    HB2  ASN  20           HB2      ASN  20  -1.152  -5.324  -9.226
  164    HB3  ASN  20           HB3      ASN  20   0.201  -6.298  -9.771
  165   HD21  ASN  20          HD22      ASN  20  -3.380  -6.162  -9.484
  166   HD22  ASN  20          HD21      ASN  20  -3.640  -7.568 -10.480
  167    H    HIS  21           H        HIS  21  -1.289  -8.969  -6.488
  168    HA   HIS  21           HA       HIS  21   1.165 -10.458  -6.936
  169    HB2  HIS  21           HB2      HIS  21   0.182 -12.149  -5.466
  170    HB3  HIS  21           HB3      HIS  21   0.210 -10.542  -4.785
  171    HD1  HIS  21           HD1      HIS  21  -1.709 -10.854  -3.057
  172    HD2  HIS  21           HD2      HIS  21  -2.719 -11.821  -7.055
  173    HE1  HIS  21           HE1      HIS  21  -4.246 -11.197  -3.143
  174    H    ILE  22           H        ILE  22  -1.038  -9.965  -9.217
  175    HA   ILE  22           HA       ILE  22  -0.798 -12.711 -10.349
  176    HB   ILE  22           HB       ILE  22  -2.413 -10.351 -11.392
  177   HG12  ILE  22          HG12      ILE  22  -3.339 -12.727  -9.718
  178   HG13  ILE  22          HG13      ILE  22  -3.298 -11.041  -9.201
  179   HG21  ILE  22          HG21      ILE  22  -2.472 -13.308 -12.137
  180   HG22  ILE  22          HG22      ILE  22  -3.533 -12.046 -12.805
  181   HG23  ILE  22          HG23      ILE  22  -1.823 -11.994 -13.142
  182   HD11  ILE  22          HD11      ILE  22  -5.554 -11.556  -9.696
  183   HD12  ILE  22          HD12      ILE  22  -4.971 -10.472 -10.975
  184   HD13  ILE  22          HD13      ILE  22  -5.156 -12.221 -11.280
  185    H    THR  23           H        THR  23   0.581  -9.498 -10.465
  186    HA   THR  23           HA       THR  23   2.151 -10.194 -12.931
  187    HB   THR  23           HB       THR  23   1.847  -7.869 -13.686
  188    HG1  THR  23           HG1      THR  23  -0.073  -7.684 -11.621
  189   HG21  THR  23          HG21      THR  23  -0.464  -7.919 -14.388
  190   HG22  THR  23          HG22      THR  23   0.214  -9.555 -14.498
  191   HG23  THR  23          HG23      THR  23  -0.877  -9.134 -13.162
  192    H    ASN  24           H        ASN  24   2.421  -9.000  -9.682
  193    HA   ASN  24           HA       ASN  24   4.026  -8.067  -8.514
  194    HB2  ASN  24           HB2      ASN  24   5.472  -9.670  -9.991
  195    HB3  ASN  24           HB3      ASN  24   6.012  -8.198 -10.791
  196   HD21  ASN  24          HD22      ASN  24   6.645  -6.414  -8.971
  197   HD22  ASN  24          HD21      ASN  24   7.845  -7.102  -7.853
  198    H    ALA  25           H        ALA  25   2.343  -6.472 -10.801
  199    HA   ALA  25           HA       ALA  25   3.811  -4.001 -10.973
  200    HB1  ALA  25           HB1      ALA  25   1.949  -4.655 -12.479
  201    HB2  ALA  25           HB2      ALA  25   0.810  -4.500 -11.125
  202    HB3  ALA  25           HB3      ALA  25   1.684  -3.075 -11.724
  203    H    SER  26           H        SER  26   3.224  -1.930  -9.907
  204    HA   SER  26           HA       SER  26   2.436  -2.255  -7.047
  205    HB2  SER  26           HB2      SER  26   4.257  -0.770  -6.471
  206    HB3  SER  26           HB3      SER  26   4.885  -2.208  -7.310
  207    HG   SER  26           HG       SER  26   4.205   0.161  -8.709
  208    H    GLN  27           H        GLN  27   1.007  -0.867  -6.312
  209    HA   GLN  27           HA       GLN  27   0.480   1.760  -7.628
  210    HB2  GLN  27           HB2      GLN  27  -1.363   0.233  -8.047
  211    HB3  GLN  27           HB3      GLN  27  -1.371  -0.317  -6.370
  212    HG2  GLN  27           HG2      GLN  27  -2.065   1.966  -5.643
  213    HG3  GLN  27           HG3      GLN  27  -2.139   2.468  -7.333
  214   HE21  GLN  27          HE22      GLN  27  -4.081   1.678  -4.801
  215   HE22  GLN  27          HE21      GLN  27  -5.431   0.962  -5.661
  216    H    PHE  28           H        PHE  28   1.175   3.396  -6.268
  217    HA   PHE  28           HA       PHE  28   1.281   2.911  -3.354
  218    HB2  PHE  28           HB2      PHE  28   2.307   5.113  -5.149
  219    HB3  PHE  28           HB3      PHE  28   2.274   5.260  -3.394
  220    HD1  PHE  28           HD1      PHE  28   3.556   3.732  -1.931
  221    HD2  PHE  28           HD2      PHE  28   3.927   3.556  -6.224
  222    HE1  PHE  28           HE1      PHE  28   5.666   2.443  -1.699
  223    HE2  PHE  28           HE2      PHE  28   6.008   2.223  -5.984
  224    HZ   PHE  28           HZ       PHE  28   6.884   1.679  -3.716
  225    H    GLU  29           H        GLU  29  -1.117   3.977  -5.478
  226    HA   GLU  29           HA       GLU  29  -2.457   5.832  -3.688
  227    HB2  GLU  29           HB2      GLU  29  -2.910   5.798  -6.079
  228    HB3  GLU  29           HB3      GLU  29  -3.490   4.138  -6.011
  229    HG2  GLU  29           HG2      GLU  29  -4.821   6.130  -4.181
  230    HG3  GLU  29           HG3      GLU  29  -5.084   6.335  -5.907
  231    H    ARG  30           H        ARG  30  -2.933   5.177  -1.698
  232    HA   ARG  30           HA       ARG  30  -3.482   2.395  -1.072
  233    HB2  ARG  30           HB2      ARG  30  -1.823   3.645   0.143
  234    HB3  ARG  30           HB3      ARG  30  -3.010   4.853   0.654
  235    HG2  ARG  30           HG2      ARG  30  -4.117   3.322   2.109
  236    HG3  ARG  30           HG3      ARG  30  -3.399   1.920   1.313
  237    HD2  ARG  30           HD2      ARG  30  -1.134   2.668   2.117
  238    HD3  ARG  30           HD3      ARG  30  -1.948   3.969   3.013
  239    HE   ARG  30           HE       ARG  30  -2.913   1.217   3.543
  240   HH11  ARG  30          HH21      ARG  30  -0.662   3.683   4.591
  241   HH12  ARG  30          HH22      ARG  30  -0.519   3.034   6.212
  242   HH21  ARG  30          HH11      ARG  30  -2.760   0.451   5.609
  243   HH22  ARG  30          HH12      ARG  30  -1.687   1.191   6.784
  244    HA   PRO  31           HA       PRO  31  -7.942   3.463  -0.890
  245    HB2  PRO  31           HB2      PRO  31  -8.970   0.962  -1.067
  246    HB3  PRO  31           HB3      PRO  31  -8.163   1.766  -2.444
  247    HG2  PRO  31           HG2      PRO  31  -6.929  -0.217  -0.497
  248    HG3  PRO  31           HG3      PRO  31  -6.890  -0.285  -2.289
  249    HD2  PRO  31           HD2      PRO  31  -4.896   0.807  -0.796
  250    HD3  PRO  31           HD3      PRO  31  -5.297   1.397  -2.429
  251    H    SER  32           H        SER  32  -6.705   3.982   1.264
  252    HA   SER  32           HA       SER  32  -6.661   4.204   3.490
  253    HB2  SER  32           HB2      SER  32  -8.559   3.679   4.869
  254    HB3  SER  32           HB3      SER  32  -9.090   4.349   3.319
  255    HG   SER  32           HG       SER  32  -9.183   1.955   2.710
  256    H    GLY  33           H        GLY  33  -7.251   0.800   2.715
  257    HA2  GLY  33           HA2      GLY  33  -6.355  -0.353   5.152
  258    HA3  GLY  33           HA3      GLY  33  -6.400  -1.174   3.585
  Start of MODEL    5
    1    H1   LYS   1           H1       LYS   1 -11.251  -1.237  -0.230
    2    H2   LYS   1           H2       LYS   1 -12.765  -1.434   0.357
    3    H3   LYS   1           H3       LYS   1 -12.538  -0.899  -1.199
    4    HA   LYS   1           HA       LYS   1 -11.852  -3.559  -0.137
    5    HB2  LYS   1           HB2      LYS   1 -14.275  -3.301  -0.653
    6    HB3  LYS   1           HB3      LYS   1 -13.865  -2.744  -2.272
    7    HG2  LYS   1           HG2      LYS   1 -12.501  -5.159  -2.224
    8    HG3  LYS   1           HG3      LYS   1 -13.772  -5.501  -1.080
    9    HD2  LYS   1           HD2      LYS   1 -14.303  -6.252  -3.349
   10    HD3  LYS   1           HD3      LYS   1 -15.475  -5.077  -2.769
   11    HE2  LYS   1           HE2      LYS   1 -14.826  -4.853  -5.180
   12    HE3  LYS   1           HE3      LYS   1 -14.678  -3.376  -4.234
   13    HZ1  LYS   1           HZ1      LYS   1 -12.330  -3.563  -4.229
   14    HZ2  LYS   1           HZ2      LYS   1 -12.307  -5.100  -4.738
   15    HZ3  LYS   1           HZ3      LYS   1 -12.774  -3.901  -5.766
   16    H    LEU   2           H        LEU   2  -9.864  -3.953  -0.813
   17    HA   LEU   2           HA       LEU   2  -8.323  -3.072  -2.702
   18    HB2  LEU   2           HB2      LEU   2  -8.556  -6.063  -2.254
   19    HB3  LEU   2           HB3      LEU   2  -7.144  -5.211  -2.868
   20    HG   LEU   2           HG       LEU   2  -8.318  -4.998  -0.066
   21   HD11  LEU   2          HD11      LEU   2  -5.651  -6.070  -1.038
   22   HD12  LEU   2          HD12      LEU   2  -6.229  -6.041   0.639
   23   HD13  LEU   2          HD13      LEU   2  -7.035  -7.067  -0.559
   24   HD21  LEU   2          HD21      LEU   2  -5.865  -3.602  -1.230
   25   HD22  LEU   2          HD22      LEU   2  -7.367  -2.803  -0.720
   26   HD23  LEU   2          HD23      LEU   2  -6.369  -3.602   0.486
   27    HA   PRO   3           HA       PRO   3 -10.101  -3.879  -6.749
   28    HB2  PRO   3           HB2      PRO   3  -7.934  -3.026  -8.305
   29    HB3  PRO   3           HB3      PRO   3  -9.196  -1.988  -7.589
   30    HG2  PRO   3           HG2      PRO   3  -6.405  -2.490  -6.616
   31    HG3  PRO   3           HG3      PRO   3  -7.366  -0.995  -6.547
   32    HD2  PRO   3           HD2      PRO   3  -6.986  -2.739  -4.426
   33    HD3  PRO   3           HD3      PRO   3  -8.394  -1.648  -4.581
   34    HA   PRO   4           HA       PRO   4  -9.164  -7.814  -8.256
   35    HB2  PRO   4           HB2      PRO   4  -8.285  -6.643 -10.908
   36    HB3  PRO   4           HB3      PRO   4  -9.316  -8.077 -10.593
   37    HG2  PRO   4           HG2      PRO   4 -10.466  -5.706 -11.168
   38    HG3  PRO   4           HG3      PRO   4 -11.113  -6.693  -9.816
   39    HD2  PRO   4           HD2      PRO   4  -9.291  -4.291  -9.696
   40    HD3  PRO   4           HD3      PRO   4 -10.692  -4.703  -8.662
   41    H    GLY   5           H        GLY   5  -7.552  -8.766  -7.150
   42    HA2  GLY   5           HA2      GLY   5  -5.588  -9.954  -7.012
   43    HA3  GLY   5           HA3      GLY   5  -5.022  -9.201  -8.507
   44    H    TRP   6           H        TRP   6  -5.953  -6.795  -6.158
   45    HA   TRP   6           HA       TRP   6  -3.083  -6.231  -5.703
   46    HB2  TRP   6           HB2      TRP   6  -5.592  -4.617  -5.260
   47    HB3  TRP   6           HB3      TRP   6  -3.978  -4.086  -4.806
   48    HD1  TRP   6           HD1      TRP   6  -6.041  -4.874  -7.945
   49    HE1  TRP   6           HE1      TRP   6  -5.012  -3.680  -9.968
   50    HE3  TRP   6           HE3      TRP   6  -1.745  -3.186  -5.768
   51    HZ2  TRP   6           HZ2      TRP   6  -2.546  -2.339 -10.611
   52    HZ3  TRP   6           HZ3      TRP   6  -0.062  -1.988  -7.118
   53    HH2  TRP   6           HH2      TRP   6  -0.420  -1.593  -9.545
   54    H    GLU   7           H        GLU   7  -2.106  -5.949  -3.727
   55    HA   GLU   7           HA       GLU   7  -3.519  -6.690  -1.226
   56    HB2  GLU   7           HB2      GLU   7  -1.555  -8.287  -2.763
   57    HB3  GLU   7           HB3      GLU   7  -0.983  -7.935  -1.151
   58    HG2  GLU   7           HG2      GLU   7  -3.721  -9.145  -1.705
   59    HG3  GLU   7           HG3      GLU   7  -2.260 -10.087  -1.390
   60    H    LYS   8           H        LYS   8  -2.662  -5.739   0.614
   61    HA   LYS   8           HA       LYS   8  -0.903  -3.479   0.419
   62    HB2  LYS   8           HB2      LYS   8  -1.235  -3.206   2.742
   63    HB3  LYS   8           HB3      LYS   8  -2.775  -3.691   2.067
   64    HG2  LYS   8           HG2      LYS   8  -0.890  -5.400   3.735
   65    HG3  LYS   8           HG3      LYS   8  -2.450  -4.731   4.217
   66    HD2  LYS   8           HD2      LYS   8  -3.536  -6.122   2.403
   67    HD3  LYS   8           HD3      LYS   8  -1.961  -6.897   2.147
   68    HE2  LYS   8           HE2      LYS   8  -2.002  -7.669   4.525
   69    HE3  LYS   8           HE3      LYS   8  -3.658  -7.030   4.641
   70    HZ1  LYS   8           HZ1      LYS   8  -3.852  -9.327   3.951
   71    HZ2  LYS   8           HZ2      LYS   8  -4.064  -8.423   2.544
   72    HZ3  LYS   8           HZ3      LYS   8  -2.704  -9.131   2.745
   73    H    ARG   9           H        ARG   9   1.208  -3.305   0.748
   74    HA   ARG   9           HA       ARG   9   2.800  -5.475   2.051
   75    HB2  ARG   9           HB2      ARG   9   3.321  -4.337  -0.728
   76    HB3  ARG   9           HB3      ARG   9   4.489  -5.321   0.157
   77    HG2  ARG   9           HG2      ARG   9   1.758  -6.232  -0.813
   78    HG3  ARG   9           HG3      ARG   9   3.303  -6.578  -1.573
   79    HD2  ARG   9           HD2      ARG   9   4.068  -7.881   0.319
   80    HD3  ARG   9           HD3      ARG   9   2.638  -7.479   1.259
   81    HE   ARG   9           HE       ARG   9   2.789  -9.324  -1.065
   82   HH11  ARG   9          HH21      ARG   9   0.624  -7.863   1.319
   83   HH12  ARG   9          HH22      ARG   9  -0.545  -9.161   1.151
   84   HH21  ARG   9          HH11      ARG   9   1.158 -10.944  -1.191
   85   HH22  ARG   9          HH12      ARG   9  -0.240 -10.754  -0.151
   86    H    MET  10           H        MET  10   5.081  -4.811   2.483
   87    HA   MET  10           HA       MET  10   5.171  -1.952   3.305
   88    HB2  MET  10           HB2      MET  10   6.514  -4.432   4.441
   89    HB3  MET  10           HB3      MET  10   6.938  -2.781   4.890
   90    HG2  MET  10           HG2      MET  10   5.455  -3.562   6.557
   91    HG3  MET  10           HG3      MET  10   4.613  -2.352   5.607
   92    HE1  MET  10           HE1      MET  10   3.677  -6.897   5.677
   93    HE2  MET  10           HE2      MET  10   5.191  -6.286   4.976
   94    HE3  MET  10           HE3      MET  10   4.864  -6.075   6.713
   95    H    PHE  11           H        PHE  11   6.816  -0.639   2.696
   96    HA   PHE  11           HA       PHE  11   8.704  -1.666   0.649
   97    HB2  PHE  11           HB2      PHE  11   6.887   0.205   0.251
   98    HB3  PHE  11           HB3      PHE  11   8.014   1.243   1.091
   99    HD1  PHE  11           HD1      PHE  11   7.590  -1.054  -1.831
  100    HD2  PHE  11           HD2      PHE  11   9.985   2.083  -0.092
  101    HE1  PHE  11           HE1      PHE  11   8.825  -0.807  -3.964
  102    HE2  PHE  11           HE2      PHE  11  11.212   2.326  -2.225
  103    HZ   PHE  11           HZ       PHE  11  10.638   0.883  -4.166
  104    H    ALA  12           H        ALA  12  10.848  -0.870   0.577
  105    HA   ALA  12           HA       ALA  12  12.197  -1.249   2.966
  106    HB1  ALA  12           HB1      ALA  12  14.200  -0.785   1.609
  107    HB2  ALA  12           HB2      ALA  12  13.039  -1.782   0.715
  108    HB3  ALA  12           HB3      ALA  12  13.191  -0.045   0.348
  109    H    ASN  13           H        ASN  13  10.942   1.842   1.924
  110    HA   ASN  13           HA       ASN  13  12.883   3.375   3.509
  111    HB2  ASN  13           HB2      ASN  13  11.769   5.289   2.707
  112    HB3  ASN  13           HB3      ASN  13  11.761   4.179   1.341
  113   HD21  ASN  13          HD22      ASN  13   9.808   5.738   3.840
  114   HD22  ASN  13          HD21      ASN  13   8.252   5.303   3.150
  115    H    GLY  14           H        GLY  14  10.283   1.407   4.396
  116    HA2  GLY  14           HA2      GLY  14   9.232   1.218   6.478
  117    HA3  GLY  14           HA3      GLY  14   9.840   2.809   6.963
  118    H    THR  15           H        THR  15   7.572   1.286   4.573
  119    HA   THR  15           HA       THR  15   5.408   3.118   5.269
  120    HB   THR  15           HB       THR  15   6.998   3.372   2.699
  121    HG1  THR  15           HG1      THR  15   7.036   4.663   4.855
  122   HG21  THR  15          HG21      THR  15   5.270   4.991   1.896
  123   HG22  THR  15          HG22      THR  15   4.794   3.294   1.799
  124   HG23  THR  15          HG23      THR  15   4.152   4.338   3.109
  125    H    VAL  16           H        VAL  16   3.384   2.458   4.174
  126    HA   VAL  16           HA       VAL  16   3.498  -0.302   3.074
  127    HB   VAL  16           HB       VAL  16   1.336   1.259   4.469
  128   HG11  VAL  16          HG11      VAL  16   0.137   0.416   2.483
  129   HG12  VAL  16          HG12      VAL  16   0.833  -1.204   2.732
  130   HG13  VAL  16          HG13      VAL  16  -0.299  -0.520   3.912
  131   HG21  VAL  16          HG21      VAL  16   2.894  -0.266   5.703
  132   HG22  VAL  16          HG22      VAL  16   1.225  -0.860   5.752
  133   HG23  VAL  16          HG23      VAL  16   2.396  -1.597   4.632
  134    H    TYR  17           H        TYR  17   2.711  -0.831   1.161
  135    HA   TYR  17           HA       TYR  17   1.633   1.212  -0.691
  136    HB2  TYR  17           HB2      TYR  17   3.192   0.807  -2.378
  137    HB3  TYR  17           HB3      TYR  17   4.175   0.956  -0.956
  138    HD1  TYR  17           HD1      TYR  17   5.063  -1.170   0.152
  139    HD2  TYR  17           HD2      TYR  17   3.195  -1.230  -3.751
  140    HE1  TYR  17           HE1      TYR  17   6.237  -3.296  -0.402
  141    HE2  TYR  17           HE2      TYR  17   4.358  -3.335  -4.268
  142    HH   TYR  17           HH       TYR  17   6.646  -4.871  -2.013
  143    H    TYR  18           H        TYR  18   1.007  -0.106  -2.853
  144    HA   TYR  18           HA       TYR  18  -0.210  -2.696  -2.024
  145    HB2  TYR  18           HB2      TYR  18  -1.402  -0.435  -3.642
  146    HB3  TYR  18           HB3      TYR  18  -2.030  -2.085  -3.686
  147    HD1  TYR  18           HD1      TYR  18  -1.365   0.802  -1.438
  148    HD2  TYR  18           HD2      TYR  18  -3.250  -3.055  -1.843
  149    HE1  TYR  18           HE1      TYR  18  -2.297   1.023   0.840
  150    HE2  TYR  18           HE2      TYR  18  -4.232  -2.796   0.432
  151    HH   TYR  18           HH       TYR  18  -3.693   0.077   2.446
  152    H    PHE  19           H        PHE  19   0.094  -4.386  -3.186
  153    HA   PHE  19           HA       PHE  19   1.775  -4.284  -5.652
  154    HB2  PHE  19           HB2      PHE  19   2.955  -5.090  -3.677
  155    HB3  PHE  19           HB3      PHE  19   1.611  -6.115  -3.235
  156    HD1  PHE  19           HD2      PHE  19   4.426  -5.684  -5.608
  157    HD2  PHE  19           HD1      PHE  19   1.321  -8.349  -4.214
  158    HE1  PHE  19           HE2      PHE  19   5.470  -7.558  -6.835
  159    HE2  PHE  19           HE1      PHE  19   2.426 -10.226  -5.379
  160    HZ   PHE  19           HZ       PHE  19   4.461  -9.827  -6.758
  161    H    ASN  20           H        ASN  20   0.972  -5.402  -7.435
  162    HA   ASN  20           HA       ASN  20  -1.636  -6.754  -7.092
  163    HB2  ASN  20           HB2      ASN  20  -1.334  -5.074  -8.887
  164    HB3  ASN  20           HB3      ASN  20  -0.143  -6.143  -9.629
  165   HD21  ASN  20          HD22      ASN  20  -3.592  -5.663  -8.939
  166   HD22  ASN  20          HD21      ASN  20  -4.173  -7.025  -9.831
  167    H    HIS  21           H        HIS  21  -1.470  -8.776  -6.350
  168    HA   HIS  21           HA       HIS  21   0.874 -10.425  -6.856
  169    HB2  HIS  21           HB2      HIS  21  -0.185 -11.964  -5.300
  170    HB3  HIS  21           HB3      HIS  21  -0.164 -10.339  -4.664
  171    HD1  HIS  21           HD1      HIS  21  -2.471  -9.450  -3.792
  172    HD2  HIS  21           HD2      HIS  21  -2.747 -12.686  -6.476
  173    HE1  HIS  21           HE1      HIS  21  -4.924 -10.107  -3.880
  174    H    ILE  22           H        ILE  22  -1.567  -9.777  -8.962
  175    HA   ILE  22           HA       ILE  22  -1.474 -12.521 -10.137
  176    HB   ILE  22           HB       ILE  22  -3.307 -10.160 -10.691
  177   HG12  ILE  22          HG12      ILE  22  -3.753 -12.890  -9.395
  178   HG13  ILE  22          HG13      ILE  22  -3.801 -11.325  -8.590
  179   HG21  ILE  22          HG21      ILE  22  -2.906 -11.352 -12.806
  180   HG22  ILE  22          HG22      ILE  22  -3.269 -12.904 -12.020
  181   HG23  ILE  22          HG23      ILE  22  -4.528 -11.666 -12.244
  182   HD11  ILE  22          HD11      ILE  22  -5.828 -12.435 -10.547
  183   HD12  ILE  22          HD12      ILE  22  -6.049 -11.991  -8.851
  184   HD13  ILE  22          HD13      ILE  22  -5.788 -10.721 -10.067
  185    H    THR  23           H        THR  23  -0.143  -9.316 -10.458
  186    HA   THR  23           HA       THR  23   1.043 -10.029 -13.131
  187    HB   THR  23           HB       THR  23   0.731  -7.682 -13.790
  188    HG1  THR  23           HG1      THR  23  -0.826  -7.457 -11.443
  189   HG21  THR  23          HG21      THR  23  -1.933  -8.832 -12.850
  190   HG22  THR  23          HG22      THR  23  -1.665  -7.614 -14.112
  191   HG23  THR  23          HG23      THR  23  -1.093  -9.276 -14.351
  192    H    ASN  24           H        ASN  24   1.815  -8.978  -9.939
  193    HA   ASN  24           HA       ASN  24   3.574  -8.162  -8.956
  194    HB2  ASN  24           HB2      ASN  24   4.754  -9.793 -10.635
  195    HB3  ASN  24           HB3      ASN  24   5.312  -8.316 -11.417
  196   HD21  ASN  24          HD22      ASN  24   6.221  -6.660  -9.618
  197   HD22  ASN  24          HD21      ASN  24   7.430  -7.459  -8.585
  198    H    ALA  25           H        ALA  25   1.718  -6.403 -10.930
  199    HA   ALA  25           HA       ALA  25   3.267  -3.989 -11.184
  200    HB1  ALA  25           HB1      ALA  25   1.126  -4.435 -12.378
  201    HB2  ALA  25           HB2      ALA  25   0.255  -4.282 -10.839
  202    HB3  ALA  25           HB3      ALA  25   1.126  -2.893 -11.505
  203    H    SER  26           H        SER  26   2.680  -1.896  -9.826
  204    HA   SER  26           HA       SER  26   2.051  -2.371  -7.005
  205    HB2  SER  26           HB2      SER  26   4.864  -1.725  -7.898
  206    HB3  SER  26           HB3      SER  26   4.248  -1.430  -6.253
  207    HG   SER  26           HG       SER  26   3.692  -3.929  -7.347
  208    H    GLN  27           H        GLN  27   1.601  -0.522  -5.874
  209    HA   GLN  27           HA       GLN  27   1.763   2.155  -7.157
  210    HB2  GLN  27           HB2      GLN  27  -0.724   0.670  -6.186
  211    HB3  GLN  27           HB3      GLN  27  -0.649   2.429  -6.258
  212    HG2  GLN  27           HG2      GLN  27  -0.106   2.308  -8.690
  213    HG3  GLN  27           HG3      GLN  27  -0.286   0.555  -8.629
  214   HE21  GLN  27          HE22      GLN  27  -1.989   3.661  -8.590
  215   HE22  GLN  27          HE21      GLN  27  -3.596   2.919  -8.773
  216    H    PHE  28           H        PHE  28   1.821   3.832  -5.637
  217    HA   PHE  28           HA       PHE  28   2.278   3.057  -2.777
  218    HB2  PHE  28           HB2      PHE  28   3.479   5.078  -4.539
  219    HB3  PHE  28           HB3      PHE  28   2.784   5.805  -3.107
  220    HD1  PHE  28           HD2      PHE  28   4.627   2.559  -3.732
  221    HD2  PHE  28           HD1      PHE  28   4.460   6.268  -1.540
  222    HE1  PHE  28           HE2      PHE  28   6.601   1.864  -2.396
  223    HE2  PHE  28           HE1      PHE  28   6.440   5.565  -0.210
  224    HZ   PHE  28           HZ       PHE  28   7.498   3.365  -0.622
  225    H    GLU  29           H        GLU  29   0.053   4.447  -4.956
  226    HA   GLU  29           HA       GLU  29  -1.684   5.908  -3.283
  227    HB2  GLU  29           HB2      GLU  29  -2.472   4.089  -5.603
  228    HB3  GLU  29           HB3      GLU  29  -3.321   5.503  -4.991
  229    HG2  GLU  29           HG2      GLU  29  -2.337   6.450  -6.815
  230    HG3  GLU  29           HG3      GLU  29  -1.069   6.779  -5.645
  231    H    ARG  30           H        ARG  30  -3.581   5.274  -2.079
  232    HA   ARG  30           HA       ARG  30  -3.545   2.428  -1.203
  233    HB2  ARG  30           HB2      ARG  30  -3.715   4.839   0.633
  234    HB3  ARG  30           HB3      ARG  30  -3.660   3.131   1.096
  235    HG2  ARG  30           HG2      ARG  30  -1.390   3.003  -0.089
  236    HG3  ARG  30           HG3      ARG  30  -1.481   4.758  -0.270
  237    HD2  ARG  30           HD2      ARG  30  -1.524   5.029   2.186
  238    HD3  ARG  30           HD3      ARG  30  -1.425   3.270   2.371
  239    HE   ARG  30           HE       ARG  30   0.837   3.295   1.706
  240   HH11  ARG  30          HH11      ARG  30  -0.401   6.504   1.063
  241   HH12  ARG  30          HH12      ARG  30   1.144   7.054   0.463
  242   HH21  ARG  30          HH21      ARG  30   2.639   3.968   0.998
  243   HH22  ARG  30          HH22      ARG  30   2.911   5.619   0.447
  244    HA   PRO  31           HA       PRO  31  -7.988   3.140  -1.818
  245    HB2  PRO  31           HB2      PRO  31  -8.853   0.576  -1.776
  246    HB3  PRO  31           HB3      PRO  31  -7.878   1.199  -3.139
  247    HG2  PRO  31           HG2      PRO  31  -6.911  -0.400  -0.746
  248    HG3  PRO  31           HG3      PRO  31  -6.563  -0.688  -2.481
  249    HD2  PRO  31           HD2      PRO  31  -4.909   0.708  -0.770
  250    HD3  PRO  31           HD3      PRO  31  -4.968   1.035  -2.523
  251    H    SER  32           H        SER  32  -9.966   2.740  -0.468
  252    HA   SER  32           HA       SER  32  -9.472   2.668   2.403
  253    HB2  SER  32           HB2      SER  32 -11.863   3.025   2.576
  254    HB3  SER  32           HB3      SER  32 -11.206   4.124   1.344
  255    HG   SER  32           HG       SER  32 -12.317   1.580   0.874
  256    H    GLY  33           H        GLY  33  -8.343   0.580   2.159
  257    HA2  GLY  33           HA2      GLY  33  -8.135  -1.701   2.482
  258    HA3  GLY  33           HA3      GLY  33  -9.827  -1.763   3.005
  Start of MODEL    6
    1    H1   LYS   1           H1       LYS   1 -12.353  -8.589  -0.340
    2    H2   LYS   1           H2       LYS   1 -11.846 -10.167  -0.300
    3    H3   LYS   1           H3       LYS   1 -11.988  -9.353  -1.735
    4    HA   LYS   1           HA       LYS   1 -10.069  -8.726   0.404
    5    HB2  LYS   1           HB2      LYS   1  -9.789 -10.778  -1.366
    6    HB3  LYS   1           HB3      LYS   1  -9.208  -9.463  -2.384
    7    HG2  LYS   1           HG2      LYS   1  -7.707  -8.881  -0.248
    8    HG3  LYS   1           HG3      LYS   1  -8.143 -10.503   0.263
    9    HD2  LYS   1           HD2      LYS   1  -6.035 -10.669  -0.790
   10    HD3  LYS   1           HD3      LYS   1  -7.176 -11.359  -1.956
   11    HE2  LYS   1           HE2      LYS   1  -7.107  -9.337  -3.322
   12    HE3  LYS   1           HE3      LYS   1  -6.331  -8.436  -2.017
   13    HZ1  LYS   1           HZ1      LYS   1  -5.026 -10.457  -3.734
   14    HZ2  LYS   1           HZ2      LYS   1  -4.632  -8.873  -3.412
   15    HZ3  LYS   1           HZ3      LYS   1  -4.422 -10.054  -2.268
   16    H    LEU   2           H        LEU   2  -8.221  -7.296  -0.976
   17    HA   LEU   2           HA       LEU   2  -9.413  -4.792  -1.727
   18    HB2  LEU   2           HB2      LEU   2  -6.668  -6.063  -2.035
   19    HB3  LEU   2           HB3      LEU   2  -6.969  -4.389  -2.460
   20    HG   LEU   2           HG       LEU   2  -7.528  -5.441   0.344
   21   HD11  LEU   2          HD11      LEU   2  -5.227  -5.955  -0.056
   22   HD12  LEU   2          HD12      LEU   2  -4.924  -4.342  -0.765
   23   HD13  LEU   2          HD13      LEU   2  -5.301  -4.512   0.967
   24   HD21  LEU   2          HD21      LEU   2  -6.774  -2.644  -0.570
   25   HD22  LEU   2          HD22      LEU   2  -8.457  -3.175  -0.345
   26   HD23  LEU   2          HD23      LEU   2  -7.335  -3.152   1.023
   27    HA   PRO   3           HA       PRO   3 -10.524  -5.202  -5.907
   28    HB2  PRO   3           HB2      PRO   3  -8.380  -3.228  -6.739
   29    HB3  PRO   3           HB3      PRO   3 -10.106  -3.272  -7.223
   30    HG2  PRO   3           HG2      PRO   3  -9.334  -1.576  -5.306
   31    HG3  PRO   3           HG3      PRO   3 -10.810  -2.562  -5.049
   32    HD2  PRO   3           HD2      PRO   3  -8.024  -3.054  -3.976
   33    HD3  PRO   3           HD3      PRO   3  -9.594  -3.150  -3.123
   34    HA   PRO   4           HA       PRO   4  -8.935  -8.385  -8.216
   35    HB2  PRO   4           HB2      PRO   4  -8.534  -6.513 -10.562
   36    HB3  PRO   4           HB3      PRO   4  -9.066  -8.231 -10.579
   37    HG2  PRO   4           HG2      PRO   4 -10.926  -6.278 -10.557
   38    HG3  PRO   4           HG3      PRO   4 -11.115  -7.682  -9.456
   39    HD2  PRO   4           HD2      PRO   4 -10.187  -4.896  -8.824
   40    HD3  PRO   4           HD3      PRO   4 -11.180  -6.013  -7.839
   41    H    GLY   5           H        GLY   5  -7.201  -8.821  -6.949
   42    HA2  GLY   5           HA2      GLY   5  -5.137  -9.885  -7.009
   43    HA3  GLY   5           HA3      GLY   5  -4.638  -8.901  -8.386
   44    H    TRP   6           H        TRP   6  -5.668  -6.471  -6.460
   45    HA   TRP   6           HA       TRP   6  -2.964  -5.757  -5.697
   46    HB2  TRP   6           HB2      TRP   6  -5.670  -4.511  -5.135
   47    HB3  TRP   6           HB3      TRP   6  -4.134  -3.816  -4.629
   48    HD1  TRP   6           HD1      TRP   6  -6.363  -4.090  -7.621
   49    HE1  TRP   6           HE1      TRP   6  -5.318  -2.855  -9.632
   50    HE3  TRP   6           HE3      TRP   6  -1.654  -3.352  -5.769
   51    HZ2  TRP   6           HZ2      TRP   6  -2.750  -1.767 -10.360
   52    HZ3  TRP   6           HZ3      TRP   6   0.083  -2.277  -7.164
   53    HH2  TRP   6           HH2      TRP   6  -0.455  -1.465  -9.446
   54    H    GLU   7           H        GLU   7  -1.914  -5.793  -3.732
   55    HA   GLU   7           HA       GLU   7  -3.517  -6.309  -1.330
   56    HB2  GLU   7           HB2      GLU   7  -2.534  -8.458  -2.577
   57    HB3  GLU   7           HB3      GLU   7  -1.058  -8.001  -1.727
   58    HG2  GLU   7           HG2      GLU   7  -2.244  -8.110   0.431
   59    HG3  GLU   7           HG3      GLU   7  -3.798  -8.318  -0.395
   60    H    LYS   8           H        LYS   8  -2.731  -5.487   0.521
   61    HA   LYS   8           HA       LYS   8  -0.900  -3.348   0.526
   62    HB2  LYS   8           HB2      LYS   8  -2.986  -3.884   1.949
   63    HB3  LYS   8           HB3      LYS   8  -1.955  -4.950   2.898
   64    HG2  LYS   8           HG2      LYS   8  -0.553  -2.984   3.534
   65    HG3  LYS   8           HG3      LYS   8  -1.570  -1.943   2.518
   66    HD2  LYS   8           HD2      LYS   8  -3.582  -2.690   3.914
   67    HD3  LYS   8           HD3      LYS   8  -2.454  -3.558   4.949
   68    HE2  LYS   8           HE2      LYS   8  -2.846  -1.580   6.111
   69    HE3  LYS   8           HE3      LYS   8  -1.278  -1.314   5.340
   70    HZ1  LYS   8           HZ1      LYS   8  -2.542  -0.089   3.567
   71    HZ2  LYS   8           HZ2      LYS   8  -3.919  -0.242   4.402
   72    HZ3  LYS   8           HZ3      LYS   8  -2.687   0.619   5.055
   73    H    ARG   9           H        ARG   9   1.203  -3.225   0.969
   74    HA   ARG   9           HA       ARG   9   2.716  -5.428   2.286
   75    HB2  ARG   9           HB2      ARG   9   3.301  -4.166  -0.436
   76    HB3  ARG   9           HB3      ARG   9   4.483  -5.117   0.462
   77    HG2  ARG   9           HG2      ARG   9   1.837  -6.174  -0.622
   78    HG3  ARG   9           HG3      ARG   9   3.432  -6.404  -1.329
   79    HD2  ARG   9           HD2      ARG   9   4.200  -7.614   0.673
   80    HD3  ARG   9           HD3      ARG   9   2.633  -7.386   1.449
   81    HE   ARG   9           HE       ARG   9   3.287  -9.242  -0.736
   82   HH11  ARG   9          HH11      ARG   9   0.526  -7.810   1.105
   83   HH12  ARG   9          HH12      ARG   9  -0.413  -9.270   0.666
   84   HH21  ARG   9          HH21      ARG   9   1.774 -10.943  -1.149
   85   HH22  ARG   9          HH22      ARG   9   0.148 -10.706  -0.462
   86    H    MET  10           H        MET  10   4.823  -4.786   3.072
   87    HA   MET  10           HA       MET  10   4.915  -1.942   3.879
   88    HB2  MET  10           HB2      MET  10   5.104  -3.788   5.544
   89    HB3  MET  10           HB3      MET  10   6.619  -4.291   4.778
   90    HG2  MET  10           HG2      MET  10   6.234  -1.456   5.776
   91    HG3  MET  10           HG3      MET  10   6.642  -2.757   6.891
   92    HE1  MET  10           HE1      MET  10   8.271  -0.001   6.303
   93    HE2  MET  10           HE2      MET  10   8.698  -1.140   7.604
   94    HE3  MET  10           HE3      MET  10   9.939  -0.598   6.449
   95    H    PHE  11           H        PHE  11   6.422  -0.558   3.225
   96    HA   PHE  11           HA       PHE  11   8.333  -1.320   1.082
   97    HB2  PHE  11           HB2      PHE  11   6.521   0.424   0.648
   98    HB3  PHE  11           HB3      PHE  11   7.295   1.432   1.844
   99    HD1  PHE  11           HD1      PHE  11   7.889  -0.389  -1.379
  100    HD2  PHE  11           HD2      PHE  11   9.111   2.855   1.192
  101    HE1  PHE  11           HE1      PHE  11   9.401   0.456  -3.156
  102    HE2  PHE  11           HE2      PHE  11  10.604   3.706  -0.605
  103    HZ   PHE  11           HZ       PHE  11  10.760   2.502  -2.767
  104    H    ALA  12           H        ALA  12  10.336  -1.632   1.820
  105    HA   ALA  12           HA       ALA  12  11.184  -1.417   4.384
  106    HB1  ALA  12           HB1      ALA  12  12.886  -1.421   1.861
  107    HB2  ALA  12           HB2      ALA  12  13.412  -1.927   3.481
  108    HB3  ALA  12           HB3      ALA  12  12.151  -2.845   2.639
  109    H    ASN  13           H        ASN  13  11.207   1.356   2.240
  110    HA   ASN  13           HA       ASN  13  13.202   2.857   3.718
  111    HB2  ASN  13           HB2      ASN  13  12.204   3.143   1.271
  112    HB3  ASN  13           HB3      ASN  13  11.002   4.140   2.100
  113   HD21  ASN  13          HD22      ASN  13  12.511   5.571   3.964
  114   HD22  ASN  13          HD21      ASN  13  13.707   6.509   3.049
  115    H    GLY  14           H        GLY  14  10.089   1.825   4.634
  116    HA2  GLY  14           HA2      GLY  14   9.205   2.280   6.818
  117    HA3  GLY  14           HA3      GLY  14   9.895   3.908   6.776
  118    H    THR  15           H        THR  15   7.658   1.873   4.761
  119    HA   THR  15           HA       THR  15   5.501   3.834   4.838
  120    HB   THR  15           HB       THR  15   7.390   3.565   2.492
  121    HG1  THR  15           HG1      THR  15   7.235   5.254   4.256
  122   HG21  THR  15          HG21      THR  15   5.842   4.881   1.085
  123   HG22  THR  15          HG22      THR  15   5.272   3.234   1.342
  124   HG23  THR  15          HG23      THR  15   4.534   4.590   2.246
  125    H    VAL  16           H        VAL  16   3.678   2.977   3.267
  126    HA   VAL  16           HA       VAL  16   3.807   0.022   2.967
  127    HB   VAL  16           HB       VAL  16   1.655   1.711   4.213
  128   HG11  VAL  16          HG11      VAL  16   0.396   0.762   2.328
  129   HG12  VAL  16          HG12      VAL  16   1.025  -0.860   2.701
  130   HG13  VAL  16          HG13      VAL  16  -0.043  -0.026   3.843
  131   HG21  VAL  16          HG21      VAL  16   2.597  -1.160   4.621
  132   HG22  VAL  16          HG22      VAL  16   3.202   0.245   5.533
  133   HG23  VAL  16          HG23      VAL  16   1.506  -0.247   5.688
  134    H    TYR  17           H        TYR  17   2.913  -0.805   1.121
  135    HA   TYR  17           HA       TYR  17   1.875   1.043  -0.922
  136    HB2  TYR  17           HB2      TYR  17   3.449   0.556  -2.555
  137    HB3  TYR  17           HB3      TYR  17   4.429   0.792  -1.137
  138    HD1  TYR  17           HD1      TYR  17   5.243  -1.289   0.158
  139    HD2  TYR  17           HD2      TYR  17   3.531  -1.538  -3.800
  140    HE1  TYR  17           HE1      TYR  17   6.434  -3.418  -0.223
  141    HE2  TYR  17           HE2      TYR  17   4.758  -3.654  -4.183
  142    HH   TYR  17           HH       TYR  17   6.934  -5.072  -1.747
  143    H    TYR  18           H        TYR  18   1.437  -0.481  -2.999
  144    HA   TYR  18           HA       TYR  18   0.055  -2.918  -2.071
  145    HB2  TYR  18           HB2      TYR  18  -0.988  -0.747  -3.932
  146    HB3  TYR  18           HB3      TYR  18  -1.769  -2.310  -3.662
  147    HD1  TYR  18           HD2      TYR  18  -0.764   0.879  -2.037
  148    HD2  TYR  18           HD1      TYR  18  -3.000  -2.796  -1.638
  149    HE1  TYR  18           HE2      TYR  18  -1.527   1.591   0.213
  150    HE2  TYR  18           HE1      TYR  18  -3.852  -2.032   0.564
  151    HH   TYR  18           HH       TYR  18  -3.961  -0.337   2.039
  152    H    PHE  19           H        PHE  19   0.477  -4.667  -3.150
  153    HA   PHE  19           HA       PHE  19   1.886  -4.526  -5.789
  154    HB2  PHE  19           HB2      PHE  19   3.317  -5.388  -4.027
  155    HB3  PHE  19           HB3      PHE  19   2.064  -6.463  -3.459
  156    HD1  PHE  19           HD1      PHE  19   4.338  -5.745  -6.340
  157    HD2  PHE  19           HD2      PHE  19   1.771  -8.662  -4.455
  158    HE1  PHE  19           HE1      PHE  19   5.218  -7.494  -7.848
  159    HE2  PHE  19           HE2      PHE  19   2.669 -10.414  -5.962
  160    HZ   PHE  19           HZ       PHE  19   4.381  -9.837  -7.669
  161    H    ASN  20           H        ASN  20   0.846  -5.467  -7.485
  162    HA   ASN  20           HA       ASN  20  -1.724  -6.807  -6.951
  163    HB2  ASN  20           HB2      ASN  20  -1.527  -4.956  -8.613
  164    HB3  ASN  20           HB3      ASN  20  -0.475  -5.984  -9.574
  165   HD21  ASN  20          HD22      ASN  20  -3.794  -5.256  -8.710
  166   HD22  ASN  20          HD21      ASN  20  -4.535  -6.583  -9.558
  167    H    HIS  21           H        HIS  21  -1.381  -8.883  -6.260
  168    HA   HIS  21           HA       HIS  21   0.769 -10.462  -7.361
  169    HB2  HIS  21           HB2      HIS  21   0.189 -12.137  -5.804
  170    HB3  HIS  21           HB3      HIS  21   0.159 -10.576  -5.030
  171    HD1  HIS  21           HD1      HIS  21  -1.230 -12.270  -3.207
  172    HD2  HIS  21           HD2      HIS  21  -3.158 -10.963  -6.701
  173    HE1  HIS  21           HE1      HIS  21  -3.705 -12.602  -2.814
  174    H    ILE  22           H        ILE  22  -1.820  -9.690  -9.102
  175    HA   ILE  22           HA       ILE  22  -1.950 -12.356 -10.454
  176    HB   ILE  22           HB       ILE  22  -3.790  -9.939 -10.587
  177   HG12  ILE  22          HG12      ILE  22  -4.228 -12.830  -9.690
  178   HG13  ILE  22          HG13      ILE  22  -4.068 -11.439  -8.629
  179   HG21  ILE  22          HG21      ILE  22  -3.916 -12.487 -12.261
  180   HG22  ILE  22          HG22      ILE  22  -5.172 -11.229 -12.201
  181   HG23  ILE  22          HG23      ILE  22  -3.606 -10.847 -12.870
  182   HD11  ILE  22          HD11      ILE  22  -6.379 -12.056 -10.482
  183   HD12  ILE  22          HD12      ILE  22  -6.376 -11.900  -8.721
  184   HD13  ILE  22          HD13      ILE  22  -6.145 -10.458  -9.734
  185    H    THR  23           H        THR  23  -0.666  -9.109 -10.679
  186    HA   THR  23           HA       THR  23   0.226  -9.590 -13.516
  187    HB   THR  23           HB       THR  23  -0.167  -7.197 -13.917
  188    HG1  THR  23           HG1      THR  23  -1.416  -7.162 -11.386
  189   HG21  THR  23          HG21      THR  23  -2.702  -8.408 -12.729
  190   HG22  THR  23          HG22      THR  23  -2.580  -7.095 -13.916
  191   HG23  THR  23          HG23      THR  23  -2.076  -8.737 -14.359
  192    H    ASN  24           H        ASN  24   1.294  -8.917 -10.378
  193    HA   ASN  24           HA       ASN  24   2.979  -8.070  -9.382
  194    HB2  ASN  24           HB2      ASN  24   5.189  -8.427 -10.098
  195    HB3  ASN  24           HB3      ASN  24   4.216  -9.776 -10.669
  196   HD21  ASN  24          HD22      ASN  24   5.303  -6.537 -11.836
  197   HD22  ASN  24          HD21      ASN  24   5.771  -7.165 -13.434
  198    H    ALA  25           H        ALA  25   1.213  -6.176 -11.092
  199    HA   ALA  25           HA       ALA  25   2.859  -3.834 -11.396
  200    HB1  ALA  25           HB1      ALA  25   0.723  -2.651 -11.498
  201    HB2  ALA  25           HB2      ALA  25   0.628  -4.146 -12.445
  202    HB3  ALA  25           HB3      ALA  25  -0.131  -4.061 -10.842
  203    H    SER  26           H        SER  26   2.697  -1.844 -10.033
  204    HA   SER  26           HA       SER  26   2.406  -2.328  -7.114
  205    HB2  SER  26           HB2      SER  26   4.593  -1.355  -6.728
  206    HB3  SER  26           HB3      SER  26   4.747  -2.817  -7.729
  207    HG   SER  26           HG       SER  26   4.457  -0.257  -8.897
  208    H    GLN  27           H        GLN  27   1.514  -0.613  -6.070
  209    HA   GLN  27           HA       GLN  27   1.894   2.157  -7.055
  210    HB2  GLN  27           HB2      GLN  27  -0.797   0.788  -6.623
  211    HB3  GLN  27           HB3      GLN  27  -0.602   2.533  -6.477
  212    HG2  GLN  27           HG2      GLN  27   0.241   2.674  -8.794
  213    HG3  GLN  27           HG3      GLN  27   0.050   0.927  -8.981
  214   HE21  GLN  27          HE22      GLN  27  -1.789   4.016  -8.460
  215   HE22  GLN  27          HE21      GLN  27  -3.275   3.305  -9.116
  216    H    PHE  28           H        PHE  28   1.412   3.756  -5.293
  217    HA   PHE  28           HA       PHE  28   1.812   2.589  -2.561
  218    HB2  PHE  28           HB2      PHE  28   2.155   5.391  -3.670
  219    HB3  PHE  28           HB3      PHE  28   2.189   4.999  -1.954
  220    HD1  PHE  28           HD1      PHE  28   3.885   3.317  -1.076
  221    HD2  PHE  28           HD2      PHE  28   4.143   5.051  -5.013
  222    HE1  PHE  28           HE1      PHE  28   6.282   2.698  -1.189
  223    HE2  PHE  28           HE2      PHE  28   6.544   4.421  -5.128
  224    HZ   PHE  28           HZ       PHE  28   7.618   3.248  -3.213
  225    H    GLU  29           H        GLU  29  -0.329   4.397  -4.607
  226    HA   GLU  29           HA       GLU  29  -2.129   5.559  -2.861
  227    HB2  GLU  29           HB2      GLU  29  -2.866   4.406  -5.585
  228    HB3  GLU  29           HB3      GLU  29  -3.585   5.771  -4.738
  229    HG2  GLU  29           HG2      GLU  29  -2.296   6.872  -6.282
  230    HG3  GLU  29           HG3      GLU  29  -1.169   6.835  -4.932
  231    H    ARG  30           H        ARG  30  -3.224   4.575  -1.213
  232    HA   ARG  30           HA       ARG  30  -3.797   1.813  -1.253
  233    HB2  ARG  30           HB2      ARG  30  -4.824   2.098   0.918
  234    HB3  ARG  30           HB3      ARG  30  -3.251   2.882   0.800
  235    HG2  ARG  30           HG2      ARG  30  -4.366   5.089   0.577
  236    HG3  ARG  30           HG3      ARG  30  -5.933   4.294   0.798
  237    HD2  ARG  30           HD2      ARG  30  -3.643   4.176   2.800
  238    HD3  ARG  30           HD3      ARG  30  -4.978   5.319   2.893
  239    HE   ARG  30           HE       ARG  30  -5.079   2.417   3.515
  240   HH11  ARG  30          HH11      ARG  30  -7.172   5.147   2.764
  241   HH12  ARG  30          HH12      ARG  30  -8.498   4.417   3.647
  242   HH21  ARG  30          HH21      ARG  30  -6.662   1.610   4.442
  243   HH22  ARG  30          HH22      ARG  30  -8.288   2.230   4.263
  244    HA   PRO  31           HA       PRO  31  -7.959   1.988  -3.018
  245    HB2  PRO  31           HB2      PRO  31  -8.317  -0.652  -3.487
  246    HB3  PRO  31           HB3      PRO  31  -7.300   0.384  -4.530
  247    HG2  PRO  31           HG2      PRO  31  -6.425  -1.575  -2.427
  248    HG3  PRO  31           HG3      PRO  31  -5.673  -1.214  -4.002
  249    HD2  PRO  31           HD2      PRO  31  -4.912  -0.153  -1.503
  250    HD3  PRO  31           HD3      PRO  31  -4.453   0.517  -3.089
  251    H    SER  32           H        SER  32  -8.271   2.760  -0.830
  252    HA   SER  32           HA       SER  32  -9.431   2.959   1.052
  253    HB2  SER  32           HB2      SER  32 -11.254   2.121  -0.412
  254    HB3  SER  32           HB3      SER  32 -10.984   0.491   0.246
  255    HG   SER  32           HG       SER  32 -11.182   1.632   2.370
  256    H    GLY  33           H        GLY  33  -7.596   0.039   0.899
  257    HA2  GLY  33           HA2      GLY  33  -7.875  -0.362   3.871
  258    HA3  GLY  33           HA3      GLY  33  -7.491  -1.613   2.702
  Start of MODEL    7
    1    H1   LYS   1           H1       LYS   1  -8.408   2.820  -3.805
    2    H2   LYS   1           H2       LYS   1  -8.725   1.815  -2.551
    3    H3   LYS   1           H3       LYS   1  -9.783   3.013  -2.927
    4    HA   LYS   1           HA       LYS   1 -10.640   0.884  -3.748
    5    HB2  LYS   1           HB2      LYS   1  -9.678   2.780  -5.930
    6    HB3  LYS   1           HB3      LYS   1 -10.900   1.542  -6.160
    7    HG2  LYS   1           HG2      LYS   1 -12.542   2.700  -5.093
    8    HG3  LYS   1           HG3      LYS   1 -11.486   3.410  -3.918
    9    HD2  LYS   1           HD2      LYS   1 -12.060   4.351  -6.724
   10    HD3  LYS   1           HD3      LYS   1 -12.341   5.190  -5.209
   11    HE2  LYS   1           HE2      LYS   1  -9.715   4.806  -6.687
   12    HE3  LYS   1           HE3      LYS   1 -10.578   6.304  -6.356
   13    HZ1  LYS   1           HZ1      LYS   1  -8.680   4.912  -4.732
   14    HZ2  LYS   1           HZ2      LYS   1  -9.182   6.454  -4.596
   15    HZ3  LYS   1           HZ3      LYS   1 -10.009   5.252  -3.847
   16    H    LEU   2           H        LEU   2  -9.348  -1.065  -3.466
   17    HA   LEU   2           HA       LEU   2  -6.984  -1.419  -5.154
   18    HB2  LEU   2           HB2      LEU   2  -8.458  -3.248  -3.231
   19    HB3  LEU   2           HB3      LEU   2  -7.185  -3.808  -4.295
   20    HG   LEU   2           HG       LEU   2  -6.936  -1.904  -1.975
   21   HD11  LEU   2          HD11      LEU   2  -6.822  -4.349  -1.557
   22   HD12  LEU   2          HD12      LEU   2  -5.521  -4.501  -2.751
   23   HD13  LEU   2          HD13      LEU   2  -5.248  -3.585  -1.264
   24   HD21  LEU   2          HD21      LEU   2  -4.836  -2.406  -4.120
   25   HD22  LEU   2          HD22      LEU   2  -5.552  -0.847  -3.655
   26   HD23  LEU   2          HD23      LEU   2  -4.514  -1.693  -2.525
   27    HA   PRO   3           HA       PRO   3  -9.448  -3.223  -8.513
   28    HB2  PRO   3           HB2      PRO   3  -6.774  -3.868  -9.666
   29    HB3  PRO   3           HB3      PRO   3  -8.120  -2.960 -10.400
   30    HG2  PRO   3           HG2      PRO   3  -5.848  -1.699  -9.552
   31    HG3  PRO   3           HG3      PRO   3  -7.469  -0.949  -9.408
   32    HD2  PRO   3           HD2      PRO   3  -5.877  -2.371  -7.269
   33    HD3  PRO   3           HD3      PRO   3  -6.792  -0.842  -7.188
   34    HA   PRO   4           HA       PRO   4  -9.130  -7.560  -7.539
   35    HB2  PRO   4           HB2      PRO   4  -9.226  -8.919  -9.951
   36    HB3  PRO   4           HB3      PRO   4 -10.635  -8.164  -9.144
   37    HG2  PRO   4           HG2      PRO   4  -8.908  -7.010 -11.349
   38    HG3  PRO   4           HG3      PRO   4 -10.698  -7.039 -11.242
   39    HD2  PRO   4           HD2      PRO   4  -9.286  -4.846 -10.559
   40    HD3  PRO   4           HD3      PRO   4 -10.711  -5.329  -9.595
   41    H    GLY   5           H        GLY   5  -7.575  -9.046  -7.073
   42    HA2  GLY   5           HA2      GLY   5  -5.583 -10.198  -7.182
   43    HA3  GLY   5           HA3      GLY   5  -5.162  -9.362  -8.675
   44    H    TRP   6           H        TRP   6  -5.933  -7.005  -6.217
   45    HA   TRP   6           HA       TRP   6  -3.040  -6.583  -5.768
   46    HB2  TRP   6           HB2      TRP   6  -5.467  -4.884  -5.296
   47    HB3  TRP   6           HB3      TRP   6  -3.857  -4.457  -4.727
   48    HD1  TRP   6           HD1      TRP   6  -5.412  -5.468  -8.135
   49    HE1  TRP   6           HE1      TRP   6  -4.368  -4.009  -9.988
   50    HE3  TRP   6           HE3      TRP   6  -2.208  -2.691  -5.285
   51    HZ2  TRP   6           HZ2      TRP   6  -2.353  -1.975 -10.209
   52    HZ3  TRP   6           HZ3      TRP   6  -0.783  -0.967  -6.325
   53    HH2  TRP   6           HH2      TRP   6  -0.812  -0.618  -8.789
   54    H    GLU   7           H        GLU   7  -2.136  -6.036  -3.745
   55    HA   GLU   7           HA       GLU   7  -3.208  -7.302  -1.300
   56    HB2  GLU   7           HB2      GLU   7  -1.368  -8.468  -3.241
   57    HB3  GLU   7           HB3      GLU   7  -0.452  -8.102  -1.797
   58    HG2  GLU   7           HG2      GLU   7  -3.100  -9.612  -1.694
   59    HG3  GLU   7           HG3      GLU   7  -1.553 -10.410  -2.004
   60    H    LYS   8           H        LYS   8  -1.632  -6.851   0.602
   61    HA   LYS   8           HA       LYS   8  -0.530  -4.096   0.311
   62    HB2  LYS   8           HB2      LYS   8  -1.037  -3.629   2.450
   63    HB3  LYS   8           HB3      LYS   8  -2.370  -4.685   2.025
   64    HG2  LYS   8           HG2      LYS   8   0.065  -5.427   3.707
   65    HG3  LYS   8           HG3      LYS   8  -1.521  -5.010   4.320
   66    HD2  LYS   8           HD2      LYS   8  -0.964  -7.436   2.574
   67    HD3  LYS   8           HD3      LYS   8  -1.038  -7.455   4.334
   68    HE2  LYS   8           HE2      LYS   8  -3.367  -6.820   4.352
   69    HE3  LYS   8           HE3      LYS   8  -3.344  -6.478   2.612
   70    HZ1  LYS   8           HZ1      LYS   8  -2.898  -9.167   3.754
   71    HZ2  LYS   8           HZ2      LYS   8  -4.304  -8.650   3.042
   72    HZ3  LYS   8           HZ3      LYS   8  -2.915  -8.751   2.158
   73    H    ARG   9           H        ARG   9   1.556  -3.546   0.724
   74    HA   ARG   9           HA       ARG   9   3.450  -5.597   1.783
   75    HB2  ARG   9           HB2      ARG   9   3.681  -4.212  -0.915
   76    HB3  ARG   9           HB3      ARG   9   4.989  -5.134  -0.172
   77    HG2  ARG   9           HG2      ARG   9   2.309  -6.259  -1.072
   78    HG3  ARG   9           HG3      ARG   9   3.826  -6.363  -1.958
   79    HD2  ARG   9           HD2      ARG   9   4.836  -7.775  -0.299
   80    HD3  ARG   9           HD3      ARG   9   3.485  -7.569   0.810
   81    HE   ARG   9           HE       ARG   9   3.475  -9.144  -1.727
   82   HH11  ARG   9          HH11      ARG   9   1.537  -8.172   1.102
   83   HH12  ARG   9          HH12      ARG   9   0.502  -9.587   0.869
   84   HH21  ARG   9          HH21      ARG   9   1.857 -10.860  -1.863
   85   HH22  ARG   9          HH22      ARG   9   0.589 -10.779  -0.617
   86    H    MET  10           H        MET  10   5.583  -4.753   2.280
   87    HA   MET  10           HA       MET  10   5.570  -1.860   2.981
   88    HB2  MET  10           HB2      MET  10   7.021  -4.203   4.258
   89    HB3  MET  10           HB3      MET  10   7.329  -2.501   4.636
   90    HG2  MET  10           HG2      MET  10   4.958  -2.209   5.274
   91    HG3  MET  10           HG3      MET  10   4.665  -3.927   5.002
   92    HE1  MET  10           HE1      MET  10   5.535  -5.858   6.520
   93    HE2  MET  10           HE2      MET  10   7.233  -5.384   6.262
   94    HE3  MET  10           HE3      MET  10   6.621  -5.639   7.909
   95    H    PHE  11           H        PHE  11   7.183  -0.569   2.312
   96    HA   PHE  11           HA       PHE  11   9.291  -1.606   0.506
   97    HB2  PHE  11           HB2      PHE  11   8.133   1.125   1.167
   98    HB3  PHE  11           HB3      PHE  11   9.711   0.990   0.443
   99    HD1  PHE  11           HD1      PHE  11   9.419  -1.142  -1.615
  100    HD2  PHE  11           HD2      PHE  11   6.777   2.084  -0.493
  101    HE1  PHE  11           HE1      PHE  11   8.446  -1.153  -3.878
  102    HE2  PHE  11           HE2      PHE  11   5.825   2.076  -2.797
  103    HZ   PHE  11           HZ       PHE  11   6.648   0.455  -4.476
  104    H    ALA  12           H        ALA  12  11.457  -1.342   0.962
  105    HA   ALA  12           HA       ALA  12  12.247  -1.737   3.609
  106    HB1  ALA  12           HB1      ALA  12  13.374  -2.634   1.607
  107    HB2  ALA  12           HB2      ALA  12  13.905  -0.994   1.161
  108    HB3  ALA  12           HB3      ALA  12  14.513  -1.758   2.645
  109    H    ASN  13           H        ASN  13  11.635   1.376   2.213
  110    HA   ASN  13           HA       ASN  13  13.500   2.833   3.940
  111    HB2  ASN  13           HB2      ASN  13  12.500   4.775   3.012
  112    HB3  ASN  13           HB3      ASN  13  12.574   3.640   1.666
  113   HD21  ASN  13          HD22      ASN  13  10.525   5.784   3.352
  114   HD22  ASN  13          HD21      ASN  13   8.994   5.058   2.895
  115    H    GLY  14           H        GLY  14  10.560   1.134   4.473
  116    HA2  GLY  14           HA2      GLY  14   9.318   1.020   6.460
  117    HA3  GLY  14           HA3      GLY  14   9.986   2.569   7.005
  118    H    THR  15           H        THR  15   8.054   1.334   4.140
  119    HA   THR  15           HA       THR  15   5.853   3.139   4.952
  120    HB   THR  15           HB       THR  15   7.283   3.351   2.270
  121    HG1  THR  15           HG1      THR  15   7.549   4.577   4.580
  122   HG21  THR  15          HG21      THR  15   5.661   5.179   1.765
  123   HG22  THR  15          HG22      THR  15   4.910   3.581   1.784
  124   HG23  THR  15          HG23      THR  15   4.693   4.683   3.169
  125    H    VAL  16           H        VAL  16   3.791   2.482   4.035
  126    HA   VAL  16           HA       VAL  16   3.818  -0.288   2.953
  127    HB   VAL  16           HB       VAL  16   1.826   1.307   4.535
  128   HG11  VAL  16          HG11      VAL  16   0.059  -0.369   4.081
  129   HG12  VAL  16          HG12      VAL  16   0.411   0.600   2.650
  130   HG13  VAL  16          HG13      VAL  16   1.039  -1.062   2.775
  131   HG21  VAL  16          HG21      VAL  16   2.702  -1.617   4.526
  132   HG22  VAL  16          HG22      VAL  16   3.411  -0.347   5.563
  133   HG23  VAL  16          HG23      VAL  16   1.716  -0.819   5.772
  134    H    TYR  17           H        TYR  17   2.930  -0.852   1.093
  135    HA   TYR  17           HA       TYR  17   1.528   1.106  -0.588
  136    HB2  TYR  17           HB2      TYR  17   2.930   0.893  -2.449
  137    HB3  TYR  17           HB3      TYR  17   4.025   1.180  -1.122
  138    HD1  TYR  17           HD1      TYR  17   5.354  -0.755  -0.123
  139    HD2  TYR  17           HD2      TYR  17   3.031  -1.178  -3.731
  140    HE1  TYR  17           HE1      TYR  17   6.649  -2.811  -0.743
  141    HE2  TYR  17           HE2      TYR  17   4.238  -3.241  -4.289
  142    HH   TYR  17           HH       TYR  17   6.056  -4.565  -3.772
  143    H    TYR  18           H        TYR  18   0.861  -0.244  -2.750
  144    HA   TYR  18           HA       TYR  18  -0.015  -2.914  -1.838
  145    HB2  TYR  18           HB2      TYR  18  -1.636  -0.810  -3.276
  146    HB3  TYR  18           HB3      TYR  18  -2.144  -2.481  -2.999
  147    HD1  TYR  18           HD1      TYR  18  -1.345   0.734  -1.317
  148    HD2  TYR  18           HD2      TYR  18  -2.831  -3.279  -0.796
  149    HE1  TYR  18           HE1      TYR  18  -1.857   1.235   1.064
  150    HE2  TYR  18           HE2      TYR  18  -3.361  -2.781   1.561
  151    HH   TYR  18           HH       TYR  18  -2.615   0.367   3.069
  152    H    PHE  19           H        PHE  19   0.018  -4.505  -3.189
  153    HA   PHE  19           HA       PHE  19   1.591  -4.271  -5.722
  154    HB2  PHE  19           HB2      PHE  19   2.908  -5.018  -3.844
  155    HB3  PHE  19           HB3      PHE  19   1.637  -6.076  -3.287
  156    HD1  PHE  19           HD1      PHE  19   4.374  -5.697  -5.739
  157    HD2  PHE  19           HD2      PHE  19   1.324  -8.321  -4.171
  158    HE1  PHE  19           HE1      PHE  19   5.482  -7.643  -6.814
  159    HE2  PHE  19           HE2      PHE  19   2.459 -10.254  -5.220
  160    HZ   PHE  19           HZ       PHE  19   4.488  -9.900  -6.621
  161    H    ASN  20           H        ASN  20   0.519  -5.051  -7.480
  162    HA   ASN  20           HA       ASN  20  -1.781  -6.787  -7.326
  163    HB2  ASN  20           HB2      ASN  20  -1.414  -5.112  -9.135
  164    HB3  ASN  20           HB3      ASN  20  -0.028  -6.048  -9.682
  165   HD21  ASN  20          HD22      ASN  20  -3.572  -6.134  -9.243
  166   HD22  ASN  20          HD21      ASN  20  -3.830  -7.475 -10.340
  167    H    HIS  21           H        HIS  21  -1.498  -8.817  -6.540
  168    HA   HIS  21           HA       HIS  21   1.016 -10.238  -6.842
  169    HB2  HIS  21           HB2      HIS  21  -0.050 -11.920  -5.429
  170    HB3  HIS  21           HB3      HIS  21  -0.192 -10.313  -4.758
  171    HD1  HIS  21           HD1      HIS  21  -2.594  -9.723  -3.924
  172    HD2  HIS  21           HD2      HIS  21  -2.474 -12.704  -6.900
  173    HE1  HIS  21           HE1      HIS  21  -4.973 -10.562  -4.200
  174    H    ILE  22           H        ILE  22  -1.108  -9.734  -9.222
  175    HA   ILE  22           HA       ILE  22  -0.744 -12.463 -10.374
  176    HB   ILE  22           HB       ILE  22  -2.540 -10.188 -11.299
  177   HG12  ILE  22          HG12      ILE  22  -3.227 -12.755  -9.795
  178   HG13  ILE  22          HG13      ILE  22  -3.308 -11.122  -9.140
  179   HG21  ILE  22          HG21      ILE  22  -2.346 -13.079 -12.255
  180   HG22  ILE  22          HG22      ILE  22  -3.539 -11.882 -12.811
  181   HG23  ILE  22          HG23      ILE  22  -1.850 -11.641 -13.173
  182   HD11  ILE  22          HD11      ILE  22  -5.527 -11.759  -9.637
  183   HD12  ILE  22          HD12      ILE  22  -5.057 -10.553 -10.853
  184   HD13  ILE  22          HD13      ILE  22  -5.116 -12.285 -11.271
  185    H    THR  23           H        THR  23   0.419  -9.166 -10.517
  186    HA   THR  23           HA       THR  23   2.026  -9.801 -12.981
  187    HB   THR  23           HB       THR  23   1.570  -7.530 -13.788
  188    HG1  THR  23           HG1      THR  23  -0.330  -7.396 -11.690
  189   HG21  THR  23          HG21      THR  23  -1.076  -8.923 -13.201
  190   HG22  THR  23          HG22      THR  23  -0.732  -7.743 -14.480
  191   HG23  THR  23          HG23      THR  23   0.030  -9.345 -14.525
  192    H    ASN  24           H        ASN  24   2.124  -8.374  -9.800
  193    HA   ASN  24           HA       ASN  24   3.660  -7.429  -8.596
  194    HB2  ASN  24           HB2      ASN  24   5.609  -7.199 -10.910
  195    HB3  ASN  24           HB3      ASN  24   5.949  -7.040  -9.200
  196   HD21  ASN  24          HD22      ASN  24   5.187  -9.307 -11.766
  197   HD22  ASN  24          HD21      ASN  24   5.773 -10.736 -10.885
  198    H    ALA  25           H        ALA  25   2.001  -5.915 -11.098
  199    HA   ALA  25           HA       ALA  25   3.089  -3.310 -11.155
  200    HB1  ALA  25           HB1      ALA  25   0.796  -2.611 -11.737
  201    HB2  ALA  25           HB2      ALA  25   1.237  -4.099 -12.599
  202    HB3  ALA  25           HB3      ALA  25   0.160  -4.173 -11.189
  203    H    SER  26           H        SER  26   3.204  -1.640  -9.624
  204    HA   SER  26           HA       SER  26   1.896  -2.155  -6.985
  205    HB2  SER  26           HB2      SER  26   4.820  -1.588  -7.586
  206    HB3  SER  26           HB3      SER  26   4.094  -1.583  -5.973
  207    HG   SER  26           HG       SER  26   4.226  -3.828  -7.776
  208    H    GLN  27           H        GLN  27   1.294  -0.417  -5.783
  209    HA   GLN  27           HA       GLN  27   2.107   2.298  -6.451
  210    HB2  GLN  27           HB2      GLN  27   0.415   1.690  -8.229
  211    HB3  GLN  27           HB3      GLN  27  -0.777   1.405  -6.969
  212    HG2  GLN  27           HG2      GLN  27  -0.983   3.586  -8.192
  213    HG3  GLN  27           HG3      GLN  27  -0.894   3.753  -6.451
  214   HE21  GLN  27          HE22      GLN  27   0.918   4.321  -9.514
  215   HE22  GLN  27          HE21      GLN  27   2.106   5.328  -8.705
  216    H    PHE  28           H        PHE  28   1.080   3.901  -4.987
  217    HA   PHE  28           HA       PHE  28   0.558   2.907  -2.297
  218    HB2  PHE  28           HB2      PHE  28   0.572   5.704  -3.480
  219    HB3  PHE  28           HB3      PHE  28   0.493   5.320  -1.762
  220    HD1  PHE  28           HD1      PHE  28   2.390   3.612  -0.908
  221    HD2  PHE  28           HD2      PHE  28   2.709   6.131  -4.391
  222    HE1  PHE  28           HE1      PHE  28   4.847   3.572  -0.703
  223    HE2  PHE  28           HE2      PHE  28   5.191   6.061  -4.206
  224    HZ   PHE  28           HZ       PHE  28   6.265   4.798  -2.351
  225    H    GLU  29           H        GLU  29  -1.477   2.803  -4.781
  226    HA   GLU  29           HA       GLU  29  -3.888   4.034  -3.789
  227    HB2  GLU  29           HB2      GLU  29  -3.583   3.526  -6.160
  228    HB3  GLU  29           HB3      GLU  29  -3.529   1.803  -5.798
  229    HG2  GLU  29           HG2      GLU  29  -5.740   2.480  -6.637
  230    HG3  GLU  29           HG3      GLU  29  -5.836   1.843  -4.998
  231    H    ARG  30           H        ARG  30  -4.785   3.504  -1.925
  232    HA   ARG  30           HA       ARG  30  -4.304   0.881  -0.736
  233    HB2  ARG  30           HB2      ARG  30  -4.602   1.926   1.345
  234    HB3  ARG  30           HB3      ARG  30  -3.694   3.066   0.385
  235    HG2  ARG  30           HG2      ARG  30  -6.618   3.208   1.199
  236    HG3  ARG  30           HG3      ARG  30  -5.305   4.234   1.738
  237    HD2  ARG  30           HD2      ARG  30  -6.663   4.232  -0.970
  238    HD3  ARG  30           HD3      ARG  30  -6.688   5.502   0.253
  239    HE   ARG  30           HE       ARG  30  -4.000   5.271  -0.345
  240   HH11  ARG  30          HH12      ARG  30  -6.855   6.035  -2.342
  241   HH12  ARG  30          HH11      ARG  30  -5.816   5.997  -3.752
  242   HH21  ARG  30          HH21      ARG  30  -2.852   5.719  -2.224
  243   HH22  ARG  30          HH22      ARG  30  -3.709   6.588  -3.500
  244    HA   PRO  31           HA       PRO  31  -8.509  -0.665  -0.816
  245    HB2  PRO  31           HB2      PRO  31  -8.291  -0.979   2.172
  246    HB3  PRO  31           HB3      PRO  31  -8.878  -2.134   0.944
  247    HG2  PRO  31           HG2      PRO  31  -6.350  -2.343   1.979
  248    HG3  PRO  31           HG3      PRO  31  -6.680  -2.634   0.261
  249    HD2  PRO  31           HD2      PRO  31  -5.529  -0.178   1.570
  250    HD3  PRO  31           HD3      PRO  31  -5.071  -0.978   0.030
  251    H    SER  32           H        SER  32  -8.335   0.819   2.122
  252    HA   SER  32           HA       SER  32 -10.817   2.253   2.147
  253    HB2  SER  32           HB2      SER  32  -8.444   2.603   4.022
  254    HB3  SER  32           HB3      SER  32 -10.127   3.080   4.335
  255    HG   SER  32           HG       SER  32  -9.688   1.061   5.260
  256    H    GLY  33           H        GLY  33 -10.332   3.383   0.012
  257    HA2  GLY  33           HA2      GLY  33 -10.718   5.967  -0.022
  258    HA3  GLY  33           HA3      GLY  33  -8.991   6.028   0.357
  Start of MODEL    8
    1    H1   LYS   1           H1       LYS   1 -11.240   0.280  -2.210
    2    H2   LYS   1           H2       LYS   1 -11.962  -0.272  -3.619
    3    H3   LYS   1           H3       LYS   1 -12.192   1.269  -3.077
    4    HA   LYS   1           HA       LYS   1 -10.828   1.627  -4.748
    5    HB2  LYS   1           HB2      LYS   1 -10.090   2.440  -2.344
    6    HB3  LYS   1           HB3      LYS   1  -8.669   1.458  -2.667
    7    HG2  LYS   1           HG2      LYS   1  -8.437   2.659  -4.889
    8    HG3  LYS   1           HG3      LYS   1  -9.803   3.692  -4.434
    9    HD2  LYS   1           HD2      LYS   1  -7.182   3.419  -2.924
   10    HD3  LYS   1           HD3      LYS   1  -7.588   4.753  -4.010
   11    HE2  LYS   1           HE2      LYS   1  -9.214   5.650  -2.559
   12    HE3  LYS   1           HE3      LYS   1  -9.400   4.156  -1.658
   13    HZ1  LYS   1           HZ1      LYS   1  -7.179   4.405  -0.791
   14    HZ2  LYS   1           HZ2      LYS   1  -6.912   5.771  -1.635
   15    HZ3  LYS   1           HZ3      LYS   1  -8.062   5.768  -0.426
   16    H    LEU   2           H        LEU   2  -8.767  -0.784  -2.911
   17    HA   LEU   2           HA       LEU   2  -7.105  -1.332  -5.047
   18    HB2  LEU   2           HB2      LEU   2  -7.964  -3.133  -2.762
   19    HB3  LEU   2           HB3      LEU   2  -6.661  -3.488  -3.866
   20    HG   LEU   2           HG       LEU   2  -6.742  -1.342  -1.730
   21   HD11  LEU   2          HD11      LEU   2  -6.075  -3.701  -1.202
   22   HD12  LEU   2          HD12      LEU   2  -4.756  -3.552  -2.381
   23   HD13  LEU   2          HD13      LEU   2  -4.782  -2.518  -0.946
   24   HD21  LEU   2          HD21      LEU   2  -4.460  -0.662  -2.459
   25   HD22  LEU   2          HD22      LEU   2  -4.675  -1.587  -3.958
   26   HD23  LEU   2          HD23      LEU   2  -5.705  -0.178  -3.610
   27    HA   PRO   3           HA       PRO   3  -9.872  -3.805  -7.689
   28    HB2  PRO   3           HB2      PRO   3  -7.433  -4.072  -9.398
   29    HB3  PRO   3           HB3      PRO   3  -9.064  -3.506  -9.839
   30    HG2  PRO   3           HG2      PRO   3  -6.967  -1.773  -9.579
   31    HG3  PRO   3           HG3      PRO   3  -8.636  -1.331  -9.095
   32    HD2  PRO   3           HD2      PRO   3  -6.353  -2.220  -7.332
   33    HD3  PRO   3           HD3      PRO   3  -7.545  -0.917  -7.092
   34    HA   PRO   4           HA       PRO   4  -8.886  -8.126  -7.051
   35    HB2  PRO   4           HB2      PRO   4  -8.540  -8.427 -10.043
   36    HB3  PRO   4           HB3      PRO   4  -9.389  -9.509  -8.892
   37    HG2  PRO   4           HG2      PRO   4 -10.813  -7.763 -10.381
   38    HG3  PRO   4           HG3      PRO   4 -11.184  -7.936  -8.633
   39    HD2  PRO   4           HD2      PRO   4  -9.550  -5.800 -10.012
   40    HD3  PRO   4           HD3      PRO   4 -10.783  -5.621  -8.725
   41    H    GLY   5           H        GLY   5  -7.087  -8.964  -6.238
   42    HA2  GLY   5           HA2      GLY   5  -5.022  -9.975  -6.234
   43    HA3  GLY   5           HA3      GLY   5  -4.668  -9.286  -7.820
   44    H    TRP   6           H        TRP   6  -5.522  -6.564  -6.189
   45    HA   TRP   6           HA       TRP   6  -2.755  -5.772  -5.683
   46    HB2  TRP   6           HB2      TRP   6  -5.432  -4.393  -5.424
   47    HB3  TRP   6           HB3      TRP   6  -3.897  -3.639  -4.996
   48    HD1  TRP   6           HD1      TRP   6  -5.815  -4.932  -8.052
   49    HE1  TRP   6           HE1      TRP   6  -4.848  -3.875 -10.186
   50    HE3  TRP   6           HE3      TRP   6  -1.733  -2.657  -6.013
   51    HZ2  TRP   6           HZ2      TRP   6  -2.505  -2.367 -10.930
   52    HZ3  TRP   6           HZ3      TRP   6  -0.116  -1.521  -7.452
   53    HH2  TRP   6           HH2      TRP   6  -0.445  -1.365  -9.907
   54    H    GLU   7           H        GLU   7  -1.682  -6.302  -3.892
   55    HA   GLU   7           HA       GLU   7  -3.149  -6.586  -1.313
   56    HB2  GLU   7           HB2      GLU   7  -2.719  -8.645  -2.812
   57    HB3  GLU   7           HB3      GLU   7  -1.013  -8.385  -2.487
   58    HG2  GLU   7           HG2      GLU   7  -2.312  -8.413   0.056
   59    HG3  GLU   7           HG3      GLU   7  -3.110  -9.674  -0.883
   60    H    LYS   8           H        LYS   8  -1.995  -6.057   0.570
   61    HA   LYS   8           HA       LYS   8  -0.098  -4.047   0.374
   62    HB2  LYS   8           HB2      LYS   8  -0.266  -3.817   2.662
   63    HB3  LYS   8           HB3      LYS   8  -1.836  -4.429   2.184
   64    HG2  LYS   8           HG2      LYS   8   0.401  -6.063   3.467
   65    HG3  LYS   8           HG3      LYS   8  -0.944  -5.360   4.320
   66    HD2  LYS   8           HD2      LYS   8  -2.470  -6.912   3.635
   67    HD3  LYS   8           HD3      LYS   8  -1.692  -7.247   2.094
   68    HE2  LYS   8           HE2      LYS   8  -0.413  -8.034   4.720
   69    HE3  LYS   8           HE3      LYS   8  -1.572  -9.081   3.883
   70    HZ1  LYS   8           HZ1      LYS   8  -0.164  -9.267   2.023
   71    HZ2  LYS   8           HZ2      LYS   8   0.793  -8.023   2.464
   72    HZ3  LYS   8           HZ3      LYS   8   0.841  -9.461   3.307
   73    H    ARG   9           H        ARG   9   1.975  -3.784   0.677
   74    HA   ARG   9           HA       ARG   9   3.821  -5.977   1.543
   75    HB2  ARG   9           HB2      ARG   9   4.064  -4.211  -0.929
   76    HB3  ARG   9           HB3      ARG   9   5.390  -5.190  -0.301
   77    HG2  ARG   9           HG2      ARG   9   2.759  -6.307  -1.335
   78    HG3  ARG   9           HG3      ARG   9   4.244  -6.132  -2.280
   79    HD2  ARG   9           HD2      ARG   9   5.440  -7.703  -0.941
   80    HD3  ARG   9           HD3      ARG   9   4.135  -7.809   0.242
   81    HE   ARG   9           HE       ARG   9   4.223  -9.054  -2.439
   82   HH11  ARG   9          HH11      ARG   9   2.034  -8.141   0.196
   83   HH12  ARG   9          HH12      ARG   9   1.021  -9.543  -0.076
   84   HH21  ARG   9          HH21      ARG   9   2.592 -10.673  -2.879
   85   HH22  ARG   9          HH22      ARG   9   1.132 -10.606  -1.880
   86    H    MET  10           H        MET  10   5.807  -5.225   2.442
   87    HA   MET  10           HA       MET  10   5.742  -2.510   3.562
   88    HB2  MET  10           HB2      MET  10   6.435  -4.559   4.880
   89    HB3  MET  10           HB3      MET  10   7.849  -4.685   3.819
   90    HG2  MET  10           HG2      MET  10   8.492  -3.585   5.867
   91    HG3  MET  10           HG3      MET  10   8.580  -2.425   4.548
   92    HE1  MET  10           HE1      MET  10   7.613   0.041   7.313
   93    HE2  MET  10           HE2      MET  10   8.806  -1.280   7.345
   94    HE3  MET  10           HE3      MET  10   8.618  -0.284   5.881
   95    H    PHE  11           H        PHE  11   6.982  -0.838   2.926
   96    HA   PHE  11           HA       PHE  11   8.874  -1.139   0.655
   97    HB2  PHE  11           HB2      PHE  11   6.913   0.503   0.504
   98    HB3  PHE  11           HB3      PHE  11   7.678   1.410   1.786
   99    HD1  PHE  11           HD1      PHE  11   8.437  -0.099  -1.584
  100    HD2  PHE  11           HD2      PHE  11   9.164   3.150   1.164
  101    HE1  PHE  11           HE1      PHE  11   9.822   1.044  -3.293
  102    HE2  PHE  11           HE2      PHE  11  10.523   4.300  -0.568
  103    HZ   PHE  11           HZ       PHE  11  10.869   3.243  -2.786
  104    H    ALA  12           H        ALA  12  10.953  -1.292   1.250
  105    HA   ALA  12           HA       ALA  12  11.828  -1.314   3.858
  106    HB1  ALA  12           HB1      ALA  12  14.065  -1.558   2.864
  107    HB2  ALA  12           HB2      ALA  12  12.861  -2.499   1.965
  108    HB3  ALA  12           HB3      ALA  12  13.457  -0.954   1.309
  109    H    ASN  13           H        ASN  13  11.539   1.611   1.956
  110    HA   ASN  13           HA       ASN  13  13.435   3.156   3.521
  111    HB2  ASN  13           HB2      ASN  13  12.393   3.532   1.100
  112    HB3  ASN  13           HB3      ASN  13  11.135   4.381   2.007
  113   HD21  ASN  13          HD22      ASN  13  12.540   5.787   3.950
  114   HD22  ASN  13          HD21      ASN  13  13.669   6.866   3.106
  115    H    GLY  14           H        GLY  14  10.456   1.787   4.413
  116    HA2  GLY  14           HA2      GLY  14   9.580   2.025   6.617
  117    HA3  GLY  14           HA3      GLY  14  10.139   3.701   6.687
  118    H    THR  15           H        THR  15   7.995   1.652   4.589
  119    HA   THR  15           HA       THR  15   5.658   3.325   5.006
  120    HB   THR  15           HB       THR  15   7.324   3.524   2.481
  121    HG1  THR  15           HG1      THR  15   7.197   5.003   4.433
  122   HG21  THR  15          HG21      THR  15   4.368   4.227   2.644
  123   HG22  THR  15          HG22      THR  15   5.496   4.810   1.406
  124   HG23  THR  15          HG23      THR  15   5.146   3.086   1.507
  125    H    VAL  16           H        VAL  16   3.813   2.370   3.507
  126    HA   VAL  16           HA       VAL  16   4.348  -0.473   2.808
  127    HB   VAL  16           HB       VAL  16   2.095   0.677   4.437
  128   HG11  VAL  16          HG11      VAL  16   1.763  -1.817   2.712
  129   HG12  VAL  16          HG12      VAL  16   0.672  -1.277   4.001
  130   HG13  VAL  16          HG13      VAL  16   0.853  -0.303   2.543
  131   HG21  VAL  16          HG21      VAL  16   3.994  -0.617   5.443
  132   HG22  VAL  16          HG22      VAL  16   2.432  -1.423   5.671
  133   HG23  VAL  16          HG23      VAL  16   3.550  -2.002   4.417
  134    H    TYR  17           H        TYR  17   3.425  -1.214   0.966
  135    HA   TYR  17           HA       TYR  17   1.944   0.701  -0.743
  136    HB2  TYR  17           HB2      TYR  17   3.368   0.509  -2.574
  137    HB3  TYR  17           HB3      TYR  17   4.447   0.753  -1.230
  138    HD1  TYR  17           HD1      TYR  17   5.778  -1.149  -0.298
  139    HD2  TYR  17           HD2      TYR  17   3.411  -1.590  -3.883
  140    HE1  TYR  17           HE1      TYR  17   7.156  -3.088  -0.956
  141    HE2  TYR  17           HE2      TYR  17   4.786  -3.558  -4.523
  142    HH   TYR  17           HH       TYR  17   7.569  -4.659  -2.603
  143    H    TYR  18           H        TYR  18   1.338  -0.619  -2.876
  144    HA   TYR  18           HA       TYR  18   0.147  -3.185  -1.986
  145    HB2  TYR  18           HB2      TYR  18  -1.198  -0.870  -3.427
  146    HB3  TYR  18           HB3      TYR  18  -1.938  -2.433  -3.060
  147    HD1  TYR  18           HD1      TYR  18  -0.652   0.727  -1.612
  148    HD2  TYR  18           HD2      TYR  18  -2.575  -3.038  -0.745
  149    HE1  TYR  18           HE1      TYR  18  -0.871   1.387   0.768
  150    HE2  TYR  18           HE2      TYR  18  -2.900  -2.334   1.588
  151    HH   TYR  18           HH       TYR  18  -1.484   0.671   2.893
  152    H    PHE  19           H        PHE  19   0.646  -4.790  -3.204
  153    HA   PHE  19           HA       PHE  19   1.876  -4.431  -5.881
  154    HB2  PHE  19           HB2      PHE  19   3.337  -5.262  -4.146
  155    HB3  PHE  19           HB3      PHE  19   2.131  -6.418  -3.600
  156    HD1  PHE  19           HD1      PHE  19   4.700  -5.728  -6.175
  157    HD2  PHE  19           HD2      PHE  19   1.791  -8.549  -4.692
  158    HE1  PHE  19           HE1      PHE  19   5.705  -7.499  -7.579
  159    HE2  PHE  19           HE2      PHE  19   2.874 -10.345  -6.041
  160    HZ   PHE  19           HZ       PHE  19   4.775  -9.807  -7.528
  161    H    ASN  20           H        ASN  20   0.829  -5.341  -7.610
  162    HA   ASN  20           HA       ASN  20  -1.629  -6.869  -7.124
  163    HB2  ASN  20           HB2      ASN  20  -1.517  -5.136  -8.889
  164    HB3  ASN  20           HB3      ASN  20  -0.308  -6.103  -9.729
  165   HD21  ASN  20          HD22      ASN  20  -3.705  -5.938  -8.722
  166   HD22  ASN  20          HD21      ASN  20  -4.284  -7.304  -9.620
  167    H    HIS  21           H        HIS  21  -1.178  -8.909  -6.316
  168    HA   HIS  21           HA       HIS  21   1.087 -10.412  -7.293
  169    HB2  HIS  21           HB2      HIS  21   0.358 -12.162  -5.766
  170    HB3  HIS  21           HB3      HIS  21   0.457 -10.589  -5.006
  171    HD1  HIS  21           HD1      HIS  21  -1.248 -10.972  -3.040
  172    HD2  HIS  21           HD2      HIS  21  -2.696 -11.985  -6.891
  173    HE1  HIS  21           HE1      HIS  21  -3.733 -11.449  -2.811
  174    H    ILE  22           H        ILE  22  -1.478  -9.801  -9.155
  175    HA   ILE  22           HA       ILE  22  -1.442 -12.500 -10.430
  176    HB   ILE  22           HB       ILE  22  -3.240 -10.109 -10.966
  177   HG12  ILE  22          HG12      ILE  22  -3.775 -11.017  -8.773
  178   HG13  ILE  22          HG13      ILE  22  -5.054 -11.340  -9.920
  179   HG21  ILE  22          HG21      ILE  22  -3.286 -12.927 -12.102
  180   HG22  ILE  22          HG22      ILE  22  -4.641 -11.781 -12.225
  181   HG23  ILE  22          HG23      ILE  22  -3.097 -11.400 -12.981
  182   HD11  ILE  22          HD11      ILE  22  -2.985 -13.374  -8.966
  183   HD12  ILE  22          HD12      ILE  22  -4.668 -13.248  -8.429
  184   HD13  ILE  22          HD13      ILE  22  -4.316 -13.703 -10.104
  185    H    THR  23           H        THR  23  -0.128  -9.281 -10.659
  186    HA   THR  23           HA       THR  23   0.918  -9.862 -13.423
  187    HB   THR  23           HB       THR  23   0.594  -7.476 -13.941
  188    HG1  THR  23           HG1      THR  23  -0.926  -7.394 -11.559
  189   HG21  THR  23          HG21      THR  23  -2.028  -8.733 -13.020
  190   HG22  THR  23          HG22      THR  23  -1.817  -7.424 -14.203
  191   HG23  THR  23          HG23      THR  23  -1.215  -9.054 -14.566
  192    H    ASN  24           H        ASN  24   1.732  -8.667 -10.237
  193    HA   ASN  24           HA       ASN  24   3.568  -7.974  -9.289
  194    HB2  ASN  24           HB2      ASN  24   5.138  -7.930 -11.880
  195    HB3  ASN  24           HB3      ASN  24   5.752  -7.929 -10.239
  196   HD21  ASN  24          HD22      ASN  24   4.288  -9.892 -12.745
  197   HD22  ASN  24          HD21      ASN  24   4.754 -11.442 -12.013
  198    H    ALA  25           H        ALA  25   1.608  -6.172 -11.185
  199    HA   ALA  25           HA       ALA  25   3.052  -3.696 -11.348
  200    HB1  ALA  25           HB1      ALA  25   0.844  -2.690 -11.572
  201    HB2  ALA  25           HB2      ALA  25   0.909  -4.187 -12.516
  202    HB3  ALA  25           HB3      ALA  25   0.066  -4.161 -10.953
  203    H    SER  26           H        SER  26   2.595  -1.687  -9.877
  204    HA   SER  26           HA       SER  26   1.951  -2.331  -7.087
  205    HB2  SER  26           HB2      SER  26   4.771  -1.715  -7.989
  206    HB3  SER  26           HB3      SER  26   4.207  -1.470  -6.318
  207    HG   SER  26           HG       SER  26   3.554  -3.895  -7.538
  208    H    GLN  27           H        GLN  27   1.404  -0.627  -5.847
  209    HA   GLN  27           HA       GLN  27   1.790   2.173  -6.771
  210    HB2  GLN  27           HB2      GLN  27  -0.870   0.791  -6.166
  211    HB3  GLN  27           HB3      GLN  27  -0.666   2.542  -6.198
  212    HG2  GLN  27           HG2      GLN  27  -0.019   2.471  -8.568
  213    HG3  GLN  27           HG3      GLN  27  -0.208   0.717  -8.588
  214   HE21  GLN  27          HE22      GLN  27  -2.422  -0.204  -8.621
  215   HE22  GLN  27          HE21      GLN  27  -3.760   0.928  -8.808
  216    H    PHE  28           H        PHE  28   1.574   3.719  -5.054
  217    HA   PHE  28           HA       PHE  28   1.680   2.686  -2.287
  218    HB2  PHE  28           HB2      PHE  28   2.095   5.450  -3.473
  219    HB3  PHE  28           HB3      PHE  28   2.229   5.058  -1.762
  220    HD1  PHE  28           HD1      PHE  28   3.873   3.228  -1.030
  221    HD2  PHE  28           HD2      PHE  28   3.988   5.099  -4.908
  222    HE1  PHE  28           HE1      PHE  28   6.241   2.537  -1.290
  223    HE2  PHE  28           HE2      PHE  28   6.361   4.391  -5.177
  224    HZ   PHE  28           HZ       PHE  28   7.491   3.118  -3.360
  225    H    GLU  29           H        GLU  29  -0.856   3.225  -4.266
  226    HA   GLU  29           HA       GLU  29  -2.416   4.917  -2.504
  227    HB2  GLU  29           HB2      GLU  29  -2.560   5.181  -4.932
  228    HB3  GLU  29           HB3      GLU  29  -3.322   3.593  -5.052
  229    HG2  GLU  29           HG2      GLU  29  -4.944   5.517  -5.073
  230    HG3  GLU  29           HG3      GLU  29  -5.231   4.329  -3.805
  231    H    ARG  30           H        ARG  30  -3.267   4.261  -0.748
  232    HA   ARG  30           HA       ARG  30  -3.490   1.470  -0.144
  233    HB2  ARG  30           HB2      ARG  30  -3.674   2.233   2.160
  234    HB3  ARG  30           HB3      ARG  30  -2.427   3.132   1.334
  235    HG2  ARG  30           HG2      ARG  30  -4.820   4.677   1.025
  236    HG3  ARG  30           HG3      ARG  30  -4.857   4.051   2.663
  237    HD2  ARG  30           HD2      ARG  30  -3.769   6.224   2.681
  238    HD3  ARG  30           HD3      ARG  30  -2.587   4.980   3.087
  239    HE   ARG  30           HE       ARG  30  -1.364   5.565   1.208
  240   HH11  ARG  30          HH21      ARG  30  -4.578   6.909   0.674
  241   HH12  ARG  30          HH22      ARG  30  -4.247   7.125  -1.039
  242   HH21  ARG  30          HH11      ARG  30  -1.039   6.064  -0.975
  243   HH22  ARG  30          HH12      ARG  30  -2.326   6.989  -1.774
  244    HA   PRO  31           HA       PRO  31  -7.788   0.415  -0.162
  245    HB2  PRO  31           HB2      PRO  31  -7.392  -0.120   2.796
  246    HB3  PRO  31           HB3      PRO  31  -8.269  -1.115   1.588
  247    HG2  PRO  31           HG2      PRO  31  -5.725  -1.769   2.288
  248    HG3  PRO  31           HG3      PRO  31  -6.232  -1.812   0.579
  249    HD2  PRO  31           HD2      PRO  31  -4.638   0.279   2.025
  250    HD3  PRO  31           HD3      PRO  31  -4.463  -0.348   0.351
  251    H    SER  32           H        SER  32  -9.848   0.664   0.934
  252    HA   SER  32           HA       SER  32 -11.369   1.944   2.370
  253    HB2  SER  32           HB2      SER  32  -9.813   3.824   2.830
  254    HB3  SER  32           HB3      SER  32 -10.005   4.370   1.145
  255    HG   SER  32           HG       SER  32 -11.404   5.361   2.784
  256    H    GLY  33           H        GLY  33 -12.695   3.923   0.845
  257    HA2  GLY  33           HA2      GLY  33 -14.051   2.540  -1.290
  258    HA3  GLY  33           HA3      GLY  33 -14.070   4.287  -0.986
  Start of MODEL    9
    1    H1   LYS   1           H1       LYS   1  -7.836   2.571  -2.280
    2    H2   LYS   1           H2       LYS   1  -8.873   3.541  -3.095
    3    H3   LYS   1           H3       LYS   1  -7.586   2.877  -3.872
    4    HA   LYS   1           HA       LYS   1  -9.804   1.330  -2.721
    5    HB2  LYS   1           HB2      LYS   1 -10.571   0.939  -5.069
    6    HB3  LYS   1           HB3      LYS   1 -10.789   2.556  -4.452
    7    HG2  LYS   1           HG2      LYS   1 -10.160   2.816  -6.681
    8    HG3  LYS   1           HG3      LYS   1  -8.771   3.310  -5.750
    9    HD2  LYS   1           HD2      LYS   1  -7.779   0.953  -6.268
   10    HD3  LYS   1           HD3      LYS   1  -9.183   0.722  -7.315
   11    HE2  LYS   1           HE2      LYS   1  -7.615   1.522  -8.833
   12    HE3  LYS   1           HE3      LYS   1  -8.437   3.020  -8.362
   13    HZ1  LYS   1           HZ1      LYS   1  -6.581   3.224  -6.629
   14    HZ2  LYS   1           HZ2      LYS   1  -5.798   2.024  -7.410
   15    HZ3  LYS   1           HZ3      LYS   1  -6.123   3.471  -8.155
   16    H    LEU   2           H        LEU   2  -9.899  -0.985  -3.687
   17    HA   LEU   2           HA       LEU   2  -7.200  -1.917  -4.470
   18    HB2  LEU   2           HB2      LEU   2  -7.680  -2.044  -1.954
   19    HB3  LEU   2           HB3      LEU   2  -8.888  -3.260  -2.331
   20    HG   LEU   2           HG       LEU   2  -7.025  -4.644  -3.382
   21   HD11  LEU   2          HD11      LEU   2  -5.246  -2.496  -2.155
   22   HD12  LEU   2          HD12      LEU   2  -4.730  -4.060  -2.821
   23   HD13  LEU   2          HD13      LEU   2  -5.415  -2.844  -3.884
   24   HD21  LEU   2          HD21      LEU   2  -6.627  -3.917  -0.466
   25   HD22  LEU   2          HD22      LEU   2  -7.808  -5.077  -1.108
   26   HD23  LEU   2          HD23      LEU   2  -6.078  -5.391  -1.286
   27    HA   PRO   3           HA       PRO   3 -10.014  -4.395  -7.045
   28    HB2  PRO   3           HB2      PRO   3  -7.699  -4.749  -8.854
   29    HB3  PRO   3           HB3      PRO   3  -9.294  -4.039  -9.192
   30    HG2  PRO   3           HG2      PRO   3  -7.007  -2.510  -9.030
   31    HG3  PRO   3           HG3      PRO   3  -8.618  -1.909  -8.528
   32    HD2  PRO   3           HD2      PRO   3  -6.414  -3.017  -6.771
   33    HD3  PRO   3           HD3      PRO   3  -7.425  -1.564  -6.560
   34    HA   PRO   4           HA       PRO   4  -8.816  -8.656  -6.241
   35    HB2  PRO   4           HB2      PRO   4  -8.894  -9.150  -9.223
   36    HB3  PRO   4           HB3      PRO   4  -9.608 -10.125  -7.900
   37    HG2  PRO   4           HG2      PRO   4 -11.172  -8.468  -9.357
   38    HG3  PRO   4           HG3      PRO   4 -11.358  -8.525  -7.573
   39    HD2  PRO   4           HD2      PRO   4  -9.861  -6.493  -9.243
   40    HD3  PRO   4           HD3      PRO   4 -10.970  -6.226  -7.862
   41    H    GLY   5           H        GLY   5  -6.936  -9.791  -5.937
   42    HA2  GLY   5           HA2      GLY   5  -4.828 -10.634  -6.277
   43    HA3  GLY   5           HA3      GLY   5  -4.770  -9.854  -7.859
   44    H    TRP   6           H        TRP   6  -5.502  -7.319  -5.831
   45    HA   TRP   6           HA       TRP   6  -2.691  -6.469  -5.601
   46    HB2  TRP   6           HB2      TRP   6  -5.331  -5.084  -5.094
   47    HB3  TRP   6           HB3      TRP   6  -3.739  -4.363  -4.859
   48    HD1  TRP   6           HD1      TRP   6  -5.948  -5.667  -7.715
   49    HE1  TRP   6           HE1      TRP   6  -5.260  -4.472  -9.893
   50    HE3  TRP   6           HE3      TRP   6  -1.789  -3.296  -6.001
   51    HZ2  TRP   6           HZ2      TRP   6  -3.149  -2.686 -10.762
   52    HZ3  TRP   6           HZ3      TRP   6  -0.427  -1.948  -7.521
   53    HH2  TRP   6           HH2      TRP   6  -1.072  -1.572  -9.860
   54    H    GLU   7           H        GLU   7  -1.518  -6.833  -3.858
   55    HA   GLU   7           HA       GLU   7  -2.849  -7.514  -1.278
   56    HB2  GLU   7           HB2      GLU   7  -1.941  -9.324  -2.804
   57    HB3  GLU   7           HB3      GLU   7  -0.348  -8.599  -2.611
   58    HG2  GLU   7           HG2      GLU   7  -1.124  -8.976   0.019
   59    HG3  GLU   7           HG3      GLU   7  -1.930 -10.328  -0.773
   60    H    LYS   8           H        LYS   8  -2.036  -6.611   0.583
   61    HA   LYS   8           HA       LYS   8  -0.424  -4.386   0.710
   62    HB2  LYS   8           HB2      LYS   8  -0.604  -4.535   3.011
   63    HB3  LYS   8           HB3      LYS   8  -2.064  -5.311   2.439
   64    HG2  LYS   8           HG2      LYS   8   0.423  -6.703   3.546
   65    HG3  LYS   8           HG3      LYS   8  -1.053  -6.409   4.415
   66    HD2  LYS   8           HD2      LYS   8  -2.214  -8.114   3.453
   67    HD3  LYS   8           HD3      LYS   8  -1.381  -8.031   1.919
   68    HE2  LYS   8           HE2      LYS   8  -0.042  -9.042   4.436
   69    HE3  LYS   8           HE3      LYS   8  -0.938 -10.103   3.341
   70    HZ1  LYS   8           HZ1      LYS   8   0.653  -9.724   1.603
   71    HZ2  LYS   8           HZ2      LYS   8   1.229  -8.403   2.288
   72    HZ3  LYS   8           HZ3      LYS   8   1.566  -9.891   2.951
   73    H    ARG   9           H        ARG   9   1.673  -3.948   0.738
   74    HA   ARG   9           HA       ARG   9   3.664  -5.959   1.674
   75    HB2  ARG   9           HB2      ARG   9   3.879  -4.423  -0.947
   76    HB3  ARG   9           HB3      ARG   9   5.184  -5.369  -0.235
   77    HG2  ARG   9           HG2      ARG   9   2.536  -6.474  -1.252
   78    HG3  ARG   9           HG3      ARG   9   4.077  -6.511  -2.095
   79    HD2  ARG   9           HD2      ARG   9   5.034  -8.033  -0.462
   80    HD3  ARG   9           HD3      ARG   9   3.614  -7.896   0.569
   81    HE   ARG   9           HE       ARG   9   2.464  -9.419  -0.717
   82   HH11  ARG   9          HH12      ARG   9   5.274  -8.455  -2.588
   83   HH12  ARG   9          HH11      ARG   9   4.928  -9.572  -3.882
   84   HH21  ARG   9          HH21      ARG   9   2.038 -10.809  -2.398
   85   HH22  ARG   9          HH22      ARG   9   3.228 -11.021  -3.668
   86    H    MET  10           H        MET  10   5.740  -5.008   2.242
   87    HA   MET  10           HA       MET  10   5.448  -2.234   3.284
   88    HB2  MET  10           HB2      MET  10   7.271  -4.544   4.058
   89    HB3  MET  10           HB3      MET  10   7.437  -2.894   4.679
   90    HG2  MET  10           HG2      MET  10   5.159  -2.967   5.589
   91    HG3  MET  10           HG3      MET  10   4.950  -4.617   4.983
   92    HE1  MET  10           HE1      MET  10   5.115  -5.019   8.896
   93    HE2  MET  10           HE2      MET  10   4.435  -3.640   8.001
   94    HE3  MET  10           HE3      MET  10   4.148  -5.304   7.431
   95    H    PHE  11           H        PHE  11   6.688  -0.631   2.584
   96    HA   PHE  11           HA       PHE  11   8.732  -1.096   0.493
   97    HB2  PHE  11           HB2      PHE  11   6.934   0.608   0.144
   98    HB3  PHE  11           HB3      PHE  11   7.483   1.457   1.579
   99    HD1  PHE  11           HD2      PHE  11   8.961   0.003  -1.576
  100    HD2  PHE  11           HD1      PHE  11   8.799   3.370   1.120
  101    HE1  PHE  11           HE2      PHE  11  10.561   1.242  -3.019
  102    HE2  PHE  11           HE1      PHE  11  10.364   4.615  -0.352
  103    HZ   PHE  11           HZ       PHE  11  11.259   3.549  -2.406
  104    H    ALA  12           H        ALA  12  10.824  -1.181   1.081
  105    HA   ALA  12           HA       ALA  12  11.635  -1.352   3.704
  106    HB1  ALA  12           HB1      ALA  12  13.321  -0.837   1.219
  107    HB2  ALA  12           HB2      ALA  12  13.895  -1.531   2.751
  108    HB3  ALA  12           HB3      ALA  12  12.718  -2.421   1.770
  109    H    ASN  13           H        ASN  13  11.356   1.679   1.984
  110    HA   ASN  13           HA       ASN  13  13.199   3.138   3.704
  111    HB2  ASN  13           HB2      ASN  13  12.251   3.660   1.275
  112    HB3  ASN  13           HB3      ASN  13  10.937   4.426   2.181
  113   HD21  ASN  13          HD22      ASN  13  12.258   5.719   4.275
  114   HD22  ASN  13          HD21      ASN  13  13.390   6.873   3.540
  115    H    GLY  14           H        GLY  14  10.184   1.697   4.367
  116    HA2  GLY  14           HA2      GLY  14   9.221   1.760   6.537
  117    HA3  GLY  14           HA3      GLY  14   9.762   3.429   6.759
  118    H    THR  15           H        THR  15   7.667   1.504   4.496
  119    HA   THR  15           HA       THR  15   5.346   3.172   5.043
  120    HB   THR  15           HB       THR  15   6.841   3.392   2.407
  121    HG1  THR  15           HG1      THR  15   6.891   4.826   4.458
  122   HG21  THR  15          HG21      THR  15   4.977   4.831   1.582
  123   HG22  THR  15          HG22      THR  15   4.560   3.120   1.632
  124   HG23  THR  15          HG23      THR  15   3.955   4.228   2.899
  125    H    VAL  16           H        VAL  16   3.433   2.287   3.591
  126    HA   VAL  16           HA       VAL  16   3.875  -0.547   2.826
  127    HB   VAL  16           HB       VAL  16   1.757   0.603   4.626
  128   HG11  VAL  16          HG11      VAL  16   0.349  -0.313   2.832
  129   HG12  VAL  16          HG12      VAL  16   1.269  -1.838   2.860
  130   HG13  VAL  16          HG13      VAL  16   0.292  -1.350   4.256
  131   HG21  VAL  16          HG21      VAL  16   3.706  -0.739   5.470
  132   HG22  VAL  16          HG22      VAL  16   2.147  -1.513   5.806
  133   HG23  VAL  16          HG23      VAL  16   3.155  -2.103   4.465
  134    H    TYR  17           H        TYR  17   2.828  -1.255   1.055
  135    HA   TYR  17           HA       TYR  17   1.179   0.594  -0.542
  136    HB2  TYR  17           HB2      TYR  17   2.522   0.461  -2.489
  137    HB3  TYR  17           HB3      TYR  17   3.587   0.945  -1.194
  138    HD1  TYR  17           HD1      TYR  17   5.176  -0.790  -0.175
  139    HD2  TYR  17           HD2      TYR  17   2.909  -1.530  -3.773
  140    HE1  TYR  17           HE1      TYR  17   6.755  -2.627  -0.809
  141    HE2  TYR  17           HE2      TYR  17   4.497  -3.308  -4.410
  142    HH   TYR  17           HH       TYR  17   6.476  -4.355  -3.896
  143    H    TYR  18           H        TYR  18   0.508  -0.734  -2.649
  144    HA   TYR  18           HA       TYR  18  -0.073  -3.541  -1.860
  145    HB2  TYR  18           HB2      TYR  18  -1.829  -1.439  -3.140
  146    HB3  TYR  18           HB3      TYR  18  -2.183  -3.165  -3.217
  147    HD1  TYR  18           HD2      TYR  18  -1.544  -0.365  -0.772
  148    HD2  TYR  18           HD1      TYR  18  -3.163  -4.320  -1.385
  149    HE1  TYR  18           HE2      TYR  18  -2.248  -0.459   1.599
  150    HE2  TYR  18           HE1      TYR  18  -4.125  -4.300   0.841
  151    HH   TYR  18           HH       TYR  18  -4.147  -3.193   2.917
  152    H    PHE  19           H        PHE  19   0.549  -5.066  -3.138
  153    HA   PHE  19           HA       PHE  19   1.802  -4.471  -5.779
  154    HB2  PHE  19           HB2      PHE  19   3.298  -5.269  -4.023
  155    HB3  PHE  19           HB3      PHE  19   2.196  -6.571  -3.618
  156    HD1  PHE  19           HD1      PHE  19   2.045  -8.614  -4.972
  157    HD2  PHE  19           HD2      PHE  19   4.768  -5.430  -6.006
  158    HE1  PHE  19           HE1      PHE  19   3.326 -10.164  -6.445
  159    HE2  PHE  19           HE2      PHE  19   5.998  -6.972  -7.496
  160    HZ   PHE  19           HZ       PHE  19   5.259  -9.334  -7.745
  161    H    ASN  20           H        ASN  20   0.862  -5.401  -7.584
  162    HA   ASN  20           HA       ASN  20  -1.459  -7.163  -7.163
  163    HB2  ASN  20           HB2      ASN  20  -1.539  -5.338  -8.832
  164    HB3  ASN  20           HB3      ASN  20  -0.255  -6.139  -9.732
  165   HD21  ASN  20          HD22      ASN  20  -3.695  -6.401  -8.709
  166   HD22  ASN  20          HD21      ASN  20  -4.039  -7.745  -9.767
  167    H    HIS  21           H        HIS  21  -0.867  -9.205  -6.517
  168    HA   HIS  21           HA       HIS  21   1.530 -10.438  -7.607
  169    HB2  HIS  21           HB2      HIS  21   1.000 -12.329  -6.158
  170    HB3  HIS  21           HB3      HIS  21   1.044 -10.795  -5.323
  171    HD1  HIS  21           HD1      HIS  21  -0.469 -11.428  -3.293
  172    HD2  HIS  21           HD2      HIS  21  -2.157 -12.210  -7.099
  173    HE1  HIS  21           HE1      HIS  21  -2.919 -12.048  -2.925
  174    H    ILE  22           H        ILE  22  -1.132  -9.935  -9.331
  175    HA   ILE  22           HA       ILE  22  -0.966 -12.545 -10.762
  176    HB   ILE  22           HB       ILE  22  -2.916 -10.235 -11.142
  177   HG12  ILE  22          HG12      ILE  22  -3.304 -12.918  -9.737
  178   HG13  ILE  22          HG13      ILE  22  -3.246 -11.339  -8.956
  179   HG21  ILE  22          HG21      ILE  22  -2.907 -13.041 -12.335
  180   HG22  ILE  22          HG22      ILE  22  -4.189 -11.828 -12.552
  181   HG23  ILE  22          HG23      ILE  22  -2.606 -11.530 -13.217
  182   HD11  ILE  22          HD11      ILE  22  -5.293 -10.654 -10.232
  183   HD12  ILE  22          HD12      ILE  22  -5.444 -12.345 -10.780
  184   HD13  ILE  22          HD13      ILE  22  -5.524 -11.964  -9.057
  185    H    THR  23           H        THR  23   0.108  -9.214 -10.864
  186    HA   THR  23           HA       THR  23   1.181  -9.581 -13.648
  187    HB   THR  23           HB       THR  23   0.588  -7.237 -14.092
  188    HG1  THR  23           HG1      THR  23  -0.836  -7.367 -11.653
  189   HG21  THR  23          HG21      THR  23  -1.086  -8.965 -14.699
  190   HG22  THR  23          HG22      THR  23  -1.880  -8.742 -13.126
  191   HG23  THR  23          HG23      THR  23  -1.816  -7.401 -14.287
  192    H    ASN  24           H        ASN  24   2.053  -8.676 -10.423
  193    HA   ASN  24           HA       ASN  24   3.808  -7.743  -9.507
  194    HB2  ASN  24           HB2      ASN  24   5.012  -9.088 -11.398
  195    HB3  ASN  24           HB3      ASN  24   5.305  -7.510 -12.121
  196   HD21  ASN  24          HD22      ASN  24   6.200  -5.864 -10.303
  197   HD22  ASN  24          HD21      ASN  24   7.622  -6.565  -9.496
  198    H    ALA  25           H        ALA  25   1.603  -6.070 -11.202
  199    HA   ALA  25           HA       ALA  25   2.847  -3.471 -11.335
  200    HB1  ALA  25           HB1      ALA  25   0.568  -2.638 -11.457
  201    HB2  ALA  25           HB2      ALA  25   0.711  -4.090 -12.458
  202    HB3  ALA  25           HB3      ALA  25  -0.081  -4.181 -10.872
  203    H    SER  26           H        SER  26   2.147  -1.577  -9.771
  204    HA   SER  26           HA       SER  26   1.662  -2.407  -7.009
  205    HB2  SER  26           HB2      SER  26   4.351  -1.337  -7.881
  206    HB3  SER  26           HB3      SER  26   3.762  -1.241  -6.204
  207    HG   SER  26           HG       SER  26   3.462  -3.691  -7.504
  208    H    GLN  27           H        GLN  27   0.815  -0.920  -5.766
  209    HA   GLN  27           HA       GLN  27   0.323   1.853  -6.736
  210    HB2  GLN  27           HB2      GLN  27  -1.512   0.338  -7.366
  211    HB3  GLN  27           HB3      GLN  27  -1.582  -0.312  -5.722
  212    HG2  GLN  27           HG2      GLN  27  -2.219   1.993  -4.931
  213    HG3  GLN  27           HG3      GLN  27  -2.345   2.490  -6.621
  214   HE21  GLN  27          HE22      GLN  27  -4.002   1.170  -3.945
  215   HE22  GLN  27          HE21      GLN  27  -5.449   0.648  -4.750
  216    H    PHE  28           H        PHE  28   1.013   3.278  -5.142
  217    HA   PHE  28           HA       PHE  28   1.236   2.404  -2.337
  218    HB2  PHE  28           HB2      PHE  28   2.082   4.826  -3.908
  219    HB3  PHE  28           HB3      PHE  28   1.950   4.914  -2.159
  220    HD1  PHE  28           HD2      PHE  28   3.416   2.553  -4.747
  221    HD2  PHE  28           HD1      PHE  28   3.812   4.397  -0.863
  222    HE1  PHE  28           HE2      PHE  28   5.588   1.431  -4.434
  223    HE2  PHE  28           HE1      PHE  28   6.009   3.289  -0.575
  224    HZ   PHE  28           HZ       PHE  28   6.901   1.805  -2.362
  225    H    GLU  29           H        GLU  29  -1.212   3.866  -4.249
  226    HA   GLU  29           HA       GLU  29  -2.692   5.286  -2.230
  227    HB2  GLU  29           HB2      GLU  29  -3.039   5.576  -4.648
  228    HB3  GLU  29           HB3      GLU  29  -3.456   3.883  -4.808
  229    HG2  GLU  29           HG2      GLU  29  -5.361   4.636  -2.997
  230    HG3  GLU  29           HG3      GLU  29  -5.117   6.161  -3.854
  231    H    ARG  30           H        ARG  30  -3.380   4.316  -0.377
  232    HA   ARG  30           HA       ARG  30  -3.688   1.492  -0.162
  233    HB2  ARG  30           HB2      ARG  30  -3.928   1.816   2.111
  234    HB3  ARG  30           HB3      ARG  30  -2.893   3.133   1.623
  235    HG2  ARG  30           HG2      ARG  30  -5.891   3.344   2.170
  236    HG3  ARG  30           HG3      ARG  30  -4.600   3.696   3.301
  237    HD2  ARG  30           HD2      ARG  30  -5.255   5.791   2.569
  238    HD3  ARG  30           HD3      ARG  30  -3.774   5.472   1.657
  239    HE   ARG  30           HE       ARG  30  -6.075   4.681   0.084
  240   HH11  ARG  30          HH12      ARG  30  -4.506   7.599   1.215
  241   HH12  ARG  30          HH11      ARG  30  -5.183   8.579  -0.062
  242   HH21  ARG  30          HH21      ARG  30  -7.077   6.037  -1.446
  243   HH22  ARG  30          HH22      ARG  30  -6.524   7.673  -1.576
  244    HA   PRO  31           HA       PRO  31  -7.723   0.430  -1.096
  245    HB2  PRO  31           HB2      PRO  31  -8.169  -0.585   1.715
  246    HB3  PRO  31           HB3      PRO  31  -8.554  -1.406   0.168
  247    HG2  PRO  31           HG2      PRO  31  -6.268  -2.066   1.461
  248    HG3  PRO  31           HG3      PRO  31  -6.211  -1.741  -0.292
  249    HD2  PRO  31           HD2      PRO  31  -5.448   0.120   1.936
  250    HD3  PRO  31           HD3      PRO  31  -4.620  -0.254   0.389
  251    H    SER  32           H        SER  32  -7.689   1.985   1.812
  252    HA   SER  32           HA       SER  32 -10.490   2.847   1.988
  253    HB2  SER  32           HB2      SER  32  -9.873   4.111   3.944
  254    HB3  SER  32           HB3      SER  32  -9.081   2.525   4.027
  255    HG   SER  32           HG       SER  32  -7.893   4.820   2.902
  256    H    GLY  33           H        GLY  33 -10.903   3.833   0.008
  257    HA2  GLY  33           HA2      GLY  33 -11.345   5.947  -1.088
  258    HA3  GLY  33           HA3      GLY  33  -9.812   6.583  -0.447
  Start of MODEL   10
    1    H1   LYS   1           H1       LYS   1 -12.994   0.288  -0.521
    2    H2   LYS   1           H2       LYS   1 -12.372   1.446  -1.557
    3    H3   LYS   1           H3       LYS   1 -11.389   0.422  -0.704
    4    HA   LYS   1           HA       LYS   1 -12.425  -1.455  -1.797
    5    HB2  LYS   1           HB2      LYS   1 -14.435  -0.167  -2.612
    6    HB3  LYS   1           HB3      LYS   1 -13.393   0.482  -3.889
    7    HG2  LYS   1           HG2      LYS   1 -14.484  -1.472  -4.790
    8    HG3  LYS   1           HG3      LYS   1 -12.809  -1.915  -4.512
    9    HD2  LYS   1           HD2      LYS   1 -13.983  -2.674  -2.088
   10    HD3  LYS   1           HD3      LYS   1 -15.319  -2.867  -3.201
   11    HE2  LYS   1           HE2      LYS   1 -14.220  -4.963  -3.021
   12    HE3  LYS   1           HE3      LYS   1 -13.852  -4.341  -4.638
   13    HZ1  LYS   1           HZ1      LYS   1 -11.926  -5.286  -3.327
   14    HZ2  LYS   1           HZ2      LYS   1 -11.655  -3.784  -3.918
   15    HZ3  LYS   1           HZ3      LYS   1 -12.023  -3.987  -2.312
   16    H    LEU   2           H        LEU   2 -10.489  -2.246  -2.029
   17    HA   LEU   2           HA       LEU   2  -8.505  -0.954  -3.704
   18    HB2  LEU   2           HB2      LEU   2  -7.096  -2.838  -3.210
   19    HB3  LEU   2           HB3      LEU   2  -7.889  -2.224  -1.776
   20    HG   LEU   2           HG       LEU   2  -9.580  -4.203  -2.097
   21   HD11  LEU   2          HD11      LEU   2  -8.998  -5.113  -4.249
   22   HD12  LEU   2          HD12      LEU   2  -7.278  -5.080  -3.862
   23   HD13  LEU   2          HD13      LEU   2  -8.355  -6.240  -3.061
   24   HD21  LEU   2          HD21      LEU   2  -7.904  -3.988  -0.270
   25   HD22  LEU   2          HD22      LEU   2  -8.157  -5.661  -0.779
   26   HD23  LEU   2          HD23      LEU   2  -6.705  -4.795  -1.314
   27    HA   PRO   3           HA       PRO   3  -9.875  -2.759  -7.547
   28    HB2  PRO   3           HB2      PRO   3  -7.598  -2.396  -9.110
   29    HB3  PRO   3           HB3      PRO   3  -8.773  -1.128  -8.671
   30    HG2  PRO   3           HG2      PRO   3  -6.079  -1.682  -7.455
   31    HG3  PRO   3           HG3      PRO   3  -6.870  -0.120  -7.769
   32    HD2  PRO   3           HD2      PRO   3  -6.781  -1.402  -5.305
   33    HD3  PRO   3           HD3      PRO   3  -8.038  -0.224  -5.784
   34    HA   PRO   4           HA       PRO   4  -9.151  -6.984  -8.056
   35    HB2  PRO   4           HB2      PRO   4  -8.109  -6.495 -10.859
   36    HB3  PRO   4           HB3      PRO   4  -9.238  -7.764 -10.280
   37    HG2  PRO   4           HG2      PRO   4 -10.217  -5.524 -11.421
   38    HG3  PRO   4           HG3      PRO   4 -10.970  -6.148  -9.916
   39    HD2  PRO   4           HD2      PRO   4  -9.019  -3.871 -10.247
   40    HD3  PRO   4           HD3      PRO   4 -10.469  -3.982  -9.206
   41    H    GLY   5           H        GLY   5  -7.661  -7.835  -6.741
   42    HA2  GLY   5           HA2      GLY   5  -5.831  -9.102  -6.241
   43    HA3  GLY   5           HA3      GLY   5  -5.189  -8.801  -7.855
   44    H    TRP   6           H        TRP   6  -5.815  -5.818  -6.292
   45    HA   TRP   6           HA       TRP   6  -2.951  -5.352  -5.840
   46    HB2  TRP   6           HB2      TRP   6  -5.425  -3.610  -5.704
   47    HB3  TRP   6           HB3      TRP   6  -3.808  -3.053  -5.310
   48    HD1  TRP   6           HD1      TRP   6  -5.854  -4.215  -8.335
   49    HE1  TRP   6           HE1      TRP   6  -4.712  -3.410 -10.484
   50    HE3  TRP   6           HE3      TRP   6  -1.447  -2.625  -6.322
   51    HZ2  TRP   6           HZ2      TRP   6  -2.155  -2.290 -11.246
   52    HZ3  TRP   6           HZ3      TRP   6   0.348  -1.812  -7.778
   53    HH2  TRP   6           HH2      TRP   6   0.030  -1.593 -10.222
   54    H    GLU   7           H        GLU   7  -2.007  -6.000  -4.022
   55    HA   GLU   7           HA       GLU   7  -3.623  -6.260  -1.548
   56    HB2  GLU   7           HB2      GLU   7  -2.830  -8.277  -2.838
   57    HB3  GLU   7           HB3      GLU   7  -1.170  -7.766  -2.513
   58    HG2  GLU   7           HG2      GLU   7  -1.752  -7.877  -0.022
   59    HG3  GLU   7           HG3      GLU   7  -3.288  -8.624  -0.497
   60    H    LYS   8           H        LYS   8  -2.956  -5.331   0.282
   61    HA   LYS   8           HA       LYS   8  -1.114  -3.228   0.321
   62    HB2  LYS   8           HB2      LYS   8  -3.137  -3.411   1.620
   63    HB3  LYS   8           HB3      LYS   8  -2.485  -4.755   2.573
   64    HG2  LYS   8           HG2      LYS   8  -0.994  -3.370   3.736
   65    HG3  LYS   8           HG3      LYS   8  -0.995  -2.143   2.470
   66    HD2  LYS   8           HD2      LYS   8  -2.100  -1.451   4.586
   67    HD3  LYS   8           HD3      LYS   8  -3.063  -1.224   3.141
   68    HE2  LYS   8           HE2      LYS   8  -3.414  -3.602   5.019
   69    HE3  LYS   8           HE3      LYS   8  -4.229  -2.052   5.243
   70    HZ1  LYS   8           HZ1      LYS   8  -5.082  -2.351   2.901
   71    HZ2  LYS   8           HZ2      LYS   8  -4.579  -3.900   2.984
   72    HZ3  LYS   8           HZ3      LYS   8  -5.721  -3.373   4.040
   73    H    ARG   9           H        ARG   9   0.966  -3.034   0.740
   74    HA   ARG   9           HA       ARG   9   2.565  -5.203   1.945
   75    HB2  ARG   9           HB2      ARG   9   2.148  -5.204  -0.633
   76    HB3  ARG   9           HB3      ARG   9   3.008  -3.676  -0.671
   77    HG2  ARG   9           HG2      ARG   9   4.443  -5.380  -1.315
   78    HG3  ARG   9           HG3      ARG   9   5.024  -4.858   0.265
   79    HD2  ARG   9           HD2      ARG   9   5.169  -7.193   0.380
   80    HD3  ARG   9           HD3      ARG   9   3.654  -6.883   1.212
   81    HE   ARG   9           HE       ARG   9   4.046  -8.029  -1.503
   82   HH11  ARG   9          HH21      ARG   9   1.335  -7.205   0.837
   83   HH12  ARG   9          HH22      ARG   9   0.563  -8.662   0.210
   84   HH21  ARG   9          HH11      ARG   9   2.609  -9.647  -2.158
   85   HH22  ARG   9          HH12      ARG   9   1.092  -9.753  -1.236
   86    H    MET  10           H        MET  10   4.723  -4.500   2.595
   87    HA   MET  10           HA       MET  10   4.866  -1.618   3.303
   88    HB2  MET  10           HB2      MET  10   4.895  -3.750   4.977
   89    HB3  MET  10           HB3      MET  10   6.620  -3.627   4.655
   90    HG2  MET  10           HG2      MET  10   4.758  -1.463   5.708
   91    HG3  MET  10           HG3      MET  10   5.926  -2.368   6.654
   92    HE1  MET  10           HE1      MET  10   9.352  -0.875   5.580
   93    HE2  MET  10           HE2      MET  10   8.496  -2.036   6.620
   94    HE3  MET  10           HE3      MET  10   8.603  -2.313   4.861
   95    H    PHE  11           H        PHE  11   6.300  -0.418   2.267
   96    HA   PHE  11           HA       PHE  11   8.305  -1.533   0.442
   97    HB2  PHE  11           HB2      PHE  11   6.834   0.448  -0.110
   98    HB3  PHE  11           HB3      PHE  11   7.608   1.345   1.180
   99    HD1  PHE  11           HD1      PHE  11   8.468  -0.666  -1.885
  100    HD2  PHE  11           HD2      PHE  11   9.365   2.774   0.556
  101    HE1  PHE  11           HE1      PHE  11  10.186   0.057  -3.531
  102    HE2  PHE  11           HE2      PHE  11  11.059   3.510  -1.115
  103    HZ   PHE  11           HZ       PHE  11  11.479   2.145  -3.143
  104    H    ALA  12           H        ALA  12  10.463  -1.713   0.920
  105    HA   ALA  12           HA       ALA  12  11.329  -1.803   3.518
  106    HB1  ALA  12           HB1      ALA  12  13.562  -2.143   2.543
  107    HB2  ALA  12           HB2      ALA  12  12.320  -3.006   1.618
  108    HB3  ALA  12           HB3      ALA  12  13.001  -1.483   0.992
  109    H    ASN  13           H        ASN  13  11.328   1.156   1.597
  110    HA   ASN  13           HA       ASN  13  13.223   2.536   3.334
  111    HB2  ASN  13           HB2      ASN  13  12.537   2.948   0.803
  112    HB3  ASN  13           HB3      ASN  13  11.276   3.957   1.527
  113   HD21  ASN  13          HD22      ASN  13  12.567   5.271   3.599
  114   HD22  ASN  13          HD21      ASN  13  13.911   6.191   2.888
  115    H    GLY  14           H        GLY  14  10.046   1.501   3.916
  116    HA2  GLY  14           HA2      GLY  14   8.949   1.838   5.957
  117    HA3  GLY  14           HA3      GLY  14   9.747   3.399   6.174
  118    H    THR  15           H        THR  15   7.395   1.769   3.935
  119    HA   THR  15           HA       THR  15   5.382   3.788   4.464
  120    HB   THR  15           HB       THR  15   6.665   3.676   1.702
  121    HG1  THR  15           HG1      THR  15   7.202   5.161   3.724
  122   HG21  THR  15          HG21      THR  15   4.986   5.464   1.102
  123   HG22  THR  15          HG22      THR  15   4.303   3.847   1.259
  124   HG23  THR  15          HG23      THR  15   4.084   5.042   2.568
  125    H    VAL  16           H        VAL  16   3.281   3.005   3.783
  126    HA   VAL  16           HA       VAL  16   3.290   0.177   2.848
  127    HB   VAL  16           HB       VAL  16   1.404   1.793   4.522
  128   HG11  VAL  16          HG11      VAL  16   0.537  -0.595   2.847
  129   HG12  VAL  16          HG12      VAL  16  -0.363   0.078   4.232
  130   HG13  VAL  16          HG13      VAL  16  -0.145   1.048   2.777
  131   HG21  VAL  16          HG21      VAL  16   1.416  -0.327   5.796
  132   HG22  VAL  16          HG22      VAL  16   2.324  -1.122   4.487
  133   HG23  VAL  16          HG23      VAL  16   3.081   0.176   5.450
  134    H    TYR  17           H        TYR  17   2.435  -0.484   1.017
  135    HA   TYR  17           HA       TYR  17   1.118   1.418  -0.848
  136    HB2  TYR  17           HB2      TYR  17   2.695   1.028  -2.559
  137    HB3  TYR  17           HB3      TYR  17   3.649   1.425  -1.159
  138    HD1  TYR  17           HD1      TYR  17   4.814  -0.518   0.096
  139    HD2  TYR  17           HD2      TYR  17   2.928  -1.036  -3.750
  140    HE1  TYR  17           HE1      TYR  17   6.266  -2.516  -0.380
  141    HE2  TYR  17           HE2      TYR  17   4.329  -3.015  -4.172
  142    HH   TYR  17           HH       TYR  17   6.164  -4.200  -3.498
  143    H    TYR  18           H        TYR  18   0.469   0.054  -2.943
  144    HA   TYR  18           HA       TYR  18  -0.377  -2.682  -2.098
  145    HB2  TYR  18           HB2      TYR  18  -1.750  -0.608  -3.794
  146    HB3  TYR  18           HB3      TYR  18  -2.111  -2.326  -3.953
  147    HD1  TYR  18           HD1      TYR  18  -1.518  -0.044  -0.994
  148    HD2  TYR  18           HD2      TYR  18  -4.236  -2.793  -2.918
  149    HE1  TYR  18           HE1      TYR  18  -2.867  -0.027   0.960
  150    HE2  TYR  18           HE2      TYR  18  -5.663  -2.725  -0.913
  151    HH   TYR  18           HH       TYR  18  -5.810  -0.614   1.176
  152    H    PHE  19           H        PHE  19   0.212  -4.386  -3.126
  153    HA   PHE  19           HA       PHE  19   1.891  -4.272  -5.584
  154    HB2  PHE  19           HB2      PHE  19   3.111  -5.094  -3.704
  155    HB3  PHE  19           HB3      PHE  19   1.751  -6.008  -3.100
  156    HD1  PHE  19           HD2      PHE  19   4.522  -5.967  -5.531
  157    HD2  PHE  19           HD1      PHE  19   1.153  -8.264  -4.070
  158    HE1  PHE  19           HE2      PHE  19   5.382  -7.979  -6.675
  159    HE2  PHE  19           HE1      PHE  19   2.060 -10.269  -5.161
  160    HZ   PHE  19           HZ       PHE  19   4.146 -10.138  -6.509
  161    H    ASN  20           H        ASN  20   1.007  -5.214  -7.418
  162    HA   ASN  20           HA       ASN  20  -1.650  -6.450  -7.151
  163    HB2  ASN  20           HB2      ASN  20  -1.155  -4.845  -8.985
  164    HB3  ASN  20           HB3      ASN  20   0.015  -5.992  -9.632
  165   HD21  ASN  20          HD22      ASN  20  -3.462  -5.451  -8.951
  166   HD22  ASN  20          HD21      ASN  20  -4.049  -6.795  -9.861
  167    H    HIS  21           H        HIS  21  -1.653  -8.513  -6.355
  168    HA   HIS  21           HA       HIS  21   0.595 -10.251  -6.847
  169    HB2  HIS  21           HB2      HIS  21  -0.465 -11.780  -5.378
  170    HB3  HIS  21           HB3      HIS  21  -0.591 -10.172  -4.738
  171    HD1  HIS  21           HD1      HIS  21  -2.637 -10.864  -3.161
  172    HD2  HIS  21           HD2      HIS  21  -3.277 -11.450  -7.302
  173    HE1  HIS  21           HE1      HIS  21  -5.128 -11.249  -3.495
  174    H    ILE  22           H        ILE  22  -1.742  -9.514  -9.077
  175    HA   ILE  22           HA       ILE  22  -1.849 -12.239 -10.262
  176    HB   ILE  22           HB       ILE  22  -3.082  -9.647 -11.282
  177   HG12  ILE  22          HG12      ILE  22  -4.418 -11.821  -9.613
  178   HG13  ILE  22          HG13      ILE  22  -4.001 -10.201  -9.051
  179   HG21  ILE  22          HG21      ILE  22  -2.815 -11.388 -13.020
  180   HG22  ILE  22          HG22      ILE  22  -3.660 -12.557 -11.985
  181   HG23  ILE  22          HG23      ILE  22  -4.502 -11.140 -12.651
  182   HD11  ILE  22          HD11      ILE  22  -6.329 -10.202  -9.509
  183   HD12  ILE  22          HD12      ILE  22  -5.537  -9.214 -10.752
  184   HD13  ILE  22          HD13      ILE  22  -6.101 -10.864 -11.130
  185    H    THR  23           H        THR  23  -0.217  -9.152 -10.569
  186    HA   THR  23           HA       THR  23   1.196 -10.029 -13.078
  187    HB   THR  23           HB       THR  23   1.138  -7.653 -13.742
  188    HG1  THR  23           HG1      THR  23  -0.582  -7.278 -11.522
  189   HG21  THR  23          HG21      THR  23  -1.685  -8.556 -13.033
  190   HG22  THR  23          HG22      THR  23  -1.203  -7.368 -14.259
  191   HG23  THR  23          HG23      THR  23  -0.769  -9.076 -14.463
  192    H    ASN  24           H        ASN  24   1.750  -9.180  -9.848
  193    HA   ASN  24           HA       ASN  24   3.322  -8.375  -8.639
  194    HB2  ASN  24           HB2      ASN  24   5.580  -8.940  -8.945
  195    HB3  ASN  24           HB3      ASN  24   4.610 -10.264  -9.577
  196   HD21  ASN  24          HD22      ASN  24   6.119  -7.208 -10.783
  197   HD22  ASN  24          HD21      ASN  24   6.791  -8.004 -12.225
  198    H    ALA  25           H        ALA  25   2.016  -6.526 -10.770
  199    HA   ALA  25           HA       ALA  25   3.867  -4.320 -10.938
  200    HB1  ALA  25           HB1      ALA  25   0.818  -4.308 -10.938
  201    HB2  ALA  25           HB2      ALA  25   1.888  -3.024 -11.527
  202    HB3  ALA  25           HB3      ALA  25   1.841  -4.585 -12.362
  203    H    SER  26           H        SER  26   3.258  -2.109  -9.733
  204    HA   SER  26           HA       SER  26   2.325  -2.474  -6.976
  205    HB2  SER  26           HB2      SER  26   5.242  -1.976  -7.641
  206    HB3  SER  26           HB3      SER  26   4.515  -1.583  -6.066
  207    HG   SER  26           HG       SER  26   3.932  -4.101  -7.113
  208    H    GLN  27           H        GLN  27   1.581  -0.641  -6.079
  209    HA   GLN  27           HA       GLN  27   2.028   1.944  -7.462
  210    HB2  GLN  27           HB2      GLN  27  -0.004   0.633  -8.273
  211    HB3  GLN  27           HB3      GLN  27  -0.722   0.889  -6.686
  212    HG2  GLN  27           HG2      GLN  27   0.232   3.073  -8.612
  213    HG3  GLN  27           HG3      GLN  27  -1.429   2.499  -8.509
  214   HE21  GLN  27          HE22      GLN  27  -0.473   5.317  -8.016
  215   HE22  GLN  27          HE21      GLN  27  -0.945   5.568  -6.342
  216    H    PHE  28           H        PHE  28   2.484   3.506  -6.095
  217    HA   PHE  28           HA       PHE  28   2.945   2.934  -3.414
  218    HB2  PHE  28           HB2      PHE  28   4.104   4.465  -5.294
  219    HB3  PHE  28           HB3      PHE  28   3.226   5.727  -4.439
  220    HD1  PHE  28           HD2      PHE  28   5.159   2.628  -3.699
  221    HD2  PHE  28           HD1      PHE  28   4.429   6.713  -2.639
  222    HE1  PHE  28           HE2      PHE  28   6.999   2.500  -1.991
  223    HE2  PHE  28           HE1      PHE  28   6.252   6.611  -0.924
  224    HZ   PHE  28           HZ       PHE  28   7.533   4.506  -0.608
  225    H    GLU  29           H        GLU  29  -0.082   3.650  -4.226
  226    HA   GLU  29           HA       GLU  29  -0.559   5.337  -1.834
  227    HB2  GLU  29           HB2      GLU  29  -1.400   6.173  -4.026
  228    HB3  GLU  29           HB3      GLU  29  -2.493   4.793  -4.096
  229    HG2  GLU  29           HG2      GLU  29  -3.481   7.006  -3.321
  230    HG3  GLU  29           HG3      GLU  29  -3.818   5.600  -2.318
  231    H    ARG  30           H        ARG  30  -2.620   4.791  -0.555
  232    HA   ARG  30           HA       ARG  30  -2.888   1.846  -0.313
  233    HB2  ARG  30           HB2      ARG  30  -2.752   2.040   2.100
  234    HB3  ARG  30           HB3      ARG  30  -1.266   2.449   1.271
  235    HG2  ARG  30           HG2      ARG  30  -2.943   4.832   1.938
  236    HG3  ARG  30           HG3      ARG  30  -2.480   3.856   3.318
  237    HD2  ARG  30           HD2      ARG  30  -0.752   5.330   3.272
  238    HD3  ARG  30           HD3      ARG  30  -0.050   3.999   2.362
  239    HE   ARG  30           HE       ARG  30  -1.438   6.222   0.888
  240   HH11  ARG  30          HH11      ARG  30   1.496   4.281   1.072
  241   HH12  ARG  30          HH12      ARG  30   2.074   5.167  -0.296
  242   HH21  ARG  30          HH21      ARG  30  -0.322   7.439  -0.617
  243   HH22  ARG  30          HH22      ARG  30   1.314   6.948  -0.976
  244    HA   PRO  31           HA       PRO  31  -7.165   3.451  -0.337
  245    HB2  PRO  31           HB2      PRO  31  -8.319   1.567  -1.920
  246    HB3  PRO  31           HB3      PRO  31  -7.282   2.857  -2.604
  247    HG2  PRO  31           HG2      PRO  31  -6.497   0.012  -1.907
  248    HG3  PRO  31           HG3      PRO  31  -6.176   0.879  -3.436
  249    HD2  PRO  31           HD2      PRO  31  -4.377   0.700  -1.416
  250    HD3  PRO  31           HD3      PRO  31  -4.409   2.119  -2.440
  251    H    SER  32           H        SER  32  -9.173   2.531   0.564
  252    HA   SER  32           HA       SER  32  -8.836   0.580   2.683
  253    HB2  SER  32           HB2      SER  32 -11.285   0.929   2.941
  254    HB3  SER  32           HB3      SER  32 -10.383   2.453   2.908
  255    HG   SER  32           HG       SER  32 -12.170   2.621   1.582
  256    H    GLY  33           H        GLY  33 -10.260  -1.377   2.814
  257    HA2  GLY  33           HA2      GLY  33  -9.929  -3.335   0.887
  258    HA3  GLY  33           HA3      GLY  33 -11.235  -3.310   2.079
  Start of MODEL   11
    1    H1   LYS   1           H1       LYS   1 -12.375  -1.033  -1.618
    2    H2   LYS   1           H2       LYS   1 -13.631  -1.419  -0.621
    3    H3   LYS   1           H3       LYS   1 -13.472  -2.138  -2.117
    4    HA   LYS   1           HA       LYS   1 -11.564  -2.427   0.079
    5    HB2  LYS   1           HB2      LYS   1 -13.701  -4.352  -0.924
    6    HB3  LYS   1           HB3      LYS   1 -12.356  -4.847   0.091
    7    HG2  LYS   1           HG2      LYS   1 -14.540  -2.859   0.838
    8    HG3  LYS   1           HG3      LYS   1 -14.365  -4.507   1.432
    9    HD2  LYS   1           HD2      LYS   1 -12.489  -2.171   2.001
   10    HD3  LYS   1           HD3      LYS   1 -13.635  -2.911   3.119
   11    HE2  LYS   1           HE2      LYS   1 -12.378  -5.046   3.039
   12    HE3  LYS   1           HE3      LYS   1 -11.245  -4.331   1.867
   13    HZ1  LYS   1           HZ1      LYS   1 -10.325  -4.194   4.067
   14    HZ2  LYS   1           HZ2      LYS   1 -10.626  -2.697   3.465
   15    HZ3  LYS   1           HZ3      LYS   1 -11.625  -3.318   4.614
   16    H    LEU   2           H        LEU   2  -9.756  -3.671  -0.393
   17    HA   LEU   2           HA       LEU   2  -8.442  -3.514  -2.703
   18    HB2  LEU   2           HB2      LEU   2  -8.351  -6.086  -1.102
   19    HB3  LEU   2           HB3      LEU   2  -7.080  -5.423  -2.109
   20    HG   LEU   2           HG       LEU   2  -8.079  -4.334   0.540
   21   HD11  LEU   2          HD11      LEU   2  -5.367  -5.434  -0.248
   22   HD12  LEU   2          HD12      LEU   2  -5.868  -4.876   1.365
   23   HD13  LEU   2          HD13      LEU   2  -6.611  -6.320   0.651
   24   HD21  LEU   2          HD21      LEU   2  -6.303  -2.652   0.402
   25   HD22  LEU   2          HD22      LEU   2  -5.853  -3.224  -1.220
   26   HD23  LEU   2          HD23      LEU   2  -7.430  -2.433  -0.936
   27    HA   PRO   3           HA       PRO   3 -10.833  -6.067  -5.615
   28    HB2  PRO   3           HB2      PRO   3  -8.873  -5.139  -7.664
   29    HB3  PRO   3           HB3      PRO   3 -10.645  -4.991  -7.644
   30    HG2  PRO   3           HG2      PRO   3  -8.993  -2.846  -7.187
   31    HG3  PRO   3           HG3      PRO   3 -10.594  -3.030  -6.400
   32    HD2  PRO   3           HD2      PRO   3  -7.867  -3.581  -5.240
   33    HD3  PRO   3           HD3      PRO   3  -9.321  -2.843  -4.505
   34    HA   PRO   4           HA       PRO   4  -8.867  -9.941  -6.368
   35    HB2  PRO   4           HB2      PRO   4  -8.770  -9.315  -9.332
   36    HB3  PRO   4           HB3      PRO   4  -9.170 -10.865  -8.521
   37    HG2  PRO   4           HG2      PRO   4 -11.167  -9.241  -9.325
   38    HG3  PRO   4           HG3      PRO   4 -11.240  -9.973  -7.689
   39    HD2  PRO   4           HD2      PRO   4 -10.413  -7.181  -8.475
   40    HD3  PRO   4           HD3      PRO   4 -11.424  -7.710  -7.095
   41    H    GLY   5           H        GLY   5  -6.936 -10.182  -5.535
   42    HA2  GLY   5           HA2      GLY   5  -4.700 -10.740  -5.681
   43    HA3  GLY   5           HA3      GLY   5  -4.544  -9.840  -7.188
   44    H    TRP   6           H        TRP   6  -5.990  -7.551  -5.221
   45    HA   TRP   6           HA       TRP   6  -3.409  -6.247  -4.839
   46    HB2  TRP   6           HB2      TRP   6  -6.258  -5.437  -4.252
   47    HB3  TRP   6           HB3      TRP   6  -4.868  -4.460  -3.798
   48    HD1  TRP   6           HD1      TRP   6  -6.936  -5.438  -6.757
   49    HE1  TRP   6           HE1      TRP   6  -6.237  -4.080  -8.841
   50    HE3  TRP   6           HE3      TRP   6  -2.574  -3.499  -4.983
   51    HZ2  TRP   6           HZ2      TRP   6  -4.010  -2.434  -9.639
   52    HZ3  TRP   6           HZ3      TRP   6  -1.120  -2.116  -6.467
   53    HH2  TRP   6           HH2      TRP   6  -1.832  -1.593  -8.771
   54    H    GLU   7           H        GLU   7  -2.123  -6.268  -3.147
   55    HA   GLU   7           HA       GLU   7  -3.230  -6.689  -0.429
   56    HB2  GLU   7           HB2      GLU   7  -1.355  -8.163   0.108
   57    HB3  GLU   7           HB3      GLU   7  -2.389  -8.835  -1.152
   58    HG2  GLU   7           HG2      GLU   7  -0.718  -8.094  -2.878
   59    HG3  GLU   7           HG3      GLU   7   0.318  -7.482  -1.582
   60    H    LYS   8           H        LYS   8  -1.901  -5.845   1.279
   61    HA   LYS   8           HA       LYS   8  -0.561  -3.344   0.603
   62    HB2  LYS   8           HB2      LYS   8  -2.235  -3.699   2.493
   63    HB3  LYS   8           HB3      LYS   8  -1.013  -4.681   3.311
   64    HG2  LYS   8           HG2      LYS   8   0.516  -2.712   3.369
   65    HG3  LYS   8           HG3      LYS   8  -0.685  -1.759   2.477
   66    HD2  LYS   8           HD2      LYS   8  -2.313  -2.174   4.373
   67    HD3  LYS   8           HD3      LYS   8  -0.993  -2.968   5.263
   68    HE2  LYS   8           HE2      LYS   8   0.350  -0.873   5.078
   69    HE3  LYS   8           HE3      LYS   8  -0.993  -0.105   4.214
   70    HZ1  LYS   8           HZ1      LYS   8  -2.360  -0.416   6.185
   71    HZ2  LYS   8           HZ2      LYS   8  -1.112  -1.122   6.991
   72    HZ3  LYS   8           HZ3      LYS   8  -1.021   0.462   6.561
   73    H    ARG   9           H        ARG   9   1.563  -2.884   1.016
   74    HA   ARG   9           HA       ARG   9   3.493  -4.987   1.850
   75    HB2  ARG   9           HB2      ARG   9   3.495  -3.400  -0.759
   76    HB3  ARG   9           HB3      ARG   9   4.866  -4.351  -0.176
   77    HG2  ARG   9           HG2      ARG   9   2.171  -5.501  -0.984
   78    HG3  ARG   9           HG3      ARG   9   3.651  -5.460  -1.945
   79    HD2  ARG   9           HD2      ARG   9   4.817  -6.773  -0.121
   80    HD3  ARG   9           HD3      ARG   9   3.244  -6.955   0.669
   81    HE   ARG   9           HE       ARG   9   2.603  -8.540  -0.936
   82   HH11  ARG   9          HH11      ARG   9   5.433  -6.940  -2.293
   83   HH12  ARG   9          HH12      ARG   9   5.521  -8.112  -3.592
   84   HH21  ARG   9          HH22      ARG   9   2.737  -9.829  -2.398
   85   HH22  ARG   9          HH21      ARG   9   3.951  -9.797  -3.706
   86    H    MET  10           H        MET  10   5.795  -3.919   1.860
   87    HA   MET  10           HA       MET  10   5.799  -1.050   2.333
   88    HB2  MET  10           HB2      MET  10   5.028  -2.151   4.509
   89    HB3  MET  10           HB3      MET  10   6.599  -2.956   4.571
   90    HG2  MET  10           HG2      MET  10   7.680  -0.671   4.549
   91    HG3  MET  10           HG3      MET  10   6.074   0.041   4.552
   92    HE1  MET  10           HE1      MET  10   8.950  -1.516   6.518
   93    HE2  MET  10           HE2      MET  10   8.226  -2.031   8.059
   94    HE3  MET  10           HE3      MET  10   7.866  -2.927   6.568
   95    H    PHE  11           H        PHE  11   7.754  -0.179   1.945
   96    HA   PHE  11           HA       PHE  11  10.001  -1.829   1.018
   97    HB2  PHE  11           HB2      PHE  11   9.511   1.167   1.279
   98    HB3  PHE  11           HB3      PHE  11  11.003   0.483   0.672
   99    HD1  PHE  11           HD1      PHE  11  10.927  -1.038  -1.405
  100    HD2  PHE  11           HD2      PHE  11   7.626   1.474  -0.216
  101    HE1  PHE  11           HE1      PHE  11   9.979  -1.188  -3.693
  102    HE2  PHE  11           HE2      PHE  11   6.698   1.328  -2.513
  103    HZ   PHE  11           HZ       PHE  11   7.868  -0.000  -4.247
  104    H    ALA  12           H        ALA  12  12.141  -1.671   1.926
  105    HA   ALA  12           HA       ALA  12  12.219  -2.179   4.652
  106    HB1  ALA  12           HB1      ALA  12  13.789  -3.055   2.965
  107    HB2  ALA  12           HB2      ALA  12  14.495  -1.432   2.766
  108    HB3  ALA  12           HB3      ALA  12  14.654  -2.294   4.311
  109    H    ASN  13           H        ASN  13  12.233   1.017   3.291
  110    HA   ASN  13           HA       ASN  13  13.560   2.213   5.635
  111    HB2  ASN  13           HB2      ASN  13  13.421   4.249   4.470
  112    HB3  ASN  13           HB3      ASN  13  13.872   3.068   3.246
  113   HD21  ASN  13          HD22      ASN  13  12.540   5.740   2.916
  114   HD22  ASN  13          HD21      ASN  13  10.977   5.385   2.208
  115    H    GLY  14           H        GLY  14  10.480   0.932   5.119
  116    HA2  GLY  14           HA2      GLY  14   8.767   1.074   6.728
  117    HA3  GLY  14           HA3      GLY  14   9.297   2.681   7.213
  118    H    THR  15           H        THR  15   8.982   2.150   3.723
  119    HA   THR  15           HA       THR  15   6.684   4.049   3.755
  120    HB   THR  15           HB       THR  15   8.153   3.024   1.316
  121    HG1  THR  15           HG1      THR  15   9.686   3.961   2.520
  122   HG21  THR  15          HG21      THR  15   6.520   5.539   1.830
  123   HG22  THR  15          HG22      THR  15   7.382   5.153   0.326
  124   HG23  THR  15          HG23      THR  15   6.023   4.142   0.842
  125    H    VAL  16           H        VAL  16   4.665   3.323   3.374
  126    HA   VAL  16           HA       VAL  16   4.317   0.451   2.760
  127    HB   VAL  16           HB       VAL  16   2.814   2.515   4.285
  128   HG11  VAL  16          HG11      VAL  16   1.212   0.335   2.888
  129   HG12  VAL  16          HG12      VAL  16   0.650   1.429   4.182
  130   HG13  VAL  16          HG13      VAL  16   1.057   2.089   2.610
  131   HG21  VAL  16          HG21      VAL  16   2.976  -0.527   4.458
  132   HG22  VAL  16          HG22      VAL  16   4.036   0.623   5.317
  133   HG23  VAL  16          HG23      VAL  16   2.314   0.565   5.700
  134    H    TYR  17           H        TYR  17   3.159  -0.360   1.048
  135    HA   TYR  17           HA       TYR  17   1.788   1.477  -0.773
  136    HB2  TYR  17           HB2      TYR  17   3.100   1.036  -2.678
  137    HB3  TYR  17           HB3      TYR  17   4.256   1.400  -1.434
  138    HD1  TYR  17           HD1      TYR  17   5.512  -0.492  -0.287
  139    HD2  TYR  17           HD2      TYR  17   3.123  -1.097  -3.833
  140    HE1  TYR  17           HE1      TYR  17   6.771  -2.576  -0.798
  141    HE2  TYR  17           HE2      TYR  17   4.325  -3.167  -4.319
  142    HH   TYR  17           HH       TYR  17   6.239  -4.405  -3.795
  143    H    TYR  18           H        TYR  18   0.978   0.031  -2.763
  144    HA   TYR  18           HA       TYR  18   0.010  -2.585  -1.729
  145    HB2  TYR  18           HB2      TYR  18  -1.417  -0.401  -3.278
  146    HB3  TYR  18           HB3      TYR  18  -2.004  -2.062  -3.199
  147    HD1  TYR  18           HD2      TYR  18  -1.135   0.906  -1.101
  148    HD2  TYR  18           HD1      TYR  18  -3.077  -2.942  -1.275
  149    HE1  TYR  18           HE2      TYR  18  -1.978   1.236   1.188
  150    HE2  TYR  18           HE1      TYR  18  -4.023  -2.573   0.967
  151    HH   TYR  18           HH       TYR  18  -4.226  -1.101   2.722
  152    H    PHE  19           H        PHE  19   0.122  -4.285  -3.001
  153    HA   PHE  19           HA       PHE  19   1.293  -4.090  -5.747
  154    HB2  PHE  19           HB2      PHE  19   2.890  -4.852  -4.055
  155    HB3  PHE  19           HB3      PHE  19   1.748  -6.012  -3.430
  156    HD1  PHE  19           HD2      PHE  19   4.122  -5.239  -6.125
  157    HD2  PHE  19           HD1      PHE  19   1.402  -8.220  -4.581
  158    HE1  PHE  19           HE2      PHE  19   5.103  -6.928  -7.650
  159    HE2  PHE  19           HE1      PHE  19   2.502  -9.919  -5.998
  160    HZ   PHE  19           HZ       PHE  19   4.261  -9.267  -7.615
  161    H    ASN  20           H        ASN  20   0.174  -5.223  -7.309
  162    HA   ASN  20           HA       ASN  20  -2.113  -6.923  -6.496
  163    HB2  ASN  20           HB2      ASN  20  -2.409  -5.125  -8.198
  164    HB3  ASN  20           HB3      ASN  20  -1.234  -5.927  -9.220
  165   HD21  ASN  20          HD22      ASN  20  -4.483  -6.179  -7.791
  166   HD22  ASN  20          HD21      ASN  20  -5.011  -7.573  -8.685
  167    H    HIS  21           H        HIS  21  -1.476  -9.027  -5.986
  168    HA   HIS  21           HA       HIS  21   0.850 -10.165  -7.246
  169    HB2  HIS  21           HB2      HIS  21   0.547 -12.012  -5.800
  170    HB3  HIS  21           HB3      HIS  21   0.208 -10.557  -4.907
  171    HD1  HIS  21           HD1      HIS  21  -1.511 -11.211  -3.168
  172    HD2  HIS  21           HD2      HIS  21  -2.235 -12.924  -6.959
  173    HE1  HIS  21           HE1      HIS  21  -3.752 -12.456  -3.019
  174    H    ILE  22           H        ILE  22  -2.031  -9.782  -8.788
  175    HA   ILE  22           HA       ILE  22  -1.743 -12.322 -10.322
  176    HB   ILE  22           HB       ILE  22  -3.876 -10.153 -10.363
  177   HG12  ILE  22          HG12      ILE  22  -3.956 -13.066  -9.440
  178   HG13  ILE  22          HG13      ILE  22  -3.891 -11.670  -8.375
  179   HG21  ILE  22          HG21      ILE  22  -3.641 -11.060 -12.638
  180   HG22  ILE  22          HG22      ILE  22  -3.720 -12.718 -12.006
  181   HG23  ILE  22          HG23      ILE  22  -5.127 -11.633 -11.921
  182   HD11  ILE  22          HD11      ILE  22  -6.142 -12.360  -8.381
  183   HD12  ILE  22          HD12      ILE  22  -6.089 -10.889  -9.373
  184   HD13  ILE  22          HD13      ILE  22  -6.207 -12.489 -10.143
  185    H    THR  23           H        THR  23  -0.828  -8.950 -10.390
  186    HA   THR  23           HA       THR  23   0.064  -9.230 -13.254
  187    HB   THR  23           HB       THR  23  -0.655  -6.899 -13.599
  188    HG1  THR  23           HG1      THR  23  -1.955  -7.156 -11.093
  189   HG21  THR  23          HG21      THR  23  -3.048  -7.197 -13.690
  190   HG22  THR  23          HG22      THR  23  -2.269  -8.725 -14.146
  191   HG23  THR  23          HG23      THR  23  -2.992  -8.541 -12.533
  192    H    ASN  24           H        ASN  24   1.006  -8.136 -10.084
  193    HA   ASN  24           HA       ASN  24   2.781  -7.207  -9.225
  194    HB2  ASN  24           HB2      ASN  24   4.073  -6.763 -11.934
  195    HB3  ASN  24           HB3      ASN  24   4.834  -6.734 -10.356
  196   HD21  ASN  24          HD22      ASN  24   3.490  -8.799 -12.851
  197   HD22  ASN  24          HD21      ASN  24   4.247 -10.282 -12.234
  198    H    ALA  25           H        ALA  25   0.456  -5.625 -10.989
  199    HA   ALA  25           HA       ALA  25   1.427  -2.996 -11.284
  200    HB1  ALA  25           HB1      ALA  25  -1.351  -3.924 -10.429
  201    HB2  ALA  25           HB2      ALA  25  -0.933  -2.338 -11.103
  202    HB3  ALA  25           HB3      ALA  25  -0.769  -3.795 -12.104
  203    H    SER  26           H        SER  26   1.969  -1.366  -9.834
  204    HA   SER  26           HA       SER  26   1.521  -1.870  -6.947
  205    HB2  SER  26           HB2      SER  26   4.220  -1.466  -8.289
  206    HB3  SER  26           HB3      SER  26   3.923  -1.530  -6.543
  207    HG   SER  26           HG       SER  26   3.509  -3.661  -8.430
  208    H    GLN  27           H        GLN  27   1.163  -0.046  -5.784
  209    HA   GLN  27           HA       GLN  27   2.540   2.422  -6.400
  210    HB2  GLN  27           HB2      GLN  27   0.731   3.860  -6.872
  211    HB3  GLN  27           HB3      GLN  27   0.602   2.543  -8.015
  212    HG2  GLN  27           HG2      GLN  27  -1.071   2.884  -5.488
  213    HG3  GLN  27           HG3      GLN  27  -1.587   3.289  -7.117
  214   HE21  GLN  27          HE22      GLN  27  -2.626   1.269  -4.983
  215   HE22  GLN  27          HE21      GLN  27  -2.680  -0.205  -5.983
  216    H    PHE  28           H        PHE  28   2.069   4.162  -4.744
  217    HA   PHE  28           HA       PHE  28   1.871   3.117  -2.098
  218    HB2  PHE  28           HB2      PHE  28   1.609   5.976  -3.077
  219    HB3  PHE  28           HB3      PHE  28   1.938   5.464  -1.425
  220    HD1  PHE  28           HD1      PHE  28   4.011   3.698  -1.260
  221    HD2  PHE  28           HD2      PHE  28   3.498   6.705  -4.307
  222    HE1  PHE  28           HE1      PHE  28   6.441   3.642  -1.722
  223    HE2  PHE  28           HE2      PHE  28   5.935   6.646  -4.767
  224    HZ   PHE  28           HZ       PHE  28   7.412   5.115  -3.481
  225    H    GLU  29           H        GLU  29  -0.518   4.676  -4.193
  226    HA   GLU  29           HA       GLU  29  -2.549   5.269  -2.374
  227    HB2  GLU  29           HB2      GLU  29  -2.507   4.631  -5.340
  228    HB3  GLU  29           HB3      GLU  29  -4.006   5.017  -4.519
  229    HG2  GLU  29           HG2      GLU  29  -1.572   6.857  -4.424
  230    HG3  GLU  29           HG3      GLU  29  -2.811   6.948  -5.681
  231    H    ARG  30           H        ARG  30  -3.602   4.019  -1.026
  232    HA   ARG  30           HA       ARG  30  -4.077   1.262  -1.197
  233    HB2  ARG  30           HB2      ARG  30  -6.176   2.028   0.369
  234    HB3  ARG  30           HB3      ARG  30  -4.569   1.640   0.874
  235    HG2  ARG  30           HG2      ARG  30  -4.925   3.498   2.082
  236    HG3  ARG  30           HG3      ARG  30  -4.037   4.185   0.743
  237    HD2  ARG  30           HD2      ARG  30  -7.047   4.247   1.234
  238    HD3  ARG  30           HD3      ARG  30  -5.935   5.609   1.366
  239    HE   ARG  30           HE       ARG  30  -6.828   4.255  -1.144
  240   HH11  ARG  30          HH11      ARG  30  -4.882   6.938   0.093
  241   HH12  ARG  30          HH12      ARG  30  -4.423   7.361  -1.554
  242   HH21  ARG  30          HH22      ARG  30  -6.508   5.053  -3.053
  243   HH22  ARG  30          HH21      ARG  30  -5.630   6.585  -3.252
  244    HA   PRO  31           HA       PRO  31  -7.050   1.454  -4.514
  245    HB2  PRO  31           HB2      PRO  31  -7.191  -1.147  -5.214
  246    HB3  PRO  31           HB3      PRO  31  -5.693  -0.189  -5.394
  247    HG2  PRO  31           HG2      PRO  31  -6.414  -2.108  -3.175
  248    HG3  PRO  31           HG3      PRO  31  -4.870  -1.991  -4.071
  249    HD2  PRO  31           HD2      PRO  31  -5.342  -0.787  -1.607
  250    HD3  PRO  31           HD3      PRO  31  -4.143  -0.200  -2.782
  251    H    SER  32           H        SER  32  -8.418   2.232  -2.696
  252    HA   SER  32           HA       SER  32 -10.359   2.382  -1.549
  253    HB2  SER  32           HB2      SER  32 -12.335   1.295  -2.288
  254    HB3  SER  32           HB3      SER  32 -11.339   1.627  -3.716
  255    HG   SER  32           HG       SER  32 -10.484  -0.608  -3.294
  256    H    GLY  33           H        GLY  33  -8.186   0.488  -0.683
  257    HA2  GLY  33           HA2      GLY  33  -7.623  -0.869   1.092
  258    HA3  GLY  33           HA3      GLY  33  -8.567   0.357   1.925
  Start of MODEL   12
    1    H1   LYS   1           H1       LYS   1  -7.722   2.982  -2.854
    2    H2   LYS   1           H2       LYS   1  -9.149   3.761  -3.171
    3    H3   LYS   1           H3       LYS   1  -8.084   3.423  -4.388
    4    HA   LYS   1           HA       LYS   1  -9.537   1.426  -2.777
    5    HB2  LYS   1           HB2      LYS   1 -10.701   0.831  -4.893
    6    HB3  LYS   1           HB3      LYS   1 -11.109   2.395  -4.227
    7    HG2  LYS   1           HG2      LYS   1 -11.061   2.593  -6.578
    8    HG3  LYS   1           HG3      LYS   1  -9.733   3.526  -5.934
    9    HD2  LYS   1           HD2      LYS   1  -8.164   1.628  -6.641
   10    HD3  LYS   1           HD3      LYS   1  -9.578   0.791  -7.295
   11    HE2  LYS   1           HE2      LYS   1  -8.585   1.885  -9.148
   12    HE3  LYS   1           HE3      LYS   1  -9.978   2.890  -8.711
   13    HZ1  LYS   1           HZ1      LYS   1  -8.121   4.374  -8.968
   14    HZ2  LYS   1           HZ2      LYS   1  -8.225   4.166  -7.304
   15    HZ3  LYS   1           HZ3      LYS   1  -7.105   3.422  -8.058
   16    H    LEU   2           H        LEU   2  -9.357  -0.848  -3.783
   17    HA   LEU   2           HA       LEU   2  -6.753  -1.242  -5.165
   18    HB2  LEU   2           HB2      LEU   2  -7.930  -2.894  -2.913
   19    HB3  LEU   2           HB3      LEU   2  -6.738  -3.499  -4.037
   20    HG   LEU   2           HG       LEU   2  -6.384  -1.377  -1.932
   21   HD11  LEU   2          HD11      LEU   2  -6.173  -3.805  -1.359
   22   HD12  LEU   2          HD12      LEU   2  -4.879  -3.948  -2.562
   23   HD13  LEU   2          HD13      LEU   2  -4.659  -2.911  -1.143
   24   HD21  LEU   2          HD21      LEU   2  -4.367  -2.010  -4.111
   25   HD22  LEU   2          HD22      LEU   2  -5.163  -0.452  -3.832
   26   HD23  LEU   2          HD23      LEU   2  -4.066  -1.073  -2.626
   27    HA   PRO   3           HA       PRO   3  -9.679  -3.370  -7.932
   28    HB2  PRO   3           HB2      PRO   3  -7.155  -3.891  -9.463
   29    HB3  PRO   3           HB3      PRO   3  -8.704  -3.222 -10.041
   30    HG2  PRO   3           HG2      PRO   3  -6.514  -1.631  -9.689
   31    HG3  PRO   3           HG3      PRO   3  -8.167  -1.056  -9.301
   32    HD2  PRO   3           HD2      PRO   3  -6.052  -2.083  -7.403
   33    HD3  PRO   3           HD3      PRO   3  -7.152  -0.688  -7.239
   34    HA   PRO   4           HA       PRO   4  -8.964  -7.753  -7.109
   35    HB2  PRO   4           HB2      PRO   4  -8.662  -8.182 -10.088
   36    HB3  PRO   4           HB3      PRO   4  -9.602  -9.141  -8.901
   37    HG2  PRO   4           HG2      PRO   4 -10.864  -7.354 -10.490
   38    HG3  PRO   4           HG3      PRO   4 -11.276  -7.434  -8.744
   39    HD2  PRO   4           HD2      PRO   4  -9.455  -5.477 -10.160
   40    HD3  PRO   4           HD3      PRO   4 -10.707  -5.158  -8.917
   41    H    GLY   5           H        GLY   5  -7.228  -8.956  -6.523
   42    HA2  GLY   5           HA2      GLY   5  -5.182 -10.004  -6.631
   43    HA3  GLY   5           HA3      GLY   5  -4.837  -9.183  -8.151
   44    H    TRP   6           H        TRP   6  -5.584  -6.634  -6.062
   45    HA   TRP   6           HA       TRP   6  -2.711  -6.150  -5.587
   46    HB2  TRP   6           HB2      TRP   6  -5.165  -4.441  -5.233
   47    HB3  TRP   6           HB3      TRP   6  -3.518  -3.940  -4.857
   48    HD1  TRP   6           HD1      TRP   6  -5.667  -4.918  -7.894
   49    HE1  TRP   6           HE1      TRP   6  -4.752  -3.749  -9.988
   50    HE3  TRP   6           HE3      TRP   6  -1.347  -3.062  -5.929
   51    HZ2  TRP   6           HZ2      TRP   6  -2.419  -2.238 -10.726
   52    HZ3  TRP   6           HZ3      TRP   6   0.275  -1.918  -7.384
   53    HH2  TRP   6           HH2      TRP   6  -0.252  -1.442  -9.765
   54    H    GLU   7           H        GLU   7  -1.668  -6.160  -3.661
   55    HA   GLU   7           HA       GLU   7  -3.199  -6.618  -1.149
   56    HB2  GLU   7           HB2      GLU   7  -1.852  -8.575  -2.740
   57    HB3  GLU   7           HB3      GLU   7  -0.805  -8.294  -1.364
   58    HG2  GLU   7           HG2      GLU   7  -3.800  -8.833  -1.070
   59    HG3  GLU   7           HG3      GLU   7  -2.601 -10.122  -1.182
   60    H    LYS   8           H        LYS   8  -1.988  -6.292   0.821
   61    HA   LYS   8           HA       LYS   8  -0.402  -3.842   0.579
   62    HB2  LYS   8           HB2      LYS   8  -1.050  -3.416   2.806
   63    HB3  LYS   8           HB3      LYS   8  -2.440  -4.139   1.993
   64    HG2  LYS   8           HG2      LYS   8  -1.504  -6.393   3.041
   65    HG3  LYS   8           HG3      LYS   8  -0.624  -5.286   4.092
   66    HD2  LYS   8           HD2      LYS   8  -2.612  -5.898   5.265
   67    HD3  LYS   8           HD3      LYS   8  -2.829  -4.234   4.730
   68    HE2  LYS   8           HE2      LYS   8  -4.893  -5.432   4.393
   69    HE3  LYS   8           HE3      LYS   8  -4.214  -5.051   2.807
   70    HZ1  LYS   8           HZ1      LYS   8  -3.888  -7.685   4.134
   71    HZ2  LYS   8           HZ2      LYS   8  -5.044  -7.359   3.007
   72    HZ3  LYS   8           HZ3      LYS   8  -3.477  -7.324   2.580
   73    H    ARG   9           H        ARG   9   1.719  -3.716   0.647
   74    HA   ARG   9           HA       ARG   9   3.389  -5.844   1.963
   75    HB2  ARG   9           HB2      ARG   9   3.830  -4.686  -0.811
   76    HB3  ARG   9           HB3      ARG   9   4.903  -5.820  -0.005
   77    HG2  ARG   9           HG2      ARG   9   2.085  -6.419  -0.988
   78    HG3  ARG   9           HG3      ARG   9   3.591  -6.803  -1.804
   79    HD2  ARG   9           HD2      ARG   9   2.966  -8.834  -0.909
   80    HD3  ARG   9           HD3      ARG   9   4.225  -8.261   0.184
   81    HE   ARG   9           HE       ARG   9   2.289  -7.473   1.672
   82   HH11  ARG   9          HH11      ARG   9   1.381 -10.179  -0.505
   83   HH12  ARG   9          HH12      ARG   9  -0.106 -10.292   0.479
   84   HH21  ARG   9          HH21      ARG   9   0.516  -7.880   2.604
   85   HH22  ARG   9          HH22      ARG   9  -0.507  -9.231   2.059
   86    H    MET  10           H        MET  10   5.674  -5.209   2.223
   87    HA   MET  10           HA       MET  10   5.744  -2.424   3.233
   88    HB2  MET  10           HB2      MET  10   7.322  -4.919   3.967
   89    HB3  MET  10           HB3      MET  10   7.675  -3.302   4.576
   90    HG2  MET  10           HG2      MET  10   6.381  -4.364   6.245
   91    HG3  MET  10           HG3      MET  10   5.386  -3.127   5.500
   92    HE1  MET  10           HE1      MET  10   5.965  -6.908   6.187
   93    HE2  MET  10           HE2      MET  10   4.767  -7.712   5.150
   94    HE3  MET  10           HE3      MET  10   6.185  -6.926   4.421
   95    H    PHE  11           H        PHE  11   7.296  -0.993   2.742
   96    HA   PHE  11           HA       PHE  11   9.081  -1.577   0.437
   97    HB2  PHE  11           HB2      PHE  11   7.217   0.038   0.074
   98    HB3  PHE  11           HB3      PHE  11   7.817   1.015   1.393
   99    HD1  PHE  11           HD1      PHE  11   9.203  -0.603  -1.740
  100    HD2  PHE  11           HD2      PHE  11   8.973   2.945   0.708
  101    HE1  PHE  11           HE1      PHE  11  10.694   0.592  -3.321
  102    HE2  PHE  11           HE2      PHE  11  10.448   4.137  -0.893
  103    HZ   PHE  11           HZ       PHE  11  11.322   2.959  -2.896
  104    H    ALA  12           H        ALA  12  11.191  -0.822   0.435
  105    HA   ALA  12           HA       ALA  12  12.660  -1.138   2.740
  106    HB1  ALA  12           HB1      ALA  12  13.504  -1.408   0.446
  107    HB2  ALA  12           HB2      ALA  12  13.413   0.352   0.187
  108    HB3  ALA  12           HB3      ALA  12  14.547  -0.321   1.379
  109    H    ASN  13           H        ASN  13  11.364   1.951   1.528
  110    HA   ASN  13           HA       ASN  13  12.774   3.546   3.510
  111    HB2  ASN  13           HB2      ASN  13  11.887   4.218   1.150
  112    HB3  ASN  13           HB3      ASN  13  10.335   4.447   1.967
  113   HD21  ASN  13          HD22      ASN  13  10.702   5.797   4.179
  114   HD22  ASN  13          HD21      ASN  13  11.682   7.253   3.897
  115    H    GLY  14           H        GLY  14  11.339   1.275   4.665
  116    HA2  GLY  14           HA2      GLY  14  10.045   0.738   6.471
  117    HA3  GLY  14           HA3      GLY  14  10.399   2.373   7.058
  118    H    THR  15           H        THR  15   8.505   1.244   4.248
  119    HA   THR  15           HA       THR  15   6.127   2.812   5.195
  120    HB   THR  15           HB       THR  15   7.644   2.855   2.565
  121    HG1  THR  15           HG1      THR  15   8.395   4.252   4.179
  122   HG21  THR  15          HG21      THR  15   5.367   2.948   1.813
  123   HG22  THR  15          HG22      THR  15   4.928   4.099   3.111
  124   HG23  THR  15          HG23      THR  15   6.015   4.587   1.798
  125    H    VAL  16           H        VAL  16   4.122   2.197   3.809
  126    HA   VAL  16           HA       VAL  16   4.225  -0.640   2.923
  127    HB   VAL  16           HB       VAL  16   2.177   0.732   4.639
  128   HG11  VAL  16          HG11      VAL  16   0.782   0.017   2.738
  129   HG12  VAL  16          HG12      VAL  16   1.511  -1.607   2.793
  130   HG13  VAL  16          HG13      VAL  16   0.511  -1.021   4.137
  131   HG21  VAL  16          HG21      VAL  16   3.901  -0.853   5.553
  132   HG22  VAL  16          HG22      VAL  16   2.246  -1.447   5.779
  133   HG23  VAL  16          HG23      VAL  16   3.255  -2.121   4.481
  134    H    TYR  17           H        TYR  17   3.242  -1.164   1.089
  135    HA   TYR  17           HA       TYR  17   1.937   0.891  -0.567
  136    HB2  TYR  17           HB2      TYR  17   3.347   0.649  -2.394
  137    HB3  TYR  17           HB3      TYR  17   4.464   0.761  -1.060
  138    HD1  TYR  17           HD1      TYR  17   5.501  -1.404  -0.127
  139    HD2  TYR  17           HD2      TYR  17   3.280  -1.316  -3.817
  140    HE1  TYR  17           HE1      TYR  17   6.661  -3.475  -0.878
  141    HE2  TYR  17           HE2      TYR  17   4.456  -3.364  -4.575
  142    HH   TYR  17           HH       TYR  17   6.940  -4.979  -2.597
  143    H    TYR  18           H        TYR  18   1.260  -0.398  -2.741
  144    HA   TYR  18           HA       TYR  18   0.048  -2.944  -1.870
  145    HB2  TYR  18           HB2      TYR  18  -1.278  -0.698  -3.402
  146    HB3  TYR  18           HB3      TYR  18  -2.002  -2.249  -2.961
  147    HD1  TYR  18           HD2      TYR  18  -2.482  -2.791  -0.530
  148    HD2  TYR  18           HD1      TYR  18  -0.968   1.078  -1.723
  149    HE1  TYR  18           HE2      TYR  18  -2.802  -1.948   1.755
  150    HE2  TYR  18           HE1      TYR  18  -1.240   1.900   0.574
  151    HH   TYR  18           HH       TYR  18  -1.809   1.333   2.743
  152    H    PHE  19           H        PHE  19   0.363  -4.592  -3.105
  153    HA   PHE  19           HA       PHE  19   1.806  -4.319  -5.700
  154    HB2  PHE  19           HB2      PHE  19   3.154  -5.130  -3.832
  155    HB3  PHE  19           HB3      PHE  19   1.912  -6.272  -3.386
  156    HD1  PHE  19           HD1      PHE  19   4.467  -5.483  -5.992
  157    HD2  PHE  19           HD2      PHE  19   1.774  -8.467  -4.401
  158    HE1  PHE  19           HE1      PHE  19   5.593  -7.227  -7.337
  159    HE2  PHE  19           HE2      PHE  19   2.927 -10.205  -5.720
  160    HZ   PHE  19           HZ       PHE  19   4.822  -9.592  -7.216
  161    H    ASN  20           H        ASN  20   0.834  -5.185  -7.455
  162    HA   ASN  20           HA       ASN  20  -1.580  -6.817  -7.186
  163    HB2  ASN  20           HB2      ASN  20  -1.333  -5.036  -8.924
  164    HB3  ASN  20           HB3      ASN  20  -0.072  -5.995  -9.672
  165   HD21  ASN  20          HD22      ASN  20  -3.565  -5.873  -8.901
  166   HD22  ASN  20          HD21      ASN  20  -4.010  -7.210  -9.923
  167    H    HIS  21           H        HIS  21  -1.163  -8.870  -6.441
  168    HA   HIS  21           HA       HIS  21   1.248 -10.290  -7.230
  169    HB2  HIS  21           HB2      HIS  21   0.438 -12.044  -5.773
  170    HB3  HIS  21           HB3      HIS  21   0.346 -10.483  -4.996
  171    HD1  HIS  21           HD1      HIS  21  -1.936  -9.982  -3.858
  172    HD2  HIS  21           HD2      HIS  21  -2.140 -12.861  -6.924
  173    HE1  HIS  21           HE1      HIS  21  -4.326 -10.883  -3.858
  174    H    ILE  22           H        ILE  22  -1.296  -9.685  -9.202
  175    HA   ILE  22           HA       ILE  22  -1.216 -12.363 -10.504
  176    HB   ILE  22           HB       ILE  22  -2.992  -9.945 -11.018
  177   HG12  ILE  22          HG12      ILE  22  -3.598 -12.626  -9.685
  178   HG13  ILE  22          HG13      ILE  22  -3.471 -11.077  -8.859
  179   HG21  ILE  22          HG21      ILE  22  -2.665 -11.219 -13.097
  180   HG22  ILE  22          HG22      ILE  22  -3.073 -12.731 -12.257
  181   HG23  ILE  22          HG23      ILE  22  -4.289 -11.457 -12.504
  182   HD11  ILE  22          HD11      ILE  22  -5.418 -10.237 -10.232
  183   HD12  ILE  22          HD12      ILE  22  -5.651 -11.915 -10.787
  184   HD13  ILE  22          HD13      ILE  22  -5.779 -11.529  -9.069
  185    H    THR  23           H        THR  23   0.146  -9.170 -10.670
  186    HA   THR  23           HA       THR  23   1.324  -9.742 -13.379
  187    HB   THR  23           HB       THR  23   1.089  -7.332 -13.865
  188    HG1  THR  23           HG1      THR  23  -0.563  -7.267 -11.570
  189   HG21  THR  23          HG21      THR  23  -1.306  -7.226 -14.257
  190   HG22  THR  23          HG22      THR  23  -0.714  -8.856 -14.627
  191   HG23  THR  23          HG23      THR  23  -1.605  -8.558 -13.121
  192    H    ASN  24           H        ASN  24   1.959  -8.580 -10.147
  193    HA   ASN  24           HA       ASN  24   3.755  -8.026  -9.056
  194    HB2  ASN  24           HB2      ASN  24   5.472  -7.884 -11.551
  195    HB3  ASN  24           HB3      ASN  24   6.002  -7.917  -9.881
  196   HD21  ASN  24          HD22      ASN  24   4.686  -9.834 -12.500
  197   HD22  ASN  24          HD21      ASN  24   5.113 -11.398 -11.770
  198    H    ALA  25           H        ALA  25   1.939  -6.112 -10.980
  199    HA   ALA  25           HA       ALA  25   3.458  -3.691 -11.061
  200    HB1  ALA  25           HB1      ALA  25   1.293  -2.624 -11.441
  201    HB2  ALA  25           HB2      ALA  25   1.392  -4.132 -12.368
  202    HB3  ALA  25           HB3      ALA  25   0.439  -4.071 -10.870
  203    H    SER  26           H        SER  26   3.192  -1.737  -9.734
  204    HA   SER  26           HA       SER  26   2.589  -2.249  -6.857
  205    HB2  SER  26           HB2      SER  26   4.693  -1.153  -6.299
  206    HB3  SER  26           HB3      SER  26   5.002  -2.588  -7.303
  207    HG   SER  26           HG       SER  26   4.635  -0.031  -8.460
  208    H    GLN  27           H        GLN  27   1.543  -0.609  -5.833
  209    HA   GLN  27           HA       GLN  27   1.715   2.171  -6.840
  210    HB2  GLN  27           HB2      GLN  27  -0.581   0.390  -7.169
  211    HB3  GLN  27           HB3      GLN  27  -1.015   1.655  -6.051
  212    HG2  GLN  27           HG2      GLN  27   0.207   2.150  -8.800
  213    HG3  GLN  27           HG3      GLN  27  -1.523   2.125  -8.466
  214   HE21  GLN  27          HE22      GLN  27  -0.798   4.454  -9.588
  215   HE22  GLN  27          HE21      GLN  27  -0.650   5.676  -8.335
  216    H    PHE  28           H        PHE  28   1.008   3.730  -5.248
  217    HA   PHE  28           HA       PHE  28   1.213   2.776  -2.431
  218    HB2  PHE  28           HB2      PHE  28   1.548   5.533  -3.640
  219    HB3  PHE  28           HB3      PHE  28   1.471   5.210  -1.911
  220    HD1  PHE  28           HD1      PHE  28   3.141   3.441  -0.925
  221    HD2  PHE  28           HD2      PHE  28   3.682   5.405  -4.731
  222    HE1  PHE  28           HE1      PHE  28   5.566   2.948  -0.841
  223    HE2  PHE  28           HE2      PHE  28   6.106   4.879  -4.650
  224    HZ   PHE  28           HZ       PHE  28   7.053   3.652  -2.703
  225    H    GLU  29           H        GLU  29  -1.138   3.670  -4.810
  226    HA   GLU  29           HA       GLU  29  -3.112   4.850  -3.243
  227    HB2  GLU  29           HB2      GLU  29  -3.213   4.467  -5.738
  228    HB3  GLU  29           HB3      GLU  29  -3.692   2.791  -5.400
  229    HG2  GLU  29           HG2      GLU  29  -5.554   3.809  -3.898
  230    HG3  GLU  29           HG3      GLU  29  -5.117   5.368  -4.578
  231    H    ARG  30           H        ARG  30  -3.741   4.245  -1.315
  232    HA   ARG  30           HA       ARG  30  -3.838   1.566  -0.412
  233    HB2  ARG  30           HB2      ARG  30  -4.165   2.417   1.675
  234    HB3  ARG  30           HB3      ARG  30  -3.390   3.754   0.878
  235    HG2  ARG  30           HG2      ARG  30  -6.328   3.462   1.630
  236    HG3  ARG  30           HG3      ARG  30  -5.143   4.580   2.290
  237    HD2  ARG  30           HD2      ARG  30  -5.009   5.616  -0.056
  238    HD3  ARG  30           HD3      ARG  30  -6.460   4.689  -0.450
  239    HE   ARG  30           HE       ARG  30  -6.302   7.121   1.056
  240   HH11  ARG  30          HH21      ARG  30  -8.416   4.140   1.046
  241   HH12  ARG  30          HH22      ARG  30  -9.624   5.159   1.858
  242   HH21  ARG  30          HH11      ARG  30  -8.171   8.096   1.980
  243   HH22  ARG  30          HH12      ARG  30  -9.552   7.009   2.220
  244    HA   PRO  31           HA       PRO  31  -7.847  -0.147  -1.072
  245    HB2  PRO  31           HB2      PRO  31  -8.060  -0.241   1.949
  246    HB3  PRO  31           HB3      PRO  31  -8.510  -1.504   0.756
  247    HG2  PRO  31           HG2      PRO  31  -6.127  -1.684   2.032
  248    HG3  PRO  31           HG3      PRO  31  -6.223  -1.973   0.289
  249    HD2  PRO  31           HD2      PRO  31  -5.305   0.500   1.740
  250    HD3  PRO  31           HD3      PRO  31  -4.626  -0.287   0.278
  251    H    SER  32           H        SER  32 -10.159  -0.026  -0.520
  252    HA   SER  32           HA       SER  32 -10.985   2.609  -1.133
  253    HB2  SER  32           HB2      SER  32 -12.647   0.186  -0.349
  254    HB3  SER  32           HB3      SER  32 -13.221   1.618  -1.232
  255    HG   SER  32           HG       SER  32 -12.644  -0.138  -2.616
  256    H    GLY  33           H        GLY  33 -12.407   4.058  -0.117
  257    HA2  GLY  33           HA2      GLY  33 -13.683   4.717   1.915
  258    HA3  GLY  33           HA3      GLY  33 -12.315   4.073   2.855
  Start of MODEL   13
    1    H1   LYS   1           H1       LYS   1 -10.573   0.195  -0.919
    2    H2   LYS   1           H2       LYS   1 -11.956  -0.370  -0.259
    3    H3   LYS   1           H3       LYS   1 -11.688  -0.536  -1.900
    4    HA   LYS   1           HA       LYS   1 -10.034  -1.742   0.187
    5    HB2  LYS   1           HB2      LYS   1 -12.573  -2.570  -0.137
    6    HB3  LYS   1           HB3      LYS   1 -11.890  -3.449  -1.482
    7    HG2  LYS   1           HG2      LYS   1 -10.527  -4.764  -0.132
    8    HG3  LYS   1           HG3      LYS   1 -10.432  -3.584   1.170
    9    HD2  LYS   1           HD2      LYS   1 -13.067  -4.989   0.586
   10    HD3  LYS   1           HD3      LYS   1 -11.786  -5.773   1.503
   11    HE2  LYS   1           HE2      LYS   1 -13.112  -4.828   3.175
   12    HE3  LYS   1           HE3      LYS   1 -11.715  -3.759   3.042
   13    HZ1  LYS   1           HZ1      LYS   1 -14.454  -3.215   2.027
   14    HZ2  LYS   1           HZ2      LYS   1 -13.568  -2.332   3.136
   15    HZ3  LYS   1           HZ3      LYS   1 -13.139  -2.258   1.662
   16    H    LEU   2           H        LEU   2  -8.463  -3.268  -0.606
   17    HA   LEU   2           HA       LEU   2  -7.154  -2.738  -3.017
   18    HB2  LEU   2           HB2      LEU   2  -6.106  -4.976  -2.659
   19    HB3  LEU   2           HB3      LEU   2  -5.888  -3.783  -1.406
   20    HG   LEU   2           HG       LEU   2  -8.179  -5.686  -0.984
   21   HD11  LEU   2          HD11      LEU   2  -6.662  -7.448  -0.132
   22   HD12  LEU   2          HD12      LEU   2  -6.496  -7.210  -1.873
   23   HD13  LEU   2          HD13      LEU   2  -5.265  -6.546  -0.776
   24   HD21  LEU   2          HD21      LEU   2  -5.912  -4.785   0.845
   25   HD22  LEU   2          HD22      LEU   2  -7.473  -3.960   0.737
   26   HD23  LEU   2          HD23      LEU   2  -7.400  -5.626   1.320
   27    HA   PRO   3           HA       PRO   3 -10.149  -4.570  -5.810
   28    HB2  PRO   3           HB2      PRO   3  -8.023  -4.222  -7.895
   29    HB3  PRO   3           HB3      PRO   3  -9.712  -3.655  -7.901
   30    HG2  PRO   3           HG2      PRO   3  -7.635  -1.941  -7.466
   31    HG3  PRO   3           HG3      PRO   3  -9.198  -1.772  -6.601
   32    HD2  PRO   3           HD2      PRO   3  -6.624  -2.991  -5.600
   33    HD3  PRO   3           HD3      PRO   3  -7.781  -1.897  -4.780
   34    HA   PRO   4           HA       PRO   4  -9.213  -8.867  -6.611
   35    HB2  PRO   4           HB2      PRO   4  -9.574  -8.265  -9.556
   36    HB3  PRO   4           HB3      PRO   4 -10.179  -9.663  -8.610
   37    HG2  PRO   4           HG2      PRO   4 -11.835  -7.600  -9.154
   38    HG3  PRO   4           HG3      PRO   4 -11.805  -8.293  -7.499
   39    HD2  PRO   4           HD2      PRO   4 -10.453  -5.791  -8.519
   40    HD3  PRO   4           HD3      PRO   4 -11.346  -6.047  -6.988
   41    H    GLY   5           H        GLY   5  -7.271  -9.805  -6.493
   42    HA2  GLY   5           HA2      GLY   5  -5.195 -10.547  -7.167
   43    HA3  GLY   5           HA3      GLY   5  -5.229  -9.447  -8.546
   44    H    TRP   6           H        TRP   6  -5.883  -7.435  -5.898
   45    HA   TRP   6           HA       TRP   6  -3.019  -6.720  -5.673
   46    HB2  TRP   6           HB2      TRP   6  -5.537  -5.270  -4.882
   47    HB3  TRP   6           HB3      TRP   6  -3.912  -4.701  -4.535
   48    HD1  TRP   6           HD1      TRP   6  -6.179  -5.449  -7.539
   49    HE1  TRP   6           HE1      TRP   6  -5.460  -3.969  -9.524
   50    HE3  TRP   6           HE3      TRP   6  -1.866  -3.538  -5.588
   51    HZ2  TRP   6           HZ2      TRP   6  -3.238  -2.255 -10.201
   52    HZ3  TRP   6           HZ3      TRP   6  -0.436  -2.036  -6.945
   53    HH2  TRP   6           HH2      TRP   6  -1.113  -1.372  -9.236
   54    H    GLU   7           H        GLU   7  -2.027  -6.227  -3.680
   55    HA   GLU   7           HA       GLU   7  -3.097  -7.382  -1.191
   56    HB2  GLU   7           HB2      GLU   7  -1.075  -8.589  -2.959
   57    HB3  GLU   7           HB3      GLU   7  -0.350  -8.172  -1.419
   58    HG2  GLU   7           HG2      GLU   7  -2.975  -9.716  -1.592
   59    HG3  GLU   7           HG3      GLU   7  -1.392 -10.499  -1.649
   60    H    LYS   8           H        LYS   8  -1.722  -6.719   0.697
   61    HA   LYS   8           HA       LYS   8  -0.576  -3.993   0.224
   62    HB2  LYS   8           HB2      LYS   8  -1.233  -3.262   2.263
   63    HB3  LYS   8           HB3      LYS   8  -2.599  -4.224   1.752
   64    HG2  LYS   8           HG2      LYS   8  -0.485  -5.007   3.803
   65    HG3  LYS   8           HG3      LYS   8  -2.111  -4.447   4.146
   66    HD2  LYS   8           HD2      LYS   8  -1.427  -7.056   2.740
   67    HD3  LYS   8           HD3      LYS   8  -1.866  -6.883   4.434
   68    HE2  LYS   8           HE2      LYS   8  -4.095  -6.105   3.879
   69    HE3  LYS   8           HE3      LYS   8  -3.683  -6.007   2.156
   70    HZ1  LYS   8           HZ1      LYS   8  -3.706  -8.528   3.698
   71    HZ2  LYS   8           HZ2      LYS   8  -4.879  -8.050   2.630
   72    HZ3  LYS   8           HZ3      LYS   8  -3.345  -8.352   2.101
   73    H    ARG   9           H        ARG   9   1.473  -3.453   0.841
   74    HA   ARG   9           HA       ARG   9   3.179  -5.544   2.138
   75    HB2  ARG   9           HB2      ARG   9   3.595  -4.327  -0.626
   76    HB3  ARG   9           HB3      ARG   9   4.844  -5.228   0.232
   77    HG2  ARG   9           HG2      ARG   9   2.174  -6.359  -0.696
   78    HG3  ARG   9           HG3      ARG   9   3.721  -6.565  -1.505
   79    HD2  ARG   9           HD2      ARG   9   4.647  -7.815   0.350
   80    HD3  ARG   9           HD3      ARG   9   3.234  -7.513   1.351
   81    HE   ARG   9           HE       ARG   9   3.408  -9.362  -0.964
   82   HH11  ARG   9          HH21      ARG   9   1.213  -8.023   1.531
   83   HH12  ARG   9          HH22      ARG   9   0.193  -9.461   1.365
   84   HH21  ARG   9          HH11      ARG   9   1.811 -11.076  -1.032
   85   HH22  ARG   9          HH12      ARG   9   0.428 -10.853   0.064
   86    H    MET  10           H        MET  10   5.202  -4.887   2.887
   87    HA   MET  10           HA       MET  10   5.401  -2.072   3.707
   88    HB2  MET  10           HB2      MET  10   7.176  -4.509   4.196
   89    HB3  MET  10           HB3      MET  10   7.477  -2.905   4.853
   90    HG2  MET  10           HG2      MET  10   5.100  -4.696   5.451
   91    HG3  MET  10           HG3      MET  10   6.441  -4.326   6.525
   92    HE1  MET  10           HE1      MET  10   6.893  -1.852   7.530
   93    HE2  MET  10           HE2      MET  10   6.669  -1.023   5.969
   94    HE3  MET  10           HE3      MET  10   5.734  -0.512   7.387
   95    H    PHE  11           H        PHE  11   6.786  -0.598   2.893
   96    HA   PHE  11           HA       PHE  11   8.584  -1.324   0.644
   97    HB2  PHE  11           HB2      PHE  11   6.842   0.469   0.329
   98    HB3  PHE  11           HB3      PHE  11   7.621   1.393   1.600
   99    HD1  PHE  11           HD1      PHE  11   8.424  -0.365  -1.641
  100    HD2  PHE  11           HD2      PHE  11   9.238   2.999   0.939
  101    HE1  PHE  11           HE1      PHE  11   9.992   0.556  -3.330
  102    HE2  PHE  11           HE2      PHE  11  10.784   3.923  -0.772
  103    HZ   PHE  11           HZ       PHE  11  11.176   2.700  -2.889
  104    H    ALA  12           H        ALA  12  10.740  -1.272   0.938
  105    HA   ALA  12           HA       ALA  12  11.864  -1.646   3.382
  106    HB1  ALA  12           HB1      ALA  12  12.798  -2.362   1.223
  107    HB2  ALA  12           HB2      ALA  12  13.228  -0.678   0.835
  108    HB3  ALA  12           HB3      ALA  12  14.014  -1.511   2.192
  109    H    ASN  13           H        ASN  13  11.748   1.566   1.764
  110    HA   ASN  13           HA       ASN  13  13.482   2.840   3.650
  111    HB2  ASN  13           HB2      ASN  13  11.386   3.972   1.769
  112    HB3  ASN  13           HB3      ASN  13  12.588   4.926   2.627
  113   HD21  ASN  13          HD22      ASN  13  14.659   5.177   1.674
  114   HD22  ASN  13          HD21      ASN  13  15.094   4.239   0.254
  115    H    GLY  14           H        GLY  14  10.426   1.586   4.344
  116    HA2  GLY  14           HA2      GLY  14   9.453   1.768   6.499
  117    HA3  GLY  14           HA3      GLY  14  10.133   3.389   6.702
  118    H    THR  15           H        THR  15   7.836   1.572   4.584
  119    HA   THR  15           HA       THR  15   5.712   3.533   4.897
  120    HB   THR  15           HB       THR  15   7.457   3.445   2.427
  121    HG1  THR  15           HG1      THR  15   7.419   5.001   4.298
  122   HG21  THR  15          HG21      THR  15   5.824   4.841   1.206
  123   HG22  THR  15          HG22      THR  15   5.283   3.173   1.378
  124   HG23  THR  15          HG23      THR  15   4.587   4.454   2.415
  125    H    VAL  16           H        VAL  16   3.786   2.772   3.397
  126    HA   VAL  16           HA       VAL  16   3.915  -0.161   2.905
  127    HB   VAL  16           HB       VAL  16   1.769   1.468   4.250
  128   HG11  VAL  16          HG11      VAL  16   1.174  -1.076   2.671
  129   HG12  VAL  16          HG12      VAL  16   0.096  -0.309   3.853
  130   HG13  VAL  16          HG13      VAL  16   0.494   0.541   2.359
  131   HG21  VAL  16          HG21      VAL  16   1.674  -0.551   5.657
  132   HG22  VAL  16          HG22      VAL  16   2.769  -1.397   4.540
  133   HG23  VAL  16          HG23      VAL  16   3.357  -0.015   5.500
  134    H    TYR  17           H        TYR  17   3.014  -0.896   1.047
  135    HA   TYR  17           HA       TYR  17   1.745   1.035  -0.793
  136    HB2  TYR  17           HB2      TYR  17   3.183   0.646  -2.587
  137    HB3  TYR  17           HB3      TYR  17   4.264   0.868  -1.243
  138    HD1  TYR  17           HD1      TYR  17   5.324  -1.181  -0.125
  139    HD2  TYR  17           HD2      TYR  17   3.206  -1.413  -3.882
  140    HE1  TYR  17           HE1      TYR  17   6.522  -3.279  -0.680
  141    HE2  TYR  17           HE2      TYR  17   4.383  -3.515  -4.408
  142    HH   TYR  17           HH       TYR  17   6.849  -4.924  -2.256
  143    H    TYR  18           H        TYR  18   0.983  -0.310  -2.823
  144    HA   TYR  18           HA       TYR  18  -0.043  -2.948  -1.930
  145    HB2  TYR  18           HB2      TYR  18  -1.425  -0.724  -3.452
  146    HB3  TYR  18           HB3      TYR  18  -1.992  -2.393  -3.490
  147    HD1  TYR  18           HD2      TYR  18  -1.129   0.371  -1.110
  148    HD2  TYR  18           HD1      TYR  18  -3.316  -3.296  -1.738
  149    HE1  TYR  18           HE2      TYR  18  -2.017   0.523   1.175
  150    HE2  TYR  18           HE1      TYR  18  -4.337  -3.052   0.522
  151    HH   TYR  18           HH       TYR  18  -3.443  -0.418   2.746
  152    H    PHE  19           H        PHE  19   0.157  -4.611  -3.202
  153    HA   PHE  19           HA       PHE  19   1.745  -4.387  -5.726
  154    HB2  PHE  19           HB2      PHE  19   3.049  -5.211  -3.841
  155    HB3  PHE  19           HB3      PHE  19   1.789  -6.325  -3.383
  156    HD1  PHE  19           HD1      PHE  19   4.417  -5.621  -5.932
  157    HD2  PHE  19           HD2      PHE  19   1.617  -8.525  -4.399
  158    HE1  PHE  19           HE1      PHE  19   5.454  -7.364  -7.345
  159    HE2  PHE  19           HE2      PHE  19   2.736 -10.287  -5.733
  160    HZ   PHE  19           HZ       PHE  19   4.603  -9.701  -7.269
  161    H    ASN  20           H        ASN  20   0.809  -5.329  -7.516
  162    HA   ASN  20           HA       ASN  20  -1.668  -6.890  -7.158
  163    HB2  ASN  20           HB2      ASN  20  -1.539  -5.116  -8.892
  164    HB3  ASN  20           HB3      ASN  20  -0.280  -6.050  -9.697
  165   HD21  ASN  20          HD22      ASN  20  -3.785  -5.935  -8.937
  166   HD22  ASN  20          HD21      ASN  20  -4.161  -7.294  -9.972
  167    H    HIS  21           H        HIS  21  -1.297  -8.922  -6.471
  168    HA   HIS  21           HA       HIS  21   1.109 -10.389  -7.171
  169    HB2  HIS  21           HB2      HIS  21   0.199 -12.090  -5.675
  170    HB3  HIS  21           HB3      HIS  21   0.179 -10.504  -4.936
  171    HD1  HIS  21           HD1      HIS  21  -2.130  -9.795  -3.894
  172    HD2  HIS  21           HD2      HIS  21  -2.357 -12.898  -6.738
  173    HE1  HIS  21           HE1      HIS  21  -4.531 -10.618  -3.876
  174    H    ILE  22           H        ILE  22  -1.485  -9.822  -9.148
  175    HA   ILE  22           HA       ILE  22  -1.277 -12.520 -10.412
  176    HB   ILE  22           HB       ILE  22  -3.215 -10.222 -10.862
  177   HG12  ILE  22          HG12      ILE  22  -3.506 -13.020  -9.667
  178   HG13  ILE  22          HG13      ILE  22  -3.619 -11.490  -8.804
  179   HG21  ILE  22          HG21      ILE  22  -4.391 -11.720 -12.459
  180   HG22  ILE  22          HG22      ILE  22  -2.793 -11.313 -13.030
  181   HG23  ILE  22          HG23      ILE  22  -3.077 -12.910 -12.301
  182   HD11  ILE  22          HD11      ILE  22  -5.662 -10.939 -10.230
  183   HD12  ILE  22          HD12      ILE  22  -5.618 -12.633 -10.776
  184   HD13  ILE  22          HD13      ILE  22  -5.837 -12.267  -9.061
  185    H    THR  23           H        THR  23  -0.076  -9.260 -10.669
  186    HA   THR  23           HA       THR  23   1.057  -9.865 -13.394
  187    HB   THR  23           HB       THR  23   0.690  -7.498 -13.956
  188    HG1  THR  23           HG1      THR  23  -0.850  -7.404 -11.581
  189   HG21  THR  23          HG21      THR  23  -1.087  -9.128 -14.561
  190   HG22  THR  23          HG22      THR  23  -1.922  -8.775 -13.033
  191   HG23  THR  23          HG23      THR  23  -1.715  -7.498 -14.249
  192    H    ASN  24           H        ASN  24   1.782  -8.610 -10.214
  193    HA   ASN  24           HA       ASN  24   3.593  -7.888  -9.230
  194    HB2  ASN  24           HB2      ASN  24   5.211  -7.854 -11.793
  195    HB3  ASN  24           HB3      ASN  24   5.795  -7.807 -10.141
  196   HD21  ASN  24          HD22      ASN  24   4.431  -9.848 -12.637
  197   HD22  ASN  24          HD21      ASN  24   4.889 -11.375 -11.853
  198    H    ALA  25           H        ALA  25   1.619  -6.157 -11.148
  199    HA   ALA  25           HA       ALA  25   2.993  -3.636 -11.293
  200    HB1  ALA  25           HB1      ALA  25   0.758  -2.686 -11.524
  201    HB2  ALA  25           HB2      ALA  25   0.880  -4.164 -12.496
  202    HB3  ALA  25           HB3      ALA  25   0.014  -4.185 -10.946
  203    H    SER  26           H        SER  26   2.408  -1.665  -9.823
  204    HA   SER  26           HA       SER  26   1.764  -2.316  -7.052
  205    HB2  SER  26           HB2      SER  26   4.592  -1.636  -7.902
  206    HB3  SER  26           HB3      SER  26   3.994  -1.428  -6.240
  207    HG   SER  26           HG       SER  26   3.435  -3.860  -7.486
  208    H    GLN  27           H        GLN  27   1.368  -0.502  -5.754
  209    HA   GLN  27           HA       GLN  27   1.910   2.188  -6.818
  210    HB2  GLN  27           HB2      GLN  27  -0.394   2.929  -6.721
  211    HB3  GLN  27           HB3      GLN  27  -0.254   1.580  -7.844
  212    HG2  GLN  27           HG2      GLN  27  -1.144   0.051  -6.028
  213    HG3  GLN  27           HG3      GLN  27  -1.354   1.461  -4.999
  214   HE21  GLN  27          HE22      GLN  27  -3.498   2.117  -4.922
  215   HE22  GLN  27          HE21      GLN  27  -4.547   2.015  -6.348
  216    H    PHE  28           H        PHE  28   2.002   3.799  -5.225
  217    HA   PHE  28           HA       PHE  28   1.871   2.968  -2.399
  218    HB2  PHE  28           HB2      PHE  28   2.569   5.591  -3.769
  219    HB3  PHE  28           HB3      PHE  28   2.572   5.348  -2.028
  220    HD1  PHE  28           HD2      PHE  28   3.975   3.326  -1.110
  221    HD2  PHE  28           HD1      PHE  28   4.616   5.195  -4.947
  222    HE1  PHE  28           HE2      PHE  28   6.305   2.484  -1.138
  223    HE2  PHE  28           HE1      PHE  28   6.942   4.330  -4.974
  224    HZ   PHE  28           HZ       PHE  28   7.791   2.981  -3.067
  225    H    GLU  29           H        GLU  29  -0.335   4.273  -4.710
  226    HA   GLU  29           HA       GLU  29  -2.024   5.842  -2.992
  227    HB2  GLU  29           HB2      GLU  29  -2.024   6.052  -5.408
  228    HB3  GLU  29           HB3      GLU  29  -2.376   4.350  -5.623
  229    HG2  GLU  29           HG2      GLU  29  -4.320   5.732  -6.116
  230    HG3  GLU  29           HG3      GLU  29  -4.633   4.628  -4.779
  231    H    ARG  30           H        ARG  30  -2.826   4.951  -1.149
  232    HA   ARG  30           HA       ARG  30  -3.291   2.126  -0.898
  233    HB2  ARG  30           HB2      ARG  30  -4.207   2.917   1.454
  234    HB3  ARG  30           HB3      ARG  30  -2.521   2.735   1.045
  235    HG2  ARG  30           HG2      ARG  30  -2.658   4.637   2.346
  236    HG3  ARG  30           HG3      ARG  30  -2.262   5.161   0.732
  237    HD2  ARG  30           HD2      ARG  30  -5.167   5.270   1.143
  238    HD3  ARG  30           HD3      ARG  30  -4.349   6.033   2.485
  239    HE   ARG  30           HE       ARG  30  -3.314   7.616   1.035
  240   HH11  ARG  30          HH11      ARG  30  -5.631   5.611  -0.781
  241   HH12  ARG  30          HH12      ARG  30  -5.545   6.684  -2.165
  242   HH21  ARG  30          HH22      ARG  30  -3.162   8.813  -0.889
  243   HH22  ARG  30          HH21      ARG  30  -3.949   8.130  -2.299
  244    HA   PRO  31           HA       PRO  31  -7.498   2.591  -2.371
  245    HB2  PRO  31           HB2      PRO  31  -8.088   0.044  -3.000
  246    HB3  PRO  31           HB3      PRO  31  -6.825   0.964  -3.861
  247    HG2  PRO  31           HG2      PRO  31  -6.428  -1.007  -1.580
  248    HG3  PRO  31           HG3      PRO  31  -5.583  -0.967  -3.164
  249    HD2  PRO  31           HD2      PRO  31  -4.614   0.186  -0.854
  250    HD3  PRO  31           HD3      PRO  31  -4.230   0.797  -2.484
  251    H    SER  32           H        SER  32  -7.694   3.290  -0.056
  252    HA   SER  32           HA       SER  32  -8.565   1.802   2.103
  253    HB2  SER  32           HB2      SER  32  -9.419   4.611   1.298
  254    HB3  SER  32           HB3      SER  32  -9.504   3.930   2.936
  255    HG   SER  32           HG       SER  32  -7.614   5.167   2.613
  256    H    GLY  33           H        GLY  33 -10.710   1.900   3.239
  257    HA2  GLY  33           HA2      GLY  33 -13.049   1.869   3.331
  258    HA3  GLY  33           HA3      GLY  33 -13.141   1.920   1.565
  Start of MODEL   14
    1    H1   LYS   1           H1       LYS   1 -14.512  -0.148  -1.136
    2    H2   LYS   1           H2       LYS   1 -13.422   0.138  -2.363
    3    H3   LYS   1           H3       LYS   1 -12.881  -0.281  -0.888
    4    HA   LYS   1           HA       LYS   1 -13.641  -2.464  -1.025
    5    HB2  LYS   1           HB2      LYS   1 -15.822  -1.963  -2.137
    6    HB3  LYS   1           HB3      LYS   1 -14.964  -1.661  -3.646
    7    HG2  LYS   1           HG2      LYS   1 -13.988  -4.182  -3.019
    8    HG3  LYS   1           HG3      LYS   1 -15.529  -4.239  -2.204
    9    HD2  LYS   1           HD2      LYS   1 -15.629  -5.219  -4.434
   10    HD3  LYS   1           HD3      LYS   1 -16.706  -3.837  -4.310
   11    HE2  LYS   1           HE2      LYS   1 -15.476  -4.043  -6.480
   12    HE3  LYS   1           HE3      LYS   1 -15.308  -2.477  -5.690
   13    HZ1  LYS   1           HZ1      LYS   1 -13.217  -3.487  -6.621
   14    HZ2  LYS   1           HZ2      LYS   1 -13.103  -2.969  -5.076
   15    HZ3  LYS   1           HZ3      LYS   1 -13.219  -4.566  -5.372
   16    H    LEU   2           H        LEU   2 -11.574  -3.156  -1.187
   17    HA   LEU   2           HA       LEU   2  -9.609  -2.427  -2.834
   18    HB2  LEU   2           HB2      LEU   2  -9.764  -3.983  -0.763
   19    HB3  LEU   2           HB3      LEU   2 -10.036  -5.285  -1.911
   20    HG   LEU   2           HG       LEU   2  -7.807  -4.741  -2.952
   21   HD11  LEU   2          HD11      LEU   2  -7.329  -3.024  -0.470
   22   HD12  LEU   2          HD12      LEU   2  -6.245  -3.302  -1.841
   23   HD13  LEU   2          HD13      LEU   2  -7.685  -2.320  -2.053
   24   HD21  LEU   2          HD21      LEU   2  -8.020  -6.540  -1.306
   25   HD22  LEU   2          HD22      LEU   2  -6.513  -5.670  -0.986
   26   HD23  LEU   2          HD23      LEU   2  -7.921  -5.380   0.041
   27    HA   PRO   3           HA       PRO   3 -10.695  -4.201  -6.833
   28    HB2  PRO   3           HB2      PRO   3  -8.579  -3.331  -8.347
   29    HB3  PRO   3           HB3      PRO   3  -9.875  -2.258  -7.740
   30    HG2  PRO   3           HG2      PRO   3  -7.130  -2.713  -6.560
   31    HG3  PRO   3           HG3      PRO   3  -7.978  -1.167  -6.832
   32    HD2  PRO   3           HD2      PRO   3  -7.928  -2.478  -4.411
   33    HD3  PRO   3           HD3      PRO   3  -9.309  -1.467  -4.945
   34    HA   PRO   4           HA       PRO   4  -9.164  -8.191  -7.358
   35    HB2  PRO   4           HB2      PRO   4  -8.427  -7.521 -10.218
   36    HB3  PRO   4           HB3      PRO   4  -9.257  -8.975  -9.576
   37    HG2  PRO   4           HG2      PRO   4 -10.704  -6.962 -10.645
   38    HG3  PRO   4           HG3      PRO   4 -11.239  -7.716  -9.106
   39    HD2  PRO   4           HD2      PRO   4  -9.772  -5.111  -9.519
   40    HD3  PRO   4           HD3      PRO   4 -11.120  -5.497  -8.410
   41    H    GLY   5           H        GLY   5  -7.440  -8.741  -6.182
   42    HA2  GLY   5           HA2      GLY   5  -5.388  -9.716  -5.934
   43    HA3  GLY   5           HA3      GLY   5  -4.927  -9.165  -7.544
   44    H    TRP   6           H        TRP   6  -5.871  -6.372  -5.999
   45    HA   TRP   6           HA       TRP   6  -3.098  -5.508  -5.514
   46    HB2  TRP   6           HB2      TRP   6  -5.820  -4.165  -5.410
   47    HB3  TRP   6           HB3      TRP   6  -4.333  -3.357  -4.956
   48    HD1  TRP   6           HD1      TRP   6  -6.252  -4.483  -8.027
   49    HE1  TRP   6           HE1      TRP   6  -5.172  -3.428 -10.118
   50    HE3  TRP   6           HE3      TRP   6  -2.009  -2.598  -5.886
   51    HZ2  TRP   6           HZ2      TRP   6  -2.757  -1.978 -10.773
   52    HZ3  TRP   6           HZ3      TRP   6  -0.362  -1.383  -7.241
   53    HH2  TRP   6           HH2      TRP   6  -0.696  -1.062  -9.679
   54    H    GLU   7           H        GLU   7  -2.205  -6.224  -3.520
   55    HA   GLU   7           HA       GLU   7  -3.673  -5.187  -1.196
   56    HB2  GLU   7           HB2      GLU   7  -3.436  -7.289   0.131
   57    HB3  GLU   7           HB3      GLU   7  -4.697  -7.163  -1.058
   58    HG2  GLU   7           HG2      GLU   7  -3.918  -9.364  -1.189
   59    HG3  GLU   7           HG3      GLU   7  -3.390  -8.557  -2.658
   60    H    LYS   8           H        LYS   8  -2.601  -5.108   0.771
   61    HA   LYS   8           HA       LYS   8  -0.537  -3.447   0.659
   62    HB2  LYS   8           HB2      LYS   8  -0.570  -3.381   2.993
   63    HB3  LYS   8           HB3      LYS   8  -2.207  -3.736   2.486
   64    HG2  LYS   8           HG2      LYS   8  -0.213  -5.774   3.587
   65    HG3  LYS   8           HG3      LYS   8  -1.420  -4.952   4.528
   66    HD2  LYS   8           HD2      LYS   8  -3.094  -6.309   3.937
   67    HD3  LYS   8           HD3      LYS   8  -2.653  -6.398   2.249
   68    HE2  LYS   8           HE2      LYS   8  -1.179  -7.878   4.452
   69    HE3  LYS   8           HE3      LYS   8  -2.508  -8.577   3.517
   70    HZ1  LYS   8           HZ1      LYS   8  -0.074  -7.509   2.204
   71    HZ2  LYS   8           HZ2      LYS   8  -0.232  -9.097   2.649
   72    HZ3  LYS   8           HZ3      LYS   8  -1.213  -8.445   1.517
   73    H    ARG   9           H        ARG   9   1.543  -3.261   0.984
   74    HA   ARG   9           HA       ARG   9   3.293  -5.527   1.848
   75    HB2  ARG   9           HB2      ARG   9   3.676  -3.753  -0.596
   76    HB3  ARG   9           HB3      ARG   9   4.951  -4.775   0.070
   77    HG2  ARG   9           HG2      ARG   9   2.347  -5.758  -1.136
   78    HG3  ARG   9           HG3      ARG   9   3.913  -5.673  -1.948
   79    HD2  ARG   9           HD2      ARG   9   4.899  -7.299  -0.467
   80    HD3  ARG   9           HD3      ARG   9   3.432  -7.379   0.513
   81    HE   ARG   9           HE       ARG   9   3.897  -8.662  -2.080
   82   HH11  ARG   9          HH21      ARG   9   1.326  -7.441   0.039
   83   HH12  ARG   9          HH22      ARG   9   0.166  -8.576  -0.607
   84   HH21  ARG   9          HH11      ARG   9   2.174  -9.992  -2.968
   85   HH22  ARG   9          HH12      ARG   9   0.556  -9.705  -2.289
   86    H    MET  10           H        MET  10   5.255  -4.849   2.796
   87    HA   MET  10           HA       MET  10   5.384  -2.084   3.813
   88    HB2  MET  10           HB2      MET  10   5.833  -4.080   5.283
   89    HB3  MET  10           HB3      MET  10   7.218  -4.475   4.253
   90    HG2  MET  10           HG2      MET  10   7.982  -3.333   6.239
   91    HG3  MET  10           HG3      MET  10   8.269  -2.311   4.836
   92    HE1  MET  10           HE1      MET  10   8.632  -0.107   6.057
   93    HE2  MET  10           HE2      MET  10   7.652   0.458   7.428
   94    HE3  MET  10           HE3      MET  10   8.612  -1.032   7.578
   95    H    PHE  11           H        PHE  11   6.897  -0.603   3.180
   96    HA   PHE  11           HA       PHE  11   8.785  -1.283   0.979
   97    HB2  PHE  11           HB2      PHE  11   6.992   0.459   0.541
   98    HB3  PHE  11           HB3      PHE  11   7.725   1.443   1.787
   99    HD1  PHE  11           HD1      PHE  11   8.547  -0.386  -1.397
  100    HD2  PHE  11           HD2      PHE  11   9.414   2.993   1.146
  101    HE1  PHE  11           HE1      PHE  11  10.081   0.523  -3.121
  102    HE2  PHE  11           HE2      PHE  11  10.926   3.908  -0.601
  103    HZ   PHE  11           HZ       PHE  11  11.271   2.671  -2.722
  104    H    ALA  12           H        ALA  12  10.816  -1.544   1.677
  105    HA   ALA  12           HA       ALA  12  11.595  -1.385   4.307
  106    HB1  ALA  12           HB1      ALA  12  12.594  -2.819   2.575
  107    HB2  ALA  12           HB2      ALA  12  13.340  -1.394   1.809
  108    HB3  ALA  12           HB3      ALA  12  13.838  -1.898   3.437
  109    H    ASN  13           H        ASN  13  11.648   1.368   2.129
  110    HA   ASN  13           HA       ASN  13  13.597   2.878   3.667
  111    HB2  ASN  13           HB2      ASN  13  12.732   3.120   1.158
  112    HB3  ASN  13           HB3      ASN  13  11.517   4.165   1.907
  113   HD21  ASN  13          HD22      ASN  13  12.944   5.604   3.806
  114   HD22  ASN  13          HD21      ASN  13  14.225   6.487   2.950
  115    H    GLY  14           H        GLY  14  10.460   1.869   4.481
  116    HA2  GLY  14           HA2      GLY  14   9.511   2.373   6.608
  117    HA3  GLY  14           HA3      GLY  14  10.199   4.001   6.557
  118    H    THR  15           H        THR  15   7.975   1.934   4.553
  119    HA   THR  15           HA       THR  15   5.782   3.831   4.733
  120    HB   THR  15           HB       THR  15   7.505   3.633   2.248
  121    HG1  THR  15           HG1      THR  15   7.464   5.305   4.052
  122   HG21  THR  15          HG21      THR  15   5.822   4.963   1.004
  123   HG22  THR  15          HG22      THR  15   5.314   3.297   1.265
  124   HG23  THR  15          HG23      THR  15   4.624   4.610   2.263
  125    H    VAL  16           H        VAL  16   3.889   2.903   3.272
  126    HA   VAL  16           HA       VAL  16   4.157  -0.018   2.838
  127    HB   VAL  16           HB       VAL  16   2.079   1.449   4.447
  128   HG11  VAL  16          HG11      VAL  16   1.422  -1.101   2.910
  129   HG12  VAL  16          HG12      VAL  16   0.460  -0.388   4.217
  130   HG13  VAL  16          HG13      VAL  16   0.646   0.487   2.699
  131   HG21  VAL  16          HG21      VAL  16   3.881   0.048   5.482
  132   HG22  VAL  16          HG22      VAL  16   2.259  -0.575   5.826
  133   HG23  VAL  16          HG23      VAL  16   3.260  -1.357   4.583
  134    H    TYR  17           H        TYR  17   3.008  -0.814   1.088
  135    HA   TYR  17           HA       TYR  17   1.623   1.130  -0.677
  136    HB2  TYR  17           HB2      TYR  17   3.030   0.745  -2.540
  137    HB3  TYR  17           HB3      TYR  17   4.100   1.048  -1.215
  138    HD1  TYR  17           HD1      TYR  17   5.373  -0.815  -0.138
  139    HD2  TYR  17           HD2      TYR  17   3.064  -1.407  -3.738
  140    HE1  TYR  17           HE1      TYR  17   6.757  -2.809  -0.707
  141    HE2  TYR  17           HE2      TYR  17   4.401  -3.405  -4.265
  142    HH   TYR  17           HH       TYR  17   6.257  -4.642  -3.720
  143    H    TYR  18           H        TYR  18   0.717  -0.191  -2.679
  144    HA   TYR  18           HA       TYR  18  -0.183  -2.901  -1.802
  145    HB2  TYR  18           HB2      TYR  18  -1.564  -0.678  -3.319
  146    HB3  TYR  18           HB3      TYR  18  -2.054  -2.362  -3.511
  147    HD1  TYR  18           HD2      TYR  18  -1.277   0.083  -0.733
  148    HD2  TYR  18           HD1      TYR  18  -3.737  -3.179  -2.116
  149    HE1  TYR  18           HE2      TYR  18  -2.351   0.017   1.421
  150    HE2  TYR  18           HE1      TYR  18  -4.928  -3.178   0.081
  151    HH   TYR  18           HH       TYR  18  -5.391  -1.506   1.957
  152    H    PHE  19           H        PHE  19   0.245  -4.606  -2.977
  153    HA   PHE  19           HA       PHE  19   1.603  -4.322  -5.620
  154    HB2  PHE  19           HB2      PHE  19   3.012  -5.233  -3.902
  155    HB3  PHE  19           HB3      PHE  19   1.760  -6.334  -3.358
  156    HD1  PHE  19           HD2      PHE  19   1.204  -8.411  -4.714
  157    HD2  PHE  19           HD1      PHE  19   4.477  -5.778  -5.737
  158    HE1  PHE  19           HE2      PHE  19   2.283 -10.214  -6.034
  159    HE2  PHE  19           HE1      PHE  19   5.455  -7.551  -7.146
  160    HZ   PHE  19           HZ       PHE  19   4.338  -9.766  -7.328
  161    H    ASN  20           H        ASN  20   0.728  -5.400  -7.355
  162    HA   ASN  20           HA       ASN  20  -1.888  -6.702  -6.919
  163    HB2  ASN  20           HB2      ASN  20  -1.685  -4.890  -8.604
  164    HB3  ASN  20           HB3      ASN  20  -0.554  -5.904  -9.503
  165   HD21  ASN  20          HD22      ASN  20  -3.910  -5.539  -8.442
  166   HD22  ASN  20          HD21      ASN  20  -4.587  -6.880  -9.301
  167    H    HIS  21           H        HIS  21  -1.576  -8.808  -6.245
  168    HA   HIS  21           HA       HIS  21   0.634 -10.355  -7.328
  169    HB2  HIS  21           HB2      HIS  21  -0.097 -12.099  -5.831
  170    HB3  HIS  21           HB3      HIS  21  -0.041 -10.557  -5.014
  171    HD1  HIS  21           HD1      HIS  21  -1.965 -10.278  -3.408
  172    HD2  HIS  21           HD2      HIS  21  -2.937 -12.536  -6.846
  173    HE1  HIS  21           HE1      HIS  21  -4.443 -10.953  -3.200
  174    H    ILE  22           H        ILE  22  -2.039  -9.569  -9.017
  175    HA   ILE  22           HA       ILE  22  -2.175 -12.196 -10.423
  176    HB   ILE  22           HB       ILE  22  -3.853  -9.669 -10.663
  177   HG12  ILE  22          HG12      ILE  22  -4.562 -12.457  -9.631
  178   HG13  ILE  22          HG13      ILE  22  -4.229 -11.068  -8.607
  179   HG21  ILE  22          HG21      ILE  22  -3.711 -10.724 -12.879
  180   HG22  ILE  22          HG22      ILE  22  -4.123 -12.303 -12.178
  181   HG23  ILE  22          HG23      ILE  22  -5.304 -10.974 -12.209
  182   HD11  ILE  22          HD11      ILE  22  -6.170  -9.864  -9.699
  183   HD12  ILE  22          HD12      ILE  22  -6.609 -11.421 -10.446
  184   HD13  ILE  22          HD13      ILE  22  -6.577 -11.263  -8.685
  185    H    THR  23           H        THR  23  -0.640  -9.071 -10.566
  186    HA   THR  23           HA       THR  23   0.325  -9.604 -13.364
  187    HB   THR  23           HB       THR  23   0.056  -7.199 -13.819
  188    HG1  THR  23           HG1      THR  23  -1.353  -7.121 -11.363
  189   HG21  THR  23          HG21      THR  23  -1.848  -8.701 -14.390
  190   HG22  THR  23          HG22      THR  23  -2.590  -8.333 -12.819
  191   HG23  THR  23          HG23      THR  23  -2.343  -7.040 -14.009
  192    H    ASN  24           H        ASN  24   1.338  -8.794 -10.156
  193    HA   ASN  24           HA       ASN  24   3.186  -8.093  -9.245
  194    HB2  ASN  24           HB2      ASN  24   4.201  -9.645 -11.093
  195    HB3  ASN  24           HB3      ASN  24   4.739  -8.141 -11.833
  196   HD21  ASN  24          HD22      ASN  24   5.826  -6.610 -10.015
  197   HD22  ASN  24          HD21      ASN  24   7.103  -7.499  -9.151
  198    H    ALA  25           H        ALA  25   1.261  -6.170 -11.000
  199    HA   ALA  25           HA       ALA  25   2.863  -3.780 -11.196
  200    HB1  ALA  25           HB1      ALA  25   0.723  -2.633 -11.360
  201    HB2  ALA  25           HB2      ALA  25   0.672  -4.113 -12.334
  202    HB3  ALA  25           HB3      ALA  25  -0.141  -4.057 -10.756
  203    H    SER  26           H        SER  26   2.449  -1.775  -9.697
  204    HA   SER  26           HA       SER  26   1.720  -2.349  -6.939
  205    HB2  SER  26           HB2      SER  26   4.615  -1.870  -7.721
  206    HB3  SER  26           HB3      SER  26   3.987  -1.609  -6.078
  207    HG   SER  26           HG       SER  26   3.307  -4.014  -7.313
  208    H    GLN  27           H        GLN  27   1.368  -0.480  -5.707
  209    HA   GLN  27           HA       GLN  27   2.198   2.135  -6.729
  210    HB2  GLN  27           HB2      GLN  27  -0.250   1.155  -7.624
  211    HB3  GLN  27           HB3      GLN  27  -0.735   2.033  -6.188
  212    HG2  GLN  27           HG2      GLN  27   0.871   3.131  -8.546
  213    HG3  GLN  27           HG3      GLN  27  -0.848   3.387  -8.262
  214   HE21  GLN  27          HE22      GLN  27  -1.539   4.990  -6.722
  215   HE22  GLN  27          HE21      GLN  27  -0.328   6.073  -6.010
  216    H    PHE  28           H        PHE  28   2.000   3.804  -5.135
  217    HA   PHE  28           HA       PHE  28   2.212   2.804  -2.387
  218    HB2  PHE  28           HB2      PHE  28   2.709   5.495  -3.701
  219    HB3  PHE  28           HB3      PHE  28   2.947   5.182  -1.985
  220    HD1  PHE  28           HD2      PHE  28   4.493   3.276  -1.275
  221    HD2  PHE  28           HD1      PHE  28   4.485   4.942  -5.247
  222    HE1  PHE  28           HE2      PHE  28   6.784   2.381  -1.653
  223    HE2  PHE  28           HE1      PHE  28   6.769   4.040  -5.629
  224    HZ   PHE  28           HZ       PHE  28   7.922   2.763  -3.826
  225    H    GLU  29           H        GLU  29  -0.456   3.960  -4.135
  226    HA   GLU  29           HA       GLU  29  -1.800   5.323  -1.945
  227    HB2  GLU  29           HB2      GLU  29  -3.746   5.208  -3.350
  228    HB3  GLU  29           HB3      GLU  29  -2.367   5.586  -4.377
  229    HG2  GLU  29           HG2      GLU  29  -2.247   3.044  -4.877
  230    HG3  GLU  29           HG3      GLU  29  -3.814   2.910  -4.081
  231    H    ARG  30           H        ARG  30  -3.903   4.428  -1.120
  232    HA   ARG  30           HA       ARG  30  -3.846   1.509  -0.551
  233    HB2  ARG  30           HB2      ARG  30  -3.513   2.745   1.479
  234    HB3  ARG  30           HB3      ARG  30  -4.929   3.773   1.172
  235    HG2  ARG  30           HG2      ARG  30  -6.448   1.920   1.437
  236    HG3  ARG  30           HG3      ARG  30  -5.134   0.752   1.304
  237    HD2  ARG  30           HD2      ARG  30  -4.191   1.618   3.458
  238    HD3  ARG  30           HD3      ARG  30  -5.630   2.655   3.619
  239    HE   ARG  30           HE       ARG  30  -6.417  -0.078   3.153
  240   HH11  ARG  30          HH11      ARG  30  -4.876   1.728   5.719
  241   HH12  ARG  30          HH12      ARG  30  -5.433   0.635   6.968
  242   HH21  ARG  30          HH21      ARG  30  -7.245  -1.322   4.731
  243   HH22  ARG  30          HH22      ARG  30  -6.772  -1.112   6.413
  244    HA   PRO  31           HA       PRO  31  -7.140   2.488  -3.497
  245    HB2  PRO  31           HB2      PRO  31  -7.269   0.172  -4.887
  246    HB3  PRO  31           HB3      PRO  31  -5.885   1.291  -4.958
  247    HG2  PRO  31           HG2      PRO  31  -6.112  -1.259  -3.355
  248    HG3  PRO  31           HG3      PRO  31  -4.740  -0.688  -4.348
  249    HD2  PRO  31           HD2      PRO  31  -5.013  -0.332  -1.580
  250    HD3  PRO  31           HD3      PRO  31  -3.962   0.661  -2.617
  251    H    SER  32           H        SER  32  -8.155   2.473  -1.199
  252    HA   SER  32           HA       SER  32 -10.057   2.262   0.010
  253    HB2  SER  32           HB2      SER  32 -12.110   2.004  -1.153
  254    HB3  SER  32           HB3      SER  32 -10.970   2.806  -2.242
  255    HG   SER  32           HG       SER  32 -10.500   0.506  -2.939
  256    H    GLY  33           H        GLY  33  -8.216   0.026   0.326
  257    HA2  GLY  33           HA2      GLY  33 -10.004  -1.579   1.965
  258    HA3  GLY  33           HA3      GLY  33  -9.097  -2.495   0.759
  Start of MODEL   15
    1    H1   LYS   1           H1       LYS   1 -12.061   1.373  -4.162
    2    H2   LYS   1           H2       LYS   1 -11.008   0.519  -3.342
    3    H3   LYS   1           H3       LYS   1 -11.921  -0.235  -4.532
    4    HA   LYS   1           HA       LYS   1 -10.923   1.359  -6.139
    5    HB2  LYS   1           HB2      LYS   1  -8.934   2.517  -5.640
    6    HB3  LYS   1           HB3      LYS   1 -10.108   2.905  -4.391
    7    HG2  LYS   1           HG2      LYS   1  -8.918   1.096  -2.945
    8    HG3  LYS   1           HG3      LYS   1  -7.676   1.075  -4.198
    9    HD2  LYS   1           HD2      LYS   1  -6.937   2.482  -2.414
   10    HD3  LYS   1           HD3      LYS   1  -7.266   3.517  -3.810
   11    HE2  LYS   1           HE2      LYS   1  -9.379   4.249  -2.863
   12    HE3  LYS   1           HE3      LYS   1  -9.308   3.018  -1.602
   13    HZ1  LYS   1           HZ1      LYS   1  -8.676   5.164  -0.753
   14    HZ2  LYS   1           HZ2      LYS   1  -7.357   4.145  -0.697
   15    HZ3  LYS   1           HZ3      LYS   1  -7.375   5.272  -1.839
   16    H    LEU   2           H        LEU   2  -9.314  -1.104  -3.987
   17    HA   LEU   2           HA       LEU   2  -7.308  -1.809  -5.755
   18    HB2  LEU   2           HB2      LEU   2  -8.811  -3.527  -3.752
   19    HB3  LEU   2           HB3      LEU   2  -7.323  -3.982  -4.549
   20    HG   LEU   2           HG       LEU   2  -7.712  -1.801  -2.483
   21   HD11  LEU   2          HD11      LEU   2  -6.062  -3.240  -1.260
   22   HD12  LEU   2          HD12      LEU   2  -7.536  -4.123  -1.680
   23   HD13  LEU   2          HD13      LEU   2  -6.051  -4.365  -2.621
   24   HD21  LEU   2          HD21      LEU   2  -5.258  -1.397  -2.619
   25   HD22  LEU   2          HD22      LEU   2  -5.189  -2.394  -4.085
   26   HD23  LEU   2          HD23      LEU   2  -6.101  -0.871  -4.077
   27    HA   PRO   3           HA       PRO   3  -9.627  -4.206  -8.868
   28    HB2  PRO   3           HB2      PRO   3  -6.886  -4.572 -10.018
   29    HB3  PRO   3           HB3      PRO   3  -8.378  -4.018 -10.821
   30    HG2  PRO   3           HG2      PRO   3  -6.364  -2.277 -10.210
   31    HG3  PRO   3           HG3      PRO   3  -8.089  -1.809 -10.068
   32    HD2  PRO   3           HD2      PRO   3  -6.206  -2.673  -7.866
   33    HD3  PRO   3           HD3      PRO   3  -7.376  -1.339  -7.902
   34    HA   PRO   4           HA       PRO   4  -8.708  -8.500  -7.795
   35    HB2  PRO   4           HB2      PRO   4  -8.022  -8.978 -10.702
   36    HB3  PRO   4           HB3      PRO   4  -9.030  -9.974  -9.604
   37    HG2  PRO   4           HG2      PRO   4 -10.209  -8.321 -11.391
   38    HG3  PRO   4           HG3      PRO   4 -10.825  -8.389  -9.707
   39    HD2  PRO   4           HD2      PRO   4  -8.985  -6.339 -10.957
   40    HD3  PRO   4           HD3      PRO   4 -10.398  -6.083  -9.883
   41    H    GLY   5           H        GLY   5  -6.958  -9.447  -6.885
   42    HA2  GLY   5           HA2      GLY   5  -4.847 -10.381  -6.757
   43    HA3  GLY   5           HA3      GLY   5  -4.379  -9.551  -8.238
   44    H    TRP   6           H        TRP   6  -5.551  -7.024  -6.378
   45    HA   TRP   6           HA       TRP   6  -2.824  -6.228  -5.676
   46    HB2  TRP   6           HB2      TRP   6  -5.502  -4.857  -5.508
   47    HB3  TRP   6           HB3      TRP   6  -3.996  -4.148  -4.927
   48    HD1  TRP   6           HD1      TRP   6  -5.494  -5.461  -8.233
   49    HE1  TRP   6           HE1      TRP   6  -4.439  -4.192 -10.204
   50    HE3  TRP   6           HE3      TRP   6  -2.083  -2.666  -5.655
   51    HZ2  TRP   6           HZ2      TRP   6  -2.333  -2.275 -10.614
   52    HZ3  TRP   6           HZ3      TRP   6  -0.592  -1.131  -6.845
   53    HH2  TRP   6           HH2      TRP   6  -0.666  -0.926  -9.328
   54    H    GLU   7           H        GLU   7  -1.821  -6.453  -3.816
   55    HA   GLU   7           HA       GLU   7  -3.301  -7.126  -1.325
   56    HB2  GLU   7           HB2      GLU   7  -1.861  -8.838  -3.074
   57    HB3  GLU   7           HB3      GLU   7  -0.744  -8.534  -1.762
   58    HG2  GLU   7           HG2      GLU   7  -3.638  -9.393  -1.286
   59    HG3  GLU   7           HG3      GLU   7  -2.345 -10.549  -1.611
   60    H    LYS   8           H        LYS   8  -1.903  -6.933   0.669
   61    HA   LYS   8           HA       LYS   8  -0.723  -4.245   0.584
   62    HB2  LYS   8           HB2      LYS   8  -1.173  -4.178   2.909
   63    HB3  LYS   8           HB3      LYS   8  -2.541  -4.976   2.142
   64    HG2  LYS   8           HG2      LYS   8  -1.291  -7.206   2.817
   65    HG3  LYS   8           HG3      LYS   8  -0.384  -6.148   3.893
   66    HD2  LYS   8           HD2      LYS   8  -2.171  -7.087   5.174
   67    HD3  LYS   8           HD3      LYS   8  -2.555  -5.388   4.905
   68    HE2  LYS   8           HE2      LYS   8  -4.564  -6.698   4.631
   69    HE3  LYS   8           HE3      LYS   8  -4.107  -6.040   3.058
   70    HZ1  LYS   8           HZ1      LYS   8  -3.214  -8.198   2.436
   71    HZ2  LYS   8           HZ2      LYS   8  -3.481  -8.803   3.938
   72    HZ3  LYS   8           HZ3      LYS   8  -4.743  -8.400   2.958
   73    H    ARG   9           H        ARG   9   1.391  -3.743   0.747
   74    HA   ARG   9           HA       ARG   9   3.320  -5.711   1.921
   75    HB2  ARG   9           HB2      ARG   9   3.602  -4.439  -0.829
   76    HB3  ARG   9           HB3      ARG   9   4.858  -5.383  -0.029
   77    HG2  ARG   9           HG2      ARG   9   2.156  -6.420  -0.961
   78    HG3  ARG   9           HG3      ARG   9   3.691  -6.637  -1.790
   79    HD2  ARG   9           HD2      ARG   9   4.577  -8.047  -0.069
   80    HD3  ARG   9           HD3      ARG   9   3.229  -7.726   1.009
   81    HE   ARG   9           HE       ARG   9   3.165  -9.393  -1.467
   82   HH11  ARG   9          HH11      ARG   9   1.297  -8.297   1.371
   83   HH12  ARG   9          HH12      ARG   9   0.155  -9.622   1.116
   84   HH21  ARG   9          HH21      ARG   9   1.422 -10.988  -1.610
   85   HH22  ARG   9          HH22      ARG   9   0.173 -10.820  -0.354
   86    H    MET  10           H        MET  10   5.446  -4.808   2.393
   87    HA   MET  10           HA       MET  10   5.338  -1.900   2.919
   88    HB2  MET  10           HB2      MET  10   6.653  -2.101   4.820
   89    HB3  MET  10           HB3      MET  10   5.344  -3.247   4.949
   90    HG2  MET  10           HG2      MET  10   7.199  -4.382   5.794
   91    HG3  MET  10           HG3      MET  10   6.971  -5.056   4.189
   92    HE1  MET  10           HE1      MET  10  10.439  -2.170   5.371
   93    HE2  MET  10           HE2      MET  10   8.807  -1.543   5.085
   94    HE3  MET  10           HE3      MET  10   9.112  -2.639   6.459
   95    H    PHE  11           H        PHE  11   6.993  -0.602   2.388
   96    HA   PHE  11           HA       PHE  11   8.913  -1.703   0.392
   97    HB2  PHE  11           HB2      PHE  11   7.140   0.169  -0.130
   98    HB3  PHE  11           HB3      PHE  11   8.244   1.224   0.718
   99    HD1  PHE  11           HD1      PHE  11   7.812  -1.049  -2.195
  100    HD2  PHE  11           HD2      PHE  11  10.364   1.903  -0.359
  101    HE1  PHE  11           HE1      PHE  11   9.139  -0.893  -4.281
  102    HE2  PHE  11           HE2      PHE  11  11.693   2.049  -2.443
  103    HZ   PHE  11           HZ       PHE  11  11.084   0.653  -4.409
  104    H    ALA  12           H        ALA  12  11.077  -1.036   0.418
  105    HA   ALA  12           HA       ALA  12  12.275  -1.294   2.907
  106    HB1  ALA  12           HB1      ALA  12  13.471  -0.351   0.267
  107    HB2  ALA  12           HB2      ALA  12  14.370  -1.037   1.637
  108    HB3  ALA  12           HB3      ALA  12  13.208  -2.043   0.755
  109    H    ASN  13           H        ASN  13  11.154   1.734   1.636
  110    HA   ASN  13           HA       ASN  13  13.087   3.362   3.126
  111    HB2  ASN  13           HB2      ASN  13  11.918   5.215   2.250
  112    HB3  ASN  13           HB3      ASN  13  11.900   4.040   0.939
  113   HD21  ASN  13          HD22      ASN  13   9.967   5.820   3.274
  114   HD22  ASN  13          HD21      ASN  13   8.411   5.230   2.718
  115    H    GLY  14           H        GLY  14  10.417   1.454   4.061
  116    HA2  GLY  14           HA2      GLY  14   9.404   1.332   6.175
  117    HA3  GLY  14           HA3      GLY  14  10.021   2.937   6.598
  118    H    THR  15           H        THR  15   7.785   1.394   4.170
  119    HA   THR  15           HA       THR  15   5.582   3.125   4.990
  120    HB   THR  15           HB       THR  15   6.877   3.386   2.241
  121    HG1  THR  15           HG1      THR  15   7.183   4.681   4.470
  122   HG21  THR  15          HG21      THR  15   4.187   4.469   3.175
  123   HG22  THR  15          HG22      THR  15   5.090   5.103   1.788
  124   HG23  THR  15          HG23      THR  15   4.515   3.437   1.752
  125    H    VAL  16           H        VAL  16   3.526   2.394   3.831
  126    HA   VAL  16           HA       VAL  16   3.772  -0.398   2.829
  127    HB   VAL  16           HB       VAL  16   1.757   0.853   4.665
  128   HG11  VAL  16          HG11      VAL  16   0.184  -1.011   4.274
  129   HG12  VAL  16          HG12      VAL  16   0.295   0.038   2.860
  130   HG13  VAL  16          HG13      VAL  16   1.129  -1.534   2.865
  131   HG21  VAL  16          HG21      VAL  16   2.045  -1.309   5.805
  132   HG22  VAL  16          HG22      VAL  16   3.007  -1.924   4.441
  133   HG23  VAL  16          HG23      VAL  16   3.640  -0.611   5.465
  134    H    TYR  17           H        TYR  17   2.808  -0.995   1.041
  135    HA   TYR  17           HA       TYR  17   1.306   0.954  -0.604
  136    HB2  TYR  17           HB2      TYR  17   2.750   0.671  -2.468
  137    HB3  TYR  17           HB3      TYR  17   3.803   1.029  -1.133
  138    HD1  TYR  17           HD1      TYR  17   5.082  -0.931  -0.033
  139    HD2  TYR  17           HD2      TYR  17   2.935  -1.343  -3.755
  140    HE1  TYR  17           HE1      TYR  17   6.457  -2.945  -0.637
  141    HE2  TYR  17           HE2      TYR  17   4.281  -3.321  -4.317
  142    HH   TYR  17           HH       TYR  17   6.066  -4.643  -3.722
  143    H    TYR  18           H        TYR  18   0.558  -0.350  -2.686
  144    HA   TYR  18           HA       TYR  18  -0.162  -3.118  -1.888
  145    HB2  TYR  18           HB2      TYR  18  -1.880  -0.975  -3.124
  146    HB3  TYR  18           HB3      TYR  18  -2.246  -2.693  -3.311
  147    HD1  TYR  18           HD2      TYR  18  -1.355  -0.245  -0.577
  148    HD2  TYR  18           HD1      TYR  18  -3.651  -3.724  -1.684
  149    HE1  TYR  18           HE2      TYR  18  -1.948  -0.561   1.750
  150    HE2  TYR  18           HE1      TYR  18  -4.372  -3.974   0.674
  151    HH   TYR  18           HH       TYR  18  -3.161  -1.843   3.273
  152    H    PHE  19           H        PHE  19   0.138  -4.700  -3.165
  153    HA   PHE  19           HA       PHE  19   1.716  -4.378  -5.671
  154    HB2  PHE  19           HB2      PHE  19   2.998  -5.135  -3.731
  155    HB3  PHE  19           HB3      PHE  19   1.757  -6.293  -3.308
  156    HD1  PHE  19           HD2      PHE  19   4.530  -5.589  -5.670
  157    HD2  PHE  19           HD1      PHE  19   1.626  -8.494  -4.341
  158    HE1  PHE  19           HE2      PHE  19   5.705  -7.350  -6.938
  159    HE2  PHE  19           HE1      PHE  19   2.865 -10.263  -5.554
  160    HZ   PHE  19           HZ       PHE  19   4.851  -9.681  -6.932
  161    H    ASN  20           H        ASN  20   0.877  -5.377  -7.483
  162    HA   ASN  20           HA       ASN  20  -1.521  -7.049  -7.185
  163    HB2  ASN  20           HB2      ASN  20  -1.382  -5.294  -8.932
  164    HB3  ASN  20           HB3      ASN  20  -0.065  -6.199  -9.688
  165   HD21  ASN  20          HD22      ASN  20  -3.491  -6.179  -8.928
  166   HD22  ASN  20          HD21      ASN  20  -3.984  -7.559  -9.859
  167    H    HIS  21           H        HIS  21  -1.087  -9.079  -6.448
  168    HA   HIS  21           HA       HIS  21   1.376 -10.438  -7.126
  169    HB2  HIS  21           HB2      HIS  21   0.604 -12.177  -5.678
  170    HB3  HIS  21           HB3      HIS  21   0.282 -10.627  -4.937
  171    HD1  HIS  21           HD1      HIS  21  -2.148 -10.337  -4.040
  172    HD2  HIS  21           HD2      HIS  21  -1.733 -13.298  -6.999
  173    HE1  HIS  21           HE1      HIS  21  -4.391 -11.549  -4.177
  174    H    ILE  22           H        ILE  22  -1.155  -9.983  -9.184
  175    HA   ILE  22           HA       ILE  22  -0.841 -12.637 -10.499
  176    HB   ILE  22           HB       ILE  22  -2.753 -10.338 -11.056
  177   HG12  ILE  22          HG12      ILE  22  -3.287 -11.389  -8.902
  178   HG13  ILE  22          HG13      ILE  22  -4.524 -11.676 -10.105
  179   HG21  ILE  22          HG21      ILE  22  -4.008 -12.039 -12.424
  180   HG22  ILE  22          HG22      ILE  22  -2.466 -11.533 -13.111
  181   HG23  ILE  22          HG23      ILE  22  -2.589 -13.104 -12.300
  182   HD11  ILE  22          HD11      ILE  22  -4.100 -13.655  -8.709
  183   HD12  ILE  22          HD12      ILE  22  -3.738 -13.998 -10.408
  184   HD13  ILE  22          HD13      ILE  22  -2.414 -13.710  -9.254
  185    H    THR  23           H        THR  23   0.317  -9.369 -10.640
  186    HA   THR  23           HA       THR  23   1.539  -9.847 -13.347
  187    HB   THR  23           HB       THR  23   1.015  -7.512 -13.921
  188    HG1  THR  23           HG1      THR  23  -0.585  -7.534 -11.586
  189   HG21  THR  23          HG21      THR  23  -0.638  -9.255 -14.573
  190   HG22  THR  23          HG22      THR  23  -1.545  -8.938 -13.080
  191   HG23  THR  23          HG23      THR  23  -1.364  -7.660 -14.297
  192    H    ASN  24           H        ASN  24   2.181  -8.830 -10.104
  193    HA   ASN  24           HA       ASN  24   3.847  -7.875  -9.084
  194    HB2  ASN  24           HB2      ASN  24   5.191  -9.329 -10.798
  195    HB3  ASN  24           HB3      ASN  24   5.603  -7.784 -11.537
  196   HD21  ASN  24          HD22      ASN  24   6.335  -6.096  -9.684
  197   HD22  ASN  24          HD21      ASN  24   7.617  -6.799  -8.672
  198    H    ALA  25           H        ALA  25   1.853  -6.247 -11.065
  199    HA   ALA  25           HA       ALA  25   3.156  -3.679 -11.208
  200    HB1  ALA  25           HB1      ALA  25   0.899  -2.800 -11.505
  201    HB2  ALA  25           HB2      ALA  25   1.092  -4.279 -12.464
  202    HB3  ALA  25           HB3      ALA  25   0.184  -4.318 -10.938
  203    H    SER  26           H        SER  26   2.493  -1.719  -9.741
  204    HA   SER  26           HA       SER  26   1.740  -2.351  -6.994
  205    HB2  SER  26           HB2      SER  26   4.621  -1.708  -7.729
  206    HB3  SER  26           HB3      SER  26   3.958  -1.505  -6.092
  207    HG   SER  26           HG       SER  26   3.429  -3.925  -7.369
  208    H    GLN  27           H        GLN  27   1.321  -0.530  -5.727
  209    HA   GLN  27           HA       GLN  27   2.023   2.134  -6.702
  210    HB2  GLN  27           HB2      GLN  27  -0.038   1.548  -7.986
  211    HB3  GLN  27           HB3      GLN  27  -0.893   1.247  -6.474
  212    HG2  GLN  27           HG2      GLN  27  -1.440   3.435  -7.504
  213    HG3  GLN  27           HG3      GLN  27  -0.794   3.598  -5.882
  214   HE21  GLN  27          HE22      GLN  27  -0.267   4.462  -9.281
  215   HE22  GLN  27          HE21      GLN  27   1.205   5.348  -8.915
  216    H    PHE  28           H        PHE  28   1.832   3.727  -5.114
  217    HA   PHE  28           HA       PHE  28   1.978   2.749  -2.353
  218    HB2  PHE  28           HB2      PHE  28   2.820   5.192  -3.861
  219    HB3  PHE  28           HB3      PHE  28   2.497   5.379  -2.153
  220    HD1  PHE  28           HD2      PHE  28   4.247   2.766  -4.285
  221    HD2  PHE  28           HD1      PHE  28   4.350   5.275  -0.771
  222    HE1  PHE  28           HE2      PHE  28   6.477   1.867  -3.700
  223    HE2  PHE  28           HE1      PHE  28   6.598   4.378  -0.210
  224    HZ   PHE  28           HZ       PHE  28   7.663   2.695  -1.676
  225    H    GLU  29           H        GLU  29  -0.710   3.350  -4.024
  226    HA   GLU  29           HA       GLU  29  -2.095   4.958  -2.028
  227    HB2  GLU  29           HB2      GLU  29  -2.752   4.144  -4.684
  228    HB3  GLU  29           HB3      GLU  29  -3.992   3.519  -3.599
  229    HG2  GLU  29           HG2      GLU  29  -3.035   6.418  -3.678
  230    HG3  GLU  29           HG3      GLU  29  -4.480   5.808  -4.479
  231    H    ARG  30           H        ARG  30  -3.856   4.095  -0.686
  232    HA   ARG  30           HA       ARG  30  -3.586   1.188  -0.073
  233    HB2  ARG  30           HB2      ARG  30  -3.776   3.357   2.053
  234    HB3  ARG  30           HB3      ARG  30  -3.757   1.641   2.322
  235    HG2  ARG  30           HG2      ARG  30  -1.582   1.628   2.538
  236    HG3  ARG  30           HG3      ARG  30  -1.345   2.148   0.882
  237    HD2  ARG  30           HD2      ARG  30  -1.862   4.119   3.167
  238    HD3  ARG  30           HD3      ARG  30  -0.259   3.481   2.811
  239    HE   ARG  30           HE       ARG  30  -0.139   4.644   0.796
  240   HH11  ARG  30          HH11      ARG  30  -3.448   5.235   2.000
  241   HH12  ARG  30          HH12      ARG  30  -3.717   6.137   0.497
  242   HH21  ARG  30          HH21      ARG  30  -0.671   6.035  -0.692
  243   HH22  ARG  30          HH22      ARG  30  -2.325   6.684  -0.729
  244    HA   PRO  31           HA       PRO  31  -8.015   1.091  -0.193
  245    HB2  PRO  31           HB2      PRO  31  -7.896  -0.378   2.441
  246    HB3  PRO  31           HB3      PRO  31  -8.839  -0.774   0.966
  247    HG2  PRO  31           HG2      PRO  31  -6.557  -2.077   1.514
  248    HG3  PRO  31           HG3      PRO  31  -6.867  -1.538  -0.165
  249    HD2  PRO  31           HD2      PRO  31  -5.089  -0.255   1.895
  250    HD3  PRO  31           HD3      PRO  31  -4.829  -0.513   0.133
  251    H    SER  32           H        SER  32  -9.833   1.753   0.770
  252    HA   SER  32           HA       SER  32 -11.117   3.026   2.525
  253    HB2  SER  32           HB2      SER  32  -8.844   5.034   2.241
  254    HB3  SER  32           HB3      SER  32 -10.384   5.291   3.086
  255    HG   SER  32           HG       SER  32  -8.371   3.391   3.631
  256    H    GLY  33           H        GLY  33 -12.339   2.652   0.666
  257    HA2  GLY  33           HA2      GLY  33 -13.660   3.671  -1.063
  258    HA3  GLY  33           HA3      GLY  33 -12.296   4.714  -1.488
  Start of MODEL   16
    1    H1   LYS   1           H1       LYS   1 -12.819   0.870  -2.332
    2    H2   LYS   1           H2       LYS   1 -13.426   2.203  -3.092
    3    H3   LYS   1           H3       LYS   1 -12.100   2.342  -2.140
    4    HA   LYS   1           HA       LYS   1 -12.247   0.882  -4.696
    5    HB2  LYS   1           HB2      LYS   1 -12.183   3.103  -5.254
    6    HB3  LYS   1           HB3      LYS   1 -11.249   3.596  -3.874
    7    HG2  LYS   1           HG2      LYS   1 -10.059   1.977  -6.178
    8    HG3  LYS   1           HG3      LYS   1 -10.193   3.725  -6.200
    9    HD2  LYS   1           HD2      LYS   1  -8.388   2.077  -4.401
   10    HD3  LYS   1           HD3      LYS   1  -7.963   3.271  -5.616
   11    HE2  LYS   1           HE2      LYS   1  -9.046   5.053  -4.243
   12    HE3  LYS   1           HE3      LYS   1  -9.411   3.848  -2.994
   13    HZ1  LYS   1           HZ1      LYS   1  -7.059   3.523  -2.649
   14    HZ2  LYS   1           HZ2      LYS   1  -6.686   4.651  -3.866
   15    HZ3  LYS   1           HZ3      LYS   1  -7.468   5.106  -2.513
   16    H    LEU   2           H        LEU   2 -10.829  -0.738  -5.003
   17    HA   LEU   2           HA       LEU   2  -8.135  -0.582  -4.056
   18    HB2  LEU   2           HB2      LEU   2  -9.378  -1.548  -2.092
   19    HB3  LEU   2           HB3      LEU   2  -9.897  -2.885  -3.083
   20    HG   LEU   2           HG       LEU   2  -7.939  -3.116  -1.423
   21   HD11  LEU   2          HD11      LEU   2  -6.782  -4.793  -2.715
   22   HD12  LEU   2          HD12      LEU   2  -8.537  -4.910  -2.938
   23   HD13  LEU   2          HD13      LEU   2  -7.530  -4.192  -4.210
   24   HD21  LEU   2          HD21      LEU   2  -6.268  -2.094  -3.746
   25   HD22  LEU   2          HD22      LEU   2  -6.606  -1.140  -2.287
   26   HD23  LEU   2          HD23      LEU   2  -5.700  -2.659  -2.179
   27    HA   PRO   3           HA       PRO   3  -8.694  -2.299  -8.168
   28    HB2  PRO   3           HB2      PRO   3  -5.704  -2.521  -8.231
   29    HB3  PRO   3           HB3      PRO   3  -6.798  -1.804  -9.446
   30    HG2  PRO   3           HG2      PRO   3  -5.401  -0.198  -7.780
   31    HG3  PRO   3           HG3      PRO   3  -7.127   0.149  -8.116
   32    HD2  PRO   3           HD2      PRO   3  -5.932  -1.271  -5.729
   33    HD3  PRO   3           HD3      PRO   3  -7.152   0.037  -5.774
   34    HA   PRO   4           HA       PRO   4  -8.740  -6.671  -8.186
   35    HB2  PRO   4           HB2      PRO   4  -7.239  -6.612 -10.817
   36    HB3  PRO   4           HB3      PRO   4  -8.676  -7.583 -10.360
   37    HG2  PRO   4           HG2      PRO   4  -8.982  -5.315 -11.797
   38    HG3  PRO   4           HG3      PRO   4 -10.085  -5.650 -10.422
   39    HD2  PRO   4           HD2      PRO   4  -7.687  -3.815 -10.510
   40    HD3  PRO   4           HD3      PRO   4  -9.294  -3.556  -9.766
   41    H    GLY   5           H        GLY   5  -7.612  -7.946  -6.860
   42    HA2  GLY   5           HA2      GLY   5  -6.007  -9.389  -6.134
   43    HA3  GLY   5           HA3      GLY   5  -5.095  -9.081  -7.613
   44    H    TRP   6           H        TRP   6  -5.639  -6.149  -5.855
   45    HA   TRP   6           HA       TRP   6  -2.829  -5.889  -5.320
   46    HB2  TRP   6           HB2      TRP   6  -5.269  -4.179  -4.932
   47    HB3  TRP   6           HB3      TRP   6  -3.757  -3.735  -4.199
   48    HD1  TRP   6           HD1      TRP   6  -3.874  -5.301  -7.687
   49    HE1  TRP   6           HE1      TRP   6  -3.031  -3.608  -9.425
   50    HE3  TRP   6           HE3      TRP   6  -3.474  -1.175  -4.684
   51    HZ2  TRP   6           HZ2      TRP   6  -2.287  -0.847  -9.512
   52    HZ3  TRP   6           HZ3      TRP   6  -2.683   0.940  -5.611
   53    HH2  TRP   6           HH2      TRP   6  -2.147   1.159  -8.038
   54    H    GLU   7           H        GLU   7  -1.694  -6.475  -3.665
   55    HA   GLU   7           HA       GLU   7  -2.962  -7.110  -1.056
   56    HB2  GLU   7           HB2      GLU   7  -1.931  -8.810  -3.004
   57    HB3  GLU   7           HB3      GLU   7  -0.559  -8.629  -1.929
   58    HG2  GLU   7           HG2      GLU   7  -3.368  -9.360  -0.958
   59    HG3  GLU   7           HG3      GLU   7  -2.217 -10.562  -1.540
   60    H    LYS   8           H        LYS   8  -1.485  -7.156   0.788
   61    HA   LYS   8           HA       LYS   8  -0.335  -4.535   1.147
   62    HB2  LYS   8           HB2      LYS   8  -0.649  -7.022   2.884
   63    HB3  LYS   8           HB3      LYS   8   0.012  -5.506   3.499
   64    HG2  LYS   8           HG2      LYS   8  -1.926  -4.302   3.110
   65    HG3  LYS   8           HG3      LYS   8  -2.702  -5.551   2.134
   66    HD2  LYS   8           HD2      LYS   8  -2.005  -6.099   5.042
   67    HD3  LYS   8           HD3      LYS   8  -3.442  -5.183   4.609
   68    HE2  LYS   8           HE2      LYS   8  -4.121  -7.431   4.932
   69    HE3  LYS   8           HE3      LYS   8  -4.280  -7.047   3.218
   70    HZ1  LYS   8           HZ1      LYS   8  -3.287  -9.260   3.726
   71    HZ2  LYS   8           HZ2      LYS   8  -2.384  -8.380   2.718
   72    HZ3  LYS   8           HZ3      LYS   8  -1.943  -8.506   4.306
   73    H    ARG   9           H        ARG   9   1.712  -3.943   0.718
   74    HA   ARG   9           HA       ARG   9   3.919  -5.822   1.529
   75    HB2  ARG   9           HB2      ARG   9   3.779  -4.371  -1.131
   76    HB3  ARG   9           HB3      ARG   9   5.177  -5.282  -0.555
   77    HG2  ARG   9           HG2      ARG   9   2.435  -6.437  -1.203
   78    HG3  ARG   9           HG3      ARG   9   3.855  -6.486  -2.244
   79    HD2  ARG   9           HD2      ARG   9   5.020  -7.978  -0.795
   80    HD3  ARG   9           HD3      ARG   9   3.826  -7.806   0.487
   81    HE   ARG   9           HE       ARG   9   3.439  -9.230  -2.113
   82   HH11  ARG   9          HH11      ARG   9   1.988  -8.484   1.068
   83   HH12  ARG   9          HH12      ARG   9   0.802  -9.767   0.809
   84   HH21  ARG   9          HH21      ARG   9   1.681 -10.806  -2.195
   85   HH22  ARG   9          HH22      ARG   9   0.611 -10.788  -0.773
   86    H    MET  10           H        MET  10   5.979  -4.872   1.867
   87    HA   MET  10           HA       MET  10   5.800  -2.088   2.897
   88    HB2  MET  10           HB2      MET  10   7.509  -4.465   3.720
   89    HB3  MET  10           HB3      MET  10   7.802  -2.809   4.254
   90    HG2  MET  10           HG2      MET  10   6.588  -3.866   5.976
   91    HG3  MET  10           HG3      MET  10   5.511  -2.706   5.208
   92    HE1  MET  10           HE1      MET  10   3.110  -5.522   6.523
   93    HE2  MET  10           HE2      MET  10   4.623  -4.983   7.285
   94    HE3  MET  10           HE3      MET  10   3.515  -3.792   6.563
   95    H    PHE  11           H        PHE  11   6.913  -0.539   1.931
   96    HA   PHE  11           HA       PHE  11   8.897  -1.079  -0.153
   97    HB2  PHE  11           HB2      PHE  11   7.107   0.713  -0.275
   98    HB3  PHE  11           HB3      PHE  11   7.922   1.547   1.041
   99    HD1  PHE  11           HD2      PHE  11   8.576   0.097  -2.380
  100    HD2  PHE  11           HD1      PHE  11   9.527   3.202   0.461
  101    HE1  PHE  11           HE2      PHE  11  10.060   1.181  -4.049
  102    HE2  PHE  11           HE1      PHE  11  11.007   4.276  -1.209
  103    HZ   PHE  11           HZ       PHE  11  11.280   3.266  -3.464
  104    H    ALA  12           H        ALA  12  10.979   0.071  -0.106
  105    HA   ALA  12           HA       ALA  12  12.586  -0.960   1.875
  106    HB1  ALA  12           HB1      ALA  12  13.208  -0.512  -0.467
  107    HB2  ALA  12           HB2      ALA  12  13.176   1.239  -0.149
  108    HB3  ALA  12           HB3      ALA  12  14.379   0.206   0.653
  109    H    ASN  13           H        ASN  13  10.837   1.918   2.410
  110    HA   ASN  13           HA       ASN  13  12.800   2.823   4.466
  111    HB2  ASN  13           HB2      ASN  13  11.921   5.003   4.266
  112    HB3  ASN  13           HB3      ASN  13  12.211   4.460   2.614
  113   HD21  ASN  13          HD22      ASN  13  10.387   6.615   3.424
  114   HD22  ASN  13          HD21      ASN  13   8.775   6.064   3.021
  115    H    GLY  14           H        GLY  14  10.136   0.845   4.303
  116    HA2  GLY  14           HA2      GLY  14   8.934   0.042   6.146
  117    HA3  GLY  14           HA3      GLY  14   9.316   1.489   7.081
  118    H    THR  15           H        THR  15   8.024   1.923   3.809
  119    HA   THR  15           HA       THR  15   5.465   2.961   4.924
  120    HB   THR  15           HB       THR  15   6.582   3.080   2.083
  121    HG1  THR  15           HG1      THR  15   7.902   4.241   3.245
  122   HG21  THR  15          HG21      THR  15   4.184   3.419   2.048
  123   HG22  THR  15          HG22      THR  15   4.284   4.574   3.406
  124   HG23  THR  15          HG23      THR  15   4.985   4.977   1.822
  125    H    VAL  16           H        VAL  16   3.494   1.964   4.302
  126    HA   VAL  16           HA       VAL  16   3.792  -0.662   2.939
  127    HB   VAL  16           HB       VAL  16   1.699   0.464   4.786
  128   HG11  VAL  16          HG11      VAL  16   0.304  -0.428   2.962
  129   HG12  VAL  16          HG12      VAL  16   1.258  -1.931   2.935
  130   HG13  VAL  16          HG13      VAL  16   0.263  -1.517   4.348
  131   HG21  VAL  16          HG21      VAL  16   2.112  -1.716   5.881
  132   HG22  VAL  16          HG22      VAL  16   3.147  -2.207   4.516
  133   HG23  VAL  16          HG23      VAL  16   3.653  -0.882   5.598
  134    H    TYR  17           H        TYR  17   2.878  -1.201   1.119
  135    HA   TYR  17           HA       TYR  17   1.216   0.727  -0.393
  136    HB2  TYR  17           HB2      TYR  17   2.645   0.743  -2.264
  137    HB3  TYR  17           HB3      TYR  17   3.700   0.989  -0.910
  138    HD1  TYR  17           HD1      TYR  17   5.272  -0.714  -0.155
  139    HD2  TYR  17           HD2      TYR  17   2.777  -1.360  -3.621
  140    HE1  TYR  17           HE1      TYR  17   6.774  -2.592  -0.924
  141    HE2  TYR  17           HE2      TYR  17   4.176  -3.282  -4.272
  142    HH   TYR  17           HH       TYR  17   6.164  -4.372  -3.926
  143    H    TYR  18           H        TYR  18   0.603  -0.471  -2.591
  144    HA   TYR  18           HA       TYR  18  -0.232  -3.225  -1.876
  145    HB2  TYR  18           HB2      TYR  18  -1.778  -0.917  -3.019
  146    HB3  TYR  18           HB3      TYR  18  -2.272  -2.594  -3.257
  147    HD1  TYR  18           HD1      TYR  18  -1.402  -0.125  -0.593
  148    HD2  TYR  18           HD2      TYR  18  -3.412  -3.825  -1.538
  149    HE1  TYR  18           HE1      TYR  18  -2.028  -0.370   1.762
  150    HE2  TYR  18           HE2      TYR  18  -4.177  -4.012   0.792
  151    HH   TYR  18           HH       TYR  18  -3.209  -1.632   3.303
  152    H    PHE  19           H        PHE  19   0.052  -4.759  -3.161
  153    HA   PHE  19           HA       PHE  19   1.401  -4.453  -5.798
  154    HB2  PHE  19           HB2      PHE  19   2.832  -5.130  -4.003
  155    HB3  PHE  19           HB3      PHE  19   1.622  -6.201  -3.339
  156    HD1  PHE  19           HD2      PHE  19   1.243  -8.472  -4.152
  157    HD2  PHE  19           HD1      PHE  19   4.337  -5.931  -5.780
  158    HE1  PHE  19           HE2      PHE  19   2.357 -10.442  -5.100
  159    HE2  PHE  19           HE1      PHE  19   5.456  -7.923  -6.722
  160    HZ   PHE  19           HZ       PHE  19   4.415 -10.168  -6.497
  161    H    ASN  20           H        ASN  20   0.198  -5.198  -7.511
  162    HA   ASN  20           HA       ASN  20  -1.951  -7.127  -7.306
  163    HB2  ASN  20           HB2      ASN  20  -1.805  -5.485  -9.193
  164    HB3  ASN  20           HB3      ASN  20  -0.290  -6.199  -9.681
  165   HD21  ASN  20          HD22      ASN  20  -3.943  -6.940  -9.529
  166   HD22  ASN  20          HD21      ASN  20  -3.653  -8.229 -10.659
  167    H    HIS  21           H        HIS  21  -1.455  -9.134  -6.538
  168    HA   HIS  21           HA       HIS  21   1.129 -10.278  -6.879
  169    HB2  HIS  21           HB2      HIS  21   0.245 -12.126  -5.621
  170    HB3  HIS  21           HB3      HIS  21  -0.350 -10.629  -4.943
  171    HD1  HIS  21           HD1      HIS  21  -3.066 -10.209  -5.189
  172    HD2  HIS  21           HD2      HIS  21  -1.527 -13.586  -7.175
  173    HE1  HIS  21           HE1      HIS  21  -5.064 -11.667  -5.816
  174    H    ILE  22           H        ILE  22  -1.152 -10.155  -9.312
  175    HA   ILE  22           HA       ILE  22  -0.345 -12.735 -10.519
  176    HB   ILE  22           HB       ILE  22  -2.241 -10.619 -11.621
  177   HG12  ILE  22          HG12      ILE  22  -3.945 -12.583 -10.894
  178   HG13  ILE  22          HG13      ILE  22  -2.746 -12.846  -9.640
  179   HG21  ILE  22          HG21      ILE  22  -1.417 -12.169 -13.331
  180   HG22  ILE  22          HG22      ILE  22  -1.835 -13.559 -12.307
  181   HG23  ILE  22          HG23      ILE  22  -3.102 -12.510 -12.982
  182   HD11  ILE  22          HD11      ILE  22  -4.606 -11.367  -8.930
  183   HD12  ILE  22          HD12      ILE  22  -3.083 -10.469  -8.884
  184   HD13  ILE  22          HD13      ILE  22  -4.223 -10.231 -10.230
  185    H    THR  23           H        THR  23   0.407  -9.320 -10.687
  186    HA   THR  23           HA       THR  23   2.177  -9.759 -13.085
  187    HB   THR  23           HB       THR  23   1.492  -7.551 -13.882
  188    HG1  THR  23           HG1      THR  23  -0.350  -7.590 -11.728
  189   HG21  THR  23          HG21      THR  23  -1.028  -9.150 -13.270
  190   HG22  THR  23          HG22      THR  23  -0.791  -7.941 -14.547
  191   HG23  THR  23          HG23      THR  23   0.093  -9.479 -14.608
  192    H    ASN  24           H        ASN  24   2.224  -8.663  -9.832
  193    HA   ASN  24           HA       ASN  24   3.558  -7.536  -8.592
  194    HB2  ASN  24           HB2      ASN  24   5.733  -7.790  -8.889
  195    HB3  ASN  24           HB3      ASN  24   5.371  -8.527 -10.432
  196   HD21  ASN  24          HD22      ASN  24   5.052  -6.708 -12.258
  197   HD22  ASN  24          HD21      ASN  24   6.376  -5.518 -12.232
  198    H    ALA  25           H        ALA  25   1.789  -6.029 -10.999
  199    HA   ALA  25           HA       ALA  25   2.862  -3.415 -11.052
  200    HB1  ALA  25           HB1      ALA  25   0.570  -2.735 -11.663
  201    HB2  ALA  25           HB2      ALA  25   1.040  -4.217 -12.519
  202    HB3  ALA  25           HB3      ALA  25  -0.057  -4.306 -11.124
  203    H    SER  26           H        SER  26   2.971  -1.755  -9.521
  204    HA   SER  26           HA       SER  26   1.574  -2.199  -6.917
  205    HB2  SER  26           HB2      SER  26   4.546  -1.830  -7.446
  206    HB3  SER  26           HB3      SER  26   3.782  -1.770  -5.856
  207    HG   SER  26           HG       SER  26   3.898  -4.020  -7.649
  208    H    GLN  27           H        GLN  27   1.048  -0.412  -5.744
  209    HA   GLN  27           HA       GLN  27   2.439   2.133  -6.165
  210    HB2  GLN  27           HB2      GLN  27  -0.580   1.975  -6.535
  211    HB3  GLN  27           HB3      GLN  27   0.362   3.453  -6.432
  212    HG2  GLN  27           HG2      GLN  27   1.564   2.821  -8.525
  213    HG3  GLN  27           HG3      GLN  27   0.465   1.444  -8.706
  214   HE21  GLN  27          HE22      GLN  27   0.713   3.689 -10.630
  215   HE22  GLN  27          HE21      GLN  27  -0.877   4.444 -10.562
  216    H    PHE  28           H        PHE  28   1.743   3.788  -4.564
  217    HA   PHE  28           HA       PHE  28   1.068   2.754  -1.926
  218    HB2  PHE  28           HB2      PHE  28   1.526   5.574  -2.968
  219    HB3  PHE  28           HB3      PHE  28   1.359   5.125  -1.274
  220    HD1  PHE  28           HD1      PHE  28   2.975   3.267  -0.376
  221    HD2  PHE  28           HD2      PHE  28   3.715   5.599  -3.922
  222    HE1  PHE  28           HE1      PHE  28   5.391   2.748  -0.210
  223    HE2  PHE  28           HE2      PHE  28   6.141   5.072  -3.759
  224    HZ   PHE  28           HZ       PHE  28   6.985   3.650  -1.903
  225    H    GLU  29           H        GLU  29  -0.912   3.187  -4.491
  226    HA   GLU  29           HA       GLU  29  -3.144   4.540  -3.231
  227    HB2  GLU  29           HB2      GLU  29  -2.714   3.061  -5.798
  228    HB3  GLU  29           HB3      GLU  29  -4.363   3.189  -5.172
  229    HG2  GLU  29           HG2      GLU  29  -2.464   5.501  -5.757
  230    HG3  GLU  29           HG3      GLU  29  -3.863   5.021  -6.730
  231    H    ARG  30           H        ARG  30  -4.051   3.847  -1.483
  232    HA   ARG  30           HA       ARG  30  -3.941   0.994  -0.847
  233    HB2  ARG  30           HB2      ARG  30  -3.975   1.608   1.439
  234    HB3  ARG  30           HB3      ARG  30  -2.774   2.561   0.628
  235    HG2  ARG  30           HG2      ARG  30  -5.550   3.672   1.273
  236    HG3  ARG  30           HG3      ARG  30  -4.247   3.614   2.443
  237    HD2  ARG  30           HD2      ARG  30  -3.756   5.664   1.741
  238    HD3  ARG  30           HD3      ARG  30  -2.879   4.831   0.461
  239    HE   ARG  30           HE       ARG  30  -5.755   5.717   0.164
  240   HH11  ARG  30          HH11      ARG  30  -2.428   5.818  -1.289
  241   HH12  ARG  30          HH12      ARG  30  -3.157   6.741  -2.626
  242   HH21  ARG  30          HH21      ARG  30  -6.325   6.832  -1.687
  243   HH22  ARG  30          HH22      ARG  30  -5.041   7.099  -2.903
  244    HA   PRO  31           HA       PRO  31  -8.190  -0.012  -0.905
  245    HB2  PRO  31           HB2      PRO  31  -8.074  -0.677   2.031
  246    HB3  PRO  31           HB3      PRO  31  -8.704  -1.666   0.678
  247    HG2  PRO  31           HG2      PRO  31  -6.266  -2.155   1.785
  248    HG3  PRO  31           HG3      PRO  31  -6.506  -2.304   0.035
  249    HD2  PRO  31           HD2      PRO  31  -5.246  -0.076   1.577
  250    HD3  PRO  31           HD3      PRO  31  -4.805  -0.752  -0.028
  251    H    SER  32           H        SER  32 -10.300   0.326   0.052
  252    HA   SER  32           HA       SER  32 -12.004   1.755   0.398
  253    HB2  SER  32           HB2      SER  32 -10.322   2.745   2.704
  254    HB3  SER  32           HB3      SER  32 -12.013   3.198   2.399
  255    HG   SER  32           HG       SER  32 -11.745   1.360   3.811
  256    H    GLY  33           H        GLY  33  -9.281   3.963   1.030
  257    HA2  GLY  33           HA2      GLY  33 -10.240   5.851  -1.081
  258    HA3  GLY  33           HA3      GLY  33 -10.056   6.405   0.590
  Start of MODEL   17
    1    H1   LYS   1           H1       LYS   1  -7.568   5.404  -6.420
    2    H2   LYS   1           H2       LYS   1  -8.458   5.137  -7.813
    3    H3   LYS   1           H3       LYS   1  -6.933   4.540  -7.671
    4    HA   LYS   1           HA       LYS   1  -7.740   3.323  -5.644
    5    HB2  LYS   1           HB2      LYS   1 -10.347   3.997  -7.052
    6    HB3  LYS   1           HB3      LYS   1 -10.200   2.629  -5.948
    7    HG2  LYS   1           HG2      LYS   1  -9.447   5.468  -5.133
    8    HG3  LYS   1           HG3      LYS   1 -11.071   4.821  -4.944
    9    HD2  LYS   1           HD2      LYS   1 -10.430   3.206  -3.364
   10    HD3  LYS   1           HD3      LYS   1  -8.715   3.314  -3.754
   11    HE2  LYS   1           HE2      LYS   1 -10.168   5.750  -2.696
   12    HE3  LYS   1           HE3      LYS   1  -9.695   4.458  -1.579
   13    HZ1  LYS   1           HZ1      LYS   1  -7.953   6.218  -1.844
   14    HZ2  LYS   1           HZ2      LYS   1  -7.426   4.700  -2.220
   15    HZ3  LYS   1           HZ3      LYS   1  -7.714   5.723  -3.413
   16    H    LEU   2           H        LEU   2  -8.471   0.936  -6.028
   17    HA   LEU   2           HA       LEU   2  -7.632   0.052  -8.689
   18    HB2  LEU   2           HB2      LEU   2  -5.724  -1.116  -7.840
   19    HB3  LEU   2           HB3      LEU   2  -5.604   0.572  -7.390
   20    HG   LEU   2           HG       LEU   2  -6.223  -1.801  -5.579
   21   HD11  LEU   2          HD11      LEU   2  -4.160  -1.174  -4.527
   22   HD12  LEU   2          HD12      LEU   2  -3.855  -1.307  -6.267
   23   HD13  LEU   2          HD13      LEU   2  -4.013   0.291  -5.506
   24   HD21  LEU   2          HD21      LEU   2  -6.076  -0.209  -3.676
   25   HD22  LEU   2          HD22      LEU   2  -6.243   1.147  -4.802
   26   HD23  LEU   2          HD23      LEU   2  -7.566  -0.048  -4.587
   27    HA   PRO   3           HA       PRO   3 -10.434  -3.175  -7.696
   28    HB2  PRO   3           HB2      PRO   3  -9.998  -4.950  -9.718
   29    HB3  PRO   3           HB3      PRO   3 -10.477  -3.257 -10.042
   30    HG2  PRO   3           HG2      PRO   3  -7.671  -4.431 -10.022
   31    HG3  PRO   3           HG3      PRO   3  -8.456  -3.477 -11.325
   32    HD2  PRO   3           HD2      PRO   3  -6.844  -2.313  -9.448
   33    HD3  PRO   3           HD3      PRO   3  -8.282  -1.483 -10.113
   34    HA   PRO   4           HA       PRO   4  -9.047  -6.847  -5.457
   35    HB2  PRO   4           HB2      PRO   4 -10.651  -8.425  -7.484
   36    HB3  PRO   4           HB3      PRO   4 -10.593  -8.617  -5.702
   37    HG2  PRO   4           HG2      PRO   4 -12.662  -7.306  -6.845
   38    HG3  PRO   4           HG3      PRO   4 -11.885  -6.624  -5.378
   39    HD2  PRO   4           HD2      PRO   4 -11.473  -5.838  -8.266
   40    HD3  PRO   4           HD3      PRO   4 -11.667  -4.791  -6.826
   41    H    GLY   5           H        GLY   5  -7.353  -8.292  -5.559
   42    HA2  GLY   5           HA2      GLY   5  -5.797  -9.748  -6.760
   43    HA3  GLY   5           HA3      GLY   5  -6.005  -8.739  -8.194
   44    H    TRP   6           H        TRP   6  -5.974  -6.255  -6.367
   45    HA   TRP   6           HA       TRP   6  -3.051  -5.969  -5.999
   46    HB2  TRP   6           HB2      TRP   6  -5.396  -4.048  -5.853
   47    HB3  TRP   6           HB3      TRP   6  -3.731  -3.625  -5.495
   48    HD1  TRP   6           HD1      TRP   6  -5.885  -4.744  -8.483
   49    HE1  TRP   6           HE1      TRP   6  -4.838  -3.810 -10.650
   50    HE3  TRP   6           HE3      TRP   6  -1.551  -2.875  -6.537
   51    HZ2  TRP   6           HZ2      TRP   6  -2.426  -2.420 -11.419
   52    HZ3  TRP   6           HZ3      TRP   6   0.096  -1.774  -7.994
   53    HH2  TRP   6           HH2      TRP   6  -0.310  -1.506 -10.410
   54    H    GLU   7           H        GLU   7  -2.126  -6.278  -4.028
   55    HA   GLU   7           HA       GLU   7  -3.851  -6.174  -1.592
   56    HB2  GLU   7           HB2      GLU   7  -3.006  -8.495  -2.805
   57    HB3  GLU   7           HB3      GLU   7  -1.649  -8.196  -1.729
   58    HG2  GLU   7           HG2      GLU   7  -4.599  -8.436  -0.965
   59    HG3  GLU   7           HG3      GLU   7  -3.353  -9.664  -0.718
   60    H    LYS   8           H        LYS   8  -2.642  -5.725   0.443
   61    HA   LYS   8           HA       LYS   8  -0.718  -3.650  -0.168
   62    HB2  LYS   8           HB2      LYS   8  -1.080  -2.686   1.791
   63    HB3  LYS   8           HB3      LYS   8  -2.588  -3.514   1.600
   64    HG2  LYS   8           HG2      LYS   8  -0.327  -4.489   3.368
   65    HG3  LYS   8           HG3      LYS   8  -1.645  -3.477   3.912
   66    HD2  LYS   8           HD2      LYS   8  -2.118  -6.234   2.717
   67    HD3  LYS   8           HD3      LYS   8  -1.810  -5.942   4.414
   68    HE2  LYS   8           HE2      LYS   8  -4.118  -6.066   4.315
   69    HE3  LYS   8           HE3      LYS   8  -3.779  -4.338   4.467
   70    HZ1  LYS   8           HZ1      LYS   8  -5.499  -4.955   2.785
   71    HZ2  LYS   8           HZ2      LYS   8  -4.286  -4.079   2.122
   72    HZ3  LYS   8           HZ3      LYS   8  -4.340  -5.731   1.908
   73    H    ARG   9           H        ARG   9   1.319  -3.473   0.358
   74    HA   ARG   9           HA       ARG   9   2.821  -5.688   1.709
   75    HB2  ARG   9           HB2      ARG   9   3.513  -4.467  -0.996
   76    HB3  ARG   9           HB3      ARG   9   4.574  -5.549  -0.095
   77    HG2  ARG   9           HG2      ARG   9   1.851  -6.257  -1.253
   78    HG3  ARG   9           HG3      ARG   9   3.415  -6.664  -1.943
   79    HD2  ARG   9           HD2      ARG   9   3.494  -8.553  -0.809
   80    HD3  ARG   9           HD3      ARG   9   3.498  -7.674   0.713
   81    HE   ARG   9           HE       ARG   9   0.980  -7.690   0.605
   82   HH11  ARG   9          HH11      ARG   9   2.712 -10.292  -0.974
   83   HH12  ARG   9          HH12      ARG   9   1.386 -11.416  -0.803
   84   HH21  ARG   9          HH21      ARG   9  -0.766  -9.149   0.728
   85   HH22  ARG   9          HH22      ARG   9  -0.498 -10.770   0.176
   86    H    MET  10           H        MET  10   4.899  -5.085   2.512
   87    HA   MET  10           HA       MET  10   5.028  -2.327   3.444
   88    HB2  MET  10           HB2      MET  10   6.828  -3.133   4.862
   89    HB3  MET  10           HB3      MET  10   5.374  -4.101   5.040
   90    HG2  MET  10           HG2      MET  10   7.800  -4.918   3.385
   91    HG3  MET  10           HG3      MET  10   7.524  -5.379   5.056
   92    HE1  MET  10           HE1      MET  10   7.113  -8.735   3.075
   93    HE2  MET  10           HE2      MET  10   8.188  -7.382   2.654
   94    HE3  MET  10           HE3      MET  10   8.006  -7.880   4.354
   95    H    PHE  11           H        PHE  11   6.522  -0.827   3.016
   96    HA   PHE  11           HA       PHE  11   8.524  -1.327   0.868
   97    HB2  PHE  11           HB2      PHE  11   6.733   0.313   0.334
   98    HB3  PHE  11           HB3      PHE  11   7.166   1.246   1.755
   99    HD1  PHE  11           HD2      PHE  11   8.876  -0.284  -1.255
  100    HD2  PHE  11           HD1      PHE  11   8.464   3.165   1.313
  101    HE1  PHE  11           HE2      PHE  11  10.501   0.960  -2.653
  102    HE2  PHE  11           HE1      PHE  11  10.054   4.413  -0.127
  103    HZ   PHE  11           HZ       PHE  11  11.088   3.310  -2.094
  104    H    ALA  12           H        ALA  12  10.610  -1.234   1.453
  105    HA   ALA  12           HA       ALA  12  11.391  -1.341   4.091
  106    HB1  ALA  12           HB1      ALA  12  13.076  -0.762   1.619
  107    HB2  ALA  12           HB2      ALA  12  13.671  -1.403   3.165
  108    HB3  ALA  12           HB3      ALA  12  12.556  -2.370   2.183
  109    H    ASN  13           H        ASN  13  11.012   1.654   2.302
  110    HA   ASN  13           HA       ASN  13  12.745   3.212   4.047
  111    HB2  ASN  13           HB2      ASN  13  11.866   3.651   1.583
  112    HB3  ASN  13           HB3      ASN  13  10.493   4.387   2.422
  113   HD21  ASN  13          HD22      ASN  13  11.671   5.784   4.520
  114   HD22  ASN  13          HD21      ASN  13  12.792   6.961   3.806
  115    H    GLY  14           H        GLY  14   9.800   1.653   4.688
  116    HA2  GLY  14           HA2      GLY  14   8.715   1.737   6.782
  117    HA3  GLY  14           HA3      GLY  14   9.246   3.407   7.027
  118    H    THR  15           H        THR  15   7.269   1.500   4.647
  119    HA   THR  15           HA       THR  15   4.924   3.168   5.095
  120    HB   THR  15           HB       THR  15   6.480   3.349   2.483
  121    HG1  THR  15           HG1      THR  15   6.538   4.799   4.583
  122   HG21  THR  15          HG21      THR  15   4.664   4.930   1.730
  123   HG22  THR  15          HG22      THR  15   4.208   3.230   1.697
  124   HG23  THR  15          HG23      THR  15   3.634   4.290   3.021
  125    H    VAL  16           H        VAL  16   3.086   2.309   3.575
  126    HA   VAL  16           HA       VAL  16   3.573  -0.472   2.674
  127    HB   VAL  16           HB       VAL  16   1.385   0.535   4.484
  128   HG11  VAL  16          HG11      VAL  16   0.048  -0.317   2.599
  129   HG12  VAL  16          HG12      VAL  16   1.025  -1.804   2.560
  130   HG13  VAL  16          HG13      VAL  16  -0.010  -1.438   3.954
  131   HG21  VAL  16          HG21      VAL  16   3.338  -0.813   5.308
  132   HG22  VAL  16          HG22      VAL  16   1.795  -1.656   5.537
  133   HG23  VAL  16          HG23      VAL  16   2.862  -2.114   4.189
  134    H    TYR  17           H        TYR  17   2.688  -1.015   0.788
  135    HA   TYR  17           HA       TYR  17   1.216   1.045  -0.812
  136    HB2  TYR  17           HB2      TYR  17   2.725   0.857  -2.625
  137    HB3  TYR  17           HB3      TYR  17   3.732   1.097  -1.222
  138    HD1  TYR  17           HD1      TYR  17   4.964  -0.927  -0.219
  139    HD2  TYR  17           HD2      TYR  17   2.845  -1.153  -3.965
  140    HE1  TYR  17           HE1      TYR  17   6.267  -2.964  -0.851
  141    HE2  TYR  17           HE2      TYR  17   4.092  -3.193  -4.559
  142    HH   TYR  17           HH       TYR  17   5.822  -4.584  -3.980
  143    H    TYR  18           H        TYR  18   0.503  -0.141  -3.041
  144    HA   TYR  18           HA       TYR  18  -0.432  -2.874  -2.362
  145    HB2  TYR  18           HB2      TYR  18  -1.694  -0.607  -3.868
  146    HB3  TYR  18           HB3      TYR  18  -2.110  -2.275  -4.256
  147    HD1  TYR  18           HD2      TYR  18  -1.698  -0.070  -1.245
  148    HD2  TYR  18           HD1      TYR  18  -3.856  -3.336  -3.062
  149    HE1  TYR  18           HE2      TYR  18  -2.812  -0.491   0.867
  150    HE2  TYR  18           HE1      TYR  18  -5.105  -3.683  -0.976
  151    HH   TYR  18           HH       TYR  18  -4.698  -1.515   1.882
  152    H    PHE  19           H        PHE  19  -0.097  -4.517  -3.512
  153    HA   PHE  19           HA       PHE  19   1.543  -4.435  -5.998
  154    HB2  PHE  19           HB2      PHE  19   2.820  -5.089  -4.060
  155    HB3  PHE  19           HB3      PHE  19   1.523  -6.100  -3.473
  156    HD1  PHE  19           HD2      PHE  19   4.308  -5.879  -5.889
  157    HD2  PHE  19           HD1      PHE  19   1.161  -8.376  -4.300
  158    HE1  PHE  19           HE2      PHE  19   5.380  -7.888  -6.884
  159    HE2  PHE  19           HE1      PHE  19   2.242 -10.364  -5.294
  160    HZ   PHE  19           HZ       PHE  19   4.316 -10.112  -6.649
  161    H    ASN  20           H        ASN  20   0.470  -5.234  -7.707
  162    HA   ASN  20           HA       ASN  20  -1.922  -6.843  -7.548
  163    HB2  ASN  20           HB2      ASN  20  -1.403  -5.210  -9.385
  164    HB3  ASN  20           HB3      ASN  20  -0.078  -6.246  -9.882
  165   HD21  ASN  20          HD22      ASN  20  -3.634  -5.988  -9.666
  166   HD22  ASN  20          HD21      ASN  20  -3.910  -7.394 -10.690
  167    H    HIS  21           H        HIS  21  -1.716  -8.874  -6.672
  168    HA   HIS  21           HA       HIS  21   0.776 -10.327  -6.966
  169    HB2  HIS  21           HB2      HIS  21  -0.248 -11.978  -5.511
  170    HB3  HIS  21           HB3      HIS  21  -0.418 -10.355  -4.888
  171    HD1  HIS  21           HD1      HIS  21  -2.785  -9.829  -4.017
  172    HD2  HIS  21           HD2      HIS  21  -2.682 -12.812  -6.985
  173    HE1  HIS  21           HE1      HIS  21  -5.171 -10.731  -4.235
  174    H    ILE  22           H        ILE  22  -1.307  -9.910  -9.380
  175    HA   ILE  22           HA       ILE  22  -0.970 -12.673 -10.442
  176    HB   ILE  22           HB       ILE  22  -2.674 -10.391 -11.529
  177   HG12  ILE  22          HG12      ILE  22  -4.530 -12.195 -10.827
  178   HG13  ILE  22          HG13      ILE  22  -3.335 -12.656  -9.628
  179   HG21  ILE  22          HG21      ILE  22  -3.710 -12.184 -12.912
  180   HG22  ILE  22          HG22      ILE  22  -2.016 -11.945 -13.296
  181   HG23  ILE  22          HG23      ILE  22  -2.500 -13.334 -12.298
  182   HD11  ILE  22          HD11      ILE  22  -5.036 -11.048  -8.800
  183   HD12  ILE  22          HD12      ILE  22  -3.425 -10.337  -8.694
  184   HD13  ILE  22          HD13      ILE  22  -4.517  -9.859 -10.011
  185    H    THR  23           H        THR  23   0.275  -9.412 -10.631
  186    HA   THR  23           HA       THR  23   1.885 -10.134 -13.070
  187    HB   THR  23           HB       THR  23   1.530  -7.845 -13.888
  188    HG1  THR  23           HG1      THR  23  -0.408  -7.640 -11.831
  189   HG21  THR  23          HG21      THR  23  -0.771  -7.984 -14.611
  190   HG22  THR  23          HG22      THR  23  -0.056  -9.608 -14.650
  191   HG23  THR  23          HG23      THR  23  -1.166  -9.158 -13.339
  192    H    ASN  24           H        ASN  24   2.005  -8.676  -9.899
  193    HA   ASN  24           HA       ASN  24   3.581  -7.781  -8.693
  194    HB2  ASN  24           HB2      ASN  24   5.571  -7.719 -10.983
  195    HB3  ASN  24           HB3      ASN  24   5.896  -7.551  -9.272
  196   HD21  ASN  24          HD22      ASN  24   5.057  -9.813 -11.820
  197   HD22  ASN  24          HD21      ASN  24   5.528 -11.256 -10.898
  198    H    ALA  25           H        ALA  25   2.018  -6.277 -11.226
  199    HA   ALA  25           HA       ALA  25   3.204  -3.725 -11.382
  200    HB1  ALA  25           HB1      ALA  25   1.305  -4.515 -12.775
  201    HB2  ALA  25           HB2      ALA  25   0.238  -4.437 -11.358
  202    HB3  ALA  25           HB3      ALA  25   0.967  -2.955 -12.004
  203    H    SER  26           H        SER  26   3.336  -1.973  -9.951
  204    HA   SER  26           HA       SER  26   2.153  -2.388  -7.242
  205    HB2  SER  26           HB2      SER  26   5.029  -1.802  -7.988
  206    HB3  SER  26           HB3      SER  26   4.361  -1.704  -6.351
  207    HG   SER  26           HG       SER  26   4.407  -4.062  -8.011
  208    H    GLN  27           H        GLN  27   1.323  -0.634  -6.268
  209    HA   GLN  27           HA       GLN  27   2.046   2.087  -7.193
  210    HB2  GLN  27           HB2      GLN  27  -0.208   2.762  -7.563
  211    HB3  GLN  27           HB3      GLN  27   0.070   1.313  -8.524
  212    HG2  GLN  27           HG2      GLN  27  -1.094  -0.020  -6.681
  213    HG3  GLN  27           HG3      GLN  27  -1.478   1.508  -5.901
  214   HE21  GLN  27          HE22      GLN  27  -2.321  -0.633  -8.649
  215   HE22  GLN  27          HE21      GLN  27  -3.665   0.402  -9.122
  216    H    PHE  28           H        PHE  28   1.576   3.780  -5.665
  217    HA   PHE  28           HA       PHE  28   1.434   2.817  -2.880
  218    HB2  PHE  28           HB2      PHE  28   2.416   5.318  -4.210
  219    HB3  PHE  28           HB3      PHE  28   1.948   5.362  -2.520
  220    HD1  PHE  28           HD2      PHE  28   3.915   2.944  -4.716
  221    HD2  PHE  28           HD1      PHE  28   3.692   5.130  -0.993
  222    HE1  PHE  28           HE2      PHE  28   6.050   1.958  -4.008
  223    HE2  PHE  28           HE1      PHE  28   5.866   4.153  -0.315
  224    HZ   PHE  28           HZ       PHE  28   7.048   2.569  -1.821
  225    H    GLU  29           H        GLU  29  -0.903   3.632  -5.058
  226    HA   GLU  29           HA       GLU  29  -2.747   4.983  -3.201
  227    HB2  GLU  29           HB2      GLU  29  -3.065   5.630  -5.424
  228    HB3  GLU  29           HB3      GLU  29  -2.800   4.017  -6.043
  229    HG2  GLU  29           HG2      GLU  29  -5.077   4.585  -6.391
  230    HG3  GLU  29           HG3      GLU  29  -5.022   3.296  -5.208
  231    H    ARG  30           H        ARG  30  -4.578   3.971  -2.392
  232    HA   ARG  30           HA       ARG  30  -4.408   1.039  -1.926
  233    HB2  ARG  30           HB2      ARG  30  -4.686   1.450   0.514
  234    HB3  ARG  30           HB3      ARG  30  -3.175   2.025  -0.156
  235    HG2  ARG  30           HG2      ARG  30  -4.569   4.364  -0.333
  236    HG3  ARG  30           HG3      ARG  30  -5.534   3.595   0.909
  237    HD2  ARG  30           HD2      ARG  30  -3.801   5.029   1.865
  238    HD3  ARG  30           HD3      ARG  30  -3.500   3.363   2.320
  239    HE   ARG  30           HE       ARG  30  -2.059   4.843   0.130
  240   HH11  ARG  30          HH11      ARG  30  -1.855   2.085   2.455
  241   HH12  ARG  30          HH12      ARG  30  -0.111   2.046   2.135
  242   HH21  ARG  30          HH21      ARG  30  -0.047   4.207  -0.419
  243   HH22  ARG  30          HH22      ARG  30   0.833   3.140   0.701
  244    HA   PRO  31           HA       PRO  31  -8.840   1.216  -2.167
  245    HB2  PRO  31           HB2      PRO  31  -9.136  -0.685   0.107
  246    HB3  PRO  31           HB3      PRO  31  -9.664  -0.889  -1.588
  247    HG2  PRO  31           HG2      PRO  31  -7.504  -2.240  -0.545
  248    HG3  PRO  31           HG3      PRO  31  -7.524  -1.685  -2.246
  249    HD2  PRO  31           HD2      PRO  31  -6.218  -0.373   0.138
  250    HD3  PRO  31           HD3      PRO  31  -5.587  -0.627  -1.519
  251    H    SER  32           H        SER  32  -7.405   1.470   0.730
  252    HA   SER  32           HA       SER  32  -8.372   3.963   1.597
  253    HB2  SER  32           HB2      SER  32  -9.766   1.693   3.064
  254    HB3  SER  32           HB3      SER  32  -9.630   3.338   3.721
  255    HG   SER  32           HG       SER  32 -10.614   2.886   1.100
  256    H    GLY  33           H        GLY  33  -6.762   0.957   2.530
  257    HA2  GLY  33           HA2      GLY  33  -4.771   2.507   4.082
  258    HA3  GLY  33           HA3      GLY  33  -5.510   1.065   4.791
  Start of MODEL   18
    1    H1   LYS   1           H1       LYS   1 -12.946  -2.136   1.388
    2    H2   LYS   1           H2       LYS   1 -11.825  -2.843   2.276
    3    H3   LYS   1           H3       LYS   1 -13.414  -3.271   2.480
    4    HA   LYS   1           HA       LYS   1 -12.455  -5.036   1.318
    5    HB2  LYS   1           HB2      LYS   1 -13.840  -5.270  -0.438
    6    HB3  LYS   1           HB3      LYS   1 -14.667  -3.971   0.387
    7    HG2  LYS   1           HG2      LYS   1 -12.869  -3.733  -2.076
    8    HG3  LYS   1           HG3      LYS   1 -14.617  -3.701  -2.073
    9    HD2  LYS   1           HD2      LYS   1 -12.928  -1.604  -0.658
   10    HD3  LYS   1           HD3      LYS   1 -13.443  -1.467  -2.331
   11    HE2  LYS   1           HE2      LYS   1 -15.728  -1.310  -1.812
   12    HE3  LYS   1           HE3      LYS   1 -15.516  -1.965  -0.180
   13    HZ1  LYS   1           HZ1      LYS   1 -15.791   0.517  -0.256
   14    HZ2  LYS   1           HZ2      LYS   1 -14.411  -0.023   0.504
   15    HZ3  LYS   1           HZ3      LYS   1 -14.272   0.598  -0.962
   16    H    LEU   2           H        LEU   2 -11.324  -5.780  -0.834
   17    HA   LEU   2           HA       LEU   2  -9.057  -3.960  -1.341
   18    HB2  LEU   2           HB2      LEU   2  -8.695  -5.650   0.537
   19    HB3  LEU   2           HB3      LEU   2  -8.867  -6.918  -0.674
   20    HG   LEU   2           HG       LEU   2  -6.913  -5.919  -1.904
   21   HD11  LEU   2          HD11      LEU   2  -6.633  -4.221   0.631
   22   HD12  LEU   2          HD12      LEU   2  -5.441  -4.349  -0.685
   23   HD13  LEU   2          HD13      LEU   2  -6.997  -3.606  -0.994
   24   HD21  LEU   2          HD21      LEU   2  -6.580  -7.816  -0.385
   25   HD22  LEU   2          HD22      LEU   2  -5.211  -6.701  -0.238
   26   HD23  LEU   2          HD23      LEU   2  -6.470  -6.721   1.015
   27    HA   PRO   3           HA       PRO   3 -10.554  -5.226  -5.325
   28    HB2  PRO   3           HB2      PRO   3  -8.934  -3.743  -7.003
   29    HB3  PRO   3           HB3      PRO   3 -10.268  -3.068  -6.024
   30    HG2  PRO   3           HG2      PRO   3  -7.313  -3.095  -5.387
   31    HG3  PRO   3           HG3      PRO   3  -8.475  -1.747  -5.227
   32    HD2  PRO   3           HD2      PRO   3  -7.720  -3.348  -3.130
   33    HD3  PRO   3           HD3      PRO   3  -9.357  -2.628  -3.240
   34    HA   PRO   4           HA       PRO   4  -8.818  -8.785  -6.838
   35    HB2  PRO   4           HB2      PRO   4  -8.552  -7.510  -9.575
   36    HB3  PRO   4           HB3      PRO   4  -9.090  -9.171  -9.156
   37    HG2  PRO   4           HG2      PRO   4 -10.924  -7.236  -9.572
   38    HG3  PRO   4           HG3      PRO   4 -11.107  -8.336  -8.166
   39    HD2  PRO   4           HD2      PRO   4 -10.100  -5.498  -8.222
   40    HD3  PRO   4           HD3      PRO   4 -11.132  -6.322  -7.017
   41    H    GLY   5           H        GLY   5  -6.963  -9.046  -5.720
   42    HA2  GLY   5           HA2      GLY   5  -4.847  -9.961  -5.776
   43    HA3  GLY   5           HA3      GLY   5  -4.539  -9.207  -7.342
   44    H    TRP   6           H        TRP   6  -5.566  -6.606  -5.550
   45    HA   TRP   6           HA       TRP   6  -2.840  -5.595  -5.283
   46    HB2  TRP   6           HB2      TRP   6  -5.571  -4.455  -4.654
   47    HB3  TRP   6           HB3      TRP   6  -4.067  -3.593  -4.366
   48    HD1  TRP   6           HD1      TRP   6  -6.446  -4.486  -7.128
   49    HE1  TRP   6           HE1      TRP   6  -5.714  -3.335  -9.316
   50    HE3  TRP   6           HE3      TRP   6  -1.758  -2.975  -5.735
   51    HZ2  TRP   6           HZ2      TRP   6  -3.360  -2.038 -10.355
   52    HZ3  TRP   6           HZ3      TRP   6  -0.273  -1.863  -7.360
   53    HH2  TRP   6           HH2      TRP   6  -1.058  -1.363  -9.661
   54    H    GLU   7           H        GLU   7  -1.600  -6.451  -3.700
   55    HA   GLU   7           HA       GLU   7  -2.804  -6.894  -1.021
   56    HB2  GLU   7           HB2      GLU   7  -2.047  -8.764  -2.575
   57    HB3  GLU   7           HB3      GLU   7  -0.406  -8.154  -2.380
   58    HG2  GLU   7           HG2      GLU   7  -1.222  -8.432   0.248
   59    HG3  GLU   7           HG3      GLU   7  -2.130  -9.727  -0.524
   60    H    LYS   8           H        LYS   8  -1.893  -5.992   0.779
   61    HA   LYS   8           HA       LYS   8  -0.131  -3.871   0.805
   62    HB2  LYS   8           HB2      LYS   8  -0.278  -3.944   3.115
   63    HB3  LYS   8           HB3      LYS   8  -1.798  -4.635   2.594
   64    HG2  LYS   8           HG2      LYS   8   0.615  -6.159   3.688
   65    HG3  LYS   8           HG3      LYS   8  -0.819  -5.747   4.579
   66    HD2  LYS   8           HD2      LYS   8  -2.114  -7.392   3.679
   67    HD3  LYS   8           HD3      LYS   8  -1.295  -7.413   2.134
   68    HE2  LYS   8           HE2      LYS   8   0.017  -8.426   4.664
   69    HE3  LYS   8           HE3      LYS   8  -0.976  -9.463   3.630
   70    HZ1  LYS   8           HZ1      LYS   8   0.587  -9.254   1.844
   71    HZ2  LYS   8           HZ2      LYS   8   1.277  -7.957   2.470
   72    HZ3  LYS   8           HZ3      LYS   8   1.523  -9.445   3.175
   73    H    ARG   9           H        ARG   9   2.001  -3.590   0.812
   74    HA   ARG   9           HA       ARG   9   3.859  -5.774   1.684
   75    HB2  ARG   9           HB2      ARG   9   4.037  -4.331  -0.997
   76    HB3  ARG   9           HB3      ARG   9   5.312  -5.349  -0.331
   77    HG2  ARG   9           HG2      ARG   9   2.537  -6.291  -1.147
   78    HG3  ARG   9           HG3      ARG   9   4.013  -6.455  -2.077
   79    HD2  ARG   9           HD2      ARG   9   4.980  -7.965  -0.412
   80    HD3  ARG   9           HD3      ARG   9   3.610  -7.715   0.664
   81    HE   ARG   9           HE       ARG   9   2.319  -9.202  -0.529
   82   HH11  ARG   9          HH11      ARG   9   5.129  -8.483  -2.505
   83   HH12  ARG   9          HH12      ARG   9   4.715  -9.666  -3.717
   84   HH21  ARG   9          HH22      ARG   9   1.769 -10.628  -2.135
   85   HH22  ARG   9          HH21      ARG   9   2.925 -10.997  -3.403
   86    H    MET  10           H        MET  10   5.936  -5.004   2.393
   87    HA   MET  10           HA       MET  10   5.798  -2.195   3.244
   88    HB2  MET  10           HB2      MET  10   7.506  -2.805   4.851
   89    HB3  MET  10           HB3      MET  10   6.133  -3.898   4.954
   90    HG2  MET  10           HG2      MET  10   8.766  -4.544   3.560
   91    HG3  MET  10           HG3      MET  10   8.364  -4.982   5.212
   92    HE1  MET  10           HE1      MET  10   8.443  -8.415   3.333
   93    HE2  MET  10           HE2      MET  10   9.439  -6.985   2.974
   94    HE3  MET  10           HE3      MET  10   9.119  -7.448   4.664
   95    H    PHE  11           H        PHE  11   7.300  -0.676   2.880
   96    HA   PHE  11           HA       PHE  11   9.303  -1.044   0.735
   97    HB2  PHE  11           HB2      PHE  11   7.420   0.607   0.420
   98    HB3  PHE  11           HB3      PHE  11   7.957   1.453   1.853
   99    HD1  PHE  11           HD2      PHE  11   9.647   0.075  -1.249
  100    HD2  PHE  11           HD1      PHE  11   8.989   3.482   1.321
  101    HE1  PHE  11           HE2      PHE  11  11.155   1.441  -2.663
  102    HE2  PHE  11           HE1      PHE  11  10.472   4.848  -0.127
  103    HZ   PHE  11           HZ       PHE  11  11.567   3.828  -2.105
  104    H    ALA  12           H        ALA  12  11.431  -0.779   1.221
  105    HA   ALA  12           HA       ALA  12  12.341  -1.028   3.820
  106    HB1  ALA  12           HB1      ALA  12  13.506  -1.797   1.790
  107    HB2  ALA  12           HB2      ALA  12  13.849  -0.110   1.334
  108    HB3  ALA  12           HB3      ALA  12  14.572  -0.805   2.800
  109    H    ASN  13           H        ASN  13  11.594   2.031   2.283
  110    HA   ASN  13           HA       ASN  13  13.287   3.622   4.037
  111    HB2  ASN  13           HB2      ASN  13  12.265   4.118   1.640
  112    HB3  ASN  13           HB3      ASN  13  10.885   4.710   2.575
  113   HD21  ASN  13          HD22      ASN  13  12.073   6.076   4.696
  114   HD22  ASN  13          HD21      ASN  13  13.074   7.365   3.996
  115    H    GLY  14           H        GLY  14  10.496   1.811   4.739
  116    HA2  GLY  14           HA2      GLY  14   9.514   1.724   6.880
  117    HA3  GLY  14           HA3      GLY  14  10.000   3.391   7.211
  118    H    THR  15           H        THR  15   7.956   1.592   4.814
  119    HA   THR  15           HA       THR  15   5.503   2.977   5.462
  120    HB   THR  15           HB       THR  15   7.093   3.668   2.961
  121    HG1  THR  15           HG1      THR  15   6.975   4.851   5.143
  122   HG21  THR  15          HG21      THR  15   4.119   4.127   3.370
  123   HG22  THR  15          HG22      THR  15   5.124   5.046   2.232
  124   HG23  THR  15          HG23      THR  15   4.935   3.309   2.006
  125    H    VAL  16           H        VAL  16   3.619   1.817   3.811
  126    HA   VAL  16           HA       VAL  16   4.727  -0.494   2.548
  127    HB   VAL  16           HB       VAL  16   2.573  -1.386   3.026
  128   HG11  VAL  16          HG11      VAL  16   2.759  -1.917   5.468
  129   HG12  VAL  16          HG12      VAL  16   4.259  -2.135   4.595
  130   HG13  VAL  16          HG13      VAL  16   4.026  -0.679   5.589
  131   HG21  VAL  16          HG21      VAL  16   1.217   0.472   3.246
  132   HG22  VAL  16          HG22      VAL  16   1.029  -0.629   4.610
  133   HG23  VAL  16          HG23      VAL  16   1.978   0.873   4.829
  134    H    TYR  17           H        TYR  17   3.349  -1.166   0.835
  135    HA   TYR  17           HA       TYR  17   1.830   0.862  -0.657
  136    HB2  TYR  17           HB2      TYR  17   3.169   0.572  -2.644
  137    HB3  TYR  17           HB3      TYR  17   4.238   0.996  -1.341
  138    HD1  TYR  17           HD1      TYR  17   5.738  -0.743  -0.321
  139    HD2  TYR  17           HD2      TYR  17   3.338  -1.530  -3.813
  140    HE1  TYR  17           HE1      TYR  17   7.175  -2.704  -0.858
  141    HE2  TYR  17           HE2      TYR  17   4.794  -3.486  -4.362
  142    HH   TYR  17           HH       TYR  17   7.591  -4.385  -2.347
  143    H    TYR  18           H        TYR  18   0.998  -0.445  -2.777
  144    HA   TYR  18           HA       TYR  18   0.124  -3.146  -1.913
  145    HB2  TYR  18           HB2      TYR  18  -1.434  -0.952  -3.294
  146    HB3  TYR  18           HB3      TYR  18  -1.921  -2.649  -3.337
  147    HD1  TYR  18           HD1      TYR  18  -1.148   0.172  -0.982
  148    HD2  TYR  18           HD2      TYR  18  -3.044  -3.689  -1.480
  149    HE1  TYR  18           HE1      TYR  18  -1.810   0.182   1.388
  150    HE2  TYR  18           HE2      TYR  18  -3.770  -3.627   0.874
  151    HH   TYR  18           HH       TYR  18  -3.723  -2.474   2.849
  152    H    PHE  19           H        PHE  19   0.667  -4.755  -3.091
  153    HA   PHE  19           HA       PHE  19   1.809  -4.404  -5.825
  154    HB2  PHE  19           HB2      PHE  19   3.379  -5.256  -4.147
  155    HB3  PHE  19           HB3      PHE  19   2.213  -6.465  -3.629
  156    HD1  PHE  19           HD2      PHE  19   4.394  -5.439  -6.496
  157    HD2  PHE  19           HD1      PHE  19   1.978  -8.561  -4.758
  158    HE1  PHE  19           HE2      PHE  19   5.309  -7.058  -8.131
  159    HE2  PHE  19           HE1      PHE  19   2.935 -10.193  -6.384
  160    HZ   PHE  19           HZ       PHE  19   4.579  -9.439  -8.077
  161    H    ASN  20           H        ASN  20   0.547  -5.166  -7.438
  162    HA   ASN  20           HA       ASN  20  -1.829  -6.740  -6.851
  163    HB2  ASN  20           HB2      ASN  20  -1.774  -4.888  -8.539
  164    HB3  ASN  20           HB3      ASN  20  -0.709  -5.880  -9.523
  165   HD21  ASN  20          HD22      ASN  20  -4.001  -5.466  -8.294
  166   HD22  ASN  20          HD21      ASN  20  -4.704  -6.870  -9.036
  167    H    HIS  21           H        HIS  21  -1.190  -8.797  -6.113
  168    HA   HIS  21           HA       HIS  21   0.902 -10.256  -7.471
  169    HB2  HIS  21           HB2      HIS  21   0.406 -12.077  -5.948
  170    HB3  HIS  21           HB3      HIS  21   0.600 -10.543  -5.130
  171    HD1  HIS  21           HD1      HIS  21  -0.804 -10.996  -2.975
  172    HD2  HIS  21           HD2      HIS  21  -2.760 -11.971  -6.604
  173    HE1  HIS  21           HE1      HIS  21  -3.226 -11.544  -2.407
  174    H    ILE  22           H        ILE  22  -1.982  -9.600  -8.875
  175    HA   ILE  22           HA       ILE  22  -2.169 -12.252 -10.225
  176    HB   ILE  22           HB       ILE  22  -3.949  -9.786 -10.300
  177   HG12  ILE  22          HG12      ILE  22  -4.420 -12.630  -9.285
  178   HG13  ILE  22          HG13      ILE  22  -4.120 -11.223  -8.275
  179   HG21  ILE  22          HG21      ILE  22  -4.248 -12.380 -11.876
  180   HG22  ILE  22          HG22      ILE  22  -5.468 -11.089 -11.772
  181   HG23  ILE  22          HG23      ILE  22  -3.941 -10.767 -12.555
  182   HD11  ILE  22          HD11      ILE  22  -6.448 -11.576  -8.187
  183   HD12  ILE  22          HD12      ILE  22  -6.221 -10.171  -9.248
  184   HD13  ILE  22          HD13      ILE  22  -6.590 -11.770  -9.938
  185    H    THR  23           H        THR  23  -0.800  -9.055 -10.571
  186    HA   THR  23           HA       THR  23  -0.116  -9.615 -13.450
  187    HB   THR  23           HB       THR  23  -0.353  -7.187 -13.835
  188    HG1  THR  23           HG1      THR  23  -1.570  -7.134 -11.283
  189   HG21  THR  23          HG21      THR  23  -2.312  -8.650 -14.282
  190   HG22  THR  23          HG22      THR  23  -2.908  -8.349 -12.636
  191   HG23  THR  23          HG23      THR  23  -2.773  -7.008 -13.792
  192    H    ASN  24           H        ASN  24   1.134  -8.571 -10.369
  193    HA   ASN  24           HA       ASN  24   3.121  -8.086  -9.613
  194    HB2  ASN  24           HB2      ASN  24   4.364  -7.960 -12.375
  195    HB3  ASN  24           HB3      ASN  24   5.180  -8.066 -10.829
  196   HD21  ASN  24          HD22      ASN  24   3.346  -9.849 -13.223
  197   HD22  ASN  24          HD21      ASN  24   3.812 -11.448 -12.606
  198    H    ALA  25           H        ALA  25   1.051  -6.079 -11.140
  199    HA   ALA  25           HA       ALA  25   2.648  -3.695 -11.388
  200    HB1  ALA  25           HB1      ALA  25  -0.328  -3.993 -10.795
  201    HB2  ALA  25           HB2      ALA  25   0.492  -2.547 -11.416
  202    HB3  ALA  25           HB3      ALA  25   0.405  -4.010 -12.414
  203    H    SER  26           H        SER  26   2.510  -1.751  -9.918
  204    HA   SER  26           HA       SER  26   2.084  -2.370  -7.049
  205    HB2  SER  26           HB2      SER  26   4.301  -1.552  -6.477
  206    HB3  SER  26           HB3      SER  26   4.444  -2.956  -7.556
  207    HG   SER  26           HG       SER  26   4.337  -0.340  -8.611
  208    H    GLN  27           H        GLN  27   1.252  -0.648  -5.942
  209    HA   GLN  27           HA       GLN  27   1.837   2.098  -6.851
  210    HB2  GLN  27           HB2      GLN  27  -0.345   2.778  -7.092
  211    HB3  GLN  27           HB3      GLN  27  -0.360   1.226  -7.893
  212    HG2  GLN  27           HG2      GLN  27  -1.304   0.218  -5.744
  213    HG3  GLN  27           HG3      GLN  27  -1.458   1.869  -5.121
  214   HE21  GLN  27          HE22      GLN  27  -2.548   3.419  -7.181
  215   HE22  GLN  27          HE21      GLN  27  -4.043   2.613  -7.668
  216    H    PHE  28           H        PHE  28   1.328   3.715  -5.030
  217    HA   PHE  28           HA       PHE  28   1.905   2.356  -2.412
  218    HB2  PHE  28           HB2      PHE  28   2.577   5.052  -3.531
  219    HB3  PHE  28           HB3      PHE  28   2.319   4.883  -1.803
  220    HD1  PHE  28           HD1      PHE  28   4.142   2.977  -4.524
  221    HD2  PHE  28           HD2      PHE  28   4.173   4.433  -0.462
  222    HE1  PHE  28           HE1      PHE  28   6.419   2.065  -4.211
  223    HE2  PHE  28           HE2      PHE  28   6.458   3.527  -0.163
  224    HZ   PHE  28           HZ       PHE  28   7.591   2.352  -2.043
  225    H    GLU  29           H        GLU  29  -0.432   4.216  -4.118
  226    HA   GLU  29           HA       GLU  29  -2.053   5.201  -2.072
  227    HB2  GLU  29           HB2      GLU  29  -3.180   4.138  -4.682
  228    HB3  GLU  29           HB3      GLU  29  -3.748   5.463  -3.678
  229    HG2  GLU  29           HG2      GLU  29  -2.773   6.593  -5.443
  230    HG3  GLU  29           HG3      GLU  29  -1.450   6.600  -4.277
  231    H    ARG  30           H        ARG  30  -2.787   4.050  -0.360
  232    HA   ARG  30           HA       ARG  30  -3.604   1.340  -0.336
  233    HB2  ARG  30           HB2      ARG  30  -3.072   2.760   1.626
  234    HB3  ARG  30           HB3      ARG  30  -4.571   3.656   1.395
  235    HG2  ARG  30           HG2      ARG  30  -4.306   0.709   2.146
  236    HG3  ARG  30           HG3      ARG  30  -4.701   2.040   3.234
  237    HD2  ARG  30           HD2      ARG  30  -6.769   2.453   1.786
  238    HD3  ARG  30           HD3      ARG  30  -6.388   0.910   0.997
  239    HE   ARG  30           HE       ARG  30  -6.622   0.742   3.905
  240   HH11  ARG  30          HH11      ARG  30  -8.464   0.633   0.879
  241   HH12  ARG  30          HH12      ARG  30  -9.736  -0.336   1.659
  242   HH21  ARG  30          HH21      ARG  30  -8.565  -0.372   4.756
  243   HH22  ARG  30          HH22      ARG  30  -9.827  -0.670   3.538
  244    HA   PRO  31           HA       PRO  31  -6.996   1.962  -3.149
  245    HB2  PRO  31           HB2      PRO  31  -8.281  -0.497  -2.932
  246    HB3  PRO  31           HB3      PRO  31  -6.810  -0.162  -3.893
  247    HG2  PRO  31           HG2      PRO  31  -7.001  -1.338  -1.117
  248    HG3  PRO  31           HG3      PRO  31  -5.963  -1.863  -2.483
  249    HD2  PRO  31           HD2      PRO  31  -5.033  -0.337  -0.447
  250    HD3  PRO  31           HD3      PRO  31  -4.454  -0.093  -2.119
  251    H    SER  32           H        SER  32  -9.474   1.811  -3.276
  252    HA   SER  32           HA       SER  32 -10.429   3.552  -1.314
  253    HB2  SER  32           HB2      SER  32 -12.470   3.547  -2.656
  254    HB3  SER  32           HB3      SER  32 -11.024   3.615  -3.683
  255    HG   SER  32           HG       SER  32 -12.396   1.255  -2.961
  256    H    GLY  33           H        GLY  33 -10.289   2.440   0.691
  257    HA2  GLY  33           HA2      GLY  33 -11.324   1.846   2.638
  258    HA3  GLY  33           HA3      GLY  33 -12.856   2.006   1.796
  Start of MODEL   19
    1    H1   LYS   1           H1       LYS   1  -8.218   4.613  -7.582
    2    H2   LYS   1           H2       LYS   1  -7.391   5.154  -6.253
    3    H3   LYS   1           H3       LYS   1  -9.018   5.444  -6.385
    4    HA   LYS   1           HA       LYS   1  -7.819   3.417  -5.064
    5    HB2  LYS   1           HB2      LYS   1 -10.624   4.067  -5.862
    6    HB3  LYS   1           HB3      LYS   1 -10.324   2.376  -5.522
    7    HG2  LYS   1           HG2      LYS   1 -10.982   3.170  -3.489
    8    HG3  LYS   1           HG3      LYS   1  -9.246   3.066  -3.325
    9    HD2  LYS   1           HD2      LYS   1 -10.768   5.644  -3.922
   10    HD3  LYS   1           HD3      LYS   1 -10.445   5.077  -2.294
   11    HE2  LYS   1           HE2      LYS   1  -8.265   5.760  -4.301
   12    HE3  LYS   1           HE3      LYS   1  -8.890   6.875  -3.094
   13    HZ1  LYS   1           HZ1      LYS   1  -7.708   4.257  -2.370
   14    HZ2  LYS   1           HZ2      LYS   1  -6.792   5.551  -2.555
   15    HZ3  LYS   1           HZ3      LYS   1  -7.985   5.541  -1.375
   16    H    LEU   2           H        LEU   2  -8.310   0.907  -5.438
   17    HA   LEU   2           HA       LEU   2  -7.670   0.221  -8.221
   18    HB2  LEU   2           HB2      LEU   2  -5.669  -0.910  -7.610
   19    HB3  LEU   2           HB3      LEU   2  -5.581   0.739  -7.033
   20    HG   LEU   2           HG       LEU   2  -5.964  -1.793  -5.367
   21   HD11  LEU   2          HD11      LEU   2  -3.822   0.379  -5.306
   22   HD12  LEU   2          HD12      LEU   2  -3.857  -1.150  -4.414
   23   HD13  LEU   2          HD13      LEU   2  -3.663  -1.157  -6.176
   24   HD21  LEU   2          HD21      LEU   2  -6.038   1.090  -4.411
   25   HD22  LEU   2          HD22      LEU   2  -7.292  -0.175  -4.180
   26   HD23  LEU   2          HD23      LEU   2  -5.732  -0.327  -3.387
   27    HA   PRO   3           HA       PRO   3 -10.392  -3.081  -7.394
   28    HB2  PRO   3           HB2      PRO   3  -9.896  -4.792  -9.481
   29    HB3  PRO   3           HB3      PRO   3 -10.484  -3.121  -9.727
   30    HG2  PRO   3           HG2      PRO   3  -7.623  -4.136  -9.834
   31    HG3  PRO   3           HG3      PRO   3  -8.494  -3.162 -11.064
   32    HD2  PRO   3           HD2      PRO   3  -6.885  -1.997  -9.202
   33    HD3  PRO   3           HD3      PRO   3  -8.404  -1.224  -9.741
   34    HA   PRO   4           HA       PRO   4  -8.763  -6.743  -5.310
   35    HB2  PRO   4           HB2      PRO   4 -10.230  -8.846  -6.389
   36    HB3  PRO   4           HB3      PRO   4 -10.811  -7.733  -5.113
   37    HG2  PRO   4           HG2      PRO   4 -11.293  -7.564  -8.100
   38    HG3  PRO   4           HG3      PRO   4 -12.487  -7.390  -6.771
   39    HD2  PRO   4           HD2      PRO   4 -11.448  -5.220  -7.958
   40    HD3  PRO   4           HD3      PRO   4 -11.643  -5.242  -6.187
   41    H    GLY   5           H        GLY   5  -7.111  -8.158  -5.618
   42    HA2  GLY   5           HA2      GLY   5  -5.700  -9.581  -7.092
   43    HA3  GLY   5           HA3      GLY   5  -5.975  -8.397  -8.380
   44    H    TRP   6           H        TRP   6  -5.864  -6.143  -6.335
   45    HA   TRP   6           HA       TRP   6  -2.937  -5.867  -6.009
   46    HB2  TRP   6           HB2      TRP   6  -5.304  -4.003  -5.662
   47    HB3  TRP   6           HB3      TRP   6  -3.646  -3.574  -5.290
   48    HD1  TRP   6           HD1      TRP   6  -5.886  -4.352  -8.291
   49    HE1  TRP   6           HE1      TRP   6  -4.853  -3.296 -10.409
   50    HE3  TRP   6           HE3      TRP   6  -1.406  -2.868  -6.341
   51    HZ2  TRP   6           HZ2      TRP   6  -2.387  -1.992 -11.146
   52    HZ3  TRP   6           HZ3      TRP   6   0.240  -1.708  -7.752
   53    HH2  TRP   6           HH2      TRP   6  -0.207  -1.260 -10.138
   54    H    GLU   7           H        GLU   7  -1.943  -6.185  -4.066
   55    HA   GLU   7           HA       GLU   7  -3.605  -6.459  -1.607
   56    HB2  GLU   7           HB2      GLU   7  -3.354  -8.560  -2.773
   57    HB3  GLU   7           HB3      GLU   7  -1.612  -8.417  -2.825
   58    HG2  GLU   7           HG2      GLU   7  -3.096  -8.406  -0.169
   59    HG3  GLU   7           HG3      GLU   7  -2.916  -9.918  -1.054
   60    H    LYS   8           H        LYS   8  -2.694  -5.747   0.280
   61    HA   LYS   8           HA       LYS   8  -0.819  -3.738   0.093
   62    HB2  LYS   8           HB2      LYS   8  -1.317  -3.237   2.264
   63    HB3  LYS   8           HB3      LYS   8  -2.765  -4.079   1.749
   64    HG2  LYS   8           HG2      LYS   8  -0.536  -5.266   3.448
   65    HG3  LYS   8           HG3      LYS   8  -2.034  -4.614   4.057
   66    HD2  LYS   8           HD2      LYS   8  -3.326  -6.389   3.396
   67    HD3  LYS   8           HD3      LYS   8  -2.294  -6.845   2.042
   68    HE2  LYS   8           HE2      LYS   8  -1.330  -7.106   4.900
   69    HE3  LYS   8           HE3      LYS   8  -2.290  -8.377   4.119
   70    HZ1  LYS   8           HZ1      LYS   8  -0.670  -8.625   2.429
   71    HZ2  LYS   8           HZ2      LYS   8   0.150  -7.323   2.825
   72    HZ3  LYS   8           HZ3      LYS   8   0.184  -8.652   3.846
   73    H    ARG   9           H        ARG   9   1.200  -3.379   0.687
   74    HA   ARG   9           HA       ARG   9   2.948  -5.474   1.887
   75    HB2  ARG   9           HB2      ARG   9   3.492  -3.983  -0.709
   76    HB3  ARG   9           HB3      ARG   9   4.654  -5.039   0.103
   77    HG2  ARG   9           HG2      ARG   9   2.038  -5.881  -1.196
   78    HG3  ARG   9           HG3      ARG   9   3.653  -6.081  -1.863
   79    HD2  ARG   9           HD2      ARG   9   4.266  -7.695  -0.175
   80    HD3  ARG   9           HD3      ARG   9   2.799  -7.373   0.749
   81    HE   ARG   9           HE       ARG   9   1.495  -8.636  -0.735
   82   HH11  ARG   9          HH11      ARG   9   4.677  -8.385  -2.233
   83   HH12  ARG   9          HH12      ARG   9   4.212  -9.500  -3.497
   84   HH21  ARG   9          HH22      ARG   9   1.041  -9.933  -2.129
   85   HH22  ARG   9          HH21      ARG   9   2.150 -10.517  -3.405
   86    H    MET  10           H        MET  10   5.079  -4.577   2.532
   87    HA   MET  10           HA       MET  10   4.849  -1.740   3.416
   88    HB2  MET  10           HB2      MET  10   6.364  -4.098   4.587
   89    HB3  MET  10           HB3      MET  10   6.555  -2.417   5.108
   90    HG2  MET  10           HG2      MET  10   4.153  -2.294   5.671
   91    HG3  MET  10           HG3      MET  10   3.937  -3.962   5.138
   92    HE1  MET  10           HE1      MET  10   6.819  -2.277   7.409
   93    HE2  MET  10           HE2      MET  10   5.263  -1.545   7.875
   94    HE3  MET  10           HE3      MET  10   6.115  -2.624   9.001
   95    H    PHE  11           H        PHE  11   6.136  -0.302   2.574
   96    HA   PHE  11           HA       PHE  11   8.380  -0.980   0.794
   97    HB2  PHE  11           HB2      PHE  11   6.668   0.816   0.290
   98    HB3  PHE  11           HB3      PHE  11   7.252   1.702   1.683
   99    HD1  PHE  11           HD1      PHE  11   8.466   0.092  -1.501
  100    HD2  PHE  11           HD2      PHE  11   8.933   3.341   1.304
  101    HE1  PHE  11           HE1      PHE  11  10.148   1.142  -2.990
  102    HE2  PHE  11           HE2      PHE  11  10.595   4.395  -0.211
  103    HZ   PHE  11           HZ       PHE  11  11.214   3.294  -2.344
  104    H    ALA  12           H        ALA  12  10.283  -1.412   1.743
  105    HA   ALA  12           HA       ALA  12  10.786  -1.482   4.404
  106    HB1  ALA  12           HB1      ALA  12  12.814  -1.227   2.148
  107    HB2  ALA  12           HB2      ALA  12  13.123  -1.905   3.760
  108    HB3  ALA  12           HB3      ALA  12  11.996  -2.723   2.663
  109    H    ASN  13           H        ASN  13  11.445   1.416   2.413
  110    HA   ASN  13           HA       ASN  13  13.023   2.777   4.362
  111    HB2  ASN  13           HB2      ASN  13  11.233   3.895   2.182
  112    HB3  ASN  13           HB3      ASN  13  12.518   4.764   3.009
  113   HD21  ASN  13          HD22      ASN  13  14.631   4.640   2.115
  114   HD22  ASN  13          HD21      ASN  13  14.984   3.486   0.838
  115    H    GLY  14           H        GLY  14   9.719   1.939   4.611
  116    HA2  GLY  14           HA2      GLY  14   8.665   2.332   6.747
  117    HA3  GLY  14           HA3      GLY  14   9.312   3.975   6.773
  118    H    THR  15           H        THR  15   7.285   1.912   4.558
  119    HA   THR  15           HA       THR  15   5.037   3.756   4.736
  120    HB   THR  15           HB       THR  15   6.919   3.787   2.382
  121    HG1  THR  15           HG1      THR  15   6.624   5.338   4.194
  122   HG21  THR  15          HG21      THR  15   5.286   4.973   0.990
  123   HG22  THR  15          HG22      THR  15   4.848   3.278   1.190
  124   HG23  THR  15          HG23      THR  15   3.985   4.546   2.114
  125    H    VAL  16           H        VAL  16   3.229   2.936   3.194
  126    HA   VAL  16           HA       VAL  16   3.440   0.004   2.724
  127    HB   VAL  16           HB       VAL  16   1.230   1.565   4.034
  128   HG11  VAL  16          HG11      VAL  16  -0.385  -0.245   3.668
  129   HG12  VAL  16          HG12      VAL  16   0.020   0.519   2.137
  130   HG13  VAL  16          HG13      VAL  16   0.729  -1.056   2.551
  131   HG21  VAL  16          HG21      VAL  16   1.216  -0.411   5.493
  132   HG22  VAL  16          HG22      VAL  16   2.336  -1.253   4.401
  133   HG23  VAL  16          HG23      VAL  16   2.882   0.172   5.321
  134    H    TYR  17           H        TYR  17   2.499  -0.809   0.905
  135    HA   TYR  17           HA       TYR  17   1.282   1.031  -1.046
  136    HB2  TYR  17           HB2      TYR  17   2.873   0.591  -2.761
  137    HB3  TYR  17           HB3      TYR  17   3.803   1.011  -1.364
  138    HD1  TYR  17           HD2      TYR  17   5.028  -0.726  -0.043
  139    HD2  TYR  17           HD1      TYR  17   3.116  -1.618  -3.802
  140    HE1  TYR  17           HE2      TYR  17   6.506  -2.722  -0.332
  141    HE2  TYR  17           HE1      TYR  17   4.560  -3.602  -4.070
  142    HH   TYR  17           HH       TYR  17   6.396  -4.721  -3.268
  143    H    TYR  18           H        TYR  18   0.565  -0.397  -3.035
  144    HA   TYR  18           HA       TYR  18  -0.205  -3.140  -2.164
  145    HB2  TYR  18           HB2      TYR  18  -1.592  -1.025  -3.812
  146    HB3  TYR  18           HB3      TYR  18  -1.960  -2.737  -4.025
  147    HD1  TYR  18           HD1      TYR  18  -1.649  -0.193  -1.253
  148    HD2  TYR  18           HD2      TYR  18  -3.720  -3.658  -2.763
  149    HE1  TYR  18           HE1      TYR  18  -2.792  -0.447   0.884
  150    HE2  TYR  18           HE2      TYR  18  -5.042  -3.769  -0.704
  151    HH   TYR  18           HH       TYR  18  -4.656  -1.342   1.963
  152    H    PHE  19           H        PHE  19   0.289  -4.827  -3.334
  153    HA   PHE  19           HA       PHE  19   1.831  -4.545  -5.868
  154    HB2  PHE  19           HB2      PHE  19   3.120  -5.505  -4.092
  155    HB3  PHE  19           HB3      PHE  19   1.800  -6.537  -3.587
  156    HD1  PHE  19           HD2      PHE  19   1.176  -8.581  -4.932
  157    HD2  PHE  19           HD1      PHE  19   4.667  -6.204  -5.835
  158    HE1  PHE  19           HE2      PHE  19   2.186 -10.490  -6.160
  159    HE2  PHE  19           HE1      PHE  19   5.600  -8.076  -7.147
  160    HZ   PHE  19           HZ       PHE  19   4.355 -10.225  -7.319
  161    H    ASN  20           H        ASN  20   0.922  -5.362  -7.686
  162    HA   ASN  20           HA       ASN  20  -1.732  -6.617  -7.541
  163    HB2  ASN  20           HB2      ASN  20  -1.178  -4.864  -9.245
  164    HB3  ASN  20           HB3      ASN  20  -0.000  -5.968  -9.935
  165   HD21  ASN  20          HD22      ASN  20  -3.525  -5.414  -9.449
  166   HD22  ASN  20          HD21      ASN  20  -3.964  -6.701 -10.563
  167    H    HIS  21           H        HIS  21  -1.671  -8.722  -6.845
  168    HA   HIS  21           HA       HIS  21   0.582 -10.436  -7.551
  169    HB2  HIS  21           HB2      HIS  21  -0.484 -12.078  -6.121
  170    HB3  HIS  21           HB3      HIS  21  -0.363 -10.522  -5.331
  171    HD1  HIS  21           HD1      HIS  21  -2.516  -9.789  -4.135
  172    HD2  HIS  21           HD2      HIS  21  -3.151 -12.484  -7.309
  173    HE1  HIS  21           HE1      HIS  21  -5.012 -10.358  -4.130
  174    H    ILE  22           H        ILE  22  -1.772  -9.485  -9.574
  175    HA   ILE  22           HA       ILE  22  -2.027 -12.135 -10.903
  176    HB   ILE  22           HB       ILE  22  -3.329  -9.456 -11.538
  177   HG12  ILE  22          HG12      ILE  22  -4.491 -11.948 -10.208
  178   HG13  ILE  22          HG13      ILE  22  -4.123 -10.434  -9.386
  179   HG21  ILE  22          HG21      ILE  22  -3.104 -10.833 -13.567
  180   HG22  ILE  22          HG22      ILE  22  -3.827 -12.221 -12.725
  181   HG23  ILE  22          HG23      ILE  22  -4.777 -10.760 -13.078
  182   HD11  ILE  22          HD11      ILE  22  -5.792  -9.259 -10.841
  183   HD12  ILE  22          HD12      ILE  22  -6.297 -10.857 -11.452
  184   HD13  ILE  22          HD13      ILE  22  -6.463 -10.477  -9.737
  185    H    THR  23           H        THR  23  -0.157  -9.195 -10.949
  186    HA   THR  23           HA       THR  23   1.084  -9.949 -13.585
  187    HB   THR  23           HB       THR  23   1.186  -7.543 -14.114
  188    HG1  THR  23           HG1      THR  23  -0.554  -7.218 -11.903
  189   HG21  THR  23          HG21      THR  23  -0.761  -8.839 -14.948
  190   HG22  THR  23          HG22      THR  23  -1.684  -8.374 -13.504
  191   HG23  THR  23          HG23      THR  23  -1.140  -7.132 -14.651
  192    H    ASN  24           H        ASN  24   1.714  -8.839 -10.321
  193    HA   ASN  24           HA       ASN  24   3.531  -8.468  -9.172
  194    HB2  ASN  24           HB2      ASN  24   5.339  -8.590 -11.604
  195    HB3  ASN  24           HB3      ASN  24   5.793  -8.670  -9.913
  196   HD21  ASN  24          HD22      ASN  24   4.368 -10.442 -12.577
  197   HD22  ASN  24          HD21      ASN  24   4.553 -12.035 -11.810
  198    H    ALA  25           H        ALA  25   2.013  -6.390 -11.182
  199    HA   ALA  25           HA       ALA  25   3.793  -4.132 -11.137
  200    HB1  ALA  25           HB1      ALA  25   1.779  -4.326 -12.586
  201    HB2  ALA  25           HB2      ALA  25   0.744  -4.193 -11.150
  202    HB3  ALA  25           HB3      ALA  25   1.782  -2.838 -11.623
  203    H    SER  26           H        SER  26   3.296  -2.061  -9.744
  204    HA   SER  26           HA       SER  26   2.165  -2.585  -7.109
  205    HB2  SER  26           HB2      SER  26   5.152  -2.232  -7.504
  206    HB3  SER  26           HB3      SER  26   4.332  -1.902  -5.962
  207    HG   SER  26           HG       SER  26   3.710  -4.298  -7.250
  208    H    GLN  27           H        GLN  27   1.577  -0.737  -6.011
  209    HA   GLN  27           HA       GLN  27   2.640   1.868  -6.797
  210    HB2  GLN  27           HB2      GLN  27   0.867   1.373  -8.501
  211    HB3  GLN  27           HB3      GLN  27  -0.312   1.176  -7.207
  212    HG2  GLN  27           HG2      GLN  27  -0.438   3.376  -8.376
  213    HG3  GLN  27           HG3      GLN  27  -0.172   3.537  -6.648
  214   HE21  GLN  27          HE21      GLN  27   1.316   4.056  -9.870
  215   HE22  GLN  27          HE22      GLN  27   2.683   4.916  -9.179
  216    H    PHE  28           H        PHE  28   2.073   3.552  -5.309
  217    HA   PHE  28           HA       PHE  28   1.793   2.604  -2.586
  218    HB2  PHE  28           HB2      PHE  28   2.081   5.373  -3.796
  219    HB3  PHE  28           HB3      PHE  28   2.131   5.026  -2.071
  220    HD1  PHE  28           HD2      PHE  28   3.827   3.236  -1.257
  221    HD2  PHE  28           HD1      PHE  28   4.135   5.265  -5.045
  222    HE1  PHE  28           HE2      PHE  28   6.257   2.706  -1.344
  223    HE2  PHE  28           HE1      PHE  28   6.556   4.725  -5.134
  224    HZ   PHE  28           HZ       PHE  28   7.622   3.449  -3.281
  225    H    GLU  29           H        GLU  29  -0.612   3.467  -4.816
  226    HA   GLU  29           HA       GLU  29  -2.491   4.763  -3.042
  227    HB2  GLU  29           HB2      GLU  29  -2.293   4.211  -5.821
  228    HB3  GLU  29           HB3      GLU  29  -3.712   3.322  -5.295
  229    HG2  GLU  29           HG2      GLU  29  -3.233   6.269  -4.649
  230    HG3  GLU  29           HG3      GLU  29  -4.038   5.718  -6.114
  231    H    ARG  30           H        ARG  30  -4.546   3.875  -2.380
  232    HA   ARG  30           HA       ARG  30  -4.318   1.050  -1.427
  233    HB2  ARG  30           HB2      ARG  30  -5.468   3.252   0.286
  234    HB3  ARG  30           HB3      ARG  30  -4.811   1.688   0.751
  235    HG2  ARG  30           HG2      ARG  30  -3.168   4.095  -0.149
  236    HG3  ARG  30           HG3      ARG  30  -3.486   3.624   1.514
  237    HD2  ARG  30           HD2      ARG  30  -2.299   1.496   1.185
  238    HD3  ARG  30           HD3      ARG  30  -2.025   1.889  -0.511
  239    HE   ARG  30           HE       ARG  30  -0.378   3.357   0.044
  240   HH11  ARG  30          HH11      ARG  30  -2.057   2.532   3.097
  241   HH12  ARG  30          HH12      ARG  30  -0.917   3.444   4.049
  242   HH21  ARG  30          HH21      ARG  30   1.284   3.859   1.464
  243   HH22  ARG  30          HH22      ARG  30   0.870   4.411   3.087
  244    HA   PRO  31           HA       PRO  31  -8.790   0.887  -2.221
  245    HB2  PRO  31           HB2      PRO  31  -9.142  -0.853   0.162
  246    HB3  PRO  31           HB3      PRO  31  -9.520  -1.189  -1.547
  247    HG2  PRO  31           HG2      PRO  31  -7.365  -2.347  -0.293
  248    HG3  PRO  31           HG3      PRO  31  -7.309  -1.856  -2.011
  249    HD2  PRO  31           HD2      PRO  31  -6.266  -0.341   0.397
  250    HD3  PRO  31           HD3      PRO  31  -5.480  -0.666  -1.182
  251    H    SER  32           H        SER  32  -8.176   0.691   1.004
  252    HA   SER  32           HA       SER  32  -9.216   3.394   1.790
  253    HB2  SER  32           HB2      SER  32 -10.410   2.433   3.729
  254    HB3  SER  32           HB3      SER  32 -11.049   1.835   2.185
  255    HG   SER  32           HG       SER  32 -10.678   0.176   3.792
  256    H    GLY  33           H        GLY  33  -6.766   0.939   2.343
  257    HA2  GLY  33           HA2      GLY  33  -5.262   2.704   4.095
  258    HA3  GLY  33           HA3      GLY  33  -5.818   1.193   4.833
  Start of MODEL   20
    1    H1   LYS   1           H1       LYS   1 -11.491  -1.077   0.627
    2    H2   LYS   1           H2       LYS   1 -11.192  -1.249  -0.979
    3    H3   LYS   1           H3       LYS   1  -9.977  -0.798  -0.008
    4    HA   LYS   1           HA       LYS   1  -9.826  -2.912   1.034
    5    HB2  LYS   1           HB2      LYS   1 -12.483  -3.341  -0.346
    6    HB3  LYS   1           HB3      LYS   1 -11.496  -4.726   0.144
    7    HG2  LYS   1           HG2      LYS   1 -11.639  -4.255   2.428
    8    HG3  LYS   1           HG3      LYS   1 -11.984  -2.559   2.176
    9    HD2  LYS   1           HD2      LYS   1 -14.259  -3.382   1.127
   10    HD3  LYS   1           HD3      LYS   1 -13.862  -4.927   1.898
   11    HE2  LYS   1           HE2      LYS   1 -15.238  -3.730   3.449
   12    HE3  LYS   1           HE3      LYS   1 -13.585  -3.637   4.083
   13    HZ1  LYS   1           HZ1      LYS   1 -14.998  -1.506   2.531
   14    HZ2  LYS   1           HZ2      LYS   1 -14.578  -1.424   4.140
   15    HZ3  LYS   1           HZ3      LYS   1 -13.490  -1.400   2.865
   16    H    LEU   2           H        LEU   2  -8.758  -4.797   0.059
   17    HA   LEU   2           HA       LEU   2  -7.249  -4.050  -2.223
   18    HB2  LEU   2           HB2      LEU   2  -7.583  -6.753  -0.874
   19    HB3  LEU   2           HB3      LEU   2  -6.295  -6.310  -1.984
   20    HG   LEU   2           HG       LEU   2  -6.776  -5.047   0.756
   21   HD11  LEU   2          HD11      LEU   2  -5.957  -7.357   0.931
   22   HD12  LEU   2          HD12      LEU   2  -4.624  -6.971  -0.172
   23   HD13  LEU   2          HD13      LEU   2  -4.704  -6.193   1.418
   24   HD21  LEU   2          HD21      LEU   2  -4.533  -4.061   0.459
   25   HD22  LEU   2          HD22      LEU   2  -4.485  -4.664  -1.218
   26   HD23  LEU   2          HD23      LEU   2  -5.679  -3.441  -0.720
   27    HA   PRO   3           HA       PRO   3 -10.178  -5.755  -5.289
   28    HB2  PRO   3           HB2      PRO   3  -8.196  -4.797  -7.297
   29    HB3  PRO   3           HB3      PRO   3  -9.927  -4.412  -7.146
   30    HG2  PRO   3           HG2      PRO   3  -7.981  -2.592  -6.513
   31    HG3  PRO   3           HG3      PRO   3  -9.531  -2.690  -5.614
   32    HD2  PRO   3           HD2      PRO   3  -6.849  -3.844  -4.851
   33    HD3  PRO   3           HD3      PRO   3  -8.022  -2.950  -3.858
   34    HA   PRO   4           HA       PRO   4  -8.678  -9.681  -6.680
   35    HB2  PRO   4           HB2      PRO   4  -8.556  -8.653  -9.527
   36    HB3  PRO   4           HB3      PRO   4  -9.129 -10.244  -8.927
   37    HG2  PRO   4           HG2      PRO   4 -10.924  -8.300  -9.443
   38    HG3  PRO   4           HG3      PRO   4 -11.067  -9.241  -7.922
   39    HD2  PRO   4           HD2      PRO   4  -9.913  -6.485  -8.336
   40    HD3  PRO   4           HD3      PRO   4 -10.973  -7.077  -7.020
   41    H    GLY   5           H        GLY   5  -6.750 -10.299  -5.994
   42    HA2  GLY   5           HA2      GLY   5  -4.561 -10.927  -6.130
   43    HA3  GLY   5           HA3      GLY   5  -4.385 -10.024  -7.636
   44    H    TRP   6           H        TRP   6  -5.597  -7.802  -5.310
   45    HA   TRP   6           HA       TRP   6  -2.900  -6.657  -5.058
   46    HB2  TRP   6           HB2      TRP   6  -5.630  -5.671  -4.259
   47    HB3  TRP   6           HB3      TRP   6  -4.143  -4.826  -3.867
   48    HD1  TRP   6           HD1      TRP   6  -6.243  -5.804  -6.900
   49    HE1  TRP   6           HE1      TRP   6  -5.682  -4.242  -8.871
   50    HE3  TRP   6           HE3      TRP   6  -2.217  -3.394  -4.889
   51    HZ2  TRP   6           HZ2      TRP   6  -3.699  -2.256  -9.507
   52    HZ3  TRP   6           HZ3      TRP   6  -1.001  -1.682  -6.203
   53    HH2  TRP   6           HH2      TRP   6  -1.714  -1.112  -8.509
   54    H    GLU   7           H        GLU   7  -1.762  -6.278  -3.251
   55    HA   GLU   7           HA       GLU   7  -2.542  -7.533  -0.672
   56    HB2  GLU   7           HB2      GLU   7  -1.277  -8.996  -2.382
   57    HB3  GLU   7           HB3      GLU   7   0.087  -7.899  -2.149
   58    HG2  GLU   7           HG2      GLU   7  -0.140  -8.443   0.368
   59    HG3  GLU   7           HG3      GLU   7  -1.244  -9.739  -0.119
   60    H    LYS   8           H        LYS   8  -1.731  -6.376   1.129
   61    HA   LYS   8           HA       LYS   8  -0.479  -3.792   0.745
   62    HB2  LYS   8           HB2      LYS   8  -2.166  -4.332   2.510
   63    HB3  LYS   8           HB3      LYS   8  -1.008  -5.435   3.270
   64    HG2  LYS   8           HG2      LYS   8   0.523  -3.591   3.747
   65    HG3  LYS   8           HG3      LYS   8  -0.461  -2.476   2.779
   66    HD2  LYS   8           HD2      LYS   8  -2.355  -2.773   4.375
   67    HD3  LYS   8           HD3      LYS   8  -1.377  -3.901   5.322
   68    HE2  LYS   8           HE2      LYS   8  -1.399  -1.695   6.363
   69    HE3  LYS   8           HE3      LYS   8   0.237  -2.129   5.847
   70    HZ1  LYS   8           HZ1      LYS   8   0.001  -0.711   3.955
   71    HZ2  LYS   8           HZ2      LYS   8  -1.581  -0.420   4.234
   72    HZ3  LYS   8           HZ3      LYS   8  -0.438   0.176   5.271
   73    H    ARG   9           H        ARG   9   1.611  -3.258   0.935
   74    HA   ARG   9           HA       ARG   9   3.644  -5.226   1.874
   75    HB2  ARG   9           HB2      ARG   9   3.606  -3.741  -0.790
   76    HB3  ARG   9           HB3      ARG   9   5.018  -4.593  -0.160
   77    HG2  ARG   9           HG2      ARG   9   2.387  -5.924  -0.900
   78    HG3  ARG   9           HG3      ARG   9   3.843  -5.825  -1.893
   79    HD2  ARG   9           HD2      ARG   9   5.129  -7.098  -0.204
   80    HD3  ARG   9           HD3      ARG   9   3.677  -7.213   0.803
   81    HE   ARG   9           HE       ARG   9   2.927  -8.957  -0.461
   82   HH11  ARG   9          HH12      ARG   9   5.356  -7.413  -2.446
   83   HH12  ARG   9          HH11      ARG   9   5.084  -8.497  -3.794
   84   HH21  ARG   9          HH21      ARG   9   2.490 -10.201  -2.223
   85   HH22  ARG   9          HH22      ARG   9   3.608 -10.179  -3.574
   86    H    MET  10           H        MET  10   5.891  -4.107   1.881
   87    HA   MET  10           HA       MET  10   5.849  -1.233   2.184
   88    HB2  MET  10           HB2      MET  10   6.644  -1.166   4.488
   89    HB3  MET  10           HB3      MET  10   5.034  -1.874   4.399
   90    HG2  MET  10           HG2      MET  10   6.054  -4.151   4.577
   91    HG3  MET  10           HG3      MET  10   7.643  -3.394   4.755
   92    HE1  MET  10           HE1      MET  10   8.095  -4.721   6.962
   93    HE2  MET  10           HE2      MET  10   6.971  -4.774   8.339
   94    HE3  MET  10           HE3      MET  10   6.513  -5.521   6.791
   95    H    PHE  11           H        PHE  11   7.752  -0.316   1.950
   96    HA   PHE  11           HA       PHE  11  10.098  -1.816   1.038
   97    HB2  PHE  11           HB2      PHE  11   9.508   1.152   1.473
   98    HB3  PHE  11           HB3      PHE  11  10.975   0.519   0.759
   99    HD1  PHE  11           HD1      PHE  11  10.769  -0.876  -1.427
  100    HD2  PHE  11           HD2      PHE  11   7.572   1.566   0.134
  101    HE1  PHE  11           HE1      PHE  11   9.646  -0.915  -3.644
  102    HE2  PHE  11           HE2      PHE  11   6.467   1.527  -2.075
  103    HZ   PHE  11           HZ       PHE  11   7.492   0.283  -3.968
  104    H    ALA  12           H        ALA  12  11.673  -2.465   2.455
  105    HA   ALA  12           HA       ALA  12  11.699  -1.979   5.227
  106    HB1  ALA  12           HB1      ALA  12  13.965  -2.946   5.115
  107    HB2  ALA  12           HB2      ALA  12  12.833  -3.861   4.104
  108    HB3  ALA  12           HB3      ALA  12  13.985  -2.730   3.351
  109    H    ASN  13           H        ASN  13  12.839   0.089   2.645
  110    HA   ASN  13           HA       ASN  13  14.505   1.879   4.060
  111    HB2  ASN  13           HB2      ASN  13  12.561   2.540   1.824
  112    HB3  ASN  13           HB3      ASN  13  14.079   3.347   2.192
  113   HD21  ASN  13          HD21      ASN  13  15.963   2.584   1.078
  114   HD22  ASN  13          HD22      ASN  13  15.889   1.106   0.132
  115    H    GLY  14           H        GLY  14  11.112   1.308   4.497
  116    HA2  GLY  14           HA2      GLY  14   9.958   2.217   6.343
  117    HA3  GLY  14           HA3      GLY  14  10.877   3.720   6.224
  118    H    THR  15           H        THR  15   8.786   1.799   3.892
  119    HA   THR  15           HA       THR  15   6.767   3.921   4.027
  120    HB   THR  15           HB       THR  15   8.323   3.445   1.460
  121    HG1  THR  15           HG1      THR  15   8.631   5.142   3.375
  122   HG21  THR  15          HG21      THR  15   6.800   5.176   0.460
  123   HG22  THR  15          HG22      THR  15   6.010   3.622   0.739
  124   HG23  THR  15          HG23      THR  15   5.721   4.987   1.852
  125    H    VAL  16           H        VAL  16   4.744   3.261   3.309
  126    HA   VAL  16           HA       VAL  16   4.416   0.336   2.885
  127    HB   VAL  16           HB       VAL  16   3.012   2.380   4.426
  128   HG11  VAL  16          HG11      VAL  16   1.160   0.671   2.724
  129   HG12  VAL  16          HG12      VAL  16   0.720   1.731   4.095
  130   HG13  VAL  16          HG13      VAL  16   1.342   2.436   2.614
  131   HG21  VAL  16          HG21      VAL  16   2.699  -0.643   4.271
  132   HG22  VAL  16          HG22      VAL  16   3.895   0.233   5.256
  133   HG23  VAL  16          HG23      VAL  16   2.173   0.421   5.605
  134    H    TYR  17           H        TYR  17   3.183  -0.525   1.186
  135    HA   TYR  17           HA       TYR  17   1.772   1.279  -0.603
  136    HB2  TYR  17           HB2      TYR  17   2.927   0.789  -2.606
  137    HB3  TYR  17           HB3      TYR  17   4.143   1.288  -1.469
  138    HD1  TYR  17           HD1      TYR  17   5.439  -0.629  -0.214
  139    HD2  TYR  17           HD2      TYR  17   3.143  -1.236  -3.823
  140    HE1  TYR  17           HE1      TYR  17   6.795  -2.638  -0.742
  141    HE2  TYR  17           HE2      TYR  17   4.529  -3.180  -4.385
  142    HH   TYR  17           HH       TYR  17   6.448  -4.365  -3.830
  143    H    TYR  18           H        TYR  18   1.000  -0.253  -2.600
  144    HA   TYR  18           HA       TYR  18   0.125  -2.868  -1.526
  145    HB2  TYR  18           HB2      TYR  18  -1.515  -0.879  -3.143
  146    HB3  TYR  18           HB3      TYR  18  -2.031  -2.499  -2.664
  147    HD1  TYR  18           HD1      TYR  18  -2.672  -3.007  -0.351
  148    HD2  TYR  18           HD2      TYR  18  -1.249   0.918  -1.453
  149    HE1  TYR  18           HE1      TYR  18  -3.133  -2.190   1.937
  150    HE2  TYR  18           HE2      TYR  18  -1.695   1.738   0.815
  151    HH   TYR  18           HH       TYR  18  -2.767   1.232   2.805
  152    H    PHE  19           H        PHE  19   0.484  -4.543  -2.873
  153    HA   PHE  19           HA       PHE  19   1.640  -4.085  -5.593
  154    HB2  PHE  19           HB2      PHE  19   3.228  -4.933  -3.930
  155    HB3  PHE  19           HB3      PHE  19   2.115  -6.211  -3.471
  156    HD1  PHE  19           HD1      PHE  19   4.361  -4.998  -6.192
  157    HD2  PHE  19           HD2      PHE  19   2.033  -8.307  -4.693
  158    HE1  PHE  19           HE1      PHE  19   5.390  -6.479  -7.879
  159    HE2  PHE  19           HE2      PHE  19   3.210  -9.816  -6.284
  160    HZ   PHE  19           HZ       PHE  19   4.807  -8.899  -7.933
  161    H    ASN  20           H        ASN  20   0.768  -5.294  -7.297
  162    HA   ASN  20           HA       ASN  20  -1.568  -7.018  -6.631
  163    HB2  ASN  20           HB2      ASN  20  -1.912  -5.146  -8.235
  164    HB3  ASN  20           HB3      ASN  20  -0.729  -5.902  -9.302
  165   HD21  ASN  20          HD22      ASN  20  -3.987  -6.175  -7.948
  166   HD22  ASN  20          HD21      ASN  20  -4.497  -7.561  -8.858
  167    H    HIS  21           H        HIS  21  -0.856  -9.046  -6.135
  168    HA   HIS  21           HA       HIS  21   1.478 -10.174  -7.466
  169    HB2  HIS  21           HB2      HIS  21   1.166 -12.058  -5.957
  170    HB3  HIS  21           HB3      HIS  21   1.166 -10.534  -5.108
  171    HD1  HIS  21           HD1      HIS  21  -0.255 -11.028  -3.051
  172    HD2  HIS  21           HD2      HIS  21  -1.962 -12.369  -6.682
  173    HE1  HIS  21           HE1      HIS  21  -2.645 -11.808  -2.527
  174    H    ILE  22           H        ILE  22  -1.479  -9.804  -8.818
  175    HA   ILE  22           HA       ILE  22  -1.154 -12.364 -10.298
  176    HB   ILE  22           HB       ILE  22  -3.436 -11.468  -9.093
  177   HG12  ILE  22          HG12      ILE  22  -4.620 -13.118 -10.627
  178   HG13  ILE  22          HG13      ILE  22  -3.074 -13.330 -11.455
  179   HG21  ILE  22          HG21      ILE  22  -3.782  -9.608 -10.688
  180   HG22  ILE  22          HG22      ILE  22  -3.858 -10.783 -12.022
  181   HG23  ILE  22          HG23      ILE  22  -5.068 -10.805 -10.730
  182   HD11  ILE  22          HD11      ILE  22  -3.470 -15.061  -9.718
  183   HD12  ILE  22          HD12      ILE  22  -2.057 -14.083  -9.285
  184   HD13  ILE  22          HD13      ILE  22  -3.617 -13.800  -8.478
  185    H    THR  23           H        THR  23  -0.375  -9.129 -10.517
  186    HA   THR  23           HA       THR  23   0.164  -9.432 -13.457
  187    HB   THR  23           HB       THR  23  -0.345  -7.025 -13.739
  188    HG1  THR  23           HG1      THR  23  -1.467  -7.239 -11.143
  189   HG21  THR  23          HG21      THR  23  -2.756  -7.105 -13.687
  190   HG22  THR  23          HG22      THR  23  -2.140  -8.681 -14.223
  191   HG23  THR  23          HG23      THR  23  -2.748  -8.481 -12.567
  192    H    ASN  24           H        ASN  24   1.383  -8.329 -10.353
  193    HA   ASN  24           HA       ASN  24   3.320  -7.643  -9.636
  194    HB2  ASN  24           HB2      ASN  24   4.419  -7.230 -12.433
  195    HB3  ASN  24           HB3      ASN  24   5.304  -7.268 -10.920
  196   HD21  ASN  24          HD22      ASN  24   3.672  -9.213 -13.324
  197   HD22  ASN  24          HD21      ASN  24   4.380 -10.750 -12.781
  198    H    ALA  25           H        ALA  25   0.939  -5.869 -10.980
  199    HA   ALA  25           HA       ALA  25   2.157  -3.287 -11.210
  200    HB1  ALA  25           HB1      ALA  25  -0.714  -3.981 -10.467
  201    HB2  ALA  25           HB2      ALA  25  -0.122  -2.447 -11.123
  202    HB3  ALA  25           HB3      ALA  25  -0.074  -3.910 -12.122
  203    H    SER  26           H        SER  26   1.489  -1.382  -9.653
  204    HA   SER  26           HA       SER  26   1.308  -2.049  -6.829
  205    HB2  SER  26           HB2      SER  26   3.906  -1.037  -8.015
  206    HB3  SER  26           HB3      SER  26   3.474  -0.835  -6.300
  207    HG   SER  26           HG       SER  26   3.121  -3.361  -7.441
  208    H    GLN  27           H        GLN  27   0.843  -0.283  -5.522
  209    HA   GLN  27           HA       GLN  27   0.894   2.453  -6.590
  210    HB2  GLN  27           HB2      GLN  27  -1.291   1.677  -7.333
  211    HB3  GLN  27           HB3      GLN  27  -1.653   1.004  -5.747
  212    HG2  GLN  27           HG2      GLN  27  -2.865   3.113  -6.202
  213    HG3  GLN  27           HG3      GLN  27  -1.853   3.196  -4.771
  214   HE21  GLN  27          HE22      GLN  27  -2.010   4.272  -8.242
  215   HE22  GLN  27          HE21      GLN  27  -0.925   5.615  -7.918
  216    H    PHE  28           H        PHE  28   1.022   3.992  -4.879
  217    HA   PHE  28           HA       PHE  28   1.965   2.889  -2.296
  218    HB2  PHE  28           HB2      PHE  28   2.090   5.573  -3.674
  219    HB3  PHE  28           HB3      PHE  28   2.317   5.434  -1.939
  220    HD1  PHE  28           HD2      PHE  28   3.573   3.029  -4.610
  221    HD2  PHE  28           HD1      PHE  28   4.564   5.975  -1.603
  222    HE1  PHE  28           HE2      PHE  28   5.933   2.493  -4.867
  223    HE2  PHE  28           HE1      PHE  28   6.963   5.449  -1.910
  224    HZ   PHE  28           HZ       PHE  28   7.665   3.710  -3.542
  225    H    GLU  29           H        GLU  29  -0.606   5.024  -3.619
  226    HA   GLU  29           HA       GLU  29  -1.883   5.594  -1.106
  227    HB2  GLU  29           HB2      GLU  29  -2.112   6.401  -3.800
  228    HB3  GLU  29           HB3      GLU  29  -3.633   5.580  -3.491
  229    HG2  GLU  29           HG2      GLU  29  -2.470   7.791  -1.728
  230    HG3  GLU  29           HG3      GLU  29  -3.587   8.074  -3.062
  231    H    ARG  30           H        ARG  30  -3.954   4.755  -0.317
  232    HA   ARG  30           HA       ARG  30  -3.920   1.827  -0.635
  233    HB2  ARG  30           HB2      ARG  30  -4.901   1.538   1.332
  234    HB3  ARG  30           HB3      ARG  30  -4.046   3.027   1.641
  235    HG2  ARG  30           HG2      ARG  30  -7.041   2.832   1.033
  236    HG3  ARG  30           HG3      ARG  30  -6.334   2.735   2.626
  237    HD2  ARG  30           HD2      ARG  30  -7.009   4.924   2.597
  238    HD3  ARG  30           HD3      ARG  30  -5.295   5.048   2.212
  239    HE   ARG  30           HE       ARG  30  -5.825   5.967   0.182
  240   HH11  ARG  30          HH11      ARG  30  -8.757   4.264   1.202
  241   HH12  ARG  30          HH12      ARG  30  -9.612   4.809  -0.257
  242   HH21  ARG  30          HH22      ARG  30  -7.051   6.663  -1.481
  243   HH22  ARG  30          HH21      ARG  30  -8.718   6.076  -1.688
  244    HA   PRO  31           HA       PRO  31  -7.458   1.703  -3.290
  245    HB2  PRO  31           HB2      PRO  31  -8.251  -0.888  -3.070
  246    HB3  PRO  31           HB3      PRO  31  -6.785  -0.373  -3.954
  247    HG2  PRO  31           HG2      PRO  31  -6.962  -1.475  -1.146
  248    HG3  PRO  31           HG3      PRO  31  -5.793  -1.894  -2.443
  249    HD2  PRO  31           HD2      PRO  31  -5.258  -0.131  -0.395
  250    HD3  PRO  31           HD3      PRO  31  -4.528   0.032  -2.018
  251    H    SER  32           H        SER  32  -9.179   2.775  -2.724
  252    HA   SER  32           HA       SER  32 -10.637   2.764  -0.289
  253    HB2  SER  32           HB2      SER  32 -11.421   3.602  -3.110
  254    HB3  SER  32           HB3      SER  32 -12.402   3.930  -1.675
  255    HG   SER  32           HG       SER  32 -11.099   5.672  -2.185
  256    H    GLY  33           H        GLY  33 -13.061   2.343  -0.154
  257    HA2  GLY  33           HA2      GLY  33 -14.963   1.009  -0.776
  258    HA3  GLY  33           HA3      GLY  33 -13.894  -0.224  -1.433