*HEADER    HYDROLASE                               06-MAY-09   2KIJ              
*TITLE     SOLUTION STRUCTURE OF THE ACTUATOR DOMAIN OF THE COPPER-              
*TITLE    2 TRANSPORTING ATPASE ATP7A                                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: COPPER-TRANSPORTING ATPASE 1;                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ACTUATOR DOMAIN, UNP RESIDUES 806-924;                     
*COMPND   5 SYNONYM: COPPER PUMP 1, MENKES DISEASE-ASSOCIATED PROTEIN;           
*COMPND   6 EC: 3.6.3.4;                                                         
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3) GOLD;                           
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PETG-20A (EMBL)                            
*KEYWDS    ACTUATOR, ATP7A, MENKES DISEASE, NMR, ALTERNATIVE SPLICING,           
*KEYWDS   2 ATP-BINDING, CELL MEMBRANE, COPPER, COPPER TRANSPORT,                
*KEYWDS   3 CYTOPLASM, DISEASE MUTATION, ENDOPLASMIC RETICULUM,                  
*KEYWDS   4 GLYCOPROTEIN, GOLGI APPARATUS, HYDROLASE, ION TRANSPORT,             
*KEYWDS   5 MAGNESIUM, MEMBRANE, METAL-BINDING, NUCLEOTIDE-BINDING,              
*KEYWDS   6 PHOSPHOPROTEIN, POLYMORPHISM, TRANSMEMBRANE, TRANSPORT               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    30                                                                    
*AUTHOR    L.BANCI, I.BERTINI, F.CANTINI, M.MIGLIARDI, F.NUSHI,                  
*AUTHOR   2 G.NATILE, A.ROSATO                                                   
*REVDAT   1   25-AUG-09 2KIJ    0                                                


 &align 
   ndip=102,dcut=-1.0,dwt=102*0.1,
   gigj = 102*-3.163,
   s11=35.507, s22=-40.506, s12=-32.172, s13=52.694, s23=-24.534,
   dij=102*1.01
   id(1)=72,   jd(1)=73,  dobsl(1)=  5.51,  dobsu(1)=  5.51, 
   id(2)=98,   jd(2)=99,  dobsl(2)= 13.95,  dobsu(2)= 13.95, 
   id(3)=108,   jd(3)=109,  dobsl(3)= 13.38,  dobsu(3)= 13.38, 
   id(4)=127,   jd(4)=128,  dobsl(4)=  0.16,  dobsu(4)=  0.16, 
   id(5)=137,   jd(5)=138,  dobsl(5)= 15.32,  dobsu(5)= 15.32, 
   id(6)=159,   jd(6)=160,  dobsl(6)= 19.70,  dobsu(6)= 19.70, 
   id(7)=178,   jd(7)=179,  dobsl(7)= 18.89,  dobsu(7)= 18.89, 
   id(8)=197,   jd(8)=198,  dobsl(8)= 15.32,  dobsu(8)= 15.32, 
   id(9)=208,   jd(9)=209,  dobsl(9)= 11.68,  dobsu(9)= 11.68, 
   id(10)=227,   jd(10)=228,  dobsl(10)=  9.65,  dobsu(10)=  9.65, 
   id(11)=244,   jd(11)=245,  dobsl(11)= -11.92,  dobsu(11)= -11.92, 
   id(12)=254,   jd(12)=255,  dobsl(12)= -8.19,  dobsu(12)= -8.19, 
   id(13)=268,   jd(13)=269,  dobsl(13)= -4.95,  dobsu(13)= -4.95, 
   id(14)=283,   jd(14)=284,  dobsl(14)= -2.51,  dobsu(14)= -2.51, 
   id(15)=293,   jd(15)=294,  dobsl(15)=  0.89,  dobsu(15)=  0.89, 
   id(16)=307,   jd(16)=308,  dobsl(16)= -10.78,  dobsu(16)= -10.78, 
   id(17)=326,   jd(17)=327,  dobsl(17)=  2.19,  dobsu(17)=  2.19, 
   id(18)=342,   jd(18)=343,  dobsl(18)= -7.86,  dobsu(18)= -7.86, 
   id(19)=356,   jd(19)=357,  dobsl(19)= -1.70,  dobsu(19)= -1.70, 
   id(20)=375,   jd(20)=376,  dobsl(20)= -6.00,  dobsu(20)= -6.00, 
   id(21)=387,   jd(21)=388,  dobsl(21)=  9.40,  dobsu(21)=  9.40, 
   id(22)=398,   jd(22)=399,  dobsl(22)= -6.16,  dobsu(22)= -6.16, 
   id(23)=410,   jd(23)=411,  dobsl(23)= -6.00,  dobsu(23)= -6.00, 
   id(24)=424,   jd(24)=425,  dobsl(24)=  1.54,  dobsu(24)=  1.54, 
   id(25)=443,   jd(25)=444,  dobsl(25)= -6.73,  dobsu(25)= -6.73, 
   id(26)=462,   jd(26)=463,  dobsl(26)=  5.59,  dobsu(26)=  5.59, 
   id(27)=481,   jd(27)=482,  dobsl(27)= -4.13,  dobsu(27)= -4.13, 
   id(28)=492,   jd(28)=493,  dobsl(28)= -2.19,  dobsu(28)= -2.19, 
   id(29)=507,   jd(29)=508,  dobsl(29)= -5.03,  dobsu(29)= -5.03, 
   id(30)=522,   jd(30)=523,  dobsl(30)= -0.16,  dobsu(30)= -0.16, 
   id(31)=539,   jd(31)=540,  dobsl(31)= -7.13,  dobsu(31)= -7.13, 
   id(32)=555,   jd(32)=556,  dobsl(32)=  1.22,  dobsu(32)=  1.22, 
   id(33)=567,   jd(33)=568,  dobsl(33)= -6.00,  dobsu(33)= -6.00, 
   id(34)=583,   jd(34)=584,  dobsl(34)= -11.68,  dobsu(34)= -11.68, 
   id(35)=598,   jd(35)=599,  dobsl(35)= -12.00,  dobsu(35)= -12.00, 
   id(36)=617,   jd(36)=618,  dobsl(36)= 13.22,  dobsu(36)= 13.22, 
   id(37)=633,   jd(37)=634,  dobsl(37)= 15.32,  dobsu(37)= 15.32, 
   id(38)=650,   jd(38)=651,  dobsl(38)= -2.76,  dobsu(38)= -2.76, 
   id(39)=674,   jd(39)=675,  dobsl(39)= -9.81,  dobsu(39)= -9.81, 
   id(40)=681,   jd(40)=682,  dobsl(40)= 15.73,  dobsu(40)= 15.73, 
   id(41)=693,   jd(41)=694,  dobsl(41)=  8.51,  dobsu(41)=  8.51, 
   id(42)=712,   jd(42)=713,  dobsl(42)=  7.38,  dobsu(42)=  7.38, 
   id(43)=731,   jd(43)=732,  dobsl(43)=  0.32,  dobsu(43)=  0.32, 
   id(44)=753,   jd(44)=754,  dobsl(44)= -13.70,  dobsu(44)= -13.70, 
   id(45)=769,   jd(45)=770,  dobsl(45)= -5.76,  dobsu(45)= -5.76, 
   id(46)=799,   jd(46)=800,  dobsl(46)= -9.89,  dobsu(46)= -9.89, 
   id(47)=806,   jd(47)=807,  dobsl(47)=  8.27,  dobsu(47)=  8.27, 
   id(48)=869,   jd(48)=870,  dobsl(48)= -6.08,  dobsu(48)= -6.08, 
   id(49)=904,   jd(49)=905,  dobsl(49)= -2.19,  dobsu(49)= -2.19, 
   id(50)=928,   jd(50)=929,  dobsl(50)=  2.35,  dobsu(50)=  2.35, 
   id(51)=978,   jd(51)=979,  dobsl(51)= -0.65,  dobsu(51)= -0.65, 
   id(52)=985,   jd(52)=986,  dobsl(52)= -1.46,  dobsu(52)= -1.46, 
   id(53)=1002,   jd(53)=1003,  dobsl(53)= -6.24,  dobsu(53)= -6.24, 
   id(54)=1013,   jd(54)=1014,  dobsl(54)= -7.54,  dobsu(54)= -7.54, 
   id(55)=1030,   jd(55)=1031,  dobsl(55)= -12.24,  dobsu(55)= -12.24, 
   id(56)=1046,   jd(56)=1047,  dobsl(56)= -0.08,  dobsu(56)= -0.08, 
   id(57)=1058,   jd(57)=1059,  dobsl(57)= -12.00,  dobsu(57)= -12.00, 
   id(58)=1073,   jd(58)=1074,  dobsl(58)=  4.70,  dobsu(58)=  4.70, 
   id(59)=1084,   jd(59)=1085,  dobsl(59)= 16.05,  dobsu(59)= 16.05, 
   id(60)=1103,   jd(60)=1104,  dobsl(60)=  7.46,  dobsu(60)=  7.46, 
   id(61)=1122,   jd(61)=1123,  dobsl(61)=  7.70,  dobsu(61)=  7.70, 
   id(62)=1136,   jd(62)=1137,  dobsl(62)= -0.49,  dobsu(62)= -0.49, 
   id(63)=1143,   jd(63)=1144,  dobsl(63)=  0.49,  dobsu(63)=  0.49, 
   id(64)=1158,   jd(64)=1159,  dobsl(64)=  5.76,  dobsu(64)=  5.76, 
   id(65)=1168,   jd(65)=1169,  dobsl(65)= -5.59,  dobsu(65)= -5.59, 
   id(66)=1199,   jd(66)=1200,  dobsl(66)= -11.68,  dobsu(66)= -11.68, 
   id(67)=1215,   jd(67)=1216,  dobsl(67)= -1.70,  dobsu(67)= -1.70, 
   id(68)=1225,   jd(68)=1226,  dobsl(68)= -7.46,  dobsu(68)= -7.46, 
   id(69)=1247,   jd(69)=1248,  dobsl(69)= -1.30,  dobsu(69)= -1.30, 
   id(70)=1283,   jd(70)=1284,  dobsl(70)= -7.95,  dobsu(70)= -7.95, 
   id(71)=1290,   jd(71)=1291,  dobsl(71)=  2.76,  dobsu(71)=  2.76, 
   id(72)=1301,   jd(72)=1302,  dobsl(72)=  3.00,  dobsu(72)=  3.00, 
   id(73)=1315,   jd(73)=1316,  dobsl(73)= -2.43,  dobsu(73)= -2.43, 
   id(74)=1331,   jd(74)=1332,  dobsl(74)= -9.40,  dobsu(74)= -9.40, 
   id(75)=1360,   jd(75)=1361,  dobsl(75)= 18.97,  dobsu(75)= 18.97, 
   id(76)=1367,   jd(76)=1368,  dobsl(76)= -0.89,  dobsu(76)= -0.89, 
   id(77)=1378,   jd(77)=1379,  dobsl(77)=  8.27,  dobsu(77)=  8.27, 
   id(78)=1397,   jd(78)=1398,  dobsl(78)= -8.84,  dobsu(78)= -8.84, 
   id(79)=1411,   jd(79)=1412,  dobsl(79)= -12.97,  dobsu(79)= -12.97, 
   id(80)=1428,   jd(80)=1429,  dobsl(80)= -6.24,  dobsu(80)= -6.24, 
   id(81)=1442,   jd(81)=1443,  dobsl(81)=  7.86,  dobsu(81)=  7.86, 
   id(82)=1460,   jd(82)=1461,  dobsl(82)= -0.49,  dobsu(82)= -0.49, 
   id(83)=1479,   jd(83)=1480,  dobsl(83)= -12.97,  dobsu(83)= -12.97, 
   id(84)=1498,   jd(84)=1499,  dobsl(84)= -11.11,  dobsu(84)= -11.11, 
   id(85)=1517,   jd(85)=1518,  dobsl(85)= -6.32,  dobsu(85)= -6.32, 
   id(86)=1528,   jd(86)=1529,  dobsl(86)= 10.95,  dobsu(86)= 10.95, 
   id(87)=1538,   jd(87)=1539,  dobsl(87)=  0.41,  dobsu(87)=  0.41, 
   id(88)=1552,   jd(88)=1553,  dobsl(88)= -6.81,  dobsu(88)= -6.81, 
   id(89)=1569,   jd(89)=1570,  dobsl(89)= -5.59,  dobsu(89)= -5.59, 
   id(90)=1585,   jd(90)=1586,  dobsl(90)= -0.65,  dobsu(90)= -0.65, 
   id(91)=1602,   jd(91)=1603,  dobsl(91)= 15.32,  dobsu(91)= 15.32, 
   id(92)=1614,   jd(92)=1615,  dobsl(92)= -12.00,  dobsu(92)= -12.00, 
   id(93)=1661,   jd(93)=1662,  dobsl(93)= 17.43,  dobsu(93)= 17.43, 
   id(94)=1672,   jd(94)=1673,  dobsl(94)=  7.30,  dobsu(94)=  7.30, 
   id(95)=1708,   jd(95)=1709,  dobsl(95)= 16.05,  dobsu(95)= 16.05, 
   id(96)=1724,   jd(96)=1725,  dobsl(96)=  8.51,  dobsu(96)=  8.51, 
   id(97)=1746,   jd(97)=1747,  dobsl(97)=  9.24,  dobsu(97)=  9.24, 
   id(98)=1765,   jd(98)=1766,  dobsl(98)= 17.76,  dobsu(98)= 17.76, 
   id(99)=1781,   jd(99)=1782,  dobsl(99)= 11.92,  dobsu(99)= 11.92, 
   id(100)=1796,   jd(100)=1797,  dobsl(100)=  3.49,  dobsu(100)=  3.49, 
   id(101)=1811,   jd(101)=1812,  dobsl(101)=  7.95,  dobsu(101)=  7.95, 
   id(102)=1821,   jd(102)=1822,  dobsl(102)=  4.22,  dobsu(102)=  4.22, 
 &end
ATOM      1  N   GLY     1      25.055  -8.006  11.644  1.00  0.00
ATOM      2  H1  GLY     1      24.504  -7.161  11.682  1.00  0.00
ATOM      3  H2  GLY     1      25.755  -7.971  12.371  1.00  0.00
ATOM      4  H3  GLY     1      24.430  -8.798  11.583  1.00  0.00
ATOM      5  CA  GLY     1      25.796  -8.005  10.397  1.00  0.00
ATOM      6 2HA  GLY     1      26.860  -8.048  10.629  1.00  0.00
ATOM      7 3HA  GLY     1      25.512  -8.890   9.827  1.00  0.00
ATOM      8  C   GLY     1      25.523  -6.771   9.560  1.00  0.00
ATOM      9  O   GLY     1      26.314  -6.417   8.687  1.00  0.00
ATOM     10  N   SER     2      24.398  -6.115   9.827  1.00  0.00
ATOM     11  H   SER     2      23.766  -6.461  10.535  1.00  0.00
ATOM     12  CA  SER     2      24.019  -4.916   9.088  1.00  0.00
ATOM     13  HA  SER     2      24.904  -4.454   8.652  1.00  0.00
ATOM     14  CB  SER     2      23.048  -5.271   7.961  1.00  0.00
ATOM     15 2HB  SER     2      22.816  -4.365   7.402  1.00  0.00
ATOM     16 3HB  SER     2      23.529  -5.992   7.300  1.00  0.00
ATOM     17  OG  SER     2      21.850  -5.828   8.476  1.00  0.00
ATOM     18  HG  SER     2      21.258  -6.042   7.751  1.00  0.00
ATOM     19  C   SER     2      23.384  -3.884  10.016  1.00  0.00
ATOM     20  O   SER     2      22.620  -4.230  10.917  1.00  0.00
ATOM     21  N   PHE     3      23.707  -2.615   9.788  1.00  0.00
ATOM     22  H   PHE     3      24.361  -2.383   9.055  1.00  0.00
ATOM     23  CA  PHE     3      23.169  -1.532  10.604  1.00  0.00
ATOM     24  HA  PHE     3      22.122  -1.727  10.836  1.00  0.00
ATOM     25  CB  PHE     3      23.947  -1.419  11.916  1.00  0.00
ATOM     26 2HB  PHE     3      24.653  -2.245  12.008  1.00  0.00
ATOM     27 3HB  PHE     3      24.487  -0.474  11.953  1.00  0.00
ATOM     28  CG  PHE     3      23.073  -1.463  13.137  1.00  0.00
ATOM     29  CD1 PHE     3      22.299  -0.369  13.490  1.00  0.00
ATOM     30  HD1 PHE     3      22.331   0.527  12.871  1.00  0.00
ATOM     31  CE1 PHE     3      21.493  -0.406  14.612  1.00  0.00
ATOM     32  HE1 PHE     3      20.887   0.460  14.879  1.00  0.00
ATOM     33  CZ  PHE     3      21.455  -1.543  15.396  1.00  0.00
ATOM     34  HZ  PHE     3      20.822  -1.576  16.283  1.00  0.00
ATOM     35  CE2 PHE     3      22.221  -2.640  15.054  1.00  0.00
ATOM     36  HE2 PHE     3      22.191  -3.540  15.669  1.00  0.00
ATOM     37  CD2 PHE     3      23.025  -2.597  13.931  1.00  0.00
ATOM     38  HD2 PHE     3      23.631  -3.462  13.661  1.00  0.00
ATOM     39  C   PHE     3      23.225  -0.206   9.851  1.00  0.00
ATOM     40  O   PHE     3      23.333   0.861  10.456  1.00  0.00
ATOM     41  N   THR     4      23.150  -0.281   8.525  1.00  0.00
ATOM     42  H   THR     4      23.086  -1.182   8.072  1.00  0.00
ATOM     43  CA  THR     4      23.194   0.912   7.689  1.00  0.00
ATOM     44  HA  THR     4      23.258   1.808   8.307  1.00  0.00
ATOM     45  CB  THR     4      24.402   0.884   6.734  1.00  0.00
ATOM     46  HB  THR     4      24.079   0.490   5.770  1.00  0.00
ATOM     47  CG2 THR     4      24.974   2.282   6.545  1.00  0.00
ATOM     48 1HG2 THR     4      25.297   2.676   7.509  1.00  0.00
ATOM     49 2HG2 THR     4      25.826   2.237   5.867  1.00  0.00
ATOM     50 3HG2 THR     4      24.208   2.934   6.124  1.00  0.00
ATOM     51  OG1 THR     4      25.416   0.015   7.252  1.00  0.00
ATOM     52 1HG  THR     4      26.164   0.003   6.651  1.00  0.00
ATOM     53  C   THR     4      21.917   1.055   6.869  1.00  0.00
ATOM     54  O   THR     4      21.955   1.466   5.710  1.00  0.00
ATOM     55  N   MET     5      20.786   0.714   7.479  1.00  0.00
ATOM     56  H   MET     5      20.808   0.351   8.422  1.00  0.00
ATOM     57  CA  MET     5      19.496   0.806   6.804  1.00  0.00
ATOM     58  HA  MET     5      19.494   1.657   6.123  1.00  0.00
ATOM     59  CB  MET     5      19.225  -0.465   5.998  1.00  0.00
ATOM     60 2HB  MET     5      19.427  -1.315   6.651  1.00  0.00
ATOM     61 3HB  MET     5      18.169  -0.460   5.727  1.00  0.00
ATOM     62  CG  MET     5      20.071  -0.580   4.740  1.00  0.00
ATOM     63 2HG  MET     5      20.242   0.424   4.353  1.00  0.00
ATOM     64 3HG  MET     5      21.025  -1.032   5.013  1.00  0.00
ATOM     65  SD  MET     5      19.285  -1.581   3.464  1.00  0.00
ATOM     66  CE  MET     5      20.205  -1.067   2.016  1.00  0.00
ATOM     67 1HE  MET     5      21.262  -1.293   2.158  1.00  0.00
ATOM     68 2HE  MET     5      19.834  -1.601   1.141  1.00  0.00
ATOM     69 3HE  MET     5      20.079   0.005   1.867  1.00  0.00
ATOM     70  C   MET     5      18.372   1.034   7.810  1.00  0.00
ATOM     71  O   MET     5      17.237   0.611   7.593  1.00  0.00
ATOM     72  N   SER     6      18.696   1.706   8.910  1.00  0.00
ATOM     73  H   SER     6      19.648   2.009   9.056  1.00  0.00
ATOM     74  CA  SER     6      17.714   1.987   9.951  1.00  0.00
ATOM     75  HA  SER     6      17.146   1.084  10.179  1.00  0.00
ATOM     76  CB  SER     6      18.413   2.460  11.227  1.00  0.00
ATOM     77 2HB  SER     6      18.370   3.548  11.266  1.00  0.00
ATOM     78 3HB  SER     6      17.888   2.045  12.088  1.00  0.00
ATOM     79  OG  SER     6      19.766   2.040  11.252  1.00  0.00
ATOM     80  HG  SER     6      20.182   2.348  12.061  1.00  0.00
ATOM     81  C   SER     6      16.714   3.041   9.485  1.00  0.00
ATOM     82  O   SER     6      15.564   3.056   9.922  1.00  0.00
ATOM     83  N   GLU     7      17.163   3.920   8.594  1.00  0.00
ATOM     84  H   GLU     7      18.124   3.885   8.288  1.00  0.00
ATOM     85  CA  GLU     7      16.308   4.978   8.069  1.00  0.00
ATOM     86  HA  GLU     7      15.716   5.411   8.876  1.00  0.00
ATOM     87  CB  GLU     7      17.156   6.083   7.437  1.00  0.00
ATOM     88 2HB  GLU     7      18.200   5.853   7.650  1.00  0.00
ATOM     89 3HB  GLU     7      16.988   6.046   6.361  1.00  0.00
ATOM     90  CG  GLU     7      16.828   7.474   7.953  1.00  0.00
ATOM     91 2HG  GLU     7      15.939   7.824   7.428  1.00  0.00
ATOM     92 3HG  GLU     7      16.611   7.394   9.019  1.00  0.00
ATOM     93  CD  GLU     7      17.961   8.458   7.740  1.00  0.00
ATOM     94  OE1 GLU     7      19.083   8.010   7.423  1.00  0.00
ATOM     95  OE2 GLU     7      17.727   9.675   7.891  1.00  0.00
ATOM     96  C   GLU     7      15.326   4.424   7.041  1.00  0.00
ATOM     97  O   GLU     7      14.142   4.759   7.054  1.00  0.00
ATOM     98  N   ALA     8      15.827   3.575   6.150  1.00  0.00
ATOM     99  H   ALA     8      16.815   3.364   6.152  1.00  0.00
ATOM    100  CA  ALA     8      14.995   2.973   5.116  1.00  0.00
ATOM    101  HA  ALA     8      14.554   3.765   4.511  1.00  0.00
ATOM    102  CB  ALA     8      15.837   2.083   4.213  1.00  0.00
ATOM    103 1HB  ALA     8      16.277   1.279   4.803  1.00  0.00
ATOM    104 2HB  ALA     8      15.207   1.657   3.432  1.00  0.00
ATOM    105 3HB  ALA     8      16.630   2.674   3.757  1.00  0.00
ATOM    106  C   ALA     8      13.849   2.176   5.728  1.00  0.00
ATOM    107  O   ALA     8      12.808   1.981   5.098  1.00  0.00
ATOM    108  N   LEU     9      14.045   1.716   6.959  1.00  0.00
ATOM    109  H   LEU     9      14.927   1.876   7.424  1.00  0.00
ATOM    110  CA  LEU     9      13.027   0.938   7.657  1.00  0.00
ATOM    111  HA  LEU     9      12.846   0.002   7.128  1.00  0.00
ATOM    112  CB  LEU     9      13.490   0.614   9.078  1.00  0.00
ATOM    113 2HB  LEU     9      14.293  -0.110   8.935  1.00  0.00
ATOM    114 3HB  LEU     9      13.895   1.524   9.520  1.00  0.00
ATOM    115  CG  LEU     9      12.432   0.023  10.010  1.00  0.00
ATOM    116  HG  LEU     9      11.587  -0.323   9.414  1.00  0.00
ATOM    117  CD1 LEU     9      13.007  -1.144  10.798  1.00  0.00
ATOM    118 1HD1 LEU     9      13.851  -0.799  11.395  1.00  0.00
ATOM    119 2HD1 LEU     9      12.239  -1.552  11.456  1.00  0.00
ATOM    120 3HD1 LEU     9      13.342  -1.919  10.109  1.00  0.00
ATOM    121  CD2 LEU     9      11.894   1.091  10.951  1.00  0.00
ATOM    122 1HD2 LEU     9      11.443   1.895  10.369  1.00  0.00
ATOM    123 2HD2 LEU     9      11.142   0.652  11.607  1.00  0.00
ATOM    124 3HD2 LEU     9      12.710   1.491  11.552  1.00  0.00
ATOM    125  C   LEU     9      11.702   1.692   7.701  1.00  0.00
ATOM    126  O   LEU     9      10.632   1.090   7.614  1.00  0.00
ATOM    127  N   ALA    10      11.781   3.012   7.834  1.00  0.00
ATOM    128  H   ALA    10      12.681   3.455   7.945  1.00  0.00
ATOM    129  CA  ALA    10      10.588   3.848   7.885  1.00  0.00
ATOM    130  HA  ALA    10       9.880   3.412   8.591  1.00  0.00
ATOM    131  CB  ALA    10      10.946   5.249   8.358  1.00  0.00
ATOM    132 1HB  ALA    10      11.647   5.701   7.657  1.00  0.00
ATOM    133 2HB  ALA    10      10.042   5.857   8.412  1.00  0.00
ATOM    134 3HB  ALA    10      11.405   5.193   9.345  1.00  0.00
ATOM    135  C   ALA    10       9.900   3.905   6.525  1.00  0.00
ATOM    136  O   ALA    10       8.688   4.104   6.439  1.00  0.00
ATOM    137  N   LYS    11      10.681   3.731   5.464  1.00  0.00
ATOM    138  H   LYS    11      11.675   3.601   5.584  1.00  0.00
ATOM    139  CA  LYS    11      10.147   3.763   4.108  1.00  0.00
ATOM    140  HA  LYS    11       9.789   4.765   3.874  1.00  0.00
ATOM    141  CB  LYS    11      11.235   3.384   3.101  1.00  0.00
ATOM    142 2HB  LYS    11      12.136   3.934   3.372  1.00  0.00
ATOM    143 3HB  LYS    11      11.417   2.314   3.206  1.00  0.00
ATOM    144  CG  LYS    11      10.866   3.696   1.661  1.00  0.00
ATOM    145 2HG  LYS    11      10.680   2.756   1.141  1.00  0.00
ATOM    146 3HG  LYS    11       9.956   4.297   1.660  1.00  0.00
ATOM    147  CD  LYS    11      11.976   4.456   0.953  1.00  0.00
ATOM    148 2HD  LYS    11      12.325   5.251   1.612  1.00  0.00
ATOM    149 3HD  LYS    11      12.795   3.765   0.753  1.00  0.00
ATOM    150  CE  LYS    11      11.490   5.059  -0.357  1.00  0.00
ATOM    151 2HE  LYS    11      10.407   4.946  -0.404  1.00  0.00
ATOM    152 3HE  LYS    11      11.745   6.118  -0.361  1.00  0.00
ATOM    153  NZ  LYS    11      12.110   4.395  -1.537  1.00  0.00
ATOM    154 1HZ  LYS    11      11.873   3.413  -1.533  1.00  0.00
ATOM    155 2HZ  LYS    11      11.763   4.822  -2.384  1.00  0.00
ATOM    156 3HZ  LYS    11      13.113   4.499  -1.493  1.00  0.00
ATOM    157  C   LYS    11       8.959   2.817   3.968  1.00  0.00
ATOM    158  O   LYS    11       8.064   3.044   3.153  1.00  0.00
ATOM    159  N   LEU    12       8.956   1.756   4.769  1.00  0.00
ATOM    160  H   LEU    12       9.728   1.596   5.400  1.00  0.00
ATOM    161  CA  LEU    12       7.876   0.776   4.736  1.00  0.00
ATOM    162  HA  LEU    12       7.722   0.426   3.715  1.00  0.00
ATOM    163  CB  LEU    12       8.224  -0.425   5.617  1.00  0.00
ATOM    164 2HB  LEU    12       8.969  -0.037   6.311  1.00  0.00
ATOM    165 3HB  LEU    12       7.329  -0.713   6.170  1.00  0.00
ATOM    166  CG  LEU    12       8.790  -1.647   4.893  1.00  0.00
ATOM    167  HG  LEU    12       9.171  -2.352   5.633  1.00  0.00
ATOM    168  CD1 LEU    12       7.711  -2.322   4.060  1.00  0.00
ATOM    169 1HD1 LEU    12       7.329  -1.619   3.320  1.00  0.00
ATOM    170 2HD1 LEU    12       8.132  -3.190   3.552  1.00  0.00
ATOM    171 3HD1 LEU    12       6.896  -2.643   4.710  1.00  0.00
ATOM    172  CD2 LEU    12       9.970  -1.250   4.018  1.00  0.00
ATOM    173 1HD2 LEU    12      10.752  -0.813   4.639  1.00  0.00
ATOM    174 2HD2 LEU    12      10.359  -2.133   3.511  1.00  0.00
ATOM    175 3HD2 LEU    12       9.644  -0.520   3.277  1.00  0.00
ATOM    176  C   LEU    12       6.562   1.397   5.199  1.00  0.00
ATOM    177  O   LEU    12       5.548   1.317   4.505  1.00  0.00
ATOM    178  N   ILE    13       6.588   2.017   6.373  1.00  0.00
ATOM    179  H   ILE    13       7.437   2.031   6.919  1.00  0.00
ATOM    180  CA  ILE    13       5.400   2.655   6.927  1.00  0.00
ATOM    181  HA  ILE    13       4.538   1.992   6.849  1.00  0.00
ATOM    182  CB  ILE    13       5.609   3.052   8.400  1.00  0.00
ATOM    183  HB  ILE    13       6.535   3.620   8.487  1.00  0.00
ATOM    184  CG2 ILE    13       4.446   3.901   8.890  1.00  0.00
ATOM    185 1HG2 ILE    13       3.519   3.333   8.804  1.00  0.00
ATOM    186 2HG2 ILE    13       4.608   4.173   9.933  1.00  0.00
ATOM    187 3HG2 ILE    13       4.375   4.805   8.286  1.00  0.00
ATOM    188  CG1 ILE    13       5.768   1.803   9.270  1.00  0.00
ATOM    189 2HG1 ILE    13       6.584   1.214   8.851  1.00  0.00
ATOM    190 3HG1 ILE    13       6.037   2.135  10.273  1.00  0.00
ATOM    191  CD1 ILE    13       4.518   0.953   9.340  1.00  0.00
ATOM    192 1HD1 ILE    13       4.247   0.620   8.338  1.00  0.00
ATOM    193 2HD1 ILE    13       4.703   0.085   9.973  1.00  0.00
ATOM    194 3HD1 ILE    13       3.701   1.540   9.760  1.00  0.00
ATOM    195  C   ILE    13       5.019   3.896   6.127  1.00  0.00
ATOM    196  O   ILE    13       3.842   4.236   6.014  1.00  0.00
ATOM    197  N   SER    14       6.023   4.567   5.571  1.00  0.00
ATOM    198  H   SER    14       6.975   4.262   5.714  1.00  0.00
ATOM    199  CA  SER    14       5.794   5.772   4.783  1.00  0.00
ATOM    200  HA  SER    14       5.035   6.390   5.263  1.00  0.00
ATOM    201  CB  SER    14       7.085   6.584   4.667  1.00  0.00
ATOM    202 2HB  SER    14       7.870   5.937   4.275  1.00  0.00
ATOM    203 3HB  SER    14       6.917   7.410   3.977  1.00  0.00
ATOM    204  OG  SER    14       7.480   7.095   5.928  1.00  0.00
ATOM    205  HG  SER    14       8.290   7.599   5.829  1.00  0.00
ATOM    206  C   SER    14       5.275   5.420   3.392  1.00  0.00
ATOM    207  O   SER    14       4.798   6.285   2.656  1.00  0.00
ATOM    208  N   LEU    15       5.370   4.143   3.037  1.00  0.00
ATOM    209  H   LEU    15       5.797   3.475   3.663  1.00  0.00
ATOM    210  CA  LEU    15       4.910   3.674   1.735  1.00  0.00
ATOM    211  HA  LEU    15       5.281   4.333   0.951  1.00  0.00
ATOM    212  CB  LEU    15       5.426   2.258   1.469  1.00  0.00
ATOM    213 2HB  LEU    15       6.052   2.038   2.334  1.00  0.00
ATOM    214 3HB  LEU    15       4.572   1.580   1.459  1.00  0.00
ATOM    215  CG  LEU    15       6.240   2.070   0.189  1.00  0.00
ATOM    216  HG  LEU    15       5.597   2.259  -0.671  1.00  0.00
ATOM    217  CD1 LEU    15       7.419   3.030   0.161  1.00  0.00
ATOM    218 1HD1 LEU    15       8.062   2.841   1.020  1.00  0.00
ATOM    219 2HD1 LEU    15       7.987   2.882  -0.757  1.00  0.00
ATOM    220 3HD1 LEU    15       7.053   4.056   0.200  1.00  0.00
ATOM    221  CD2 LEU    15       6.719   0.630   0.069  1.00  0.00
ATOM    222 1HD2 LEU    15       5.858  -0.039   0.043  1.00  0.00
ATOM    223 2HD2 LEU    15       7.296   0.514  -0.848  1.00  0.00
ATOM    224 3HD2 LEU    15       7.345   0.382   0.926  1.00  0.00
ATOM    225  C   LEU    15       3.387   3.697   1.654  1.00  0.00
ATOM    226  O   LEU    15       2.811   3.512   0.583  1.00  0.00
ATOM    227  N   GLN    16       2.743   3.926   2.794  1.00  0.00
ATOM    228  H   GLN    16       3.260   4.039   3.654  1.00  0.00
ATOM    229  CA  GLN    16       1.287   3.975   2.851  1.00  0.00
ATOM    230  HA  GLN    16       0.864   3.385   2.038  1.00  0.00
ATOM    231  CB  GLN    16       0.788   3.404   4.180  1.00  0.00
ATOM    232 2HB  GLN    16       1.263   3.973   4.979  1.00  0.00
ATOM    233 3HB  GLN    16      -0.291   3.558   4.217  1.00  0.00
ATOM    234  CG  GLN    16       1.094   1.926   4.360  1.00  0.00
ATOM    235 2HG  GLN    16       0.345   1.345   3.821  1.00  0.00
ATOM    236 3HG  GLN    16       2.080   1.719   3.946  1.00  0.00
ATOM    237  CD  GLN    16       1.081   1.501   5.815  1.00  0.00
ATOM    238  OE1 GLN    16       1.873   1.988   6.623  1.00  0.00
ATOM    239  NE2 GLN    16       0.180   0.588   6.158  1.00  0.00
ATOM    240 1HE2 GLN    16       0.127   0.269   7.115  1.00  0.00
ATOM    241 2HE2 GLN    16      -0.449   0.216   5.461  1.00  0.00
ATOM    242  C   GLN    16       0.782   5.403   2.676  1.00  0.00
ATOM    243  O   GLN    16       0.975   6.251   3.547  1.00  0.00
ATOM    244  N   ALA    17       0.136   5.663   1.544  1.00  0.00
ATOM    245  H   ALA    17       0.041   4.945   0.840  1.00  0.00
ATOM    246  CA  ALA    17      -0.398   6.988   1.256  1.00  0.00
ATOM    247  HA  ALA    17       0.431   7.684   1.132  1.00  0.00
ATOM    248  CB  ALA    17      -1.207   6.962  -0.032  1.00  0.00
ATOM    249 1HB  ALA    17      -2.047   6.276   0.080  1.00  0.00
ATOM    250 2HB  ALA    17      -1.582   7.962  -0.246  1.00  0.00
ATOM    251 3HB  ALA    17      -0.573   6.628  -0.853  1.00  0.00
ATOM    252  C   ALA    17      -1.254   7.498   2.410  1.00  0.00
ATOM    253  O   ALA    17      -1.694   6.724   3.261  1.00  0.00
ATOM    254  N   THR    18      -1.485   8.807   2.436  1.00  0.00
ATOM    255  H   THR    18      -1.080   9.406   1.731  1.00  0.00
ATOM    256  CA  THR    18      -2.286   9.421   3.487  1.00  0.00
ATOM    257  HA  THR    18      -2.366   8.753   4.345  1.00  0.00
ATOM    258  CB  THR    18      -1.673  10.754   3.955  1.00  0.00
ATOM    259  HB  THR    18      -2.008  11.548   3.288  1.00  0.00
ATOM    260  CG2 THR    18      -2.099  11.076   5.380  1.00  0.00
ATOM    261 1HG2 THR    18      -1.764  10.282   6.048  1.00  0.00
ATOM    262 2HG2 THR    18      -1.654  12.022   5.688  1.00  0.00
ATOM    263 3HG2 THR    18      -3.186  11.154   5.426  1.00  0.00
ATOM    264  OG1 THR    18      -0.244  10.688   3.883  1.00  0.00
ATOM    265 1HG  THR    18       0.130  11.522   4.176  1.00  0.00
ATOM    266  C   THR    18      -3.714   9.671   3.015  1.00  0.00
ATOM    267  O   THR    18      -4.630   9.807   3.826  1.00  0.00
ATOM    268  N   GLU    19      -3.897   9.727   1.700  1.00  0.00
ATOM    269  H   GLU    19      -3.109   9.639   1.075  1.00  0.00
ATOM    270  CA  GLU    19      -5.215   9.960   1.121  1.00  0.00
ATOM    271  HA  GLU    19      -5.989   9.688   1.839  1.00  0.00
ATOM    272  CB  GLU    19      -5.383  11.437   0.757  1.00  0.00
ATOM    273 2HB  GLU    19      -6.339  11.539   0.243  1.00  0.00
ATOM    274 3HB  GLU    19      -5.410  12.001   1.689  1.00  0.00
ATOM    275  CG  GLU    19      -4.272  11.975  -0.129  1.00  0.00
ATOM    276 2HG  GLU    19      -3.324  11.604   0.260  1.00  0.00
ATOM    277 3HG  GLU    19      -4.429  11.586  -1.135  1.00  0.00
ATOM    278  CD  GLU    19      -4.242  13.490  -0.172  1.00  0.00
ATOM    279  OE1 GLU    19      -3.145  14.066  -0.015  1.00  0.00
ATOM    280  OE2 GLU    19      -5.315  14.100  -0.363  1.00  0.00
ATOM    281  C   GLU    19      -5.428   9.092  -0.115  1.00  0.00
ATOM    282  O   GLU    19      -4.472   8.705  -0.787  1.00  0.00
ATOM    283  N   ALA    20      -6.688   8.789  -0.409  1.00  0.00
ATOM    284  H   ALA    20      -7.436   9.094   0.198  1.00  0.00
ATOM    285  CA  ALA    20      -7.027   7.969  -1.565  1.00  0.00
ATOM    286  HA  ALA    20      -6.210   8.017  -2.285  1.00  0.00
ATOM    287  CB  ALA    20      -7.219   6.519  -1.144  1.00  0.00
ATOM    288 1HB  ALA    20      -8.040   6.453  -0.430  1.00  0.00
ATOM    289 2HB  ALA    20      -7.451   5.913  -2.020  1.00  0.00
ATOM    290 3HB  ALA    20      -6.304   6.150  -0.680  1.00  0.00
ATOM    291  C   ALA    20      -8.280   8.490  -2.260  1.00  0.00
ATOM    292  O   ALA    20      -9.268   8.832  -1.609  1.00  0.00
ATOM    293  N   THR    21      -8.234   8.550  -3.587  1.00  0.00
ATOM    294  H   THR    21      -7.391   8.284  -4.075  1.00  0.00
ATOM    295  CA  THR    21      -9.364   9.032  -4.371  1.00  0.00
ATOM    296  HA  THR    21      -9.860   9.858  -3.861  1.00  0.00
ATOM    297  CB  THR    21      -8.918   9.511  -5.765  1.00  0.00
ATOM    298  HB  THR    21      -9.086   8.708  -6.482  1.00  0.00
ATOM    299  CG2 THR    21      -9.702  10.743  -6.191  1.00  0.00
ATOM    300 1HG2 THR    21      -9.535  11.546  -5.474  1.00  0.00
ATOM    301 2HG2 THR    21      -9.370  11.062  -7.178  1.00  0.00
ATOM    302 3HG2 THR    21     -10.765  10.503  -6.226  1.00  0.00
ATOM    303  OG1 THR    21      -7.518   9.809  -5.756  1.00  0.00
ATOM    304 1HG  THR    21      -7.249  10.106  -6.628  1.00  0.00
ATOM    305  C   THR    21     -10.423   7.948  -4.533  1.00  0.00
ATOM    306  O   THR    21     -10.119   6.827  -4.943  1.00  0.00
ATOM    307  N   ILE    22     -11.666   8.288  -4.208  1.00  0.00
ATOM    308  H   ILE    22     -11.861   9.211  -3.847  1.00  0.00
ATOM    309  CA  ILE    22     -12.770   7.342  -4.320  1.00  0.00
ATOM    310  HA  ILE    22     -12.400   6.351  -4.584  1.00  0.00
ATOM    311  CB  ILE    22     -13.572   7.256  -3.008  1.00  0.00
ATOM    312  HB  ILE    22     -14.119   8.187  -2.863  1.00  0.00
ATOM    313  CG2 ILE    22     -14.554   6.095  -3.064  1.00  0.00
ATOM    314 1HG2 ILE    22     -14.008   5.163  -3.208  1.00  0.00
ATOM    315 2HG2 ILE    22     -15.114   6.046  -2.130  1.00  0.00
ATOM    316 3HG2 ILE    22     -15.245   6.242  -3.894  1.00  0.00
ATOM    317  CG1 ILE    22     -12.626   7.104  -1.816  1.00  0.00
ATOM    318 2HG1 ILE    22     -12.080   6.170  -1.949  1.00  0.00
ATOM    319 3HG1 ILE    22     -11.928   7.940  -1.845  1.00  0.00
ATOM    320  CD1 ILE    22     -13.336   7.086  -0.480  1.00  0.00
ATOM    321 1HD1 ILE    22     -14.035   6.249  -0.450  1.00  0.00
ATOM    322 2HD1 ILE    22     -12.604   6.975   0.320  1.00  0.00
ATOM    323 3HD1 ILE    22     -13.882   8.019  -0.345  1.00  0.00
ATOM    324  C   ILE    22     -13.712   7.729  -5.455  1.00  0.00
ATOM    325  O   ILE    22     -14.355   8.778  -5.412  1.00  0.00
ATOM    326  N   VAL    23     -13.791   6.874  -6.469  1.00  0.00
ATOM    327  H   VAL    23     -13.222   6.039  -6.472  1.00  0.00
ATOM    328  CA  VAL    23     -14.658   7.124  -7.615  1.00  0.00
ATOM    329  HA  VAL    23     -14.861   8.187  -7.746  1.00  0.00
ATOM    330  CB  VAL    23     -14.040   6.577  -8.916  1.00  0.00
ATOM    331  HB  VAL    23     -14.049   5.487  -8.881  1.00  0.00
ATOM    332  CG1 VAL    23     -14.833   7.052 -10.124  1.00  0.00
ATOM    333 1HG1 VAL    23     -14.825   8.141 -10.159  1.00  0.00
ATOM    334 2HG1 VAL    23     -14.382   6.656 -11.034  1.00  0.00
ATOM    335 3HG1 VAL    23     -15.862   6.699 -10.045  1.00  0.00
ATOM    336  CG2 VAL    23     -12.581   6.993  -9.028  1.00  0.00
ATOM    337 1HG2 VAL    23     -12.024   6.598  -8.178  1.00  0.00
ATOM    338 2HG2 VAL    23     -12.160   6.598  -9.953  1.00  0.00
ATOM    339 3HG2 VAL    23     -12.513   8.080  -9.033  1.00  0.00
ATOM    340  C   VAL    23     -16.031   6.494  -7.413  1.00  0.00
ATOM    341  O   VAL    23     -16.143   5.348  -6.976  1.00  0.00
ATOM    342  N   THR    24     -17.076   7.250  -7.736  1.00  0.00
ATOM    343  H   THR    24     -16.935   8.193  -8.067  1.00  0.00
ATOM    344  CA  THR    24     -18.443   6.767  -7.589  1.00  0.00
ATOM    345  HA  THR    24     -18.450   5.756  -7.180  1.00  0.00
ATOM    346  CB  THR    24     -19.265   7.679  -6.660  1.00  0.00
ATOM    347  HB  THR    24     -19.677   8.500  -7.247  1.00  0.00
ATOM    348  CG2 THR    24     -20.400   6.905  -6.007  1.00  0.00
ATOM    349 1HG2 THR    24     -19.990   6.084  -5.419  1.00  0.00
ATOM    350 2HG2 THR    24     -20.967   7.570  -5.355  1.00  0.00
ATOM    351 3HG2 THR    24     -21.059   6.505  -6.778  1.00  0.00
ATOM    352  OG1 THR    24     -18.420   8.239  -5.650  1.00  0.00
ATOM    353 1HG  THR    24     -18.941   8.805  -5.076  1.00  0.00
ATOM    354  C   THR    24     -19.142   6.676  -8.941  1.00  0.00
ATOM    355  O   THR    24     -18.875   7.470  -9.844  1.00  0.00
ATOM    356  N   LEU    25     -20.037   5.704  -9.075  1.00  0.00
ATOM    357  H   LEU    25     -20.199   5.057  -8.316  1.00  0.00
ATOM    358  CA  LEU    25     -20.775   5.509 -10.318  1.00  0.00
ATOM    359  HA  LEU    25     -20.683   6.394 -10.947  1.00  0.00
ATOM    360  CB  LEU    25     -20.219   4.306 -11.082  1.00  0.00
ATOM    361 2HB  LEU    25     -20.510   3.450 -10.473  1.00  0.00
ATOM    362 3HB  LEU    25     -20.723   4.252 -12.047  1.00  0.00
ATOM    363  CG  LEU    25     -18.705   4.289 -11.296  1.00  0.00
ATOM    364  HG  LEU    25     -18.210   4.438 -10.336  1.00  0.00
ATOM    365  CD1 LEU    25     -18.265   2.961 -11.892  1.00  0.00
ATOM    366 1HD1 LEU    25     -18.760   2.811 -12.852  1.00  0.00
ATOM    367 2HD1 LEU    25     -17.185   2.967 -12.037  1.00  0.00
ATOM    368 3HD1 LEU    25     -18.536   2.151 -11.215  1.00  0.00
ATOM    369  CD2 LEU    25     -18.279   5.444 -12.190  1.00  0.00
ATOM    370 1HD2 LEU    25     -18.560   6.388 -11.723  1.00  0.00
ATOM    371 2HD2 LEU    25     -17.199   5.415 -12.331  1.00  0.00
ATOM    372 3HD2 LEU    25     -18.774   5.357 -13.157  1.00  0.00
ATOM    373  C   LEU    25     -22.262   5.308 -10.043  1.00  0.00
ATOM    374  O   LEU    25     -22.641   4.552  -9.148  1.00  0.00
ATOM    375  N   ASP    26     -23.100   5.987 -10.818  1.00  0.00
ATOM    376  H   ASP    26     -22.741   6.620 -11.518  1.00  0.00
ATOM    377  CA  ASP    26     -24.545   5.880 -10.660  1.00  0.00
ATOM    378  HA  ASP    26     -24.816   4.853 -10.411  1.00  0.00
ATOM    379  CB  ASP    26     -25.026   6.798  -9.536  1.00  0.00
ATOM    380 2HB  ASP    26     -24.212   7.478  -9.284  1.00  0.00
ATOM    381 3HB  ASP    26     -25.875   7.370  -9.909  1.00  0.00
ATOM    382  CG  ASP    26     -25.442   6.028  -8.298  1.00  0.00
ATOM    383  OD1 ASP    26     -26.406   5.239  -8.386  1.00  0.00
ATOM    384  OD2 ASP    26     -24.803   6.214  -7.241  1.00  0.00
ATOM    385  C   ASP    26     -25.261   6.231 -11.961  1.00  0.00
ATOM    386  O   ASP    26     -25.975   7.231 -12.038  1.00  0.00
ATOM    387  N   SER    27     -25.065   5.401 -12.981  1.00  0.00
ATOM    388  H   SER    27     -24.449   4.608 -12.877  1.00  0.00
ATOM    389  CA  SER    27     -25.688   5.626 -14.280  1.00  0.00
ATOM    390  HA  SER    27     -26.767   5.727 -14.161  1.00  0.00
ATOM    391  CB  SER    27     -25.143   6.907 -14.916  1.00  0.00
ATOM    392 2HB  SER    27     -24.191   7.152 -14.445  1.00  0.00
ATOM    393 3HB  SER    27     -24.987   6.729 -15.980  1.00  0.00
ATOM    394  OG  SER    27     -26.046   7.985 -14.745  1.00  0.00
ATOM    395  HG  SER    27     -25.682   8.774 -15.151  1.00  0.00
ATOM    396  C   SER    27     -25.448   4.441 -15.210  1.00  0.00
ATOM    397  O   SER    27     -26.347   3.636 -15.452  1.00  0.00
ATOM    398  N   ASP    28     -24.228   4.342 -15.728  1.00  0.00
ATOM    399  H   ASP    28     -23.533   5.046 -15.525  1.00  0.00
ATOM    400  CA  ASP    28     -23.868   3.255 -16.632  1.00  0.00
ATOM    401  HA  ASP    28     -24.157   2.299 -16.195  1.00  0.00
ATOM    402  CB  ASP    28     -24.587   3.417 -17.972  1.00  0.00
ATOM    403 2HB  ASP    28     -25.531   3.930 -17.788  1.00  0.00
ATOM    404 3HB  ASP    28     -23.960   4.031 -18.618  1.00  0.00
ATOM    405  CG  ASP    28     -24.859   2.087 -18.648  1.00  0.00
ATOM    406  OD1 ASP    28     -26.039   1.797 -18.934  1.00  0.00
ATOM    407  OD2 ASP    28     -23.891   1.337 -18.891  1.00  0.00
ATOM    408  C   ASP    28     -22.359   3.209 -16.852  1.00  0.00
ATOM    409  O   ASP    28     -21.888   3.192 -17.988  1.00  0.00
ATOM    410  N   ASN    29     -21.607   3.190 -15.756  1.00  0.00
ATOM    411  H   ASN    29     -22.039   3.235 -14.844  1.00  0.00
ATOM    412  CA  ASN    29     -20.151   3.148 -15.830  1.00  0.00
ATOM    413  HA  ASN    29     -19.730   3.105 -14.825  1.00  0.00
ATOM    414  CB  ASN    29     -19.694   1.911 -16.605  1.00  0.00
ATOM    415 2HB  ASN    29     -20.535   1.528 -17.185  1.00  0.00
ATOM    416 3HB  ASN    29     -18.888   2.196 -17.280  1.00  0.00
ATOM    417  CG  ASN    29     -19.194   0.808 -15.691  1.00  0.00
ATOM    418  OD1 ASN    29     -19.886  -0.184 -15.461  1.00  0.00
ATOM    419  ND2 ASN    29     -17.986   0.978 -15.165  1.00  0.00
ATOM    420 1HD2 ASN    29     -17.604   0.275 -14.549  1.00  0.00
ATOM    421 2HD2 ASN    29     -17.456   1.809 -15.383  1.00  0.00
ATOM    422  C   ASN    29     -19.603   4.408 -16.493  1.00  0.00
ATOM    423  O   ASN    29     -18.446   4.448 -16.914  1.00  0.00
ATOM    424  N   ILE    30     -20.441   5.435 -16.583  1.00  0.00
ATOM    425  H   ILE    30     -21.391   5.343 -16.250  1.00  0.00
ATOM    426  CA  ILE    30     -20.041   6.697 -17.193  1.00  0.00
ATOM    427  HA  ILE    30     -19.037   6.618 -17.609  1.00  0.00
ATOM    428  CB  ILE    30     -21.023   7.124 -18.300  1.00  0.00
ATOM    429  HB  ILE    30     -20.871   8.180 -18.522  1.00  0.00
ATOM    430  CG2 ILE    30     -20.792   6.303 -19.559  1.00  0.00
ATOM    431 1HG2 ILE    30     -20.945   5.246 -19.337  1.00  0.00
ATOM    432 2HG2 ILE    30     -21.494   6.616 -20.332  1.00  0.00
ATOM    433 3HG2 ILE    30     -19.772   6.456 -19.911  1.00  0.00
ATOM    434  CG1 ILE    30     -22.467   6.972 -17.816  1.00  0.00
ATOM    435 2HG1 ILE    30     -22.610   5.928 -17.536  1.00  0.00
ATOM    436 3HG1 ILE    30     -22.585   7.602 -16.935  1.00  0.00
ATOM    437  CD1 ILE    30     -23.496   7.361 -18.855  1.00  0.00
ATOM    438 1HD1 ILE    30     -23.380   6.730 -19.736  1.00  0.00
ATOM    439 2HD1 ILE    30     -24.497   7.228 -18.443  1.00  0.00
ATOM    440 3HD1 ILE    30     -23.354   8.405 -19.134  1.00  0.00
ATOM    441  C   ILE    30     -19.951   7.807 -16.152  1.00  0.00
ATOM    442  O   ILE    30     -19.027   8.621 -16.174  1.00  0.00
ATOM    443  N   LEU    31     -20.916   7.834 -15.239  1.00  0.00
ATOM    444  H   LEU    31     -21.670   7.163 -15.280  1.00  0.00
ATOM    445  CA  LEU    31     -20.946   8.844 -14.187  1.00  0.00
ATOM    446  HA  LEU    31     -20.921   9.840 -14.628  1.00  0.00
ATOM    447  CB  LEU    31     -22.225   8.708 -13.359  1.00  0.00
ATOM    448 2HB  LEU    31     -23.021   8.968 -14.057  1.00  0.00
ATOM    449 3HB  LEU    31     -22.330   7.664 -13.063  1.00  0.00
ATOM    450  CG  LEU    31     -22.321   9.601 -12.121  1.00  0.00
ATOM    451  HG  LEU    31     -21.352   9.621 -11.622  1.00  0.00
ATOM    452  CD1 LEU    31     -22.718  11.015 -12.514  1.00  0.00
ATOM    453 1HD1 LEU    31     -23.688  10.995 -13.012  1.00  0.00
ATOM    454 2HD1 LEU    31     -22.782  11.636 -11.621  1.00  0.00
ATOM    455 3HD1 LEU    31     -21.971  11.428 -13.191  1.00  0.00
ATOM    456  CD2 LEU    31     -23.314   9.024 -11.123  1.00  0.00
ATOM    457 1HD2 LEU    31     -22.987   8.030 -10.817  1.00  0.00
ATOM    458 2HD2 LEU    31     -23.370   9.672 -10.248  1.00  0.00
ATOM    459 3HD2 LEU    31     -24.298   8.955 -11.587  1.00  0.00
ATOM    460  C   LEU    31     -19.725   8.723 -13.281  1.00  0.00
ATOM    461  O   LEU    31     -19.724   7.951 -12.321  1.00  0.00
ATOM    462  N   LEU    32     -18.687   9.492 -13.591  1.00  0.00
ATOM    463  H   LEU    32     -18.725  10.087 -14.406  1.00  0.00
ATOM    464  CA  LEU    32     -17.459   9.473 -12.804  1.00  0.00
ATOM    465  HA  LEU    32     -17.350   8.507 -12.311  1.00  0.00
ATOM    466  CB  LEU    32     -16.246   9.701 -13.708  1.00  0.00
ATOM    467 2HB  LEU    32     -16.646  10.269 -14.547  1.00  0.00
ATOM    468 3HB  LEU    32     -15.527  10.313 -13.165  1.00  0.00
ATOM    469  CG  LEU    32     -15.552   8.442 -14.230  1.00  0.00
ATOM    470  HG  LEU    32     -15.319   7.791 -13.387  1.00  0.00
ATOM    471  CD1 LEU    32     -16.452   7.702 -15.208  1.00  0.00
ATOM    472 1HD1 LEU    32     -16.686   8.352 -16.051  1.00  0.00
ATOM    473 2HD1 LEU    32     -15.941   6.809 -15.568  1.00  0.00
ATOM    474 3HD1 LEU    32     -17.376   7.413 -14.706  1.00  0.00
ATOM    475  CD2 LEU    32     -14.226   8.797 -14.887  1.00  0.00
ATOM    476 1HD2 LEU    32     -13.577   9.282 -14.158  1.00  0.00
ATOM    477 2HD2 LEU    32     -13.747   7.889 -15.252  1.00  0.00
ATOM    478 3HD2 LEU    32     -14.404   9.474 -15.722  1.00  0.00
ATOM    479  C   LEU    32     -17.497  10.535 -11.709  1.00  0.00
ATOM    480  O   LEU    32     -17.699  11.717 -11.985  1.00  0.00
ATOM    481  N   SER    33     -17.300  10.104 -10.467  1.00  0.00
ATOM    482  H   SER    33     -17.166   9.119 -10.288  1.00  0.00
ATOM    483  CA  SER    33     -17.314  11.017  -9.331  1.00  0.00
ATOM    484  HA  SER    33     -17.128  12.035  -9.671  1.00  0.00
ATOM    485  CB  SER    33     -18.675  10.976  -8.633  1.00  0.00
ATOM    486 2HB  SER    33     -19.455  10.917  -9.392  1.00  0.00
ATOM    487 3HB  SER    33     -18.717  10.089  -8.001  1.00  0.00
ATOM    488  OG  SER    33     -18.876  12.132  -7.838  1.00  0.00
ATOM    489  HG  SER    33     -19.735  12.082  -7.412  1.00  0.00
ATOM    490  C   SER    33     -16.211  10.665  -8.338  1.00  0.00
ATOM    491  O   SER    33     -16.428   9.902  -7.397  1.00  0.00
ATOM    492  N   GLU    34     -15.026  11.228  -8.555  1.00  0.00
ATOM    493  H   GLU    34     -14.888  11.824  -9.358  1.00  0.00
ATOM    494  CA  GLU    34     -13.888  10.973  -7.680  1.00  0.00
ATOM    495  HA  GLU    34     -13.929   9.949  -7.307  1.00  0.00
ATOM    496  CB  GLU    34     -12.576  11.163  -8.444  1.00  0.00
ATOM    497 2HB  GLU    34     -12.381  12.234  -8.495  1.00  0.00
ATOM    498 3HB  GLU    34     -11.790  10.678  -7.866  1.00  0.00
ATOM    499  CG  GLU    34     -12.601  10.585  -9.850  1.00  0.00
ATOM    500 2HG  GLU    34     -13.186   9.665  -9.824  1.00  0.00
ATOM    501 3HG  GLU    34     -13.092  11.308 -10.501  1.00  0.00
ATOM    502  CD  GLU    34     -11.213  10.286 -10.382  1.00  0.00
ATOM    503  OE1 GLU    34     -11.092   9.406 -11.260  1.00  0.00
ATOM    504  OE2 GLU    34     -10.248  10.931  -9.921  1.00  0.00
ATOM    505  C   GLU    34     -13.919  11.894  -6.464  1.00  0.00
ATOM    506  O   GLU    34     -14.309  13.057  -6.565  1.00  0.00
ATOM    507  N   GLU    35     -13.506  11.365  -5.317  1.00  0.00
ATOM    508  H   GLU    35     -13.224  10.396  -5.279  1.00  0.00
ATOM    509  CA  GLU    35     -13.488  12.139  -4.082  1.00  0.00
ATOM    510  HA  GLU    35     -13.466  13.204  -4.312  1.00  0.00
ATOM    511  CB  GLU    35     -14.739  11.845  -3.251  1.00  0.00
ATOM    512 2HB  GLU    35     -14.553  10.925  -2.697  1.00  0.00
ATOM    513 3HB  GLU    35     -14.867  12.670  -2.551  1.00  0.00
ATOM    514  CG  GLU    35     -16.000  11.688  -4.084  1.00  0.00
ATOM    515 2HG  GLU    35     -15.874  12.273  -4.994  1.00  0.00
ATOM    516 3HG  GLU    35     -16.102  10.634  -4.342  1.00  0.00
ATOM    517  CD  GLU    35     -17.245  12.152  -3.353  1.00  0.00
ATOM    518  OE1 GLU    35     -18.121  12.761  -4.002  1.00  0.00
ATOM    519  OE2 GLU    35     -17.343  11.907  -2.133  1.00  0.00
ATOM    520  C   GLU    35     -12.237  11.831  -3.264  1.00  0.00
ATOM    521  O   GLU    35     -11.991  10.682  -2.899  1.00  0.00
ATOM    522  N   GLN    36     -11.452  12.866  -2.981  1.00  0.00
ATOM    523  H   GLN    36     -11.681  13.786  -3.330  1.00  0.00
ATOM    524  CA  GLN    36     -10.227  12.705  -2.208  1.00  0.00
ATOM    525  HA  GLN    36      -9.737  11.770  -2.481  1.00  0.00
ATOM    526  CB  GLN    36      -9.266  13.862  -2.489  1.00  0.00
ATOM    527 2HB  GLN    36      -9.650  14.738  -1.967  1.00  0.00
ATOM    528 3HB  GLN    36      -8.297  13.588  -2.073  1.00  0.00
ATOM    529  CG  GLN    36      -9.112  14.180  -3.968  1.00  0.00
ATOM    530 2HG  GLN    36      -9.642  13.422  -4.546  1.00  0.00
ATOM    531 3HG  GLN    36      -9.552  15.158  -4.163  1.00  0.00
ATOM    532  CD  GLN    36      -7.663  14.203  -4.412  1.00  0.00
ATOM    533  OE1 GLN    36      -7.179  15.204  -4.940  1.00  0.00
ATOM    534  NE2 GLN    36      -6.961  13.096  -4.199  1.00  0.00
ATOM    535 1HE2 GLN    36      -5.991  13.056  -4.475  1.00  0.00
ATOM    536 2HE2 GLN    36      -7.401  12.299  -3.762  1.00  0.00
ATOM    537  C   GLN    36     -10.530  12.631  -0.715  1.00  0.00
ATOM    538  O   GLN    36     -11.118  13.550  -0.145  1.00  0.00
ATOM    539  N   VAL    37     -10.126  11.532  -0.088  1.00  0.00
ATOM    540  H   VAL    37      -9.673  10.792  -0.605  1.00  0.00
ATOM    541  CA  VAL    37     -10.354  11.338   1.339  1.00  0.00
ATOM    542  HA  VAL    37     -10.557  12.279   1.849  1.00  0.00
ATOM    543  CB  VAL    37     -11.530  10.377   1.594  1.00  0.00
ATOM    544  HB  VAL    37     -11.735  10.345   2.664  1.00  0.00
ATOM    545  CG1 VAL    37     -12.773  10.845   0.854  1.00  0.00
ATOM    546 1HG1 VAL    37     -12.569  10.877  -0.216  1.00  0.00
ATOM    547 2HG1 VAL    37     -13.593  10.153   1.047  1.00  0.00
ATOM    548 3HG1 VAL    37     -13.050  11.840   1.201  1.00  0.00
ATOM    549  CG2 VAL    37     -11.158   8.960   1.185  1.00  0.00
ATOM    550 1HG2 VAL    37     -10.298   8.627   1.766  1.00  0.00
ATOM    551 2HG2 VAL    37     -12.001   8.294   1.372  1.00  0.00
ATOM    552 3HG2 VAL    37     -10.910   8.941   0.124  1.00  0.00
ATOM    553  C   VAL    37      -9.108  10.792   2.026  1.00  0.00
ATOM    554  O   VAL    37      -8.078  10.576   1.386  1.00  0.00
ATOM    555  N   ASP    38      -9.207  10.570   3.332  1.00  0.00
ATOM    556  H   ASP    38     -10.064  10.793   3.819  1.00  0.00
ATOM    557  CA  ASP    38      -8.088  10.047   4.106  1.00  0.00
ATOM    558  HA  ASP    38      -7.156  10.485   3.752  1.00  0.00
ATOM    559  CB  ASP    38      -8.259  10.391   5.587  1.00  0.00
ATOM    560 2HB  ASP    38      -9.275  10.757   5.733  1.00  0.00
ATOM    561 3HB  ASP    38      -8.118   9.476   6.163  1.00  0.00
ATOM    562  CG  ASP    38      -7.271  11.441   6.055  1.00  0.00
ATOM    563  OD1 ASP    38      -7.103  12.456   5.346  1.00  0.00
ATOM    564  OD2 ASP    38      -6.666  11.249   7.130  1.00  0.00
ATOM    565  C   ASP    38      -7.967   8.536   3.934  1.00  0.00
ATOM    566  O   ASP    38      -8.968   7.835   3.786  1.00  0.00
ATOM    567  N   VAL    39      -6.733   8.040   3.953  1.00  0.00
ATOM    568  H   VAL    39      -5.941   8.658   4.050  1.00  0.00
ATOM    569  CA  VAL    39      -6.481   6.613   3.798  1.00  0.00
ATOM    570  HA  VAL    39      -6.976   6.206   2.916  1.00  0.00
ATOM    571  CB  VAL    39      -4.973   6.317   3.697  1.00  0.00
ATOM    572  HB  VAL    39      -4.539   6.951   2.925  1.00  0.00
ATOM    573  CG1 VAL    39      -4.284   6.592   5.025  1.00  0.00
ATOM    574 1HG1 VAL    39      -4.718   5.957   5.798  1.00  0.00
ATOM    575 2HG1 VAL    39      -3.220   6.377   4.934  1.00  0.00
ATOM    576 3HG1 VAL    39      -4.421   7.638   5.296  1.00  0.00
ATOM    577  CG2 VAL    39      -4.740   4.881   3.253  1.00  0.00
ATOM    578 1HG2 VAL    39      -5.198   4.723   2.276  1.00  0.00
ATOM    579 2HG2 VAL    39      -3.669   4.689   3.187  1.00  0.00
ATOM    580 3HG2 VAL    39      -5.187   4.199   3.977  1.00  0.00
ATOM    581  C   VAL    39      -7.065   5.822   4.963  1.00  0.00
ATOM    582  O   VAL    39      -7.188   4.599   4.897  1.00  0.00
ATOM    583  N   GLU    40      -7.424   6.529   6.030  1.00  0.00
ATOM    584  H   GLU    40      -7.276   7.527   6.049  1.00  0.00
ATOM    585  CA  GLU    40      -7.996   5.892   7.211  1.00  0.00
ATOM    586  HA  GLU    40      -7.763   4.827   7.208  1.00  0.00
ATOM    587  CB  GLU    40      -7.418   6.515   8.484  1.00  0.00
ATOM    588 2HB  GLU    40      -6.497   7.027   8.207  1.00  0.00
ATOM    589 3HB  GLU    40      -8.143   7.242   8.849  1.00  0.00
ATOM    590  CG  GLU    40      -7.124   5.502   9.577  1.00  0.00
ATOM    591 2HG  GLU    40      -7.139   6.027  10.532  1.00  0.00
ATOM    592 3HG  GLU    40      -7.916   4.753   9.562  1.00  0.00
ATOM    593  CD  GLU    40      -5.781   4.821   9.396  1.00  0.00
ATOM    594  OE1 GLU    40      -4.969   5.319   8.588  1.00  0.00
ATOM    595  OE2 GLU    40      -5.543   3.791  10.061  1.00  0.00
ATOM    596  C   GLU    40      -9.517   6.019   7.215  1.00  0.00
ATOM    597  O   GLU    40     -10.219   5.188   7.792  1.00  0.00
ATOM    598  N   LEU    41     -10.019   7.064   6.567  1.00  0.00
ATOM    599  H   LEU    41      -9.401   7.735   6.135  1.00  0.00
ATOM    600  CA  LEU    41     -11.457   7.301   6.495  1.00  0.00
ATOM    601  HA  LEU    41     -11.908   7.150   7.476  1.00  0.00
ATOM    602  CB  LEU    41     -11.735   8.736   6.045  1.00  0.00
ATOM    603 2HB  LEU    41     -11.120   8.856   5.153  1.00  0.00
ATOM    604 3HB  LEU    41     -12.788   8.809   5.773  1.00  0.00
ATOM    605  CG  LEU    41     -11.392   9.834   7.052  1.00  0.00
ATOM    606  HG  LEU    41     -10.328   9.785   7.280  1.00  0.00
ATOM    607  CD1 LEU    41     -11.726  11.204   6.482  1.00  0.00
ATOM    608 1HD1 LEU    41     -12.791  11.253   6.254  1.00  0.00
ATOM    609 2HD1 LEU    41     -11.476  11.973   7.213  1.00  0.00
ATOM    610 3HD1 LEU    41     -11.152  11.368   5.570  1.00  0.00
ATOM    611  CD2 LEU    41     -12.131   9.605   8.363  1.00  0.00
ATOM    612 1HD2 LEU    41     -11.843   8.640   8.780  1.00  0.00
ATOM    613 2HD2 LEU    41     -11.875  10.396   9.068  1.00  0.00
ATOM    614 3HD2 LEU    41     -13.206   9.614   8.182  1.00  0.00
ATOM    615  C   LEU    41     -12.124   6.317   5.539  1.00  0.00
ATOM    616  O   LEU    41     -13.350   6.261   5.445  1.00  0.00
ATOM    617  N   VAL    42     -11.308   5.541   4.833  1.00  0.00
ATOM    618  H   VAL    42     -10.308   5.643   4.925  1.00  0.00
ATOM    619  CA  VAL    42     -11.819   4.556   3.886  1.00  0.00
ATOM    620  HA  VAL    42     -12.899   4.635   3.763  1.00  0.00
ATOM    621  CB  VAL    42     -11.153   4.708   2.505  1.00  0.00
ATOM    622  HB  VAL    42     -11.497   5.635   2.047  1.00  0.00
ATOM    623  CG1 VAL    42      -9.639   4.742   2.643  1.00  0.00
ATOM    624 1HG1 VAL    42      -9.295   3.815   3.101  1.00  0.00
ATOM    625 2HG1 VAL    42      -9.186   4.849   1.658  1.00  0.00
ATOM    626 3HG1 VAL    42      -9.350   5.585   3.270  1.00  0.00
ATOM    627  CG2 VAL    42     -11.587   3.581   1.579  1.00  0.00
ATOM    628 1HG2 VAL    42     -12.670   3.608   1.455  1.00  0.00
ATOM    629 2HG2 VAL    42     -11.108   3.703   0.608  1.00  0.00
ATOM    630 3HG2 VAL    42     -11.295   2.623   2.010  1.00  0.00
ATOM    631  C   VAL    42     -11.593   3.137   4.394  1.00  0.00
ATOM    632  O   VAL    42     -10.459   2.661   4.452  1.00  0.00
ATOM    633  N   GLN    43     -12.680   2.466   4.762  1.00  0.00
ATOM    634  H   GLN    43     -13.586   2.911   4.727  1.00  0.00
ATOM    635  CA  GLN    43     -12.600   1.100   5.266  1.00  0.00
ATOM    636  HA  GLN    43     -11.771   1.011   5.967  1.00  0.00
ATOM    637  CB  GLN    43     -13.894   0.724   5.990  1.00  0.00
ATOM    638 2HB  GLN    43     -13.724  -0.231   6.489  1.00  0.00
ATOM    639 3HB  GLN    43     -14.086   1.494   6.737  1.00  0.00
ATOM    640  CG  GLN    43     -15.095   0.605   5.065  1.00  0.00
ATOM    641 2HG  GLN    43     -15.255   1.564   4.573  1.00  0.00
ATOM    642 3HG  GLN    43     -14.885  -0.158   4.315  1.00  0.00
ATOM    643  CD  GLN    43     -16.363   0.222   5.803  1.00  0.00
ATOM    644  OE1 GLN    43     -17.018  -0.764   5.465  1.00  0.00
ATOM    645  NE2 GLN    43     -16.716   1.002   6.818  1.00  0.00
ATOM    646 1HE2 GLN    43     -17.553   0.793   7.345  1.00  0.00
ATOM    647 2HE2 GLN    43     -16.147   1.800   7.059  1.00  0.00
ATOM    648  C   GLN    43     -12.333   0.116   4.131  1.00  0.00
ATOM    649  O   GLN    43     -12.137   0.515   2.983  1.00  0.00
ATOM    650  N   ARG    44     -12.328  -1.172   4.460  1.00  0.00
ATOM    651  H   ARG    44     -12.466  -1.449   5.422  1.00  0.00
ATOM    652  CA  ARG    44     -12.084  -2.213   3.469  1.00  0.00
ATOM    653  HA  ARG    44     -11.486  -1.813   2.650  1.00  0.00
ATOM    654  CB  ARG    44     -11.327  -3.381   4.101  1.00  0.00
ATOM    655 2HB  ARG    44     -11.230  -4.156   3.340  1.00  0.00
ATOM    656 3HB  ARG    44     -10.338  -3.017   4.377  1.00  0.00
ATOM    657  CG  ARG    44     -12.014  -3.960   5.328  1.00  0.00
ATOM    658 2HG  ARG    44     -12.860  -3.322   5.584  1.00  0.00
ATOM    659 3HG  ARG    44     -12.375  -4.959   5.083  1.00  0.00
ATOM    660  CD  ARG    44     -11.064  -4.041   6.512  1.00  0.00
ATOM    661 2HD  ARG    44     -10.279  -4.764   6.288  1.00  0.00
ATOM    662 3HD  ARG    44     -10.618  -3.060   6.677  1.00  0.00
ATOM    663  NE  ARG    44     -11.747  -4.456   7.735  1.00  0.00
ATOM    664  HE  ARG    44     -11.972  -3.745   8.417  1.00  0.00
ATOM    665  CZ  ARG    44     -12.086  -5.713   7.996  1.00  0.00
ATOM    666  NH1 ARG    44     -11.807  -6.673   7.125  1.00  0.00
ATOM    667 1HH1 ARG    44     -11.336  -6.446   6.261  1.00  0.00
ATOM    668 2HH1 ARG    44     -12.068  -7.628   7.329  1.00  0.00
ATOM    669  NH2 ARG    44     -12.706  -6.012   9.130  1.00  0.00
ATOM    670 1HH2 ARG    44     -12.919  -5.281   9.794  1.00  0.00
ATOM    671 2HH2 ARG    44     -12.962  -6.970   9.325  1.00  0.00
ATOM    672  C   ARG    44     -13.396  -2.708   2.868  1.00  0.00
ATOM    673  O   ARG    44     -14.275  -3.190   3.581  1.00  0.00
ATOM    674  N   GLY    45     -13.520  -2.587   1.549  1.00  0.00
ATOM    675  H   GLY    45     -12.778  -2.189   0.992  1.00  0.00
ATOM    676  CA  GLY    45     -14.728  -3.026   0.874  1.00  0.00
ATOM    677 2HA  GLY    45     -14.546  -4.013   0.448  1.00  0.00
ATOM    678 3HA  GLY    45     -15.530  -3.091   1.609  1.00  0.00
ATOM    679  C   GLY    45     -15.149  -2.081  -0.233  1.00  0.00
ATOM    680  O   GLY    45     -16.097  -2.359  -0.968  1.00  0.00
ATOM    681  N   ASP    46     -14.446  -0.961  -0.352  1.00  0.00
ATOM    682  H   ASP    46     -13.698  -0.763   0.297  1.00  0.00
ATOM    683  CA  ASP    46     -14.753   0.030  -1.378  1.00  0.00
ATOM    684  HA  ASP    46     -15.813  -0.014  -1.630  1.00  0.00
ATOM    685  CB  ASP    46     -14.429   1.436  -0.872  1.00  0.00
ATOM    686 2HB  ASP    46     -13.441   1.408  -0.414  1.00  0.00
ATOM    687 3HB  ASP    46     -14.413   2.107  -1.730  1.00  0.00
ATOM    688  CG  ASP    46     -15.441   1.935   0.140  1.00  0.00
ATOM    689  OD1 ASP    46     -15.692   3.158   0.176  1.00  0.00
ATOM    690  OD2 ASP    46     -15.982   1.102   0.897  1.00  0.00
ATOM    691  C   ASP    46     -13.975  -0.256  -2.659  1.00  0.00
ATOM    692  O   ASP    46     -13.003  -1.012  -2.651  1.00  0.00
ATOM    693  N   ILE    47     -14.409   0.353  -3.757  1.00  0.00
ATOM    694  H   ILE    47     -15.229   0.941  -3.718  1.00  0.00
ATOM    695  CA  ILE    47     -13.753   0.165  -5.045  1.00  0.00
ATOM    696  HA  ILE    47     -13.002  -0.622  -4.980  1.00  0.00
ATOM    697  CB  ILE    47     -14.770  -0.186  -6.148  1.00  0.00
ATOM    698  HB  ILE    47     -15.520   0.603  -6.206  1.00  0.00
ATOM    699  CG2 ILE    47     -14.068  -0.318  -7.492  1.00  0.00
ATOM    700 1HG2 ILE    47     -13.319  -1.108  -7.435  1.00  0.00
ATOM    701 2HG2 ILE    47     -14.799  -0.567  -8.261  1.00  0.00
ATOM    702 3HG2 ILE    47     -13.583   0.625  -7.743  1.00  0.00
ATOM    703  CG1 ILE    47     -15.510  -1.478  -5.798  1.00  0.00
ATOM    704 2HG1 ILE    47     -15.976  -1.334  -4.823  1.00  0.00
ATOM    705 3HG1 ILE    47     -16.284  -1.626  -6.551  1.00  0.00
ATOM    706  CD1 ILE    47     -14.613  -2.695  -5.752  1.00  0.00
ATOM    707 1HD1 ILE    47     -13.840  -2.549  -4.998  1.00  0.00
ATOM    708 2HD1 ILE    47     -15.206  -3.574  -5.498  1.00  0.00
ATOM    709 3HD1 ILE    47     -14.147  -2.841  -6.726  1.00  0.00
ATOM    710  C   ILE    47     -12.982   1.414  -5.458  1.00  0.00
ATOM    711  O   ILE    47     -13.576   2.434  -5.809  1.00  0.00
ATOM    712  N   ILE    48     -11.657   1.326  -5.414  1.00  0.00
ATOM    713  H   ILE    48     -11.217   0.476  -5.090  1.00  0.00
ATOM    714  CA  ILE    48     -10.805   2.448  -5.787  1.00  0.00
ATOM    715  HA  ILE    48     -11.410   3.306  -6.080  1.00  0.00
ATOM    716  CB  ILE    48      -9.868   2.850  -4.633  1.00  0.00
ATOM    717  HB  ILE    48      -9.154   2.045  -4.458  1.00  0.00
ATOM    718  CG2 ILE    48      -9.117   4.127  -4.980  1.00  0.00
ATOM    719 1HG2 ILE    48      -9.831   4.932  -5.155  1.00  0.00
ATOM    720 2HG2 ILE    48      -8.459   4.398  -4.154  1.00  0.00
ATOM    721 3HG2 ILE    48      -8.523   3.966  -5.880  1.00  0.00
ATOM    722  CG1 ILE    48     -10.664   3.029  -3.338  1.00  0.00
ATOM    723 2HG1 ILE    48     -11.134   2.072  -3.108  1.00  0.00
ATOM    724 3HG1 ILE    48      -9.955   3.282  -2.550  1.00  0.00
ATOM    725  CD1 ILE    48     -11.725   4.104  -3.426  1.00  0.00
ATOM    726 1HD1 ILE    48     -12.436   3.850  -4.213  1.00  0.00
ATOM    727 2HD1 ILE    48     -12.250   4.176  -2.473  1.00  0.00
ATOM    728 3HD1 ILE    48     -11.256   5.060  -3.655  1.00  0.00
ATOM    729  C   ILE    48      -9.966   2.117  -7.016  1.00  0.00
ATOM    730  O   ILE    48      -9.293   1.086  -7.064  1.00  0.00
ATOM    731  N   LYS    49     -10.009   2.998  -8.010  1.00  0.00
ATOM    732  H   LYS    49     -10.602   3.812  -7.937  1.00  0.00
ATOM    733  CA  LYS    49      -9.250   2.803  -9.240  1.00  0.00
ATOM    734  HA  LYS    49      -9.182   1.739  -9.469  1.00  0.00
ATOM    735  CB  LYS    49      -9.941   3.511 -10.407  1.00  0.00
ATOM    736 2HB  LYS    49     -10.484   4.362  -9.996  1.00  0.00
ATOM    737 3HB  LYS    49      -9.161   3.867 -11.079  1.00  0.00
ATOM    738  CG  LYS    49     -10.903   2.621 -11.175  1.00  0.00
ATOM    739 2HG  LYS    49     -10.361   1.738 -11.514  1.00  0.00
ATOM    740 3HG  LYS    49     -11.705   2.317 -10.501  1.00  0.00
ATOM    741  CD  LYS    49     -11.495   3.343 -12.374  1.00  0.00
ATOM    742 2HD  LYS    49     -12.578   3.382 -12.253  1.00  0.00
ATOM    743 3HD  LYS    49     -11.096   4.356 -12.399  1.00  0.00
ATOM    744  CE  LYS    49     -11.156   2.633 -13.675  1.00  0.00
ATOM    745 2HE  LYS    49     -10.233   3.059 -14.066  1.00  0.00
ATOM    746 3HE  LYS    49     -11.004   1.575 -13.458  1.00  0.00
ATOM    747  NZ  LYS    49     -12.239   2.781 -14.687  1.00  0.00
ATOM    748 1HZ  LYS    49     -12.380   3.760 -14.888  1.00  0.00
ATOM    749 2HZ  LYS    49     -11.977   2.297 -15.534  1.00  0.00
ATOM    750 3HZ  LYS    49     -13.095   2.385 -14.324  1.00  0.00
ATOM    751  C   LYS    49      -7.824   3.322  -9.088  1.00  0.00
ATOM    752  O   LYS    49      -7.606   4.438  -8.615  1.00  0.00
ATOM    753  N   VAL    50      -6.856   2.508  -9.494  1.00  0.00
ATOM    754  H   VAL    50      -7.084   1.590  -9.849  1.00  0.00
ATOM    755  CA  VAL    50      -5.451   2.886  -9.406  1.00  0.00
ATOM    756  HA  VAL    50      -5.288   3.667  -8.664  1.00  0.00
ATOM    757  CB  VAL    50      -4.565   1.678  -9.051  1.00  0.00
ATOM    758  HB  VAL    50      -4.962   1.199  -8.155  1.00  0.00
ATOM    759  CG1 VAL    50      -4.545   0.675 -10.195  1.00  0.00
ATOM    760 1HG1 VAL    50      -4.149   1.152 -11.091  1.00  0.00
ATOM    761 2HG1 VAL    50      -3.914  -0.172  -9.925  1.00  0.00
ATOM    762 3HG1 VAL    50      -5.559   0.324 -10.389  1.00  0.00
ATOM    763  CG2 VAL    50      -3.155   2.134  -8.707  1.00  0.00
ATOM    764 1HG2 VAL    50      -3.190   2.810  -7.853  1.00  0.00
ATOM    765 2HG2 VAL    50      -2.543   1.267  -8.459  1.00  0.00
ATOM    766 3HG2 VAL    50      -2.721   2.651  -9.562  1.00  0.00
ATOM    767  C   VAL    50      -4.962   3.493 -10.716  1.00  0.00
ATOM    768  O   VAL    50      -5.169   2.928 -11.790  1.00  0.00
ATOM    769  N   VAL    51      -4.312   4.649 -10.621  1.00  0.00
ATOM    770  H   VAL    51      -4.193   5.089  -9.720  1.00  0.00
ATOM    771  CA  VAL    51      -3.791   5.333 -11.799  1.00  0.00
ATOM    772  HA  VAL    51      -4.276   4.991 -12.714  1.00  0.00
ATOM    773  CB  VAL    51      -3.971   6.858 -11.687  1.00  0.00
ATOM    774  HB  VAL    51      -3.339   7.344 -12.430  1.00  0.00
ATOM    775  CG1 VAL    51      -5.423   7.244 -11.926  1.00  0.00
ATOM    776 1HG1 VAL    51      -6.056   6.758 -11.183  1.00  0.00
ATOM    777 2HG1 VAL    51      -5.531   8.325 -11.843  1.00  0.00
ATOM    778 3HG1 VAL    51      -5.725   6.925 -12.924  1.00  0.00
ATOM    779  CG2 VAL    51      -3.496   7.352 -10.329  1.00  0.00
ATOM    780 1HG2 VAL    51      -2.441   7.110 -10.202  1.00  0.00
ATOM    781 2HG2 VAL    51      -3.631   8.432 -10.267  1.00  0.00
ATOM    782 3HG2 VAL    51      -4.076   6.868  -9.543  1.00  0.00
ATOM    783  C   VAL    51      -2.314   5.020 -12.007  1.00  0.00
ATOM    784  O   VAL    51      -1.598   4.636 -11.082  1.00  0.00
ATOM    785  N   PRO    52      -1.844   5.189 -13.252  1.00  0.00
ATOM    786  CD  PRO    52      -2.640   5.645 -14.404  1.00  0.00
ATOM    787 2HD  PRO    52      -3.204   6.535 -14.125  1.00  0.00
ATOM    788 3HD  PRO    52      -3.331   4.856 -14.701  1.00  0.00
ATOM    789  CG  PRO    52      -1.602   5.925 -15.456  1.00  0.00
ATOM    790 2HG  PRO    52      -1.319   6.976 -15.417  1.00  0.00
ATOM    791 3HG  PRO    52      -2.010   5.695 -16.440  1.00  0.00
ATOM    792  CB  PRO    52      -0.448   5.038 -15.139  1.00  0.00
ATOM    793 2HB  PRO    52       0.470   5.516 -15.478  1.00  0.00
ATOM    794 3HB  PRO    52      -0.524   4.044 -15.580  1.00  0.00
ATOM    795  CA  PRO    52      -0.446   4.932 -13.612  1.00  0.00
ATOM    796  HA  PRO    52      -0.183   3.937 -13.253  1.00  0.00
ATOM    797  C   PRO    52       0.507   5.958 -13.008  1.00  0.00
ATOM    798  O   PRO    52       0.988   6.855 -13.699  1.00  0.00
ATOM    799  N   GLY    53       0.776   5.819 -11.713  1.00  0.00
ATOM    800  H   GLY    53       0.363   5.070 -11.174  1.00  0.00
ATOM    801  CA  GLY    53       1.670   6.740 -11.038  1.00  0.00
ATOM    802 2HA  GLY    53       2.680   6.332 -11.079  1.00  0.00
ATOM    803 3HA  GLY    53       1.642   7.694 -11.563  1.00  0.00
ATOM    804  C   GLY    53       1.287   6.963  -9.588  1.00  0.00
ATOM    805  O   GLY    53       2.110   7.393  -8.781  1.00  0.00
ATOM    806  N   GLY    54       0.033   6.672  -9.258  1.00  0.00
ATOM    807  H   GLY    54      -0.618   6.321  -9.946  1.00  0.00
ATOM    808  CA  GLY    54      -0.436   6.851  -7.896  1.00  0.00
ATOM    809 2HA  GLY    54      -0.107   7.828  -7.544  1.00  0.00
ATOM    810 3HA  GLY    54      -1.526   6.814  -7.899  1.00  0.00
ATOM    811  C   GLY    54       0.091   5.785  -6.956  1.00  0.00
ATOM    812  O   GLY    54      -0.154   5.833  -5.751  1.00  0.00
ATOM    813  N   LYS    55       0.817   4.818  -7.508  1.00  0.00
ATOM    814  H   LYS    55       0.965   4.805  -8.507  1.00  0.00
ATOM    815  CA  LYS    55       1.380   3.735  -6.712  1.00  0.00
ATOM    816  HA  LYS    55       1.981   3.083  -7.345  1.00  0.00
ATOM    817  CB  LYS    55       2.272   4.299  -5.604  1.00  0.00
ATOM    818 2HB  LYS    55       1.618   4.744  -4.854  1.00  0.00
ATOM    819 3HB  LYS    55       2.812   3.461  -5.162  1.00  0.00
ATOM    820  CG  LYS    55       3.265   5.340  -6.093  1.00  0.00
ATOM    821 2HG  LYS    55       4.264   5.040  -5.776  1.00  0.00
ATOM    822 3HG  LYS    55       3.224   5.372  -7.182  1.00  0.00
ATOM    823  CD  LYS    55       2.948   6.717  -5.534  1.00  0.00
ATOM    824 2HD  LYS    55       2.011   7.061  -5.972  1.00  0.00
ATOM    825 3HD  LYS    55       2.834   6.633  -4.453  1.00  0.00
ATOM    826  CE  LYS    55       4.052   7.714  -5.852  1.00  0.00
ATOM    827 2HE  LYS    55       4.488   8.052  -4.912  1.00  0.00
ATOM    828 3HE  LYS    55       4.813   7.204  -6.443  1.00  0.00
ATOM    829  NZ  LYS    55       3.537   8.888  -6.611  1.00  0.00
ATOM    830 1HZ  LYS    55       2.832   9.360  -6.063  1.00  0.00
ATOM    831 2HZ  LYS    55       4.297   9.525  -6.802  1.00  0.00
ATOM    832 3HZ  LYS    55       3.132   8.574  -7.482  1.00  0.00
ATOM    833  C   LYS    55       0.276   2.876  -6.102  1.00  0.00
ATOM    834  O   LYS    55      -0.896   3.014  -6.454  1.00  0.00
ATOM    835  N   PHE    56       0.658   1.992  -5.187  1.00  0.00
ATOM    836  H   PHE    56       1.636   1.895  -4.954  1.00  0.00
ATOM    837  CA  PHE    56      -0.300   1.112  -4.528  1.00  0.00
ATOM    838  HA  PHE    56      -1.280   1.213  -4.996  1.00  0.00
ATOM    839  CB  PHE    56       0.150  -0.346  -4.645  1.00  0.00
ATOM    840 2HB  PHE    56       1.238  -0.405  -4.656  1.00  0.00
ATOM    841 3HB  PHE    56      -0.236  -0.929  -3.808  1.00  0.00
ATOM    842  CG  PHE    56      -0.330  -1.023  -5.897  1.00  0.00
ATOM    843  CD1 PHE    56      -1.287  -2.022  -5.836  1.00  0.00
ATOM    844  HD1 PHE    56      -1.691  -2.315  -4.867  1.00  0.00
ATOM    845  CE1 PHE    56      -1.731  -2.647  -6.987  1.00  0.00
ATOM    846  HE1 PHE    56      -2.485  -3.432  -6.926  1.00  0.00
ATOM    847  CZ  PHE    56      -1.218  -2.276  -8.214  1.00  0.00
ATOM    848  HZ  PHE    56      -1.565  -2.768  -9.123  1.00  0.00
ATOM    849  CE2 PHE    56      -0.264  -1.280  -8.288  1.00  0.00
ATOM    850  HE2 PHE    56       0.141  -0.983  -9.255  1.00  0.00
ATOM    851  CD2 PHE    56       0.177  -0.660  -7.135  1.00  0.00
ATOM    852  HD2 PHE    56       0.932   0.124  -7.192  1.00  0.00
ATOM    853  C   PHE    56      -0.464   1.489  -3.059  1.00  0.00
ATOM    854  O   PHE    56       0.236   0.984  -2.180  1.00  0.00
ATOM    855  N   PRO    57      -1.411   2.398  -2.784  1.00  0.00
ATOM    856  CD  PRO    57      -2.282   3.042  -3.781  1.00  0.00
ATOM    857 2HD  PRO    57      -2.715   2.280  -4.430  1.00  0.00
ATOM    858 3HD  PRO    57      -1.695   3.737  -4.380  1.00  0.00
ATOM    859  CG  PRO    57      -3.316   3.740  -2.941  1.00  0.00
ATOM    860 2HG  PRO    57      -4.182   3.089  -2.814  1.00  0.00
ATOM    861 3HG  PRO    57      -3.625   4.661  -3.434  1.00  0.00
ATOM    862  CB  PRO    57      -2.657   4.030  -1.637  1.00  0.00
ATOM    863 2HB  PRO    57      -3.413   4.033  -0.851  1.00  0.00
ATOM    864 3HB  PRO    57      -2.112   4.973  -1.620  1.00  0.00
ATOM    865  CA  PRO    57      -1.689   2.864  -1.422  1.00  0.00
ATOM    866  HA  PRO    57      -0.746   3.169  -0.970  1.00  0.00
ATOM    867  C   PRO    57      -2.338   1.785  -0.561  1.00  0.00
ATOM    868  O   PRO    57      -2.520   1.963   0.643  1.00  0.00
ATOM    869  N   VAL    58      -2.685   0.665  -1.187  1.00  0.00
ATOM    870  H   VAL    58      -2.541   0.576  -2.183  1.00  0.00
ATOM    871  CA  VAL    58      -3.312  -0.444  -0.478  1.00  0.00
ATOM    872  HA  VAL    58      -2.840  -0.627   0.488  1.00  0.00
ATOM    873  CB  VAL    58      -4.813  -0.188  -0.251  1.00  0.00
ATOM    874  HB  VAL    58      -5.329  -1.146  -0.175  1.00  0.00
ATOM    875  CG1 VAL    58      -5.031   0.607   1.028  1.00  0.00
ATOM    876 1HG1 VAL    58      -4.517   1.565   0.953  1.00  0.00
ATOM    877 2HG1 VAL    58      -6.098   0.778   1.173  1.00  0.00
ATOM    878 3HG1 VAL    58      -4.636   0.047   1.876  1.00  0.00
ATOM    879  CG2 VAL    58      -5.417   0.533  -1.446  1.00  0.00
ATOM    880 1HG2 VAL    58      -5.294  -0.078  -2.340  1.00  0.00
ATOM    881 2HG2 VAL    58      -6.479   0.705  -1.268  1.00  0.00
ATOM    882 3HG2 VAL    58      -4.913   1.488  -1.587  1.00  0.00
ATOM    883  C   VAL    58      -3.141  -1.752  -1.243  1.00  0.00
ATOM    884  O   VAL    58      -2.832  -1.751  -2.435  1.00  0.00
ATOM    885  N   ASP    59      -3.344  -2.867  -0.550  1.00  0.00
ATOM    886  H   ASP    59      -3.563  -2.817   0.435  1.00  0.00
ATOM    887  CA  ASP    59      -3.215  -4.184  -1.163  1.00  0.00
ATOM    888  HA  ASP    59      -2.559  -4.126  -2.031  1.00  0.00
ATOM    889  CB  ASP    59      -2.619  -5.178  -0.166  1.00  0.00
ATOM    890 2HB  ASP    59      -2.506  -6.137  -0.673  1.00  0.00
ATOM    891 3HB  ASP    59      -1.639  -4.808   0.134  1.00  0.00
ATOM    892  CG  ASP    59      -3.488  -5.357   1.063  1.00  0.00
ATOM    893  OD1 ASP    59      -3.837  -6.514   1.380  1.00  0.00
ATOM    894  OD2 ASP    59      -3.819  -4.341   1.708  1.00  0.00
ATOM    895  C   ASP    59      -4.567  -4.688  -1.658  1.00  0.00
ATOM    896  O   ASP    59      -5.486  -4.905  -0.870  1.00  0.00
ATOM    897  N   GLY    60      -4.680  -4.871  -2.970  1.00  0.00
ATOM    898  H   GLY    60      -3.906  -4.683  -3.590  1.00  0.00
ATOM    899  CA  GLY    60      -5.924  -5.348  -3.547  1.00  0.00
ATOM    900 2HA  GLY    60      -6.461  -5.917  -2.787  1.00  0.00
ATOM    901 3HA  GLY    60      -6.520  -4.485  -3.843  1.00  0.00
ATOM    902  C   GLY    60      -5.700  -6.232  -4.758  1.00  0.00
ATOM    903  O   GLY    60      -4.638  -6.188  -5.380  1.00  0.00
ATOM    904  N   ARG    61      -6.701  -7.040  -5.091  1.00  0.00
ATOM    905  H   ARG    61      -7.541  -7.063  -4.531  1.00  0.00
ATOM    906  CA  ARG    61      -6.607  -7.942  -6.234  1.00  0.00
ATOM    907  HA  ARG    61      -5.646  -8.456  -6.223  1.00  0.00
ATOM    908  CB  ARG    61      -7.721  -8.989  -6.177  1.00  0.00
ATOM    909 2HB  ARG    61      -7.661  -9.477  -5.204  1.00  0.00
ATOM    910 3HB  ARG    61      -8.671  -8.460  -6.259  1.00  0.00
ATOM    911  CG  ARG    61      -7.629 -10.036  -7.275  1.00  0.00
ATOM    912 2HG  ARG    61      -8.113  -9.643  -8.169  1.00  0.00
ATOM    913 3HG  ARG    61      -6.577 -10.225  -7.485  1.00  0.00
ATOM    914  CD  ARG    61      -8.304 -11.335  -6.864  1.00  0.00
ATOM    915 2HD  ARG    61      -7.605 -12.159  -7.006  1.00  0.00
ATOM    916 3HD  ARG    61      -8.583 -11.273  -5.812  1.00  0.00
ATOM    917  NE  ARG    61      -9.505 -11.600  -7.651  1.00  0.00
ATOM    918  HE  ARG    61      -9.429 -12.239  -8.429  1.00  0.00
ATOM    919  CZ  ARG    61     -10.687 -11.048  -7.398  1.00  0.00
ATOM    920  NH1 ARG    61     -10.825 -10.205  -6.384  1.00  0.00
ATOM    921 1HH1 ARG    61     -10.029  -9.984  -5.804  1.00  0.00
ATOM    922 2HH1 ARG    61     -11.726  -9.789  -6.196  1.00  0.00
ATOM    923  NH2 ARG    61     -11.733 -11.339  -8.160  1.00  0.00
ATOM    924 1HH2 ARG    61     -11.628 -11.981  -8.932  1.00  0.00
ATOM    925 2HH2 ARG    61     -12.630 -10.918  -7.964  1.00  0.00
ATOM    926  C   ARG    61      -6.688  -7.167  -7.546  1.00  0.00
ATOM    927  O   ARG    61      -7.285  -6.092  -7.609  1.00  0.00
ATOM    928  N   VAL    62      -6.082  -7.720  -8.592  1.00  0.00
ATOM    929  H   VAL    62      -5.580  -8.590  -8.484  1.00  0.00
ATOM    930  CA  VAL    62      -6.086  -7.082  -9.903  1.00  0.00
ATOM    931  HA  VAL    62      -6.765  -6.230  -9.937  1.00  0.00
ATOM    932  CB  VAL    62      -4.676  -6.604 -10.298  1.00  0.00
ATOM    933  HB  VAL    62      -4.042  -7.474 -10.470  1.00  0.00
ATOM    934  CG1 VAL    62      -4.734  -5.761 -11.563  1.00  0.00
ATOM    935 1HG1 VAL    62      -5.368  -4.891 -11.391  1.00  0.00
ATOM    936 2HG1 VAL    62      -3.729  -5.432 -11.827  1.00  0.00
ATOM    937 3HG1 VAL    62      -5.147  -6.356 -12.378  1.00  0.00
ATOM    938  CG2 VAL    62      -4.038  -5.826  -9.157  1.00  0.00
ATOM    939 1HG2 VAL    62      -3.962  -6.467  -8.278  1.00  0.00
ATOM    940 2HG2 VAL    62      -3.043  -5.496  -9.453  1.00  0.00
ATOM    941 3HG2 VAL    62      -4.653  -4.958  -8.920  1.00  0.00
ATOM    942  C   VAL    62      -6.608  -8.032 -10.975  1.00  0.00
ATOM    943  O   VAL    62      -6.003  -9.069 -11.247  1.00  0.00
ATOM    944  N   ILE    63      -7.734  -7.671 -11.580  1.00  0.00
ATOM    945  H   ILE    63      -8.210  -6.825 -11.300  1.00  0.00
ATOM    946  CA  ILE    63      -8.337  -8.490 -12.624  1.00  0.00
ATOM    947  HA  ILE    63      -7.586  -9.125 -13.094  1.00  0.00
ATOM    948  CB  ILE    63      -9.473  -9.368 -12.065  1.00  0.00
ATOM    949  HB  ILE    63     -10.008  -9.829 -12.895  1.00  0.00
ATOM    950  CG2 ILE    63      -8.908 -10.454 -11.162  1.00  0.00
ATOM    951 1HG2 ILE    63      -8.373  -9.995 -10.331  1.00  0.00
ATOM    952 2HG2 ILE    63      -9.723 -11.066 -10.775  1.00  0.00
ATOM    953 3HG2 ILE    63      -8.223 -11.081 -11.732  1.00  0.00
ATOM    954  CG1 ILE    63     -10.484  -8.508 -11.305  1.00  0.00
ATOM    955 2HG1 ILE    63     -10.142  -8.438 -10.272  1.00  0.00
ATOM    956 3HG1 ILE    63     -10.477  -7.517 -11.758  1.00  0.00
ATOM    957  CD1 ILE    63     -11.891  -9.064 -11.333  1.00  0.00
ATOM    958 1HD1 ILE    63     -11.900 -10.055 -10.879  1.00  0.00
ATOM    959 2HD1 ILE    63     -12.555  -8.404 -10.775  1.00  0.00
ATOM    960 3HD1 ILE    63     -12.234  -9.135 -12.365  1.00  0.00
ATOM    961  C   ILE    63      -8.886  -7.626 -13.754  1.00  0.00
ATOM    962  O   ILE    63      -9.996  -7.851 -14.237  1.00  0.00
ATOM    963  N   GLU    64      -8.101  -6.637 -14.171  1.00  0.00
ATOM    964  H   GLU    64      -7.212  -6.473 -13.722  1.00  0.00
ATOM    965  CA  GLU    64      -8.509  -5.740 -15.245  1.00  0.00
ATOM    966  HA  GLU    64      -8.903  -6.318 -16.081  1.00  0.00
ATOM    967  CB  GLU    64      -9.600  -4.785 -14.754  1.00  0.00
ATOM    968 2HB  GLU    64      -9.723  -4.954 -13.684  1.00  0.00
ATOM    969 3HB  GLU    64      -9.244  -3.769 -14.923  1.00  0.00
ATOM    970  CG  GLU    64     -10.935  -4.976 -15.453  1.00  0.00
ATOM    971 2HG  GLU    64     -11.199  -6.032 -15.390  1.00  0.00
ATOM    972 3HG  GLU    64     -11.680  -4.384 -14.920  1.00  0.00
ATOM    973  CD  GLU    64     -10.898  -4.551 -16.908  1.00  0.00
ATOM    974  OE1 GLU    64     -11.652  -5.135 -17.716  1.00  0.00
ATOM    975  OE2 GLU    64     -10.117  -3.636 -17.240  1.00  0.00
ATOM    976  C   GLU    64      -7.319  -4.943 -15.770  1.00  0.00
ATOM    977  O   GLU    64      -6.592  -4.313 -15.002  1.00  0.00
ATOM    978  N   GLY    65      -7.125  -4.976 -17.085  1.00  0.00
ATOM    979  H   GLY    65      -7.741  -5.504 -17.687  1.00  0.00
ATOM    980  CA  GLY    65      -6.022  -4.254 -17.691  1.00  0.00
ATOM    981 2HA  GLY    65      -6.191  -4.206 -18.767  1.00  0.00
ATOM    982 3HA  GLY    65      -6.004  -3.245 -17.281  1.00  0.00
ATOM    983  C   GLY    65      -4.683  -4.916 -17.431  1.00  0.00
ATOM    984  O   GLY    65      -4.626  -6.066 -16.993  1.00  0.00
ATOM    985  N   HID    66      -3.603  -4.191 -17.703  1.00  0.00
ATOM    986  H   HID    66      -3.701  -3.264 -18.091  1.00  0.00
ATOM    987  CA  HID    66      -2.258  -4.716 -17.497  1.00  0.00
ATOM    988  HA  HID    66      -2.223  -5.294 -16.573  1.00  0.00
ATOM    989  CB  HID    66      -1.860  -5.627 -18.659  1.00  0.00
ATOM    990 2HB  HID    66      -0.787  -5.817 -18.635  1.00  0.00
ATOM    991 3HB  HID    66      -2.398  -6.574 -18.601  1.00  0.00
ATOM    992  CG  HID    66      -2.162  -5.045 -20.006  1.00  0.00
ATOM    993  ND1 HID    66      -1.211  -4.425 -20.789  1.00  0.00
ATOM    994  HD1 HID    66      -0.242  -4.309 -20.530  1.00  0.00
ATOM    995  CE1 HID    66      -1.769  -4.016 -21.914  1.00  0.00
ATOM    996  HE1 HID    66      -1.179  -3.498 -22.670  1.00  0.00
ATOM    997  NE2 HID    66      -3.046  -4.350 -21.891  1.00  0.00
ATOM    998  CD2 HID    66      -3.317  -4.995 -20.709  1.00  0.00
ATOM    999  HD2 HID    66      -4.326  -5.352 -20.502  1.00  0.00
ATOM   1000  C   HID    66      -1.248  -3.582 -17.355  1.00  0.00
ATOM   1001  O   HID    66      -0.978  -2.854 -18.311  1.00  0.00
ATOM   1002  N   SER    67      -0.694  -3.436 -16.156  1.00  0.00
ATOM   1003  H   SER    67      -0.970  -4.041 -15.395  1.00  0.00
ATOM   1004  CA  SER    67       0.283  -2.387 -15.887  1.00  0.00
ATOM   1005  HA  SER    67       0.441  -1.789 -16.784  1.00  0.00
ATOM   1006  CB  SER    67      -0.216  -1.470 -14.770  1.00  0.00
ATOM   1007 2HB  SER    67      -0.405  -2.073 -13.881  1.00  0.00
ATOM   1008 3HB  SER    67       0.557  -0.734 -14.551  1.00  0.00
ATOM   1009  OG  SER    67      -1.408  -0.804 -15.151  1.00  0.00
ATOM   1010  HG  SER    67      -1.700  -0.236 -14.434  1.00  0.00
ATOM   1011  C   SER    67       1.633  -2.987 -15.503  1.00  0.00
ATOM   1012  O   SER    67       1.791  -4.206 -15.456  1.00  0.00
ATOM   1013  N   MET    68       2.602  -2.120 -15.230  1.00  0.00
ATOM   1014  H   MET    68       2.432  -1.128 -15.314  1.00  0.00
ATOM   1015  CA  MET    68       3.938  -2.563 -14.848  1.00  0.00
ATOM   1016  HA  MET    68       4.009  -3.647 -14.939  1.00  0.00
ATOM   1017  CB  MET    68       4.989  -1.925 -15.758  1.00  0.00
ATOM   1018 2HB  MET    68       4.508  -1.712 -16.712  1.00  0.00
ATOM   1019 3HB  MET    68       5.300  -0.990 -15.292  1.00  0.00
ATOM   1020  CG  MET    68       6.207  -2.805 -15.990  1.00  0.00
ATOM   1021 2HG  MET    68       7.092  -2.245 -15.690  1.00  0.00
ATOM   1022 3HG  MET    68       6.109  -3.692 -15.363  1.00  0.00
ATOM   1023  SD  MET    68       6.381  -3.312 -17.712  1.00  0.00
ATOM   1024  CE  MET    68       5.938  -5.044 -17.602  1.00  0.00
ATOM   1025 1HE  MET    68       4.920  -5.136 -17.221  1.00  0.00
ATOM   1026 2HE  MET    68       5.998  -5.499 -18.591  1.00  0.00
ATOM   1027 3HE  MET    68       6.625  -5.554 -16.926  1.00  0.00
ATOM   1028  C   MET    68       4.231  -2.216 -13.392  1.00  0.00
ATOM   1029  O   MET    68       4.713  -1.125 -13.089  1.00  0.00
ATOM   1030  N   VAL    69       3.937  -3.152 -12.495  1.00  0.00
ATOM   1031  H   VAL    69       3.516  -4.022 -12.790  1.00  0.00
ATOM   1032  CA  VAL    69       4.170  -2.945 -11.070  1.00  0.00
ATOM   1033  HA  VAL    69       3.969  -1.916 -10.772  1.00  0.00
ATOM   1034  CB  VAL    69       3.296  -3.883 -10.217  1.00  0.00
ATOM   1035  HB  VAL    69       3.521  -4.916 -10.483  1.00  0.00
ATOM   1036  CG1 VAL    69       3.572  -3.669  -8.736  1.00  0.00
ATOM   1037 1HG1 VAL    69       3.347  -2.637  -8.469  1.00  0.00
ATOM   1038 2HG1 VAL    69       2.945  -4.341  -8.148  1.00  0.00
ATOM   1039 3HG1 VAL    69       4.621  -3.877  -8.528  1.00  0.00
ATOM   1040  CG2 VAL    69       1.823  -3.669 -10.529  1.00  0.00
ATOM   1041 1HG2 VAL    69       1.640  -3.877 -11.583  1.00  0.00
ATOM   1042 2HG2 VAL    69       1.220  -4.340  -9.917  1.00  0.00
ATOM   1043 3HG2 VAL    69       1.551  -2.637 -10.310  1.00  0.00
ATOM   1044  C   VAL    69       5.635  -3.169 -10.715  1.00  0.00
ATOM   1045  O   VAL    69       6.160  -4.272 -10.867  1.00  0.00
ATOM   1046  N   ASP    70       6.291  -2.116 -10.240  1.00  0.00
ATOM   1047  H   ASP    70       5.825  -1.223 -10.164  1.00  0.00
ATOM   1048  CA  ASP    70       7.697  -2.198  -9.860  1.00  0.00
ATOM   1049  HA  ASP    70       8.140  -3.104 -10.273  1.00  0.00
ATOM   1050  CB  ASP    70       8.464  -0.989 -10.399  1.00  0.00
ATOM   1051 2HB  ASP    70       8.137  -0.811 -11.423  1.00  0.00
ATOM   1052 3HB  ASP    70       8.208  -0.128  -9.782  1.00  0.00
ATOM   1053  CG  ASP    70       9.965  -1.199 -10.377  1.00  0.00
ATOM   1054  OD1 ASP    70      10.538  -1.270  -9.270  1.00  0.00
ATOM   1055  OD2 ASP    70      10.566  -1.294 -11.467  1.00  0.00
ATOM   1056  C   ASP    70       7.847  -2.277  -8.344  1.00  0.00
ATOM   1057  O   ASP    70       7.714  -1.273  -7.645  1.00  0.00
ATOM   1058  N   GLU    71       8.123  -3.477  -7.844  1.00  0.00
ATOM   1059  H   GLU    71       8.193  -4.278  -8.456  1.00  0.00
ATOM   1060  CA  GLU    71       8.288  -3.686  -6.410  1.00  0.00
ATOM   1061  HA  GLU    71       8.105  -2.754  -5.876  1.00  0.00
ATOM   1062  CB  GLU    71       7.298  -4.739  -5.908  1.00  0.00
ATOM   1063 2HB  GLU    71       7.674  -5.113  -4.956  1.00  0.00
ATOM   1064 3HB  GLU    71       6.342  -4.239  -5.749  1.00  0.00
ATOM   1065  CG  GLU    71       7.107  -5.902  -6.868  1.00  0.00
ATOM   1066 2HG  GLU    71       6.369  -5.603  -7.612  1.00  0.00
ATOM   1067 3HG  GLU    71       8.061  -6.093  -7.359  1.00  0.00
ATOM   1068  CD  GLU    71       6.637  -7.163  -6.170  1.00  0.00
ATOM   1069  OE1 GLU    71       6.044  -7.050  -5.077  1.00  0.00
ATOM   1070  OE2 GLU    71       6.864  -8.263  -6.716  1.00  0.00
ATOM   1071  C   GLU    71       9.715  -4.118  -6.085  1.00  0.00
ATOM   1072  O   GLU    71       9.941  -5.212  -5.567  1.00  0.00
ATOM   1073  N   SER    72      10.675  -3.252  -6.393  1.00  0.00
ATOM   1074  H   SER    72      10.441  -2.379  -6.843  1.00  0.00
ATOM   1075  CA  SER    72      12.080  -3.544  -6.138  1.00  0.00
ATOM   1076  HA  SER    72      12.260  -4.614  -6.240  1.00  0.00
ATOM   1077  CB  SER    72      12.967  -2.801  -7.138  1.00  0.00
ATOM   1078 2HB  SER    72      14.000  -3.116  -6.989  1.00  0.00
ATOM   1079 3HB  SER    72      12.649  -3.063  -8.147  1.00  0.00
ATOM   1080  OG  SER    72      12.871  -1.399  -6.962  1.00  0.00
ATOM   1081  HG  SER    72      13.435  -0.957  -7.600  1.00  0.00
ATOM   1082  C   SER    72      12.466  -3.157  -4.713  1.00  0.00
ATOM   1083  O   SER    72      13.644  -3.154  -4.356  1.00  0.00
ATOM   1084  N   LEU    73      11.464  -2.831  -3.904  1.00  0.00
ATOM   1085  H   LEU    73      10.515  -2.820  -4.252  1.00  0.00
ATOM   1086  CA  LEU    73      11.697  -2.441  -2.518  1.00  0.00
ATOM   1087  HA  LEU    73      12.756  -2.537  -2.279  1.00  0.00
ATOM   1088  CB  LEU    73      11.275  -0.987  -2.298  1.00  0.00
ATOM   1089 2HB  LEU    73      11.852  -0.431  -3.036  1.00  0.00
ATOM   1090 3HB  LEU    73      10.213  -0.903  -2.529  1.00  0.00
ATOM   1091  CG  LEU    73      11.541  -0.414  -0.906  1.00  0.00
ATOM   1092  HG  LEU    73      11.603   0.672  -0.976  1.00  0.00
ATOM   1093  CD1 LEU    73      10.423  -0.796   0.052  1.00  0.00
ATOM   1094 1HD1 LEU    73      10.360  -1.882   0.123  1.00  0.00
ATOM   1095 2HD1 LEU    73      10.630  -0.379   1.038  1.00  0.00
ATOM   1096 3HD1 LEU    73       9.476  -0.402  -0.317  1.00  0.00
ATOM   1097  CD2 LEU    73      12.885  -0.896  -0.378  1.00  0.00
ATOM   1098 1HD2 LEU    73      13.678  -0.572  -1.051  1.00  0.00
ATOM   1099 2HD2 LEU    73      13.057  -0.478   0.614  1.00  0.00
ATOM   1100 3HD2 LEU    73      12.883  -1.985  -0.318  1.00  0.00
ATOM   1101  C   LEU    73      10.936  -3.354  -1.561  1.00  0.00
ATOM   1102  O   LEU    73      11.293  -3.477  -0.389  1.00  0.00
ATOM   1103  N   ILE    74       9.887  -3.992  -2.069  1.00  0.00
ATOM   1104  H   ILE    74       9.615  -3.837  -3.029  1.00  0.00
ATOM   1105  CA  ILE    74       9.078  -4.895  -1.260  1.00  0.00
ATOM   1106  HA  ILE    74       9.145  -4.627  -0.205  1.00  0.00
ATOM   1107  CB  ILE    74       7.602  -4.878  -1.701  1.00  0.00
ATOM   1108  HB  ILE    74       7.539  -5.182  -2.746  1.00  0.00
ATOM   1109  CG2 ILE    74       6.782  -5.832  -0.846  1.00  0.00
ATOM   1110 1HG2 ILE    74       6.843  -5.529   0.199  1.00  0.00
ATOM   1111 2HG2 ILE    74       5.741  -5.809  -1.170  1.00  0.00
ATOM   1112 3HG2 ILE    74       7.172  -6.844  -0.953  1.00  0.00
ATOM   1113  CG1 ILE    74       7.039  -3.458  -1.615  1.00  0.00
ATOM   1114 2HG1 ILE    74       7.685  -2.815  -2.212  1.00  0.00
ATOM   1115 3HG1 ILE    74       6.040  -3.476  -2.052  1.00  0.00
ATOM   1116  CD1 ILE    74       6.961  -2.923  -0.202  1.00  0.00
ATOM   1117 1HD1 ILE    74       7.959  -2.905   0.236  1.00  0.00
ATOM   1118 2HD1 ILE    74       6.553  -1.913  -0.217  1.00  0.00
ATOM   1119 3HD1 ILE    74       6.314  -3.566   0.396  1.00  0.00
ATOM   1120  C   ILE    74       9.604  -6.324  -1.340  1.00  0.00
ATOM   1121  O   ILE    74       9.832  -6.972  -0.318  1.00  0.00
ATOM   1122  N   THR    75       9.795  -6.811  -2.562  1.00  0.00
ATOM   1123  H   THR    75       9.566  -6.251  -3.371  1.00  0.00
ATOM   1124  CA  THR    75      10.295  -8.163  -2.777  1.00  0.00
ATOM   1125  HA  THR    75      10.270  -8.732  -1.848  1.00  0.00
ATOM   1126  CB  THR    75       9.459  -8.910  -3.834  1.00  0.00
ATOM   1127  HB  THR    75      10.108  -9.600  -4.372  1.00  0.00
ATOM   1128  CG2 THR    75       8.327  -9.687  -3.179  1.00  0.00
ATOM   1129 1HG2 THR    75       7.676  -8.998  -2.640  1.00  0.00
ATOM   1130 2HG2 THR    75       7.751 -10.206  -3.945  1.00  0.00
ATOM   1131 3HG2 THR    75       8.741 -10.415  -2.481  1.00  0.00
ATOM   1132  OG1 THR    75       8.921  -7.979  -4.780  1.00  0.00
ATOM   1133 1HG  THR    75       8.402  -8.452  -5.434  1.00  0.00
ATOM   1134  C   THR    75      11.754  -8.147  -3.218  1.00  0.00
ATOM   1135  O   THR    75      12.355  -9.195  -3.449  1.00  0.00
ATOM   1136  N   GLY    76      12.319  -6.949  -3.333  1.00  0.00
ATOM   1137  H   GLY    76      11.797  -6.107  -3.136  1.00  0.00
ATOM   1138  CA  GLY    76      13.704  -6.819  -3.745  1.00  0.00
ATOM   1139 2HA  GLY    76      14.019  -5.790  -3.575  1.00  0.00
ATOM   1140 3HA  GLY    76      14.309  -7.489  -3.135  1.00  0.00
ATOM   1141  C   GLY    76      13.909  -7.163  -5.208  1.00  0.00
ATOM   1142  O   GLY    76      14.976  -7.637  -5.597  1.00  0.00
ATOM   1143  N   GLU    77      12.883  -6.926  -6.019  1.00  0.00
ATOM   1144  H   GLU    77      12.016  -6.565  -5.646  1.00  0.00
ATOM   1145  CA  GLU    77      12.954  -7.217  -7.446  1.00  0.00
ATOM   1146  HA  GLU    77      13.219  -8.264  -7.598  1.00  0.00
ATOM   1147  CB  GLU    77      11.602  -6.954  -8.111  1.00  0.00
ATOM   1148 2HB  GLU    77      11.447  -5.875  -8.118  1.00  0.00
ATOM   1149 3HB  GLU    77      11.666  -7.319  -9.136  1.00  0.00
ATOM   1150  CG  GLU    77      10.436  -7.628  -7.407  1.00  0.00
ATOM   1151 2HG  GLU    77      10.421  -7.278  -6.375  1.00  0.00
ATOM   1152 3HG  GLU    77       9.518  -7.320  -7.908  1.00  0.00
ATOM   1153  CD  GLU    77      10.538  -9.141  -7.425  1.00  0.00
ATOM   1154  OE1 GLU    77       9.756  -9.796  -6.705  1.00  0.00
ATOM   1155  OE2 GLU    77      11.400  -9.669  -8.158  1.00  0.00
ATOM   1156  C   GLU    77      14.037  -6.377  -8.118  1.00  0.00
ATOM   1157  O   GLU    77      14.925  -5.844  -7.455  1.00  0.00
ATOM   1158  N   ALA    78      13.954  -6.266  -9.440  1.00  0.00
ATOM   1159  H   ALA    78      13.230  -6.758  -9.945  1.00  0.00
ATOM   1160  CA  ALA    78      14.925  -5.491 -10.203  1.00  0.00
ATOM   1161  HA  ALA    78      15.023  -4.504  -9.751  1.00  0.00
ATOM   1162  CB  ALA    78      16.284  -6.175 -10.178  1.00  0.00
ATOM   1163 1HB  ALA    78      16.203  -7.161 -10.636  1.00  0.00
ATOM   1164 2HB  ALA    78      17.004  -5.575 -10.734  1.00  0.00
ATOM   1165 3HB  ALA    78      16.619  -6.281  -9.146  1.00  0.00
ATOM   1166  C   ALA    78      14.458  -5.290 -11.641  1.00  0.00
ATOM   1167  O   ALA    78      14.708  -4.247 -12.244  1.00  0.00
ATOM   1168  N   MET    79      13.781  -6.296 -12.184  1.00  0.00
ATOM   1169  H   MET    79      13.629  -7.146 -11.660  1.00  0.00
ATOM   1170  CA  MET    79      13.279  -6.228 -13.552  1.00  0.00
ATOM   1171  HA  MET    79      13.810  -5.453 -14.104  1.00  0.00
ATOM   1172  CB  MET    79      13.491  -7.566 -14.262  1.00  0.00
ATOM   1173 2HB  MET    79      12.888  -7.553 -15.170  1.00  0.00
ATOM   1174 3HB  MET    79      14.546  -7.631 -14.528  1.00  0.00
ATOM   1175  CG  MET    79      13.107  -8.770 -13.417  1.00  0.00
ATOM   1176 2HG  MET    79      12.427  -8.433 -12.634  1.00  0.00
ATOM   1177 3HG  MET    79      12.594  -9.486 -14.059  1.00  0.00
ATOM   1178  SD  MET    79      14.534  -9.570 -12.658  1.00  0.00
ATOM   1179  CE  MET    79      14.679 -11.038 -13.673  1.00  0.00
ATOM   1180 1HE  MET    79      14.843 -10.748 -14.711  1.00  0.00
ATOM   1181 2HE  MET    79      15.520 -11.639 -13.326  1.00  0.00
ATOM   1182 3HE  MET    79      13.762 -11.623 -13.600  1.00  0.00
ATOM   1183  C   MET    79      11.799  -5.858 -13.571  1.00  0.00
ATOM   1184  O   MET    79      11.079  -6.034 -12.588  1.00  0.00
ATOM   1185  N   PRO    80      11.334  -5.333 -14.714  1.00  0.00
ATOM   1186  CD  PRO    80      12.137  -5.095 -15.926  1.00  0.00
ATOM   1187 2HD  PRO    80      12.705  -5.994 -16.166  1.00  0.00
ATOM   1188 3HD  PRO    80      12.824  -4.268 -15.748  1.00  0.00
ATOM   1189  CG  PRO    80      11.105  -4.769 -16.969  1.00  0.00
ATOM   1190 2HG  PRO    80      10.828  -5.678 -17.503  1.00  0.00
ATOM   1191 3HG  PRO    80      11.515  -4.045 -17.673  1.00  0.00
ATOM   1192  CB  PRO    80       9.944  -4.196 -16.233  1.00  0.00
ATOM   1193 2HB  PRO    80       9.030  -4.422 -16.783  1.00  0.00
ATOM   1194 3HB  PRO    80      10.013  -3.121 -16.071  1.00  0.00
ATOM   1195  CA  PRO    80       9.936  -4.927 -14.888  1.00  0.00
ATOM   1196  HA  PRO    80       9.665  -4.281 -14.053  1.00  0.00
ATOM   1197  C   PRO    80       8.988  -6.121 -14.935  1.00  0.00
ATOM   1198  O   PRO    80       8.962  -6.867 -15.914  1.00  0.00
ATOM   1199  N   VAL    81       8.210  -6.295 -13.872  1.00  0.00
ATOM   1200  H   VAL    81       8.287  -5.672 -13.081  1.00  0.00
ATOM   1201  CA  VAL    81       7.259  -7.397 -13.794  1.00  0.00
ATOM   1202  HA  VAL    81       7.606  -8.272 -14.344  1.00  0.00
ATOM   1203  CB  VAL    81       6.994  -7.808 -12.333  1.00  0.00
ATOM   1204  HB  VAL    81       6.397  -7.035 -11.850  1.00  0.00
ATOM   1205  CG1 VAL    81       6.248  -9.132 -12.277  1.00  0.00
ATOM   1206 1HG1 VAL    81       6.844  -9.907 -12.759  1.00  0.00
ATOM   1207 2HG1 VAL    81       6.070  -9.406 -11.237  1.00  0.00
ATOM   1208 3HG1 VAL    81       5.294  -9.035 -12.795  1.00  0.00
ATOM   1209  CG2 VAL    81       8.301  -7.890 -11.558  1.00  0.00
ATOM   1210 1HG2 VAL    81       8.792  -6.917 -11.568  1.00  0.00
ATOM   1211 2HG2 VAL    81       8.095  -8.182 -10.528  1.00  0.00
ATOM   1212 3HG2 VAL    81       8.953  -8.631 -12.021  1.00  0.00
ATOM   1213  C   VAL    81       5.935  -7.028 -14.454  1.00  0.00
ATOM   1214  O   VAL    81       5.295  -6.047 -14.079  1.00  0.00
ATOM   1215  N   ALA    82       5.530  -7.823 -15.439  1.00  0.00
ATOM   1216  H   ALA    82       6.111  -8.592 -15.740  1.00  0.00
ATOM   1217  CA  ALA    82       4.280  -7.582 -16.150  1.00  0.00
ATOM   1218  HA  ALA    82       4.123  -6.507 -16.235  1.00  0.00
ATOM   1219  CB  ALA    82       4.347  -8.176 -17.550  1.00  0.00
ATOM   1220 1HB  ALA    82       4.494  -9.254 -17.481  1.00  0.00
ATOM   1221 2HB  ALA    82       3.415  -7.970 -18.077  1.00  0.00
ATOM   1222 3HB  ALA    82       5.179  -7.730 -18.095  1.00  0.00
ATOM   1223  C   ALA    82       3.093  -8.157 -15.385  1.00  0.00
ATOM   1224  O   ALA    82       3.068  -9.343 -15.057  1.00  0.00
ATOM   1225  N   LYS    83       2.111  -7.309 -15.103  1.00  0.00
ATOM   1226  H   LYS    83       2.191  -6.338 -15.367  1.00  0.00
ATOM   1227  CA  LYS    83       0.919  -7.732 -14.376  1.00  0.00
ATOM   1228  HA  LYS    83       1.184  -8.483 -13.631  1.00  0.00
ATOM   1229  CB  LYS    83       0.283  -6.538 -13.661  1.00  0.00
ATOM   1230 2HB  LYS    83       0.490  -5.652 -14.260  1.00  0.00
ATOM   1231 3HB  LYS    83      -0.793  -6.712 -13.630  1.00  0.00
ATOM   1232  CG  LYS    83       0.802  -6.328 -12.249  1.00  0.00
ATOM   1233 2HG  LYS    83       1.890  -6.281 -12.285  1.00  0.00
ATOM   1234 3HG  LYS    83       0.409  -5.383 -11.874  1.00  0.00
ATOM   1235  CD  LYS    83       0.375  -7.455 -11.324  1.00  0.00
ATOM   1236 2HD  LYS    83      -0.354  -7.063 -10.615  1.00  0.00
ATOM   1237 3HD  LYS    83      -0.088  -8.239 -11.924  1.00  0.00
ATOM   1238  CE  LYS    83       1.560  -8.032 -10.565  1.00  0.00
ATOM   1239 2HE  LYS    83       2.377  -7.313 -10.609  1.00  0.00
ATOM   1240 3HE  LYS    83       1.262  -8.179  -9.527  1.00  0.00
ATOM   1241  NZ  LYS    83       2.009  -9.330 -11.141  1.00  0.00
ATOM   1242 1HZ  LYS    83       2.285  -9.194 -12.103  1.00  0.00
ATOM   1243 2HZ  LYS    83       2.794  -9.680 -10.611  1.00  0.00
ATOM   1244 3HZ  LYS    83       1.251  -9.997 -11.099  1.00  0.00
ATOM   1245  C   LYS    83      -0.095  -8.372 -15.320  1.00  0.00
ATOM   1246  O   LYS    83       0.028  -8.272 -16.541  1.00  0.00
ATOM   1247  N   LYS    84      -1.097  -9.028 -14.746  1.00  0.00
ATOM   1248  H   LYS    84      -1.138  -9.109 -13.740  1.00  0.00
ATOM   1249  CA  LYS    84      -2.134  -9.683 -15.534  1.00  0.00
ATOM   1250  HA  LYS    84      -2.285  -9.144 -16.469  1.00  0.00
ATOM   1251  CB  LYS    84      -1.725 -11.122 -15.859  1.00  0.00
ATOM   1252 2HB  LYS    84      -2.625 -11.656 -16.164  1.00  0.00
ATOM   1253 3HB  LYS    84      -1.026 -11.082 -16.694  1.00  0.00
ATOM   1254  CG  LYS    84      -1.078 -11.848 -14.693  1.00  0.00
ATOM   1255 2HG  LYS    84       0.004 -11.796 -14.812  1.00  0.00
ATOM   1256 3HG  LYS    84      -1.367 -11.345 -13.770  1.00  0.00
ATOM   1257  CD  LYS    84      -1.511 -13.303 -14.632  1.00  0.00
ATOM   1258 2HD  LYS    84      -1.140 -13.736 -13.703  1.00  0.00
ATOM   1259 3HD  LYS    84      -2.601 -13.340 -14.639  1.00  0.00
ATOM   1260  CE  LYS    84      -0.969 -14.096 -15.812  1.00  0.00
ATOM   1261 2HE  LYS    84      -1.619 -13.921 -16.669  1.00  0.00
ATOM   1262 3HE  LYS    84       0.033 -13.733 -16.037  1.00  0.00
ATOM   1263  NZ  LYS    84      -0.914 -15.555 -15.521  1.00  0.00
ATOM   1264 1HZ  LYS    84      -1.843 -15.892 -15.313  1.00  0.00
ATOM   1265 2HZ  LYS    84      -0.551 -16.046 -16.325  1.00  0.00
ATOM   1266 3HZ  LYS    84      -0.312 -15.718 -14.727  1.00  0.00
ATOM   1267  C   LYS    84      -3.467  -9.677 -14.792  1.00  0.00
ATOM   1268  O   LYS    84      -3.523  -9.557 -13.568  1.00  0.00
ATOM   1269  N   PRO    85      -4.567  -9.812 -15.548  1.00  0.00
ATOM   1270  CD  PRO    85      -4.575  -9.960 -17.013  1.00  0.00
ATOM   1271 2HD  PRO    85      -3.861 -10.731 -17.303  1.00  0.00
ATOM   1272 3HD  PRO    85      -4.295  -9.014 -17.474  1.00  0.00
ATOM   1273  CG  PRO    85      -5.996 -10.346 -17.316  1.00  0.00
ATOM   1274 2HG  PRO    85      -6.080 -11.433 -17.347  1.00  0.00
ATOM   1275 3HG  PRO    85      -6.288  -9.932 -18.281  1.00  0.00
ATOM   1276  CB  PRO    85      -6.821  -9.769 -16.218  1.00  0.00
ATOM   1277 2HB  PRO    85      -7.699 -10.398 -16.066  1.00  0.00
ATOM   1278 3HB  PRO    85      -7.138  -8.742 -16.399  1.00  0.00
ATOM   1279  CA  PRO    85      -5.919  -9.827 -14.983  1.00  0.00
ATOM   1280  HA  PRO    85      -6.025  -8.956 -14.336  1.00  0.00
ATOM   1281  C   PRO    85      -6.197 -11.093 -14.179  1.00  0.00
ATOM   1282  O   PRO    85      -6.905 -11.988 -14.638  1.00  0.00
ATOM   1283  N   GLY    86      -5.634 -11.161 -12.976  1.00  0.00
ATOM   1284  H   GLY    86      -5.058 -10.408 -12.629  1.00  0.00
ATOM   1285  CA  GLY    86      -5.834 -12.322 -12.128  1.00  0.00
ATOM   1286 2HA  GLY    86      -6.708 -12.145 -11.500  1.00  0.00
ATOM   1287 3HA  GLY    86      -6.015 -13.188 -12.765  1.00  0.00
ATOM   1288  C   GLY    86      -4.638 -12.604 -11.241  1.00  0.00
ATOM   1289  O   GLY    86      -4.207 -13.750 -11.114  1.00  0.00
ATOM   1290  N   SER    87      -4.100 -11.556 -10.625  1.00  0.00
ATOM   1291  H   SER    87      -4.473 -10.631 -10.781  1.00  0.00
ATOM   1292  CA  SER    87      -2.942 -11.696  -9.749  1.00  0.00
ATOM   1293  HA  SER    87      -2.855 -12.729  -9.411  1.00  0.00
ATOM   1294  CB  SER    87      -1.662 -11.316 -10.496  1.00  0.00
ATOM   1295 2HB  SER    87      -1.918 -11.073 -11.527  1.00  0.00
ATOM   1296 3HB  SER    87      -1.224 -10.442 -10.015  1.00  0.00
ATOM   1297  OG  SER    87      -0.728 -12.382 -10.480  1.00  0.00
ATOM   1298  HG  SER    87       0.064 -12.120 -10.954  1.00  0.00
ATOM   1299  C   SER    87      -3.095 -10.827  -8.504  1.00  0.00
ATOM   1300  O   SER    87      -3.902  -9.897  -8.476  1.00  0.00
ATOM   1301  N   THR    88      -2.314 -11.137  -7.474  1.00  0.00
ATOM   1302  H   THR    88      -1.687 -11.927  -7.534  1.00  0.00
ATOM   1303  CA  THR    88      -2.362 -10.387  -6.226  1.00  0.00
ATOM   1304  HA  THR    88      -3.268  -9.782  -6.178  1.00  0.00
ATOM   1305  CB  THR    88      -2.332 -11.326  -5.005  1.00  0.00
ATOM   1306  HB  THR    88      -2.228 -10.725  -4.102  1.00  0.00
ATOM   1307  CG2 THR    88      -3.609 -12.147  -4.922  1.00  0.00
ATOM   1308 1HG2 THR    88      -3.714 -12.749  -5.824  1.00  0.00
ATOM   1309 2HG2 THR    88      -3.565 -12.803  -4.052  1.00  0.00
ATOM   1310 3HG2 THR    88      -4.466 -11.480  -4.830  1.00  0.00
ATOM   1311  OG1 THR    88      -1.201 -12.200  -5.087  1.00  0.00
ATOM   1312 1HG  THR    88      -1.190 -12.782  -4.323  1.00  0.00
ATOM   1313  C   THR    88      -1.199  -9.407  -6.128  1.00  0.00
ATOM   1314  O   THR    88      -0.185  -9.561  -6.809  1.00  0.00
ATOM   1315  N   VAL    89      -1.351  -8.398  -5.275  1.00  0.00
ATOM   1316  H   VAL    89      -2.213  -8.298  -4.758  1.00  0.00
ATOM   1317  CA  VAL    89      -0.311  -7.393  -5.087  1.00  0.00
ATOM   1318  HA  VAL    89       0.672  -7.772  -5.364  1.00  0.00
ATOM   1319  CB  VAL    89      -0.601  -6.125  -5.911  1.00  0.00
ATOM   1320  HB  VAL    89       0.225  -5.426  -5.786  1.00  0.00
ATOM   1321  CG1 VAL    89      -0.756  -6.468  -7.384  1.00  0.00
ATOM   1322 1HG1 VAL    89      -1.583  -7.168  -7.510  1.00  0.00
ATOM   1323 2HG1 VAL    89      -0.961  -5.559  -7.950  1.00  0.00
ATOM   1324 3HG1 VAL    89       0.163  -6.924  -7.750  1.00  0.00
ATOM   1325  CG2 VAL    89      -1.844  -5.422  -5.386  1.00  0.00
ATOM   1326 1HG2 VAL    89      -1.690  -5.140  -4.344  1.00  0.00
ATOM   1327 2HG2 VAL    89      -2.035  -4.528  -5.980  1.00  0.00
ATOM   1328 3HG2 VAL    89      -2.700  -6.094  -5.457  1.00  0.00
ATOM   1329  C   VAL    89      -0.176  -7.012  -3.617  1.00  0.00
ATOM   1330  O   VAL    89      -0.891  -7.534  -2.761  1.00  0.00
ATOM   1331  N   ILE    90       0.746  -6.098  -3.332  1.00  0.00
ATOM   1332  H   ILE    90       1.328  -5.720  -4.065  1.00  0.00
ATOM   1333  CA  ILE    90       0.974  -5.645  -1.965  1.00  0.00
ATOM   1334  HA  ILE    90       0.179  -6.000  -1.308  1.00  0.00
ATOM   1335  CB  ILE    90       2.335  -6.129  -1.431  1.00  0.00
ATOM   1336  HB  ILE    90       2.685  -5.434  -0.668  1.00  0.00
ATOM   1337  CG2 ILE    90       2.203  -7.519  -0.827  1.00  0.00
ATOM   1338 1HG2 ILE    90       1.852  -8.216  -1.589  1.00  0.00
ATOM   1339 2HG2 ILE    90       3.173  -7.848  -0.454  1.00  0.00
ATOM   1340 3HG2 ILE    90       1.488  -7.492  -0.004  1.00  0.00
ATOM   1341  CG1 ILE    90       3.377  -6.127  -2.552  1.00  0.00
ATOM   1342 2HG1 ILE    90       4.310  -6.501  -2.131  1.00  0.00
ATOM   1343 3HG1 ILE    90       3.027  -6.812  -3.324  1.00  0.00
ATOM   1344  CD1 ILE    90       3.609  -4.760  -3.158  1.00  0.00
ATOM   1345 1HD1 ILE    90       3.959  -4.075  -2.386  1.00  0.00
ATOM   1346 2HD1 ILE    90       4.359  -4.834  -3.945  1.00  0.00
ATOM   1347 3HD1 ILE    90       2.676  -4.386  -3.579  1.00  0.00
ATOM   1348  C   ILE    90       0.916  -4.124  -1.873  1.00  0.00
ATOM   1349  O   ILE    90       1.000  -3.427  -2.884  1.00  0.00
ATOM   1350  N   ALA    91       0.774  -3.616  -0.653  1.00  0.00
ATOM   1351  H   ALA    91       0.667  -4.231   0.142  1.00  0.00
ATOM   1352  CA  ALA    91       0.709  -2.177  -0.428  1.00  0.00
ATOM   1353  HA  ALA    91       0.205  -1.709  -1.274  1.00  0.00
ATOM   1354  CB  ALA    91      -0.082  -1.876   0.836  1.00  0.00
ATOM   1355 1HB  ALA    91       0.415  -2.331   1.693  1.00  0.00
ATOM   1356 2HB  ALA    91      -0.141  -0.798   0.981  1.00  0.00
ATOM   1357 3HB  ALA    91      -1.089  -2.285   0.742  1.00  0.00
ATOM   1358  C   ALA    91       2.106  -1.572  -0.336  1.00  0.00
ATOM   1359  O   ALA    91       2.853  -1.850   0.601  1.00  0.00
ATOM   1360  N   GLY    92       2.453  -0.744  -1.317  1.00  0.00
ATOM   1361  H   GLY    92       1.815  -0.538  -2.072  1.00  0.00
ATOM   1362  CA  GLY    92       3.760  -0.114  -1.328  1.00  0.00
ATOM   1363 2HA  GLY    92       3.636   0.940  -1.082  1.00  0.00
ATOM   1364 3HA  GLY    92       4.380  -0.594  -0.570  1.00  0.00
ATOM   1365  C   GLY    92       4.448  -0.229  -2.674  1.00  0.00
ATOM   1366  O   GLY    92       5.562   0.264  -2.853  1.00  0.00
ATOM   1367  N   SER    93       3.785  -0.883  -3.622  1.00  0.00
ATOM   1368  H   SER    93       2.885  -1.295  -3.418  1.00  0.00
ATOM   1369  CA  SER    93       4.342  -1.066  -4.957  1.00  0.00
ATOM   1370  HA  SER    93       5.417  -1.235  -4.891  1.00  0.00
ATOM   1371  CB  SER    93       3.699  -2.275  -5.639  1.00  0.00
ATOM   1372 2HB  SER    93       4.482  -2.867  -6.112  1.00  0.00
ATOM   1373 3HB  SER    93       3.197  -2.877  -4.881  1.00  0.00
ATOM   1374  OG  SER    93       2.759  -1.868  -6.618  1.00  0.00
ATOM   1375  HG  SER    93       2.370  -2.643  -7.030  1.00  0.00
ATOM   1376  C   SER    93       4.134   0.183  -5.808  1.00  0.00
ATOM   1377  O   SER    93       3.172   0.927  -5.614  1.00  0.00
ATOM   1378  N   ILE    94       5.043   0.406  -6.751  1.00  0.00
ATOM   1379  H   ILE    94       5.831  -0.218  -6.852  1.00  0.00
ATOM   1380  CA  ILE    94       4.960   1.563  -7.633  1.00  0.00
ATOM   1381  HA  ILE    94       4.205   2.263  -7.275  1.00  0.00
ATOM   1382  CB  ILE    94       6.316   2.284  -7.747  1.00  0.00
ATOM   1383  HB  ILE    94       6.996   1.669  -8.336  1.00  0.00
ATOM   1384  CG2 ILE    94       6.143   3.636  -8.421  1.00  0.00
ATOM   1385 1HG2 ILE    94       5.462   4.251  -7.832  1.00  0.00
ATOM   1386 2HG2 ILE    94       7.110   4.132  -8.494  1.00  0.00
ATOM   1387 3HG2 ILE    94       5.731   3.494  -9.420  1.00  0.00
ATOM   1388  CG1 ILE    94       6.948   2.449  -6.363  1.00  0.00
ATOM   1389 2HG1 ILE    94       7.094   1.451  -5.949  1.00  0.00
ATOM   1390 3HG1 ILE    94       7.916   2.930  -6.501  1.00  0.00
ATOM   1391  CD1 ILE    94       6.108   3.271  -5.410  1.00  0.00
ATOM   1392 1HD1 ILE    94       5.139   2.790  -5.271  1.00  0.00
ATOM   1393 2HD1 ILE    94       6.616   3.346  -4.449  1.00  0.00
ATOM   1394 3HD1 ILE    94       5.961   4.269  -5.822  1.00  0.00
ATOM   1395  C   ILE    94       4.493   1.159  -9.028  1.00  0.00
ATOM   1396  O   ILE    94       5.119   0.330  -9.687  1.00  0.00
ATOM   1397  N   ASN    95       3.391   1.754  -9.472  1.00  0.00
ATOM   1398  H   ASN    95       2.895   2.407  -8.882  1.00  0.00
ATOM   1399  CA  ASN    95       2.840   1.457 -10.790  1.00  0.00
ATOM   1400  HA  ASN    95       3.095   0.437 -11.078  1.00  0.00
ATOM   1401  CB  ASN    95       1.316   1.592 -10.771  1.00  0.00
ATOM   1402 2HB  ASN    95       0.932   1.125  -9.864  1.00  0.00
ATOM   1403 3HB  ASN    95       1.056   2.650 -10.772  1.00  0.00
ATOM   1404  CG  ASN    95       0.663   0.931 -11.969  1.00  0.00
ATOM   1405  OD1 ASN    95       1.060  -0.158 -12.385  1.00  0.00
ATOM   1406  ND2 ASN    95      -0.345   1.588 -12.531  1.00  0.00
ATOM   1407 1HD2 ASN    95      -0.817   1.193 -13.332  1.00  0.00
ATOM   1408 2HD2 ASN    95      -0.636   2.479 -12.154  1.00  0.00
ATOM   1409  C   ASN    95       3.431   2.384 -11.848  1.00  0.00
ATOM   1410  O   ASN    95       3.947   3.455 -11.529  1.00  0.00
ATOM   1411  N   GLN    96       3.350   1.965 -13.106  1.00  0.00
ATOM   1412  H   GLN    96       2.944   1.063 -13.314  1.00  0.00
ATOM   1413  CA  GLN    96       3.877   2.758 -14.211  1.00  0.00
ATOM   1414  HA  GLN    96       3.428   3.751 -14.201  1.00  0.00
ATOM   1415  CB  GLN    96       5.394   2.905 -14.083  1.00  0.00
ATOM   1416 2HB  GLN    96       5.607   3.198 -13.055  1.00  0.00
ATOM   1417 3HB  GLN    96       5.833   1.927 -14.280  1.00  0.00
ATOM   1418  CG  GLN    96       5.989   3.929 -15.036  1.00  0.00
ATOM   1419 2HG  GLN    96       6.967   3.577 -15.362  1.00  0.00
ATOM   1420 3HG  GLN    96       5.331   4.025 -15.900  1.00  0.00
ATOM   1421  CD  GLN    96       6.153   5.294 -14.397  1.00  0.00
ATOM   1422  OE1 GLN    96       7.271   5.751 -14.160  1.00  0.00
ATOM   1423  NE2 GLN    96       5.036   5.954 -14.115  1.00  0.00
ATOM   1424 1HE2 GLN    96       5.087   6.868 -13.688  1.00  0.00
ATOM   1425 2HE2 GLN    96       4.140   5.539 -14.328  1.00  0.00
ATOM   1426  C   GLN    96       3.527   2.123 -15.552  1.00  0.00
ATOM   1427  O   GLN    96       4.326   1.387 -16.129  1.00  0.00
ATOM   1428  N   ASN    97       2.327   2.413 -16.044  1.00  0.00
ATOM   1429  H   ASN    97       1.694   2.999 -15.518  1.00  0.00
ATOM   1430  CA  ASN    97       1.870   1.870 -17.318  1.00  0.00
ATOM   1431  HA  ASN    97       2.563   2.150 -18.111  1.00  0.00
ATOM   1432  CB  ASN    97       1.799   0.343 -17.248  1.00  0.00
ATOM   1433 2HB  ASN    97       2.795  -0.047 -17.038  1.00  0.00
ATOM   1434 3HB  ASN    97       1.120   0.058 -16.443  1.00  0.00
ATOM   1435  CG  ASN    97       1.301  -0.272 -18.542  1.00  0.00
ATOM   1436  OD1 ASN    97       2.090  -0.732 -19.367  1.00  0.00
ATOM   1437  ND2 ASN    97      -0.014  -0.282 -18.723  1.00  0.00
ATOM   1438 1HD2 ASN    97      -0.402  -0.680 -19.567  1.00  0.00
ATOM   1439 2HD2 ASN    97      -0.621   0.107 -18.016  1.00  0.00
ATOM   1440  C   ASN    97       0.505   2.437 -17.693  1.00  0.00
ATOM   1441  O   ASN    97       0.383   3.218 -18.636  1.00  0.00
ATOM   1442  N   GLY    98      -0.522   2.038 -16.947  1.00  0.00
ATOM   1443  H   GLY    98      -0.389   1.395 -16.179  1.00  0.00
ATOM   1444  CA  GLY    98      -1.865   2.517 -17.217  1.00  0.00
ATOM   1445 2HA  GLY    98      -1.804   3.561 -17.524  1.00  0.00
ATOM   1446 3HA  GLY    98      -2.286   1.924 -18.029  1.00  0.00
ATOM   1447  C   GLY    98      -2.772   2.411 -16.007  1.00  0.00
ATOM   1448  O   GLY    98      -2.306   2.175 -14.893  1.00  0.00
ATOM   1449  N   SER    99      -4.071   2.589 -16.226  1.00  0.00
ATOM   1450  H   SER    99      -4.403   2.809 -17.154  1.00  0.00
ATOM   1451  CA  SER    99      -5.045   2.517 -15.143  1.00  0.00
ATOM   1452  HA  SER    99      -4.547   2.666 -14.185  1.00  0.00
ATOM   1453  CB  SER    99      -6.110   3.602 -15.315  1.00  0.00
ATOM   1454 2HB  SER    99      -5.688   4.415 -15.904  1.00  0.00
ATOM   1455 3HB  SER    99      -6.962   3.174 -15.844  1.00  0.00
ATOM   1456  OG  SER    99      -6.537   4.101 -14.059  1.00  0.00
ATOM   1457  HG  SER    99      -7.204   4.778 -14.194  1.00  0.00
ATOM   1458  C   SER    99      -5.706   1.143 -15.097  1.00  0.00
ATOM   1459  O   SER    99      -6.149   0.619 -16.120  1.00  0.00
ATOM   1460  N   LEU   100      -5.769   0.564 -13.903  1.00  0.00
ATOM   1461  H   LEU   100      -5.365   1.020 -13.098  1.00  0.00
ATOM   1462  CA  LEU   100      -6.376  -0.750 -13.721  1.00  0.00
ATOM   1463  HA  LEU   100      -6.852  -1.072 -14.648  1.00  0.00
ATOM   1464  CB  LEU   100      -5.309  -1.777 -13.337  1.00  0.00
ATOM   1465 2HB  LEU   100      -5.184  -1.638 -12.263  1.00  0.00
ATOM   1466 3HB  LEU   100      -5.710  -2.773 -13.529  1.00  0.00
ATOM   1467  CG  LEU   100      -3.955  -1.630 -14.031  1.00  0.00
ATOM   1468  HG  LEU   100      -3.636  -0.590 -13.967  1.00  0.00
ATOM   1469  CD1 LEU   100      -2.916  -2.521 -13.369  1.00  0.00
ATOM   1470 1HD1 LEU   100      -3.235  -3.562 -13.433  1.00  0.00
ATOM   1471 2HD1 LEU   100      -1.959  -2.403 -13.877  1.00  0.00
ATOM   1472 3HD1 LEU   100      -2.809  -2.239 -12.322  1.00  0.00
ATOM   1473  CD2 LEU   100      -4.076  -1.959 -15.512  1.00  0.00
ATOM   1474 1HD2 LEU   100      -4.789  -1.279 -15.979  1.00  0.00
ATOM   1475 2HD2 LEU   100      -3.103  -1.849 -15.990  1.00  0.00
ATOM   1476 3HD2 LEU   100      -4.424  -2.986 -15.629  1.00  0.00
ATOM   1477  C   LEU   100      -7.462  -0.704 -12.651  1.00  0.00
ATOM   1478  O   LEU   100      -7.450   0.161 -11.775  1.00  0.00
ATOM   1479  N   LEU   101      -8.400  -1.642 -12.728  1.00  0.00
ATOM   1480  H   LEU   101      -8.385  -2.312 -13.484  1.00  0.00
ATOM   1481  CA  LEU   101      -9.493  -1.711 -11.765  1.00  0.00
ATOM   1482  HA  LEU   101      -9.671  -0.726 -11.334  1.00  0.00
ATOM   1483  CB  LEU   101     -10.776  -2.183 -12.453  1.00  0.00
ATOM   1484 2HB  LEU   101     -10.446  -2.995 -13.102  1.00  0.00
ATOM   1485 3HB  LEU   101     -11.446  -2.579 -11.690  1.00  0.00
ATOM   1486  CG  LEU   101     -11.515  -1.134 -13.285  1.00  0.00
ATOM   1487  HG  LEU   101     -11.664  -0.241 -12.678  1.00  0.00
ATOM   1488  CD1 LEU   101     -10.713  -0.775 -14.526  1.00  0.00
ATOM   1489 1HD1 LEU   101     -10.565  -1.668 -15.134  1.00  0.00
ATOM   1490 2HD1 LEU   101     -11.255  -0.028 -15.105  1.00  0.00
ATOM   1491 3HD1 LEU   101      -9.745  -0.373 -14.229  1.00  0.00
ATOM   1492  CD2 LEU   101     -12.899  -1.638 -13.670  1.00  0.00
ATOM   1493 1HD2 LEU   101     -13.475  -1.845 -12.768  1.00  0.00
ATOM   1494 2HD2 LEU   101     -13.411  -0.879 -14.262  1.00  0.00
ATOM   1495 3HD2 LEU   101     -12.804  -2.552 -14.256  1.00  0.00
ATOM   1496  C   LEU   101      -9.146  -2.649 -10.613  1.00  0.00
ATOM   1497  O   LEU   101      -9.176  -3.871 -10.764  1.00  0.00
ATOM   1498  N   ILE   102      -8.820  -2.070  -9.463  1.00  0.00
ATOM   1499  H   ILE   102      -8.783  -1.063  -9.396  1.00  0.00
ATOM   1500  CA  ILE   102      -8.471  -2.854  -8.285  1.00  0.00
ATOM   1501  HA  ILE   102      -8.576  -3.920  -8.490  1.00  0.00
ATOM   1502  CB  ILE   102      -7.033  -2.560  -7.818  1.00  0.00
ATOM   1503  HB  ILE   102      -6.935  -1.493  -7.621  1.00  0.00
ATOM   1504  CG2 ILE   102      -6.717  -3.340  -6.551  1.00  0.00
ATOM   1505 1HG2 ILE   102      -6.815  -4.408  -6.747  1.00  0.00
ATOM   1506 2HG2 ILE   102      -5.698  -3.122  -6.234  1.00  0.00
ATOM   1507 3HG2 ILE   102      -7.412  -3.051  -5.763  1.00  0.00
ATOM   1508  CG1 ILE   102      -6.034  -2.904  -8.925  1.00  0.00
ATOM   1509 2HG1 ILE   102      -6.070  -3.984  -9.073  1.00  0.00
ATOM   1510 3HG1 ILE   102      -6.368  -2.403  -9.833  1.00  0.00
ATOM   1511  CD1 ILE   102      -4.615  -2.485  -8.610  1.00  0.00
ATOM   1512 1HD1 ILE   102      -4.281  -2.987  -7.702  1.00  0.00
ATOM   1513 2HD1 ILE   102      -3.962  -2.761  -9.438  1.00  0.00
ATOM   1514 3HD1 ILE   102      -4.579  -1.406  -8.462  1.00  0.00
ATOM   1515  C   ILE   102      -9.433  -2.576  -7.135  1.00  0.00
ATOM   1516  O   ILE   102      -9.823  -1.432  -6.900  1.00  0.00
ATOM   1517  N   CYS   103      -9.811  -3.630  -6.419  1.00  0.00
ATOM   1518  H   CYS   103      -9.489  -4.554  -6.669  1.00  0.00
ATOM   1519  CA  CYS   103     -10.727  -3.500  -5.292  1.00  0.00
ATOM   1520  HA  CYS   103     -11.323  -2.594  -5.401  1.00  0.00
ATOM   1521  CB  CYS   103     -11.672  -4.701  -5.234  1.00  0.00
ATOM   1522 2HB  CYS   103     -12.249  -4.689  -4.309  1.00  0.00
ATOM   1523 3HB  CYS   103     -12.353  -4.692  -6.085  1.00  0.00
ATOM   1524  SG  CYS   103     -10.833  -6.302  -5.280  1.00  0.00
ATOM   1525  HG  CYS   103     -11.938  -7.040  -5.213  1.00  0.00
ATOM   1526  C   CYS   103      -9.960  -3.377  -3.979  1.00  0.00
ATOM   1527  O   CYS   103      -9.396  -4.352  -3.485  1.00  0.00
ATOM   1528  N   ALA   104      -9.943  -2.171  -3.421  1.00  0.00
ATOM   1529  H   ALA   104     -10.384  -1.392  -3.887  1.00  0.00
ATOM   1530  CA  ALA   104      -9.246  -1.921  -2.165  1.00  0.00
ATOM   1531  HA  ALA   104      -8.316  -2.490  -2.157  1.00  0.00
ATOM   1532  CB  ALA   104      -8.913  -0.442  -2.033  1.00  0.00
ATOM   1533 1HB  ALA   104      -9.835   0.139  -2.029  1.00  0.00
ATOM   1534 2HB  ALA   104      -8.374  -0.273  -1.101  1.00  0.00
ATOM   1535 3HB  ALA   104      -8.292  -0.133  -2.873  1.00  0.00
ATOM   1536  C   ALA   104     -10.075  -2.387  -0.974  1.00  0.00
ATOM   1537  O   ALA   104     -10.974  -1.681  -0.515  1.00  0.00
ATOM   1538  N   THR   105      -9.769  -3.581  -0.477  1.00  0.00
ATOM   1539  H   THR   105      -9.041  -4.135  -0.905  1.00  0.00
ATOM   1540  CA  THR   105     -10.487  -4.143   0.660  1.00  0.00
ATOM   1541  HA  THR   105     -11.016  -3.360   1.204  1.00  0.00
ATOM   1542  CB  THR   105     -11.509  -5.205   0.210  1.00  0.00
ATOM   1543  HB  THR   105     -12.262  -4.726  -0.415  1.00  0.00
ATOM   1544  CG2 THR   105     -10.826  -6.313  -0.578  1.00  0.00
ATOM   1545 1HG2 THR   105     -10.074  -6.794   0.047  1.00  0.00
ATOM   1546 2HG2 THR   105     -11.567  -7.051  -0.885  1.00  0.00
ATOM   1547 3HG2 THR   105     -10.348  -5.890  -1.461  1.00  0.00
ATOM   1548  OG1 THR   105     -12.171  -5.762   1.351  1.00  0.00
ATOM   1549 1HG  THR   105     -12.806  -6.422   1.062  1.00  0.00
ATOM   1550  C   THR   105      -9.526  -4.772   1.662  1.00  0.00
ATOM   1551  O   THR   105      -9.684  -5.931   2.046  1.00  0.00
ATOM   1552  N   HID   106      -8.529  -4.000   2.083  1.00  0.00
ATOM   1553  H   HID   106      -8.423  -3.066   1.715  1.00  0.00
ATOM   1554  CA  HID   106      -7.542  -4.481   3.042  1.00  0.00
ATOM   1555  HA  HID   106      -8.026  -5.115   3.786  1.00  0.00
ATOM   1556  CB  HID   106      -6.464  -5.299   2.330  1.00  0.00
ATOM   1557 2HB  HID   106      -6.168  -4.804   1.406  1.00  0.00
ATOM   1558 3HB  HID   106      -5.592  -5.419   2.973  1.00  0.00
ATOM   1559  CG  HID   106      -6.910  -6.678   1.953  1.00  0.00
ATOM   1560  ND1 HID   106      -7.127  -7.069   0.648  1.00  0.00
ATOM   1561  HD1 HID   106      -7.008  -6.472  -0.157  1.00  0.00
ATOM   1562  CE1 HID   106      -7.511  -8.333   0.627  1.00  0.00
ATOM   1563  HE1 HID   106      -7.735  -8.831  -0.317  1.00  0.00
ATOM   1564  NE2 HID   106      -7.549  -8.777   1.871  1.00  0.00
ATOM   1565  CD2 HID   106      -7.177  -7.762   2.718  1.00  0.00
ATOM   1566  HD2 HID   106      -7.145  -7.934   3.794  1.00  0.00
ATOM   1567  C   HID   106      -6.901  -3.318   3.793  1.00  0.00
ATOM   1568  O   HID   106      -5.838  -2.829   3.411  1.00  0.00
ATOM   1569  N   VAL   107      -7.556  -2.878   4.863  1.00  0.00
ATOM   1570  H   VAL   107      -8.441  -3.292   5.121  1.00  0.00
ATOM   1571  CA  VAL   107      -7.050  -1.773   5.668  1.00  0.00
ATOM   1572  HA  VAL   107      -7.048  -0.836   5.113  1.00  0.00
ATOM   1573  CB  VAL   107      -7.884  -1.584   6.949  1.00  0.00
ATOM   1574  HB  VAL   107      -8.940  -1.537   6.681  1.00  0.00
ATOM   1575  CG1 VAL   107      -7.657  -2.741   7.910  1.00  0.00
ATOM   1576 1HG1 VAL   107      -6.602  -2.789   8.180  1.00  0.00
ATOM   1577 2HG1 VAL   107      -8.255  -2.590   8.809  1.00  0.00
ATOM   1578 3HG1 VAL   107      -7.952  -3.675   7.431  1.00  0.00
ATOM   1579  CG2 VAL   107      -7.548  -0.256   7.612  1.00  0.00
ATOM   1580 1HG2 VAL   107      -7.767   0.560   6.924  1.00  0.00
ATOM   1581 2HG2 VAL   107      -8.147  -0.139   8.516  1.00  0.00
ATOM   1582 3HG2 VAL   107      -6.490  -0.237   7.873  1.00  0.00
ATOM   1583  C   VAL   107      -5.592  -1.995   6.052  1.00  0.00
ATOM   1584  O   VAL   107      -5.109  -3.126   6.071  1.00  0.00
ATOM   1585  N   GLY   108      -4.894  -0.905   6.359  1.00  0.00
ATOM   1586  H   GLY   108      -5.321   0.010   6.334  1.00  0.00
ATOM   1587  CA  GLY   108      -3.496  -1.002   6.740  1.00  0.00
ATOM   1588 2HA  GLY   108      -2.917  -1.277   5.859  1.00  0.00
ATOM   1589 3HA  GLY   108      -3.169  -0.027   7.100  1.00  0.00
ATOM   1590  C   GLY   108      -3.261  -2.033   7.826  1.00  0.00
ATOM   1591  O   GLY   108      -2.183  -2.619   7.912  1.00  0.00
ATOM   1592  N   ALA   109      -4.273  -2.253   8.659  1.00  0.00
ATOM   1593  H   ALA   109      -5.124  -1.715   8.575  1.00  0.00
ATOM   1594  CA  ALA   109      -4.172  -3.220   9.745  1.00  0.00
ATOM   1595  HA  ALA   109      -3.241  -3.048  10.284  1.00  0.00
ATOM   1596  CB  ALA   109      -5.333  -3.050  10.714  1.00  0.00
ATOM   1597 1HB  ALA   109      -6.273  -3.228  10.191  1.00  0.00
ATOM   1598 2HB  ALA   109      -5.232  -3.764  11.532  1.00  0.00
ATOM   1599 3HB  ALA   109      -5.327  -2.037  11.115  1.00  0.00
ATOM   1600  C   ALA   109      -4.132  -4.647   9.208  1.00  0.00
ATOM   1601  O   ALA   109      -3.363  -5.480   9.688  1.00  0.00
ATOM   1602  N   ASP   110      -4.966  -4.921   8.211  1.00  0.00
ATOM   1603  H   ASP   110      -5.602  -4.213   7.874  1.00  0.00
ATOM   1604  CA  ASP   110      -5.026  -6.248   7.608  1.00  0.00
ATOM   1605  HA  ASP   110      -5.082  -7.008   8.388  1.00  0.00
ATOM   1606  CB  ASP   110      -6.263  -6.371   6.717  1.00  0.00
ATOM   1607 2HB  ASP   110      -7.025  -5.693   7.101  1.00  0.00
ATOM   1608 3HB  ASP   110      -5.982  -6.067   5.709  1.00  0.00
ATOM   1609  CG  ASP   110      -6.814  -7.783   6.683  1.00  0.00
ATOM   1610  OD1 ASP   110      -6.047  -8.712   6.352  1.00  0.00
ATOM   1611  OD2 ASP   110      -8.011  -7.959   6.989  1.00  0.00
ATOM   1612  C   ASP   110      -3.767  -6.533   6.795  1.00  0.00
ATOM   1613  O   ASP   110      -3.507  -7.674   6.412  1.00  0.00
ATOM   1614  N   THR   111      -2.988  -5.488   6.534  1.00  0.00
ATOM   1615  H   THR   111      -3.256  -4.567   6.848  1.00  0.00
ATOM   1616  CA  THR   111      -1.758  -5.625   5.764  1.00  0.00
ATOM   1617  HA  THR   111      -1.831  -6.465   5.073  1.00  0.00
ATOM   1618  CB  THR   111      -1.455  -4.348   4.958  1.00  0.00
ATOM   1619  HB  THR   111      -0.727  -4.587   4.183  1.00  0.00
ATOM   1620  CG2 THR   111      -2.720  -3.801   4.314  1.00  0.00
ATOM   1621 1HG2 THR   111      -3.449  -3.562   5.089  1.00  0.00
ATOM   1622 2HG2 THR   111      -2.481  -2.900   3.750  1.00  0.00
ATOM   1623 3HG2 THR   111      -3.139  -4.550   3.641  1.00  0.00
ATOM   1624  OG1 THR   111      -0.880  -3.353   5.813  1.00  0.00
ATOM   1625 1HG  THR   111      -0.695  -2.562   5.303  1.00  0.00
ATOM   1626  C   THR   111      -0.573  -5.932   6.672  1.00  0.00
ATOM   1627  O   THR   111      -0.272  -5.176   7.596  1.00  0.00
ATOM   1628  N   THR   112       0.099  -7.047   6.403  1.00  0.00
ATOM   1629  H   THR   112      -0.201  -7.650   5.650  1.00  0.00
ATOM   1630  CA  THR   112       1.252  -7.455   7.197  1.00  0.00
ATOM   1631  HA  THR   112       1.029  -7.379   8.261  1.00  0.00
ATOM   1632  CB  THR   112       1.664  -8.906   6.883  1.00  0.00
ATOM   1633  HB  THR   112       0.839  -9.570   7.144  1.00  0.00
ATOM   1634  CG2 THR   112       1.997  -9.067   5.408  1.00  0.00
ATOM   1635 1HG2 THR   112       2.821  -8.404   5.147  1.00  0.00
ATOM   1636 2HG2 THR   112       2.285 -10.100   5.211  1.00  0.00
ATOM   1637 3HG2 THR   112       1.123  -8.813   4.808  1.00  0.00
ATOM   1638  OG1 THR   112       2.798  -9.275   7.676  1.00  0.00
ATOM   1639 1HG  THR   112       3.048 -10.180   7.475  1.00  0.00
ATOM   1640  C   THR   112       2.442  -6.536   6.950  1.00  0.00
ATOM   1641  O   THR   112       3.445  -6.596   7.662  1.00  0.00
ATOM   1642  N   LEU   113       2.326  -5.684   5.937  1.00  0.00
ATOM   1643  H   LEU   113       1.496  -5.693   5.362  1.00  0.00
ATOM   1644  CA  LEU   113       3.394  -4.750   5.596  1.00  0.00
ATOM   1645  HA  LEU   113       4.267  -5.298   5.241  1.00  0.00
ATOM   1646  CB  LEU   113       2.931  -3.798   4.492  1.00  0.00
ATOM   1647 2HB  LEU   113       2.818  -4.442   3.619  1.00  0.00
ATOM   1648 3HB  LEU   113       1.958  -3.396   4.775  1.00  0.00
ATOM   1649  CG  LEU   113       3.881  -2.647   4.157  1.00  0.00
ATOM   1650  HG  LEU   113       4.640  -2.578   4.936  1.00  0.00
ATOM   1651  CD1 LEU   113       4.553  -2.882   2.814  1.00  0.00
ATOM   1652 1HD1 LEU   113       3.794  -2.952   2.035  1.00  0.00
ATOM   1653 2HD1 LEU   113       5.225  -2.053   2.593  1.00  0.00
ATOM   1654 3HD1 LEU   113       5.122  -3.811   2.850  1.00  0.00
ATOM   1655  CD2 LEU   113       3.133  -1.321   4.156  1.00  0.00
ATOM   1656 1HD2 LEU   113       2.700  -1.147   5.141  1.00  0.00
ATOM   1657 2HD2 LEU   113       3.824  -0.514   3.916  1.00  0.00
ATOM   1658 3HD2 LEU   113       2.338  -1.352   3.411  1.00  0.00
ATOM   1659  C   LEU   113       3.832  -3.954   6.820  1.00  0.00
ATOM   1660  O   LEU   113       4.989  -4.020   7.235  1.00  0.00
ATOM   1661  N   SER   114       2.899  -3.202   7.396  1.00  0.00
ATOM   1662  H   SER   114       1.970  -3.159   7.002  1.00  0.00
ATOM   1663  CA  SER   114       3.189  -2.391   8.573  1.00  0.00
ATOM   1664  HA  SER   114       4.112  -1.833   8.420  1.00  0.00
ATOM   1665  CB  SER   114       2.053  -1.398   8.827  1.00  0.00
ATOM   1666 2HB  SER   114       2.128  -0.589   8.101  1.00  0.00
ATOM   1667 3HB  SER   114       1.102  -1.915   8.698  1.00  0.00
ATOM   1668  OG  SER   114       2.125  -0.864  10.137  1.00  0.00
ATOM   1669  HG  SER   114       1.403  -0.246  10.271  1.00  0.00
ATOM   1670  C   SER   114       3.394  -3.272   9.802  1.00  0.00
ATOM   1671  O   SER   114       4.057  -2.873  10.759  1.00  0.00
ATOM   1672  N   GLN   115       2.819  -4.469   9.767  1.00  0.00
ATOM   1673  H   GLN   115       2.257  -4.738   8.972  1.00  0.00
ATOM   1674  CA  GLN   115       2.938  -5.406  10.878  1.00  0.00
ATOM   1675  HA  GLN   115       2.689  -4.906  11.814  1.00  0.00
ATOM   1676  CB  GLN   115       1.981  -6.584  10.684  1.00  0.00
ATOM   1677 2HB  GLN   115       1.043  -6.183  10.299  1.00  0.00
ATOM   1678 3HB  GLN   115       2.425  -7.246   9.941  1.00  0.00
ATOM   1679  CG  GLN   115       1.711  -7.365  11.960  1.00  0.00
ATOM   1680 2HG  GLN   115       1.733  -8.430  11.729  1.00  0.00
ATOM   1681 3HG  GLN   115       2.492  -7.134  12.684  1.00  0.00
ATOM   1682  CD  GLN   115       0.366  -7.031  12.575  1.00  0.00
ATOM   1683  OE1 GLN   115      -0.566  -7.835  12.531  1.00  0.00
ATOM   1684  NE2 GLN   115       0.258  -5.840  13.152  1.00  0.00
ATOM   1685 1HE2 GLN   115      -0.616  -5.566  13.578  1.00  0.00
ATOM   1686 2HE2 GLN   115       1.050  -5.214  13.163  1.00  0.00
ATOM   1687  C   GLN   115       4.370  -5.915  11.010  1.00  0.00
ATOM   1688  O   GLN   115       4.894  -6.039  12.117  1.00  0.00
ATOM   1689  N   ILE   116       4.995  -6.208   9.875  1.00  0.00
ATOM   1690  H   ILE   116       4.512  -6.116   8.993  1.00  0.00
ATOM   1691  CA  ILE   116       6.366  -6.703   9.865  1.00  0.00
ATOM   1692  HA  ILE   116       6.453  -7.598  10.482  1.00  0.00
ATOM   1693  CB  ILE   116       6.840  -7.019   8.434  1.00  0.00
ATOM   1694  HB  ILE   116       6.723  -6.129   7.816  1.00  0.00
ATOM   1695  CG2 ILE   116       8.301  -7.443   8.441  1.00  0.00
ATOM   1696 1HG2 ILE   116       8.418  -8.334   9.059  1.00  0.00
ATOM   1697 2HG2 ILE   116       8.621  -7.663   7.423  1.00  0.00
ATOM   1698 3HG2 ILE   116       8.912  -6.637   8.847  1.00  0.00
ATOM   1699  CG1 ILE   116       5.966  -8.112   7.814  1.00  0.00
ATOM   1700 2HG1 ILE   116       6.479  -9.063   7.960  1.00  0.00
ATOM   1701 3HG1 ILE   116       5.022  -8.123   8.359  1.00  0.00
ATOM   1702  CD1 ILE   116       5.695  -7.906   6.340  1.00  0.00
ATOM   1703 1HD1 ILE   116       6.638  -7.896   5.795  1.00  0.00
ATOM   1704 2HD1 ILE   116       5.070  -8.718   5.968  1.00  0.00
ATOM   1705 3HD1 ILE   116       5.180  -6.956   6.194  1.00  0.00
ATOM   1706  C   ILE   116       7.320  -5.692  10.492  1.00  0.00
ATOM   1707  O   ILE   116       7.965  -5.973  11.502  1.00  0.00
ATOM   1708  N   VAL   117       7.404  -4.511   9.886  1.00  0.00
ATOM   1709  H   VAL   117       6.876  -4.336   9.043  1.00  0.00
ATOM   1710  CA  VAL   117       8.277  -3.456  10.387  1.00  0.00
ATOM   1711  HA  VAL   117       9.327  -3.745  10.346  1.00  0.00
ATOM   1712  CB  VAL   117       8.094  -2.151   9.589  1.00  0.00
ATOM   1713  HB  VAL   117       8.684  -1.364  10.058  1.00  0.00
ATOM   1714  CG1 VAL   117       8.550  -2.337   8.150  1.00  0.00
ATOM   1715 1HG1 VAL   117       7.960  -3.124   7.680  1.00  0.00
ATOM   1716 2HG1 VAL   117       8.413  -1.405   7.602  1.00  0.00
ATOM   1717 3HG1 VAL   117       9.603  -2.616   8.135  1.00  0.00
ATOM   1718  CG2 VAL   117       6.645  -1.693   9.643  1.00  0.00
ATOM   1719 1HG2 VAL   117       6.357  -1.518  10.680  1.00  0.00
ATOM   1720 2HG2 VAL   117       6.533  -0.770   9.074  1.00  0.00
ATOM   1721 3HG2 VAL   117       6.003  -2.463   9.214  1.00  0.00
ATOM   1722  C   VAL   117       8.013  -3.177  11.862  1.00  0.00
ATOM   1723  O   VAL   117       8.921  -2.815  12.610  1.00  0.00
ATOM   1724  N   LYS   118       6.762  -3.349  12.276  1.00  0.00
ATOM   1725  H   LYS   118       6.044  -3.618  11.618  1.00  0.00
ATOM   1726  CA  LYS   118       6.376  -3.119  13.663  1.00  0.00
ATOM   1727  HA  LYS   118       6.624  -2.098  13.953  1.00  0.00
ATOM   1728  CB  LYS   118       4.869  -3.323  13.836  1.00  0.00
ATOM   1729 2HB  LYS   118       4.537  -3.992  13.042  1.00  0.00
ATOM   1730 3HB  LYS   118       4.713  -3.803  14.803  1.00  0.00
ATOM   1731  CG  LYS   118       4.071  -2.032  13.777  1.00  0.00
ATOM   1732 2HG  LYS   118       4.324  -1.429  14.649  1.00  0.00
ATOM   1733 3HG  LYS   118       4.349  -1.495  12.871  1.00  0.00
ATOM   1734  CD  LYS   118       2.575  -2.302  13.766  1.00  0.00
ATOM   1735 2HD  LYS   118       2.104  -1.608  13.070  1.00  0.00
ATOM   1736 3HD  LYS   118       2.411  -3.325  13.425  1.00  0.00
ATOM   1737  CE  LYS   118       1.966  -2.125  15.148  1.00  0.00
ATOM   1738 2HE  LYS   118       2.312  -2.942  15.782  1.00  0.00
ATOM   1739 3HE  LYS   118       2.314  -1.177  15.556  1.00  0.00
ATOM   1740  NZ  LYS   118       0.478  -2.129  15.103  1.00  0.00
ATOM   1741 1HZ  LYS   118       0.155  -3.009  14.725  1.00  0.00
ATOM   1742 2HZ  LYS   118       0.112  -2.010  16.037  1.00  0.00
ATOM   1743 3HZ  LYS   118       0.157  -1.372  14.517  1.00  0.00
ATOM   1744  C   LYS   118       7.136  -4.051  14.602  1.00  0.00
ATOM   1745  O   LYS   118       7.869  -3.599  15.482  1.00  0.00
ATOM   1746  N   LEU   119       6.959  -5.353  14.407  1.00  0.00
ATOM   1747  H   LEU   119       6.324  -5.675  13.690  1.00  0.00
ATOM   1748  CA  LEU   119       7.629  -6.349  15.235  1.00  0.00
ATOM   1749  HA  LEU   119       7.430  -6.151  16.288  1.00  0.00
ATOM   1750  CB  LEU   119       7.117  -7.750  14.897  1.00  0.00
ATOM   1751 2HB  LEU   119       6.096  -7.582  14.555  1.00  0.00
ATOM   1752 3HB  LEU   119       7.715  -8.143  14.075  1.00  0.00
ATOM   1753  CG  LEU   119       7.109  -8.758  16.047  1.00  0.00
ATOM   1754  HG  LEU   119       6.405  -8.421  16.808  1.00  0.00
ATOM   1755  CD1 LEU   119       6.696 -10.134  15.549  1.00  0.00
ATOM   1756 1HD1 LEU   119       7.399 -10.472  14.788  1.00  0.00
ATOM   1757 2HD1 LEU   119       6.696 -10.838  16.382  1.00  0.00
ATOM   1758 3HD1 LEU   119       5.695 -10.081  15.120  1.00  0.00
ATOM   1759  CD2 LEU   119       8.476  -8.818  16.713  1.00  0.00
ATOM   1760 1HD2 LEU   119       8.732  -7.835  17.107  1.00  0.00
ATOM   1761 2HD2 LEU   119       8.451  -9.541  17.529  1.00  0.00
ATOM   1762 3HD2 LEU   119       9.224  -9.123  15.981  1.00  0.00
ATOM   1763  C   LEU   119       9.141  -6.288  15.042  1.00  0.00
ATOM   1764  O   LEU   119       9.904  -6.389  16.003  1.00  0.00
ATOM   1765  N   VAL   120       9.568  -6.121  13.795  1.00  0.00
ATOM   1766  H   VAL   120       8.903  -6.071  13.036  1.00  0.00
ATOM   1767  CA  VAL   120      10.989  -6.044  13.476  1.00  0.00
ATOM   1768  HA  VAL   120      11.540  -6.895  13.877  1.00  0.00
ATOM   1769  CB  VAL   120      11.220  -5.980  11.955  1.00  0.00
ATOM   1770  HB  VAL   120      10.716  -5.100  11.557  1.00  0.00
ATOM   1771  CG1 VAL   120      12.707  -5.897  11.644  1.00  0.00
ATOM   1772 1HG1 VAL   120      13.211  -6.778  12.042  1.00  0.00
ATOM   1773 2HG1 VAL   120      12.851  -5.853  10.565  1.00  0.00
ATOM   1774 3HG1 VAL   120      13.125  -5.002  12.103  1.00  0.00
ATOM   1775  CG2 VAL   120      10.590  -7.183  11.270  1.00  0.00
ATOM   1776 1HG2 VAL   120       9.517  -7.193  11.465  1.00  0.00
ATOM   1777 2HG2 VAL   120      10.762  -7.122  10.196  1.00  0.00
ATOM   1778 3HG2 VAL   120      11.037  -8.099  11.658  1.00  0.00
ATOM   1779  C   VAL   120      11.632  -4.825  14.129  1.00  0.00
ATOM   1780  O   VAL   120      12.847  -4.779  14.316  1.00  0.00
ATOM   1781  N   GLU   121      10.807  -3.841  14.474  1.00  0.00
ATOM   1782  H   GLU   121       9.820  -3.913  14.273  1.00  0.00
ATOM   1783  CA  GLU   121      11.297  -2.621  15.106  1.00  0.00
ATOM   1784  HA  GLU   121      12.097  -2.189  14.506  1.00  0.00
ATOM   1785  CB  GLU   121      10.169  -1.595  15.228  1.00  0.00
ATOM   1786 2HB  GLU   121       9.302  -2.001  14.706  1.00  0.00
ATOM   1787 3HB  GLU   121       9.937  -1.490  16.288  1.00  0.00
ATOM   1788  CG  GLU   121      10.518  -0.235  14.649  1.00  0.00
ATOM   1789 2HG  GLU   121      11.400   0.134  15.172  1.00  0.00
ATOM   1790 3HG  GLU   121      10.751  -0.370  13.593  1.00  0.00
ATOM   1791  CD  GLU   121       9.389   0.768  14.793  1.00  0.00
ATOM   1792  OE1 GLU   121       9.018   1.393  13.778  1.00  0.00
ATOM   1793  OE2 GLU   121       8.878   0.928  15.921  1.00  0.00
ATOM   1794  C   GLU   121      11.880  -2.919  16.484  1.00  0.00
ATOM   1795  O   GLU   121      12.860  -2.302  16.900  1.00  0.00
ATOM   1796  N   GLU   122      11.269  -3.868  17.186  1.00  0.00
ATOM   1797  H   GLU   122      10.448  -4.325  16.814  1.00  0.00
ATOM   1798  CA  GLU   122      11.727  -4.247  18.518  1.00  0.00
ATOM   1799  HA  GLU   122      11.580  -3.418  19.210  1.00  0.00
ATOM   1800  CB  GLU   122      10.939  -5.455  19.028  1.00  0.00
ATOM   1801 2HB  GLU   122      10.617  -6.025  18.157  1.00  0.00
ATOM   1802 3HB  GLU   122      11.621  -6.060  19.626  1.00  0.00
ATOM   1803  CG  GLU   122       9.727  -5.083  19.865  1.00  0.00
ATOM   1804 2HG  GLU   122       9.558  -4.012  19.752  1.00  0.00
ATOM   1805 3HG  GLU   122       8.868  -5.629  19.473  1.00  0.00
ATOM   1806  CD  GLU   122       9.908  -5.414  21.334  1.00  0.00
ATOM   1807  OE1 GLU   122       9.744  -6.597  21.699  1.00  0.00
ATOM   1808  OE2 GLU   122      10.213  -4.491  22.117  1.00  0.00
ATOM   1809  C   GLU   122      13.219  -4.565  18.511  1.00  0.00
ATOM   1810  O   GLU   122      13.976  -4.063  19.342  1.00  0.00
ATOM   1811  N   ALA   123      13.635  -5.402  17.566  1.00  0.00
ATOM   1812  H   ALA   123      12.969  -5.821  16.933  1.00  0.00
ATOM   1813  CA  ALA   123      15.036  -5.786  17.449  1.00  0.00
ATOM   1814  HA  ALA   123      15.412  -6.057  18.436  1.00  0.00
ATOM   1815  CB  ALA   123      15.178  -6.989  16.528  1.00  0.00
ATOM   1816 1HB  ALA   123      14.813  -6.731  15.534  1.00  0.00
ATOM   1817 2HB  ALA   123      16.227  -7.278  16.466  1.00  0.00
ATOM   1818 3HB  ALA   123      14.595  -7.821  16.924  1.00  0.00
ATOM   1819  C   ALA   123      15.883  -4.625  16.939  1.00  0.00
ATOM   1820  O   ALA   123      16.798  -4.166  17.623  1.00  0.00
ATOM   1821  N   GLN   124      15.572  -4.155  15.735  1.00  0.00
ATOM   1822  H   GLN   124      14.831  -4.585  15.199  1.00  0.00
ATOM   1823  CA  GLN   124      16.307  -3.048  15.135  1.00  0.00
ATOM   1824  HA  GLN   124      17.339  -3.345  14.950  1.00  0.00
ATOM   1825  CB  GLN   124      15.668  -2.646  13.805  1.00  0.00
ATOM   1826 2HB  GLN   124      14.662  -2.287  14.022  1.00  0.00
ATOM   1827 3HB  GLN   124      16.262  -1.832  13.391  1.00  0.00
ATOM   1828  CG  GLN   124      15.593  -3.782  12.798  1.00  0.00
ATOM   1829 2HG  GLN   124      14.768  -4.440  13.074  1.00  0.00
ATOM   1830 3HG  GLN   124      15.407  -3.362  11.810  1.00  0.00
ATOM   1831  CD  GLN   124      16.868  -4.600  12.745  1.00  0.00
ATOM   1832  OE1 GLN   124      17.946  -4.074  12.466  1.00  0.00
ATOM   1833  NE2 GLN   124      16.752  -5.895  13.013  1.00  0.00
ATOM   1834 1HE2 GLN   124      17.570  -6.488  12.992  1.00  0.00
ATOM   1835 2HE2 GLN   124      15.846  -6.282  13.237  1.00  0.00
ATOM   1836  C   GLN   124      16.348  -1.848  16.076  1.00  0.00
ATOM   1837  O   GLN   124      17.246  -1.016  15.951  1.00  0.00
ATOM   1838  OXT GLN   124      15.491  -1.709  16.947  1.00  0.00
TER
END
#
#   2 SER  HN      2 SER  QB      4.16             (#peak  2177)
 &rst
  ixpk= 2177, nxpk= 0, iat=  11,  -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,

      rk2=50.0, rk3=50.0, ir6=1, ialtd=0,
 igr2=  15,  16,
 &end
#
#   2 SER  QB      3 PHE  HN      5.72             (#peak  1172)
 &rst
  ixpk= 1172, nxpk= 0, iat=  -1,  22, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
 igr1=  15,  16,
 &end
#
#   3 PHE  HN      4 THR  HN      3.42             (#peak  1177)
 &rst
  ixpk= 1177, nxpk= 0, iat=  22,  42, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,  &end
#
#   3 PHE  HA      3 PHE  HB2     2.99             (#peak  2763)
 &rst
  ixpk= 2763, nxpk= 0, iat=  24,  26, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#   3 PHE  HA      3 PHE  HB3     2.92             (#peak   578)
 &rst
  ixpk= 578, nxpk= 0, iat=  24,  27, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,  &end
#
#   3 PHE  HA      3 PHE  QD      3.39             (#peak  2146)
 &rst
  ixpk= 2146, nxpk= 0, iat=  24,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2=  30,  38,
 &end
#
#   3 PHE  HA      3 PHE  QE      4.42             (#peak  2149)
 &rst
  ixpk= 2149, nxpk= 0, iat=  24,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2=  32,  36,
 &end
#
#   3 PHE  HA      5 MET  HN      5.97             (#peak  2155)
 &rst
  ixpk= 2155, nxpk= 0, iat=  24,  56, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
#   3 PHE  HA      6 SER  HN      4.89             (#peak  2148)
 &rst
  ixpk= 2148, nxpk= 0, iat=  24,  73, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#   3 PHE  HB2     4 THR  HN      4.41             (#peak  2767)
 &rst
  ixpk= 2767, nxpk= 0, iat=  26,  42, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#   3 PHE  HB3     4 THR  HN      4.64             (#peak   582)
 &rst
  ixpk= 582, nxpk= 0, iat=  27,  42, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#   3 PHE  QD      4 THR  HN      6.15             (#peak  1600)
 &rst
  ixpk= 1600, nxpk= 0, iat=  -1,  42, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=  30,  38,
 &end
#
#   4 THR  HN      4 THR  HB      4.05             (#peak  2831)
 &rst
  ixpk= 2831, nxpk= 0, iat=  42,  46, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#   4 THR  HN      4 THR  QG2     4.38             (#peak  3295)
 &rst
  ixpk= 3295, nxpk= 0, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2=  48,  49,  50,
 &end
#
#   4 THR  HN      5 MET  HN      5.08             (#peak  1609)
 &rst
  ixpk= 1609, nxpk= 0, iat=  42,  56, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#   4 THR  HA      4 THR  QG2     2.64             (#peak  1142)
 &rst
  ixpk= 1142, nxpk= 0, iat=  44,  -1, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,
 igr2=  48,  49,  50,
 &end
#
#   4 THR  HB      5 MET  HN      4.44             (#peak  2832)
 &rst
  ixpk= 2832, nxpk= 0, iat=  46,  56, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
#   4 THR  QG2     5 MET  HN      4.41             (#peak  3296)
 &rst
  ixpk= 3296, nxpk= 0, iat=  -1,  56, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  48,  49,  50,
 &end
#
#   4 THR  QG2     6 SER  HN      5.02             (#peak  3291)
 &rst
  ixpk= 3291, nxpk= 0, iat=  -1,  73, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1=  48,  49,  50,
 &end
#
#   5 MET  HN      5 MET  QG      4.05             (#peak  1255)
 &rst
  ixpk= 1255, nxpk= 0, iat=  56,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2=  63,  64,
 &end
#
#   5 MET  HN      6 SER  HN      3.67             (#peak   370)
 &rst
  ixpk= 370, nxpk= 0, iat=  56,  73, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#   5 MET  HA      5 MET  QB      2.77             (#peak  2936)
 &rst
  ixpk= 2936, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
 igr2=  60,  61,
 &end
#
#   5 MET  HA      5 MET  QG      3.61             (#peak  2938)
 &rst
  ixpk= 2938, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=  63,  64,
 &end
#
#   5 MET  HA      8 ALA  HN      4.61             (#peak  2939)
 &rst
  ixpk= 2939, nxpk= 0, iat=  58,  99, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,  &end
#
#   5 MET  HA      8 ALA  QB      4.34             (#peak  2941)
 &rst
  ixpk= 2941, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr2= 103, 104, 105,
 &end
#
#   5 MET  QB      5 MET  QG      2.40             (#peak  1251)
 &rst
  ixpk= 1251, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1=  60,  61,
 igr2=  63,  64,
 &end
#
#   5 MET  QB      6 SER  HN      4.11             (#peak   626)
 &rst
  ixpk= 626, nxpk= 0, iat=  -1,  73, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1=  60,  61,
 &end
#
#   5 MET  QB      8 ALA  HN      5.24             (#peak   628)
 &rst
  ixpk= 628, nxpk= 0, iat=  -1,  99, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=  60,  61,
 &end
#
#   5 MET  QG      6 SER  HN      5.30             (#peak  1252)
 &rst
  ixpk= 1252, nxpk= 0, iat=  -1,  73, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
 igr1=  63,  64,
 &end
#
#   6 SER  HN      6 SER  HB2     4.00             (#peak  1683)
 &rst
  ixpk= 1683, nxpk= 0, iat=  73,  77, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  &end
#
#   6 SER  HN      9 LEU  HN      5.96             (#peak   365)
 &rst
  ixpk= 365, nxpk= 0, iat=  73, 109, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,  &end
#
#   6 SER  HA      6 SER  HB3     2.96             (#peak  3433)
 &rst
  ixpk= 3433, nxpk= 0, iat=  75,  78, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,  &end
#
#   6 SER  HA      8 ALA  HN      4.65             (#peak  2258)
 &rst
  ixpk= 2258, nxpk= 0, iat=  75,  99, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#   6 SER  HA      9 LEU  HN      4.27             (#peak  2260)
 &rst
  ixpk= 2260, nxpk= 0, iat=  75, 109, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#   6 SER  HA      9 LEU  HB2     3.91             (#peak  2287)
 &rst
  ixpk= 2287, nxpk= 0, iat=  75, 113, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#   6 SER  HA      9 LEU  HB3     4.35             (#peak  2902)
 &rst
  ixpk= 2902, nxpk= 0, iat=  75, 114, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#   6 SER  HA      9 LEU  QD1     4.83             (#peak  4348)
 &rst
  ixpk= 4348, nxpk= 0, iat=  75,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr2= 118, 119, 120,
 &end
#
#   6 SER  HA      9 LEU  QD2     4.84             (#peak  4349)
 &rst
  ixpk= 4349, nxpk= 0, iat=  75,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr2= 122, 123, 124,
 &end
#
#   8 ALA  HN     10 ALA  HN      6.02             (#peak  1147)
 &rst
  ixpk= 1147, nxpk= 0, iat=  99, 128, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,  &end
#
#   8 ALA  HN     11 LYS  HN      6.15             (#peak  1297)
 &rst
  ixpk= 1297, nxpk= 0, iat=  99, 138, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#   8 ALA  HN      8 ALA  QB      2.88             (#peak  3034)
 &rst
  ixpk= 3034, nxpk= 0, iat=  99,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr2= 103, 104, 105,
 &end
#
#   8 ALA  HN      9 LEU  HN      5.97             (#peak   599)
 &rst
  ixpk= 599, nxpk= 0, iat=  99, 109, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
#   8 ALA  HA     11 LYS  HN      4.13             (#peak   796)
 &rst
  ixpk= 796, nxpk= 0, iat= 101, 138, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#   8 ALA  HA     11 LYS  QB      4.11             (#peak  3693)
 &rst
  ixpk= 3693, nxpk= 0, iat= 101,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2= 142, 143,
 &end
#
#   8 ALA  QB     73 LEU  QD1     5.44             (#peak  3913)
 &rst
  ixpk= 3913, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
 igr1= 103, 104, 105,
 igr2=1094,1095,1096,
 &end
#
#   8 ALA  QB     73 LEU  QD2     4.69             (#peak  3914)
 &rst
  ixpk= 3914, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
 igr1= 103, 104, 105,
 igr2=1098,1099,1100,
 &end
#
#   8 ALA  QB      9 LEU  HN      3.88             (#peak  3035)
 &rst
  ixpk= 3035, nxpk= 0, iat=  -1, 109, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 103, 104, 105,
 &end
#
#   9 LEU  HN     10 ALA  HN      5.17             (#peak   893)
 &rst
  ixpk= 893, nxpk= 0, iat= 109, 128, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
#   9 LEU  HN     12 LEU  HN      6.15             (#peak   911)
 &rst
  ixpk= 911, nxpk= 0, iat= 109, 160, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#   9 LEU  HN      9 LEU  HG      5.74             (#peak   886)
 &rst
  ixpk= 886, nxpk= 0, iat= 109, 116, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#   9 LEU  HN      9 LEU  QD1     4.95             (#peak   700)
 &rst
  ixpk= 700, nxpk= 0, iat= 109,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr2= 118, 119, 120,
 &end
#
#   9 LEU  HN      9 LEU  QD2     4.64             (#peak  2337)
 &rst
  ixpk= 2337, nxpk= 0, iat= 109,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 122, 123, 124,
 &end
#
#   9 LEU  HA    117 VAL  QG1     5.47             (#peak  4276)
 &rst
  ixpk= 4276, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr2=1715,1716,1717,
 &end
#
#   9 LEU  HA    117 VAL  QG2     6.08             (#peak  4277)
 &rst
  ixpk= 4277, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr2=1719,1720,1721,
 &end
#
#   9 LEU  HA     12 LEU  HB2     4.54             (#peak  1911)
 &rst
  ixpk= 1911, nxpk= 0, iat= 111, 164, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#   9 LEU  HA     12 LEU  HG      4.81             (#peak  1908)
 &rst
  ixpk= 1908, nxpk= 0, iat= 111, 167, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#   9 LEU  HA     12 LEU  QD2     3.45             (#peak  4376)
 &rst
  ixpk= 4376, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 173, 174, 175,
 &end
#
#   9 LEU  HA      9 LEU  HG      3.76             (#peak  1698)
 &rst
  ixpk= 1698, nxpk= 0, iat= 111, 116, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#   9 LEU  HA      9 LEU  QD1     3.42             (#peak   699)
 &rst
  ixpk= 699, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 118, 119, 120,
 &end
#
#   9 LEU  HA      9 LEU  QD2     4.57             (#peak  2336)
 &rst
  ixpk= 2336, nxpk= 0, iat= 111,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2= 122, 123, 124,
 &end
#
#   9 LEU  HB2    10 ALA  HN      4.28             (#peak  2290)
 &rst
  ixpk= 2290, nxpk= 0, iat= 113, 128, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#   9 LEU  HB2   117 VAL  HB      6.15             (#peak  3845)
 &rst
  ixpk= 3845, nxpk= 0, iat= 113,1713, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#   9 LEU  HB2     9 LEU  QD1     2.40             (#peak  2283)
 &rst
  ixpk= 2283, nxpk= 0, iat= 113,  -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
 igr2= 118, 119, 120,
 &end
#
#   9 LEU  HB2     9 LEU  QD2     3.72             (#peak  2338)
 &rst
  ixpk= 2338, nxpk= 0, iat= 113,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2= 122, 123, 124,
 &end
#
#   9 LEU  HB3    10 ALA  HN      3.80             (#peak  2905)
 &rst
  ixpk= 2905, nxpk= 0, iat= 114, 128, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#   9 LEU  HB3   117 VAL  HB      6.01             (#peak  3846)
 &rst
  ixpk= 3846, nxpk= 0, iat= 114,1713, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,  &end
#
#   9 LEU  HB3     9 LEU  QD1     3.16             (#peak  2898)
 &rst
  ixpk= 2898, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2= 118, 119, 120,
 &end
#
#   9 LEU  HB3     9 LEU  QD2     2.67             (#peak  2904)
 &rst
  ixpk= 2904, nxpk= 0, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
 igr2= 122, 123, 124,
 &end
#
#   9 LEU  HG     10 ALA  HN      5.92             (#peak  1148)
 &rst
  ixpk= 1148, nxpk= 0, iat= 116, 128, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,  &end
#
#   9 LEU  QD1    10 ALA  HN      5.33             (#peak  1146)
 &rst
  ixpk= 1146, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr1= 118, 119, 120,
 &end
#
#   9 LEU  QD1   117 VAL  HB      5.47             (#peak  3849)
 &rst
  ixpk= 3849, nxpk= 0, iat=  -1,1713, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1= 118, 119, 120,
 &end
#
#   9 LEU  QD1   117 VAL  QG1     3.80             (#peak  3896)
 &rst
  ixpk= 3896, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1= 118, 119, 120,
 igr2=1715,1716,1717,
 &end
#
#   9 LEU  QD1   117 VAL  QG2     4.92             (#peak  3898)
 &rst
  ixpk= 3898, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
 igr1= 118, 119, 120,
 igr2=1719,1720,1721,
 &end
#
#   9 LEU  QD1   120 VAL  QQG     4.48             (#peak  4145)
 &rst
  ixpk= 4145, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
 igr1= 118, 119, 120,
 igr2=1772,1773,1774,1776,1777,1778,
 &end
#
#   9 LEU  QD1   121 GLU  HN      6.15             (#peak  1829)
 &rst
  ixpk= 1829, nxpk= 0, iat=  -1,1782, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 118, 119, 120,
 &end
#
#   9 LEU  QD1   121 GLU  HB2     4.18             (#peak  4314)
 &rst
  ixpk= 4314, nxpk= 0, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr1= 118, 119, 120,
 &end
#
#   9 LEU  QD1   121 GLU  HB3     5.65             (#peak  4313)
 &rst
  ixpk= 4313, nxpk= 0, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 118, 119, 120,
 &end
#
#   9 LEU  QD1   121 GLU  QG      4.54             (#peak  4147)
 &rst
  ixpk= 4147, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 118, 119, 120,
 igr2=1789,1790,
 &end
#
#   9 LEU  QD2    10 ALA  HN      4.75             (#peak  2340)
 &rst
  ixpk= 2340, nxpk= 0, iat=  -1, 128, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1= 122, 123, 124,
 &end
#
#   9 LEU  QD2   117 VAL  HB      4.93             (#peak  3848)
 &rst
  ixpk= 3848, nxpk= 0, iat=  -1,1713, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr1= 122, 123, 124,
 &end
#
#   9 LEU  QD2   117 VAL  QG1     4.42             (#peak  3897)
 &rst
  ixpk= 3897, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
 igr1= 122, 123, 124,
 igr2=1715,1716,1717,
 &end
#
#   9 LEU  QD2   117 VAL  QG2     5.30             (#peak  3899)
 &rst
  ixpk= 3899, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 122, 123, 124,
 igr2=1719,1720,1721,
 &end
#
#   9 LEU  QD2   121 GLU  HN      6.15             (#peak  1830)
 &rst
  ixpk= 1830, nxpk= 0, iat=  -1,1782, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 122, 123, 124,
 &end
#
#   9 LEU  QD2   121 GLU  HB2     4.23             (#peak  4315)
 &rst
  ixpk= 4315, nxpk= 0, iat=  -1,1786, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 122, 123, 124,
 &end
#
#   9 LEU  QD2   121 GLU  HB3     5.26             (#peak  4312)
 &rst
  ixpk= 4312, nxpk= 0, iat=  -1,1787, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1= 122, 123, 124,
 &end
#
#   9 LEU  QD2   121 GLU  QG      4.64             (#peak  4148)
 &rst
  ixpk= 4148, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
 igr1= 122, 123, 124,
 igr2=1789,1790,
 &end
#
#  10 ALA  HN     10 ALA  QB      3.11             (#peak   654)
 &rst
  ixpk= 654, nxpk= 0, iat= 128,  -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
 igr2= 132, 133, 134,
 &end
#
#  10 ALA  HN     11 LYS  HN      3.76             (#peak  1305)
 &rst
  ixpk= 1305, nxpk= 0, iat= 128, 138, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,  &end
#
#  10 ALA  HN     12 LEU  HN      6.15             (#peak   913)
 &rst
  ixpk= 913, nxpk= 0, iat= 128, 160, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  10 ALA  HA    117 VAL  HB      6.11             (#peak  4333)
 &rst
  ixpk= 4333, nxpk= 0, iat= 130,1713, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,  &end
#
#  10 ALA  HA    117 VAL  QG1     4.85             (#peak  4334)
 &rst
  ixpk= 4334, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2=1715,1716,1717,
 &end
#
#  10 ALA  HA    117 VAL  QG2     5.88             (#peak  4335)
 &rst
  ixpk= 4335, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
 igr2=1719,1720,1721,
 &end
#
#  10 ALA  HA     13 ILE  HN      4.68             (#peak  2488)
 &rst
  ixpk= 2488, nxpk= 0, iat= 130, 179, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#  10 ALA  HA     13 ILE  HB      4.22             (#peak   834)
 &rst
  ixpk= 834, nxpk= 0, iat= 130, 183, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#  10 ALA  HA     13 ILE  QD1     5.88             (#peak  3912)
 &rst
  ixpk= 3912, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
 igr2= 192, 193, 194,
 &end
#
#  10 ALA  HA     13 ILE  QG2     5.49             (#peak  3911)
 &rst
  ixpk= 3911, nxpk= 0, iat= 130,  -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr2= 185, 186, 187,
 &end
#
#  10 ALA  QB     11 LYS  HN      3.89             (#peak   655)
 &rst
  ixpk= 655, nxpk= 0, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
 igr1= 132, 133, 134,
 &end
#
#  11 LYS  HN     11 LYS  HG2     4.95             (#peak  1586)
 &rst
  ixpk= 1586, nxpk= 0, iat= 138, 145, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  11 LYS  HN     11 LYS  HG3     4.81             (#peak  3322)
 &rst
  ixpk= 3322, nxpk= 0, iat= 138, 146, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  11 LYS  HN     11 LYS  QB      2.93             (#peak  3700)
 &rst
  ixpk= 3700, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
 igr2= 142, 143,
 &end
#
#  11 LYS  HN     11 LYS  QD      4.65             (#peak  1151)
 &rst
  ixpk= 1151, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 148, 149,
 &end
#
#  11 LYS  HN     12 LEU  HN      4.22             (#peak   915)
 &rst
  ixpk= 915, nxpk= 0, iat= 138, 160, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#  11 LYS  HN     13 ILE  HN      6.15             (#peak  1300)
 &rst
  ixpk= 1300, nxpk= 0, iat= 138, 179, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  11 LYS  HN     73 LEU  QD2     6.15             (#peak  1298)
 &rst
  ixpk= 1298, nxpk= 0, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1098,1099,1100,
 &end
#
#  11 LYS  HA     11 LYS  HG2     4.20             (#peak  1585)
 &rst
  ixpk= 1585, nxpk= 0, iat= 140, 145, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  11 LYS  HA     11 LYS  HG3     3.67             (#peak  2993)
 &rst
  ixpk= 2993, nxpk= 0, iat= 140, 146, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
#  11 LYS  HA     11 LYS  QD      4.19             (#peak  2986)
 &rst
  ixpk= 2986, nxpk= 0, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2= 148, 149,
 &end
#
#  11 LYS  HA     11 LYS  QE      4.47             (#peak  2990)
 &rst
  ixpk= 2990, nxpk= 0, iat= 140,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 151, 152,
 &end
#
#  11 LYS  HA     14 SER  HB2     3.66             (#peak  2988)
 &rst
  ixpk= 2988, nxpk= 0, iat= 140, 202, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#  11 LYS  HG2    11 LYS  QD      3.01             (#peak  1147)
 &rst
  ixpk= 1147, nxpk= 0, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr2= 148, 149,
 &end
#
#  11 LYS  HG2    11 LYS  QE      2.95             (#peak  2851)
 &rst
  ixpk= 2851, nxpk= 0, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2= 151, 152,
 &end
#
#  11 LYS  HG2    12 LEU  HN      6.00             (#peak  1583)
 &rst
  ixpk= 1583, nxpk= 0, iat= 145, 160, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  11 LYS  HG2    73 LEU  QD2     4.22             (#peak  1581)
 &rst
  ixpk= 1581, nxpk= 0, iat= 145,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2=1098,1099,1100,
 &end
#
#  11 LYS  HG3    11 LYS  QE      4.14             (#peak  3320)
 &rst
  ixpk= 3320, nxpk= 0, iat= 146,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2= 151, 152,
 &end
#
#  11 LYS  HG3    14 SER  HN      6.15             (#peak    39)
 &rst
  ixpk= 39, nxpk= 0, iat= 146, 198, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  11 LYS  HG3    15 LEU  HN      6.15             (#peak  1870)
 &rst
  ixpk= 1870, nxpk= 0, iat= 146, 209, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  11 LYS  QB     11 LYS  HG2     2.76             (#peak  3696)
 &rst
  ixpk= 3696, nxpk= 0, iat=  -1, 145, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,
 igr1= 142, 143,
 &end
#
#  11 LYS  QB     11 LYS  QD      2.40             (#peak  3694)
 &rst
  ixpk= 3694, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1= 142, 143,
 igr2= 148, 149,
 &end
#
#  11 LYS  QB     11 LYS  QE      3.63             (#peak  3698)
 &rst
  ixpk= 3698, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
 igr1= 142, 143,
 igr2= 151, 152,
 &end
#
#  11 LYS  QB     12 LEU  HN      4.04             (#peak  3697)
 &rst
  ixpk= 3697, nxpk= 0, iat=  -1, 160, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 142, 143,
 &end
#
#  11 LYS  QB     73 LEU  QD2     4.66             (#peak  1398)
 &rst
  ixpk= 1398, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 142, 143,
 igr2=1098,1099,1100,
 &end
#
#  11 LYS  QD     11 LYS  QE      2.52             (#peak  1149)
 &rst
  ixpk= 1149, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
 igr1= 148, 149,
 igr2= 151, 152,
 &end
#
#  11 LYS  QD     12 LEU  HN      5.64             (#peak  1148)
 &rst
  ixpk= 1148, nxpk= 0, iat=  -1, 160, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr1= 148, 149,
 &end
#
#  11 LYS  QD     73 LEU  QD2     4.12             (#peak  1146)
 &rst
  ixpk= 1146, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 148, 149,
 igr2=1098,1099,1100,
 &end
#
#  12 LEU  HN     12 LEU  HA      2.88             (#peak  1375)
 &rst
  ixpk= 1375, nxpk= 0, iat= 160, 162, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
#  12 LEU  HN     12 LEU  HB2     4.18             (#peak  1806)
 &rst
  ixpk= 1806, nxpk= 0, iat= 160, 164, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  12 LEU  HN     12 LEU  HB3     4.05             (#peak  3514)
 &rst
  ixpk= 3514, nxpk= 0, iat= 160, 165, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  12 LEU  HN     12 LEU  HG      4.39             (#peak   516)
 &rst
  ixpk= 516, nxpk= 0, iat= 160, 167, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
#  12 LEU  HN     12 LEU  QD1     4.49             (#peak  2127)
 &rst
  ixpk= 2127, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr2= 169, 170, 171,
 &end
#
#  12 LEU  HN     12 LEU  QD2     3.46             (#peak     6)
 &rst
  ixpk= 6, nxpk= 0, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2= 173, 174, 175,
 &end
#
#  12 LEU  HN     13 ILE  HN      3.50             (#peak   701)
 &rst
  ixpk= 701, nxpk= 0, iat= 160, 179, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  12 LEU  HA     12 LEU  HG      4.17             (#peak  1367)
 &rst
  ixpk= 1367, nxpk= 0, iat= 162, 167, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  12 LEU  HA     12 LEU  QD1     3.94             (#peak  2124)
 &rst
  ixpk= 2124, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 169, 170, 171,
 &end
#
#  12 LEU  HA     12 LEU  QD2     2.70             (#peak     3)
 &rst
  ixpk= 3, nxpk= 0, iat= 162,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr2= 173, 174, 175,
 &end
#
#  12 LEU  HA     15 LEU  HB2     5.47             (#peak  1368)
 &rst
  ixpk= 1368, nxpk= 0, iat= 162, 213, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,  &end
#
#  12 LEU  HA     15 LEU  HB3     5.28             (#peak  1773)
 &rst
  ixpk= 1773, nxpk= 0, iat= 162, 214, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
#  12 LEU  HB2   117 VAL  QG1     4.86             (#peak  4157)
 &rst
  ixpk= 4157, nxpk= 0, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=1715,1716,1717,
 &end
#
#  12 LEU  HB2   117 VAL  QG2     4.66             (#peak  4163)
 &rst
  ixpk= 4163, nxpk= 0, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2=1719,1720,1721,
 &end
#
#  12 LEU  HB2    12 LEU  HG      2.82             (#peak   513)
 &rst
  ixpk= 513, nxpk= 0, iat= 164, 167, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32,  &end
#
#  12 LEU  HB2    12 LEU  QD1     3.26             (#peak  1805)
 &rst
  ixpk= 1805, nxpk= 0, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2= 169, 170, 171,
 &end
#
#  12 LEU  HB2    12 LEU  QD2     2.73             (#peak  1798)
 &rst
  ixpk= 1798, nxpk= 0, iat= 164,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2= 173, 174, 175,
 &end
#
#  12 LEU  HB2    13 ILE  HN      4.37             (#peak  1802)
 &rst
  ixpk= 1802, nxpk= 0, iat= 164, 179, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  12 LEU  HB3   117 VAL  QG1     4.64             (#peak  4160)
 &rst
  ixpk= 4160, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2=1715,1716,1717,
 &end
#
#  12 LEU  HB3   117 VAL  QG2     4.80             (#peak  4161)
 &rst
  ixpk= 4161, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2=1719,1720,1721,
 &end
#
#  12 LEU  HB3    12 LEU  QD1     2.55             (#peak  3513)
 &rst
  ixpk= 3513, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,
 igr2= 169, 170, 171,
 &end
#
#  12 LEU  HB3    12 LEU  QD2     3.35             (#peak  3508)
 &rst
  ixpk= 3508, nxpk= 0, iat= 165,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 173, 174, 175,
 &end
#
#  12 LEU  HB3    13 ILE  HN      3.88             (#peak  3511)
 &rst
  ixpk= 3511, nxpk= 0, iat= 165, 179, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#  12 LEU  HG    117 VAL  QG1     5.23             (#peak  4158)
 &rst
  ixpk= 4158, nxpk= 0, iat= 167,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr2=1715,1716,1717,
 &end
#
#  12 LEU  HG    117 VAL  QG2     5.19             (#peak  4162)
 &rst
  ixpk= 4162, nxpk= 0, iat= 167,  -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr2=1719,1720,1721,
 &end
#
#  12 LEU  HG     13 ILE  HN      5.81             (#peak   695)
 &rst
  ixpk= 695, nxpk= 0, iat= 167, 179, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,  &end
#
#  12 LEU  QD1   113 LEU  HN      6.08             (#peak  2128)
 &rst
  ixpk= 2128, nxpk= 0, iat=  -1,1643, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
 igr1= 169, 170, 171,
 &end
#
#  12 LEU  QD1   113 LEU  QD1     4.01             (#peak  4139)
 &rst
  ixpk= 4139, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1= 169, 170, 171,
 igr2=1652,1653,1654,
 &end
#
#  12 LEU  QD1   113 LEU  QD2     4.62             (#peak  4140)
 &rst
  ixpk= 4140, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
 igr1= 169, 170, 171,
 igr2=1656,1657,1658,
 &end
#
#  12 LEU  QD1   116 ILE  QD1     4.63             (#peak  4178)
 &rst
  ixpk= 4178, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
 igr1= 169, 170, 171,
 igr2=1703,1704,1705,
 &end
#
#  12 LEU  QD1   117 VAL  HN      6.15             (#peak  1856)
 &rst
  ixpk= 1856, nxpk= 0, iat=  -1,1709, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 169, 170, 171,
 &end
#
#  12 LEU  QD1    73 LEU  QD1     4.82             (#peak  4110)
 &rst
  ixpk= 4110, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
 igr1= 169, 170, 171,
 igr2=1094,1095,1096,
 &end
#
#  12 LEU  QD1    73 LEU  QD2     4.82             (#peak  4107)
 &rst
  ixpk= 4107, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
 igr1= 169, 170, 171,
 igr2=1098,1099,1100,
 &end
#
#  12 LEU  QD2   113 LEU  QD1     5.51             (#peak  4141)
 &rst
  ixpk= 4141, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
 igr1= 173, 174, 175,
 igr2=1652,1653,1654,
 &end
#
#  12 LEU  QD2   113 LEU  QD2     5.78             (#peak  4142)
 &rst
  ixpk= 4142, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.34, r4= 8.84,
 igr1= 173, 174, 175,
 igr2=1656,1657,1658,
 &end
#
#  12 LEU  QD2   116 ILE  QD1     5.72             (#peak  4177)
 &rst
  ixpk= 4177, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.25, r4= 8.75,
 igr1= 173, 174, 175,
 igr2=1703,1704,1705,
 &end
#
#  12 LEU  QD2   117 VAL  HN      6.15             (#peak  1857)
 &rst
  ixpk= 1857, nxpk= 0, iat=  -1,1709, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 173, 174, 175,
 &end
#
#  12 LEU  QD2    73 LEU  QD1     4.67             (#peak  4109)
 &rst
  ixpk= 4109, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 173, 174, 175,
 igr2=1094,1095,1096,
 &end
#
#  12 LEU  QD2    73 LEU  QD2     4.11             (#peak  4143)
 &rst
  ixpk= 4143, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 173, 174, 175,
 igr2=1098,1099,1100,
 &end
#
#  13 ILE  HN    117 VAL  QG1     6.15             (#peak  1813)
 &rst
  ixpk= 1813, nxpk= 0, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1715,1716,1717,
 &end
#
#  13 ILE  HN    117 VAL  QG2     6.15             (#peak  1814)
 &rst
  ixpk= 1814, nxpk= 0, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1719,1720,1721,
 &end
#
#  13 ILE  HN     13 ILE  HB      3.11             (#peak   833)
 &rst
  ixpk= 833, nxpk= 0, iat= 179, 183, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#  13 ILE  HN     13 ILE  HG12    4.71             (#peak   344)
 &rst
  ixpk= 344, nxpk= 0, iat= 179, 189, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  13 ILE  HN     13 ILE  HG13    4.93             (#peak  1346)
 &rst
  ixpk= 1346, nxpk= 0, iat= 179, 190, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#  13 ILE  HN     13 ILE  QD1     4.50             (#peak  3715)
 &rst
  ixpk= 3715, nxpk= 0, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 192, 193, 194,
 &end
#
#  13 ILE  HN     13 ILE  QG2     3.90             (#peak  2513)
 &rst
  ixpk= 2513, nxpk= 0, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 185, 186, 187,
 &end
#
#  13 ILE  HN     14 SER  HN      5.63             (#peak    35)
 &rst
  ixpk= 35, nxpk= 0, iat= 179, 198, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#  13 ILE  HN     15 LEU  HN      5.29             (#peak   694)
 &rst
  ixpk= 694, nxpk= 0, iat= 179, 209, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
#  13 ILE  HA     13 ILE  HG12    3.04             (#peak    80)
 &rst
  ixpk= 80, nxpk= 0, iat= 181, 189, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,  &end
#
#  13 ILE  HA     13 ILE  HG13    4.04             (#peak    83)
 &rst
  ixpk= 83, nxpk= 0, iat= 181, 190, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#  13 ILE  HA     13 ILE  QD1     3.50             (#peak  3709)
 &rst
  ixpk= 3709, nxpk= 0, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 192, 193, 194,
 &end
#
#  13 ILE  HA     13 ILE  QG2     3.67             (#peak  2508)
 &rst
  ixpk= 2508, nxpk= 0, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 185, 186, 187,
 &end
#
#  13 ILE  HA     15 LEU  HN      6.15             (#peak  1752)
 &rst
  ixpk= 1752, nxpk= 0, iat= 181, 209, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  13 ILE  HA     16 GLN  HN      4.89             (#peak    82)
 &rst
  ixpk= 82, nxpk= 0, iat= 181, 228, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#  13 ILE  HA     16 GLN  HG3     4.45             (#peak  1647)
 &rst
  ixpk= 1647, nxpk= 0, iat= 181, 236, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
#  13 ILE  HB    117 VAL  QG1     5.97             (#peak  3741)
 &rst
  ixpk= 3741, nxpk= 0, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
 igr2=1715,1716,1717,
 &end
#
#  13 ILE  HB    117 VAL  QG2     6.06             (#peak  2541)
 &rst
  ixpk= 2541, nxpk= 0, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr2=1719,1720,1721,
 &end
#
#  13 ILE  HB     13 ILE  HG12    2.90             (#peak   830)
 &rst
  ixpk= 830, nxpk= 0, iat= 183, 189, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,  &end
#
#  13 ILE  HB     13 ILE  QD1     3.45             (#peak  3712)
 &rst
  ixpk= 3712, nxpk= 0, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
 igr2= 192, 193, 194,
 &end
#
#  13 ILE  HB     14 SER  HN      4.63             (#peak   829)
 &rst
  ixpk= 829, nxpk= 0, iat= 183, 198, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  13 ILE  HG12  117 VAL  QG2     4.31             (#peak  2538)
 &rst
  ixpk= 2538, nxpk= 0, iat= 189,  -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
 igr2=1719,1720,1721,
 &end
#
#  13 ILE  HG12   14 SER  HN      5.33             (#peak   340)
 &rst
  ixpk= 340, nxpk= 0, iat= 189, 198, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#  13 ILE  HG13   14 SER  HN      5.55             (#peak  1342)
 &rst
  ixpk= 1342, nxpk= 0, iat= 190, 198, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
#  13 ILE  QD1   114 SER  HA      4.24             (#peak  4270)
 &rst
  ixpk= 4270, nxpk= 0, iat=  -1,1664, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 192, 193, 194,
 &end
#
#  13 ILE  QD1    14 SER  HN      5.93             (#peak    40)
 &rst
  ixpk= 40, nxpk= 0, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
 igr1= 192, 193, 194,
 &end
#
#  13 ILE  QD1    16 GLN  HB2     5.13             (#peak  2806)
 &rst
  ixpk= 2806, nxpk= 0, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr1= 192, 193, 194,
 &end
#
#  13 ILE  QD1    16 GLN  HG3     4.72             (#peak  1658)
 &rst
  ixpk= 1658, nxpk= 0, iat=  -1, 236, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 192, 193, 194,
 &end
#
#  13 ILE  QG2    13 ILE  HG12    3.55             (#peak  2510)
 &rst
  ixpk= 2510, nxpk= 0, iat=  -1, 189, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr1= 185, 186, 187,
 &end
#
#  13 ILE  QG2    13 ILE  HG13    3.80             (#peak  2512)
 &rst
  ixpk= 2512, nxpk= 0, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 185, 186, 187,
 &end
#
#  13 ILE  QG2    13 ILE  QD1     2.40             (#peak  3716)
 &rst
  ixpk= 3716, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1= 185, 186, 187,
 igr2= 192, 193, 194,
 &end
#
#  13 ILE  QG2    14 SER  HN      3.87             (#peak  2509)
 &rst
  ixpk= 2509, nxpk= 0, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 185, 186, 187,
 &end
#
#  13 ILE  QG2    14 SER  HA      3.63             (#peak  2514)
 &rst
  ixpk= 2514, nxpk= 0, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 185, 186, 187,
 &end
#
#  13 ILE  QG2    16 GLN  HE21    6.15             (#peak  1876)
 &rst
  ixpk= 1876, nxpk= 0, iat=  -1, 240, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 185, 186, 187,
 &end
#
#  13 ILE  QG2    16 GLN  HE22    6.15             (#peak  1877)
 &rst
  ixpk= 1877, nxpk= 0, iat=  -1, 241, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 185, 186, 187,
 &end
#
#  14 SER  HN     14 SER  HB2     3.89             (#peak  1985)
 &rst
  ixpk= 1985, nxpk= 0, iat= 198, 202, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  14 SER  HN     14 SER  HB3     3.60             (#peak   204)
 &rst
  ixpk= 204, nxpk= 0, iat= 198, 203, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  14 SER  HN     15 LEU  HN      4.38             (#peak   240)
 &rst
  ixpk= 240, nxpk= 0, iat= 198, 209, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,  &end
#
#  14 SER  HA     16 GLN  HN      5.69             (#peak  2221)
 &rst
  ixpk= 2221, nxpk= 0, iat= 200, 228, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,  &end
#
#  14 SER  HB2    15 LEU  HN      3.70             (#peak  1986)
 &rst
  ixpk= 1986, nxpk= 0, iat= 202, 209, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  14 SER  HB3    15 LEU  HN      4.54             (#peak   205)
 &rst
  ixpk= 205, nxpk= 0, iat= 203, 209, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  15 LEU  HN     15 LEU  HB2     3.85             (#peak  1038)
 &rst
  ixpk= 1038, nxpk= 0, iat= 209, 213, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#  15 LEU  HN     15 LEU  HG      4.49             (#peak  2676)
 &rst
  ixpk= 2676, nxpk= 0, iat= 209, 216, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  15 LEU  HN     15 LEU  QD1     5.07             (#peak  3179)
 &rst
  ixpk= 3179, nxpk= 0, iat= 209,  -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr2= 218, 219, 220,
 &end
#
#  15 LEU  HN     15 LEU  QD2     5.20             (#peak  1004)
 &rst
  ixpk= 1004, nxpk= 0, iat= 209,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2= 222, 223, 224,
 &end
#
#  15 LEU  HA     15 LEU  HG      3.82             (#peak  3553)
 &rst
  ixpk= 3553, nxpk= 0, iat= 211, 216, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#  15 LEU  HA     15 LEU  QD1     4.04             (#peak  3554)
 &rst
  ixpk= 3554, nxpk= 0, iat= 211,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 218, 219, 220,
 &end
#
#  15 LEU  HA     15 LEU  QD2     3.79             (#peak  1011)
 &rst
  ixpk= 1011, nxpk= 0, iat= 211,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2= 222, 223, 224,
 &end
#
#  15 LEU  HB2    15 LEU  QD1     3.13             (#peak  1045)
 &rst
  ixpk= 1045, nxpk= 0, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 218, 219, 220,
 &end
#
#  15 LEU  HB2    15 LEU  QD2     3.44             (#peak  1006)
 &rst
  ixpk= 1006, nxpk= 0, iat= 213,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 222, 223, 224,
 &end
#
#  15 LEU  HB2    16 GLN  HN      4.58             (#peak  1041)
 &rst
  ixpk= 1041, nxpk= 0, iat= 213, 228, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,  &end
#
#  15 LEU  HB3    15 LEU  QD1     3.38             (#peak  1776)
 &rst
  ixpk= 1776, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 218, 219, 220,
 &end
#
#  15 LEU  HB3    15 LEU  QD2     2.40             (#peak  1008)
 &rst
  ixpk= 1008, nxpk= 0, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
 igr2= 222, 223, 224,
 &end
#
#  15 LEU  HB3    16 GLN  HN      4.86             (#peak  1772)
 &rst
  ixpk= 1772, nxpk= 0, iat= 214, 228, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#  15 LEU  HG     16 GLN  HN      5.63             (#peak  2679)
 &rst
  ixpk= 2679, nxpk= 0, iat= 216, 228, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#  15 LEU  QD1   113 LEU  QD1     4.89             (#peak  4173)
 &rst
  ixpk= 4173, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
 igr1= 218, 219, 220,
 igr2=1652,1653,1654,
 &end
#
#  15 LEU  QD1   113 LEU  QD2     5.15             (#peak  4174)
 &rst
  ixpk= 4174, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
 igr1= 218, 219, 220,
 igr2=1656,1657,1658,
 &end
#
#  15 LEU  QD1    16 GLN  HN      5.76             (#peak  3182)
 &rst
  ixpk= 3182, nxpk= 0, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
 igr1= 218, 219, 220,
 &end
#
#  15 LEU  QD1    73 LEU  QD1     4.64             (#peak  4136)
 &rst
  ixpk= 4136, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr1= 218, 219, 220,
 igr2=1094,1095,1096,
 &end
#
#  15 LEU  QD1    73 LEU  QD2     4.67             (#peak  4135)
 &rst
  ixpk= 4135, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1= 218, 219, 220,
 igr2=1098,1099,1100,
 &end
#
#  15 LEU  QD2   113 LEU  QD1     4.89             (#peak  4176)
 &rst
  ixpk= 4176, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
 igr1= 222, 223, 224,
 igr2=1652,1653,1654,
 &end
#
#  15 LEU  QD2   113 LEU  QD2     4.69             (#peak  4175)
 &rst
  ixpk= 4175, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
 igr1= 222, 223, 224,
 igr2=1656,1657,1658,
 &end
#
#  15 LEU  QD2    16 GLN  HN      5.24             (#peak  1007)
 &rst
  ixpk= 1007, nxpk= 0, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr1= 222, 223, 224,
 &end
#
#  15 LEU  QD2    73 LEU  QD1     4.77             (#peak  4138)
 &rst
  ixpk= 4138, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
 igr1= 222, 223, 224,
 igr2=1094,1095,1096,
 &end
#
#  15 LEU  QD2    73 LEU  QD2     4.90             (#peak  4137)
 &rst
  ixpk= 4137, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 222, 223, 224,
 igr2=1098,1099,1100,
 &end
#
#  16 GLN  HN     16 GLN  HB3     3.96             (#peak   612)
 &rst
  ixpk= 612, nxpk= 0, iat= 228, 233, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,  &end
#
#  16 GLN  HN     16 GLN  HE21    6.15             (#peak   552)
 &rst
  ixpk= 552, nxpk= 0, iat= 228, 240, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  16 GLN  HN     16 GLN  HE22    6.15             (#peak   550)
 &rst
  ixpk= 550, nxpk= 0, iat= 228, 241, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  16 GLN  HN     16 GLN  HG2     4.47             (#peak   106)
 &rst
  ixpk= 106, nxpk= 0, iat= 228, 235, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#  16 GLN  HN     16 GLN  HG3     4.76             (#peak  1650)
 &rst
  ixpk= 1650, nxpk= 0, iat= 228, 236, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  16 GLN  HN     17 ALA  HN      6.15             (#peak  1524)
 &rst
  ixpk= 1524, nxpk= 0, iat= 228, 245, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  16 GLN  HA     16 GLN  HE21    5.69             (#peak  3632)
 &rst
  ixpk= 3632, nxpk= 0, iat= 230, 240, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,  &end
#
#  16 GLN  HA     16 GLN  HE22    6.15             (#peak  1209)
 &rst
  ixpk= 1209, nxpk= 0, iat= 230, 241, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  16 GLN  HA     16 GLN  HG2     4.02             (#peak   112)
 &rst
  ixpk= 112, nxpk= 0, iat= 230, 235, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  16 GLN  HA     16 GLN  HG3     3.62             (#peak  3629)
 &rst
  ixpk= 3629, nxpk= 0, iat= 230, 236, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#  16 GLN  HA     17 ALA  QB      3.93             (#peak  4388)
 &rst
  ixpk= 4388, nxpk= 0, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 249, 250, 251,
 &end
#
#  16 GLN  HB2    16 GLN  HE21    4.27             (#peak  2803)
 &rst
  ixpk= 2803, nxpk= 0, iat= 232, 240, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  16 GLN  HB2    16 GLN  HE22    4.89             (#peak  2802)
 &rst
  ixpk= 2802, nxpk= 0, iat= 232, 241, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#  16 GLN  HB2    17 ALA  HN      5.02             (#peak  2804)
 &rst
  ixpk= 2804, nxpk= 0, iat= 232, 245, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  16 GLN  HB3    16 GLN  HE21    4.32             (#peak   616)
 &rst
  ixpk= 616, nxpk= 0, iat= 233, 240, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,  &end
#
#  16 GLN  HB3    16 GLN  HE22    5.54             (#peak   615)
 &rst
  ixpk= 615, nxpk= 0, iat= 233, 241, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,  &end
#
#  16 GLN  HB3    17 ALA  HN      4.37             (#peak   617)
 &rst
  ixpk= 617, nxpk= 0, iat= 233, 245, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  16 GLN  HE21  113 LEU  QD1     6.15             (#peak  1873)
 &rst
  ixpk= 1873, nxpk= 0, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1652,1653,1654,
 &end
#
#  16 GLN  HE21  113 LEU  QD2     6.15             (#peak  1874)
 &rst
  ixpk= 1874, nxpk= 0, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1656,1657,1658,
 &end
#
#  16 GLN  HE21  114 SER  QB      6.15             (#peak  1883)
 &rst
  ixpk= 1883, nxpk= 0, iat= 240,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1666,1667,
 &end
#
#  16 GLN  HE22  113 LEU  QD1     6.15             (#peak  1718)
 &rst
  ixpk= 1718, nxpk= 0, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1652,1653,1654,
 &end
#
#  16 GLN  HE22  113 LEU  QD2     6.15             (#peak  1872)
 &rst
  ixpk= 1872, nxpk= 0, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1656,1657,1658,
 &end
#
#  16 GLN  HE22  114 SER  QB      6.15             (#peak  1882)
 &rst
  ixpk= 1882, nxpk= 0, iat= 241,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1666,1667,
 &end
#
#  16 GLN  HG2    17 ALA  HN      4.94             (#peak   111)
 &rst
  ixpk= 111, nxpk= 0, iat= 235, 245, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
#  16 GLN  HG3   113 LEU  QD1     4.45             (#peak  1651)
 &rst
  ixpk= 1651, nxpk= 0, iat= 236,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2=1652,1653,1654,
 &end
#
#  16 GLN  HG3   113 LEU  QD2     4.80             (#peak  4100)
 &rst
  ixpk= 4100, nxpk= 0, iat= 236,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2=1656,1657,1658,
 &end
#
#  16 GLN  HG3    17 ALA  HN      5.58             (#peak  1656)
 &rst
  ixpk= 1656, nxpk= 0, iat= 236, 245, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,  &end
#
#  17 ALA  HN    113 LEU  QD2     6.15             (#peak  1529)
 &rst
  ixpk= 1529, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1656,1657,1658,
 &end
#
#  17 ALA  HN     17 ALA  QB      3.13             (#peak  3402)
 &rst
  ixpk= 3402, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 249, 250, 251,
 &end
#
#  17 ALA  HN     18 THR  HN      5.46             (#peak  1523)
 &rst
  ixpk= 1523, nxpk= 0, iat= 245, 255, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  17 ALA  HN     57 PRO  HA      6.15             (#peak  1768)
 &rst
  ixpk= 1768, nxpk= 0, iat= 245, 866, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  17 ALA  HN     58 VAL  QG1     6.15             (#peak  1526)
 &rst
  ixpk= 1526, nxpk= 0, iat= 245,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 876, 877, 878,
 &end
#
#  17 ALA  HA     19 GLU  HN      4.94             (#peak  1480)
 &rst
  ixpk= 1480, nxpk= 0, iat= 247, 269, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
#  17 ALA  QB     18 THR  HN      2.96             (#peak  3397)
 &rst
  ixpk= 3397, nxpk= 0, iat=  -1, 255, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr1= 249, 250, 251,
 &end
#
#  17 ALA  QB     19 GLU  HN      4.09             (#peak  3398)
 &rst
  ixpk= 3398, nxpk= 0, iat=  -1, 269, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr1= 249, 250, 251,
 &end
#
#  17 ALA  QB     57 PRO  HA      4.22             (#peak  4102)
 &rst
  ixpk= 4102, nxpk= 0, iat=  -1, 866, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 249, 250, 251,
 &end
#
#  17 ALA  QB     57 PRO  HB2     3.92             (#peak  3396)
 &rst
  ixpk= 3396, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1= 249, 250, 251,
 &end
#
#  17 ALA  QB     57 PRO  HB3     3.73             (#peak  4303)
 &rst
  ixpk= 4303, nxpk= 0, iat=  -1, 864, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr1= 249, 250, 251,
 &end
#
#  18 THR  HN     18 THR  QG2     4.37             (#peak   813)
 &rst
  ixpk= 813, nxpk= 0, iat= 255,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 261, 262, 263,
 &end
#
#  18 THR  HN     19 GLU  HN      5.88             (#peak   427)
 &rst
  ixpk= 427, nxpk= 0, iat= 255, 269, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,  &end
#
#  18 THR  HN     39 VAL  HN      6.15             (#peak   270)
 &rst
  ixpk= 270, nxpk= 0, iat= 255, 568, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  18 THR  HA     18 THR  QG2     2.63             (#peak  3681)
 &rst
  ixpk= 3681, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,
 igr2= 261, 262, 263,
 &end
#
#  18 THR  HA     39 VAL  QG1     3.62             (#peak  3679)
 &rst
  ixpk= 3679, nxpk= 0, iat= 257,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2= 574, 575, 576,
 &end
#
#  18 THR  HA     40 GLU  HN      6.15             (#peak  1742)
 &rst
  ixpk= 1742, nxpk= 0, iat= 257, 584, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  18 THR  HB     19 GLU  HN      3.82             (#peak  1215)
 &rst
  ixpk= 1215, nxpk= 0, iat= 259, 269, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
#  18 THR  HB     19 GLU  HB3     4.05             (#peak   904)
 &rst
  ixpk= 904, nxpk= 0, iat= 259, 274, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
#  18 THR  HB     19 GLU  QG      5.26             (#peak  4179)
 &rst
  ixpk= 4179, nxpk= 0, iat= 259,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2= 276, 277,
 &end
#
#  18 THR  QG2    19 GLU  HN      4.23             (#peak   815)
 &rst
  ixpk= 815, nxpk= 0, iat=  -1, 269, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 261, 262, 263,
 &end
#
#  19 GLU  HN     19 GLU  HB2     4.07             (#peak   350)
 &rst
  ixpk= 350, nxpk= 0, iat= 269, 273, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  19 GLU  HN     19 GLU  QG      3.42             (#peak  1939)
 &rst
  ixpk= 1939, nxpk= 0, iat= 269,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 276, 277,
 &end
#
#  19 GLU  HN     20 ALA  HN      6.15             (#peak   951)
 &rst
  ixpk= 951, nxpk= 0, iat= 269, 284, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  19 GLU  HN     39 VAL  QG1     5.00             (#peak   732)
 &rst
  ixpk= 732, nxpk= 0, iat= 269,  -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
 igr2= 574, 575, 576,
 &end
#
#  19 GLU  HA     19 GLU  HB2     2.72             (#peak   354)
 &rst
  ixpk= 354, nxpk= 0, iat= 271, 273, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22,  &end
#
#  19 GLU  HA     19 GLU  QG      3.52             (#peak  3534)
 &rst
  ixpk= 3534, nxpk= 0, iat= 271,  -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr2= 276, 277,
 &end
#
#  19 GLU  HA     20 ALA  HN      2.91             (#peak  3535)
 &rst
  ixpk= 3535, nxpk= 0, iat= 271, 284, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,  &end
#
#  19 GLU  HA     20 ALA  QB      3.86             (#peak  3647)
 &rst
  ixpk= 3647, nxpk= 0, iat= 271,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2= 288, 289, 290,
 &end
#
#  19 GLU  HA     38 ASP  HA      3.05             (#peak  3533)
 &rst
  ixpk= 3533, nxpk= 0, iat= 271, 558, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,  &end
#
#  19 GLU  HA     39 VAL  HN      3.60             (#peak  3538)
 &rst
  ixpk= 3538, nxpk= 0, iat= 271, 568, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  19 GLU  HA     39 VAL  HA      4.83             (#peak  4300)
 &rst
  ixpk= 4300, nxpk= 0, iat= 271, 570, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  19 GLU  HA     39 VAL  HB      4.28             (#peak  2920)
 &rst
  ixpk= 2920, nxpk= 0, iat= 271, 572, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#  19 GLU  HB2    19 GLU  QG      2.40             (#peak  1937)
 &rst
  ixpk= 1937, nxpk= 0, iat= 273,  -1, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr2= 276, 277,
 &end
#
#  19 GLU  HB2    20 ALA  HN      3.31             (#peak   353)
 &rst
  ixpk= 353, nxpk= 0, iat= 273, 284, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
#  19 GLU  HB2    38 ASP  HA      4.01             (#peak   351)
 &rst
  ixpk= 351, nxpk= 0, iat= 273, 558, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  19 GLU  HB3    20 ALA  HN      4.10             (#peak   907)
 &rst
  ixpk= 907, nxpk= 0, iat= 274, 284, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#  19 GLU  HB3    38 ASP  HA      4.02             (#peak  1838)
 &rst
  ixpk= 1838, nxpk= 0, iat= 274, 558, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  19 GLU  HB3    39 VAL  HN      4.72             (#peak   909)
 &rst
  ixpk= 909, nxpk= 0, iat= 274, 568, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#  19 GLU  QG     20 ALA  HN      3.98             (#peak  1941)
 &rst
  ixpk= 1941, nxpk= 0, iat=  -1, 284, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1= 276, 277,
 &end
#
#  20 ALA  HN     20 ALA  QB      3.80             (#peak  3645)
 &rst
  ixpk= 3645, nxpk= 0, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 288, 289, 290,
 &end
#
#  20 ALA  HN     21 THR  HN      5.65             (#peak  1659)
 &rst
  ixpk= 1659, nxpk= 0, iat= 284, 294, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,  &end
#
#  20 ALA  HN     37 VAL  HN      4.66             (#peak   171)
 &rst
  ixpk= 171, nxpk= 0, iat= 284, 540, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#  20 ALA  HN     37 VAL  HB      6.15             (#peak  1717)
 &rst
  ixpk= 1717, nxpk= 0, iat= 284, 544, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 20 ALA   HN     37 VAL  O       2.4
 &rst
  ixpk= 1717, nxpk= 0, iat= 284, 554, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#  20 ALA  HN     37 VAL  QG2     4.32             (#peak    14)
 &rst
  ixpk= 14, nxpk= 0, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2= 550, 551, 552,
 &end
#
#  20 ALA  HN     38 ASP  HA      4.37             (#peak   952)
 &rst
  ixpk= 952, nxpk= 0, iat= 284, 558, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  20 ALA  HN     39 VAL  HA      5.45             (#peak  4295)
 &rst
  ixpk= 4295, nxpk= 0, iat= 284, 570, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#  20 ALA  HN     39 VAL  HB      6.04             (#peak  4299)
 &rst
  ixpk= 4299, nxpk= 0, iat= 284, 572, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,  &end
#
#  20 ALA  HA     21 THR  HN      3.15             (#peak  2675)
 &rst
  ixpk= 2675, nxpk= 0, iat= 286, 294, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#  20 ALA  HA     57 PRO  HG2     5.96             (#peak  3447)
 &rst
  ixpk= 3447, nxpk= 0, iat= 286, 860, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,  &end
#
#  20 ALA  HA     57 PRO  HG3     5.67             (#peak  2669)
 &rst
  ixpk= 2669, nxpk= 0, iat= 286, 861, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,  &end
#
# 20 ALA   N      37 VAL  O       3.3
 &rst
  ixpk= 2669, nxpk= 0, iat= 283, 554, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#  20 ALA  QB     21 THR  HN      3.80             (#peak  3650)
 &rst
  ixpk= 3650, nxpk= 0, iat=  -1, 294, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 288, 289, 290,
 &end
#
#  20 ALA  QB     22 ILE  QD1     4.64             (#peak  4097)
 &rst
  ixpk= 4097, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr1= 288, 289, 290,
 igr2= 321, 322, 323,
 &end
#
#  20 ALA  QB     37 VAL  HN      4.72             (#peak  3644)
 &rst
  ixpk= 3644, nxpk= 0, iat=  -1, 540, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 288, 289, 290,
 &end
#
#  20 ALA  QB     37 VAL  QG1     5.83             (#peak  3947)
 &rst
  ixpk= 3947, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 288, 289, 290,
 igr2= 546, 547, 548,
 &end
#
#  20 ALA  QB     37 VAL  QG2     4.09             (#peak  3944)
 &rst
  ixpk= 3944, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1= 288, 289, 290,
 igr2= 550, 551, 552,
 &end
#
#  20 ALA  QB     39 VAL  HA      3.85             (#peak  3648)
 &rst
  ixpk= 3648, nxpk= 0, iat=  -1, 570, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 288, 289, 290,
 &end
#
#  20 ALA  QB     57 PRO  HB2     3.93             (#peak  4181)
 &rst
  ixpk= 4181, nxpk= 0, iat=  -1, 863, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 288, 289, 290,
 &end
#
#  20 ALA  QB     57 PRO  HB3     4.11             (#peak  4184)
 &rst
  ixpk= 4184, nxpk= 0, iat=  -1, 864, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 288, 289, 290,
 &end
#
#  21 THR  HN     21 THR  HB      3.52             (#peak  1459)
 &rst
  ixpk= 1459, nxpk= 0, iat= 294, 298, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  21 THR  HN     21 THR  QG2     4.23             (#peak  1037)
 &rst
  ixpk= 1037, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 300, 301, 302,
 &end
#
#  21 THR  HN     22 ILE  HN      5.14             (#peak   212)
 &rst
  ixpk= 212, nxpk= 0, iat= 294, 308, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  21 THR  HN     48 ILE  QD1     6.15             (#peak  1656)
 &rst
  ixpk= 1656, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 726, 727, 728,
 &end
#
#  21 THR  HN     48 ILE  QG2     6.15             (#peak  1661)
 &rst
  ixpk= 1661, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 719, 720, 721,
 &end
#
#  21 THR  HA     21 THR  QG2     2.94             (#peak  1035)
 &rst
  ixpk= 1035, nxpk= 0, iat= 296,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 300, 301, 302,
 &end
#
#  21 THR  HA     22 ILE  HN      3.33             (#peak  3226)
 &rst
  ixpk= 3226, nxpk= 0, iat= 296, 308, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,  &end
#
#  21 THR  HA     36 GLN  HA      3.84             (#peak  1796)
 &rst
  ixpk= 1796, nxpk= 0, iat= 296, 525, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  21 THR  HA     37 VAL  HN      3.98             (#peak  3225)
 &rst
  ixpk= 3225, nxpk= 0, iat= 296, 540, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  21 THR  HB     22 ILE  HN      4.98             (#peak  1454)
 &rst
  ixpk= 1454, nxpk= 0, iat= 298, 308, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  21 THR  HB     49 LYS  HN      6.15             (#peak  1457)
 &rst
  ixpk= 1457, nxpk= 0, iat= 298, 732, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  21 THR  QG2    22 ILE  HN      4.47             (#peak  1029)
 &rst
  ixpk= 1029, nxpk= 0, iat=  -1, 308, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 300, 301, 302,
 &end
#
#  21 THR  QG2    34 GLU  QG      4.28             (#peak  1033)
 &rst
  ixpk= 1033, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 300, 301, 302,
 igr2= 500, 501,
 &end
#
#  21 THR  QG2    35 GLU  HN      5.10             (#peak  1036)
 &rst
  ixpk= 1036, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1= 300, 301, 302,
 &end
#
#  21 THR  QG2    36 GLN  HA      3.70             (#peak  1788)
 &rst
  ixpk= 1788, nxpk= 0, iat=  -1, 525, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 300, 301, 302,
 &end
#
#  21 THR  QG2    37 VAL  HN      6.15             (#peak   167)
 &rst
  ixpk= 167, nxpk= 0, iat=  -1, 540, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 300, 301, 302,
 &end
#
#  21 THR  QG2    49 LYS  HN      6.15             (#peak  1058)
 &rst
  ixpk= 1058, nxpk= 0, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 300, 301, 302,
 &end
#
#  22 ILE  HN     22 ILE  HB      3.24             (#peak   114)
 &rst
  ixpk= 114, nxpk= 0, iat= 308, 312, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#  22 ILE  HN     22 ILE  HG12    4.76             (#peak   879)
 &rst
  ixpk= 879, nxpk= 0, iat= 308, 318, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  22 ILE  HN     22 ILE  HG13    3.85             (#peak  1667)
 &rst
  ixpk= 1667, nxpk= 0, iat= 308, 319, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#  22 ILE  HN     22 ILE  QD1     4.47             (#peak  1225)
 &rst
  ixpk= 1225, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr2= 321, 322, 323,
 &end
#
#  22 ILE  HN     22 ILE  QG2     4.14             (#peak  3415)
 &rst
  ixpk= 3415, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 314, 315, 316,
 &end
#
#  22 ILE  HN     23 VAL  HN      5.76             (#peak   448)
 &rst
  ixpk= 448, nxpk= 0, iat= 308, 327, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,  &end
#
#  22 ILE  HN     35 GLU  HN      6.15             (#peak  1558)
 &rst
  ixpk= 1558, nxpk= 0, iat= 308, 508, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  22 ILE  HN     35 GLU  HB3     5.12             (#peak  2116)
 &rst
  ixpk= 2116, nxpk= 0, iat= 308, 513, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
# 22 ILE   HN     35 GLU  O       2.4
 &rst
  ixpk= 2116, nxpk= 0, iat= 308, 521, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#  22 ILE  HN     35 GLU  QG      4.68             (#peak  2379)
 &rst
  ixpk= 2379, nxpk= 0, iat= 308,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 515, 516,
 &end
#
#  22 ILE  HN     36 GLN  HA      5.02             (#peak   205)
 &rst
  ixpk= 205, nxpk= 0, iat= 308, 525, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  22 ILE  HA     22 ILE  HG12    3.31             (#peak  2397)
 &rst
  ixpk= 2397, nxpk= 0, iat= 310, 318, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
#  22 ILE  HA     22 ILE  HG13    3.54             (#peak  1672)
 &rst
  ixpk= 1672, nxpk= 0, iat= 310, 319, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,  &end
#
#  22 ILE  HA     22 ILE  QD1     4.15             (#peak  2399)
 &rst
  ixpk= 2399, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 321, 322, 323,
 &end
#
#  22 ILE  HA     22 ILE  QG2     2.80             (#peak  3420)
 &rst
  ixpk= 3420, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 314, 315, 316,
 &end
#
#  22 ILE  HA     23 VAL  HN      2.94             (#peak  2398)
 &rst
  ixpk= 2398, nxpk= 0, iat= 310, 327, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,  &end
#
#  22 ILE  HA     23 VAL  QG2     3.90             (#peak  2401)
 &rst
  ixpk= 2401, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 337, 338, 339,
 &end
#
#  22 ILE  HA     48 ILE  HA      4.57             (#peak   213)
 &rst
  ixpk= 213, nxpk= 0, iat= 310, 715, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  22 ILE  HA     48 ILE  QD1     3.09             (#peak  2396)
 &rst
  ixpk= 2396, nxpk= 0, iat= 310,  -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
 igr2= 726, 727, 728,
 &end
#
#  22 ILE  HB     22 ILE  QD1     2.85             (#peak  1224)
 &rst
  ixpk= 1224, nxpk= 0, iat= 312,  -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
 igr2= 321, 322, 323,
 &end
#
#  22 ILE  HB     23 VAL  HN      4.76             (#peak   116)
 &rst
  ixpk= 116, nxpk= 0, iat= 312, 327, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  22 ILE  HB     35 GLU  HB2     4.24             (#peak  3870)
 &rst
  ixpk= 3870, nxpk= 0, iat= 312, 512, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#  22 ILE  HB     35 GLU  HB3     4.82             (#peak  3873)
 &rst
  ixpk= 3873, nxpk= 0, iat= 312, 513, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  22 ILE  HB     35 GLU  QG      3.45             (#peak  3871)
 &rst
  ixpk= 3871, nxpk= 0, iat= 312,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 515, 516,
 &end
#
#  22 ILE  HB     42 VAL  HB      6.15             (#peak  3908)
 &rst
  ixpk= 3908, nxpk= 0, iat= 312, 622, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  22 ILE  HG12   23 VAL  HN      5.73             (#peak   881)
 &rst
  ixpk= 881, nxpk= 0, iat= 318, 327, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,  &end
#
#  22 ILE  HG12   35 GLU  QG      6.15             (#peak  3949)
 &rst
  ixpk= 3949, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2= 515, 516,
 &end
#
#  22 ILE  HG12   37 VAL  QG1     4.30             (#peak  4362)
 &rst
  ixpk= 4362, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
 igr2= 546, 547, 548,
 &end
#
#  22 ILE  HG12   37 VAL  QG2     3.44             (#peak  4361)
 &rst
  ixpk= 4361, nxpk= 0, iat= 318,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2= 550, 551, 552,
 &end
#
#  22 ILE  HG13   23 VAL  HN      6.01             (#peak  1669)
 &rst
  ixpk= 1669, nxpk= 0, iat= 319, 327, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,  &end
#
#  22 ILE  HG13   35 GLU  HB2     6.03             (#peak  3868)
 &rst
  ixpk= 3868, nxpk= 0, iat= 319, 512, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,  &end
#
#  22 ILE  HG13   35 GLU  HB3     5.90             (#peak  3872)
 &rst
  ixpk= 3872, nxpk= 0, iat= 319, 513, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,  &end
#
#  22 ILE  HG13   35 GLU  QG      5.84             (#peak  3952)
 &rst
  ixpk= 3952, nxpk= 0, iat= 319,  -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr2= 515, 516,
 &end
#
#  22 ILE  HG13   42 VAL  HB      4.72             (#peak  3907)
 &rst
  ixpk= 3907, nxpk= 0, iat= 319, 622, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
# 22 ILE   N      35 GLU  O       3.3
 &rst
  ixpk= 3907, nxpk= 0, iat= 307, 521, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#  22 ILE  QD1    35 GLU  HB2     3.87             (#peak  3961)
 &rst
  ixpk= 3961, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 321, 322, 323,
 &end
#
#  22 ILE  QD1    35 GLU  HB3     4.92             (#peak  3956)
 &rst
  ixpk= 3956, nxpk= 0, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr1= 321, 322, 323,
 &end
#
#  22 ILE  QD1    35 GLU  QG      4.78             (#peak  3950)
 &rst
  ixpk= 3950, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1= 321, 322, 323,
 igr2= 515, 516,
 &end
#
#  22 ILE  QD1    42 VAL  QG1     4.26             (#peak  4098)
 &rst
  ixpk= 4098, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 321, 322, 323,
 igr2= 624, 625, 626,
 &end
#
#  22 ILE  QD1    42 VAL  QG2     4.26             (#peak  4099)
 &rst
  ixpk= 4099, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1= 321, 322, 323,
 igr2= 628, 629, 630,
 &end
#
#  22 ILE  QD1    46 ASP  HA      6.15             (#peak  1226)
 &rst
  ixpk= 1226, nxpk= 0, iat=  -1, 684, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 321, 322, 323,
 &end
#
#  22 ILE  QG2    22 ILE  HG12    3.24             (#peak  3416)
 &rst
  ixpk= 3416, nxpk= 0, iat=  -1, 318, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr1= 314, 315, 316,
 &end
#
#  22 ILE  QG2    22 ILE  HG13    3.65             (#peak  1673)
 &rst
  ixpk= 1673, nxpk= 0, iat=  -1, 319, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr1= 314, 315, 316,
 &end
#
#  22 ILE  QG2    22 ILE  QD1     2.40             (#peak  3418)
 &rst
  ixpk= 3418, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1= 314, 315, 316,
 igr2= 321, 322, 323,
 &end
#
#  22 ILE  QG2    23 VAL  HN      3.37             (#peak   459)
 &rst
  ixpk= 459, nxpk= 0, iat=  -1, 327, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr1= 314, 315, 316,
 &end
#
#  22 ILE  QG2    35 GLU  HB2     4.24             (#peak  3960)
 &rst
  ixpk= 3960, nxpk= 0, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 314, 315, 316,
 &end
#
#  22 ILE  QG2    35 GLU  HB3     5.90             (#peak  3957)
 &rst
  ixpk= 3957, nxpk= 0, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
 igr1= 314, 315, 316,
 &end
#
#  22 ILE  QG2    35 GLU  QG      4.13             (#peak  3954)
 &rst
  ixpk= 3954, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr1= 314, 315, 316,
 igr2= 515, 516,
 &end
#
#  22 ILE  QG2    46 ASP  HN      6.15             (#peak   968)
 &rst
  ixpk= 968, nxpk= 0, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 314, 315, 316,
 &end
#
#  22 ILE  QG2    47 ILE  HN      5.19             (#peak  3422)
 &rst
  ixpk= 3422, nxpk= 0, iat=  -1, 694, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1= 314, 315, 316,
 &end
#
#  23 VAL  HN     23 VAL  HB      4.01             (#peak  2534)
 &rst
  ixpk= 2534, nxpk= 0, iat= 327, 331, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  23 VAL  HN     23 VAL  QG1     5.78             (#peak   447)
 &rst
  ixpk= 447, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
 igr2= 333, 334, 335,
 &end
#
#  23 VAL  HN     23 VAL  QG2     4.12             (#peak  1945)
 &rst
  ixpk= 1945, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr2= 337, 338, 339,
 &end
#
#  23 VAL  HN     24 THR  HN      6.15             (#peak   450)
 &rst
  ixpk= 450, nxpk= 0, iat= 327, 343, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  23 VAL  HN     47 ILE  HB      6.15             (#peak  1879)
 &rst
  ixpk= 1879, nxpk= 0, iat= 327, 698, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  23 VAL  HN     48 ILE  HA      4.81             (#peak  3873)
 &rst
  ixpk= 3873, nxpk= 0, iat= 327, 715, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  23 VAL  HN     48 ILE  QD1     3.93             (#peak   491)
 &rst
  ixpk= 491, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 726, 727, 728,
 &end
#
#  23 VAL  HN     48 ILE  QG2     5.51             (#peak  2687)
 &rst
  ixpk= 2687, nxpk= 0, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr2= 719, 720, 721,
 &end
#
#  23 VAL  HA     23 VAL  QG1     2.96             (#peak   359)
 &rst
  ixpk= 359, nxpk= 0, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2= 333, 334, 335,
 &end
#
#  23 VAL  HA     23 VAL  QG2     3.35             (#peak  1946)
 &rst
  ixpk= 1946, nxpk= 0, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr2= 337, 338, 339,
 &end
#
#  23 VAL  HA     24 THR  HN      3.02             (#peak  1823)
 &rst
  ixpk= 1823, nxpk= 0, iat= 329, 343, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,  &end
#
#  23 VAL  HA     34 GLU  HA      2.65             (#peak   260)
 &rst
  ixpk= 260, nxpk= 0, iat= 329, 495, r1= 1.30, r2= 1.80, r3= 2.65, r4= 3.15,  &end
#
#  23 VAL  HA     34 GLU  QB      4.58             (#peak  3883)
 &rst
  ixpk= 3883, nxpk= 0, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 497, 498,
 &end
#
#  23 VAL  HA     34 GLU  QG      4.47             (#peak  3882)
 &rst
  ixpk= 3882, nxpk= 0, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
 igr2= 500, 501,
 &end
#
#  23 VAL  HA     35 GLU  HN      4.19             (#peak  1828)
 &rst
  ixpk= 1828, nxpk= 0, iat= 329, 508, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#  23 VAL  HB     24 THR  HN      4.85             (#peak  2533)
 &rst
  ixpk= 2533, nxpk= 0, iat= 331, 343, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
#  23 VAL  HB     34 GLU  QB      5.44             (#peak  3876)
 &rst
  ixpk= 3876, nxpk= 0, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr2= 497, 498,
 &end
#
#  23 VAL  HB     34 GLU  QG      4.28             (#peak  3879)
 &rst
  ixpk= 3879, nxpk= 0, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 500, 501,
 &end
#
#  23 VAL  HB     47 ILE  QG2     4.79             (#peak  4363)
 &rst
  ixpk= 4363, nxpk= 0, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr2= 700, 701, 702,
 &end
#
#  23 VAL  QG1    24 THR  HN      4.44             (#peak   357)
 &rst
  ixpk= 357, nxpk= 0, iat=  -1, 343, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr1= 333, 334, 335,
 &end
#
#  23 VAL  QG1    34 GLU  HA      3.80             (#peak   355)
 &rst
  ixpk= 355, nxpk= 0, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1= 333, 334, 335,
 &end
#
#  23 VAL  QG1    34 GLU  QB      4.75             (#peak  3981)
 &rst
  ixpk= 3981, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr1= 333, 334, 335,
 igr2= 497, 498,
 &end
#
#  23 VAL  QG1    34 GLU  QG      4.43             (#peak  3980)
 &rst
  ixpk= 3980, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 333, 334, 335,
 igr2= 500, 501,
 &end
#
#  23 VAL  QG1    35 GLU  HN      5.54             (#peak  1557)
 &rst
  ixpk= 1557, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
 igr1= 333, 334, 335,
 &end
#
#  23 VAL  QG2    24 THR  HN      4.35             (#peak  1944)
 &rst
  ixpk= 1944, nxpk= 0, iat=  -1, 343, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 337, 338, 339,
 &end
#
#  23 VAL  QG2    34 GLU  QB      5.44             (#peak  3878)
 &rst
  ixpk= 3878, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
 igr1= 337, 338, 339,
 igr2= 497, 498,
 &end
#
#  23 VAL  QG2    34 GLU  QG      4.43             (#peak  3979)
 &rst
  ixpk= 3979, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 337, 338, 339,
 igr2= 500, 501,
 &end
#
#  23 VAL  QG2    48 ILE  HA      3.75             (#peak  3874)
 &rst
  ixpk= 3874, nxpk= 0, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr1= 337, 338, 339,
 &end
#
#  23 VAL  QG2    49 LYS  QB      5.06             (#peak  3876)
 &rst
  ixpk= 3876, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
 igr1= 337, 338, 339,
 igr2= 736, 737,
 &end
#
#  23 VAL  QG2    49 LYS  QD      4.65             (#peak  3875)
 &rst
  ixpk= 3875, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1= 337, 338, 339,
 igr2= 742, 743,
 &end
#
#  24 THR  HN     24 THR  QG2     4.22             (#peak  1871)
 &rst
  ixpk= 1871, nxpk= 0, iat= 343,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr2= 349, 350, 351,
 &end
#
#  24 THR  HN     25 LEU  HN      6.15             (#peak   274)
 &rst
  ixpk= 274, nxpk= 0, iat= 343, 357, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  24 THR  HN     33 SER  HN      6.15             (#peak  1383)
 &rst
  ixpk= 1383, nxpk= 0, iat= 343, 482, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  24 THR  HN     33 SER  HB3     6.15             (#peak  1715)
 &rst
  ixpk= 1715, nxpk= 0, iat= 343, 487, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 24 THR   HN     33 SER  O       2.4
 &rst
  ixpk= 1715, nxpk= 0, iat= 343, 491, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#  24 THR  HN     34 GLU  HA      3.84             (#peak   272)
 &rst
  ixpk= 272, nxpk= 0, iat= 343, 495, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
#  24 THR  HN     34 GLU  QB      5.80             (#peak  1717)
 &rst
  ixpk= 1717, nxpk= 0, iat= 343,  -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr2= 497, 498,
 &end
#
#  24 THR  HN     34 GLU  QG      5.90             (#peak  1716)
 &rst
  ixpk= 1716, nxpk= 0, iat= 343,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr2= 500, 501,
 &end
#
#  24 THR  HA     24 THR  QG2     2.40             (#peak  1873)
 &rst
  ixpk= 1873, nxpk= 0, iat= 345,  -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
 igr2= 349, 350, 351,
 &end
#
#  24 THR  HB     25 LEU  HN      4.42             (#peak   284)
 &rst
  ixpk= 284, nxpk= 0, iat= 347, 357, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  24 THR  HB     33 SER  HN      5.41             (#peak   287)
 &rst
  ixpk= 287, nxpk= 0, iat= 347, 482, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
# 24 THR   N      33 SER  O       3.3
 &rst
  ixpk= 287, nxpk= 0, iat= 342, 491, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#  24 THR  QG2    25 LEU  HN      3.88             (#peak  1870)
 &rst
  ixpk= 1870, nxpk= 0, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
 igr1= 349, 350, 351,
 &end
#
#  24 THR  QG2    26 ASP  HA      5.16             (#peak  4316)
 &rst
  ixpk= 4316, nxpk= 0, iat=  -1, 378, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1= 349, 350, 351,
 &end
#
#  24 THR  QG2    33 SER  HB2     6.15             (#peak  3963)
 &rst
  ixpk= 3963, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 349, 350, 351,
 &end
#
#  24 THR  QG2    33 SER  HB3     5.87             (#peak  3962)
 &rst
  ixpk= 3962, nxpk= 0, iat=  -1, 487, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
 igr1= 349, 350, 351,
 &end
#
#  25 LEU  HN     25 LEU  HB2     3.86             (#peak   964)
 &rst
  ixpk= 964, nxpk= 0, iat= 357, 361, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  25 LEU  HN     25 LEU  HG      4.53             (#peak   567)
 &rst
  ixpk= 567, nxpk= 0, iat= 357, 364, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  25 LEU  HN     25 LEU  QD1     4.23             (#peak  2202)
 &rst
  ixpk= 2202, nxpk= 0, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2= 366, 367, 368,
 &end
#
#  25 LEU  HN     25 LEU  QD2     4.04             (#peak    64)
 &rst
  ixpk= 64, nxpk= 0, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr2= 370, 371, 372,
 &end
#
#  25 LEU  HA     25 LEU  HG      3.89             (#peak  1060)
 &rst
  ixpk= 1060, nxpk= 0, iat= 359, 364, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  25 LEU  HA     25 LEU  QD1     4.09             (#peak  1064)
 &rst
  ixpk= 1064, nxpk= 0, iat= 359,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 366, 367, 368,
 &end
#
#  25 LEU  HA     25 LEU  QD2     3.71             (#peak    67)
 &rst
  ixpk= 67, nxpk= 0, iat= 359,  -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
 igr2= 370, 371, 372,
 &end
#
#  25 LEU  HA     32 LEU  HA      4.91             (#peak  4273)
 &rst
  ixpk= 4273, nxpk= 0, iat= 359, 465, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  25 LEU  HA     33 SER  HN      6.15             (#peak  1755)
 &rst
  ixpk= 1755, nxpk= 0, iat= 359, 482, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  25 LEU  HB2    25 LEU  QD1     3.63             (#peak   969)
 &rst
  ixpk= 969, nxpk= 0, iat= 361,  -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr2= 366, 367, 368,
 &end
#
#  25 LEU  HB2    25 LEU  QD2     3.68             (#peak   963)
 &rst
  ixpk= 963, nxpk= 0, iat= 361,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 370, 371, 372,
 &end
#
#  25 LEU  HB2    26 ASP  HN      4.72             (#peak   972)
 &rst
  ixpk= 972, nxpk= 0, iat= 361, 376, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#  25 LEU  HB2    28 ASP  HN      6.15             (#peak  1848)
 &rst
  ixpk= 1848, nxpk= 0, iat= 361, 399, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  25 LEU  HB2    29 ASN  HN      6.15             (#peak  1849)
 &rst
  ixpk= 1849, nxpk= 0, iat= 361, 411, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  25 LEU  HB2    29 ASN  HA      5.84             (#peak  4328)
 &rst
  ixpk= 4328, nxpk= 0, iat= 361, 413, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,  &end
#
#  25 LEU  HB2    29 ASN  HD22    6.15             (#peak  1852)
 &rst
  ixpk= 1852, nxpk= 0, iat= 361, 421, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  25 LEU  HB3    25 LEU  QD1     3.77             (#peak  2756)
 &rst
  ixpk= 2756, nxpk= 0, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2= 366, 367, 368,
 &end
#
#  25 LEU  HB3    25 LEU  QD2     3.81             (#peak  2750)
 &rst
  ixpk= 2750, nxpk= 0, iat= 362,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 370, 371, 372,
 &end
#
#  25 LEU  HB3    26 ASP  HN      4.88             (#peak  2759)
 &rst
  ixpk= 2759, nxpk= 0, iat= 362, 376, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
#  25 LEU  HB3    28 ASP  HN      6.15             (#peak  1847)
 &rst
  ixpk= 1847, nxpk= 0, iat= 362, 399, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  25 LEU  HB3    29 ASN  HN      6.15             (#peak  1850)
 &rst
  ixpk= 1850, nxpk= 0, iat= 362, 411, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  25 LEU  HB3    29 ASN  HA      5.31             (#peak  4326)
 &rst
  ixpk= 4326, nxpk= 0, iat= 362, 413, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#  25 LEU  HB3    29 ASN  HD22    6.15             (#peak  1851)
 &rst
  ixpk= 1851, nxpk= 0, iat= 362, 421, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  25 LEU  HG     26 ASP  HN      5.72             (#peak   574)
 &rst
  ixpk= 574, nxpk= 0, iat= 364, 376, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,  &end
#
#  25 LEU  HG     29 ASN  HA      4.92             (#peak  4327)
 &rst
  ixpk= 4327, nxpk= 0, iat= 364, 413, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  25 LEU  QD1    26 ASP  HN      5.90             (#peak  2210)
 &rst
  ixpk= 2210, nxpk= 0, iat=  -1, 376, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
 igr1= 366, 367, 368,
 &end
#
#  25 LEU  QD1    29 ASN  HA      4.86             (#peak  4325)
 &rst
  ixpk= 4325, nxpk= 0, iat=  -1, 413, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 366, 367, 368,
 &end
#
#  25 LEU  QD1    29 ASN  HD21    6.15             (#peak  1841)
 &rst
  ixpk= 1841, nxpk= 0, iat=  -1, 420, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 366, 367, 368,
 &end
#
#  25 LEU  QD1    29 ASN  HD22    6.15             (#peak  1868)
 &rst
  ixpk= 1868, nxpk= 0, iat=  -1, 421, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 366, 367, 368,
 &end
#
#  25 LEU  QD1    32 LEU  QD1     4.64             (#peak  3987)
 &rst
  ixpk= 3987, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr1= 366, 367, 368,
 igr2= 472, 473, 474,
 &end
#
#  25 LEU  QD1    32 LEU  QD2     5.47             (#peak  3988)
 &rst
  ixpk= 3988, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.89, r4= 8.39,
 igr1= 366, 367, 368,
 igr2= 476, 477, 478,
 &end
#
#  25 LEU  QD2    26 ASP  HN      5.77             (#peak    70)
 &rst
  ixpk= 70, nxpk= 0, iat=  -1, 376, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 370, 371, 372,
 &end
#
#  25 LEU  QD2    29 ASN  HA      4.79             (#peak  4324)
 &rst
  ixpk= 4324, nxpk= 0, iat=  -1, 413, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 370, 371, 372,
 &end
#
#  25 LEU  QD2    32 LEU  HN      5.41             (#peak  3884)
 &rst
  ixpk= 3884, nxpk= 0, iat=  -1, 463, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr1= 370, 371, 372,
 &end
#
#  25 LEU  QD2    32 LEU  QD1     4.93             (#peak  3989)
 &rst
  ixpk= 3989, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
 igr1= 370, 371, 372,
 igr2= 472, 473, 474,
 &end
#
#  25 LEU  QD2    32 LEU  QD2     4.93             (#peak  3990)
 &rst
  ixpk= 3990, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
 igr1= 370, 371, 372,
 igr2= 476, 477, 478,
 &end
#
#  25 LEU  QD2    33 SER  HN      6.15             (#peak  3886)
 &rst
  ixpk= 3886, nxpk= 0, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 370, 371, 372,
 &end
#
#  26 ASP  HN     27 SER  HN      6.15             (#peak  1696)
 &rst
  ixpk= 1696, nxpk= 0, iat= 376, 388, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  26 ASP  HN     29 ASN  HA      6.15             (#peak  1832)
 &rst
  ixpk= 1832, nxpk= 0, iat= 376, 413, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  26 ASP  HN     31 LEU  HN      6.15             (#peak  1747)
 &rst
  ixpk= 1747, nxpk= 0, iat= 376, 444, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  26 ASP  HB2    27 SER  HN      6.11             (#peak   660)
 &rst
  ixpk= 660, nxpk= 0, iat= 380, 388, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,  &end
#
#  26 ASP  HB2    31 LEU  HG      4.79             (#peak  4002)
 &rst
  ixpk= 4002, nxpk= 0, iat= 380, 451, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
#  26 ASP  HB2    31 LEU  QB      4.69             (#peak  3969)
 &rst
  ixpk= 3969, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 448, 449,
 &end
#
#  26 ASP  HB2    31 LEU  QD1     4.38             (#peak  3970)
 &rst
  ixpk= 3970, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2= 453, 454, 455,
 &end
#
#  26 ASP  HB2    31 LEU  QD2     4.26             (#peak  4000)
 &rst
  ixpk= 4000, nxpk= 0, iat= 380,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 457, 458, 459,
 &end
#
#  26 ASP  HB3    27 SER  HN      4.22             (#peak   434)
 &rst
  ixpk= 434, nxpk= 0, iat= 381, 388, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
#  26 ASP  HB3    31 LEU  HG      5.33             (#peak  3968)
 &rst
  ixpk= 3968, nxpk= 0, iat= 381, 451, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#  26 ASP  HB3    31 LEU  QD1     4.59             (#peak  4017)
 &rst
  ixpk= 4017, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr2= 453, 454, 455,
 &end
#
#  26 ASP  HB3    31 LEU  QD2     4.42             (#peak  3965)
 &rst
  ixpk= 3965, nxpk= 0, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2= 457, 458, 459,
 &end
#
#  27 SER  HN     27 SER  HB2     3.62             (#peak  1609)
 &rst
  ixpk= 1609, nxpk= 0, iat= 388, 392, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,  &end
#
#  27 SER  HN     28 ASP  HN      6.02             (#peak   653)
 &rst
  ixpk= 653, nxpk= 0, iat= 388, 399, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,  &end
#
#  27 SER  HN     30 ILE  QD1     6.15             (#peak   659)
 &rst
  ixpk= 659, nxpk= 0, iat= 388,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 438, 439, 440,
 &end
#
#  27 SER  HA     31 LEU  HN      6.15             (#peak  1771)
 &rst
  ixpk= 1771, nxpk= 0, iat= 390, 444, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  27 SER  HA     31 LEU  QD1     6.15             (#peak  4337)
 &rst
  ixpk= 4337, nxpk= 0, iat= 390,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 453, 454, 455,
 &end
#
#  27 SER  HA     31 LEU  QD2     5.23             (#peak  4336)
 &rst
  ixpk= 4336, nxpk= 0, iat= 390,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr2= 457, 458, 459,
 &end
#
#  27 SER  HB2    28 ASP  HN      4.50             (#peak  1608)
 &rst
  ixpk= 1608, nxpk= 0, iat= 392, 399, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  27 SER  HB2    30 ILE  HB      5.93             (#peak  4066)
 &rst
  ixpk= 4066, nxpk= 0, iat= 392, 429, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
#  27 SER  HB2    30 ILE  HG12    5.14             (#peak  3901)
 &rst
  ixpk= 3901, nxpk= 0, iat= 392, 435, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  27 SER  HB2    30 ILE  HG13    5.76             (#peak  4126)
 &rst
  ixpk= 4126, nxpk= 0, iat= 392, 436, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,  &end
#
#  27 SER  HB2    30 ILE  QD1     4.66             (#peak  4122)
 &rst
  ixpk= 4122, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 438, 439, 440,
 &end
#
#  27 SER  HB2    30 ILE  QG2     5.94             (#peak  4125)
 &rst
  ixpk= 4125, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
 igr2= 431, 432, 433,
 &end
#
#  27 SER  HB2    31 LEU  QD1     4.83             (#peak  3891)
 &rst
  ixpk= 3891, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
 igr2= 453, 454, 455,
 &end
#
#  27 SER  HB2    31 LEU  QD2     6.04             (#peak  3894)
 &rst
  ixpk= 3894, nxpk= 0, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
 igr2= 457, 458, 459,
 &end
#
#  27 SER  HB3    28 ASP  HN      5.53             (#peak   419)
 &rst
  ixpk= 419, nxpk= 0, iat= 393, 399, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,  &end
#
#  27 SER  HB3    30 ILE  HB      6.15             (#peak  4064)
 &rst
  ixpk= 4064, nxpk= 0, iat= 393, 429, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  27 SER  HB3    30 ILE  HG12    6.03             (#peak  4120)
 &rst
  ixpk= 4120, nxpk= 0, iat= 393, 435, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,  &end
#
#  27 SER  HB3    30 ILE  HG13    5.36             (#peak  4127)
 &rst
  ixpk= 4127, nxpk= 0, iat= 393, 436, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#  27 SER  HB3    30 ILE  QD1     4.24             (#peak  4123)
 &rst
  ixpk= 4123, nxpk= 0, iat= 393,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr2= 438, 439, 440,
 &end
#
#  27 SER  HB3    30 ILE  QG2     5.23             (#peak  4124)
 &rst
  ixpk= 4124, nxpk= 0, iat= 393,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr2= 431, 432, 433,
 &end
#
#  28 ASP  HN     28 ASP  HB2     3.70             (#peak  3353)
 &rst
  ixpk= 3353, nxpk= 0, iat= 399, 403, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
#  28 ASP  HN     29 ASN  HN      4.87             (#peak  1476)
 &rst
  ixpk= 1476, nxpk= 0, iat= 399, 411, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  28 ASP  HN     30 ILE  HB      6.15             (#peak  1835)
 &rst
  ixpk= 1835, nxpk= 0, iat= 399, 429, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  28 ASP  HN     30 ILE  HG12    6.15             (#peak  1834)
 &rst
  ixpk= 1834, nxpk= 0, iat= 399, 435, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  28 ASP  HN     30 ILE  HG13    6.15             (#peak  1833)
 &rst
  ixpk= 1833, nxpk= 0, iat= 399, 436, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  28 ASP  HN     30 ILE  QD1     6.15             (#peak  1836)
 &rst
  ixpk= 1836, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 438, 439, 440,
 &end
#
#  28 ASP  HN     30 ILE  QG2     6.15             (#peak  1837)
 &rst
  ixpk= 1837, nxpk= 0, iat= 399,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 431, 432, 433,
 &end
#
#  28 ASP  HB2    29 ASN  HN      5.43             (#peak  3355)
 &rst
  ixpk= 3355, nxpk= 0, iat= 403, 411, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#  28 ASP  HB2    30 ILE  HG12    4.91             (#peak  4341)
 &rst
  ixpk= 4341, nxpk= 0, iat= 403, 435, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,  &end
#
#  28 ASP  HB2    30 ILE  HG13    5.97             (#peak  4340)
 &rst
  ixpk= 4340, nxpk= 0, iat= 403, 436, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
#  28 ASP  HB2    30 ILE  QD1     4.91             (#peak  4338)
 &rst
  ixpk= 4338, nxpk= 0, iat= 403,  -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr2= 438, 439, 440,
 &end
#
#  28 ASP  HB2    30 ILE  QG2     6.15             (#peak  4339)
 &rst
  ixpk= 4339, nxpk= 0, iat= 403,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 431, 432, 433,
 &end
#
#  28 ASP  HB3    29 ASN  HN      4.79             (#peak  3769)
 &rst
  ixpk= 3769, nxpk= 0, iat= 404, 411, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
#  28 ASP  HB3    30 ILE  HN      6.15             (#peak  1716)
 &rst
  ixpk= 1716, nxpk= 0, iat= 404, 425, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  28 ASP  HB3    30 ILE  HG12    4.93             (#peak  4342)
 &rst
  ixpk= 4342, nxpk= 0, iat= 404, 435, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#  28 ASP  HB3    30 ILE  HG13    6.15             (#peak  3897)
 &rst
  ixpk= 3897, nxpk= 0, iat= 404, 436, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  28 ASP  HB3    30 ILE  QD1     5.64             (#peak  3896)
 &rst
  ixpk= 3896, nxpk= 0, iat= 404,  -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
 igr2= 438, 439, 440,
 &end
#
#  28 ASP  HB3    30 ILE  QG2     5.63             (#peak  4344)
 &rst
  ixpk= 4344, nxpk= 0, iat= 404,  -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
 igr2= 431, 432, 433,
 &end
#
#  29 ASN  HN     29 ASN  HB2     4.20             (#peak  1176)
 &rst
  ixpk= 1176, nxpk= 0, iat= 411, 415, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  29 ASN  HN     29 ASN  HD21    6.15             (#peak  1480)
 &rst
  ixpk= 1480, nxpk= 0, iat= 411, 420, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  29 ASN  HN     29 ASN  HD22    6.15             (#peak   977)
 &rst
  ixpk= 977, nxpk= 0, iat= 411, 421, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  29 ASN  HN     30 ILE  HN      5.43             (#peak  1474)
 &rst
  ixpk= 1474, nxpk= 0, iat= 411, 425, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,  &end
#
#  29 ASN  HN     30 ILE  HG12    6.15             (#peak  1839)
 &rst
  ixpk= 1839, nxpk= 0, iat= 411, 435, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  29 ASN  HN     30 ILE  HG13    6.15             (#peak  1838)
 &rst
  ixpk= 1838, nxpk= 0, iat= 411, 436, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  29 ASN  HN     30 ILE  QG2     6.15             (#peak  1479)
 &rst
  ixpk= 1479, nxpk= 0, iat= 411,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 431, 432, 433,
 &end
#
#  29 ASN  HA     29 ASN  HD22    5.57             (#peak   325)
 &rst
  ixpk= 325, nxpk= 0, iat= 413, 421, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,  &end
#
#  29 ASN  HB2    29 ASN  HD21    3.88             (#peak  1173)
 &rst
  ixpk= 1173, nxpk= 0, iat= 415, 420, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,  &end
#
#  29 ASN  HB2    30 ILE  HN      4.71             (#peak  1171)
 &rst
  ixpk= 1171, nxpk= 0, iat= 415, 425, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  29 ASN  HB2    32 LEU  QD1     6.12             (#peak  4320)
 &rst
  ixpk= 4320, nxpk= 0, iat= 415,  -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
 igr2= 472, 473, 474,
 &end
#
#  29 ASN  HB3    29 ASN  HD21    3.74             (#peak  2982)
 &rst
  ixpk= 2982, nxpk= 0, iat= 416, 420, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  29 ASN  HB3    30 ILE  HN      5.66             (#peak  2980)
 &rst
  ixpk= 2980, nxpk= 0, iat= 416, 425, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,  &end
#
#  29 ASN  HB3    32 LEU  QD1     5.73             (#peak  4319)
 &rst
  ixpk= 4319, nxpk= 0, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
 igr2= 472, 473, 474,
 &end
#
#  29 ASN  HD21   30 ILE  QG2     6.15             (#peak  1842)
 &rst
  ixpk= 1842, nxpk= 0, iat= 420,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 431, 432, 433,
 &end
#
#  30 ILE  HN     30 ILE  HB      4.17             (#peak  1879)
 &rst
  ixpk= 1879, nxpk= 0, iat= 425, 429, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  30 ILE  HN     30 ILE  HG12    3.95             (#peak  3604)
 &rst
  ixpk= 3604, nxpk= 0, iat= 425, 435, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  30 ILE  HN     30 ILE  HG13    4.24             (#peak  2559)
 &rst
  ixpk= 2559, nxpk= 0, iat= 425, 436, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#  30 ILE  HN     30 ILE  QD1     4.61             (#peak  3159)
 &rst
  ixpk= 3159, nxpk= 0, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 438, 439, 440,
 &end
#
#  30 ILE  HN     30 ILE  QG2     4.27             (#peak  1417)
 &rst
  ixpk= 1417, nxpk= 0, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2= 431, 432, 433,
 &end
#
#  30 ILE  HN     31 LEU  HN      4.34             (#peak    70)
 &rst
  ixpk= 70, nxpk= 0, iat= 425, 444, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
#  30 ILE  HA     30 ILE  HG12    3.80             (#peak  1579)
 &rst
  ixpk= 1579, nxpk= 0, iat= 427, 435, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  30 ILE  HA     30 ILE  QD1     4.62             (#peak  1578)
 &rst
  ixpk= 1578, nxpk= 0, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr2= 438, 439, 440,
 &end
#
#  30 ILE  HA     30 ILE  QG2     3.59             (#peak  1574)
 &rst
  ixpk= 1574, nxpk= 0, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2= 431, 432, 433,
 &end
#
#  30 ILE  HB     30 ILE  QD1     3.65             (#peak  3162)
 &rst
  ixpk= 3162, nxpk= 0, iat= 429,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 438, 439, 440,
 &end
#
#  30 ILE  HB     31 LEU  HN      4.24             (#peak  1878)
 &rst
  ixpk= 1878, nxpk= 0, iat= 429, 444, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#  30 ILE  HG13   31 LEU  HN      5.03             (#peak  2558)
 &rst
  ixpk= 2558, nxpk= 0, iat= 436, 444, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
#  30 ILE  QD1    31 LEU  HN      4.77             (#peak  3158)
 &rst
  ixpk= 3158, nxpk= 0, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr1= 438, 439, 440,
 &end
#
#  30 ILE  QG2    30 ILE  HG12    3.61             (#peak  3605)
 &rst
  ixpk= 3605, nxpk= 0, iat=  -1, 435, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1= 431, 432, 433,
 &end
#
#  30 ILE  QG2    30 ILE  HG13    3.35             (#peak  2560)
 &rst
  ixpk= 2560, nxpk= 0, iat=  -1, 436, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
 igr1= 431, 432, 433,
 &end
#
#  30 ILE  QG2    30 ILE  QD1     2.75             (#peak  1422)
 &rst
  ixpk= 1422, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
 igr1= 431, 432, 433,
 igr2= 438, 439, 440,
 &end
#
#  30 ILE  QG2    31 LEU  HN      4.27             (#peak  1416)
 &rst
  ixpk= 1416, nxpk= 0, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr1= 431, 432, 433,
 &end
#
#  31 LEU  HN     31 LEU  HG      4.64             (#peak    72)
 &rst
  ixpk= 72, nxpk= 0, iat= 444, 451, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  31 LEU  HN     31 LEU  QB      3.78             (#peak  2212)
 &rst
  ixpk= 2212, nxpk= 0, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 448, 449,
 &end
#
#  31 LEU  HN     31 LEU  QD1     4.73             (#peak  1621)
 &rst
  ixpk= 1621, nxpk= 0, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 453, 454, 455,
 &end
#
#  31 LEU  HN     31 LEU  QD2     5.04             (#peak  3366)
 &rst
  ixpk= 3366, nxpk= 0, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2= 457, 458, 459,
 &end
#
#  31 LEU  HN     32 LEU  HN      6.15             (#peak  1666)
 &rst
  ixpk= 1666, nxpk= 0, iat= 444, 463, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  31 LEU  HA     31 LEU  QD1     3.21             (#peak  1624)
 &rst
  ixpk= 1624, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
 igr2= 453, 454, 455,
 &end
#
#  31 LEU  HA     31 LEU  QD2     4.35             (#peak  3369)
 &rst
  ixpk= 3369, nxpk= 0, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2= 457, 458, 459,
 &end
#
#  31 LEU  HG     32 LEU  HN      4.89             (#peak    77)
 &rst
  ixpk= 77, nxpk= 0, iat= 451, 463, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#  31 LEU  QB     31 LEU  HG      2.75             (#peak    74)
 &rst
  ixpk= 74, nxpk= 0, iat=  -1, 451, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,
 igr1= 448, 449,
 &end
#
#  31 LEU  QB     31 LEU  QD1     2.76             (#peak  1623)
 &rst
  ixpk= 1623, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1= 448, 449,
 igr2= 453, 454, 455,
 &end
#
#  31 LEU  QB     31 LEU  QD2     2.46             (#peak  2216)
 &rst
  ixpk= 2216, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
 igr1= 448, 449,
 igr2= 457, 458, 459,
 &end
#
#  31 LEU  QB     32 LEU  HN      4.19             (#peak  2217)
 &rst
  ixpk= 2217, nxpk= 0, iat=  -1, 463, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 448, 449,
 &end
#
#  31 LEU  QD1    32 LEU  HN      4.94             (#peak  1626)
 &rst
  ixpk= 1626, nxpk= 0, iat=  -1, 463, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1= 453, 454, 455,
 &end
#
#  31 LEU  QD1    33 SER  HB2     5.27             (#peak  4332)
 &rst
  ixpk= 4332, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr1= 453, 454, 455,
 &end
#
#  31 LEU  QD1    33 SER  HB3     6.15             (#peak  4329)
 &rst
  ixpk= 4329, nxpk= 0, iat=  -1, 487, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 453, 454, 455,
 &end
#
#  31 LEU  QD2    32 LEU  HN      5.96             (#peak  3371)
 &rst
  ixpk= 3371, nxpk= 0, iat=  -1, 463, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr1= 457, 458, 459,
 &end
#
#  31 LEU  QD2    33 SER  HB2     5.44             (#peak  4331)
 &rst
  ixpk= 4331, nxpk= 0, iat=  -1, 486, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1= 457, 458, 459,
 &end
#
#  31 LEU  QD2    33 SER  HB3     5.32             (#peak  4330)
 &rst
  ixpk= 4330, nxpk= 0, iat=  -1, 487, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
 igr1= 457, 458, 459,
 &end
#
#  32 LEU  HN     32 LEU  HB2     3.71             (#peak   379)
 &rst
  ixpk= 379, nxpk= 0, iat= 463, 467, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  32 LEU  HN     32 LEU  HG      5.02             (#peak   317)
 &rst
  ixpk= 317, nxpk= 0, iat= 463, 470, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  32 LEU  HN     32 LEU  QD1     4.66             (#peak  1671)
 &rst
  ixpk= 1671, nxpk= 0, iat= 463,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr2= 472, 473, 474,
 &end
#
#  32 LEU  HN     32 LEU  QD2     5.71             (#peak  3625)
 &rst
  ixpk= 3625, nxpk= 0, iat= 463,  -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
 igr2= 476, 477, 478,
 &end
#
#  32 LEU  HN     33 SER  HN      5.88             (#peak  1391)
 &rst
  ixpk= 1391, nxpk= 0, iat= 463, 482, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,  &end
#
#  32 LEU  HA     32 LEU  HG      4.03             (#peak   312)
 &rst
  ixpk= 312, nxpk= 0, iat= 465, 470, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  32 LEU  HA     32 LEU  QD1     3.82             (#peak   761)
 &rst
  ixpk= 761, nxpk= 0, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 472, 473, 474,
 &end
#
#  32 LEU  HA     32 LEU  QD2     4.14             (#peak  3620)
 &rst
  ixpk= 3620, nxpk= 0, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
 igr2= 476, 477, 478,
 &end
#
#  32 LEU  HB2    32 LEU  QD1     3.58             (#peak   375)
 &rst
  ixpk= 375, nxpk= 0, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 472, 473, 474,
 &end
#
#  32 LEU  HB2    32 LEU  QD2     3.41             (#peak  3619)
 &rst
  ixpk= 3619, nxpk= 0, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
 igr2= 476, 477, 478,
 &end
#
#  32 LEU  HB2    33 SER  HN      4.98             (#peak   377)
 &rst
  ixpk= 377, nxpk= 0, iat= 467, 482, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,  &end
#
#  32 LEU  HB3    32 LEU  QD1     3.27             (#peak  2481)
 &rst
  ixpk= 2481, nxpk= 0, iat= 468,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 472, 473, 474,
 &end
#
#  32 LEU  HB3    32 LEU  QD2     3.27             (#peak  3622)
 &rst
  ixpk= 3622, nxpk= 0, iat= 468,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 476, 477, 478,
 &end
#
#  32 LEU  HB3    33 SER  HN      5.05             (#peak  2483)
 &rst
  ixpk= 2483, nxpk= 0, iat= 468, 482, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#  32 LEU  HG     33 SER  HN      6.10             (#peak   315)
 &rst
  ixpk= 315, nxpk= 0, iat= 470, 482, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,  &end
#
#  32 LEU  QD1    33 SER  HN      5.12             (#peak  1905)
 &rst
  ixpk= 1905, nxpk= 0, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1= 472, 473, 474,
 &end
#
#  32 LEU  QD2    33 SER  HN      6.15             (#peak  1390)
 &rst
  ixpk= 1390, nxpk= 0, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 476, 477, 478,
 &end
#
# 33 SER   HN     24 THR  O       2.4
 &rst
  ixpk= 1390, nxpk= 0, iat= 482, 355, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#  33 SER  HN     33 SER  HB3     3.50             (#peak  2378)
 &rst
  ixpk= 2378, nxpk= 0, iat= 482, 487, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  33 SER  HN     34 GLU  HN      6.15             (#peak  1388)
 &rst
  ixpk= 1388, nxpk= 0, iat= 482, 493, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  33 SER  HA     34 GLU  QB      5.06             (#peak  3905)
 &rst
  ixpk= 3905, nxpk= 0, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr2= 497, 498,
 &end
#
#  33 SER  HA     34 GLU  QG      4.83             (#peak  3904)
 &rst
  ixpk= 3904, nxpk= 0, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
 igr2= 500, 501,
 &end
#
#  33 SER  HB2    34 GLU  HN      4.66             (#peak   486)
 &rst
  ixpk= 486, nxpk= 0, iat= 486, 493, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#  33 SER  HB3    34 GLU  HN      5.07             (#peak  2377)
 &rst
  ixpk= 2377, nxpk= 0, iat= 487, 493, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
# 33 SER   N      24 THR  O       3.3
 &rst
  ixpk= 2377, nxpk= 0, iat= 481, 355, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#  34 GLU  HN     34 GLU  QB      4.10             (#peak   235)
 &rst
  ixpk= 235, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr2= 497, 498,
 &end
#
#  34 GLU  HN     34 GLU  QG      4.44             (#peak  1812)
 &rst
  ixpk= 1812, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
 igr2= 500, 501,
 &end
#
#  34 GLU  HN     35 GLU  HN      6.15             (#peak  1568)
 &rst
  ixpk= 1568, nxpk= 0, iat= 493, 508, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  34 GLU  HN     35 GLU  QG      5.39             (#peak  2384)
 &rst
  ixpk= 2384, nxpk= 0, iat= 493,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2= 515, 516,
 &end
#
#  34 GLU  HA     34 GLU  QB      2.62             (#peak   255)
 &rst
  ixpk= 255, nxpk= 0, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,
 igr2= 497, 498,
 &end
#
#  34 GLU  HA     34 GLU  QG      2.55             (#peak   259)
 &rst
  ixpk= 259, nxpk= 0, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,
 igr2= 500, 501,
 &end
#
#  34 GLU  HA     35 GLU  HN      2.88             (#peak   262)
 &rst
  ixpk= 262, nxpk= 0, iat= 495, 508, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,  &end
#
#  34 GLU  QB     34 GLU  QG      2.40             (#peak  1808)
 &rst
  ixpk= 1808, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1= 497, 498,
 igr2= 500, 501,
 &end
#
#  34 GLU  QB     35 GLU  HN      3.48             (#peak   236)
 &rst
  ixpk= 236, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
 igr1= 497, 498,
 &end
#
#  34 GLU  QG     35 GLU  HN      4.65             (#peak  1813)
 &rst
  ixpk= 1813, nxpk= 0, iat=  -1, 508, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 500, 501,
 &end
#
# 35 GLU   HN     22 ILE  O       2.4
 &rst
  ixpk= 1813, nxpk= 0, iat= 508, 325, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#  35 GLU  HN     35 GLU  HB2     3.51             (#peak   730)
 &rst
  ixpk= 730, nxpk= 0, iat= 508, 512, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  35 GLU  HN     35 GLU  HB3     4.16             (#peak  2121)
 &rst
  ixpk= 2121, nxpk= 0, iat= 508, 513, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  35 GLU  HN     35 GLU  QG      3.62             (#peak  2385)
 &rst
  ixpk= 2385, nxpk= 0, iat= 508,  -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr2= 515, 516,
 &end
#
#  35 GLU  HN     36 GLN  HN      6.15             (#peak   222)
 &rst
  ixpk= 222, nxpk= 0, iat= 508, 523, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  35 GLU  HN     37 VAL  QG1     6.15             (#peak  2137)
 &rst
  ixpk= 2137, nxpk= 0, iat= 508,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 546, 547, 548,
 &end
#
#  35 GLU  HA     35 GLU  QG      3.35             (#peak  2382)
 &rst
  ixpk= 2382, nxpk= 0, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 515, 516,
 &end
#
#  35 GLU  HA     36 GLN  HN      2.56             (#peak  2360)
 &rst
  ixpk= 2360, nxpk= 0, iat= 510, 523, r1= 1.30, r2= 1.80, r3= 2.56, r4= 3.06,  &end
#
# 35 GLU   N      22 ILE  O       3.3
 &rst
  ixpk= 2360, nxpk= 0, iat= 507, 325, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#  36 GLN  HN     36 GLN  HB2     3.44             (#peak  1350)
 &rst
  ixpk= 1350, nxpk= 0, iat= 523, 527, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#  36 GLN  HN     36 GLN  HE21    6.15             (#peak   837)
 &rst
  ixpk= 837, nxpk= 0, iat= 523, 535, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  36 GLN  HN     36 GLN  HG2     3.91             (#peak  3106)
 &rst
  ixpk= 3106, nxpk= 0, iat= 523, 530, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,  &end
#
#  36 GLN  HN     36 GLN  HG3     4.10             (#peak  1966)
 &rst
  ixpk= 1966, nxpk= 0, iat= 523, 531, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#  36 GLN  HN     37 VAL  HN      6.15             (#peak   213)
 &rst
  ixpk= 213, nxpk= 0, iat= 523, 540, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  36 GLN  HA     36 GLN  HE21    5.28             (#peak  1793)
 &rst
  ixpk= 1793, nxpk= 0, iat= 525, 535, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,  &end
#
#  36 GLN  HA     36 GLN  HE22    4.84             (#peak  1794)
 &rst
  ixpk= 1794, nxpk= 0, iat= 525, 536, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#  36 GLN  HA     36 GLN  HG2     3.71             (#peak  3108)
 &rst
  ixpk= 3108, nxpk= 0, iat= 525, 530, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  36 GLN  HA     36 GLN  HG3     4.13             (#peak  1791)
 &rst
  ixpk= 1791, nxpk= 0, iat= 525, 531, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  36 GLN  HA     37 VAL  HN      2.78             (#peak  1785)
 &rst
  ixpk= 1785, nxpk= 0, iat= 525, 540, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28,  &end
#
#  36 GLN  HA     37 VAL  QG1     5.41             (#peak  1792)
 &rst
  ixpk= 1792, nxpk= 0, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
 igr2= 546, 547, 548,
 &end
#
#  36 GLN  HA     37 VAL  QG2     4.61             (#peak    12)
 &rst
  ixpk= 12, nxpk= 0, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 550, 551, 552,
 &end
#
#  36 GLN  HB2    36 GLN  HE21    4.12             (#peak  1354)
 &rst
  ixpk= 1354, nxpk= 0, iat= 527, 535, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,  &end
#
#  36 GLN  HB2    36 GLN  HE22    5.13             (#peak  1355)
 &rst
  ixpk= 1355, nxpk= 0, iat= 527, 536, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,  &end
#
#  36 GLN  HB2    37 VAL  HN      5.14             (#peak  1349)
 &rst
  ixpk= 1349, nxpk= 0, iat= 527, 540, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  36 GLN  HB3    36 GLN  HE21    2.71             (#peak  3841)
 &rst
  ixpk= 3841, nxpk= 0, iat= 528, 535, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21,  &end
#
#  36 GLN  HB3    36 GLN  HE22    3.61             (#peak  3842)
 &rst
  ixpk= 3842, nxpk= 0, iat= 528, 536, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,  &end
#
#  36 GLN  HB3    37 VAL  HN      5.49             (#peak  3836)
 &rst
  ixpk= 3836, nxpk= 0, iat= 528, 540, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
#  36 GLN  HE22   37 VAL  HN      6.15             (#peak  1039)
 &rst
  ixpk= 1039, nxpk= 0, iat= 536, 540, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  36 GLN  HG2    36 GLN  HE21    3.06             (#peak  3110)
 &rst
  ixpk= 3110, nxpk= 0, iat= 530, 535, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,  &end
#
#  36 GLN  HG2    37 VAL  HN      4.93             (#peak  3105)
 &rst
  ixpk= 3105, nxpk= 0, iat= 530, 540, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#  36 GLN  HG3    36 GLN  HE21    3.85             (#peak  1970)
 &rst
  ixpk= 1970, nxpk= 0, iat= 531, 535, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
# 37 VAL   HN     20 ALA  O       2.4
 &rst
  ixpk= 1970, nxpk= 0, iat= 540, 292, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#  37 VAL  HN     37 VAL  HB      4.19             (#peak   519)
 &rst
  ixpk= 519, nxpk= 0, iat= 540, 544, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#  37 VAL  HN     37 VAL  QG1     3.13             (#peak  2131)
 &rst
  ixpk= 2131, nxpk= 0, iat= 540,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 546, 547, 548,
 &end
#
#  37 VAL  HN     37 VAL  QG2     3.10             (#peak     9)
 &rst
  ixpk= 9, nxpk= 0, iat= 540,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2= 550, 551, 552,
 &end
#
#  37 VAL  HN     38 ASP  HN      6.15             (#peak   321)
 &rst
  ixpk= 321, nxpk= 0, iat= 540, 556, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  37 VAL  HA     37 VAL  HB      2.73             (#peak   524)
 &rst
  ixpk= 524, nxpk= 0, iat= 542, 544, r1= 1.30, r2= 1.80, r3= 2.73, r4= 3.23,  &end
#
#  37 VAL  HA     37 VAL  QG1     2.59             (#peak  2136)
 &rst
  ixpk= 2136, nxpk= 0, iat= 542,  -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
 igr2= 546, 547, 548,
 &end
#
#  37 VAL  HA     37 VAL  QG2     3.68             (#peak    15)
 &rst
  ixpk= 15, nxpk= 0, iat= 542,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2= 550, 551, 552,
 &end
#
#  37 VAL  HA     38 ASP  HN      2.81             (#peak  2954)
 &rst
  ixpk= 2954, nxpk= 0, iat= 542, 556, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31,  &end
#
#  37 VAL  HB     38 ASP  HN      3.15             (#peak   521)
 &rst
  ixpk= 521, nxpk= 0, iat= 544, 556, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#  37 VAL  HB     41 LEU  QD2     5.32             (#peak   522)
 &rst
  ixpk= 522, nxpk= 0, iat= 544,  -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
 igr2= 612, 613, 614,
 &end
#
# 37 VAL   N      20 ALA  O       3.3
 &rst
  ixpk= 522, nxpk= 0, iat= 539, 292, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#  37 VAL  QG1    38 ASP  HN      4.52             (#peak  2133)
 &rst
  ixpk= 2133, nxpk= 0, iat=  -1, 556, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1= 546, 547, 548,
 &end
#
#  37 VAL  QG2    38 ASP  HN      3.56             (#peak    11)
 &rst
  ixpk= 11, nxpk= 0, iat=  -1, 556, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr1= 550, 551, 552,
 &end
#
#  38 ASP  HN     38 ASP  HB3     3.89             (#peak  1547)
 &rst
  ixpk= 1547, nxpk= 0, iat= 556, 561, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  38 ASP  HN     39 VAL  HN      6.15             (#peak  1543)
 &rst
  ixpk= 1543, nxpk= 0, iat= 556, 568, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  38 ASP  HN     40 GLU  HN      5.63             (#peak  1738)
 &rst
  ixpk= 1738, nxpk= 0, iat= 556, 584, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#  38 ASP  HN     41 LEU  HB2     5.45             (#peak  3800)
 &rst
  ixpk= 3800, nxpk= 0, iat= 556, 603, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#  38 ASP  HN     41 LEU  HB3     5.27             (#peak  3207)
 &rst
  ixpk= 3207, nxpk= 0, iat= 556, 604, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
#  38 ASP  HN     41 LEU  QD1     3.81             (#peak  3281)
 &rst
  ixpk= 3281, nxpk= 0, iat= 556,  -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr2= 608, 609, 610,
 &end
#
#  38 ASP  HN     41 LEU  QD2     4.76             (#peak   324)
 &rst
  ixpk= 324, nxpk= 0, iat= 556,  -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr2= 612, 613, 614,
 &end
#
#  38 ASP  HA     39 VAL  HN      2.90             (#peak  1846)
 &rst
  ixpk= 1846, nxpk= 0, iat= 558, 568, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,  &end
#
#  38 ASP  HA     41 LEU  QD1     4.64             (#peak  3286)
 &rst
  ixpk= 3286, nxpk= 0, iat= 558,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2= 608, 609, 610,
 &end
#
#  38 ASP  HA     41 LEU  QD2     6.15             (#peak  1108)
 &rst
  ixpk= 1108, nxpk= 0, iat= 558,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 612, 613, 614,
 &end
#
#  38 ASP  HB2    39 VAL  HN      4.74             (#peak  3677)
 &rst
  ixpk= 3677, nxpk= 0, iat= 560, 568, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
#  38 ASP  HB2    39 VAL  QG1     5.31             (#peak  3672)
 &rst
  ixpk= 3672, nxpk= 0, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
 igr2= 574, 575, 576,
 &end
#
#  38 ASP  HB2    40 GLU  HN      4.48             (#peak  3674)
 &rst
  ixpk= 3674, nxpk= 0, iat= 560, 584, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,  &end
#
#  38 ASP  HB2    41 LEU  HN      5.59             (#peak  1746)
 &rst
  ixpk= 1746, nxpk= 0, iat= 560, 599, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,  &end
#
#  38 ASP  HB2    41 LEU  HG      4.71             (#peak  4095)
 &rst
  ixpk= 4095, nxpk= 0, iat= 560, 606, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  38 ASP  HB2    41 LEU  QD1     3.80             (#peak  4087)
 &rst
  ixpk= 4087, nxpk= 0, iat= 560,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 608, 609, 610,
 &end
#
#  38 ASP  HB3    39 VAL  HN      4.21             (#peak  1551)
 &rst
  ixpk= 1551, nxpk= 0, iat= 561, 568, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
#  38 ASP  HB3    40 GLU  HN      6.15             (#peak  1548)
 &rst
  ixpk= 1548, nxpk= 0, iat= 561, 584, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  38 ASP  HB3    41 LEU  HN      5.52             (#peak  1747)
 &rst
  ixpk= 1747, nxpk= 0, iat= 561, 599, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,  &end
#
#  38 ASP  HB3    41 LEU  HG      4.04             (#peak  4085)
 &rst
  ixpk= 4085, nxpk= 0, iat= 561, 606, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,  &end
#
#  38 ASP  HB3    41 LEU  QD1     4.26             (#peak  4086)
 &rst
  ixpk= 4086, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 608, 609, 610,
 &end
#
#  38 ASP  HB3    41 LEU  QD2     5.33             (#peak  4083)
 &rst
  ixpk= 4083, nxpk= 0, iat= 561,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2= 612, 613, 614,
 &end
#
#  39 VAL  HN     39 VAL  HB      3.21             (#peak  2922)
 &rst
  ixpk= 2922, nxpk= 0, iat= 568, 572, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  39 VAL  HN     39 VAL  QG1     3.69             (#peak   736)
 &rst
  ixpk= 736, nxpk= 0, iat= 568,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2= 574, 575, 576,
 &end
#
#  39 VAL  HN     39 VAL  QG2     4.28             (#peak  2391)
 &rst
  ixpk= 2391, nxpk= 0, iat= 568,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr2= 578, 579, 580,
 &end
#
#  39 VAL  HN     40 GLU  HN      6.15             (#peak  1544)
 &rst
  ixpk= 1544, nxpk= 0, iat= 568, 584, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  39 VAL  HA     39 VAL  HB      2.98             (#peak  3571)
 &rst
  ixpk= 3571, nxpk= 0, iat= 570, 572, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48,  &end
#
#  39 VAL  HA     39 VAL  QG1     3.67             (#peak   735)
 &rst
  ixpk= 735, nxpk= 0, iat= 570,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 574, 575, 576,
 &end
#
#  39 VAL  HA     39 VAL  QG2     2.61             (#peak  3569)
 &rst
  ixpk= 3569, nxpk= 0, iat= 570,  -1, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
 igr2= 578, 579, 580,
 &end
#
#  39 VAL  HA     41 LEU  HN      4.68             (#peak  4298)
 &rst
  ixpk= 4298, nxpk= 0, iat= 570, 599, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#  39 VAL  HA     42 VAL  HN      4.95             (#peak  4297)
 &rst
  ixpk= 4297, nxpk= 0, iat= 570, 618, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  39 VAL  HA     42 VAL  HB      4.83             (#peak  3570)
 &rst
  ixpk= 3570, nxpk= 0, iat= 570, 622, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,  &end
#
#  39 VAL  QG2    40 GLU  HN      4.59             (#peak  2387)
 &rst
  ixpk= 2387, nxpk= 0, iat=  -1, 584, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1= 578, 579, 580,
 &end
#
#  39 VAL  QG2    58 VAL  QG2     4.12             (#peak  4358)
 &rst
  ixpk= 4358, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 578, 579, 580,
 igr2= 880, 881, 882,
 &end
#
#  40 GLU  HN     40 GLU  HB2     3.19             (#peak  1472)
 &rst
  ixpk= 1472, nxpk= 0, iat= 584, 588, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
#  40 GLU  HN     40 GLU  HB3     3.81             (#peak  1814)
 &rst
  ixpk= 1814, nxpk= 0, iat= 584, 589, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#  40 GLU  HN     40 GLU  QG      4.29             (#peak  3516)
 &rst
  ixpk= 3516, nxpk= 0, iat= 584,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2= 591, 592,
 &end
#
#  40 GLU  HN     41 LEU  HN      5.52             (#peak   377)
 &rst
  ixpk= 377, nxpk= 0, iat= 584, 599, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,  &end
#
#  40 GLU  HN     41 LEU  HA      6.15             (#peak  1743)
 &rst
  ixpk= 1743, nxpk= 0, iat= 584, 601, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  40 GLU  HN     41 LEU  HB3     6.15             (#peak   379)
 &rst
  ixpk= 379, nxpk= 0, iat= 584, 604, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  40 GLU  HN     42 VAL  HN      6.15             (#peak  1394)
 &rst
  ixpk= 1394, nxpk= 0, iat= 584, 618, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  40 GLU  HA     40 GLU  HB2     2.86             (#peak  1475)
 &rst
  ixpk= 1475, nxpk= 0, iat= 586, 588, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,  &end
#
#  40 GLU  HA     40 GLU  QG      2.69             (#peak  3519)
 &rst
  ixpk= 3519, nxpk= 0, iat= 586,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr2= 591, 592,
 &end
#
#  40 GLU  HA     42 VAL  HN      6.15             (#peak  1398)
 &rst
  ixpk= 1398, nxpk= 0, iat= 586, 618, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  40 GLU  HB2    41 LEU  HN      4.62             (#peak  1476)
 &rst
  ixpk= 1476, nxpk= 0, iat= 588, 599, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#  40 GLU  HB2    41 LEU  QD1     6.15             (#peak  1477)
 &rst
  ixpk= 1477, nxpk= 0, iat= 588,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 608, 609, 610,
 &end
#
#  40 GLU  HB2    41 LEU  QD2     5.97             (#peak  4093)
 &rst
  ixpk= 4093, nxpk= 0, iat= 588,  -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
 igr2= 612, 613, 614,
 &end
#
#  40 GLU  HB3    40 GLU  QG      2.40             (#peak  3518)
 &rst
  ixpk= 3518, nxpk= 0, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr2= 591, 592,
 &end
#
#  40 GLU  HB3    41 LEU  HN      4.63             (#peak  1818)
 &rst
  ixpk= 1818, nxpk= 0, iat= 589, 599, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  40 GLU  HB3    41 LEU  QD1     5.23             (#peak  1819)
 &rst
  ixpk= 1819, nxpk= 0, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr2= 608, 609, 610,
 &end
#
#  40 GLU  HB3    41 LEU  QD2     4.61             (#peak  4094)
 &rst
  ixpk= 4094, nxpk= 0, iat= 589,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2= 612, 613, 614,
 &end
#
#  40 GLU  QG     41 LEU  HN      4.78             (#peak  3520)
 &rst
  ixpk= 3520, nxpk= 0, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1= 591, 592,
 &end
#
#  40 GLU  QG     41 LEU  QD2     4.67             (#peak  4091)
 &rst
  ixpk= 4091, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1= 591, 592,
 igr2= 612, 613, 614,
 &end
#
#  41 LEU  HN     41 LEU  HB3     4.19             (#peak  3212)
 &rst
  ixpk= 3212, nxpk= 0, iat= 599, 604, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
#  41 LEU  HN     41 LEU  HG      4.87             (#peak  1525)
 &rst
  ixpk= 1525, nxpk= 0, iat= 599, 606, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  41 LEU  HN     41 LEU  QD1     4.69             (#peak  3287)
 &rst
  ixpk= 3287, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 608, 609, 610,
 &end
#
#  41 LEU  HN     41 LEU  QD2     4.75             (#peak  1109)
 &rst
  ixpk= 1109, nxpk= 0, iat= 599,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr2= 612, 613, 614,
 &end
#
#  41 LEU  HN     42 VAL  HN      5.11             (#peak  1400)
 &rst
  ixpk= 1400, nxpk= 0, iat= 599, 618, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,  &end
#
#  41 LEU  HA     41 LEU  HG      3.80             (#peak   454)
 &rst
  ixpk= 454, nxpk= 0, iat= 601, 606, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  41 LEU  HA     41 LEU  QD1     4.26             (#peak  3280)
 &rst
  ixpk= 3280, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 608, 609, 610,
 &end
#
#  41 LEU  HA     41 LEU  QD2     3.08             (#peak   453)
 &rst
  ixpk= 453, nxpk= 0, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
 igr2= 612, 613, 614,
 &end
#
#  41 LEU  HA     43 GLN  HN      6.15             (#peak   456)
 &rst
  ixpk= 456, nxpk= 0, iat= 601, 634, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  41 LEU  HB2    41 LEU  HG      2.63             (#peak  3802)
 &rst
  ixpk= 3802, nxpk= 0, iat= 603, 606, r1= 1.30, r2= 1.80, r3= 2.63, r4= 3.13,  &end
#
#  41 LEU  HB2    41 LEU  QD1     2.73             (#peak  3290)
 &rst
  ixpk= 3290, nxpk= 0, iat= 603,  -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
 igr2= 608, 609, 610,
 &end
#
#  41 LEU  HB2    41 LEU  QD2     3.27             (#peak  1112)
 &rst
  ixpk= 1112, nxpk= 0, iat= 603,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 612, 613, 614,
 &end
#
#  41 LEU  HB2    42 VAL  HN      4.65             (#peak  3807)
 &rst
  ixpk= 3807, nxpk= 0, iat= 603, 618, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  41 LEU  HB3    41 LEU  QD1     3.23             (#peak  3215)
 &rst
  ixpk= 3215, nxpk= 0, iat= 604,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2= 608, 609, 610,
 &end
#
#  41 LEU  HB3    41 LEU  QD2     2.94             (#peak  3209)
 &rst
  ixpk= 3209, nxpk= 0, iat= 604,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 612, 613, 614,
 &end
#
#  41 LEU  HB3    42 VAL  HN      5.90             (#peak  3216)
 &rst
  ixpk= 3216, nxpk= 0, iat= 604, 618, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,  &end
#
#  41 LEU  HG     42 VAL  HN      6.15             (#peak  1395)
 &rst
  ixpk= 1395, nxpk= 0, iat= 606, 618, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  42 VAL  HN     42 VAL  HB      4.02             (#peak  2896)
 &rst
  ixpk= 2896, nxpk= 0, iat= 618, 622, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  42 VAL  HN     42 VAL  QG1     3.94             (#peak   202)
 &rst
  ixpk= 202, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2= 624, 625, 626,
 &end
#
#  42 VAL  HN     42 VAL  QG2     4.09             (#peak  1756)
 &rst
  ixpk= 1756, nxpk= 0, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 628, 629, 630,
 &end
#
#  42 VAL  HN     43 GLN  HN      6.15             (#peak  1402)
 &rst
  ixpk= 1402, nxpk= 0, iat= 618, 634, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  42 VAL  HN     43 GLN  HA      6.15             (#peak  1399)
 &rst
  ixpk= 1399, nxpk= 0, iat= 618, 636, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  42 VAL  HA     42 VAL  QG1     3.64             (#peak  1627)
 &rst
  ixpk= 1627, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr2= 624, 625, 626,
 &end
#
#  42 VAL  HA     42 VAL  QG2     3.80             (#peak  1752)
 &rst
  ixpk= 1752, nxpk= 0, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2= 628, 629, 630,
 &end
#
#  42 VAL  HB     43 GLN  HN      5.73             (#peak  2895)
 &rst
  ixpk= 2895, nxpk= 0, iat= 622, 634, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,  &end
#
#  42 VAL  QG1    43 GLN  HN      4.62             (#peak   201)
 &rst
  ixpk= 201, nxpk= 0, iat=  -1, 634, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
 igr1= 624, 625, 626,
 &end
#
#  42 VAL  QG1    58 VAL  QG1     4.89             (#peak  4221)
 &rst
  ixpk= 4221, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
 igr1= 624, 625, 626,
 igr2= 876, 877, 878,
 &end
#
#  42 VAL  QG2    43 GLN  HN      4.23             (#peak  1755)
 &rst
  ixpk= 1755, nxpk= 0, iat=  -1, 634, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1= 628, 629, 630,
 &end
#
#  43 GLN  HN     43 GLN  HB2     4.16             (#peak  1055)
 &rst
  ixpk= 1055, nxpk= 0, iat= 634, 638, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
#  43 GLN  HN     43 GLN  HE21    6.15             (#peak  1246)
 &rst
  ixpk= 1246, nxpk= 0, iat= 634, 646, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  43 GLN  HN     43 GLN  HG2     4.25             (#peak   773)
 &rst
  ixpk= 773, nxpk= 0, iat= 634, 641, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
#  43 GLN  HN     43 GLN  HG3     4.31             (#peak  2964)
 &rst
  ixpk= 2964, nxpk= 0, iat= 634, 642, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  43 GLN  HN     44 ARG  HN      6.15             (#peak  1252)
 &rst
  ixpk= 1252, nxpk= 0, iat= 634, 651, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  43 GLN  HN     46 ASP  HN      6.15             (#peak  1782)
 &rst
  ixpk= 1782, nxpk= 0, iat= 634, 682, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  43 GLN  HA    107 VAL  HN      6.15             (#peak  1865)
 &rst
  ixpk= 1865, nxpk= 0, iat= 636,1570, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  43 GLN  HA    107 VAL  QG1     5.14             (#peak  4263)
 &rst
  ixpk= 4263, nxpk= 0, iat= 636,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1576,1577,1578,
 &end
#
#  43 GLN  HA    107 VAL  QG2     5.32             (#peak  4264)
 &rst
  ixpk= 4264, nxpk= 0, iat= 636,  -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
 igr2=1580,1581,1582,
 &end
#
#  43 GLN  HA     43 GLN  HE21    6.15             (#peak     7)
 &rst
  ixpk= 7, nxpk= 0, iat= 636, 646, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  43 GLN  HA     43 GLN  HE22    6.15             (#peak  1410)
 &rst
  ixpk= 1410, nxpk= 0, iat= 636, 647, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  43 GLN  HA     43 GLN  HG2     4.24             (#peak   771)
 &rst
  ixpk= 771, nxpk= 0, iat= 636, 641, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,  &end
#
#  43 GLN  HA     43 GLN  HG3     3.98             (#peak  2962)
 &rst
  ixpk= 2962, nxpk= 0, iat= 636, 642, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  43 GLN  HA     44 ARG  HN      2.98             (#peak  2721)
 &rst
  ixpk= 2721, nxpk= 0, iat= 636, 651, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48,  &end
#
#  43 GLN  HB2    43 GLN  HE21    3.74             (#peak  1047)
 &rst
  ixpk= 1047, nxpk= 0, iat= 638, 646, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  43 GLN  HB2    43 GLN  HE22    4.27             (#peak  1056)
 &rst
  ixpk= 1056, nxpk= 0, iat= 638, 647, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
#  43 GLN  HB2    44 ARG  HN      4.79             (#peak  1050)
 &rst
  ixpk= 1050, nxpk= 0, iat= 638, 651, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
#  43 GLN  HB3    43 GLN  HE21    5.68             (#peak  1326)
 &rst
  ixpk= 1326, nxpk= 0, iat= 639, 646, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,  &end
#
#  43 GLN  HB3    43 GLN  HE22    5.34             (#peak  1335)
 &rst
  ixpk= 1335, nxpk= 0, iat= 639, 647, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#  43 GLN  HB3    44 ARG  HN      4.63             (#peak  1329)
 &rst
  ixpk= 1329, nxpk= 0, iat= 639, 651, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  43 GLN  HE21   44 ARG  HN      6.15             (#peak   556)
 &rst
  ixpk= 556, nxpk= 0, iat= 646, 651, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  43 GLN  HE22   44 ARG  HN      6.15             (#peak  1751)
 &rst
  ixpk= 1751, nxpk= 0, iat= 647, 651, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  43 GLN  HG2    43 GLN  HE21    3.86             (#peak   766)
 &rst
  ixpk= 766, nxpk= 0, iat= 641, 646, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  43 GLN  HG2    44 ARG  HN      5.07             (#peak   769)
 &rst
  ixpk= 769, nxpk= 0, iat= 641, 651, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,  &end
#
#  43 GLN  HG3    43 GLN  HE21    3.93             (#peak  2957)
 &rst
  ixpk= 2957, nxpk= 0, iat= 642, 646, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  43 GLN  HG3    44 ARG  HN      4.76             (#peak  2960)
 &rst
  ixpk= 2960, nxpk= 0, iat= 642, 651, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  44 ARG  HN    106 HIS  HA      6.15             (#peak  1800)
 &rst
  ixpk= 1800, nxpk= 0, iat= 651,1555, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  44 ARG  HN    107 VAL  QG1     5.56             (#peak  2580)
 &rst
  ixpk= 2580, nxpk= 0, iat= 651,  -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
 igr2=1576,1577,1578,
 &end
#
#  44 ARG  HN    107 VAL  QG2     4.65             (#peak   403)
 &rst
  ixpk= 403, nxpk= 0, iat= 651,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr2=1580,1581,1582,
 &end
#
#  44 ARG  HN     44 ARG  HD2     6.15             (#peak   560)
 &rst
  ixpk= 560, nxpk= 0, iat= 651, 661, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  44 ARG  HN     44 ARG  HD3     6.15             (#peak   566)
 &rst
  ixpk= 566, nxpk= 0, iat= 651, 662, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  44 ARG  HN     44 ARG  HG2     4.82             (#peak   469)
 &rst
  ixpk= 469, nxpk= 0, iat= 651, 658, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  44 ARG  HN     44 ARG  HG3     4.90             (#peak  2836)
 &rst
  ixpk= 2836, nxpk= 0, iat= 651, 659, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#  44 ARG  HN     44 ARG  QB      3.83             (#peak  2662)
 &rst
  ixpk= 2662, nxpk= 0, iat= 651,  -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
 igr2= 655, 656,
 &end
#
#  44 ARG  HN     45 GLY  HN      6.15             (#peak   557)
 &rst
  ixpk= 557, nxpk= 0, iat= 651, 675, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  44 ARG  HA    105 THR  HA      3.97             (#peak  4292)
 &rst
  ixpk= 4292, nxpk= 0, iat= 653,1541, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#  44 ARG  HA    107 VAL  QG1     5.90             (#peak  4283)
 &rst
  ixpk= 4283, nxpk= 0, iat= 653,  -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
 igr2=1576,1577,1578,
 &end
#
#  44 ARG  HA    107 VAL  QG2     5.84             (#peak  4282)
 &rst
  ixpk= 4282, nxpk= 0, iat= 653,  -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
 igr2=1580,1581,1582,
 &end
#
#  44 ARG  HA     44 ARG  HD2     6.15             (#peak  1532)
 &rst
  ixpk= 1532, nxpk= 0, iat= 653, 661, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  44 ARG  HA     44 ARG  HD3     6.15             (#peak  1535)
 &rst
  ixpk= 1535, nxpk= 0, iat= 653, 662, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  44 ARG  HA     44 ARG  HG2     3.80             (#peak  1531)
 &rst
  ixpk= 1531, nxpk= 0, iat= 653, 658, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  44 ARG  HA     44 ARG  QB      3.01             (#peak  2663)
 &rst
  ixpk= 2663, nxpk= 0, iat= 653,  -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr2= 655, 656,
 &end
#
#  44 ARG  HD3   105 THR  HA      6.07             (#peak  2093)
 &rst
  ixpk= 2093, nxpk= 0, iat= 662,1541, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,  &end
#
#  44 ARG  HD3   107 VAL  QG1     3.84             (#peak  4286)
 &rst
  ixpk= 4286, nxpk= 0, iat= 662,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr2=1576,1577,1578,
 &end
#
#  44 ARG  HD3   107 VAL  QG2     4.85             (#peak  4285)
 &rst
  ixpk= 4285, nxpk= 0, iat= 662,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2=1580,1581,1582,
 &end
#
#  44 ARG  HD3    45 GLY  HN      6.15             (#peak  1735)
 &rst
  ixpk= 1735, nxpk= 0, iat= 662, 675, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  44 ARG  HG2   105 THR  HA      5.23             (#peak   470)
 &rst
  ixpk= 470, nxpk= 0, iat= 658,1541, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
#  44 ARG  HG2    45 GLY  HN      4.82             (#peak   466)
 &rst
  ixpk= 466, nxpk= 0, iat= 658, 675, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  44 ARG  HG3   105 THR  HA      5.08             (#peak  1313)
 &rst
  ixpk= 1313, nxpk= 0, iat= 659,1541, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#  44 ARG  HG3   106 HIS  HN      6.00             (#peak  2842)
 &rst
  ixpk= 2842, nxpk= 0, iat= 659,1553, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
#  44 ARG  HG3    44 ARG  HD2     2.87             (#peak   637)
 &rst
  ixpk= 637, nxpk= 0, iat= 659, 661, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,  &end
#
#  44 ARG  HG3    45 GLY  HN      5.05             (#peak  2833)
 &rst
  ixpk= 2833, nxpk= 0, iat= 659, 675, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#  44 ARG  HG3    45 GLY  HA2     5.21             (#peak  4280)
 &rst
  ixpk= 4280, nxpk= 0, iat= 659, 677, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#  44 ARG  HG3    45 GLY  HA3     5.21             (#peak  4290)
 &rst
  ixpk= 4290, nxpk= 0, iat= 659, 678, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,  &end
#
#  44 ARG  QB    105 THR  HA      3.96             (#peak  4293)
 &rst
  ixpk= 4293, nxpk= 0, iat=  -1,1541, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 655, 656,
 &end
#
#  44 ARG  QB    106 HIS  HA      4.23             (#peak  4211)
 &rst
  ixpk= 4211, nxpk= 0, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
 igr1= 655, 656,
 &end
#
#  44 ARG  QB     44 ARG  HD2     3.00             (#peak  2661)
 &rst
  ixpk= 2661, nxpk= 0, iat=  -1, 661, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
 igr1= 655, 656,
 &end
#
#  44 ARG  QB     44 ARG  HD3     2.40             (#peak  2096)
 &rst
  ixpk= 2096, nxpk= 0, iat=  -1, 662, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr1= 655, 656,
 &end
#
#  44 ARG  QB     45 GLY  HN      4.12             (#peak  2659)
 &rst
  ixpk= 2659, nxpk= 0, iat=  -1, 675, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1= 655, 656,
 &end
#
#  44 ARG  QB     45 GLY  HA2     5.13             (#peak  4279)
 &rst
  ixpk= 4279, nxpk= 0, iat=  -1, 677, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr1= 655, 656,
 &end
#
#  44 ARG  QB     45 GLY  HA3     6.06             (#peak  4288)
 &rst
  ixpk= 4288, nxpk= 0, iat=  -1, 678, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1= 655, 656,
 &end
#
#  44 ARG  QB     46 ASP  HN      5.40             (#peak  2665)
 &rst
  ixpk= 2665, nxpk= 0, iat=  -1, 682, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 655, 656,
 &end
#
#  45 GLY  HN    105 THR  HA      6.15             (#peak  1793)
 &rst
  ixpk= 1793, nxpk= 0, iat= 675,1541, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  45 GLY  HN     46 ASP  HN      5.80             (#peak   960)
 &rst
  ixpk= 960, nxpk= 0, iat= 675, 682, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
#  46 ASP  HN    104 ALA  QB      5.24             (#peak  3484)
 &rst
  ixpk= 3484, nxpk= 0, iat= 682,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr2=1533,1534,1535,
 &end
#
#  46 ASP  HN     46 ASP  HB2     3.94             (#peak  1853)
 &rst
  ixpk= 1853, nxpk= 0, iat= 682, 686, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  46 ASP  HN     47 ILE  HN      6.15             (#peak  1710)
 &rst
  ixpk= 1710, nxpk= 0, iat= 682, 694, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  46 ASP  HN     48 ILE  QD1     5.97             (#peak   494)
 &rst
  ixpk= 494, nxpk= 0, iat= 682,  -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
 igr2= 726, 727, 728,
 &end
#
#  46 ASP  HA     47 ILE  HN      2.86             (#peak   696)
 &rst
  ixpk= 696, nxpk= 0, iat= 684, 694, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,  &end
#
#  46 ASP  HA     48 ILE  QD1     5.08             (#peak   690)
 &rst
  ixpk= 690, nxpk= 0, iat= 684,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr2= 726, 727, 728,
 &end
#
#  46 ASP  HB2    47 ILE  HN      4.57             (#peak  1856)
 &rst
  ixpk= 1856, nxpk= 0, iat= 686, 694, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  46 ASP  HB2    48 ILE  QD1     3.60             (#peak  1849)
 &rst
  ixpk= 1849, nxpk= 0, iat= 686,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2= 726, 727, 728,
 &end
#
#  46 ASP  HB2    48 ILE  QG1     4.84             (#peak  1851)
 &rst
  ixpk= 1851, nxpk= 0, iat= 686,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2= 723, 724,
 &end
#
#  46 ASP  HB3    47 ILE  HN      3.85             (#peak  3581)
 &rst
  ixpk= 3581, nxpk= 0, iat= 687, 694, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#  46 ASP  HB3    48 ILE  QD1     3.65             (#peak  3575)
 &rst
  ixpk= 3575, nxpk= 0, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2= 726, 727, 728,
 &end
#
#  46 ASP  HB3    48 ILE  QG1     4.85             (#peak  3577)
 &rst
  ixpk= 3577, nxpk= 0, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr2= 723, 724,
 &end
#
#  47 ILE  HN     47 ILE  HB      3.90             (#peak  1120)
 &rst
  ixpk= 1120, nxpk= 0, iat= 694, 698, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#  47 ILE  HN     47 ILE  HG12    4.52             (#peak  2916)
 &rst
  ixpk= 2916, nxpk= 0, iat= 694, 704, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  47 ILE  HN     47 ILE  HG13    4.57             (#peak  2274)
 &rst
  ixpk= 2274, nxpk= 0, iat= 694, 705, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,  &end
#
#  47 ILE  HN     47 ILE  QD1     4.37             (#peak  2351)
 &rst
  ixpk= 2351, nxpk= 0, iat= 694,  -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
 igr2= 707, 708, 709,
 &end
#
#  47 ILE  HN     47 ILE  QG2     4.39             (#peak   714)
 &rst
  ixpk= 714, nxpk= 0, iat= 694,  -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr2= 700, 701, 702,
 &end
#
#  47 ILE  HA    103 CYS  HA      4.37             (#peak   222)
 &rst
  ixpk= 222, nxpk= 0, iat= 696,1520, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  47 ILE  HA    104 ALA  HN      4.64             (#peak   230)
 &rst
  ixpk= 230, nxpk= 0, iat= 696,1529, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  47 ILE  HA    104 ALA  QB      4.64             (#peak  3879)
 &rst
  ixpk= 3879, nxpk= 0, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
 igr2=1533,1534,1535,
 &end
#
#  47 ILE  HA     47 ILE  HG12    4.03             (#peak   229)
 &rst
  ixpk= 229, nxpk= 0, iat= 696, 704, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  47 ILE  HA     47 ILE  HG13    3.72             (#peak  2266)
 &rst
  ixpk= 2266, nxpk= 0, iat= 696, 705, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
#  47 ILE  HA     47 ILE  QD1     4.69             (#peak   228)
 &rst
  ixpk= 228, nxpk= 0, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2= 707, 708, 709,
 &end
#
#  47 ILE  HA     47 ILE  QG2     2.97             (#peak   223)
 &rst
  ixpk= 223, nxpk= 0, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2= 700, 701, 702,
 &end
#
#  47 ILE  HA     48 ILE  HN      3.12             (#peak   226)
 &rst
  ixpk= 226, nxpk= 0, iat= 696, 713, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  47 ILE  HA     48 ILE  QG1     4.01             (#peak   911)
 &rst
  ixpk= 911, nxpk= 0, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 723, 724,
 &end
#
#  47 ILE  HB     47 ILE  QD1     3.61             (#peak  1118)
 &rst
  ixpk= 1118, nxpk= 0, iat= 698,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr2= 707, 708, 709,
 &end
#
#  47 ILE  HB     48 ILE  HN      5.16             (#peak  1116)
 &rst
  ixpk= 1116, nxpk= 0, iat= 698, 713, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,  &end
#
#  47 ILE  HG12  103 CYS  HA      5.46             (#peak  2908)
 &rst
  ixpk= 2908, nxpk= 0, iat= 704,1520, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
#  47 ILE  HG12  103 CYS  HB2     6.15             (#peak  4044)
 &rst
  ixpk= 4044, nxpk= 0, iat= 704,1522, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  47 ILE  HG12  103 CYS  HB3     5.04             (#peak  4043)
 &rst
  ixpk= 4043, nxpk= 0, iat= 704,1523, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
#  47 ILE  HG12   48 ILE  HN      5.45             (#peak  2912)
 &rst
  ixpk= 2912, nxpk= 0, iat= 704, 713, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,  &end
#
#  47 ILE  HG13  103 CYS  HB2     6.15             (#peak  1738)
 &rst
  ixpk= 1738, nxpk= 0, iat= 705,1522, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  47 ILE  HG13  103 CYS  HB3     5.67             (#peak  4045)
 &rst
  ixpk= 4045, nxpk= 0, iat= 705,1523, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,  &end
#
#  47 ILE  QD1   103 CYS  HB2     4.61             (#peak  2347)
 &rst
  ixpk= 2347, nxpk= 0, iat=  -1,1522, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1= 707, 708, 709,
 &end
#
#  47 ILE  QD1   103 CYS  HB3     4.43             (#peak  2343)
 &rst
  ixpk= 2343, nxpk= 0, iat=  -1,1523, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 707, 708, 709,
 &end
#
#  47 ILE  QG2   103 CYS  HA      4.26             (#peak   707)
 &rst
  ixpk= 707, nxpk= 0, iat=  -1,1520, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr1= 700, 701, 702,
 &end
#
#  47 ILE  QG2    47 ILE  HG12    3.27             (#peak   713)
 &rst
  ixpk= 713, nxpk= 0, iat=  -1, 704, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 700, 701, 702,
 &end
#
#  47 ILE  QG2    47 ILE  HG13    3.31             (#peak  2268)
 &rst
  ixpk= 2268, nxpk= 0, iat=  -1, 705, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr1= 700, 701, 702,
 &end
#
#  47 ILE  QG2    47 ILE  QD1     2.40             (#peak   712)
 &rst
  ixpk= 712, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1= 700, 701, 702,
 igr2= 707, 708, 709,
 &end
#
#  47 ILE  QG2    48 ILE  HN      3.32             (#peak   710)
 &rst
  ixpk= 710, nxpk= 0, iat=  -1, 713, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr1= 700, 701, 702,
 &end
#
#  47 ILE  QG2    48 ILE  HA      4.02             (#peak   210)
 &rst
  ixpk= 210, nxpk= 0, iat=  -1, 715, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr1= 700, 701, 702,
 &end
#
#  48 ILE  HN    102 ILE  HN      6.15             (#peak  1327)
 &rst
  ixpk= 1327, nxpk= 0, iat= 713,1499, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  48 ILE  HN    103 CYS  HA      4.60             (#peak   544)
 &rst
  ixpk= 544, nxpk= 0, iat= 713,1520, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#  48 ILE  HN     48 ILE  HB      3.71             (#peak  3091)
 &rst
  ixpk= 3091, nxpk= 0, iat= 713, 717, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,  &end
#
#  48 ILE  HN     48 ILE  QD1     3.90             (#peak   493)
 &rst
  ixpk= 493, nxpk= 0, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2= 726, 727, 728,
 &end
#
#  48 ILE  HN     48 ILE  QG1     3.53             (#peak   915)
 &rst
  ixpk= 915, nxpk= 0, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr2= 723, 724,
 &end
#
#  48 ILE  HN     48 ILE  QG2     6.15             (#peak  2688)
 &rst
  ixpk= 2688, nxpk= 0, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 719, 720, 721,
 &end
#
#  48 ILE  HN     49 LYS  HN      6.15             (#peak  1062)
 &rst
  ixpk= 1062, nxpk= 0, iat= 713, 732, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  48 ILE  HA     48 ILE  QD1     2.94             (#peak   488)
 &rst
  ixpk= 488, nxpk= 0, iat= 715,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 726, 727, 728,
 &end
#
#  48 ILE  HA     48 ILE  QG1     3.42             (#peak   211)
 &rst
  ixpk= 211, nxpk= 0, iat= 715,  -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
 igr2= 723, 724,
 &end
#
#  48 ILE  HA     48 ILE  QG2     2.91             (#peak  2684)
 &rst
  ixpk= 2684, nxpk= 0, iat= 715,  -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
 igr2= 719, 720, 721,
 &end
#
#  48 ILE  HA     49 LYS  HN      3.12             (#peak   215)
 &rst
  ixpk= 215, nxpk= 0, iat= 715, 732, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,  &end
#
#  48 ILE  HB     48 ILE  QD1     3.76             (#peak  3089)
 &rst
  ixpk= 3089, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr2= 726, 727, 728,
 &end
#
#  48 ILE  HB     48 ILE  QG1     2.82             (#peak   918)
 &rst
  ixpk= 918, nxpk= 0, iat= 717,  -1, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,
 igr2= 723, 724,
 &end
#
#  48 ILE  HB     49 LYS  HN      6.15             (#peak  1067)
 &rst
  ixpk= 1067, nxpk= 0, iat= 717, 732, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  48 ILE  QD1   104 ALA  HN      6.15             (#peak  1725)
 &rst
  ixpk= 1725, nxpk= 0, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 726, 727, 728,
 &end
#
#  48 ILE  QD1    49 LYS  HN      4.71             (#peak   497)
 &rst
  ixpk= 497, nxpk= 0, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1= 726, 727, 728,
 &end
#
#  48 ILE  QG1   104 ALA  HN      6.15             (#peak  1727)
 &rst
  ixpk= 1727, nxpk= 0, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1= 723, 724,
 &end
#
#  48 ILE  QG1    49 LYS  HN      4.93             (#peak   917)
 &rst
  ixpk= 917, nxpk= 0, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 723, 724,
 &end
#
#  48 ILE  QG2   104 ALA  HN      6.15             (#peak  1726)
 &rst
  ixpk= 1726, nxpk= 0, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 719, 720, 721,
 &end
#
#  48 ILE  QG2    48 ILE  QD1     2.40             (#peak  2685)
 &rst
  ixpk= 2685, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1= 719, 720, 721,
 igr2= 726, 727, 728,
 &end
#
#  48 ILE  QG2    48 ILE  QG1     2.40             (#peak  2686)
 &rst
  ixpk= 2686, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 719, 720, 721,
 igr2= 723, 724,
 &end
#
#  48 ILE  QG2    49 LYS  HN      3.63             (#peak  2692)
 &rst
  ixpk= 2692, nxpk= 0, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
 igr1= 719, 720, 721,
 &end
#
#  49 LYS  HN     49 LYS  HE3     6.15             (#peak    41)
 &rst
  ixpk= 41, nxpk= 0, iat= 732, 746, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  49 LYS  HN     49 LYS  QB      4.09             (#peak  2188)
 &rst
  ixpk= 2188, nxpk= 0, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2= 736, 737,
 &end
#
#  49 LYS  HN     49 LYS  QD      5.45             (#peak  2746)
 &rst
  ixpk= 2746, nxpk= 0, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2= 742, 743,
 &end
#
#  49 LYS  HN     49 LYS  QG      4.79             (#peak   555)
 &rst
  ixpk= 555, nxpk= 0, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr2= 739, 740,
 &end
#
#  49 LYS  HN     50 VAL  HN      6.15             (#peak  1063)
 &rst
  ixpk= 1063, nxpk= 0, iat= 732, 754, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  49 LYS  HA    101 LEU  HA      3.95             (#peak   960)
 &rst
  ixpk= 960, nxpk= 0, iat= 734,1482, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  49 LYS  HA    101 LEU  HG      6.15             (#peak  3326)
 &rst
  ixpk= 3326, nxpk= 0, iat= 734,1487, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  49 LYS  HA    101 LEU  QD2     6.15             (#peak  3867)
 &rst
  ixpk= 3867, nxpk= 0, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1493,1494,1495,
 &end
#
#  49 LYS  HA    102 ILE  HN      4.52             (#peak  3334)
 &rst
  ixpk= 3334, nxpk= 0, iat= 734,1499, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  49 LYS  HA     49 LYS  HE2     4.92             (#peak  1597)
 &rst
  ixpk= 1597, nxpk= 0, iat= 734, 745, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  49 LYS  HA     49 LYS  HE3     4.41             (#peak    42)
 &rst
  ixpk= 42, nxpk= 0, iat= 734, 746, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
#  49 LYS  HA     49 LYS  QD      4.01             (#peak  2748)
 &rst
  ixpk= 2748, nxpk= 0, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2= 742, 743,
 &end
#
#  49 LYS  HA     49 LYS  QG      3.82             (#peak   556)
 &rst
  ixpk= 556, nxpk= 0, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2= 739, 740,
 &end
#
#  49 LYS  HA     50 VAL  HN      3.19             (#peak  3331)
 &rst
  ixpk= 3331, nxpk= 0, iat= 734, 754, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
#  49 LYS  HE2   101 LEU  QD1     3.37             (#peak  2066)
 &rst
  ixpk= 2066, nxpk= 0, iat= 745,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=1489,1490,1491,
 &end
#
#  49 LYS  HE2    50 VAL  HN      6.15             (#peak   937)
 &rst
  ixpk= 937, nxpk= 0, iat= 745, 754, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  49 LYS  HE3   101 LEU  HG      4.84             (#peak    34)
 &rst
  ixpk= 34, nxpk= 0, iat= 746,1487, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#  49 LYS  HE3   101 LEU  QD1     3.36             (#peak  2062)
 &rst
  ixpk= 2062, nxpk= 0, iat= 746,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2=1489,1490,1491,
 &end
#
#  49 LYS  HE3   101 LEU  QD2     3.42             (#peak    43)
 &rst
  ixpk= 43, nxpk= 0, iat= 746,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2=1493,1494,1495,
 &end
#
#  49 LYS  HE3    50 VAL  HN      6.15             (#peak   931)
 &rst
  ixpk= 931, nxpk= 0, iat= 746, 754, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  49 LYS  QB    101 LEU  QD1     5.43             (#peak  2184)
 &rst
  ixpk= 2184, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
 igr1= 736, 737,
 igr2=1489,1490,1491,
 &end
#
#  49 LYS  QB    101 LEU  QD2     6.15             (#peak  2190)
 &rst
  ixpk= 2190, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
 igr1= 736, 737,
 igr2=1493,1494,1495,
 &end
#
#  49 LYS  QB     49 LYS  HE2     4.69             (#peak  1593)
 &rst
  ixpk= 1593, nxpk= 0, iat=  -1, 745, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1= 736, 737,
 &end
#
#  49 LYS  QB     49 LYS  HE3     4.29             (#peak    38)
 &rst
  ixpk= 38, nxpk= 0, iat=  -1, 746, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr1= 736, 737,
 &end
#
#  49 LYS  QB     49 LYS  QD      3.07             (#peak  2187)
 &rst
  ixpk= 2187, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr1= 736, 737,
 igr2= 742, 743,
 &end
#
#  49 LYS  QB     49 LYS  QG      2.40             (#peak   552)
 &rst
  ixpk= 552, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1= 736, 737,
 igr2= 739, 740,
 &end
#
#  49 LYS  QB     50 VAL  HN      4.87             (#peak   939)
 &rst
  ixpk= 939, nxpk= 0, iat=  -1, 754, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
 igr1= 736, 737,
 &end
#
#  49 LYS  QD    101 LEU  QD1     4.66             (#peak  2742)
 &rst
  ixpk= 2742, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 742, 743,
 igr2=1489,1490,1491,
 &end
#
#  49 LYS  QD    101 LEU  QD2     4.66             (#peak  2749)
 &rst
  ixpk= 2749, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
 igr1= 742, 743,
 igr2=1493,1494,1495,
 &end
#
#  49 LYS  QD     50 VAL  HN      5.41             (#peak  2744)
 &rst
  ixpk= 2744, nxpk= 0, iat=  -1, 754, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 742, 743,
 &end
#
#  49 LYS  QG    101 LEU  QD1     4.96             (#peak   551)
 &rst
  ixpk= 551, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr1= 739, 740,
 igr2=1489,1490,1491,
 &end
#
#  49 LYS  QG    101 LEU  QD2     5.70             (#peak   557)
 &rst
  ixpk= 557, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.68, r4= 8.18,
 igr1= 739, 740,
 igr2=1493,1494,1495,
 &end
#
#  49 LYS  QG     49 LYS  HE2     3.62             (#peak  1590)
 &rst
  ixpk= 1590, nxpk= 0, iat=  -1, 745, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
 igr1= 739, 740,
 &end
#
#  49 LYS  QG     49 LYS  HE3     4.18             (#peak    35)
 &rst
  ixpk= 35, nxpk= 0, iat=  -1, 746, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
 igr1= 739, 740,
 &end
#
#  49 LYS  QG     49 LYS  QD      2.40             (#peak   554)
 &rst
  ixpk= 554, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1= 739, 740,
 igr2= 742, 743,
 &end
#
#  49 LYS  QG     50 VAL  HN      4.62             (#peak   553)
 &rst
  ixpk= 553, nxpk= 0, iat=  -1, 754, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr1= 739, 740,
 &end
#
#  50 VAL  HN    100 LEU  HN      6.15             (#peak   935)
 &rst
  ixpk= 935, nxpk= 0, iat= 754,1461, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 50 VAL   HN    100 LEU  O       2.4
 &rst
  ixpk= 935, nxpk= 0, iat= 754,1478, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#  50 VAL  HN    101 LEU  HA      6.15             (#peak   955)
 &rst
  ixpk= 955, nxpk= 0, iat= 754,1482, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  50 VAL  HN     50 VAL  HB      3.73             (#peak  2590)
 &rst
  ixpk= 2590, nxpk= 0, iat= 754, 758, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,  &end
#
#  50 VAL  HN     50 VAL  QG1     4.19             (#peak   417)
 &rst
  ixpk= 417, nxpk= 0, iat= 754,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2= 760, 761, 762,
 &end
#
#  50 VAL  HN     50 VAL  QG2     4.13             (#peak  2012)
 &rst
  ixpk= 2012, nxpk= 0, iat= 754,  -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
 igr2= 764, 765, 766,
 &end
#
#  50 VAL  HN     51 VAL  HN      6.15             (#peak   936)
 &rst
  ixpk= 936, nxpk= 0, iat= 754, 770, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  50 VAL  HA     50 VAL  QG1     3.42             (#peak  2327)
 &rst
  ixpk= 2327, nxpk= 0, iat= 756,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr2= 760, 761, 762,
 &end
#
#  50 VAL  HA     50 VAL  QG2     2.76             (#peak  2013)
 &rst
  ixpk= 2013, nxpk= 0, iat= 756,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2= 764, 765, 766,
 &end
#
#  50 VAL  HA     51 VAL  HN      3.49             (#peak  2328)
 &rst
  ixpk= 2328, nxpk= 0, iat= 756, 770, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  50 VAL  HB    102 ILE  HN      5.03             (#peak  2593)
 &rst
  ixpk= 2593, nxpk= 0, iat= 758,1499, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
#  50 VAL  HB     51 VAL  HN      4.50             (#peak  2588)
 &rst
  ixpk= 2588, nxpk= 0, iat= 758, 770, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 50 VAL   N     100 LEU  O       3.3
 &rst
  ixpk= 2588, nxpk= 0, iat= 753,1478, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
#  50 VAL  QG1   100 LEU  QD1     3.80             (#peak  3468)
 &rst
  ixpk= 3468, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1= 760, 761, 762,
 igr2=1470,1471,1472,
 &end
#
#  50 VAL  QG1    51 VAL  HN      4.20             (#peak   415)
 &rst
  ixpk= 415, nxpk= 0, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr1= 760, 761, 762,
 &end
#
#  50 VAL  QG1    54 GLY  HN      6.15             (#peak  1446)
 &rst
  ixpk= 1446, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 760, 761, 762,
 &end
#
#  50 VAL  QG1    54 GLY  HA3     6.15             (#peak   776)
 &rst
  ixpk= 776, nxpk= 0, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 760, 761, 762,
 &end
#
#  50 VAL  QG1    95 ASN  HD21    4.44             (#peak   424)
 &rst
  ixpk= 424, nxpk= 0, iat=  -1,1407, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr1= 760, 761, 762,
 &end
#
#  50 VAL  QG1    95 ASN  HD22    5.30             (#peak   411)
 &rst
  ixpk= 411, nxpk= 0, iat=  -1,1408, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 760, 761, 762,
 &end
#
#  50 VAL  QG2   100 LEU  HN      6.15             (#peak  1880)
 &rst
  ixpk= 1880, nxpk= 0, iat=  -1,1461, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2   100 LEU  QD1     4.59             (#peak  3474)
 &rst
  ixpk= 3474, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1= 764, 765, 766,
 igr2=1470,1471,1472,
 &end
#
#  50 VAL  QG2   102 ILE  QD1     3.96             (#peak  2011)
 &rst
  ixpk= 2011, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 764, 765, 766,
 igr2=1512,1513,1514,
 &end
#
#  50 VAL  QG2    51 VAL  HN      3.77             (#peak  2008)
 &rst
  ixpk= 2008, nxpk= 0, iat=  -1, 770, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2    54 GLY  HN      4.22             (#peak  2019)
 &rst
  ixpk= 2019, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2    54 GLY  HA2     6.15             (#peak  2433)
 &rst
  ixpk= 2433, nxpk= 0, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2    54 GLY  HA3     6.15             (#peak  2006)
 &rst
  ixpk= 2006, nxpk= 0, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2    55 LYS  HN      4.53             (#peak  2009)
 &rst
  ixpk= 2009, nxpk= 0, iat=  -1, 814, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2    95 ASN  HN      4.89             (#peak  2007)
 &rst
  ixpk= 2007, nxpk= 0, iat=  -1,1398, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2    95 ASN  HB2     3.50             (#peak  3559)
 &rst
  ixpk= 3559, nxpk= 0, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2    95 ASN  HB3     3.60             (#peak  2621)
 &rst
  ixpk= 2621, nxpk= 0, iat=  -1,1403, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2    95 ASN  HD21    4.43             (#peak  2021)
 &rst
  ixpk= 2021, nxpk= 0, iat=  -1,1407, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
 igr1= 764, 765, 766,
 &end
#
#  50 VAL  QG2    95 ASN  HD22    5.17             (#peak  2004)
 &rst
  ixpk= 2004, nxpk= 0, iat=  -1,1408, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
 igr1= 764, 765, 766,
 &end
#
#  51 VAL  HN     51 VAL  HB      4.20             (#peak  3237)
 &rst
  ixpk= 3237, nxpk= 0, iat= 770, 774, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  51 VAL  HN     51 VAL  QG1     3.04             (#peak  1074)
 &rst
  ixpk= 1074, nxpk= 0, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2= 776, 777, 778,
 &end
#
#  51 VAL  HN     51 VAL  QG2     4.03             (#peak  2859)
 &rst
  ixpk= 2859, nxpk= 0, iat= 770,  -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr2= 780, 781, 782,
 &end
#
#  51 VAL  HA    100 LEU  HN      5.71             (#peak  3022)
 &rst
  ixpk= 3022, nxpk= 0, iat= 772,1461, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,  &end
#
#  51 VAL  HA     51 VAL  QG1     2.78             (#peak  1076)
 &rst
  ixpk= 1076, nxpk= 0, iat= 772,  -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr2= 776, 777, 778,
 &end
#
#  51 VAL  HA     51 VAL  QG2     3.43             (#peak  3025)
 &rst
  ixpk= 3025, nxpk= 0, iat= 772,  -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
 igr2= 780, 781, 782,
 &end
#
#  51 VAL  HA     99 SER  HA      4.71             (#peak  3020)
 &rst
  ixpk= 3020, nxpk= 0, iat= 772,1452, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  51 VAL  QG1    54 GLY  HN      6.15             (#peak  1448)
 &rst
  ixpk= 1448, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 776, 777, 778,
 &end
#
#  51 VAL  QG2    53 GLY  HA2     5.49             (#peak  2969)
 &rst
  ixpk= 2969, nxpk= 0, iat=  -1, 802, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
 igr1= 780, 781, 782,
 &end
#
#  51 VAL  QG2    53 GLY  HA3     4.58             (#peak  1157)
 &rst
  ixpk= 1157, nxpk= 0, iat=  -1, 803, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 780, 781, 782,
 &end
#
#  51 VAL  QG2    54 GLY  HN      4.86             (#peak  2864)
 &rst
  ixpk= 2864, nxpk= 0, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr1= 780, 781, 782,
 &end
#
#  52 PRO  HA     53 GLY  HN      3.10             (#peak  3438)
 &rst
  ixpk= 3438, nxpk= 0, iat= 796, 800, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#  52 PRO  HA     95 ASN  HD21    4.59             (#peak  3440)
 &rst
  ixpk= 3440, nxpk= 0, iat= 796,1407, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  52 PRO  HA     95 ASN  HD22    4.70             (#peak  3435)
 &rst
  ixpk= 3435, nxpk= 0, iat= 796,1408, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  52 PRO  HA     97 ASN  HA      6.03             (#peak  4233)
 &rst
  ixpk= 4233, nxpk= 0, iat= 796,1431, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,  &end
#
#  52 PRO  QB     97 ASN  HA      4.64             (#peak  4234)
 &rst
  ixpk= 4234, nxpk= 0, iat=  -1,1431, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
 igr1= 793, 794,
 &end
#
#  52 PRO  QG     97 ASN  HA      5.95             (#peak  4215)
 &rst
  ixpk= 4215, nxpk= 0, iat=  -1,1431, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
 igr1= 790, 791,
 &end
#
#  53 GLY  HN     54 GLY  HN      4.26             (#peak  1233)
 &rst
  ixpk= 1233, nxpk= 0, iat= 800, 807, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  53 GLY  HN     94 ILE  QG2     6.15             (#peak  1224)
 &rst
  ixpk= 1224, nxpk= 0, iat= 800,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1385,1386,1387,
 &end
#
#  53 GLY  HN     95 ASN  HB3     4.72             (#peak  2625)
 &rst
  ixpk= 2625, nxpk= 0, iat= 800,1403, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#  53 GLY  HN     95 ASN  HD21    6.15             (#peak  1516)
 &rst
  ixpk= 1516, nxpk= 0, iat= 800,1407, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  53 GLY  HN     95 ASN  HD22    6.15             (#peak  1225)
 &rst
  ixpk= 1225, nxpk= 0, iat= 800,1408, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  53 GLY  HN     96 GLN  HA      4.97             (#peak  3379)
 &rst
  ixpk= 3379, nxpk= 0, iat= 800,1414, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#  53 GLY  HA2    94 ILE  QG2     4.06             (#peak  2966)
 &rst
  ixpk= 2966, nxpk= 0, iat= 802,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1385,1386,1387,
 &end
#
#  53 GLY  HA2    96 GLN  HA      4.10             (#peak  3377)
 &rst
  ixpk= 3377, nxpk= 0, iat= 802,1414, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
#  53 GLY  HA3    94 ILE  QG2     5.60             (#peak  1154)
 &rst
  ixpk= 1154, nxpk= 0, iat= 803,  -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
 igr2=1385,1386,1387,
 &end
#
#  53 GLY  HA3    95 ASN  HN      6.15             (#peak   402)
 &rst
  ixpk= 402, nxpk= 0, iat= 803,1398, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  53 GLY  HA3    96 GLN  HA      5.34             (#peak  3372)
 &rst
  ixpk= 3372, nxpk= 0, iat= 803,1414, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,  &end
#
#  54 GLY  HN     95 ASN  HN      6.15             (#peak  1799)
 &rst
  ixpk= 1799, nxpk= 0, iat= 807,1398, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  54 GLY  HN     95 ASN  HB2     6.01             (#peak  3565)
 &rst
  ixpk= 3565, nxpk= 0, iat= 807,1402, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,  &end
#
#  54 GLY  HN     95 ASN  HB3     4.64             (#peak  2626)
 &rst
  ixpk= 2626, nxpk= 0, iat= 807,1403, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
#  54 GLY  HN     95 ASN  HD21    6.15             (#peak  1518)
 &rst
  ixpk= 1518, nxpk= 0, iat= 807,1407, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  54 GLY  HN     95 ASN  HD22    6.15             (#peak  1445)
 &rst
  ixpk= 1445, nxpk= 0, iat= 807,1408, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  54 GLY  HA3    55 LYS  HN      3.40             (#peak   778)
 &rst
  ixpk= 778, nxpk= 0, iat= 810, 814, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
#  55 LYS  HN     55 LYS  HG2     4.54             (#peak  3051)
 &rst
  ixpk= 3051, nxpk= 0, iat= 814, 821, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  55 LYS  HN     55 LYS  HG3     4.18             (#peak   854)
 &rst
  ixpk= 854, nxpk= 0, iat= 814, 822, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  55 LYS  HN     55 LYS  QB      3.80             (#peak  1709)
 &rst
  ixpk= 1709, nxpk= 0, iat= 814,  -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
 igr2= 818, 819,
 &end
#
#  55 LYS  HN     55 LYS  QD      5.51             (#peak  1275)
 &rst
  ixpk= 1275, nxpk= 0, iat= 814,  -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr2= 824, 825,
 &end
#
#  55 LYS  HN     55 LYS  QE      6.15             (#peak   733)
 &rst
  ixpk= 733, nxpk= 0, iat= 814,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2= 827, 828,
 &end
#
#  55 LYS  HN     56 PHE  HN      6.15             (#peak   732)
 &rst
  ixpk= 732, nxpk= 0, iat= 814, 836, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  55 LYS  HN     94 ILE  HA      5.36             (#peak   935)
 &rst
  ixpk= 935, nxpk= 0, iat= 814,1381, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#  55 LYS  HN     94 ILE  QG2     4.80             (#peak   246)
 &rst
  ixpk= 246, nxpk= 0, iat= 814,  -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
 igr2=1385,1386,1387,
 &end
#
#  55 LYS  HA     55 LYS  HG2     3.95             (#peak  3052)
 &rst
  ixpk= 3052, nxpk= 0, iat= 816, 821, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,  &end
#
#  55 LYS  HA     55 LYS  HG3     3.53             (#peak  1758)
 &rst
  ixpk= 1758, nxpk= 0, iat= 816, 822, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,  &end
#
#  55 LYS  HA     55 LYS  QD      4.82             (#peak  1761)
 &rst
  ixpk= 1761, nxpk= 0, iat= 816,  -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
 igr2= 824, 825,
 &end
#
#  55 LYS  HA     55 LYS  QE      5.19             (#peak  1768)
 &rst
  ixpk= 1768, nxpk= 0, iat= 816,  -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
 igr2= 827, 828,
 &end
#
#  55 LYS  HA     56 PHE  HN      3.36             (#peak  1767)
 &rst
  ixpk= 1767, nxpk= 0, iat= 816, 836, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,  &end
#
#  55 LYS  HA     56 PHE  QD      5.40             (#peak  1760)
 &rst
  ixpk= 1760, nxpk= 0, iat= 816,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr2= 844, 852,
 &end
#
#  55 LYS  HA     94 ILE  HA      3.52             (#peak   936)
 &rst
  ixpk= 936, nxpk= 0, iat= 816,1381, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,  &end
#
#  55 LYS  HA     94 ILE  QG1     5.48             (#peak  2415)
 &rst
  ixpk= 2415, nxpk= 0, iat= 816,  -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr2=1389,1390,
 &end
#
#  55 LYS  HA     94 ILE  QG2     3.72             (#peak   247)
 &rst
  ixpk= 247, nxpk= 0, iat= 816,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2=1385,1386,1387,
 &end
#
#  55 LYS  HG2    55 LYS  QE      3.08             (#peak  3456)
 &rst
  ixpk= 3456, nxpk= 0, iat= 821,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr2= 827, 828,
 &end
#
#  55 LYS  HG2    56 PHE  HN      6.15             (#peak  3054)
 &rst
  ixpk= 3054, nxpk= 0, iat= 821, 836, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  55 LYS  HG2    94 ILE  QG2     3.40             (#peak   251)
 &rst
  ixpk= 251, nxpk= 0, iat= 821,  -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
 igr2=1385,1386,1387,
 &end
#
#  55 LYS  HG3    55 LYS  QE      3.18             (#peak  3451)
 &rst
  ixpk= 3451, nxpk= 0, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
 igr2= 827, 828,
 &end
#
#  55 LYS  HG3    56 PHE  HN      5.05             (#peak   857)
 &rst
  ixpk= 857, nxpk= 0, iat= 822, 836, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,  &end
#
#  55 LYS  HG3    94 ILE  QG2     3.61             (#peak   850)
 &rst
  ixpk= 850, nxpk= 0, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr2=1385,1386,1387,
 &end
#
#  55 LYS  QB     55 LYS  HG2     2.89             (#peak  1711)
 &rst
  ixpk= 1711, nxpk= 0, iat=  -1, 821, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1= 818, 819,
 &end
#
#  55 LYS  QB     55 LYS  QD      2.40             (#peak  1707)
 &rst
  ixpk= 1707, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1= 818, 819,
 igr2= 824, 825,
 &end
#
#  55 LYS  QB     55 LYS  QE      3.69             (#peak  3453)
 &rst
  ixpk= 3453, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 818, 819,
 igr2= 827, 828,
 &end
#
#  55 LYS  QB     56 PHE  HN      5.84             (#peak  1419)
 &rst
  ixpk= 1419, nxpk= 0, iat=  -1, 836, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
 igr1= 818, 819,
 &end
#
#  55 LYS  QB     94 ILE  HA      4.19             (#peak   934)
 &rst
  ixpk= 934, nxpk= 0, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr1= 818, 819,
 &end
#
#  55 LYS  QB     94 ILE  QG2     4.14             (#peak   245)
 &rst
  ixpk= 245, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1= 818, 819,
 igr2=1385,1386,1387,
 &end
#
#  55 LYS  QD     94 ILE  QG2     4.10             (#peak  1271)
 &rst
  ixpk= 1271, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
 igr1= 824, 825,
 igr2=1385,1386,1387,
 &end
#
#  55 LYS  QE     94 ILE  QG2     3.11             (#peak   253)
 &rst
  ixpk= 253, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr1= 827, 828,
 igr2=1385,1386,1387,
 &end
#
#  56 PHE  HN     56 PHE  QE      6.15             (#peak  1423)
 &rst
  ixpk= 1423, nxpk= 0, iat= 836,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2= 846, 850,
 &end
#
#  56 PHE  HN     92 GLY  HN      6.15             (#peak  1810)
 &rst
  ixpk= 1810, nxpk= 0, iat= 836,1361, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  56 PHE  HN     93 SER  HN      6.15             (#peak  1422)
 &rst
  ixpk= 1422, nxpk= 0, iat= 836,1368, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  56 PHE  HA     56 PHE  QD      3.82             (#peak  1186)
 &rst
  ixpk= 1186, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
 igr2= 844, 852,
 &end
#
#  56 PHE  HA     56 PHE  QE      5.61             (#peak  1190)
 &rst
  ixpk= 1190, nxpk= 0, iat= 838,  -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr2= 846, 850,
 &end
#
#  56 PHE  HA     57 PRO  HD2     3.60             (#peak  1184)
 &rst
  ixpk= 1184, nxpk= 0, iat= 838, 857, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,  &end
#
#  56 PHE  HA     57 PRO  HD3     3.31             (#peak  2572)
 &rst
  ixpk= 2572, nxpk= 0, iat= 838, 858, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,  &end
#
#  56 PHE  HA     91 ALA  HA      5.77             (#peak  4359)
 &rst
  ixpk= 4359, nxpk= 0, iat= 838,1353, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,  &end
#
#  56 PHE  HA     92 GLY  HN      6.15             (#peak  1809)
 &rst
  ixpk= 1809, nxpk= 0, iat= 838,1361, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  56 PHE  HB2    91 ALA  HA      3.99             (#peak  1208)
 &rst
  ixpk= 1208, nxpk= 0, iat= 840,1353, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  56 PHE  HB2    91 ALA  QB      5.11             (#peak  4069)
 &rst
  ixpk= 4069, nxpk= 0, iat= 840,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr2=1355,1356,1357,
 &end
#
#  56 PHE  HB2    93 SER  QB      5.32             (#peak  1206)
 &rst
  ixpk= 1206, nxpk= 0, iat= 840,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1372,1373,
 &end
#
#  56 PHE  HB3    57 PRO  HD2     4.31             (#peak  3000)
 &rst
  ixpk= 3000, nxpk= 0, iat= 841, 857, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,  &end
#
#  56 PHE  HB3    57 PRO  HD3     5.12             (#peak  4101)
 &rst
  ixpk= 4101, nxpk= 0, iat= 841, 858, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,  &end
#
#  56 PHE  HB3    58 VAL  HN      4.09             (#peak  3009)
 &rst
  ixpk= 3009, nxpk= 0, iat= 841, 870, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
#  56 PHE  HB3    91 ALA  HA      4.35             (#peak  3005)
 &rst
  ixpk= 3005, nxpk= 0, iat= 841,1353, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,  &end
#
#  56 PHE  HB3    91 ALA  QB      5.13             (#peak  4070)
 &rst
  ixpk= 4070, nxpk= 0, iat= 841,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2=1355,1356,1357,
 &end
#
#  56 PHE  HB3    93 SER  HN      6.15             (#peak  1021)
 &rst
  ixpk= 1021, nxpk= 0, iat= 841,1368, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  56 PHE  QD    102 ILE  QG2     5.08             (#peak   681)
 &rst
  ixpk= 681, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
 igr1= 844, 852,
 igr2=1505,1506,1507,
 &end
#
#  56 PHE  QD     69 VAL  QG1     4.53             (#peak  1016)
 &rst
  ixpk= 1016, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 844, 852,
 igr2=1037,1038,1039,
 &end
#
#  56 PHE  QD     89 VAL  QG1     5.04             (#peak  4382)
 &rst
  ixpk= 4382, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
 igr1= 844, 852,
 igr2=1322,1323,1324,
 &end
#
#  56 PHE  QD     89 VAL  QG2     4.00             (#peak  4384)
 &rst
  ixpk= 4384, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1= 844, 852,
 igr2=1326,1327,1328,
 &end
#
#  56 PHE  QD     92 GLY  HN      6.15             (#peak  1002)
 &rst
  ixpk= 1002, nxpk= 0, iat=  -1,1361, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1= 844, 852,
 &end
#
#  56 PHE  QD     93 SER  HN      6.13             (#peak  1011)
 &rst
  ixpk= 1011, nxpk= 0, iat=  -1,1368, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
 igr1= 844, 852,
 &end
#
#  56 PHE  QD     95 ASN  HN      6.15             (#peak   403)
 &rst
  ixpk= 403, nxpk= 0, iat=  -1,1398, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1= 844, 852,
 &end
#
#  56 PHE  QD     95 ASN  HB2     5.78             (#peak  3558)
 &rst
  ixpk= 3558, nxpk= 0, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 844, 852,
 &end
#
#  56 PHE  QE    100 LEU  QD1     3.94             (#peak  4390)
 &rst
  ixpk= 4390, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1= 846, 850,
 igr2=1470,1471,1472,
 &end
#
#  56 PHE  QE    102 ILE  QG1     4.70             (#peak  3818)
 &rst
  ixpk= 3818, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr1= 846, 850,
 igr2=1509,1510,
 &end
#
#  56 PHE  QE    102 ILE  QG2     3.87             (#peak  4377)
 &rst
  ixpk= 4377, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 846, 850,
 igr2=1505,1506,1507,
 &end
#
#  56 PHE  QE     69 VAL  QG1     3.61             (#peak  1021)
 &rst
  ixpk= 1021, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
 igr1= 846, 850,
 igr2=1037,1038,1039,
 &end
#
#  56 PHE  QE     69 VAL  QG2     4.16             (#peak  2814)
 &rst
  ixpk= 2814, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
 igr1= 846, 850,
 igr2=1041,1042,1043,
 &end
#
#  56 PHE  QE     89 VAL  QG1     3.86             (#peak  4381)
 &rst
  ixpk= 4381, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1= 846, 850,
 igr2=1322,1323,1324,
 &end
#
#  56 PHE  QE     89 VAL  QG2     4.18             (#peak  4383)
 &rst
  ixpk= 4383, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1= 846, 850,
 igr2=1326,1327,1328,
 &end
#
#  56 PHE  QE     95 ASN  HN      6.15             (#peak   409)
 &rst
  ixpk= 409, nxpk= 0, iat=  -1,1398, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1= 846, 850,
 &end
#
#  56 PHE  QE     95 ASN  HB2     4.72             (#peak  3563)
 &rst
  ixpk= 3563, nxpk= 0, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 846, 850,
 &end
#
#  56 PHE  QE     95 ASN  HB3     4.71             (#peak  2623)
 &rst
  ixpk= 2623, nxpk= 0, iat=  -1,1403, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
 igr1= 846, 850,
 &end
#
#  57 PRO  HD3    58 VAL  HN      4.52             (#peak  2577)
 &rst
  ixpk= 2577, nxpk= 0, iat= 858, 870, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,  &end
#
#  57 PRO  HD3    58 VAL  QG2     5.96             (#peak  3884)
 &rst
  ixpk= 3884, nxpk= 0, iat= 858,  -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr2= 880, 881, 882,
 &end
#
#  57 PRO  HG2    58 VAL  HN      3.77             (#peak  3449)
 &rst
  ixpk= 3449, nxpk= 0, iat= 860, 870, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,  &end
#
#  58 VAL  HN     58 VAL  QG1     6.15             (#peak  1764)
 &rst
  ixpk= 1764, nxpk= 0, iat= 870,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2= 876, 877, 878,
 &end
#
#  58 VAL  HN     58 VAL  QG2     3.09             (#peak  1501)
 &rst
  ixpk= 1501, nxpk= 0, iat= 870,  -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
 igr2= 880, 881, 882,
 &end
#
#  58 VAL  HN     59 ASP  HN      6.15             (#peak   690)
 &rst
  ixpk= 690, nxpk= 0, iat= 870, 886, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  58 VAL  HN     91 ALA  QB      3.96             (#peak   538)
 &rst
  ixpk= 538, nxpk= 0, iat= 870,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr2=1355,1356,1357,
 &end
#
#  58 VAL  HA     58 VAL  QG1     3.66             (#peak  4050)
 &rst
  ixpk= 4050, nxpk= 0, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr2= 876, 877, 878,
 &end
#
#  58 VAL  HA     58 VAL  QG2     3.22             (#peak  1500)
 &rst
  ixpk= 1500, nxpk= 0, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
 igr2= 880, 881, 882,
 &end
#
#  58 VAL  HA     59 ASP  HN      3.21             (#peak  2596)
 &rst
  ixpk= 2596, nxpk= 0, iat= 872, 886, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,  &end
#
#  58 VAL  HA     91 ALA  QB      2.92             (#peak  2594)
 &rst
  ixpk= 2594, nxpk= 0, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2=1355,1356,1357,
 &end
#
#  58 VAL  HB    104 ALA  QB      4.78             (#peak  3848)
 &rst
  ixpk= 3848, nxpk= 0, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr2=1533,1534,1535,
 &end
#
#  58 VAL  HB    107 VAL  HA      5.52             (#peak  4248)
 &rst
  ixpk= 4248, nxpk= 0, iat= 874,1572, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,  &end
#
#  58 VAL  HB     59 ASP  HN      4.36             (#peak  3846)
 &rst
  ixpk= 3846, nxpk= 0, iat= 874, 886, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
#  58 VAL  QG1   104 ALA  QB      4.68             (#peak  3855)
 &rst
  ixpk= 3855, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
 igr1= 876, 877, 878,
 igr2=1533,1534,1535,
 &end
#
#  58 VAL  QG1   107 VAL  HA      3.98             (#peak  4249)
 &rst
  ixpk= 4249, nxpk= 0, iat=  -1,1572, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr1= 876, 877, 878,
 &end
#
#  58 VAL  QG1   107 VAL  QG1     5.55             (#peak  4266)
 &rst
  ixpk= 4266, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,
 igr1= 876, 877, 878,
 igr2=1576,1577,1578,
 &end
#
#  58 VAL  QG1   108 GLY  HN      4.91             (#peak  1733)
 &rst
  ixpk= 1733, nxpk= 0, iat=  -1,1586, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1= 876, 877, 878,
 &end
#
#  58 VAL  QG1    59 ASP  HN      6.15             (#peak  1765)
 &rst
  ixpk= 1765, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 876, 877, 878,
 &end
#
#  58 VAL  QG1    91 ALA  QB      4.18             (#peak  4062)
 &rst
  ixpk= 4062, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 876, 877, 878,
 igr2=1355,1356,1357,
 &end
#
#  58 VAL  QG2   104 ALA  HN      5.53             (#peak  3889)
 &rst
  ixpk= 3889, nxpk= 0, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
 igr1= 880, 881, 882,
 &end
#
#  58 VAL  QG2   104 ALA  HA      4.74             (#peak  3881)
 &rst
  ixpk= 3881, nxpk= 0, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1= 880, 881, 882,
 &end
#
#  58 VAL  QG2   104 ALA  QB      3.99             (#peak  3849)
 &rst
  ixpk= 3849, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1= 880, 881, 882,
 igr2=1533,1534,1535,
 &end
#
#  58 VAL  QG2   105 THR  HN      5.02             (#peak  3890)
 &rst
  ixpk= 3890, nxpk= 0, iat=  -1,1539, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 880, 881, 882,
 &end
#
#  58 VAL  QG2    59 ASP  HN      4.04             (#peak  1499)
 &rst
  ixpk= 1499, nxpk= 0, iat=  -1, 886, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 880, 881, 882,
 &end
#
#  58 VAL  QG2    91 ALA  QB      4.30             (#peak  4061)
 &rst
  ixpk= 4061, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1= 880, 881, 882,
 igr2=1355,1356,1357,
 &end
#
#  59 ASP  HN    105 THR  HN      6.15             (#peak   681)
 &rst
  ixpk= 681, nxpk= 0, iat= 886,1539, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  59 ASP  HN    106 HIS  HN      6.15             (#peak  1761)
 &rst
  ixpk= 1761, nxpk= 0, iat= 886,1553, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  59 ASP  HN    107 VAL  HA      6.15             (#peak  1867)
 &rst
  ixpk= 1867, nxpk= 0, iat= 886,1572, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  59 ASP  HN    111 THR  QG2     6.15             (#peak   686)
 &rst
  ixpk= 686, nxpk= 0, iat= 886,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1621,1622,1623,
 &end
#
#  59 ASP  HN     60 GLY  HN      6.15             (#peak   679)
 &rst
  ixpk= 679, nxpk= 0, iat= 886, 898, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  59 ASP  HA     60 GLY  HN      2.40             (#peak  3250)
 &rst
  ixpk= 3250, nxpk= 0, iat= 888, 898, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#  59 ASP  HA     90 ILE  HA      3.44             (#peak   747)
 &rst
  ixpk= 747, nxpk= 0, iat= 888,1334, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94,  &end
#
#  59 ASP  HA     90 ILE  HB      6.13             (#peak  4060)
 &rst
  ixpk= 4060, nxpk= 0, iat= 888,1336, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,  &end
#
#  59 ASP  HA     90 ILE  QG1     6.01             (#peak  4224)
 &rst
  ixpk= 4224, nxpk= 0, iat= 888,  -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
 igr2=1342,1343,
 &end
#
#  59 ASP  HA     90 ILE  QG2     6.15             (#peak  4225)
 &rst
  ixpk= 4225, nxpk= 0, iat= 888,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1338,1339,1340,
 &end
#
#  59 ASP  HA     91 ALA  HN      3.89             (#peak  3252)
 &rst
  ixpk= 3252, nxpk= 0, iat= 888,1351, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
#  59 ASP  HB2    60 GLY  HN      5.61             (#peak  1088)
 &rst
  ixpk= 1088, nxpk= 0, iat= 890, 898, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,  &end
#
#  59 ASP  HB2    90 ILE  QD1     6.15             (#peak  4033)
 &rst
  ixpk= 4033, nxpk= 0, iat= 890,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1345,1346,1347,
 &end
#
#  59 ASP  HB2    90 ILE  QG1     5.82             (#peak  4031)
 &rst
  ixpk= 4031, nxpk= 0, iat= 890,  -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr2=1342,1343,
 &end
#
#  59 ASP  HB2    90 ILE  QG2     6.15             (#peak  4032)
 &rst
  ixpk= 4032, nxpk= 0, iat= 890,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1338,1339,1340,
 &end
#
#  59 ASP  HB3    60 GLY  HN      4.67             (#peak   397)
 &rst
  ixpk= 397, nxpk= 0, iat= 891, 898, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  59 ASP  HB3    90 ILE  QD1     5.86             (#peak  4034)
 &rst
  ixpk= 4034, nxpk= 0, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
 igr2=1345,1346,1347,
 &end
#
#  59 ASP  HB3    90 ILE  QG1     6.15             (#peak  4036)
 &rst
  ixpk= 4036, nxpk= 0, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1342,1343,
 &end
#
#  59 ASP  HB3    90 ILE  QG2     6.15             (#peak  4035)
 &rst
  ixpk= 4035, nxpk= 0, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1338,1339,1340,
 &end
#
#  60 GLY  HN     89 VAL  HN      6.15             (#peak  1463)
 &rst
  ixpk= 1463, nxpk= 0, iat= 898,1316, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  60 GLY  HN     89 VAL  HB      6.15             (#peak   146)
 &rst
  ixpk= 146, nxpk= 0, iat= 898,1320, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  60 GLY  HN     89 VAL  QG1     6.15             (#peak  1770)
 &rst
  ixpk= 1770, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1322,1323,1324,
 &end
#
#  60 GLY  HN     89 VAL  QG2     4.01             (#peak  2923)
 &rst
  ixpk= 2923, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2=1326,1327,1328,
 &end
#
#  60 GLY  HN     90 ILE  HA      5.25             (#peak   739)
 &rst
  ixpk= 739, nxpk= 0, iat= 898,1334, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#  60 GLY  HN     90 ILE  QD1     6.15             (#peak  1769)
 &rst
  ixpk= 1769, nxpk= 0, iat= 898,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1345,1346,1347,
 &end
#
#  60 GLY  HA2   104 ALA  HA      5.55             (#peak  3221)
 &rst
  ixpk= 3221, nxpk= 0, iat= 900,1531, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
#  60 GLY  HA2   104 ALA  QB      5.96             (#peak  4048)
 &rst
  ixpk= 4048, nxpk= 0, iat= 900,  -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
 igr2=1533,1534,1535,
 &end
#
#  60 GLY  HA2   105 THR  HN      4.90             (#peak  1993)
 &rst
  ixpk= 1993, nxpk= 0, iat= 900,1539, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#  60 GLY  HA2   106 HIS  HN      6.15             (#peak  1801)
 &rst
  ixpk= 1801, nxpk= 0, iat= 900,1553, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  60 GLY  HA3   104 ALA  QB      5.58             (#peak  4186)
 &rst
  ixpk= 4186, nxpk= 0, iat= 901,  -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
 igr2=1533,1534,1535,
 &end
#
#  60 GLY  HA3   105 THR  HN      4.96             (#peak   271)
 &rst
  ixpk= 271, nxpk= 0, iat= 901,1539, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#  60 GLY  HA3    61 ARG  HN      3.49             (#peak   268)
 &rst
  ixpk= 268, nxpk= 0, iat= 901, 905, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,  &end
#
#  61 ARG  HN    103 CYS  HN      6.15             (#peak  1274)
 &rst
  ixpk= 1274, nxpk= 0, iat= 905,1518, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  61 ARG  HN    103 CYS  HB2     6.15             (#peak  3866)
 &rst
  ixpk= 3866, nxpk= 0, iat= 905,1522, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  61 ARG  HN    104 ALA  HA      5.99             (#peak  3219)
 &rst
  ixpk= 3219, nxpk= 0, iat= 905,1531, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,  &end
#
#  61 ARG  HN    105 THR  QG2     6.15             (#peak  1729)
 &rst
  ixpk= 1729, nxpk= 0, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1545,1546,1547,
 &end
#
#  61 ARG  HN     61 ARG  HG2     6.12             (#peak   871)
 &rst
  ixpk= 871, nxpk= 0, iat= 905, 912, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,  &end
#
#  61 ARG  HN     61 ARG  HG3     4.82             (#peak  3703)
 &rst
  ixpk= 3703, nxpk= 0, iat= 905, 913, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
#  61 ARG  HN     61 ARG  QB      3.35             (#peak  1290)
 &rst
  ixpk= 1290, nxpk= 0, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2= 909, 910,
 &end
#
#  61 ARG  HN     61 ARG  QD      6.15             (#peak  3064)
 &rst
  ixpk= 3064, nxpk= 0, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2= 915, 916,
 &end
#
#  61 ARG  HA     61 ARG  HG2     3.90             (#peak  2875)
 &rst
  ixpk= 2875, nxpk= 0, iat= 907, 912, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#  61 ARG  HA     61 ARG  HG3     3.64             (#peak  2883)
 &rst
  ixpk= 2883, nxpk= 0, iat= 907, 913, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#  61 ARG  HA     61 ARG  QB      3.01             (#peak  2877)
 &rst
  ixpk= 2877, nxpk= 0, iat= 907,  -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
 igr2= 909, 910,
 &end
#
#  61 ARG  HA     61 ARG  QD      4.20             (#peak  3069)
 &rst
  ixpk= 3069, nxpk= 0, iat= 907,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2= 915, 916,
 &end
#
#  61 ARG  HA     62 VAL  HN      3.47             (#peak  2876)
 &rst
  ixpk= 2876, nxpk= 0, iat= 907, 929, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,  &end
#
#  61 ARG  HA     88 THR  HA      3.57             (#peak  1559)
 &rst
  ixpk= 1559, nxpk= 0, iat= 907,1304, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#  61 ARG  HA     89 VAL  HN      3.75             (#peak  2882)
 &rst
  ixpk= 2882, nxpk= 0, iat= 907,1316, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  61 ARG  HA     89 VAL  QG2     4.09             (#peak  2880)
 &rst
  ixpk= 2880, nxpk= 0, iat= 907,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2=1326,1327,1328,
 &end
#
#  61 ARG  HG2    61 ARG  QD      2.90             (#peak  3065)
 &rst
  ixpk= 3065, nxpk= 0, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
 igr2= 915, 916,
 &end
#
#  61 ARG  HG2    62 VAL  HN      3.79             (#peak   873)
 &rst
  ixpk= 873, nxpk= 0, iat= 912, 929, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
#  61 ARG  HG2    86 GLY  HA2     5.31             (#peak  4256)
 &rst
  ixpk= 4256, nxpk= 0, iat= 912,1286, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,  &end
#
#  61 ARG  HG2    86 GLY  HA3     6.15             (#peak  4255)
 &rst
  ixpk= 4255, nxpk= 0, iat= 912,1287, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  61 ARG  HG2    88 THR  QG2     5.47             (#peak  4052)
 &rst
  ixpk= 4052, nxpk= 0, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr2=1308,1309,1310,
 &end
#
#  61 ARG  HG3    61 ARG  QD      2.48             (#peak  3071)
 &rst
  ixpk= 3071, nxpk= 0, iat= 913,  -1, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28,
 igr2= 915, 916,
 &end
#
#  61 ARG  HG3    86 GLY  HA2     5.41             (#peak  4257)
 &rst
  ixpk= 4257, nxpk= 0, iat= 913,1286, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#  61 ARG  HG3    88 THR  QG2     3.90             (#peak  4051)
 &rst
  ixpk= 4051, nxpk= 0, iat= 913,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2=1308,1309,1310,
 &end
#
#  61 ARG  QB    103 CYS  HB2     5.67             (#peak  1294)
 &rst
  ixpk= 1294, nxpk= 0, iat=  -1,1522, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 909, 910,
 &end
#
#  61 ARG  QB    103 CYS  HB3     5.62             (#peak  1289)
 &rst
  ixpk= 1289, nxpk= 0, iat=  -1,1523, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
 igr1= 909, 910,
 &end
#
#  61 ARG  QB     61 ARG  HG2     2.40             (#peak   874)
 &rst
  ixpk= 874, nxpk= 0, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr1= 909, 910,
 &end
#
#  61 ARG  QB     61 ARG  HG3     2.61             (#peak  3705)
 &rst
  ixpk= 3705, nxpk= 0, iat=  -1, 913, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,
 igr1= 909, 910,
 &end
#
#  61 ARG  QB     61 ARG  QD      2.50             (#peak  3067)
 &rst
  ixpk= 3067, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
 igr1= 909, 910,
 igr2= 915, 916,
 &end
#
#  61 ARG  QB     62 VAL  HN      4.14             (#peak  1292)
 &rst
  ixpk= 1292, nxpk= 0, iat=  -1, 929, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr1= 909, 910,
 &end
#
#  61 ARG  QB     88 THR  QG2     4.26             (#peak  4022)
 &rst
  ixpk= 4022, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1= 909, 910,
 igr2=1308,1309,1310,
 &end
#
#  61 ARG  QD     62 VAL  HN      5.09             (#peak  3066)
 &rst
  ixpk= 3066, nxpk= 0, iat=  -1, 929, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 915, 916,
 &end
#
#  61 ARG  QD     86 GLY  HA2     4.52             (#peak  4259)
 &rst
  ixpk= 4259, nxpk= 0, iat=  -1,1286, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1= 915, 916,
 &end
#
#  61 ARG  QD     86 GLY  HA3     5.83             (#peak  4258)
 &rst
  ixpk= 4258, nxpk= 0, iat=  -1,1287, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
 igr1= 915, 916,
 &end
#
#  61 ARG  QD     88 THR  QG2     3.24             (#peak  2144)
 &rst
  ixpk= 2144, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1= 915, 916,
 igr2=1308,1309,1310,
 &end
#
#  62 VAL  HN    102 ILE  QG2     5.13             (#peak   680)
 &rst
  ixpk= 680, nxpk= 0, iat= 929,  -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
 igr2=1505,1506,1507,
 &end
#
#  62 VAL  HN     62 VAL  QG1     4.05             (#peak  2031)
 &rst
  ixpk= 2031, nxpk= 0, iat= 929,  -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
 igr2= 935, 936, 937,
 &end
#
#  62 VAL  HN     62 VAL  QG2     4.26             (#peak  3753)
 &rst
  ixpk= 3753, nxpk= 0, iat= 929,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2= 939, 940, 941,
 &end
#
#  62 VAL  HN     63 ILE  HN      5.03             (#peak   502)
 &rst
  ixpk= 502, nxpk= 0, iat= 929, 945, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
#  62 VAL  HN     86 GLY  HN      6.15             (#peak  1775)
 &rst
  ixpk= 1775, nxpk= 0, iat= 929,1284, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  62 VAL  HN     87 SER  HN      6.15             (#peak   498)
 &rst
  ixpk= 498, nxpk= 0, iat= 929,1291, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  62 VAL  HN     88 THR  HA      4.62             (#peak  1556)
 &rst
  ixpk= 1556, nxpk= 0, iat= 929,1304, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#  62 VAL  HN     88 THR  QG2     6.06             (#peak  2140)
 &rst
  ixpk= 2140, nxpk= 0, iat= 929,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr2=1308,1309,1310,
 &end
#
#  62 VAL  HA    102 ILE  HA      3.68             (#peak  2728)
 &rst
  ixpk= 2728, nxpk= 0, iat= 931,1501, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
#  62 VAL  HA    102 ILE  QG1     4.84             (#peak   676)
 &rst
  ixpk= 676, nxpk= 0, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr2=1509,1510,
 &end
#
#  62 VAL  HA    102 ILE  QG2     4.72             (#peak   666)
 &rst
  ixpk= 666, nxpk= 0, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1505,1506,1507,
 &end
#
#  62 VAL  HA    103 CYS  HN      5.54             (#peak   673)
 &rst
  ixpk= 673, nxpk= 0, iat= 931,1518, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,  &end
#
#  62 VAL  HA     62 VAL  QG1     3.52             (#peak   669)
 &rst
  ixpk= 669, nxpk= 0, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2= 935, 936, 937,
 &end
#
#  62 VAL  HA     62 VAL  QG2     3.36             (#peak  3749)
 &rst
  ixpk= 3749, nxpk= 0, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr2= 939, 940, 941,
 &end
#
#  62 VAL  HA     63 ILE  HG12    4.90             (#peak  3168)
 &rst
  ixpk= 3168, nxpk= 0, iat= 931, 955, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
#  62 VAL  HB     87 SER  HN      5.98             (#peak  2603)
 &rst
  ixpk= 2603, nxpk= 0, iat= 933,1291, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,  &end
#
#  62 VAL  QG1    63 ILE  HA      4.74             (#peak  2035)
 &rst
  ixpk= 2035, nxpk= 0, iat=  -1, 947, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
 igr1= 935, 936, 937,
 &end
#
#  62 VAL  QG1    64 GLU  HN      3.10             (#peak  2033)
 &rst
  ixpk= 2033, nxpk= 0, iat=  -1, 964, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1= 935, 936, 937,
 &end
#
#  62 VAL  QG1    67 SER  HB2     5.90             (#peak  2038)
 &rst
  ixpk= 2038, nxpk= 0, iat=  -1,1007, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
 igr1= 935, 936, 937,
 &end
#
#  62 VAL  QG1    87 SER  HN      5.22             (#peak  2032)
 &rst
  ixpk= 2032, nxpk= 0, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1= 935, 936, 937,
 &end
#
#  62 VAL  QG2   100 LEU  HB3     4.98             (#peak  3747)
 &rst
  ixpk= 3747, nxpk= 0, iat=  -1,1466, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
 igr1= 939, 940, 941,
 &end
#
#  62 VAL  QG2    64 GLU  HN      6.15             (#peak  3755)
 &rst
  ixpk= 3755, nxpk= 0, iat=  -1, 964, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 939, 940, 941,
 &end
#
#  62 VAL  QG2    86 GLY  HN      6.15             (#peak  3750)
 &rst
  ixpk= 3750, nxpk= 0, iat=  -1,1284, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 939, 940, 941,
 &end
#
#  62 VAL  QG2    87 SER  HN      5.47             (#peak  3754)
 &rst
  ixpk= 3754, nxpk= 0, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1= 939, 940, 941,
 &end
#
#  62 VAL  QG2    87 SER  HB3     4.44             (#peak   804)
 &rst
  ixpk= 804, nxpk= 0, iat=  -1,1296, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr1= 939, 940, 941,
 &end
#
#  62 VAL  QG2    89 VAL  QG1     2.90             (#peak  3752)
 &rst
  ixpk= 3752, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1= 939, 940, 941,
 igr2=1322,1323,1324,
 &end
#
#  62 VAL  QG2    89 VAL  QG2     3.93             (#peak  3758)
 &rst
  ixpk= 3758, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 939, 940, 941,
 igr2=1326,1327,1328,
 &end
#
#  63 ILE  HN    101 LEU  HN      6.15             (#peak  1089)
 &rst
  ixpk= 1089, nxpk= 0, iat= 945,1480, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  63 ILE  HN    101 LEU  HB2     6.15             (#peak  2503)
 &rst
  ixpk= 2503, nxpk= 0, iat= 945,1484, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  63 ILE  HN    101 LEU  QD1     6.15             (#peak   795)
 &rst
  ixpk= 795, nxpk= 0, iat= 945,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1489,1490,1491,
 &end
#
#  63 ILE  HN    101 LEU  QD2     6.15             (#peak   804)
 &rst
  ixpk= 804, nxpk= 0, iat= 945,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1493,1494,1495,
 &end
#
#  63 ILE  HN    102 ILE  HA      4.62             (#peak  2730)
 &rst
  ixpk= 2730, nxpk= 0, iat= 945,1501, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#  63 ILE  HN     63 ILE  HG12    3.55             (#peak  3173)
 &rst
  ixpk= 3173, nxpk= 0, iat= 945, 955, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
#  63 ILE  HN     63 ILE  HG13    4.55             (#peak  2495)
 &rst
  ixpk= 2495, nxpk= 0, iat= 945, 956, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
#  63 ILE  HN     63 ILE  QD1     4.17             (#peak  2791)
 &rst
  ixpk= 2791, nxpk= 0, iat= 945,  -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr2= 958, 959, 960,
 &end
#
#  63 ILE  HN     63 ILE  QG2     4.09             (#peak   998)
 &rst
  ixpk= 998, nxpk= 0, iat= 945,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2= 951, 952, 953,
 &end
#
#  63 ILE  HN     64 GLU  HN      5.20             (#peak   763)
 &rst
  ixpk= 763, nxpk= 0, iat= 945, 964, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
#  63 ILE  HA     63 ILE  QD1     4.29             (#peak  2455)
 &rst
  ixpk= 2455, nxpk= 0, iat= 947,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2= 958, 959, 960,
 &end
#
#  63 ILE  HA     63 ILE  QG2     2.40             (#peak  2447)
 &rst
  ixpk= 2447, nxpk= 0, iat= 947,  -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
 igr2= 951, 952, 953,
 &end
#
#  63 ILE  HA     85 PRO  HA      4.51             (#peak  4213)
 &rst
  ixpk= 4213, nxpk= 0, iat= 947,1280, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,  &end
#
#  63 ILE  HA     86 GLY  HN      6.15             (#peak  1790)
 &rst
  ixpk= 1790, nxpk= 0, iat= 947,1284, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  63 ILE  HA     86 GLY  HA2     4.76             (#peak   464)
 &rst
  ixpk= 464, nxpk= 0, iat= 947,1286, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  63 ILE  HB     63 ILE  QD1     3.55             (#peak  1452)
 &rst
  ixpk= 1452, nxpk= 0, iat= 949,  -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
 igr2= 958, 959, 960,
 &end
#
#  63 ILE  HB     64 GLU  HN      4.71             (#peak  1448)
 &rst
  ixpk= 1448, nxpk= 0, iat= 949, 964, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,  &end
#
#  63 ILE  HG12  102 ILE  HA      5.70             (#peak  3176)
 &rst
  ixpk= 3176, nxpk= 0, iat= 955,1501, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
#  63 ILE  HG12   64 GLU  HN      5.63             (#peak  3172)
 &rst
  ixpk= 3172, nxpk= 0, iat= 955, 964, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,  &end
#
#  63 ILE  HG12   87 SER  HN      6.15             (#peak   535)
 &rst
  ixpk= 535, nxpk= 0, iat= 955,1291, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  63 ILE  HG13   64 GLU  HN      6.15             (#peak  2494)
 &rst
  ixpk= 2494, nxpk= 0, iat= 956, 964, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  63 ILE  QD1    64 GLU  HN      5.80             (#peak   768)
 &rst
  ixpk= 768, nxpk= 0, iat=  -1, 964, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
 igr1= 958, 959, 960,
 &end
#
#  63 ILE  QD1    64 GLU  HB2     4.92             (#peak  4346)
 &rst
  ixpk= 4346, nxpk= 0, iat=  -1, 968, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr1= 958, 959, 960,
 &end
#
#  63 ILE  QD1    64 GLU  HB3     6.15             (#peak  4347)
 &rst
  ixpk= 4347, nxpk= 0, iat=  -1, 969, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1= 958, 959, 960,
 &end
#
#  63 ILE  QG2    63 ILE  HG12    3.18             (#peak  3169)
 &rst
  ixpk= 3169, nxpk= 0, iat=  -1, 955, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
 igr1= 951, 952, 953,
 &end
#
#  63 ILE  QG2    63 ILE  HG13    3.76             (#peak  1000)
 &rst
  ixpk= 1000, nxpk= 0, iat=  -1, 956, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1= 951, 952, 953,
 &end
#
#  63 ILE  QG2    63 ILE  QD1     4.14             (#peak  2788)
 &rst
  ixpk= 2788, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr1= 951, 952, 953,
 igr2= 958, 959, 960,
 &end
#
#  63 ILE  QG2    64 GLU  HN      4.48             (#peak   997)
 &rst
  ixpk= 997, nxpk= 0, iat=  -1, 964, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1= 951, 952, 953,
 &end
#
#  64 GLU  HN    100 LEU  HA      6.15             (#peak  1786)
 &rst
  ixpk= 1786, nxpk= 0, iat= 964,1463, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  64 GLU  HN    100 LEU  HB2     6.15             (#peak  1871)
 &rst
  ixpk= 1871, nxpk= 0, iat= 964,1465, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  64 GLU  HN    101 LEU  HN      6.15             (#peak  1785)
 &rst
  ixpk= 1785, nxpk= 0, iat= 964,1480, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  64 GLU  HN    101 LEU  HB2     6.15             (#peak  1788)
 &rst
  ixpk= 1788, nxpk= 0, iat= 964,1484, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  64 GLU  HN    101 LEU  HB3     6.15             (#peak  1787)
 &rst
  ixpk= 1787, nxpk= 0, iat= 964,1485, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  64 GLU  HN    101 LEU  QD1     6.15             (#peak  1854)
 &rst
  ixpk= 1854, nxpk= 0, iat= 964,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1489,1490,1491,
 &end
#
#  64 GLU  HN     64 GLU  HB2     3.74             (#peak  2242)
 &rst
  ixpk= 2242, nxpk= 0, iat= 964, 968, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  64 GLU  HN     64 GLU  HB3     3.85             (#peak   332)
 &rst
  ixpk= 332, nxpk= 0, iat= 964, 969, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,  &end
#
#  64 GLU  HN     64 GLU  HG2     5.19             (#peak   754)
 &rst
  ixpk= 754, nxpk= 0, iat= 964, 971, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
#  64 GLU  HN     64 GLU  HG3     5.93             (#peak  1920)
 &rst
  ixpk= 1920, nxpk= 0, iat= 964, 972, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
#  64 GLU  HN     65 GLY  HN      5.36             (#peak   770)
 &rst
  ixpk= 770, nxpk= 0, iat= 964, 979, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,  &end
#
#  64 GLU  HA     64 GLU  HG2     3.94             (#peak  2404)
 &rst
  ixpk= 2404, nxpk= 0, iat= 966, 971, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  64 GLU  HA     64 GLU  HG3     3.94             (#peak  1923)
 &rst
  ixpk= 1923, nxpk= 0, iat= 966, 972, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
#  64 GLU  HA     65 GLY  HN      3.15             (#peak  2410)
 &rst
  ixpk= 2410, nxpk= 0, iat= 966, 979, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,  &end
#
#  64 GLU  HA     85 PRO  HA      4.59             (#peak  4239)
 &rst
  ixpk= 4239, nxpk= 0, iat= 966,1280, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  64 GLU  HA     85 PRO  HG2     6.15             (#peak  4229)
 &rst
  ixpk= 4229, nxpk= 0, iat= 966,1274, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  64 GLU  HA     85 PRO  HG3     6.02             (#peak  4230)
 &rst
  ixpk= 4230, nxpk= 0, iat= 966,1275, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,  &end
#
#  64 GLU  HB2   100 LEU  HA      5.33             (#peak  2244)
 &rst
  ixpk= 2244, nxpk= 0, iat= 968,1463, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,  &end
#
#  64 GLU  HB2   101 LEU  QD1     5.39             (#peak  4236)
 &rst
  ixpk= 4236, nxpk= 0, iat= 968,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr2=1489,1490,1491,
 &end
#
#  64 GLU  HB2   101 LEU  QD2     4.90             (#peak  4235)
 &rst
  ixpk= 4235, nxpk= 0, iat= 968,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr2=1493,1494,1495,
 &end
#
#  64 GLU  HB2    65 GLY  HN      5.97             (#peak  2247)
 &rst
  ixpk= 2247, nxpk= 0, iat= 968, 979, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
#  64 GLU  HB3   100 LEU  HA      4.47             (#peak  2168)
 &rst
  ixpk= 2168, nxpk= 0, iat= 969,1463, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
#  64 GLU  HB3   101 LEU  HB3     4.49             (#peak  4311)
 &rst
  ixpk= 4311, nxpk= 0, iat= 969,1485, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
#  64 GLU  HB3   101 LEU  QD1     5.71             (#peak  4238)
 &rst
  ixpk= 4238, nxpk= 0, iat= 969,  -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
 igr2=1489,1490,1491,
 &end
#
#  64 GLU  HB3   101 LEU  QD2     5.34             (#peak  4237)
 &rst
  ixpk= 4237, nxpk= 0, iat= 969,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr2=1493,1494,1495,
 &end
#
#  64 GLU  HB3    65 GLY  HN      4.54             (#peak   337)
 &rst
  ixpk= 337, nxpk= 0, iat= 969, 979, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
#  64 GLU  HG2    65 GLY  HN      4.87             (#peak   102)
 &rst
  ixpk= 102, nxpk= 0, iat= 971, 979, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  64 GLU  HG3    65 GLY  HN      5.67             (#peak  1924)
 &rst
  ixpk= 1924, nxpk= 0, iat= 972, 979, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,  &end
#
#  65 GLY  HN     66 HIS  HN      6.15             (#peak  1619)
 &rst
  ixpk= 1619, nxpk= 0, iat= 979, 986, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  65 GLY  HN     85 PRO  HA      6.15             (#peak  1789)
 &rst
  ixpk= 1789, nxpk= 0, iat= 979,1280, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  65 GLY  HN     85 PRO  HG2     6.15             (#peak  1805)
 &rst
  ixpk= 1805, nxpk= 0, iat= 979,1274, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  65 GLY  HN     85 PRO  HG3     6.15             (#peak  1804)
 &rst
  ixpk= 1804, nxpk= 0, iat= 979,1275, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  65 GLY  HA2   100 LEU  HA      6.15             (#peak  4203)
 &rst
  ixpk= 4203, nxpk= 0, iat= 981,1463, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  65 GLY  HA2   100 LEU  QD2     3.59             (#peak  4375)
 &rst
  ixpk= 4375, nxpk= 0, iat= 981,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2=1474,1475,1476,
 &end
#
#  65 GLY  HA3   100 LEU  HA      5.98             (#peak  4232)
 &rst
  ixpk= 4232, nxpk= 0, iat= 982,1463, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,  &end
#
#  65 GLY  HA3   100 LEU  QD2     3.51             (#peak  4374)
 &rst
  ixpk= 4374, nxpk= 0, iat= 982,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1474,1475,1476,
 &end
#
#  65 GLY  HA3    66 HIS  HN      3.24             (#peak  3585)
 &rst
  ixpk= 3585, nxpk= 0, iat= 982, 986, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
#  66 HIS  HN    100 LEU  HA      6.15             (#peak  1863)
 &rst
  ixpk= 1863, nxpk= 0, iat= 986,1463, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  66 HIS  HN    100 LEU  HB2     6.15             (#peak  1859)
 &rst
  ixpk= 1859, nxpk= 0, iat= 986,1465, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  66 HIS  HN    100 LEU  HB3     6.15             (#peak  1858)
 &rst
  ixpk= 1858, nxpk= 0, iat= 986,1466, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  66 HIS  HN    100 LEU  HG      6.15             (#peak  1738)
 &rst
  ixpk= 1738, nxpk= 0, iat= 986,1468, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  66 HIS  HN    100 LEU  QD1     6.15             (#peak  1740)
 &rst
  ixpk= 1740, nxpk= 0, iat= 986,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1470,1471,1472,
 &end
#
#  66 HIS  HN    100 LEU  QD2     6.15             (#peak  1739)
 &rst
  ixpk= 1739, nxpk= 0, iat= 986,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1474,1475,1476,
 &end
#
#  66 HIS  HN     66 HIS  HB3     3.83             (#peak  3395)
 &rst
  ixpk= 3395, nxpk= 0, iat= 986, 991, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  66 HIS  HN     67 SER  HN      6.15             (#peak   471)
 &rst
  ixpk= 471, nxpk= 0, iat= 986,1003, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  66 HIS  HN     99 SER  HN      6.15             (#peak  1862)
 &rst
  ixpk= 1862, nxpk= 0, iat= 986,1450, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  66 HIS  HA     66 HIS  HD2     4.97             (#peak  1244)
 &rst
  ixpk= 1244, nxpk= 0, iat= 988, 999, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,  &end
#
#  66 HIS  HA     84 LYS  HA      4.26             (#peak  4009)
 &rst
  ixpk= 4009, nxpk= 0, iat= 988,1250, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  66 HIS  HA     84 LYS  QB      5.50             (#peak  4305)
 &rst
  ixpk= 4305, nxpk= 0, iat= 988,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1252,1253,
 &end
#
#  66 HIS  HB2    67 SER  HN      4.63             (#peak  1641)
 &rst
  ixpk= 1641, nxpk= 0, iat= 990,1003, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  66 HIS  HB2    84 LYS  QB      5.50             (#peak  4356)
 &rst
  ixpk= 4356, nxpk= 0, iat= 990,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1252,1253,
 &end
#
#  66 HIS  HB3    67 SER  HN      4.93             (#peak  3390)
 &rst
  ixpk= 3390, nxpk= 0, iat= 991,1003, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#  66 HIS  HB3    84 LYS  QB      4.75             (#peak  4357)
 &rst
  ixpk= 4357, nxpk= 0, iat= 991,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2=1252,1253,
 &end
#
#  66 HIS  HD2    67 SER  HN      6.15             (#peak   461)
 &rst
  ixpk= 461, nxpk= 0, iat= 999,1003, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  67 SER  HN    100 LEU  QD1     6.15             (#peak  1821)
 &rst
  ixpk= 1821, nxpk= 0, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1470,1471,1472,
 &end
#
#  67 SER  HN    100 LEU  QD2     6.15             (#peak  1820)
 &rst
  ixpk= 1820, nxpk= 0, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1474,1475,1476,
 &end
#
#  67 SER  HN     67 SER  HB2     3.39             (#peak   807)
 &rst
  ixpk= 807, nxpk= 0, iat=1003,1007, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,  &end
#
#  67 SER  HN     82 ALA  QB      6.15             (#peak  1866)
 &rst
  ixpk= 1866, nxpk= 0, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1220,1221,1222,
 &end
#
#  67 SER  HN     83 LYS  HN      5.99             (#peak   466)
 &rst
  ixpk= 466, nxpk= 0, iat=1003,1226, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,  &end
#
#  67 SER  HN     83 LYS  QD      6.15             (#peak  1798)
 &rst
  ixpk= 1798, nxpk= 0, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1236,1237,
 &end
#
#  67 SER  HN     84 LYS  HA      5.60             (#peak   460)
 &rst
  ixpk= 460, nxpk= 0, iat=1003,1250, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,  &end
#
#  67 SER  HA     98 GLY  HN      6.15             (#peak  1741)
 &rst
  ixpk= 1741, nxpk= 0, iat=1005,1443, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  67 SER  HB2   100 LEU  QD1     3.92             (#peak  4372)
 &rst
  ixpk= 4372, nxpk= 0, iat=1007,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2=1470,1471,1472,
 &end
#
#  67 SER  HB2   100 LEU  QD2     3.60             (#peak  4373)
 &rst
  ixpk= 4373, nxpk= 0, iat=1007,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2=1474,1475,1476,
 &end
#
#  67 SER  HB2    68 MET  HN      4.62             (#peak   809)
 &rst
  ixpk= 809, nxpk= 0, iat=1007,1014, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
#  67 SER  HB2    83 LYS  HB3     6.15             (#peak  4038)
 &rst
  ixpk= 4038, nxpk= 0, iat=1007,1231, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  67 SER  HB2    83 LYS  HG2     6.15             (#peak  4037)
 &rst
  ixpk= 4037, nxpk= 0, iat=1007,1233, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  67 SER  HB2    95 ASN  HD22    4.86             (#peak   805)
 &rst
  ixpk= 805, nxpk= 0, iat=1007,1408, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#  67 SER  HB2    97 ASN  HN      6.15             (#peak   808)
 &rst
  ixpk= 808, nxpk= 0, iat=1007,1429, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  67 SER  HB2    98 GLY  HN      5.40             (#peak   811)
 &rst
  ixpk= 811, nxpk= 0, iat=1007,1443, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
#  67 SER  HB3   100 LEU  QD1     4.50             (#peak  4370)
 &rst
  ixpk= 4370, nxpk= 0, iat=1008,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1470,1471,1472,
 &end
#
#  67 SER  HB3   100 LEU  QD2     4.50             (#peak  4371)
 &rst
  ixpk= 4371, nxpk= 0, iat=1008,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1474,1475,1476,
 &end
#
#  67 SER  HB3    68 MET  HN      4.11             (#peak  2522)
 &rst
  ixpk= 2522, nxpk= 0, iat=1008,1014, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
#  67 SER  HB3    83 LYS  HG2     6.15             (#peak  4039)
 &rst
  ixpk= 4039, nxpk= 0, iat=1008,1233, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  67 SER  HB3    83 LYS  HG3     5.38             (#peak  4040)
 &rst
  ixpk= 4040, nxpk= 0, iat=1008,1234, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
#  67 SER  HB3    95 ASN  HD22    4.76             (#peak  2518)
 &rst
  ixpk= 2518, nxpk= 0, iat=1008,1408, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  67 SER  HB3    97 ASN  HN      6.15             (#peak  2521)
 &rst
  ixpk= 2521, nxpk= 0, iat=1008,1429, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  67 SER  HB3    98 GLY  HN      5.91             (#peak  2524)
 &rst
  ixpk= 2524, nxpk= 0, iat=1008,1443, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,  &end
#
#  68 MET  HN     68 MET  HG2     5.39             (#peak  3638)
 &rst
  ixpk= 3638, nxpk= 0, iat=1014,1021, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,  &end
#
#  68 MET  HN     68 MET  HG3     4.76             (#peak  1931)
 &rst
  ixpk= 1931, nxpk= 0, iat=1014,1022, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  68 MET  HN     96 GLN  HN      6.15             (#peak  1749)
 &rst
  ixpk= 1749, nxpk= 0, iat=1014,1412, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  68 MET  HN     97 ASN  HN      6.15             (#peak  1784)
 &rst
  ixpk= 1784, nxpk= 0, iat=1014,1429, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  68 MET  HN     97 ASN  HB2     6.14             (#peak  1513)
 &rst
  ixpk= 1513, nxpk= 0, iat=1014,1433, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,  &end
#
#  68 MET  HN     97 ASN  HB3     5.41             (#peak  3269)
 &rst
  ixpk= 3269, nxpk= 0, iat=1014,1434, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#  68 MET  HN     98 GLY  HN      6.15             (#peak  1745)
 &rst
  ixpk= 1745, nxpk= 0, iat=1014,1443, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  68 MET  HA     68 MET  HG2     3.86             (#peak  3640)
 &rst
  ixpk= 3640, nxpk= 0, iat=1016,1021, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  68 MET  HA     68 MET  HG3     3.83             (#peak  1933)
 &rst
  ixpk= 1933, nxpk= 0, iat=1016,1022, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
#  68 MET  HA     68 MET  QE      3.48             (#peak  2107)
 &rst
  ixpk= 2107, nxpk= 0, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2=1025,1026,1027,
 &end
#
#  68 MET  HA     69 VAL  HN      3.20             (#peak  2113)
 &rst
  ixpk= 2113, nxpk= 0, iat=1016,1031, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  68 MET  HA     69 VAL  QG2     4.45             (#peak  2810)
 &rst
  ixpk= 2810, nxpk= 0, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2=1041,1042,1043,
 &end
#
#  68 MET  HA     82 ALA  HA      3.23             (#peak  1427)
 &rst
  ixpk= 1427, nxpk= 0, iat=1016,1218, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
#  68 MET  HA     83 LYS  HN      4.87             (#peak  2108)
 &rst
  ixpk= 2108, nxpk= 0, iat=1016,1226, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  68 MET  HB2    68 MET  QE      3.52             (#peak  3596)
 &rst
  ixpk= 3596, nxpk= 0, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
 igr2=1025,1026,1027,
 &end
#
#  68 MET  HB2    69 VAL  HN      5.42             (#peak  3601)
 &rst
  ixpk= 3601, nxpk= 0, iat=1018,1031, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#  68 MET  HB2    96 GLN  HN      6.15             (#peak  3600)
 &rst
  ixpk= 3600, nxpk= 0, iat=1018,1412, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  68 MET  HB3    68 MET  QE      4.38             (#peak  1433)
 &rst
  ixpk= 1433, nxpk= 0, iat=1019,  -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr2=1025,1026,1027,
 &end
#
#  68 MET  HB3    69 VAL  HN      5.37             (#peak  1405)
 &rst
  ixpk= 1405, nxpk= 0, iat=1019,1031, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,  &end
#
#  68 MET  HB3    96 GLN  QB      4.56             (#peak  2053)
 &rst
  ixpk= 2053, nxpk= 0, iat=1019,  -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
 igr2=1416,1417,
 &end
#
#  68 MET  HG2    68 MET  QE      3.65             (#peak  3637)
 &rst
  ixpk= 3637, nxpk= 0, iat=1021,  -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
 igr2=1025,1026,1027,
 &end
#
#  68 MET  HG2    69 VAL  HN      5.74             (#peak  3641)
 &rst
  ixpk= 3641, nxpk= 0, iat=1021,1031, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#  68 MET  HG2    81 VAL  HN      6.15             (#peak   238)
 &rst
  ixpk= 238, nxpk= 0, iat=1021,1200, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  68 MET  HG3    68 MET  QE      2.66             (#peak  1436)
 &rst
  ixpk= 1436, nxpk= 0, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,
 igr2=1025,1026,1027,
 &end
#
#  68 MET  HG3    69 VAL  HN      4.80             (#peak  1934)
 &rst
  ixpk= 1934, nxpk= 0, iat=1022,1031, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
#  68 MET  HG3    80 PRO  QB      4.39             (#peak  1930)
 &rst
  ixpk= 1930, nxpk= 0, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr2=1193,1194,
 &end
#
#  68 MET  HG3    81 VAL  HN      4.81             (#peak  1927)
 &rst
  ixpk= 1927, nxpk= 0, iat=1022,1200, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,  &end
#
#  68 MET  HG3    81 VAL  HA      4.93             (#peak  1926)
 &rst
  ixpk= 1926, nxpk= 0, iat=1022,1202, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,  &end
#
#  68 MET  QE     81 VAL  HA      3.74             (#peak  1432)
 &rst
  ixpk= 1432, nxpk= 0, iat=  -1,1202, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=1025,1026,1027,
 &end
#
#  68 MET  QE     82 ALA  HN      4.73             (#peak  1438)
 &rst
  ixpk= 1438, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
 igr1=1025,1026,1027,
 &end
#
#  68 MET  QE     82 ALA  QB      2.52             (#peak  1440)
 &rst
  ixpk= 1440, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
 igr1=1025,1026,1027,
 igr2=1220,1221,1222,
 &end
#
#  69 VAL  HN     69 VAL  HB      3.35             (#peak  3191)
 &rst
  ixpk= 3191, nxpk= 0, iat=1031,1035, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,  &end
#
#  69 VAL  HN     69 VAL  QG1     4.39             (#peak  1114)
 &rst
  ixpk= 1114, nxpk= 0, iat=1031,  -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr2=1037,1038,1039,
 &end
#
#  69 VAL  HN     69 VAL  QG2     3.10             (#peak  2813)
 &rst
  ixpk= 2813, nxpk= 0, iat=1031,  -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr2=1041,1042,1043,
 &end
#
#  69 VAL  HN     81 VAL  HN      5.06             (#peak  1113)
 &rst
  ixpk= 1113, nxpk= 0, iat=1031,1200, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,  &end
#
#  69 VAL  HN     82 ALA  HA      5.57             (#peak  1116)
 &rst
  ixpk= 1116, nxpk= 0, iat=1031,1218, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,  &end
#
#  69 VAL  HN     83 LYS  HG2     6.13             (#peak  3085)
 &rst
  ixpk= 3085, nxpk= 0, iat=1031,1233, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,  &end
#
#  69 VAL  HN     96 GLN  QB      6.15             (#peak  1118)
 &rst
  ixpk= 1118, nxpk= 0, iat=1031,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1416,1417,
 &end
#
#  69 VAL  HA     69 VAL  QG1     2.90             (#peak  3823)
 &rst
  ixpk= 3823, nxpk= 0, iat=1033,  -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
 igr2=1037,1038,1039,
 &end
#
#  69 VAL  HA     69 VAL  QG2     3.17             (#peak  3825)
 &rst
  ixpk= 3825, nxpk= 0, iat=1033,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2=1041,1042,1043,
 &end
#
#  69 VAL  HA     70 ASP  HN      3.09             (#peak  3822)
 &rst
  ixpk= 3822, nxpk= 0, iat=1033,1047, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,  &end
#
#  69 VAL  HA     95 ASN  HA      3.03             (#peak  3104)
 &rst
  ixpk= 3104, nxpk= 0, iat=1033,1400, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
#  69 VAL  HA     96 GLN  HN      4.75             (#peak   881)
 &rst
  ixpk= 881, nxpk= 0, iat=1033,1412, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
#  69 VAL  HB     70 ASP  HN      5.08             (#peak  3187)
 &rst
  ixpk= 3187, nxpk= 0, iat=1035,1047, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,  &end
#
#  69 VAL  HB     71 GLU  QG      4.29             (#peak  3193)
 &rst
  ixpk= 3193, nxpk= 0, iat=1035,  -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
 igr2=1066,1067,
 &end
#
#  69 VAL  HB     81 VAL  HB      5.49             (#peak  4309)
 &rst
  ixpk= 4309, nxpk= 0, iat=1035,1204, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,  &end
#
#  69 VAL  HB     83 LYS  QE      4.02             (#peak  3194)
 &rst
  ixpk= 3194, nxpk= 0, iat=1035,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2=1239,1240,
 &end
#
#  69 VAL  QG1    70 ASP  HN      4.08             (#peak  1012)
 &rst
  ixpk= 1012, nxpk= 0, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr1=1037,1038,1039,
 &end
#
#  69 VAL  QG1    71 GLU  HN      4.59             (#peak  1017)
 &rst
  ixpk= 1017, nxpk= 0, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
 igr1=1037,1038,1039,
 &end
#
#  69 VAL  QG1    71 GLU  HA      5.33             (#peak  3298)
 &rst
  ixpk= 3298, nxpk= 0, iat=  -1,1061, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr1=1037,1038,1039,
 &end
#
#  69 VAL  QG1    71 GLU  QG      3.76             (#peak  3405)
 &rst
  ixpk= 3405, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1=1037,1038,1039,
 igr2=1066,1067,
 &end
#
#  69 VAL  QG1    83 LYS  HG3     4.91             (#peak  1014)
 &rst
  ixpk= 1014, nxpk= 0, iat=  -1,1234, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1=1037,1038,1039,
 &end
#
#  69 VAL  QG1    83 LYS  QE      3.71             (#peak  1025)
 &rst
  ixpk= 1025, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1=1037,1038,1039,
 igr2=1239,1240,
 &end
#
#  69 VAL  QG1    89 VAL  HB      5.24             (#peak  4306)
 &rst
  ixpk= 4306, nxpk= 0, iat=  -1,1320, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr1=1037,1038,1039,
 &end
#
#  69 VAL  QG1    89 VAL  QG1     3.93             (#peak  4046)
 &rst
  ixpk= 4046, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1037,1038,1039,
 igr2=1322,1323,1324,
 &end
#
#  69 VAL  QG1    93 SER  QB      5.40             (#peak  4307)
 &rst
  ixpk= 4307, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1037,1038,1039,
 igr2=1372,1373,
 &end
#
#  69 VAL  QG1    94 ILE  HN      5.10             (#peak  1026)
 &rst
  ixpk= 1026, nxpk= 0, iat=  -1,1379, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr1=1037,1038,1039,
 &end
#
#  69 VAL  QG1    95 ASN  HN      4.81             (#peak  1013)
 &rst
  ixpk= 1013, nxpk= 0, iat=  -1,1398, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1=1037,1038,1039,
 &end
#
#  69 VAL  QG1    96 GLN  HN      6.00             (#peak  1018)
 &rst
  ixpk= 1018, nxpk= 0, iat=  -1,1412, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr1=1037,1038,1039,
 &end
#
#  69 VAL  QG2    70 ASP  HN      4.60             (#peak  2807)
 &rst
  ixpk= 2807, nxpk= 0, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
 igr1=1041,1042,1043,
 &end
#
#  69 VAL  QG2    83 LYS  HG2     3.03             (#peak  3084)
 &rst
  ixpk= 3084, nxpk= 0, iat=  -1,1233, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr1=1041,1042,1043,
 &end
#
#  69 VAL  QG2    89 VAL  QG1     3.68             (#peak  2809)
 &rst
  ixpk= 2809, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1=1041,1042,1043,
 igr2=1322,1323,1324,
 &end
#
#  69 VAL  QG2    89 VAL  QG2     5.26             (#peak  4047)
 &rst
  ixpk= 4047, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
 igr1=1041,1042,1043,
 igr2=1326,1327,1328,
 &end
#
#  69 VAL  QG2    95 ASN  HB2     4.55             (#peak  2817)
 &rst
  ixpk= 2817, nxpk= 0, iat=  -1,1402, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
 igr1=1041,1042,1043,
 &end
#
#  69 VAL  QG2    96 GLN  HN      5.15             (#peak  2811)
 &rst
  ixpk= 2811, nxpk= 0, iat=  -1,1412, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
 igr1=1041,1042,1043,
 &end
#
#  70 ASP  HN     70 ASP  HB2     3.74             (#peak   621)
 &rst
  ixpk= 621, nxpk= 0, iat=1047,1051, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
#  70 ASP  HN     70 ASP  HB3     3.75             (#peak  2250)
 &rst
  ixpk= 2250, nxpk= 0, iat=1047,1052, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
#  70 ASP  HN     71 GLU  HN      6.02             (#peak   311)
 &rst
  ixpk= 311, nxpk= 0, iat=1047,1059, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,  &end
#
#  70 ASP  HN     94 ILE  HN      6.15             (#peak  1587)
 &rst
  ixpk= 1587, nxpk= 0, iat=1047,1379, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  70 ASP  HN     94 ILE  HB      4.05             (#peak   752)
 &rst
  ixpk= 752, nxpk= 0, iat=1047,1383, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,  &end
#
# 70 ASP   HN     94 ILE  O       2.4
 &rst
  ixpk= 752, nxpk= 0, iat=1047,1396, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 70 ASP   HN     94 ILE  O       2.4
 &rst
  ixpk= 752, nxpk= 0, iat=1047,1396, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
#  70 ASP  HN     94 ILE  QG2     5.32             (#peak   239)
 &rst
  ixpk= 239, nxpk= 0, iat=1047,  -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
 igr2=1385,1386,1387,
 &end
#
#  70 ASP  HN     95 ASN  HA      4.37             (#peak  3097)
 &rst
  ixpk= 3097, nxpk= 0, iat=1047,1400, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,  &end
#
#  70 ASP  HA     72 SER  HN      5.14             (#peak  1543)
 &rst
  ixpk= 1543, nxpk= 0, iat=1049,1074, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,  &end
#
#  70 ASP  HA     80 PRO  HA      4.60             (#peak  1540)
 &rst
  ixpk= 1540, nxpk= 0, iat=1049,1196, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#  70 ASP  HA     81 VAL  HN      4.13             (#peak  1539)
 &rst
  ixpk= 1539, nxpk= 0, iat=1049,1200, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  70 ASP  HB2    71 GLU  HN      4.84             (#peak   622)
 &rst
  ixpk= 622, nxpk= 0, iat=1051,1059, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#  70 ASP  HB2    94 ILE  HB      4.87             (#peak   620)
 &rst
  ixpk= 620, nxpk= 0, iat=1051,1383, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  70 ASP  HB3    71 GLU  HN      4.66             (#peak  2251)
 &rst
  ixpk= 2251, nxpk= 0, iat=1052,1059, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
#  70 ASP  HB3    94 ILE  HN      4.67             (#peak  2256)
 &rst
  ixpk= 2256, nxpk= 0, iat=1052,1379, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  70 ASP  HB3    94 ILE  QD1     5.40             (#peak  1833)
 &rst
  ixpk= 1833, nxpk= 0, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr2=1392,1393,1394,
 &end
#
#  70 ASP  HB3    94 ILE  QG1     4.20             (#peak  2417)
 &rst
  ixpk= 2417, nxpk= 0, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr2=1389,1390,
 &end
#
#  71 GLU  HN     71 GLU  QG      3.73             (#peak  3406)
 &rst
  ixpk= 3406, nxpk= 0, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
 igr2=1066,1067,
 &end
#
#  71 GLU  HN     72 SER  HN      6.15             (#peak   588)
 &rst
  ixpk= 588, nxpk= 0, iat=1059,1074, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  71 GLU  HN     80 PRO  HA      5.82             (#peak   587)
 &rst
  ixpk= 587, nxpk= 0, iat=1059,1196, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,  &end
#
#  71 GLU  HA     71 GLU  QG      3.56             (#peak  3412)
 &rst
  ixpk= 3412, nxpk= 0, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2=1066,1067,
 &end
#
#  71 GLU  HA     74 ILE  HN      6.15             (#peak  1811)
 &rst
  ixpk= 1811, nxpk= 0, iat=1061,1104, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  71 GLU  HA     74 ILE  HB      5.17             (#peak  4278)
 &rst
  ixpk= 4278, nxpk= 0, iat=1061,1108, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,  &end
#
#  71 GLU  HA     90 ILE  QD1     4.97             (#peak  4369)
 &rst
  ixpk= 4369, nxpk= 0, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1345,1346,1347,
 &end
#
#  71 GLU  HA     94 ILE  HN      4.87             (#peak  3303)
 &rst
  ixpk= 3303, nxpk= 0, iat=1061,1379, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,  &end
#
#  71 GLU  QB     71 GLU  QG      2.40             (#peak  1665)
 &rst
  ixpk= 1665, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1=1063,1064,
 igr2=1066,1067,
 &end
#
#  71 GLU  QB     72 SER  HN      5.85             (#peak  1659)
 &rst
  ixpk= 1659, nxpk= 0, iat=  -1,1074, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
 igr1=1063,1064,
 &end
#
#  71 GLU  QB     74 ILE  HN      5.94             (#peak   828)
 &rst
  ixpk= 828, nxpk= 0, iat=  -1,1104, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1063,1064,
 &end
#
#  71 GLU  QB     75 THR  HN      5.50             (#peak  1663)
 &rst
  ixpk= 1663, nxpk= 0, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1063,1064,
 &end
#
#  71 GLU  QB     75 THR  QG2     4.83             (#peak  4111)
 &rst
  ixpk= 4111, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1=1063,1064,
 igr2=1129,1130,1131,
 &end
#
#  71 GLU  QB     90 ILE  QD1     4.36             (#peak  4367)
 &rst
  ixpk= 4367, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1063,1064,
 igr2=1345,1346,1347,
 &end
#
#  71 GLU  QB     93 SER  QB      4.46             (#peak  4207)
 &rst
  ixpk= 4207, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr1=1063,1064,
 igr2=1372,1373,
 &end
#
#  71 GLU  QG     72 SER  HN      4.79             (#peak  3404)
 &rst
  ixpk= 3404, nxpk= 0, iat=  -1,1074, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
 igr1=1066,1067,
 &end
#
#  71 GLU  QG     74 ILE  HN      6.15             (#peak  1831)
 &rst
  ixpk= 1831, nxpk= 0, iat=  -1,1104, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=1066,1067,
 &end
#
#  71 GLU  QG     75 THR  HN      6.15             (#peak  1324)
 &rst
  ixpk= 1324, nxpk= 0, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=1066,1067,
 &end
#
#  71 GLU  QG     75 THR  QG2     4.72             (#peak  4114)
 &rst
  ixpk= 4114, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1066,1067,
 igr2=1129,1130,1131,
 &end
#
#  71 GLU  QG     77 GLU  HG2     5.56             (#peak  4187)
 &rst
  ixpk= 4187, nxpk= 0, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1=1066,1067,
 &end
#
#  71 GLU  QG     77 GLU  HG3     4.90             (#peak  4188)
 &rst
  ixpk= 4188, nxpk= 0, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1=1066,1067,
 &end
#
#  71 GLU  QG     81 VAL  HN      5.18             (#peak  3403)
 &rst
  ixpk= 3403, nxpk= 0, iat=  -1,1200, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=1066,1067,
 &end
#
#  71 GLU  QG     90 ILE  QD1     3.91             (#peak  4366)
 &rst
  ixpk= 4366, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
 igr1=1066,1067,
 igr2=1345,1346,1347,
 &end
#
#  71 GLU  QG     93 SER  QB      4.09             (#peak  1569)
 &rst
  ixpk= 1569, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr1=1066,1067,
 igr2=1372,1373,
 &end
#
#  72 SER  HN     73 LEU  HN      6.15             (#peak   384)
 &rst
  ixpk= 384, nxpk= 0, iat=1074,1085, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  72 SER  HA     75 THR  HN      5.57             (#peak  1223)
 &rst
  ixpk= 1223, nxpk= 0, iat=1076,1123, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,  &end
#
#  72 SER  HB2    73 LEU  HN      4.78             (#peak   982)
 &rst
  ixpk= 982, nxpk= 0, iat=1078,1085, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,  &end
#
#  72 SER  HB2    74 ILE  HN      6.15             (#peak   825)
 &rst
  ixpk= 825, nxpk= 0, iat=1078,1104, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  72 SER  HB2    78 ALA  HN      5.58             (#peak  1718)
 &rst
  ixpk= 1718, nxpk= 0, iat=1078,1159, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,  &end
#
#  72 SER  HB2    78 ALA  HA      4.59             (#peak  3918)
 &rst
  ixpk= 3918, nxpk= 0, iat=1078,1161, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,  &end
#
#  72 SER  HB2    78 ALA  QB      4.36             (#peak  3920)
 &rst
  ixpk= 3920, nxpk= 0, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2=1163,1164,1165,
 &end
#
#  72 SER  HB2    79 MET  HN      6.15             (#peak  1720)
 &rst
  ixpk= 1720, nxpk= 0, iat=1078,1169, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  72 SER  HB3    73 LEU  HN      5.01             (#peak  2527)
 &rst
  ixpk= 2527, nxpk= 0, iat=1079,1085, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,  &end
#
#  72 SER  HB3    78 ALA  HN      5.97             (#peak  1719)
 &rst
  ixpk= 1719, nxpk= 0, iat=1079,1159, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
#  72 SER  HB3    78 ALA  HA      4.46             (#peak  3919)
 &rst
  ixpk= 3919, nxpk= 0, iat=1079,1161, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,  &end
#
#  72 SER  HB3    78 ALA  QB      4.61             (#peak  3921)
 &rst
  ixpk= 3921, nxpk= 0, iat=1079,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr2=1163,1164,1165,
 &end
#
#  72 SER  HB3    79 MET  HN      6.14             (#peak  1721)
 &rst
  ixpk= 1721, nxpk= 0, iat=1079,1169, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,  &end
#
#  73 LEU  HN     73 LEU  HB2     3.66             (#peak  2439)
 &rst
  ixpk= 2439, nxpk= 0, iat=1085,1089, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#  73 LEU  HN     73 LEU  HB3     4.06             (#peak   275)
 &rst
  ixpk= 275, nxpk= 0, iat=1085,1090, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  73 LEU  HN     73 LEU  HG      5.30             (#peak  1862)
 &rst
  ixpk= 1862, nxpk= 0, iat=1085,1092, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  73 LEU  HN     73 LEU  QD1     4.75             (#peak  3587)
 &rst
  ixpk= 3587, nxpk= 0, iat=1085,  -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr2=1094,1095,1096,
 &end
#
#  73 LEU  HN     73 LEU  QD2     4.92             (#peak  1388)
 &rst
  ixpk= 1388, nxpk= 0, iat=1085,  -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
 igr2=1098,1099,1100,
 &end
#
#  73 LEU  HN     74 ILE  HN      5.25             (#peak   822)
 &rst
  ixpk= 822, nxpk= 0, iat=1085,1104, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,  &end
#
#  73 LEU  HA     73 LEU  HG      3.90             (#peak  1866)
 &rst
  ixpk= 1866, nxpk= 0, iat=1087,1092, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
#  73 LEU  HA     73 LEU  QD1     3.79             (#peak  3592)
 &rst
  ixpk= 3592, nxpk= 0, iat=1087,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2=1094,1095,1096,
 &end
#
#  73 LEU  HA     73 LEU  QD2     3.90             (#peak  2303)
 &rst
  ixpk= 2303, nxpk= 0, iat=1087,  -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
 igr2=1098,1099,1100,
 &end
#
#  73 LEU  HA     76 GLY  HN      4.84             (#peak  2300)
 &rst
  ixpk= 2300, nxpk= 0, iat=1087,1137, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#  73 LEU  HA     76 GLY  HA2     4.01             (#peak  4189)
 &rst
  ixpk= 4189, nxpk= 0, iat=1087,1139, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  73 LEU  HB2    73 LEU  QD1     3.33             (#peak  2445)
 &rst
  ixpk= 2445, nxpk= 0, iat=1089,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2=1094,1095,1096,
 &end
#
#  73 LEU  HB2    73 LEU  QD2     3.80             (#peak  1395)
 &rst
  ixpk= 1395, nxpk= 0, iat=1089,  -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr2=1098,1099,1100,
 &end
#
#  73 LEU  HB2    74 ILE  HN      5.23             (#peak  2442)
 &rst
  ixpk= 2442, nxpk= 0, iat=1089,1104, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
#  73 LEU  HB3    73 LEU  QD1     2.63             (#peak   282)
 &rst
  ixpk= 282, nxpk= 0, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,
 igr2=1094,1095,1096,
 &end
#
#  73 LEU  HB3    73 LEU  QD2     3.68             (#peak   276)
 &rst
  ixpk= 276, nxpk= 0, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1098,1099,1100,
 &end
#
#  73 LEU  HB3    74 ILE  HN      3.93             (#peak   278)
 &rst
  ixpk= 278, nxpk= 0, iat=1090,1104, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,  &end
#
#  73 LEU  HB3    74 ILE  HG13    6.15             (#peak  2769)
 &rst
  ixpk= 2769, nxpk= 0, iat=1090,1115, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  73 LEU  HG     74 ILE  HN      5.58             (#peak  1865)
 &rst
  ixpk= 1865, nxpk= 0, iat=1092,1104, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,  &end
#
#  73 LEU  QD1    74 ILE  HN      6.15             (#peak  3591)
 &rst
  ixpk= 3591, nxpk= 0, iat=  -1,1104, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1=1094,1095,1096,
 &end
#
#  73 LEU  QD1    74 ILE  HA      4.12             (#peak  1129)
 &rst
  ixpk= 1129, nxpk= 0, iat=  -1,1106, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1094,1095,1096,
 &end
#
#  73 LEU  QD2    74 ILE  HN      6.01             (#peak  1393)
 &rst
  ixpk= 1393, nxpk= 0, iat=  -1,1104, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
 igr1=1098,1099,1100,
 &end
#
#  74 ILE  HN     74 ILE  HB      3.81             (#peak   824)
 &rst
  ixpk= 824, nxpk= 0, iat=1104,1108, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#  74 ILE  HN     74 ILE  HG12    3.80             (#peak   562)
 &rst
  ixpk= 562, nxpk= 0, iat=1104,1114, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  74 ILE  HN     74 ILE  HG13    3.98             (#peak  2774)
 &rst
  ixpk= 2774, nxpk= 0, iat=1104,1115, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,  &end
#
#  74 ILE  HN     74 ILE  QD1     4.21             (#peak    57)
 &rst
  ixpk= 57, nxpk= 0, iat=1104,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2=1117,1118,1119,
 &end
#
#  74 ILE  HN     74 ILE  QG2     5.33             (#peak  2197)
 &rst
  ixpk= 2197, nxpk= 0, iat=1104,  -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
 igr2=1110,1111,1112,
 &end
#
#  74 ILE  HN     75 THR  HN      3.56             (#peak  1319)
 &rst
  ixpk= 1319, nxpk= 0, iat=1104,1123, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  74 ILE  HA     74 ILE  HG12    3.57             (#peak   561)
 &rst
  ixpk= 561, nxpk= 0, iat=1106,1114, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,  &end
#
#  74 ILE  HA     74 ILE  QD1     3.04             (#peak    54)
 &rst
  ixpk= 54, nxpk= 0, iat=1106,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2=1117,1118,1119,
 &end
#
#  74 ILE  HA     74 ILE  QG2     2.92             (#peak  2195)
 &rst
  ixpk= 2195, nxpk= 0, iat=1106,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2=1110,1111,1112,
 &end
#
#  74 ILE  HB     74 ILE  HG13    3.00             (#peak   600)
 &rst
  ixpk= 600, nxpk= 0, iat=1108,1115, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
#  74 ILE  HB     74 ILE  QD1     3.32             (#peak    53)
 &rst
  ixpk= 53, nxpk= 0, iat=1108,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr2=1117,1118,1119,
 &end
#
#  74 ILE  HB     75 THR  HN      3.64             (#peak   601)
 &rst
  ixpk= 601, nxpk= 0, iat=1108,1123, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,  &end
#
#  74 ILE  HB     75 THR  QG2     4.56             (#peak   597)
 &rst
  ixpk= 597, nxpk= 0, iat=1108,  -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr2=1129,1130,1131,
 &end
#
#  74 ILE  HB     76 GLY  HN      4.95             (#peak   593)
 &rst
  ixpk= 593, nxpk= 0, iat=1108,1137, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  74 ILE  HG12   75 THR  HN      5.24             (#peak   565)
 &rst
  ixpk= 565, nxpk= 0, iat=1114,1123, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#  74 ILE  HG12   76 GLY  HN      6.15             (#peak  1722)
 &rst
  ixpk= 1722, nxpk= 0, iat=1114,1137, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  74 ILE  HG12   93 SER  HN      6.15             (#peak  1881)
 &rst
  ixpk= 1881, nxpk= 0, iat=1114,1368, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  74 ILE  HG13   93 SER  HN      4.65             (#peak  2776)
 &rst
  ixpk= 2776, nxpk= 0, iat=1115,1368, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,  &end
#
#  74 ILE  QD1   113 LEU  QD1     5.29             (#peak  4129)
 &rst
  ixpk= 4129, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
 igr1=1117,1118,1119,
 igr2=1652,1653,1654,
 &end
#
#  74 ILE  QD1   113 LEU  QD2     4.59             (#peak  4130)
 &rst
  ixpk= 4130, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1=1117,1118,1119,
 igr2=1656,1657,1658,
 &end
#
#  74 ILE  QD1    75 THR  HN      4.79             (#peak    62)
 &rst
  ixpk= 62, nxpk= 0, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1=1117,1118,1119,
 &end
#
#  74 ILE  QD1    76 GLY  HN      6.15             (#peak  1724)
 &rst
  ixpk= 1724, nxpk= 0, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1=1117,1118,1119,
 &end
#
#  74 ILE  QD1    90 ILE  QD1     4.26             (#peak  4119)
 &rst
  ixpk= 4119, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
 igr1=1117,1118,1119,
 igr2=1345,1346,1347,
 &end
#
#  74 ILE  QD1    90 ILE  QG1     4.60             (#peak  1377)
 &rst
  ixpk= 1377, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
 igr1=1117,1118,1119,
 igr2=1342,1343,
 &end
#
#  74 ILE  QD1    90 ILE  QG2     4.59             (#peak  4131)
 &rst
  ixpk= 4131, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1=1117,1118,1119,
 igr2=1338,1339,1340,
 &end
#
#  74 ILE  QD1    92 GLY  HN      5.27             (#peak    59)
 &rst
  ixpk= 59, nxpk= 0, iat=  -1,1361, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
 igr1=1117,1118,1119,
 &end
#
#  74 ILE  QD1    92 GLY  HA3     3.29             (#peak    56)
 &rst
  ixpk= 56, nxpk= 0, iat=  -1,1364, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
 igr1=1117,1118,1119,
 &end
#
#  74 ILE  QD1    93 SER  HN      4.50             (#peak    60)
 &rst
  ixpk= 60, nxpk= 0, iat=  -1,1368, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1117,1118,1119,
 &end
#
#  74 ILE  QG2    74 ILE  HG12    3.77             (#peak   563)
 &rst
  ixpk= 563, nxpk= 0, iat=  -1,1114, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1110,1111,1112,
 &end
#
#  74 ILE  QG2    74 ILE  HG13    3.48             (#peak  2775)
 &rst
  ixpk= 2775, nxpk= 0, iat=  -1,1115, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr1=1110,1111,1112,
 &end
#
#  74 ILE  QG2    74 ILE  QD1     2.40             (#peak    58)
 &rst
  ixpk= 58, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1=1110,1111,1112,
 igr2=1117,1118,1119,
 &end
#
#  74 ILE  QG2    75 THR  HN      3.72             (#peak  2200)
 &rst
  ixpk= 2200, nxpk= 0, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr1=1110,1111,1112,
 &end
#
#  74 ILE  QG2    75 THR  HA      4.69             (#peak  2194)
 &rst
  ixpk= 2194, nxpk= 0, iat=  -1,1125, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr1=1110,1111,1112,
 &end
#
#  74 ILE  QG2    75 THR  QG2     4.40             (#peak  2196)
 &rst
  ixpk= 2196, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1110,1111,1112,
 igr2=1129,1130,1131,
 &end
#
#  74 ILE  QG2    76 GLY  HN      6.15             (#peak  1723)
 &rst
  ixpk= 1723, nxpk= 0, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1=1110,1111,1112,
 &end
#
#  75 THR  HN     75 THR  QG2     4.32             (#peak  1167)
 &rst
  ixpk= 1167, nxpk= 0, iat=1123,  -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
 igr2=1129,1130,1131,
 &end
#
#  75 THR  HN     76 GLY  HN      6.15             (#peak    22)
 &rst
  ixpk= 22, nxpk= 0, iat=1123,1137, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  75 THR  HN     77 GLU  HN      5.38             (#peak  1322)
 &rst
  ixpk= 1322, nxpk= 0, iat=1123,1144, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,  &end
#
#  75 THR  HA     75 THR  QG2     2.65             (#peak  1164)
 &rst
  ixpk= 1164, nxpk= 0, iat=1125,  -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
 igr2=1129,1130,1131,
 &end
#
#  75 THR  HB     76 GLY  HN      6.15             (#peak  3346)
 &rst
  ixpk= 3346, nxpk= 0, iat=1127,1137, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  75 THR  HB     77 GLU  HN      4.26             (#peak  3350)
 &rst
  ixpk= 3350, nxpk= 0, iat=1127,1144, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,  &end
#
#  75 THR  QG2    76 GLY  HN      4.53             (#peak  1162)
 &rst
  ixpk= 1162, nxpk= 0, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1=1129,1130,1131,
 &end
#
#  75 THR  QG2    77 GLU  HN      5.36             (#peak  1168)
 &rst
  ixpk= 1168, nxpk= 0, iat=  -1,1144, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1=1129,1130,1131,
 &end
#
#  75 THR  QG2    77 GLU  HG2     4.81             (#peak  4134)
 &rst
  ixpk= 4134, nxpk= 0, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
 igr1=1129,1130,1131,
 &end
#
#  75 THR  QG2    77 GLU  HG3     4.65             (#peak  4133)
 &rst
  ixpk= 4133, nxpk= 0, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=1129,1130,1131,
 &end
#
#  76 GLY  HN     77 GLU  HN      4.01             (#peak  1365)
 &rst
  ixpk= 1365, nxpk= 0, iat=1137,1144, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  76 GLY  HN     77 GLU  HB2     6.15             (#peak    16)
 &rst
  ixpk= 16, nxpk= 0, iat=1137,1148, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  76 GLY  HN     77 GLU  HG2     6.15             (#peak  2225)
 &rst
  ixpk= 2225, nxpk= 0, iat=1137,1151, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  76 GLY  HN     77 GLU  HG3     6.15             (#peak   289)
 &rst
  ixpk= 289, nxpk= 0, iat=1137,1152, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  77 GLU  HN     77 GLU  HB2     4.03             (#peak   791)
 &rst
  ixpk= 791, nxpk= 0, iat=1144,1148, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  77 GLU  HN     77 GLU  HB3     4.07             (#peak  2464)
 &rst
  ixpk= 2464, nxpk= 0, iat=1144,1149, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
#  77 GLU  HN     77 GLU  HG2     3.50             (#peak  2231)
 &rst
  ixpk= 2231, nxpk= 0, iat=1144,1151, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  77 GLU  HN     77 GLU  HG3     4.70             (#peak   295)
 &rst
  ixpk= 295, nxpk= 0, iat=1144,1152, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  77 GLU  HN     78 ALA  HN      5.20             (#peak  1819)
 &rst
  ixpk= 1819, nxpk= 0, iat=1144,1159, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
#  77 GLU  HN     79 MET  HN      6.15             (#peak  1367)
 &rst
  ixpk= 1367, nxpk= 0, iat=1144,1169, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  77 GLU  HA     77 GLU  HG2     3.99             (#peak  2229)
 &rst
  ixpk= 2229, nxpk= 0, iat=1146,1151, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
#  77 GLU  HA     77 GLU  HG3     4.01             (#peak   293)
 &rst
  ixpk= 293, nxpk= 0, iat=1146,1152, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,  &end
#
#  77 GLU  HA     79 MET  HN      5.24             (#peak  2353)
 &rst
  ixpk= 2353, nxpk= 0, iat=1146,1169, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,  &end
#
#  77 GLU  HB2    78 ALA  HN      4.76             (#peak   787)
 &rst
  ixpk= 787, nxpk= 0, iat=1148,1159, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  77 GLU  HB2    79 MET  HN      4.96             (#peak   785)
 &rst
  ixpk= 785, nxpk= 0, iat=1148,1169, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
#  77 GLU  HB3    78 ALA  HN      4.72             (#peak  2460)
 &rst
  ixpk= 2460, nxpk= 0, iat=1149,1159, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,  &end
#
#  77 GLU  HB3    79 MET  HN      5.32             (#peak  2458)
 &rst
  ixpk= 2458, nxpk= 0, iat=1149,1169, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,  &end
#
#  77 GLU  HG2    78 ALA  HN      6.15             (#peak  1815)
 &rst
  ixpk= 1815, nxpk= 0, iat=1151,1159, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  77 GLU  HG2    79 MET  HN      6.15             (#peak  1817)
 &rst
  ixpk= 1817, nxpk= 0, iat=1151,1169, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  77 GLU  HG2    81 VAL  QG1     6.15             (#peak  4192)
 &rst
  ixpk= 4192, nxpk= 0, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1206,1207,1208,
 &end
#
#  77 GLU  HG2    81 VAL  QG2     4.77             (#peak  4191)
 &rst
  ixpk= 4191, nxpk= 0, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
 igr2=1210,1211,1212,
 &end
#
#  77 GLU  HG3    78 ALA  HN      6.15             (#peak  1816)
 &rst
  ixpk= 1816, nxpk= 0, iat=1152,1159, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  77 GLU  HG3    79 MET  HN      5.56             (#peak  1818)
 &rst
  ixpk= 1818, nxpk= 0, iat=1152,1169, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
#  77 GLU  HG3    81 VAL  QG1     5.24             (#peak  4194)
 &rst
  ixpk= 4194, nxpk= 0, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
 igr2=1206,1207,1208,
 &end
#
#  77 GLU  HG3    81 VAL  QG2     4.45             (#peak  4193)
 &rst
  ixpk= 4193, nxpk= 0, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr2=1210,1211,1212,
 &end
#
#  78 ALA  HN     78 ALA  QB      4.06             (#peak  1876)
 &rst
  ixpk= 1876, nxpk= 0, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1163,1164,1165,
 &end
#
#  78 ALA  HN     79 MET  HN      6.15             (#peak   736)
 &rst
  ixpk= 736, nxpk= 0, iat=1159,1169, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  78 ALA  HN     79 MET  HB2     5.99             (#peak  1748)
 &rst
  ixpk= 1748, nxpk= 0, iat=1159,1173, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,  &end
#
#  78 ALA  HN     79 MET  HB3     5.72             (#peak  1749)
 &rst
  ixpk= 1749, nxpk= 0, iat=1159,1174, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,  &end
#
#  78 ALA  HN     79 MET  QG      6.15             (#peak   738)
 &rst
  ixpk= 738, nxpk= 0, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1176,1177,
 &end
#
#  78 ALA  QB     79 MET  HN      3.79             (#peak  1875)
 &rst
  ixpk= 1875, nxpk= 0, iat=  -1,1169, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr1=1163,1164,1165,
 &end
#
#  79 MET  HN     79 MET  HB2     4.03             (#peak  1518)
 &rst
  ixpk= 1518, nxpk= 0, iat=1169,1173, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  79 MET  HN     79 MET  QG      4.02             (#peak  1098)
 &rst
  ixpk= 1098, nxpk= 0, iat=1169,  -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
 igr2=1176,1177,
 &end
#
#  79 MET  HA     79 MET  QG      3.57             (#peak  1097)
 &rst
  ixpk= 1097, nxpk= 0, iat=1171,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2=1176,1177,
 &end
#
#  79 MET  HA     80 PRO  HD2     2.74             (#peak  3357)
 &rst
  ixpk= 3357, nxpk= 0, iat=1171,1187, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24,  &end
#
#  79 MET  HA     80 PRO  HD3     2.56             (#peak  1177)
 &rst
  ixpk= 1177, nxpk= 0, iat=1171,1188, r1= 1.30, r2= 1.80, r3= 2.56, r4= 3.06,  &end
#
#  79 MET  HB2    79 MET  QG      2.52             (#peak  1519)
 &rst
  ixpk= 1519, nxpk= 0, iat=1173,  -1, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33,
 igr2=1176,1177,
 &end
#
#  79 MET  HB3    79 MET  QG      2.64             (#peak  3276)
 &rst
  ixpk= 3276, nxpk= 0, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,
 igr2=1176,1177,
 &end
#
#  79 MET  HB3    80 PRO  HD2     4.28             (#peak  3363)
 &rst
  ixpk= 3363, nxpk= 0, iat=1174,1187, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,  &end
#
#  80 PRO  HA     81 VAL  HN      3.10             (#peak   584)
 &rst
  ixpk= 584, nxpk= 0, iat=1196,1200, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#  80 PRO  HA     81 VAL  QG2     4.19             (#peak   590)
 &rst
  ixpk= 590, nxpk= 0, iat=1196,  -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
 igr2=1210,1211,1212,
 &end
#
#  80 PRO  QB     81 VAL  HN      3.89             (#peak  1614)
 &rst
  ixpk= 1614, nxpk= 0, iat=  -1,1200, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
 igr1=1193,1194,
 &end
#
#  81 VAL  HN     81 VAL  HB      3.10             (#peak  2473)
 &rst
  ixpk= 2473, nxpk= 0, iat=1200,1204, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,  &end
#
#  81 VAL  HN     81 VAL  QG1     5.20             (#peak   303)
 &rst
  ixpk= 303, nxpk= 0, iat=1200,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr2=1206,1207,1208,
 &end
#
#  81 VAL  HN     81 VAL  QG2     3.00             (#peak  1895)
 &rst
  ixpk= 1895, nxpk= 0, iat=1200,  -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
 igr2=1210,1211,1212,
 &end
#
#  81 VAL  HN     82 ALA  HN      6.15             (#peak  1161)
 &rst
  ixpk= 1161, nxpk= 0, iat=1200,1216, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  81 VAL  HA     81 VAL  QG1     3.16             (#peak   302)
 &rst
  ixpk= 302, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
 igr2=1206,1207,1208,
 &end
#
#  81 VAL  HA     81 VAL  QG2     3.34             (#peak   479)
 &rst
  ixpk= 479, nxpk= 0, iat=1202,  -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
 igr2=1210,1211,1212,
 &end
#
#  81 VAL  HA     82 ALA  HN      2.65             (#peak   482)
 &rst
  ixpk= 482, nxpk= 0, iat=1202,1216, r1= 1.30, r2= 1.80, r3= 2.65, r4= 3.15,  &end
#
#  81 VAL  HB     82 ALA  HN      4.50             (#peak  2476)
 &rst
  ixpk= 2476, nxpk= 0, iat=1204,1216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  81 VAL  HB     83 LYS  QE      4.39             (#peak  2477)
 &rst
  ixpk= 2477, nxpk= 0, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
 igr2=1239,1240,
 &end
#
#  81 VAL  QG1    82 ALA  HN      3.09             (#peak   307)
 &rst
  ixpk= 307, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
 igr1=1206,1207,1208,
 &end
#
#  81 VAL  QG1    82 ALA  QB      4.42             (#peak   309)
 &rst
  ixpk= 309, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
 igr1=1206,1207,1208,
 igr2=1220,1221,1222,
 &end
#
#  81 VAL  QG1    83 LYS  QD      5.00             (#peak   304)
 &rst
  ixpk= 304, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
 igr1=1206,1207,1208,
 igr2=1236,1237,
 &end
#
#  81 VAL  QG1    83 LYS  QE      3.89             (#peak  3491)
 &rst
  ixpk= 3491, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1=1206,1207,1208,
 igr2=1239,1240,
 &end
#
#  81 VAL  QG2    82 ALA  HN      4.50             (#peak  1899)
 &rst
  ixpk= 1899, nxpk= 0, iat=  -1,1216, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1210,1211,1212,
 &end
#
#  82 ALA  HN     82 ALA  QB      2.51             (#peak  3616)
 &rst
  ixpk= 3616, nxpk= 0, iat=1216,  -1, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
 igr2=1220,1221,1222,
 &end
#
#  82 ALA  HA     83 LYS  HN      2.62             (#peak  1426)
 &rst
  ixpk= 1426, nxpk= 0, iat=1218,1226, r1= 1.30, r2= 1.80, r3= 2.62, r4= 3.12,  &end
#
#  82 ALA  HA     83 LYS  HG2     5.18             (#peak  3081)
 &rst
  ixpk= 3081, nxpk= 0, iat=1218,1233, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,  &end
#
#  82 ALA  QB     83 LYS  HN      3.30             (#peak  3615)
 &rst
  ixpk= 3615, nxpk= 0, iat=  -1,1226, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1220,1221,1222,
 &end
#
#  83 LYS  HN     83 LYS  HB3     4.02             (#peak   193)
 &rst
  ixpk= 193, nxpk= 0, iat=1226,1231, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,  &end
#
#  83 LYS  HN     83 LYS  HG2     4.76             (#peak  3082)
 &rst
  ixpk= 3082, nxpk= 0, iat=1226,1233, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
#  83 LYS  HN     83 LYS  HG3     5.74             (#peak   897)
 &rst
  ixpk= 897, nxpk= 0, iat=1226,1234, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,  &end
#
#  83 LYS  HN     83 LYS  QD      5.04             (#peak  1322)
 &rst
  ixpk= 1322, nxpk= 0, iat=1226,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr2=1236,1237,
 &end
#
#  83 LYS  HN     83 LYS  QE      6.15             (#peak  3496)
 &rst
  ixpk= 3496, nxpk= 0, iat=1226,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1239,1240,
 &end
#
#  83 LYS  HN     84 LYS  HN      6.15             (#peak   712)
 &rst
  ixpk= 712, nxpk= 0, iat=1226,1248, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  83 LYS  HA     83 LYS  HG2     3.81             (#peak  3078)
 &rst
  ixpk= 3078, nxpk= 0, iat=1228,1233, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,  &end
#
#  83 LYS  HA     83 LYS  QD      3.72             (#peak   976)
 &rst
  ixpk= 976, nxpk= 0, iat=1228,  -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
 igr2=1236,1237,
 &end
#
#  83 LYS  HA     83 LYS  QE      4.37             (#peak  3493)
 &rst
  ixpk= 3493, nxpk= 0, iat=1228,  -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
 igr2=1239,1240,
 &end
#
#  83 LYS  HA     84 LYS  HN      3.26             (#peak   977)
 &rst
  ixpk= 977, nxpk= 0, iat=1228,1248, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,  &end
#
#  83 LYS  HB2    83 LYS  QD      3.56             (#peak  1745)
 &rst
  ixpk= 1745, nxpk= 0, iat=1230,  -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr2=1236,1237,
 &end
#
#  83 LYS  HB2    83 LYS  QE      4.59             (#peak  3497)
 &rst
  ixpk= 3497, nxpk= 0, iat=1230,  -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
 igr2=1239,1240,
 &end
#
#  83 LYS  HB2    84 LYS  HN      4.74             (#peak   615)
 &rst
  ixpk= 615, nxpk= 0, iat=1230,1248, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
#  83 LYS  HB3    83 LYS  QD      2.96             (#peak  1316)
 &rst
  ixpk= 1316, nxpk= 0, iat=1231,  -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
 igr2=1236,1237,
 &end
#
#  83 LYS  HB3    83 LYS  QE      4.72             (#peak  3490)
 &rst
  ixpk= 3490, nxpk= 0, iat=1231,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2=1239,1240,
 &end
#
#  83 LYS  HB3    84 LYS  HN      4.67             (#peak   192)
 &rst
  ixpk= 192, nxpk= 0, iat=1231,1248, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
#  83 LYS  HG2    83 LYS  QD      2.98             (#peak  1324)
 &rst
  ixpk= 1324, nxpk= 0, iat=1233,  -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
 igr2=1236,1237,
 &end
#
#  83 LYS  HG2    83 LYS  QE      2.95             (#peak  3499)
 &rst
  ixpk= 3499, nxpk= 0, iat=1233,  -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
 igr2=1239,1240,
 &end
#
#  83 LYS  HG2    84 LYS  HN      5.20             (#peak  3080)
 &rst
  ixpk= 3080, nxpk= 0, iat=1233,1248, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,  &end
#
#  83 LYS  HG2    87 SER  HB2     6.15             (#peak  4350)
 &rst
  ixpk= 4350, nxpk= 0, iat=1233,1295, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  83 LYS  HG2    87 SER  HB3     6.05             (#peak  4353)
 &rst
  ixpk= 4353, nxpk= 0, iat=1233,1296, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
#  83 LYS  HG3    83 LYS  QD      2.54             (#peak   895)
 &rst
  ixpk= 895, nxpk= 0, iat=1234,  -1, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,
 igr2=1236,1237,
 &end
#
#  83 LYS  HG3    83 LYS  QE      3.15             (#peak  3492)
 &rst
  ixpk= 3492, nxpk= 0, iat=1234,  -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
 igr2=1239,1240,
 &end
#
#  83 LYS  HG3    84 LYS  HN      5.23             (#peak   896)
 &rst
  ixpk= 896, nxpk= 0, iat=1234,1248, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
#  83 LYS  HG3    87 SER  HB2     6.15             (#peak  4351)
 &rst
  ixpk= 4351, nxpk= 0, iat=1234,1295, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  83 LYS  HG3    87 SER  HB3     6.10             (#peak  4352)
 &rst
  ixpk= 4352, nxpk= 0, iat=1234,1296, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,  &end
#
#  83 LYS  QD     84 LYS  HN      4.20             (#peak  1321)
 &rst
  ixpk= 1321, nxpk= 0, iat=  -1,1248, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
 igr1=1236,1237,
 &end
#
#  84 LYS  HN     84 LYS  HG2     5.02             (#peak  3118)
 &rst
  ixpk= 3118, nxpk= 0, iat=1248,1255, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  84 LYS  HN     84 LYS  HG3     6.15             (#peak   606)
 &rst
  ixpk= 606, nxpk= 0, iat=1248,1256, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  84 LYS  HN     84 LYS  QB      4.05             (#peak   926)
 &rst
  ixpk= 926, nxpk= 0, iat=1248,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2=1252,1253,
 &end
#
#  84 LYS  HN     84 LYS  QD      5.36             (#peak  1361)
 &rst
  ixpk= 1361, nxpk= 0, iat=1248,  -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
 igr2=1258,1259,
 &end
#
#  84 LYS  HN     87 SER  HN      6.15             (#peak  1791)
 &rst
  ixpk= 1791, nxpk= 0, iat=1248,1291, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  84 LYS  HN     87 SER  HB2     6.15             (#peak  1806)
 &rst
  ixpk= 1806, nxpk= 0, iat=1248,1295, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  84 LYS  HN     87 SER  HB3     6.15             (#peak  1807)
 &rst
  ixpk= 1807, nxpk= 0, iat=1248,1296, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  84 LYS  HA     84 LYS  HG2     4.18             (#peak  3114)
 &rst
  ixpk= 3114, nxpk= 0, iat=1250,1255, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,  &end
#
#  84 LYS  HA     84 LYS  HG3     4.08             (#peak    18)
 &rst
  ixpk= 18, nxpk= 0, iat=1250,1256, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
#  84 LYS  HA     84 LYS  QD      4.55             (#peak  1358)
 &rst
  ixpk= 1358, nxpk= 0, iat=1250,  -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
 igr2=1258,1259,
 &end
#
#  84 LYS  HA     84 LYS  QE      4.90             (#peak    26)
 &rst
  ixpk= 26, nxpk= 0, iat=1250,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr2=1261,1262,
 &end
#
#  84 LYS  HG2    84 LYS  QE      3.35             (#peak  3121)
 &rst
  ixpk= 3121, nxpk= 0, iat=1255,  -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
 igr2=1261,1262,
 &end
#
#  84 LYS  HG2    85 PRO  QD      5.20             (#peak  1199)
 &rst
  ixpk= 1199, nxpk= 0, iat=1255,  -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
 igr2=1271,1272,
 &end
#
#  84 LYS  HG3    84 LYS  QE      3.43             (#peak   609)
 &rst
  ixpk= 609, nxpk= 0, iat=1256,  -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
 igr2=1261,1262,
 &end
#
#  84 LYS  HG3    85 PRO  QD      4.57             (#peak  1195)
 &rst
  ixpk= 1195, nxpk= 0, iat=1256,  -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
 igr2=1271,1272,
 &end
#
#  84 LYS  QB     84 LYS  QD      3.59             (#peak   927)
 &rst
  ixpk= 927, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
 igr1=1252,1253,
 igr2=1258,1259,
 &end
#
#  84 LYS  QB     84 LYS  QE      2.61             (#peak  3524)
 &rst
  ixpk= 3524, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
 igr1=1252,1253,
 igr2=1261,1262,
 &end
#
#  84 LYS  QB     85 PRO  QD      2.72             (#peak  1196)
 &rst
  ixpk= 1196, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
 igr1=1252,1253,
 igr2=1271,1272,
 &end
#
#  84 LYS  QB     87 SER  HN      5.74             (#peak   925)
 &rst
  ixpk= 925, nxpk= 0, iat=  -1,1291, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1=1252,1253,
 &end
#
#  84 LYS  QD     84 LYS  QE      2.40             (#peak  3527)
 &rst
  ixpk= 3527, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1=1258,1259,
 igr2=1261,1262,
 &end
#
#  84 LYS  QE     85 PRO  QD      4.28             (#peak  3525)
 &rst
  ixpk= 3525, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
 igr1=1261,1262,
 igr2=1271,1272,
 &end
#
#  85 PRO  HA     86 GLY  HN      3.11             (#peak  3686)
 &rst
  ixpk= 3686, nxpk= 0, iat=1280,1284, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
#  85 PRO  HG2    86 GLY  HN      5.23             (#peak  1634)
 &rst
  ixpk= 1634, nxpk= 0, iat=1274,1284, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
#  85 PRO  QB     86 GLY  HN      4.12             (#peak    89)
 &rst
  ixpk= 89, nxpk= 0, iat=  -1,1284, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr1=1277,1278,
 &end
#
#  86 GLY  HN     87 SER  HN      4.40             (#peak   524)
 &rst
  ixpk= 524, nxpk= 0, iat=1284,1291, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,  &end
#
#  86 GLY  HA2    87 SER  HN      3.56             (#peak   523)
 &rst
  ixpk= 523, nxpk= 0, iat=1286,1291, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,  &end
#
#  87 SER  HN     87 SER  HB2     3.01             (#peak  2997)
 &rst
  ixpk= 2997, nxpk= 0, iat=1291,1295, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,  &end
#
#  87 SER  HA     88 THR  QG2     3.86             (#peak  2142)
 &rst
  ixpk= 2142, nxpk= 0, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2=1308,1309,1310,
 &end
#
#  87 SER  HB2    88 THR  HN      4.89             (#peak  2995)
 &rst
  ixpk= 2995, nxpk= 0, iat=1295,1302, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
#  87 SER  HB3    88 THR  HN      4.53             (#peak   798)
 &rst
  ixpk= 798, nxpk= 0, iat=1296,1302, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,  &end
#
#  88 THR  HN     88 THR  HB      4.17             (#peak   525)
 &rst
  ixpk= 525, nxpk= 0, iat=1302,1306, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
#  88 THR  HN     88 THR  QG2     3.37             (#peak  2138)
 &rst
  ixpk= 2138, nxpk= 0, iat=1302,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=1308,1309,1310,
 &end
#
#  88 THR  HN     89 VAL  HN      4.70             (#peak  1462)
 &rst
  ixpk= 1462, nxpk= 0, iat=1302,1316, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,  &end
#
#  88 THR  HA     88 THR  QG2     2.71             (#peak  2141)
 &rst
  ixpk= 2141, nxpk= 0, iat=1304,  -1, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,
 igr2=1308,1309,1310,
 &end
#
#  88 THR  HA     89 VAL  HN      3.01             (#peak  1561)
 &rst
  ixpk= 1561, nxpk= 0, iat=1304,1316, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,  &end
#
#  88 THR  HA     89 VAL  QG1     5.04             (#peak  1555)
 &rst
  ixpk= 1555, nxpk= 0, iat=1304,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=1322,1323,1324,
 &end
#
#  88 THR  HA     89 VAL  QG2     3.98             (#peak  2927)
 &rst
  ixpk= 2927, nxpk= 0, iat=1304,  -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
 igr2=1326,1327,1328,
 &end
#
#  88 THR  HB     89 VAL  HN      4.20             (#peak   529)
 &rst
  ixpk= 529, nxpk= 0, iat=1306,1316, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
#  88 THR  QG2    89 VAL  HN      4.65             (#peak  2145)
 &rst
  ixpk= 2145, nxpk= 0, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
 igr1=1308,1309,1310,
 &end
#
#  89 VAL  HN     89 VAL  QG1     3.87             (#peak  1137)
 &rst
  ixpk= 1137, nxpk= 0, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
 igr2=1322,1323,1324,
 &end
#
#  89 VAL  HN     89 VAL  QG2     3.15             (#peak  2933)
 &rst
  ixpk= 2933, nxpk= 0, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2=1326,1327,1328,
 &end
#
#  89 VAL  HA     89 VAL  QG1     3.15             (#peak  1136)
 &rst
  ixpk= 1136, nxpk= 0, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
 igr2=1322,1323,1324,
 &end
#
#  89 VAL  HA     89 VAL  QG2     3.62             (#peak  2932)
 &rst
  ixpk= 2932, nxpk= 0, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
 igr2=1326,1327,1328,
 &end
#
#  89 VAL  HA     90 ILE  HN      3.48             (#peak  3503)
 &rst
  ixpk= 3503, nxpk= 0, iat=1318,1332, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  89 VAL  HB     90 ILE  HN      4.06             (#peak  3305)
 &rst
  ixpk= 3305, nxpk= 0, iat=1320,1332, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,  &end
#
#  89 VAL  QG1   102 ILE  QG1     4.76             (#peak  1139)
 &rst
  ixpk= 1139, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
 igr1=1322,1323,1324,
 igr2=1509,1510,
 &end
#
#  89 VAL  QG1    90 ILE  HN      4.33             (#peak  1132)
 &rst
  ixpk= 1132, nxpk= 0, iat=  -1,1332, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr1=1322,1323,1324,
 &end
#
#  89 VAL  QG2   102 ILE  QG1     4.78             (#peak  2935)
 &rst
  ixpk= 2935, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
 igr1=1326,1327,1328,
 igr2=1509,1510,
 &end
#
#  89 VAL  QG2   102 ILE  QG2     3.47             (#peak  2924)
 &rst
  ixpk= 2924, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1=1326,1327,1328,
 igr2=1505,1506,1507,
 &end
#
#  89 VAL  QG2    90 ILE  HN      5.94             (#peak  2928)
 &rst
  ixpk= 2928, nxpk= 0, iat=  -1,1332, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
 igr1=1326,1327,1328,
 &end
#
#  89 VAL  QG2    90 ILE  HA      5.25             (#peak  2925)
 &rst
  ixpk= 2925, nxpk= 0, iat=  -1,1334, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1326,1327,1328,
 &end
#
#  90 ILE  HN     90 ILE  QD1     5.28             (#peak   947)
 &rst
  ixpk= 947, nxpk= 0, iat=1332,  -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
 igr2=1345,1346,1347,
 &end
#
#  90 ILE  HN     90 ILE  QG1     6.15             (#peak  1382)
 &rst
  ixpk= 1382, nxpk= 0, iat=1332,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1342,1343,
 &end
#
#  90 ILE  HN     90 ILE  QG2     6.15             (#peak   994)
 &rst
  ixpk= 994, nxpk= 0, iat=1332,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1338,1339,1340,
 &end
#
#  90 ILE  HN     91 ALA  HN      6.15             (#peak   988)
 &rst
  ixpk= 988, nxpk= 0, iat=1332,1351, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  90 ILE  HA     90 ILE  QD1     4.23             (#peak   941)
 &rst
  ixpk= 941, nxpk= 0, iat=1334,  -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr2=1345,1346,1347,
 &end
#
#  90 ILE  HA     90 ILE  QG1     3.61             (#peak  1378)
 &rst
  ixpk= 1378, nxpk= 0, iat=1334,  -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
 igr2=1342,1343,
 &end
#
#  90 ILE  HA     90 ILE  QG2     3.69             (#peak  3128)
 &rst
  ixpk= 3128, nxpk= 0, iat=1334,  -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
 igr2=1338,1339,1340,
 &end
#
#  90 ILE  HA     91 ALA  HN      3.20             (#peak   741)
 &rst
  ixpk= 741, nxpk= 0, iat=1334,1351, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,  &end
#
#  90 ILE  HB    113 LEU  QD1     3.51             (#peak  4391)
 &rst
  ixpk= 4391, nxpk= 0, iat=1336,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1652,1653,1654,
 &end
#
#  90 ILE  HB     90 ILE  QD1     3.59             (#peak  3542)
 &rst
  ixpk= 3542, nxpk= 0, iat=1336,  -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr2=1345,1346,1347,
 &end
#
#  90 ILE  HB     90 ILE  QG1     2.58             (#peak  1386)
 &rst
  ixpk= 1386, nxpk= 0, iat=1336,  -1, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,
 igr2=1342,1343,
 &end
#
#  90 ILE  HB     91 ALA  HN      5.70             (#peak  3541)
 &rst
  ixpk= 3541, nxpk= 0, iat=1336,1351, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,  &end
#
#  90 ILE  QD1    91 ALA  HN      5.44             (#peak   942)
 &rst
  ixpk= 942, nxpk= 0, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
 igr1=1345,1346,1347,
 &end
#
#  90 ILE  QD1    91 ALA  HA      4.91             (#peak   948)
 &rst
  ixpk= 948, nxpk= 0, iat=  -1,1353, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
 igr1=1345,1346,1347,
 &end
#
#  90 ILE  QD1    93 SER  HN      6.15             (#peak  1010)
 &rst
  ixpk= 1010, nxpk= 0, iat=  -1,1368, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1=1345,1346,1347,
 &end
#
#  90 ILE  QG1    91 ALA  HN      5.55             (#peak  1379)
 &rst
  ixpk= 1379, nxpk= 0, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
 igr1=1342,1343,
 &end
#
#  90 ILE  QG2   112 THR  QG2     4.64             (#peak  3914)
 &rst
  ixpk= 3914, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr1=1338,1339,1340,
 igr2=1635,1636,1637,
 &end
#
#  90 ILE  QG2    90 ILE  QD1     3.99             (#peak   949)
 &rst
  ixpk= 949, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1=1338,1339,1340,
 igr2=1345,1346,1347,
 &end
#
#  90 ILE  QG2    90 ILE  QG1     3.28             (#peak  1385)
 &rst
  ixpk= 1385, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr1=1338,1339,1340,
 igr2=1342,1343,
 &end
#
#  90 ILE  QG2    91 ALA  HN      4.42             (#peak  3129)
 &rst
  ixpk= 3129, nxpk= 0, iat=  -1,1351, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1=1338,1339,1340,
 &end
#
#  90 ILE  QG2    93 SER  HN      6.15             (#peak  1023)
 &rst
  ixpk= 1023, nxpk= 0, iat=  -1,1368, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1=1338,1339,1340,
 &end
#
#  90 ILE  QG2    93 SER  QB      6.14             (#peak  3132)
 &rst
  ixpk= 3132, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.28, r4= 8.78,
 igr1=1338,1339,1340,
 igr2=1372,1373,
 &end
#
#  91 ALA  HN     91 ALA  QB      3.67             (#peak   532)
 &rst
  ixpk= 532, nxpk= 0, iat=1351,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1355,1356,1357,
 &end
#
#  91 ALA  HA    113 LEU  QD2     4.82             (#peak  4360)
 &rst
  ixpk= 4360, nxpk= 0, iat=1353,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2=1656,1657,1658,
 &end
#
#  91 ALA  HA     93 SER  HN      4.92             (#peak  2715)
 &rst
  ixpk= 2715, nxpk= 0, iat=1353,1368, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
#  91 ALA  QB     92 GLY  HN      4.22             (#peak   536)
 &rst
  ixpk= 536, nxpk= 0, iat=  -1,1361, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
 igr1=1355,1356,1357,
 &end
#
#  92 GLY  HN     93 SER  HN      6.14             (#peak  1017)
 &rst
  ixpk= 1017, nxpk= 0, iat=1361,1368, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,  &end
#
#  92 GLY  HA2   113 LEU  QD2     5.39             (#peak  3336)
 &rst
  ixpk= 3336, nxpk= 0, iat=1363,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr2=1656,1657,1658,
 &end
#
#  93 SER  HN     93 SER  QB      3.81             (#peak  1566)
 &rst
  ixpk= 1566, nxpk= 0, iat=1368,  -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
 igr2=1372,1373,
 &end
#
#  93 SER  HA     93 SER  QB      2.90             (#peak  1567)
 &rst
  ixpk= 1567, nxpk= 0, iat=1370,  -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
 igr2=1372,1373,
 &end
#
#  93 SER  QB     94 ILE  HN      3.31             (#peak  1571)
 &rst
  ixpk= 1571, nxpk= 0, iat=  -1,1379, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
 igr1=1372,1373,
 &end
#
#  94 ILE  HN     94 ILE  HB      3.48             (#peak   757)
 &rst
  ixpk= 757, nxpk= 0, iat=1379,1383, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
#  94 ILE  HN     94 ILE  QD1     3.78             (#peak  1835)
 &rst
  ixpk= 1835, nxpk= 0, iat=1379,  -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
 igr2=1392,1393,1394,
 &end
#
#  94 ILE  HN     94 ILE  QG1     3.55             (#peak  2419)
 &rst
  ixpk= 2419, nxpk= 0, iat=1379,  -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
 igr2=1389,1390,
 &end
#
#  94 ILE  HN     94 ILE  QG2     4.10             (#peak   254)
 &rst
  ixpk= 254, nxpk= 0, iat=1379,  -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
 igr2=1385,1386,1387,
 &end
#
#  94 ILE  HA     94 ILE  QD1     3.17             (#peak  1831)
 &rst
  ixpk= 1831, nxpk= 0, iat=1381,  -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
 igr2=1392,1393,1394,
 &end
#
#  94 ILE  HA     94 ILE  QG1     3.49             (#peak  2414)
 &rst
  ixpk= 2414, nxpk= 0, iat=1381,  -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
 igr2=1389,1390,
 &end
#
#  94 ILE  HA     94 ILE  QG2     2.82             (#peak   930)
 &rst
  ixpk= 930, nxpk= 0, iat=1381,  -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
 igr2=1385,1386,1387,
 &end
#
#  94 ILE  HA     95 ASN  HN      3.51             (#peak   932)
 &rst
  ixpk= 932, nxpk= 0, iat=1381,1398, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,  &end
#
#  94 ILE  HB     94 ILE  QD1     3.54             (#peak  1830)
 &rst
  ixpk= 1830, nxpk= 0, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
 igr2=1392,1393,1394,
 &end
#
#  94 ILE  HB     94 ILE  QG1     2.72             (#peak  2412)
 &rst
  ixpk= 2412, nxpk= 0, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,
 igr2=1389,1390,
 &end
#
#  94 ILE  HB     95 ASN  HN      4.42             (#peak   753)
 &rst
  ixpk= 753, nxpk= 0, iat=1383,1398, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
#  94 ILE  QG1    95 ASN  HN      5.80             (#peak  2413)
 &rst
  ixpk= 2413, nxpk= 0, iat=  -1,1398, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1=1389,1390,
 &end
#
#  94 ILE  QG2    94 ILE  QD1     2.40             (#peak  1829)
 &rst
  ixpk= 1829, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1=1385,1386,1387,
 igr2=1392,1393,1394,
 &end
#
#  94 ILE  QG2    94 ILE  QG1     2.40             (#peak  2411)
 &rst
  ixpk= 2411, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1385,1386,1387,
 igr2=1389,1390,
 &end
#
#  94 ILE  QG2    95 ASN  HN      3.12             (#peak   241)
 &rst
  ixpk= 241, nxpk= 0, iat=  -1,1398, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
 igr1=1385,1386,1387,
 &end
#
#  95 ASN  HN     95 ASN  HB2     3.66             (#peak  3557)
 &rst
  ixpk= 3557, nxpk= 0, iat=1398,1402, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,  &end
#
#  95 ASN  HN     95 ASN  HB3     3.78             (#peak  2620)
 &rst
  ixpk= 2620, nxpk= 0, iat=1398,1403, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,  &end
#
#  95 ASN  HN     95 ASN  HD21    6.15             (#peak  1510)
 &rst
  ixpk= 1510, nxpk= 0, iat=1398,1407, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  95 ASN  HN     95 ASN  HD22    6.15             (#peak   396)
 &rst
  ixpk= 396, nxpk= 0, iat=1398,1408, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  95 ASN  HN     96 GLN  HN      6.15             (#peak   868)
 &rst
  ixpk= 868, nxpk= 0, iat=1398,1412, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  95 ASN  HA     95 ASN  HB2     2.99             (#peak  3102)
 &rst
  ixpk= 3102, nxpk= 0, iat=1400,1402, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,  &end
#
#  95 ASN  HA     95 ASN  HD21    5.10             (#peak  3103)
 &rst
  ixpk= 3103, nxpk= 0, iat=1400,1407, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
#  95 ASN  HA     95 ASN  HD22    6.15             (#peak  3096)
 &rst
  ixpk= 3096, nxpk= 0, iat=1400,1408, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  95 ASN  HB2    95 ASN  HD21    3.86             (#peak  3567)
 &rst
  ixpk= 3567, nxpk= 0, iat=1402,1407, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
#  95 ASN  HB2    96 GLN  HN      4.68             (#peak  3560)
 &rst
  ixpk= 3560, nxpk= 0, iat=1402,1412, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
#  95 ASN  HB3    95 ASN  HD21    3.97             (#peak  2628)
 &rst
  ixpk= 2628, nxpk= 0, iat=1403,1407, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,  &end
#
#  95 ASN  HD21  100 LEU  HN      6.15             (#peak  1511)
 &rst
  ixpk= 1511, nxpk= 0, iat=1407,1461, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  95 ASN  HD21   96 GLN  HN      6.15             (#peak  1513)
 &rst
  ixpk= 1513, nxpk= 0, iat=1407,1412, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  95 ASN  HD21   99 SER  HA      5.03             (#peak   128)
 &rst
  ixpk= 128, nxpk= 0, iat=1407,1452, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,  &end
#
#  95 ASN  HD22  100 LEU  HN      6.15             (#peak    55)
 &rst
  ixpk= 55, nxpk= 0, iat=1408,1461, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  95 ASN  HD22  100 LEU  HG      4.95             (#peak  1725)
 &rst
  ixpk= 1725, nxpk= 0, iat=1408,1468, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,  &end
#
#  95 ASN  HD22   96 GLN  HN      6.15             (#peak   867)
 &rst
  ixpk= 867, nxpk= 0, iat=1408,1412, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  95 ASN  HD22   98 GLY  HN      6.15             (#peak   805)
 &rst
  ixpk= 805, nxpk= 0, iat=1408,1443, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  95 ASN  HD22   99 SER  HA      4.84             (#peak   122)
 &rst
  ixpk= 122, nxpk= 0, iat=1408,1452, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
#  96 GLN  HN     96 GLN  HE21    6.15             (#peak   871)
 &rst
  ixpk= 871, nxpk= 0, iat=1412,1424, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  96 GLN  HN     96 GLN  HE22    6.15             (#peak   875)
 &rst
  ixpk= 875, nxpk= 0, iat=1412,1425, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  96 GLN  HN     96 GLN  QB      3.99             (#peak  2056)
 &rst
  ixpk= 2056, nxpk= 0, iat=1412,  -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
 igr2=1416,1417,
 &end
#
#  96 GLN  HN     96 GLN  QG      4.65             (#peak  3776)
 &rst
  ixpk= 3776, nxpk= 0, iat=1412,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr2=1419,1420,
 &end
#
#  96 GLN  HN     97 ASN  HN      6.15             (#peak   870)
 &rst
  ixpk= 870, nxpk= 0, iat=1412,1429, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  96 GLN  HA     96 GLN  HE21    4.63             (#peak  3374)
 &rst
  ixpk= 3374, nxpk= 0, iat=1414,1424, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,  &end
#
#  96 GLN  HA     96 GLN  HE22    4.03             (#peak  3378)
 &rst
  ixpk= 3378, nxpk= 0, iat=1414,1425, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
#  96 GLN  HA     96 GLN  QB      2.83             (#peak  3375)
 &rst
  ixpk= 3375, nxpk= 0, iat=1414,  -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
 igr2=1416,1417,
 &end
#
#  96 GLN  HA     96 GLN  QG      3.03             (#peak  3381)
 &rst
  ixpk= 3381, nxpk= 0, iat=1414,  -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr2=1419,1420,
 &end
#
#  96 GLN  QB     96 GLN  HE21    4.98             (#peak  2052)
 &rst
  ixpk= 2052, nxpk= 0, iat=  -1,1424, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
 igr1=1416,1417,
 &end
#
#  96 GLN  QB     96 GLN  HE22    4.78             (#peak  2058)
 &rst
  ixpk= 2058, nxpk= 0, iat=  -1,1425, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
 igr1=1416,1417,
 &end
#
#  96 GLN  QB     96 GLN  QG      2.40             (#peak  3774)
 &rst
  ixpk= 3774, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1=1416,1417,
 igr2=1419,1420,
 &end
#
#  96 GLN  QB     97 ASN  HN      4.53             (#peak  2051)
 &rst
  ixpk= 2051, nxpk= 0, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=1416,1417,
 &end
#
#  96 GLN  QB     97 ASN  HB3     5.42             (#peak  2059)
 &rst
  ixpk= 2059, nxpk= 0, iat=  -1,1434, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
 igr1=1416,1417,
 &end
#
#  96 GLN  QB     98 GLY  HN      6.15             (#peak   812)
 &rst
  ixpk= 812, nxpk= 0, iat=  -1,1443, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=1416,1417,
 &end
#
#  96 GLN  QG     97 ASN  HN      4.00             (#peak  3772)
 &rst
  ixpk= 3772, nxpk= 0, iat=  -1,1429, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr1=1419,1420,
 &end
#
#  96 GLN  QG     98 GLY  HN      6.15             (#peak  3775)
 &rst
  ixpk= 3775, nxpk= 0, iat=  -1,1443, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=1419,1420,
 &end
#
#  97 ASN  HN     97 ASN  HB3     4.13             (#peak  3266)
 &rst
  ixpk= 3266, nxpk= 0, iat=1429,1434, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,  &end
#
#  97 ASN  HN     97 ASN  HD22    6.15             (#peak   620)
 &rst
  ixpk= 620, nxpk= 0, iat=1429,1439, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  97 ASN  HN     98 GLY  HN      5.62             (#peak   479)
 &rst
  ixpk= 479, nxpk= 0, iat=1429,1443, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,  &end
#
#  97 ASN  HN     98 GLY  HA3     5.42             (#peak   427)
 &rst
  ixpk= 427, nxpk= 0, iat=1429,1446, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
#  97 ASN  HA     97 ASN  HB2     2.70             (#peak  2705)
 &rst
  ixpk= 2705, nxpk= 0, iat=1431,1433, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20,  &end
#
#  97 ASN  HA     97 ASN  HD21    4.60             (#peak   444)
 &rst
  ixpk= 444, nxpk= 0, iat=1431,1438, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
#  97 ASN  HA     97 ASN  HD22    4.86             (#peak  2704)
 &rst
  ixpk= 2704, nxpk= 0, iat=1431,1439, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
#  97 ASN  HB2    98 GLY  HN      5.02             (#peak  1514)
 &rst
  ixpk= 1514, nxpk= 0, iat=1433,1443, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,  &end
#
#  97 ASN  HB3    97 ASN  HD21    3.80             (#peak  3265)
 &rst
  ixpk= 3265, nxpk= 0, iat=1434,1438, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
#  97 ASN  HB3    98 GLY  HN      6.15             (#peak  3271)
 &rst
  ixpk= 3271, nxpk= 0, iat=1434,1443, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  97 ASN  HD21   98 GLY  HN      6.15             (#peak   808)
 &rst
  ixpk= 808, nxpk= 0, iat=1438,1443, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  97 ASN  HD21   98 GLY  HA3     5.41             (#peak   426)
 &rst
  ixpk= 426, nxpk= 0, iat=1438,1446, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,  &end
#
#  97 ASN  HD22   98 GLY  HN      6.15             (#peak   623)
 &rst
  ixpk= 623, nxpk= 0, iat=1439,1443, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  98 GLY  HN     99 SER  HN      6.15             (#peak   900)
 &rst
  ixpk= 900, nxpk= 0, iat=1443,1450, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
#  99 SER  HN    100 LEU  HN      5.30             (#peak   517)
 &rst
  ixpk= 517, nxpk= 0, iat=1450,1461, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,  &end
#
#  99 SER  HA    100 LEU  HN      3.37             (#peak   123)
 &rst
  ixpk= 123, nxpk= 0, iat=1452,1461, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
#  99 SER  HA     99 SER  QB      2.66             (#peak  2086)
 &rst
  ixpk= 2086, nxpk= 0, iat=1452,  -1, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,
 igr2=1454,1455,
 &end
#
#  99 SER  QB    100 LEU  HN      4.85             (#peak  2087)
 &rst
  ixpk= 2087, nxpk= 0, iat=  -1,1461, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1=1454,1455,
 &end
#
# 100 LEU  HN    100 LEU  HB2     3.99             (#peak  2311)
 &rst
  ixpk= 2311, nxpk= 0, iat=1461,1465, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,  &end
#
# 100 LEU  HN    100 LEU  HG      4.82             (#peak  1726)
 &rst
  ixpk= 1726, nxpk= 0, iat=1461,1468, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 100 LEU  HN    100 LEU  QD1     4.93             (#peak  3469)
 &rst
  ixpk= 3469, nxpk= 0, iat=1461,  -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
 igr2=1470,1471,1472,
 &end
#
# 100 LEU  HN    100 LEU  QD2     4.68             (#peak  1299)
 &rst
  ixpk= 1299, nxpk= 0, iat=1461,  -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
 igr2=1474,1475,1476,
 &end
#
# 100 LEU  HA    100 LEU  HG      3.94             (#peak  1730)
 &rst
  ixpk= 1730, nxpk= 0, iat=1463,1468, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 100 LEU  HA    100 LEU  QD1     4.42             (#peak  2176)
 &rst
  ixpk= 2176, nxpk= 0, iat=1463,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2=1470,1471,1472,
 &end
#
# 100 LEU  HA    100 LEU  QD2     4.11             (#peak  2170)
 &rst
  ixpk= 2170, nxpk= 0, iat=1463,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr2=1474,1475,1476,
 &end
#
# 100 LEU  HA    101 LEU  HN      3.18             (#peak  2175)
 &rst
  ixpk= 2175, nxpk= 0, iat=1463,1480, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,  &end
#
# 100 LEU  HB2   100 LEU  QD1     2.59             (#peak  3478)
 &rst
  ixpk= 3478, nxpk= 0, iat=1465,  -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
 igr2=1470,1471,1472,
 &end
#
# 100 LEU  HB2   100 LEU  QD2     3.60             (#peak  2312)
 &rst
  ixpk= 2312, nxpk= 0, iat=1465,  -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr2=1474,1475,1476,
 &end
#
# 100 LEU  HB2   101 LEU  HN      4.25             (#peak  2317)
 &rst
  ixpk= 2317, nxpk= 0, iat=1465,1480, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,  &end
#
# 100 LEU  HB3   100 LEU  QD2     3.32             (#peak   171)
 &rst
  ixpk= 171, nxpk= 0, iat=1466,  -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
 igr2=1474,1475,1476,
 &end
#
# 100 LEU  HB3   101 LEU  HN      4.16             (#peak   177)
 &rst
  ixpk= 177, nxpk= 0, iat=1466,1480, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 100 LEU  HB3   102 ILE  QD1     4.54             (#peak  2319)
 &rst
  ixpk= 2319, nxpk= 0, iat=1466,  -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr2=1512,1513,1514,
 &end
#
# 100 LEU  HG    101 LEU  HN      5.15             (#peak  1732)
 &rst
  ixpk= 1732, nxpk= 0, iat=1468,1480, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,  &end
#
# 100 LEU  QD2   101 LEU  HN      4.23             (#peak  1306)
 &rst
  ixpk= 1306, nxpk= 0, iat=  -1,1480, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
 igr1=1474,1475,1476,
 &end
#
# 101 LEU  HN    101 LEU  HB3     4.19             (#peak  2634)
 &rst
  ixpk= 2634, nxpk= 0, iat=1480,1485, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 101 LEU  HN    101 LEU  HG      4.82             (#peak  1083)
 &rst
  ixpk= 1083, nxpk= 0, iat=1480,1487, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 101 LEU  HN    101 LEU  QD1     5.05             (#peak  2073)
 &rst
  ixpk= 2073, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr2=1489,1490,1491,
 &end
#
# 101 LEU  HN    101 LEU  QD2     5.02             (#peak  3790)
 &rst
  ixpk= 3790, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr2=1493,1494,1495,
 &end
#
# 101 LEU  HN    102 ILE  HN      6.15             (#peak  1332)
 &rst
  ixpk= 1332, nxpk= 0, iat=1480,1499, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 101 LEU  HN    102 ILE  QG1     4.89             (#peak  3815)
 &rst
  ixpk= 3815, nxpk= 0, iat=1480,  -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr2=1509,1510,
 &end
#
# 101 LEU  HA    101 LEU  HG      3.79             (#peak   952)
 &rst
  ixpk= 952, nxpk= 0, iat=1482,1487, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 101 LEU  HA    101 LEU  QD1     5.10             (#peak   954)
 &rst
  ixpk= 954, nxpk= 0, iat=1482,  -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
 igr2=1489,1490,1491,
 &end
#
# 101 LEU  HA    101 LEU  QD2     4.08             (#peak   961)
 &rst
  ixpk= 961, nxpk= 0, iat=1482,  -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
 igr2=1493,1494,1495,
 &end
#
# 101 LEU  HA    102 ILE  HN      3.17             (#peak   959)
 &rst
  ixpk= 959, nxpk= 0, iat=1482,1499, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,  &end
#
# 101 LEU  HA    102 ILE  QG1     5.39             (#peak  3811)
 &rst
  ixpk= 3811, nxpk= 0, iat=1482,  -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
 igr2=1509,1510,
 &end
#
# 101 LEU  HB2   101 LEU  QD2     3.86             (#peak  3787)
 &rst
  ixpk= 3787, nxpk= 0, iat=1484,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2=1493,1494,1495,
 &end
#
# 101 LEU  HB3   102 ILE  HN      5.89             (#peak  2635)
 &rst
  ixpk= 2635, nxpk= 0, iat=1485,1499, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,  &end
#
# 101 LEU  QD2   102 ILE  HN      5.66             (#peak  3791)
 &rst
  ixpk= 3791, nxpk= 0, iat=  -1,1499, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1=1493,1494,1495,
 &end
#
# 102 ILE  HN    102 ILE  HB      3.83             (#peak  2889)
 &rst
  ixpk= 2889, nxpk= 0, iat=1499,1503, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 102 ILE  HN    102 ILE  QD1     4.33             (#peak  2325)
 &rst
  ixpk= 2325, nxpk= 0, iat=1499,  -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
 igr2=1512,1513,1514,
 &end
#
# 102 ILE  HN    102 ILE  QG1     3.71             (#peak  3820)
 &rst
  ixpk= 3820, nxpk= 0, iat=1499,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2=1509,1510,
 &end
#
# 102 ILE  HN    102 ILE  QG2     4.50             (#peak   687)
 &rst
  ixpk= 687, nxpk= 0, iat=1499,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1505,1506,1507,
 &end
#
# 102 ILE  HA    102 ILE  QD1     4.06             (#peak  2731)
 &rst
  ixpk= 2731, nxpk= 0, iat=1501,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1512,1513,1514,
 &end
#
# 102 ILE  HA    102 ILE  QG1     4.00             (#peak  2737)
 &rst
  ixpk= 2737, nxpk= 0, iat=1501,  -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
 igr2=1509,1510,
 &end
#
# 102 ILE  HA    102 ILE  QG2     2.54             (#peak   683)
 &rst
  ixpk= 683, nxpk= 0, iat=1501,  -1, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55,
 igr2=1505,1506,1507,
 &end
#
# 102 ILE  HB    102 ILE  QD1     3.23             (#peak  2324)
 &rst
  ixpk= 2324, nxpk= 0, iat=1503,  -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
 igr2=1512,1513,1514,
 &end
#
# 102 ILE  HB    102 ILE  QG1     2.67             (#peak  3816)
 &rst
  ixpk= 3816, nxpk= 0, iat=1503,  -1, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,
 igr2=1509,1510,
 &end
#
# 102 ILE  HB    103 CYS  HN      5.40             (#peak  2888)
 &rst
  ixpk= 2888, nxpk= 0, iat=1503,1518, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,  &end
#
# 102 ILE  QG1   103 CYS  HN      5.66             (#peak  3819)
 &rst
  ixpk= 3819, nxpk= 0, iat=  -1,1518, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
 igr1=1509,1510,
 &end
#
# 102 ILE  QG2   102 ILE  QD1     3.47             (#peak   682)
 &rst
  ixpk= 682, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
 igr1=1505,1506,1507,
 igr2=1512,1513,1514,
 &end
#
# 102 ILE  QG2   102 ILE  QG1     2.40             (#peak  3810)
 &rst
  ixpk= 3810, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1505,1506,1507,
 igr2=1509,1510,
 &end
#
# 102 ILE  QG2   103 CYS  HN      4.56             (#peak   686)
 &rst
  ixpk= 686, nxpk= 0, iat=  -1,1518, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
 igr1=1505,1506,1507,
 &end
#
# 103 CYS  HN    103 CYS  HB2     3.83             (#peak  1740)
 &rst
  ixpk= 1740, nxpk= 0, iat=1518,1522, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,  &end
#
# 103 CYS  HN    103 CYS  HB3     3.90             (#peak   186)
 &rst
  ixpk= 186, nxpk= 0, iat=1518,1523, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
# 103 CYS  HN    104 ALA  HN      4.84             (#peak  1361)
 &rst
  ixpk= 1361, nxpk= 0, iat=1518,1529, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,  &end
#
# 103 CYS  HB2   104 ALA  HN      4.74             (#peak  1741)
 &rst
  ixpk= 1741, nxpk= 0, iat=1522,1529, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,  &end
#
# 103 CYS  HB3   104 ALA  HN      4.90             (#peak   187)
 &rst
  ixpk= 187, nxpk= 0, iat=1523,1529, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,  &end
#
# 104 ALA  HN    104 ALA  QB      3.24             (#peak  3486)
 &rst
  ixpk= 3486, nxpk= 0, iat=1529,  -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
 igr2=1533,1534,1535,
 &end
#
# 104 ALA  HA    105 THR  HN      3.29             (#peak  3220)
 &rst
  ixpk= 3220, nxpk= 0, iat=1531,1539, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,  &end
#
# 104 ALA  QB    106 HIS  HN      4.36             (#peak  3489)
 &rst
  ixpk= 3489, nxpk= 0, iat=  -1,1553, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr1=1533,1534,1535,
 &end
#
# 105 THR  HN    105 THR  QG2     4.20             (#peak  4242)
 &rst
  ixpk= 4242, nxpk= 0, iat=1539,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1545,1546,1547,
 &end
#
# 105 THR  HN    106 HIS  HN      6.13             (#peak  1644)
 &rst
  ixpk= 1644, nxpk= 0, iat=1539,1553, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,  &end
#
# 105 THR  HA    105 THR  QG2     4.06             (#peak  4240)
 &rst
  ixpk= 4240, nxpk= 0, iat=1541,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1545,1546,1547,
 &end
#
# 105 THR  HB    106 HIS  HN      4.85             (#peak  3075)
 &rst
  ixpk= 3075, nxpk= 0, iat=1543,1553, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 105 THR  QG2   106 HIS  HN      4.79             (#peak  4241)
 &rst
  ixpk= 4241, nxpk= 0, iat=  -1,1553, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
 igr1=1545,1546,1547,
 &end
#
# 106 HIS  HN    107 VAL  QG1     6.15             (#peak  2585)
 &rst
  ixpk= 2585, nxpk= 0, iat=1553,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1576,1577,1578,
 &end
#
# 106 HIS  HN    107 VAL  QG2     6.15             (#peak   409)
 &rst
  ixpk= 409, nxpk= 0, iat=1553,  -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr2=1580,1581,1582,
 &end
#
# 106 HIS  HA    106 HIS  HD2     6.15             (#peak  2695)
 &rst
  ixpk= 2695, nxpk= 0, iat=1555,1566, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 106 HIS  HB2   111 THR  HN      6.15             (#peak  1825)
 &rst
  ixpk= 1825, nxpk= 0, iat=1557,1615, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 106 HIS  HB2   111 THR  HA      6.15             (#peak  4208)
 &rst
  ixpk= 4208, nxpk= 0, iat=1557,1617, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 106 HIS  HB3   110 ASP  HB3     4.41             (#peak  4228)
 &rst
  ixpk= 4228, nxpk= 0, iat=1558,1608, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 106 HIS  HB3   111 THR  HN      6.15             (#peak  1828)
 &rst
  ixpk= 1828, nxpk= 0, iat=1558,1615, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 106 HIS  HB3   111 THR  HA      5.51             (#peak  4209)
 &rst
  ixpk= 4209, nxpk= 0, iat=1558,1617, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,  &end
#
# 106 HIS  HD2   110 ASP  HA      5.55             (#peak  4227)
 &rst
  ixpk= 4227, nxpk= 0, iat=1566,1605, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,  &end
#
# 107 VAL  HN    107 VAL  QG1     4.36             (#peak  2582)
 &rst
  ixpk= 2582, nxpk= 0, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
 igr2=1576,1577,1578,
 &end
#
# 107 VAL  HN    107 VAL  QG2     4.44             (#peak   405)
 &rst
  ixpk= 405, nxpk= 0, iat=1570,  -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
 igr2=1580,1581,1582,
 &end
#
# 107 VAL  HN    108 GLY  HN      4.67             (#peak  1215)
 &rst
  ixpk= 1215, nxpk= 0, iat=1570,1586, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 107 VAL  HN    109 ALA  HN      6.15             (#peak  1824)
 &rst
  ixpk= 1824, nxpk= 0, iat=1570,1593, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 107 VAL  HN    110 ASP  HN      6.15             (#peak  1823)
 &rst
  ixpk= 1823, nxpk= 0, iat=1570,1603, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 107 VAL  HN    110 ASP  HB2     4.27             (#peak  2043)
 &rst
  ixpk= 2043, nxpk= 0, iat=1570,1607, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 107 VAL  HN    110 ASP  HB3     3.80             (#peak  3763)
 &rst
  ixpk= 3763, nxpk= 0, iat=1570,1608, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 107 VAL  HN    111 THR  HN      6.15             (#peak  1822)
 &rst
  ixpk= 1822, nxpk= 0, iat=1570,1615, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 107 VAL  HA    107 VAL  QG1     3.99             (#peak  2579)
 &rst
  ixpk= 2579, nxpk= 0, iat=1572,  -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
 igr2=1576,1577,1578,
 &end
#
# 107 VAL  HA    107 VAL  QG2     4.06             (#peak   502)
 &rst
  ixpk= 502, nxpk= 0, iat=1572,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr2=1580,1581,1582,
 &end
#
# 107 VAL  HA    109 ALA  HN      4.80             (#peak   504)
 &rst
  ixpk= 504, nxpk= 0, iat=1572,1593, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,  &end
#
# 107 VAL  HA    110 ASP  HB3     6.15             (#peak  4260)
 &rst
  ixpk= 4260, nxpk= 0, iat=1572,1608, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 107 VAL  HB    108 GLY  HN      4.69             (#peak  3797)
 &rst
  ixpk= 3797, nxpk= 0, iat=1574,1586, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,  &end
#
# 107 VAL  QG1   108 GLY  HN      3.59             (#peak  2584)
 &rst
  ixpk= 2584, nxpk= 0, iat=  -1,1586, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
 igr1=1576,1577,1578,
 &end
#
# 107 VAL  QG1   108 GLY  HA3     5.73             (#peak  2581)
 &rst
  ixpk= 2581, nxpk= 0, iat=  -1,1589, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
 igr1=1576,1577,1578,
 &end
#
# 107 VAL  QG2   108 GLY  HN      4.17             (#peak   407)
 &rst
  ixpk= 407, nxpk= 0, iat=  -1,1586, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
 igr1=1580,1581,1582,
 &end
#
# 107 VAL  QG2   108 GLY  HA2     5.51             (#peak   408)
 &rst
  ixpk= 408, nxpk= 0, iat=  -1,1588, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
 igr1=1580,1581,1582,
 &end
#
# 107 VAL  QG2   108 GLY  HA3     5.40             (#peak  1996)
 &rst
  ixpk= 1996, nxpk= 0, iat=  -1,1589, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1580,1581,1582,
 &end
#
# 108 GLY  HN    109 ALA  HN      6.15             (#peak   631)
 &rst
  ixpk= 631, nxpk= 0, iat=1586,1593, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 108 GLY  HN    109 ALA  HA      6.14             (#peak  1339)
 &rst
  ixpk= 1339, nxpk= 0, iat=1586,1595, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,  &end
#
# 108 GLY  HN    110 ASP  HN      6.15             (#peak  1035)
 &rst
  ixpk= 1035, nxpk= 0, iat=1586,1603, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 108 GLY  HN    111 THR  QG2     5.14             (#peak  2299)
 &rst
  ixpk= 2299, nxpk= 0, iat=1586,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1621,1622,1623,
 &end
#
# 108 GLY  HA2   110 ASP  HN      4.92             (#peak  3723)
 &rst
  ixpk= 3723, nxpk= 0, iat=1588,1603, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,  &end
#
# 108 GLY  HA2   111 THR  HN      4.85             (#peak  3720)
 &rst
  ixpk= 3720, nxpk= 0, iat=1588,1615, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 108 GLY  HA3   110 ASP  HN      5.27             (#peak  2001)
 &rst
  ixpk= 2001, nxpk= 0, iat=1589,1603, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,  &end
#
# 108 GLY  HA3   111 THR  HN      6.15             (#peak  1776)
 &rst
  ixpk= 1776, nxpk= 0, iat=1589,1615, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 108 GLY  HA3   111 THR  HB      6.15             (#peak  1997)
 &rst
  ixpk= 1997, nxpk= 0, iat=1589,1619, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 109 ALA  HN    109 ALA  QB      3.82             (#peak  3233)
 &rst
  ixpk= 3233, nxpk= 0, iat=1593,  -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
 igr2=1597,1598,1599,
 &end
#
# 109 ALA  HN    110 ASP  HN      6.15             (#peak  1030)
 &rst
  ixpk= 1030, nxpk= 0, iat=1593,1603, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 109 ALA  QB    110 ASP  HN      2.93             (#peak  3234)
 &rst
  ixpk= 3234, nxpk= 0, iat=  -1,1603, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
 igr1=1597,1598,1599,
 &end
#
# 110 ASP  HN    110 ASP  HB2     4.20             (#peak  2044)
 &rst
  ixpk= 2044, nxpk= 0, iat=1603,1607, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,  &end
#
# 110 ASP  HN    110 ASP  HB3     3.41             (#peak  3764)
 &rst
  ixpk= 3764, nxpk= 0, iat=1603,1608, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,  &end
#
# 110 ASP  HN    111 THR  HN      6.00             (#peak  1027)
 &rst
  ixpk= 1027, nxpk= 0, iat=1603,1615, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 110 ASP  HB2   111 THR  HN      4.47             (#peak  2040)
 &rst
  ixpk= 2040, nxpk= 0, iat=1607,1615, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,  &end
#
# 110 ASP  HB3   111 THR  HN      3.92             (#peak  3760)
 &rst
  ixpk= 3760, nxpk= 0, iat=1608,1615, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 111 THR  HN    111 THR  QG2     3.04             (#peak  2293)
 &rst
  ixpk= 2293, nxpk= 0, iat=1615,  -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
 igr2=1621,1622,1623,
 &end
#
# 111 THR  HN    114 SER  HN      6.15             (#peak   300)
 &rst
  ixpk= 300, nxpk= 0, iat=1615,1662, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 111 THR  HN    114 SER  QB      6.15             (#peak  1468)
 &rst
  ixpk= 1468, nxpk= 0, iat=1615,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1666,1667,
 &end
#
# 111 THR  HA    111 THR  QG2     3.68             (#peak  2294)
 &rst
  ixpk= 2294, nxpk= 0, iat=1617,  -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
 igr2=1621,1622,1623,
 &end
#
# 111 THR  HA    114 SER  HN      6.15             (#peak  1071)
 &rst
  ixpk= 1071, nxpk= 0, iat=1617,1662, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 111 THR  HB    114 SER  HN      5.23             (#peak   661)
 &rst
  ixpk= 661, nxpk= 0, iat=1619,1662, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,  &end
#
# 111 THR  HB    115 GLN  HN      6.15             (#peak  1130)
 &rst
  ixpk= 1130, nxpk= 0, iat=1619,1673, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 111 THR  QG2   114 SER  HN      5.71             (#peak  2295)
 &rst
  ixpk= 2295, nxpk= 0, iat=  -1,1662, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
 igr1=1621,1622,1623,
 &end
#
# 112 THR  HA    115 GLN  HN      3.89             (#peak  1445)
 &rst
  ixpk= 1445, nxpk= 0, iat=1631,1673, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,  &end
#
# 112 THR  HA    115 GLN  HB3     4.14             (#peak  4204)
 &rst
  ixpk= 4204, nxpk= 0, iat=1631,1678, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,  &end
#
# 112 THR  HB    113 LEU  HN      4.64             (#peak   991)
 &rst
  ixpk= 991, nxpk= 0, iat=1633,1643, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
# 112 THR  QG2   113 LEU  HN      4.03             (#peak  2470)
 &rst
  ixpk= 2470, nxpk= 0, iat=  -1,1643, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1=1635,1636,1637,
 &end
#
# 112 THR  QG2   114 SER  HN      6.15             (#peak  1756)
 &rst
  ixpk= 1756, nxpk= 0, iat=  -1,1662, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1=1635,1636,1637,
 &end
#
# 112 THR  QG2   116 ILE  QD1     3.98             (#peak  3013)
 &rst
  ixpk= 3013, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
 igr1=1635,1636,1637,
 igr2=1703,1704,1705,
 &end
#
# 113 LEU  HN    113 LEU  HG      4.64             (#peak    50)
 &rst
  ixpk= 50, nxpk= 0, iat=1643,1650, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,  &end
#
# 113 LEU  HN    113 LEU  QD1     4.42             (#peak  1606)
 &rst
  ixpk= 1606, nxpk= 0, iat=1643,  -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr2=1652,1653,1654,
 &end
#
# 113 LEU  HN    113 LEU  QD2     4.82             (#peak  3344)
 &rst
  ixpk= 3344, nxpk= 0, iat=1643,  -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
 igr2=1656,1657,1658,
 &end
#
# 113 LEU  HN    114 SER  HN      4.41             (#peak  1429)
 &rst
  ixpk= 1429, nxpk= 0, iat=1643,1662, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,  &end
#
# 113 LEU  HA    113 LEU  QD1     3.94             (#peak  1604)
 &rst
  ixpk= 1604, nxpk= 0, iat=1645,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2=1652,1653,1654,
 &end
#
# 113 LEU  HA    113 LEU  QD2     4.85             (#peak  3149)
 &rst
  ixpk= 3149, nxpk= 0, iat=1645,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2=1656,1657,1658,
 &end
#
# 113 LEU  HA    116 ILE  HB      3.68             (#peak  1680)
 &rst
  ixpk= 1680, nxpk= 0, iat=1645,1694, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,  &end
#
# 113 LEU  HA    116 ILE  QD1     2.40             (#peak  3147)
 &rst
  ixpk= 3147, nxpk= 0, iat=1645,  -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
 igr2=1703,1704,1705,
 &end
#
# 113 LEU  HG    114 SER  HN      5.65             (#peak    45)
 &rst
  ixpk= 45, nxpk= 0, iat=1650,1662, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,  &end
#
# 113 LEU  QB    113 LEU  QD1     2.40             (#peak  1602)
 &rst
  ixpk= 1602, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1647,1648,
 igr2=1652,1653,1654,
 &end
#
# 113 LEU  QB    113 LEU  QD2     2.40             (#peak  3340)
 &rst
  ixpk= 3340, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
 igr1=1647,1648,
 igr2=1656,1657,1658,
 &end
#
# 113 LEU  QB    114 SER  HN      5.10             (#peak  1887)
 &rst
  ixpk= 1887, nxpk= 0, iat=  -1,1662, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
 igr1=1647,1648,
 &end
#
# 113 LEU  QD1   114 SER  HN      5.12             (#peak  1599)
 &rst
  ixpk= 1599, nxpk= 0, iat=  -1,1662, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1=1652,1653,1654,
 &end
#
# 113 LEU  QD1   115 GLN  HN      6.15             (#peak  1603)
 &rst
  ixpk= 1603, nxpk= 0, iat=  -1,1673, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1=1652,1653,1654,
 &end
#
# 113 LEU  QD2   114 SER  HN      4.75             (#peak  3338)
 &rst
  ixpk= 3338, nxpk= 0, iat=  -1,1662, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
 igr1=1656,1657,1658,
 &end
#
# 113 LEU  QD2   115 GLN  HN      6.15             (#peak  3341)
 &rst
  ixpk= 3341, nxpk= 0, iat=  -1,1673, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1=1656,1657,1658,
 &end
#
# 114 SER  HN    114 SER  QB      2.69             (#peak  1470)
 &rst
  ixpk= 1470, nxpk= 0, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr2=1666,1667,
 &end
#
# 114 SER  HN    115 GLN  HN      4.21             (#peak  1134)
 &rst
  ixpk= 1134, nxpk= 0, iat=1662,1673, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,  &end
#
# 114 SER  HN    116 ILE  HN      4.36             (#peak   648)
 &rst
  ixpk= 648, nxpk= 0, iat=1662,1690, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,  &end
#
# 114 SER  HN    116 ILE  HG13    5.94             (#peak  2779)
 &rst
  ixpk= 2779, nxpk= 0, iat=1662,1701, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,  &end
#
# 114 SER  HA    117 VAL  HN      4.55             (#peak   395)
 &rst
  ixpk= 395, nxpk= 0, iat=1664,1709, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,  &end
#
# 114 SER  HA    117 VAL  QG2     3.25             (#peak  2540)
 &rst
  ixpk= 2540, nxpk= 0, iat=1664,  -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
 igr2=1719,1720,1721,
 &end
#
# 114 SER  QB    115 GLN  HN      4.25             (#peak  1471)
 &rst
  ixpk= 1471, nxpk= 0, iat=  -1,1673, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr1=1666,1667,
 &end
#
# 115 GLN  HN    115 GLN  HB2     3.55             (#peak   369)
 &rst
  ixpk= 369, nxpk= 0, iat=1673,1677, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,  &end
#
# 115 GLN  HN    115 GLN  HB3     3.92             (#peak  2555)
 &rst
  ixpk= 2555, nxpk= 0, iat=1673,1678, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 115 GLN  HN    115 GLN  HE21    6.15             (#peak  1138)
 &rst
  ixpk= 1138, nxpk= 0, iat=1673,1685, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 115 GLN  HN    115 GLN  HG2     4.82             (#peak  3669)
 &rst
  ixpk= 3669, nxpk= 0, iat=1673,1680, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,  &end
#
# 115 GLN  HN    115 GLN  HG3     5.10             (#peak  1963)
 &rst
  ixpk= 1963, nxpk= 0, iat=1673,1681, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,  &end
#
# 115 GLN  HN    116 ILE  HG13    4.94             (#peak  2783)
 &rst
  ixpk= 2783, nxpk= 0, iat=1673,1701, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,  &end
#
# 115 GLN  HN    118 LYS  QD      6.15             (#peak  1285)
 &rst
  ixpk= 1285, nxpk= 0, iat=1673,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr2=1735,1736,
 &end
#
# 115 GLN  HA    115 GLN  HB2     2.64             (#peak   130)
 &rst
  ixpk= 130, nxpk= 0, iat=1675,1677, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14,  &end
#
# 115 GLN  HA    115 GLN  HE21    4.34             (#peak   136)
 &rst
  ixpk= 136, nxpk= 0, iat=1675,1685, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,  &end
#
# 115 GLN  HA    115 GLN  HE22    6.05             (#peak   134)
 &rst
  ixpk= 134, nxpk= 0, iat=1675,1686, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,  &end
#
# 115 GLN  HA    115 GLN  HG2     3.82             (#peak  3663)
 &rst
  ixpk= 3663, nxpk= 0, iat=1675,1680, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,  &end
#
# 115 GLN  HA    115 GLN  HG3     3.59             (#peak  1957)
 &rst
  ixpk= 1957, nxpk= 0, iat=1675,1681, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,  &end
#
# 115 GLN  HA    117 VAL  HN      5.96             (#peak   140)
 &rst
  ixpk= 140, nxpk= 0, iat=1675,1709, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,  &end
#
# 115 GLN  HA    118 LYS  HN      4.42             (#peak   141)
 &rst
  ixpk= 141, nxpk= 0, iat=1675,1725, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,  &end
#
# 115 GLN  HA    118 LYS  HG3     4.17             (#peak   859)
 &rst
  ixpk= 859, nxpk= 0, iat=1675,1733, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,  &end
#
# 115 GLN  HA    118 LYS  QB      4.04             (#peak  1714)
 &rst
  ixpk= 1714, nxpk= 0, iat=1675,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr2=1729,1730,
 &end
#
# 115 GLN  HA    118 LYS  QD      4.45             (#peak   132)
 &rst
  ixpk= 132, nxpk= 0, iat=1675,  -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
 igr2=1735,1736,
 &end
#
# 115 GLN  HB2   115 GLN  HE21    3.67             (#peak   367)
 &rst
  ixpk= 367, nxpk= 0, iat=1677,1685, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,  &end
#
# 115 GLN  HB2   115 GLN  HE22    4.68             (#peak   365)
 &rst
  ixpk= 365, nxpk= 0, iat=1677,1686, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,  &end
#
# 115 GLN  HB2   116 ILE  HN      4.96             (#peak   370)
 &rst
  ixpk= 370, nxpk= 0, iat=1677,1690, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,  &end
#
# 115 GLN  HB3   115 GLN  HE21    4.75             (#peak  2552)
 &rst
  ixpk= 2552, nxpk= 0, iat=1678,1685, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,  &end
#
# 115 GLN  HB3   115 GLN  HE22    5.51             (#peak  2550)
 &rst
  ixpk= 2550, nxpk= 0, iat=1678,1686, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,  &end
#
# 115 GLN  HB3   115 GLN  HG2     2.85             (#peak  3668)
 &rst
  ixpk= 3668, nxpk= 0, iat=1678,1680, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,  &end
#
# 115 GLN  HB3   116 ILE  HN      4.07             (#peak  2556)
 &rst
  ixpk= 2556, nxpk= 0, iat=1678,1690, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,  &end
#
# 115 GLN  HG2   115 GLN  HE21    3.65             (#peak  3667)
 &rst
  ixpk= 3667, nxpk= 0, iat=1680,1685, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,  &end
#
# 115 GLN  HG2   116 ILE  HN      4.73             (#peak  3670)
 &rst
  ixpk= 3670, nxpk= 0, iat=1680,1690, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,  &end
#
# 115 GLN  HG3   116 ILE  HN      4.88             (#peak  1964)
 &rst
  ixpk= 1964, nxpk= 0, iat=1681,1690, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,  &end
#
# 116 ILE  HN    112 THR  O       2.4
 &rst
  ixpk= 1964, nxpk= 0, iat=1690,1641, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 116 ILE  HN    116 ILE  HB      3.28             (#peak  1678)
 &rst
  ixpk= 1678, nxpk= 0, iat=1690,1694, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,  &end
#
# 116 ILE  HN    116 ILE  HG12    4.08             (#peak  3427)
 &rst
  ixpk= 3427, nxpk= 0, iat=1690,1700, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
# 116 ILE  HN    116 ILE  HG13    3.79             (#peak  2784)
 &rst
  ixpk= 2784, nxpk= 0, iat=1690,1701, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,  &end
#
# 116 ILE  HN    116 ILE  QD1     4.20             (#peak  3015)
 &rst
  ixpk= 3015, nxpk= 0, iat=1690,  -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
 igr2=1703,1704,1705,
 &end
#
# 116 ILE  HN    116 ILE  QG2     4.69             (#peak  1239)
 &rst
  ixpk= 1239, nxpk= 0, iat=1690,  -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
 igr2=1696,1697,1698,
 &end
#
# 116 ILE  HN    117 VAL  HN      5.80             (#peak  1193)
 &rst
  ixpk= 1193, nxpk= 0, iat=1690,1709, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,  &end
#
# 116 ILE  HN    117 VAL  QG2     6.07             (#peak  2544)
 &rst
  ixpk= 2544, nxpk= 0, iat=1690,  -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
 igr2=1719,1720,1721,
 &end
#
# 116 ILE  HN    118 LYS  HG3     6.04             (#peak   866)
 &rst
  ixpk= 866, nxpk= 0, iat=1690,1733, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,  &end
#
# 116 ILE  HA    116 ILE  HG12    3.72             (#peak  3425)
 &rst
  ixpk= 3425, nxpk= 0, iat=1692,1700, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 116 ILE  HA    116 ILE  HG13    3.11             (#peak  2080)
 &rst
  ixpk= 2080, nxpk= 0, iat=1692,1701, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,  &end
#
# 116 ILE  HA    116 ILE  QD1     4.21             (#peak  2082)
 &rst
  ixpk= 2082, nxpk= 0, iat=1692,  -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
 igr2=1703,1704,1705,
 &end
#
# 116 ILE  HA    119 LEU  HN      4.49             (#peak  2075)
 &rst
  ixpk= 2075, nxpk= 0, iat=1692,1747, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,  &end
#
# 116 ILE  HA    119 LEU  HB2     4.30             (#peak  3730)
 &rst
  ixpk= 3730, nxpk= 0, iat=1692,1751, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,  &end
#
# 116 ILE  HA    119 LEU  HB3     4.39             (#peak  1493)
 &rst
  ixpk= 1493, nxpk= 0, iat=1692,1752, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,  &end
#
# 116 ILE  HB    116 ILE  QD1     2.96             (#peak  1679)
 &rst
  ixpk= 1679, nxpk= 0, iat=1694,  -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
 igr2=1703,1704,1705,
 &end
#
# 116 ILE  HB    117 VAL  HN      3.92             (#peak  1681)
 &rst
  ixpk= 1681, nxpk= 0, iat=1694,1709, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,  &end
#
# 116 ILE  HG12  117 VAL  HN      5.56             (#peak  3429)
 &rst
  ixpk= 3429, nxpk= 0, iat=1700,1709, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,  &end
#
# 116 ILE  HG13  117 VAL  HN      5.04             (#peak  2786)
 &rst
  ixpk= 2786, nxpk= 0, iat=1701,1709, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,  &end
#
# 116 ILE  N     112 THR  O       3.3
 &rst
  ixpk= 2786, nxpk= 0, iat=1689,1641, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 116 ILE  QD1   117 VAL  HN      5.07             (#peak  3018)
 &rst
  ixpk= 3018, nxpk= 0, iat=  -1,1709, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr1=1703,1704,1705,
 &end
#
# 116 ILE  QG2   116 ILE  HG12    2.92             (#peak  3423)
 &rst
  ixpk= 3423, nxpk= 0, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr1=1696,1697,1698,
 &end
#
# 116 ILE  QG2   116 ILE  HG13    3.80             (#peak  1238)
 &rst
  ixpk= 1238, nxpk= 0, iat=  -1,1701, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
 igr1=1696,1697,1698,
 &end
#
# 116 ILE  QG2   116 ILE  QD1     2.40             (#peak  3010)
 &rst
  ixpk= 3010, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
 igr1=1696,1697,1698,
 igr2=1703,1704,1705,
 &end
#
# 116 ILE  QG2   117 VAL  HN      3.83             (#peak  1241)
 &rst
  ixpk= 1241, nxpk= 0, iat=  -1,1709, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
 igr1=1696,1697,1698,
 &end
#
# 116 ILE  QG2   117 VAL  HA      3.33             (#peak  1232)
 &rst
  ixpk= 1232, nxpk= 0, iat=  -1,1711, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
 igr1=1696,1697,1698,
 &end
#
# 116 ILE  QG2   120 VAL  HN      4.38             (#peak  1237)
 &rst
  ixpk= 1237, nxpk= 0, iat=  -1,1766, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
 igr1=1696,1697,1698,
 &end
#
# 116 ILE  QG2   120 VAL  HB      4.42             (#peak  1265)
 &rst
  ixpk= 1265, nxpk= 0, iat=  -1,1770, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
 igr1=1696,1697,1698,
 &end
#
# 117 VAL  HN    117 VAL  HB      3.90             (#peak  2027)
 &rst
  ixpk= 2027, nxpk= 0, iat=1709,1713, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,  &end
#
# 117 VAL  HN    117 VAL  QG1     3.94             (#peak  1356)
 &rst
  ixpk= 1356, nxpk= 0, iat=1709,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2=1715,1716,1717,
 &end
#
# 117 VAL  HN    117 VAL  QG2     3.79             (#peak  2545)
 &rst
  ixpk= 2545, nxpk= 0, iat=1709,  -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
 igr2=1719,1720,1721,
 &end
#
# 117 VAL  HN    118 LYS  HN      4.67             (#peak  1355)
 &rst
  ixpk= 1355, nxpk= 0, iat=1709,1725, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,  &end
#
# 117 VAL  HN    118 LYS  HG3     5.42             (#peak   868)
 &rst
  ixpk= 868, nxpk= 0, iat=1709,1733, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,  &end
#
# 117 VAL  HN    119 LEU  HN      6.10             (#peak   193)
 &rst
  ixpk= 193, nxpk= 0, iat=1709,1747, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,  &end
#
# 117 VAL  HN    120 VAL  HN      6.15             (#peak  1347)
 &rst
  ixpk= 1347, nxpk= 0, iat=1709,1766, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 117 VAL  HA    117 VAL  QG1     3.51             (#peak   389)
 &rst
  ixpk= 389, nxpk= 0, iat=1711,  -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
 igr2=1715,1716,1717,
 &end
#
# 117 VAL  HA    117 VAL  QG2     3.86             (#peak   386)
 &rst
  ixpk= 386, nxpk= 0, iat=1711,  -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
 igr2=1719,1720,1721,
 &end
#
# 117 VAL  HA    119 LEU  HN      5.77             (#peak   381)
 &rst
  ixpk= 381, nxpk= 0, iat=1711,1747, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,  &end
#
# 117 VAL  HA    120 VAL  HN      4.76             (#peak   385)
 &rst
  ixpk= 385, nxpk= 0, iat=1711,1766, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 117 VAL  HA    120 VAL  HB      3.84             (#peak   383)
 &rst
  ixpk= 383, nxpk= 0, iat=1711,1770, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 117 VAL  HB    118 LYS  HN      4.11             (#peak  2028)
 &rst
  ixpk= 2028, nxpk= 0, iat=1713,1725, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
# 117 VAL  HB    118 LYS  HG3     6.15             (#peak  2023)
 &rst
  ixpk= 2023, nxpk= 0, iat=1713,1733, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 117 VAL  QG1   118 LYS  HN      4.54             (#peak  3745)
 &rst
  ixpk= 3745, nxpk= 0, iat=  -1,1725, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
 igr1=1715,1716,1717,
 &end
#
# 117 VAL  QG2   118 LYS  HN      5.12             (#peak  2546)
 &rst
  ixpk= 2546, nxpk= 0, iat=  -1,1725, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
 igr1=1719,1720,1721,
 &end
#
# 118 LYS  HN    118 LYS  HG2     4.44             (#peak  3063)
 &rst
  ixpk= 3063, nxpk= 0, iat=1725,1732, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 118 LYS  HN    118 LYS  HG3     4.10             (#peak   870)
 &rst
  ixpk= 870, nxpk= 0, iat=1725,1733, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,  &end
#
# 118 LYS  HN    118 LYS  QB      3.13             (#peak  1723)
 &rst
  ixpk= 1723, nxpk= 0, iat=1725,  -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
 igr2=1729,1730,
 &end
#
# 118 LYS  HN    118 LYS  QD      6.06             (#peak  1288)
 &rst
  ixpk= 1288, nxpk= 0, iat=1725,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr2=1735,1736,
 &end
#
# 118 LYS  HN    118 LYS  QE      5.25             (#peak  3464)
 &rst
  ixpk= 3464, nxpk= 0, iat=1725,  -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
 igr2=1738,1739,
 &end
#
# 118 LYS  HN    119 LEU  HN      4.11             (#peak   195)
 &rst
  ixpk= 195, nxpk= 0, iat=1725,1747, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,  &end
#
# 118 LYS  HN    121 GLU  HN      5.93             (#peak  1506)
 &rst
  ixpk= 1506, nxpk= 0, iat=1725,1782, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,  &end
#
# 118 LYS  HA    118 LYS  HG2     3.19             (#peak  1979)
 &rst
  ixpk= 1979, nxpk= 0, iat=1727,1732, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,  &end
#
# 118 LYS  HA    118 LYS  HG3     4.09             (#peak   864)
 &rst
  ixpk= 864, nxpk= 0, iat=1727,1733, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,  &end
#
# 118 LYS  HA    118 LYS  QB      2.49             (#peak  1977)
 &rst
  ixpk= 1977, nxpk= 0, iat=1727,  -1, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29,
 igr2=1729,1730,
 &end
#
# 118 LYS  HA    118 LYS  QD      4.21             (#peak  1284)
 &rst
  ixpk= 1284, nxpk= 0, iat=1727,  -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
 igr2=1735,1736,
 &end
#
# 118 LYS  HA    118 LYS  QE      4.28             (#peak  3461)
 &rst
  ixpk= 3461, nxpk= 0, iat=1727,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=1738,1739,
 &end
#
# 118 LYS  HA    121 GLU  HN      4.60             (#peak  1982)
 &rst
  ixpk= 1982, nxpk= 0, iat=1727,1782, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,  &end
#
# 118 LYS  HA    121 GLU  HB2     3.94             (#peak  1980)
 &rst
  ixpk= 1980, nxpk= 0, iat=1727,1786, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,  &end
#
# 118 LYS  HG2   118 LYS  QD      2.81             (#peak  3058)
 &rst
  ixpk= 3058, nxpk= 0, iat=1732,  -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
 igr2=1735,1736,
 &end
#
# 118 LYS  HG2   118 LYS  QE      4.01             (#peak  3462)
 &rst
  ixpk= 3462, nxpk= 0, iat=1732,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2=1738,1739,
 &end
#
# 118 LYS  HG2   119 LEU  HN      5.29             (#peak  3056)
 &rst
  ixpk= 3056, nxpk= 0, iat=1732,1747, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,  &end
#
# 118 LYS  HG3   118 LYS  QE      3.20             (#peak   869)
 &rst
  ixpk= 869, nxpk= 0, iat=1733,  -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
 igr2=1738,1739,
 &end
#
# 118 LYS  HG3   119 LEU  HN      5.19             (#peak   860)
 &rst
  ixpk= 860, nxpk= 0, iat=1733,1747, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,  &end
#
# 118 LYS  QB    118 LYS  HG2     2.97             (#peak  1720)
 &rst
  ixpk= 1720, nxpk= 0, iat=  -1,1732, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
 igr1=1729,1730,
 &end
#
# 118 LYS  QB    118 LYS  HG3     2.48             (#peak   863)
 &rst
  ixpk= 863, nxpk= 0, iat=  -1,1733, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28,
 igr1=1729,1730,
 &end
#
# 118 LYS  QB    118 LYS  QD      2.40             (#peak  1717)
 &rst
  ixpk= 1717, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1=1729,1730,
 igr2=1735,1736,
 &end
#
# 118 LYS  QB    118 LYS  QE      3.20             (#peak  3460)
 &rst
  ixpk= 3460, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
 igr1=1729,1730,
 igr2=1738,1739,
 &end
#
# 118 LYS  QB    119 LEU  HN      3.03             (#peak  1715)
 &rst
  ixpk= 1715, nxpk= 0, iat=  -1,1747, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
 igr1=1729,1730,
 &end
#
# 118 LYS  QB    121 GLU  HN      6.15             (#peak  1722)
 &rst
  ixpk= 1722, nxpk= 0, iat=  -1,1782, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=1729,1730,
 &end
#
# 118 LYS  QD    118 LYS  QE      2.40             (#peak  3459)
 &rst
  ixpk= 3459, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
 igr1=1735,1736,
 igr2=1738,1739,
 &end
#
# 118 LYS  QD    119 LEU  HN      6.04             (#peak  1280)
 &rst
  ixpk= 1280, nxpk= 0, iat=  -1,1747, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
 igr1=1735,1736,
 &end
#
# 119 LEU  HN    119 LEU  HB2     3.24             (#peak  3726)
 &rst
  ixpk= 3726, nxpk= 0, iat=1747,1751, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
# 119 LEU  HN    119 LEU  HB3     3.43             (#peak  1489)
 &rst
  ixpk= 1489, nxpk= 0, iat=1747,1752, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,  &end
#
# 119 LEU  HN    119 LEU  HG      4.89             (#peak  3241)
 &rst
  ixpk= 3241, nxpk= 0, iat=1747,1754, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,  &end
#
# 119 LEU  HN    119 LEU  QD1     4.85             (#peak  1079)
 &rst
  ixpk= 1079, nxpk= 0, iat=1747,  -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
 igr2=1756,1757,1758,
 &end
#
# 119 LEU  HN    119 LEU  QD2     4.97             (#peak  2865)
 &rst
  ixpk= 2865, nxpk= 0, iat=1747,  -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
 igr2=1760,1761,1762,
 &end
#
# 119 LEU  HN    120 VAL  HN      4.54             (#peak   188)
 &rst
  ixpk= 188, nxpk= 0, iat=1747,1766, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,  &end
#
# 119 LEU  HN    121 GLU  HN      6.15             (#peak   194)
 &rst
  ixpk= 194, nxpk= 0, iat=1747,1782, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 119 LEU  HA    119 LEU  HG      3.84             (#peak  3242)
 &rst
  ixpk= 3242, nxpk= 0, iat=1749,1754, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,  &end
#
# 119 LEU  HA    119 LEU  QD1     3.97             (#peak  1081)
 &rst
  ixpk= 1081, nxpk= 0, iat=1749,  -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
 igr2=1756,1757,1758,
 &end
#
# 119 LEU  HA    119 LEU  QD2     2.40             (#peak   847)
 &rst
  ixpk= 847, nxpk= 0, iat=1749,  -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
 igr2=1760,1761,1762,
 &end
#
# 119 LEU  HA    122 GLU  HN      4.76             (#peak   840)
 &rst
  ixpk= 840, nxpk= 0, iat=1749,1797, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,  &end
#
# 119 LEU  HA    122 GLU  HB2     3.72             (#peak  2233)
 &rst
  ixpk= 2233, nxpk= 0, iat=1749,1801, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,  &end
#
# 119 LEU  HA    123 ALA  HN      6.01             (#peak   844)
 &rst
  ixpk= 844, nxpk= 0, iat=1749,1812, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,  &end
#
# 119 LEU  HB2   119 LEU  HG      2.40             (#peak  3248)
 &rst
  ixpk= 3248, nxpk= 0, iat=1751,1754, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90,  &end
#
# 119 LEU  HB2   119 LEU  QD1     3.91             (#peak  3728)
 &rst
  ixpk= 3728, nxpk= 0, iat=1751,  -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
 igr2=1756,1757,1758,
 &end
#
# 119 LEU  HB2   119 LEU  QD2     3.53             (#peak  3732)
 &rst
  ixpk= 3732, nxpk= 0, iat=1751,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2=1760,1761,1762,
 &end
#
# 119 LEU  HB2   120 VAL  HN      4.03             (#peak  3731)
 &rst
  ixpk= 3731, nxpk= 0, iat=1751,1766, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,  &end
#
# 119 LEU  HB3   119 LEU  QD1     3.85             (#peak  1491)
 &rst
  ixpk= 1491, nxpk= 0, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
 igr2=1756,1757,1758,
 &end
#
# 119 LEU  HB3   119 LEU  QD2     2.40             (#peak  1495)
 &rst
  ixpk= 1495, nxpk= 0, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
 igr2=1760,1761,1762,
 &end
#
# 119 LEU  HB3   120 VAL  HN      3.74             (#peak  1494)
 &rst
  ixpk= 1494, nxpk= 0, iat=1752,1766, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 119 LEU  HG    120 VAL  HN      5.97             (#peak  3245)
 &rst
  ixpk= 3245, nxpk= 0, iat=1754,1766, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
# 119 LEU  QD2   122 GLU  HN      6.15             (#peak   346)
 &rst
  ixpk= 346, nxpk= 0, iat=  -1,1797, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
 igr1=1760,1761,1762,
 &end
#
# 119 LEU  QD2   123 ALA  QB      4.66             (#peak  2871)
 &rst
  ixpk= 2871, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
 igr1=1760,1761,1762,
 igr2=1816,1817,1818,
 &end
#
# 120 VAL  HN    120 VAL  HB      3.27             (#peak  1267)
 &rst
  ixpk= 1267, nxpk= 0, iat=1766,1770, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,  &end
#
# 120 VAL  HN    120 VAL  QQG     2.70             (#peak  3039)
 &rst
  ixpk= 3039, nxpk= 0, iat=1766,  -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
 igr2=1772,1773,1774,1776,1777,1778,
 &end
#
# 120 VAL  HN    121 GLU  HN      5.51             (#peak  1499)
 &rst
  ixpk= 1499, nxpk= 0, iat=1766,1782, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,  &end
#
# 120 VAL  HA    120 VAL  QQG     2.58             (#peak  2948)
 &rst
  ixpk= 2948, nxpk= 0, iat=1768,  -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
 igr2=1772,1773,1774,1776,1777,1778,
 &end
#
# 120 VAL  HA    122 GLU  HN      5.97             (#peak  2943)
 &rst
  ixpk= 2943, nxpk= 0, iat=1768,1797, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,  &end
#
# 120 VAL  HA    123 ALA  HN      3.75             (#peak  2945)
 &rst
  ixpk= 2945, nxpk= 0, iat=1768,1812, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,  &end
#
# 120 VAL  HA    123 ALA  QB      3.46             (#peak  2949)
 &rst
  ixpk= 2949, nxpk= 0, iat=1768,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2=1816,1817,1818,
 &end
#
# 120 VAL  HB    121 GLU  HN      4.16             (#peak  1270)
 &rst
  ixpk= 1270, nxpk= 0, iat=1770,1782, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,  &end
#
# 120 VAL  QQG   121 GLU  HN      4.35             (#peak  3045)
 &rst
  ixpk= 3045, nxpk= 0, iat=  -1,1782, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1=1772,1773,1774,1776,1777,1778,
 &end
#
# 120 VAL  QQG   123 ALA  QB      4.02             (#peak  3044)
 &rst
  ixpk= 3044, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
 igr1=1772,1773,1774,1776,1777,1778,
 igr2=1816,1817,1818,
 &end
#
# 120 VAL  QQG   124 GLN  HN      4.67             (#peak  3040)
 &rst
  ixpk= 3040, nxpk= 0, iat=  -1,1822, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
 igr1=1772,1773,1774,1776,1777,1778,
 &end
#
# 120 VAL  QQG   124 GLN  HE21    3.22             (#peak  3043)
 &rst
  ixpk= 3043, nxpk= 0, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
 igr1=1772,1773,1774,1776,1777,1778,
 &end
#
# 120 VAL  QQG   124 GLN  HE22    4.07             (#peak  3046)
 &rst
  ixpk= 3046, nxpk= 0, iat=  -1,1835, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
 igr1=1772,1773,1774,1776,1777,1778,
 &end
#
# 121 GLU  HN    121 GLU  HB2     3.23             (#peak  3263)
 &rst
  ixpk= 3263, nxpk= 0, iat=1782,1786, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,  &end
#
# 121 GLU  HN    121 GLU  HB3     3.86             (#peak  1508)
 &rst
  ixpk= 1508, nxpk= 0, iat=1782,1787, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,  &end
#
# 121 GLU  HN    121 GLU  QG      4.30             (#peak  1096)
 &rst
  ixpk= 1096, nxpk= 0, iat=1782,  -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
 igr2=1789,1790,
 &end
#
# 121 GLU  HN    122 GLU  HN      6.15             (#peak   350)
 &rst
  ixpk= 350, nxpk= 0, iat=1782,1797, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 121 GLU  HN    123 ALA  QB      5.83             (#peak  3205)
 &rst
  ixpk= 3205, nxpk= 0, iat=1782,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr2=1816,1817,1818,
 &end
#
# 121 GLU  HA    121 GLU  QG      2.61             (#peak   154)
 &rst
  ixpk= 154, nxpk= 0, iat=1784,  -1, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,
 igr2=1789,1790,
 &end
#
# 121 GLU  HA    123 ALA  HN      4.66             (#peak   157)
 &rst
  ixpk= 157, nxpk= 0, iat=1784,1812, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,  &end
#
# 121 GLU  HA    124 GLN  HN      4.79             (#peak   158)
 &rst
  ixpk= 158, nxpk= 0, iat=1784,1822, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,  &end
#
# 121 GLU  HA    124 GLN  HB2     4.45             (#peak  1408)
 &rst
  ixpk= 1408, nxpk= 0, iat=1784,1826, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,  &end
#
# 121 GLU  HB2   121 GLU  QG      2.40             (#peak  3259)
 &rst
  ixpk= 3259, nxpk= 0, iat=1786,  -1, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr2=1789,1790,
 &end
#
# 121 GLU  HB2   122 GLU  HN      4.19             (#peak  3258)
 &rst
  ixpk= 3258, nxpk= 0, iat=1786,1797, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,  &end
#
# 121 GLU  HB2   122 GLU  HG2     5.46             (#peak  3661)
 &rst
  ixpk= 3661, nxpk= 0, iat=1786,1804, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,  &end
#
# 121 GLU  HB3   122 GLU  HN      5.84             (#peak  1504)
 &rst
  ixpk= 1504, nxpk= 0, iat=1787,1797, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,  &end
#
# 122 GLU  HN    122 GLU  HB2     3.48             (#peak  2232)
 &rst
  ixpk= 2232, nxpk= 0, iat=1797,1801, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,  &end
#
# 122 GLU  HN    122 GLU  HB3     4.08             (#peak  1950)
 &rst
  ixpk= 1950, nxpk= 0, iat=1797,1802, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,  &end
#
# 122 GLU  HN    122 GLU  HG2     3.37             (#peak  3656)
 &rst
  ixpk= 3656, nxpk= 0, iat=1797,1804, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,  &end
#
# 122 GLU  HN    122 GLU  HG3     3.40             (#peak  1460)
 &rst
  ixpk= 1460, nxpk= 0, iat=1797,1805, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,  &end
#
# 122 GLU  HN    123 ALA  HN      5.76             (#peak   342)
 &rst
  ixpk= 342, nxpk= 0, iat=1797,1812, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,  &end
#
# 122 GLU  HN    123 ALA  HA      5.59             (#peak   639)
 &rst
  ixpk= 639, nxpk= 0, iat=1797,1814, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,  &end
#
# 122 GLU  HN    123 ALA  QB      5.57             (#peak  3197)
 &rst
  ixpk= 3197, nxpk= 0, iat=1797,  -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
 igr2=1816,1817,1818,
 &end
#
# 122 GLU  HA    122 GLU  HB3     2.83             (#peak  2278)
 &rst
  ixpk= 2278, nxpk= 0, iat=1799,1802, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33,  &end
#
# 122 GLU  HA    122 GLU  HG2     3.24             (#peak  3660)
 &rst
  ixpk= 3660, nxpk= 0, iat=1799,1804, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,  &end
#
# 122 GLU  HA    122 GLU  HG3     3.87             (#peak  1465)
 &rst
  ixpk= 1465, nxpk= 0, iat=1799,1805, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,  &end
#
# 122 GLU  HA    124 GLN  HN      6.00             (#peak  2281)
 &rst
  ixpk= 2281, nxpk= 0, iat=1799,1822, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 122 GLU  HB2   123 ALA  HN      4.22             (#peak  2235)
 &rst
  ixpk= 2235, nxpk= 0, iat=1801,1812, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,  &end
#
# 122 GLU  HB3   123 ALA  HN      4.44             (#peak  1952)
 &rst
  ixpk= 1952, nxpk= 0, iat=1802,1812, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,  &end
#
# 122 GLU  HG3   123 ALA  HN      5.26             (#peak  1462)
 &rst
  ixpk= 1462, nxpk= 0, iat=1805,1812, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,  &end
#
# 123 ALA  HN    123 ALA  QB      3.72             (#peak  3198)
 &rst
  ixpk= 3198, nxpk= 0, iat=1812,  -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
 igr2=1816,1817,1818,
 &end
#
# 123 ALA  HN    124 GLN  HN      3.80             (#peak  1072)
 &rst
  ixpk= 1072, nxpk= 0, iat=1812,1822, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,  &end
#
# 123 ALA  HN    124 GLN  QG      5.43             (#peak  2820)
 &rst
  ixpk= 2820, nxpk= 0, iat=1812,  -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
 igr2=1829,1830,
 &end
#
# 123 ALA  QB    124 GLN  HN      3.60             (#peak  3199)
 &rst
  ixpk= 3199, nxpk= 0, iat=  -1,1822, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
 igr1=1816,1817,1818,
 &end
#
# 123 ALA  QB    124 GLN  QG      4.20             (#peak  3200)
 &rst
  ixpk= 3200, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
 igr1=1816,1817,1818,
 igr2=1829,1830,
 &end
#
# 124 GLN  HN    124 GLN  HB2     3.74             (#peak  1410)
 &rst
  ixpk= 1410, nxpk= 0, iat=1822,1826, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,  &end
#
# 124 GLN  HN    124 GLN  HE21    3.03             (#peak  1266)
 &rst
  ixpk= 1266, nxpk= 0, iat=1822,1834, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,  &end
#
# 124 GLN  HN    124 GLN  HE22    6.15             (#peak  1534)
 &rst
  ixpk= 1534, nxpk= 0, iat=1822,1835, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 124 GLN  HN    124 GLN  QG      4.01             (#peak  2821)
 &rst
  ixpk= 2821, nxpk= 0, iat=1822,  -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
 igr2=1829,1830,
 &end
#
# 124 GLN  HA    124 GLN  HE21    4.85             (#peak  2847)
 &rst
  ixpk= 2847, nxpk= 0, iat=1824,1834, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,  &end
#
# 124 GLN  HA    124 GLN  QG      3.68             (#peak  2823)
 &rst
  ixpk= 2823, nxpk= 0, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
 igr2=1829,1830,
 &end
#
# 124 GLN  HB2   124 GLN  HE21    4.27             (#peak  1413)
 &rst
  ixpk= 1413, nxpk= 0, iat=1826,1834, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,  &end
#
# 124 GLN  HB2   124 GLN  HE22    6.15             (#peak  1533)
 &rst
  ixpk= 1533, nxpk= 0, iat=1826,1835, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,  &end
#
# 124 GLN  HB2   124 GLN  QG      2.62             (#peak  1411)
 &rst
  ixpk= 1411, nxpk= 0, iat=1826,  -1, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,
 igr2=1829,1830,
 &end
#
# 124 GLN  HB3   124 GLN  HE21    4.62             (#peak  3155)
 &rst
  ixpk= 3155, nxpk= 0, iat=1827,1834, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,  &end
#
# 124 GLN  HB3   124 GLN  HE22    4.86             (#peak  3157)
 &rst
  ixpk= 3157, nxpk= 0, iat=1827,1835, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,  &end
#
# 124 GLN  HB3   124 GLN  QG      2.40             (#peak  3153)
 &rst
  ixpk= 3153, nxpk= 0, iat=1827,  -1, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
 igr2=1829,1830,
 &end
#
# 124 GLN  QG    124 GLN  HE21    3.26             (#peak  2824)
 &rst
  ixpk= 2824, nxpk= 0, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=1829,1830,
 &end
#
# 124 GLN  QG    124 GLN  HE22    3.66             (#peak  2827)
 &rst
  ixpk= 2827, nxpk= 0, iat=  -1,1835, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=1829,1830,
 &end
# 1838 atoms read from pdb file ./prm_1D.pdb.
# 8 ALA PHI:  (7 GLU C)-(8 ALA N)-(8 ALA CA)-(8 ALA C) -70.0 -30.0
 &rst     iat =    96,    98,   100,   106,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
   rk2 =  32.0, rk3 =  32.0,    &end

# 8 ALA PSI:  (8 ALA N)-(8 ALA CA)-(8 ALA C)-(9 LEU N) -60.0 -10.0
 &rst     iat =    98,   100,   106,   108,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 9 LEU PHI:  (8 ALA C)-(9 LEU N)-(9 LEU CA)-(9 LEU C) -70.0 -30.0
 &rst     iat =   106,   108,   110,   125,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 9 LEU PSI:  (9 LEU N)-(9 LEU CA)-(9 LEU C)-(10 ALA N) -60.0 -10.0
 &rst     iat =   108,   110,   125,   127,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 10 ALA PHI:  (9 LEU C)-(10 ALA N)-(10 ALA CA)-(10 ALA C) -70.0 -30.0
 &rst     iat =   125,   127,   129,   135,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 10 ALA PSI:  (10 ALA N)-(10 ALA CA)-(10 ALA C)-(11 LYS N) -60.0 -10.0
 &rst     iat =   127,   129,   135,   137,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 11 LYS PHI:  (10 ALA C)-(11 LYS N)-(11 LYS CA)-(11 LYS C) -70.0 -30.0
 &rst     iat =   135,   137,   139,   157,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 11 LYS PSI:  (11 LYS N)-(11 LYS CA)-(11 LYS C)-(12 LEU N) -60.0 -10.0
 &rst     iat =   137,   139,   157,   159,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 12 LEU PHI:  (11 LYS C)-(12 LEU N)-(12 LEU CA)-(12 LEU C) -70.0 -30.0
 &rst     iat =   157,   159,   161,   176,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 12 LEU PSI:  (12 LEU N)-(12 LEU CA)-(12 LEU C)-(13 ILE N) -60.0 -10.0
 &rst     iat =   159,   161,   176,   178,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 13 ILE PHI:  (12 LEU C)-(13 ILE N)-(13 ILE CA)-(13 ILE C) -70.0 -30.0
 &rst     iat =   176,   178,   180,   195,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 13 ILE PSI:  (13 ILE N)-(13 ILE CA)-(13 ILE C)-(14 SER N) -60.0 -10.0
 &rst     iat =   178,   180,   195,   197,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 14 SER PHI:  (13 ILE C)-(14 SER N)-(14 SER CA)-(14 SER C) -75.0 -25.0
 &rst     iat =   195,   197,   199,   206,
   r1 = -105.0, r2 = -75.0, r3 = -25.0, r4 =  5.0,
 &end

# 14 SER PSI:  (14 SER N)-(14 SER CA)-(14 SER C)-(15 LEU N) -60.0 -10.0
 &rst     iat =   197,   199,   206,   208,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 15 LEU PHI:  (14 SER C)-(15 LEU N)-(15 LEU CA)-(15 LEU C) -70.0 -30.0
 &rst     iat =   206,   208,   210,   225,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 15 LEU PSI:  (15 LEU N)-(15 LEU CA)-(15 LEU C)-(16 GLN N) -60.0 -10.0
 &rst     iat =   208,   210,   225,   227,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 19 GLU PHI:  (18 THR C)-(19 GLU N)-(19 GLU CA)-(19 GLU C) -140.0 -80.0
 &rst     iat =   266,   268,   270,   281,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 19 GLU PSI:  (19 GLU N)-(19 GLU CA)-(19 GLU C)-(20 ALA N)  60.0 180.0
 &rst     iat =   268,   270,   281,   283,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 20 ALA PHI:  (19 GLU C)-(20 ALA N)-(20 ALA CA)-(20 ALA C) -140.0 -80.0
 &rst     iat =   281,   283,   285,   291,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 20 ALA PSI:  (20 ALA N)-(20 ALA CA)-(20 ALA C)-(21 THR N)  60.0 180.0
 &rst     iat =   283,   285,   291,   293,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 21 THR PHI:  (20 ALA C)-(21 THR N)-(21 THR CA)-(21 THR C) -140.0 -80.0
 &rst     iat =   291,   293,   295,   305,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 21 THR PSI:  (21 THR N)-(21 THR CA)-(21 THR C)-(22 ILE N)  60.0 180.0
 &rst     iat =   293,   295,   305,   307,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 22 ILE PHI:  (21 THR C)-(22 ILE N)-(22 ILE CA)-(22 ILE C) -140.0 -80.0
 &rst     iat =   305,   307,   309,   324,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 22 ILE PSI:  (22 ILE N)-(22 ILE CA)-(22 ILE C)-(23 VAL N)  60.0 180.0
 &rst     iat =   307,   309,   324,   326,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 23 VAL PHI:  (22 ILE C)-(23 VAL N)-(23 VAL CA)-(23 VAL C) -140.0 -80.0
 &rst     iat =   324,   326,   328,   340,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 23 VAL PSI:  (23 VAL N)-(23 VAL CA)-(23 VAL C)-(24 THR N)  60.0 180.0
 &rst     iat =   326,   328,   340,   342,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 24 THR PHI:  (23 VAL C)-(24 THR N)-(24 THR CA)-(24 THR C) -140.0 -80.0
 &rst     iat =   340,   342,   344,   354,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 24 THR PSI:  (24 THR N)-(24 THR CA)-(24 THR C)-(25 LEU N)  60.0 180.0
 &rst     iat =   342,   344,   354,   356,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 33 SER PHI:  (32 LEU C)-(33 SER N)-(33 SER CA)-(33 SER C) -140.0 -80.0
 &rst     iat =   479,   481,   483,   490,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 33 SER PSI:  (33 SER N)-(33 SER CA)-(33 SER C)-(34 GLU N)  60.0 180.0
 &rst     iat =   481,   483,   490,   492,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 34 GLU PHI:  (33 SER C)-(34 GLU N)-(34 GLU CA)-(34 GLU C) -140.0 -80.0
 &rst     iat =   490,   492,   494,   505,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 34 GLU PSI:  (34 GLU N)-(34 GLU CA)-(34 GLU C)-(35 GLU N)  60.0 180.0
 &rst     iat =   492,   494,   505,   507,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 35 GLU PHI:  (34 GLU C)-(35 GLU N)-(35 GLU CA)-(35 GLU C) -140.0 -80.0
 &rst     iat =   505,   507,   509,   520,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 35 GLU PSI:  (35 GLU N)-(35 GLU CA)-(35 GLU C)-(36 GLN N)  60.0 180.0
 &rst     iat =   507,   509,   520,   522,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 36 GLN PHI:  (35 GLU C)-(36 GLN N)-(36 GLN CA)-(36 GLN C) -140.0 -80.0
 &rst     iat =   520,   522,   524,   537,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 36 GLN PSI:  (36 GLN N)-(36 GLN CA)-(36 GLN C)-(37 VAL N)  60.0 180.0
 &rst     iat =   522,   524,   537,   539,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 37 VAL PHI:  (36 GLN C)-(37 VAL N)-(37 VAL CA)-(37 VAL C) -140.0 -80.0
 &rst     iat =   537,   539,   541,   553,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 37 VAL PSI:  (37 VAL N)-(37 VAL CA)-(37 VAL C)-(38 ASP N)  60.0 180.0
 &rst     iat =   539,   541,   553,   555,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 38 ASP PHI:  (37 VAL C)-(38 ASP N)-(38 ASP CA)-(38 ASP C) -140.0 -80.0
 &rst     iat =   553,   555,   557,   565,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 38 ASP PSI:  (38 ASP N)-(38 ASP CA)-(38 ASP C)-(39 VAL N)  60.0 180.0
 &rst     iat =   555,   557,   565,   567,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 47 ILE PHI:  (46 ASP C)-(47 ILE N)-(47 ILE CA)-(47 ILE C) -140.0 -80.0
 &rst     iat =   691,   693,   695,   710,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 47 ILE PSI:  (47 ILE N)-(47 ILE CA)-(47 ILE C)-(48 ILE N)  60.0 180.0
 &rst     iat =   693,   695,   710,   712,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 48 ILE PHI:  (47 ILE C)-(48 ILE N)-(48 ILE CA)-(48 ILE C) -140.0 -80.0
 &rst     iat =   710,   712,   714,   729,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 48 ILE PSI:  (48 ILE N)-(48 ILE CA)-(48 ILE C)-(49 LYS N)  60.0 180.0
 &rst     iat =   712,   714,   729,   731,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 49 LYS PHI:  (48 ILE C)-(49 LYS N)-(49 LYS CA)-(49 LYS C) -140.0 -80.0
 &rst     iat =   729,   731,   733,   751,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 49 LYS PSI:  (49 LYS N)-(49 LYS CA)-(49 LYS C)-(50 VAL N)  60.0 180.0
 &rst     iat =   731,   733,   751,   753,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 50 VAL PHI:  (49 LYS C)-(50 VAL N)-(50 VAL CA)-(50 VAL C) -140.0 -80.0
 &rst     iat =   751,   753,   755,   767,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 50 VAL PSI:  (50 VAL N)-(50 VAL CA)-(50 VAL C)-(51 VAL N)  60.0 180.0
 &rst     iat =   753,   755,   767,   769,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 59 ASP PHI:  (58 VAL C)-(59 ASP N)-(59 ASP CA)-(59 ASP C) -140.0 -80.0
 &rst     iat =   883,   885,   887,   895,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 59 ASP PSI:  (59 ASP N)-(59 ASP CA)-(59 ASP C)-(60 GLY N)  60.0 180.0
 &rst     iat =   885,   887,   895,   897,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 60 GLY PHI:  (59 ASP C)-(60 GLY N)-(60 GLY CA)-(60 GLY C) -146.0 -70.0
 &rst     iat =   895,   897,   899,   902,
   r1 = -147.0, r2 = -146.0, r3 = -70.0, r4 = -69.0,
 &end

# 61 ARG PHI:  (60 GLY C)-(61 ARG N)-(61 ARG CA)-(61 ARG C) -146.0 -70.0
 &rst     iat =   902,   904,   906,   926,
   r1 = -147.0, r2 = -146.0, r3 = -70.0, r4 = -69.0,
 &end

# 61 ARG PSI:  (61 ARG N)-(61 ARG CA)-(61 ARG C)-(62 VAL N)  60.0 180.0
 &rst     iat =   904,   906,   926,   928,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 62 VAL PHI:  (61 ARG C)-(62 VAL N)-(62 VAL CA)-(62 VAL C) -140.0 -80.0
 &rst     iat =   926,   928,   930,   942,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 62 VAL PSI:  (62 VAL N)-(62 VAL CA)-(62 VAL C)-(63 ILE N)  60.0 180.0
 &rst     iat =   928,   930,   942,   944,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 63 ILE PHI:  (62 VAL C)-(63 ILE N)-(63 ILE CA)-(63 ILE C) -140.0 -80.0
 &rst     iat =   942,   944,   946,   961,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 63 ILE PSI:  (63 ILE N)-(63 ILE CA)-(63 ILE C)-(64 GLU N)  45.0 190.0
 &rst     iat =   944,   946,   961,   963,
   r1 =  15.0, r2 =  45.0, r3 = 190.0, r4 = 220.0,
 &end

# 64 GLU PHI:  (63 ILE C)-(64 GLU N)-(64 GLU CA)-(64 GLU C) -165.0 -70.0
 &rst     iat =   961,   963,   965,   976,
   r1 = -195.0, r2 = -165.0, r3 = -70.0, r4 = -40.0,
 &end

# 64 GLU PSI:  (64 GLU N)-(64 GLU CA)-(64 GLU C)-(65 GLY N)  50.0 180.0
 &rst     iat =   963,   965,   976,   978,
   r1 =  49.0, r2 =  50.0, r3 = 180.0, r4 = 181.0,
 &end

# 67 SER PHI:  (66 HID C)-(67 SER N)-(67 SER CA)-(67 SER C) -140.0 -80.0
 &rst     iat =  1000,  1002,  1004,  1011,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 67 SER PSI:  (67 SER N)-(67 SER CA)-(67 SER C)-(68 MET N)  60.0 180.0
 &rst     iat =  1002,  1004,  1011,  1013,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 68 MET PHI:  (67 SER C)-(68 MET N)-(68 MET CA)-(68 MET C) -140.0 -80.0
 &rst     iat =  1011,  1013,  1015,  1028,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 68 MET PSI:  (68 MET N)-(68 MET CA)-(68 MET C)-(69 VAL N)  60.0 180.0
 &rst     iat =  1013,  1015,  1028,  1030,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 69 VAL PHI:  (68 MET C)-(69 VAL N)-(69 VAL CA)-(69 VAL C) -140.0 -80.0
 &rst     iat =  1028,  1030,  1032,  1044,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 69 VAL PSI:  (69 VAL N)-(69 VAL CA)-(69 VAL C)-(70 ASP N)  60.0 180.0
 &rst     iat =  1030,  1032,  1044,  1046,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 70 ASP PHI:  (69 VAL C)-(70 ASP N)-(70 ASP CA)-(70 ASP C) -140.0 -80.0
 &rst     iat =  1044,  1046,  1048,  1056,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 70 ASP PSI:  (70 ASP N)-(70 ASP CA)-(70 ASP C)-(71 GLU N)  60.0 180.0
 &rst     iat =  1046,  1048,  1056,  1058,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 81 VAL PHI:  (80 PRO C)-(81 VAL N)-(81 VAL CA)-(81 VAL C) -140.0 -80.0
 &rst     iat =  1197,  1199,  1201,  1213,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 81 VAL PSI:  (81 VAL N)-(81 VAL CA)-(81 VAL C)-(82 ALA N)  60.0 180.0
 &rst     iat =  1199,  1201,  1213,  1215,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 82 ALA PHI:  (81 VAL C)-(82 ALA N)-(82 ALA CA)-(82 ALA C) -140.0 -80.0
 &rst     iat =  1213,  1215,  1217,  1223,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 82 ALA PSI:  (82 ALA N)-(82 ALA CA)-(82 ALA C)-(83 LYS N)  60.0 180.0
 &rst     iat =  1215,  1217,  1223,  1225,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 83 LYS PHI:  (82 ALA C)-(83 LYS N)-(83 LYS CA)-(83 LYS C) -140.0 -80.0
 &rst     iat =  1223,  1225,  1227,  1245,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 83 LYS PSI:  (83 LYS N)-(83 LYS CA)-(83 LYS C)-(84 LYS N)  60.0 180.0
 &rst     iat =  1225,  1227,  1245,  1247,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 88 THR PHI:  (87 SER C)-(88 THR N)-(88 THR CA)-(88 THR C) -140.0 -80.0
 &rst     iat =  1299,  1301,  1303,  1313,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 88 THR PSI:  (88 THR N)-(88 THR CA)-(88 THR C)-(89 VAL N)  60.0 180.0
 &rst     iat =  1301,  1303,  1313,  1315,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 89 VAL PHI:  (88 THR C)-(89 VAL N)-(89 VAL CA)-(89 VAL C) -140.0 -80.0
 &rst     iat =  1313,  1315,  1317,  1329,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 89 VAL PSI:  (89 VAL N)-(89 VAL CA)-(89 VAL C)-(90 ILE N)  60.0 180.0
 &rst     iat =  1315,  1317,  1329,  1331,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 94 ILE PHI:  (93 SER C)-(94 ILE N)-(94 ILE CA)-(94 ILE C) -140.0 -80.0
 &rst     iat =  1376,  1378,  1380,  1395,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 94 ILE PSI:  (94 ILE N)-(94 ILE CA)-(94 ILE C)-(95 ASN N)  60.0 180.0
 &rst     iat =  1378,  1380,  1395,  1397,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 95 ASN PHI:  (94 ILE C)-(95 ASN N)-(95 ASN CA)-(95 ASN C) -140.0 -80.0
 &rst     iat =  1395,  1397,  1399,  1409,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 95 ASN PSI:  (95 ASN N)-(95 ASN CA)-(95 ASN C)-(96 GLN N)  60.0 180.0
 &rst     iat =  1397,  1399,  1409,  1411,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 100 LEU PHI:  (99 SER C)-(100 LEU N)-(100 LEU CA)-(100 LEU C) -140.0 -80.0
 &rst     iat =  1458,  1460,  1462,  1477,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 100 LEU PSI:  (100 LEU N)-(100 LEU CA)-(100 LEU C)-(101 LEU N)  60.0 180.0
 &rst     iat =  1460,  1462,  1477,  1479,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 101 LEU PHI:  (100 LEU C)-(101 LEU N)-(101 LEU CA)-(101 LEU C) -140.0 -80.0
 &rst     iat =  1477,  1479,  1481,  1496,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 101 LEU PSI:  (101 LEU N)-(101 LEU CA)-(101 LEU C)-(102 ILE N)  60.0 180.0
 &rst     iat =  1479,  1481,  1496,  1498,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 102 ILE PHI:  (101 LEU C)-(102 ILE N)-(102 ILE CA)-(102 ILE C) -140.0 -80.0
 &rst     iat =  1496,  1498,  1500,  1515,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 102 ILE PSI:  (102 ILE N)-(102 ILE CA)-(102 ILE C)-(103 CYS N)  60.0 180.0
 &rst     iat =  1498,  1500,  1515,  1517,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 103 CYS PHI:  (102 ILE C)-(103 CYS N)-(103 CYS CA)-(103 CYS C) -140.0 -80.0
 &rst     iat =  1515,  1517,  1519,  1526,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 103 CYS PSI:  (103 CYS N)-(103 CYS CA)-(103 CYS C)-(104 ALA N)  60.0 180.0
 &rst     iat =  1517,  1519,  1526,  1528,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 104 ALA PHI:  (103 CYS C)-(104 ALA N)-(104 ALA CA)-(104 ALA C) -140.0 -80.0
 &rst     iat =  1526,  1528,  1530,  1536,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 104 ALA PSI:  (104 ALA N)-(104 ALA CA)-(104 ALA C)-(105 THR N)  60.0 180.0
 &rst     iat =  1528,  1530,  1536,  1538,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 105 THR PHI:  (104 ALA C)-(105 THR N)-(105 THR CA)-(105 THR C) -140.0 -80.0
 &rst     iat =  1536,  1538,  1540,  1550,
   r1 = -170.0, r2 = -140.0, r3 = -80.0, r4 = -50.0,
 &end

# 105 THR PSI:  (105 THR N)-(105 THR CA)-(105 THR C)-(106 HID N)  55.0 190.0
 &rst     iat =  1538,  1540,  1550,  1552,
   r1 =  54.0, r2 =  55.0, r3 = 190.0, r4 = 191.0,
 &end

# 106 HIS PHI:  (105 THR C)-(106 HID N)-(106 HID CA)-(106 HID C) -155.0 -70.0
 &rst     iat =  1550,  1552,  1554,  1567,
   r1 = -156.0, r2 = -155.0, r3 = -70.0, r4 = -69.0,
 &end

# 106 HIS PSI:  (106 HID N)-(106 HID CA)-(106 HID C)-(107 VAL N)  60.0 180.0
 &rst     iat =  1552,  1554,  1567,  1569,
   r1 =  30.0, r2 =  60.0, r3 = 180.0, r4 = 210.0,
 &end

# 108 GLY PHI:  (107 VAL C)-(108 GLY N)-(108 GLY CA)-(108 GLY C) -70.0 -30.0
 &rst     iat =  1583,  1585,  1587,  1590,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 109 ALA PHI:  (108 GLY C)-(109 ALA N)-(109 ALA CA)-(109 ALA C) -70.0 -30.0
 &rst     iat =  1590,  1592,  1594,  1600,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 109 ALA PSI:  (109 ALA N)-(109 ALA CA)-(109 ALA C)-(110 ASP N) -60.0 -10.0
 &rst     iat =  1592,  1594,  1600,  1602,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 110 ASP PHI:  (109 ALA C)-(110 ASP N)-(110 ASP CA)-(110 ASP C) -70.0 -30.0
 &rst     iat =  1600,  1602,  1604,  1612,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 110 ASP PSI:  (110 ASP N)-(110 ASP CA)-(110 ASP C)-(111 THR N) -60.0 -10.0
 &rst     iat =  1602,  1604,  1612,  1614,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 112 THR PHI:  (111 THR C)-(112 THR N)-(112 THR CA)-(112 THR C) -70.0 -30.0
 &rst     iat =  1626,  1628,  1630,  1640,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 112 THR PSI:  (112 THR N)-(112 THR CA)-(112 THR C)-(113 LEU N) -60.0 -10.0
 &rst     iat =  1628,  1630,  1640,  1642,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 113 LEU PHI:  (112 THR C)-(113 LEU N)-(113 LEU CA)-(113 LEU C) -70.0 -30.0
 &rst     iat =  1640,  1642,  1644,  1659,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 113 LEU PSI:  (113 LEU N)-(113 LEU CA)-(113 LEU C)-(114 SER N) -60.0 -10.0
 &rst     iat =  1642,  1644,  1659,  1661,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 114 SER PHI:  (113 LEU C)-(114 SER N)-(114 SER CA)-(114 SER C) -70.0 -30.0
 &rst     iat =  1659,  1661,  1663,  1670,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 114 SER PSI:  (114 SER N)-(114 SER CA)-(114 SER C)-(115 GLN N) -60.0 -10.0
 &rst     iat =  1661,  1663,  1670,  1672,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 115 GLN PHI:  (114 SER C)-(115 GLN N)-(115 GLN CA)-(115 GLN C) -70.0 -30.0
 &rst     iat =  1670,  1672,  1674,  1687,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 115 GLN PSI:  (115 GLN N)-(115 GLN CA)-(115 GLN C)-(116 ILE N) -60.0 -10.0
 &rst     iat =  1672,  1674,  1687,  1689,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 116 ILE PHI:  (115 GLN C)-(116 ILE N)-(116 ILE CA)-(116 ILE C) -70.0 -30.0
 &rst     iat =  1687,  1689,  1691,  1706,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 116 ILE PSI:  (116 ILE N)-(116 ILE CA)-(116 ILE C)-(117 VAL N) -60.0 -10.0
 &rst     iat =  1689,  1691,  1706,  1708,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 117 VAL PHI:  (116 ILE C)-(117 VAL N)-(117 VAL CA)-(117 VAL C) -70.0 -30.0
 &rst     iat =  1706,  1708,  1710,  1722,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 117 VAL PSI:  (117 VAL N)-(117 VAL CA)-(117 VAL C)-(118 LYS N) -60.0 -10.0
 &rst     iat =  1708,  1710,  1722,  1724,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 118 LYS PHI:  (117 VAL C)-(118 LYS N)-(118 LYS CA)-(118 LYS C) -70.0 -30.0
 &rst     iat =  1722,  1724,  1726,  1744,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 118 LYS PSI:  (118 LYS N)-(118 LYS CA)-(118 LYS C)-(119 LEU N) -60.0 -10.0
 &rst     iat =  1724,  1726,  1744,  1746,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 119 LEU PHI:  (118 LYS C)-(119 LEU N)-(119 LEU CA)-(119 LEU C) -70.0 -30.0
 &rst     iat =  1744,  1746,  1748,  1763,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 119 LEU PSI:  (119 LEU N)-(119 LEU CA)-(119 LEU C)-(120 VAL N) -60.0 -10.0
 &rst     iat =  1746,  1748,  1763,  1765,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 120 VAL PHI:  (119 LEU C)-(120 VAL N)-(120 VAL CA)-(120 VAL C) -70.0 -30.0
 &rst     iat =  1763,  1765,  1767,  1779,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 120 VAL PSI:  (120 VAL N)-(120 VAL CA)-(120 VAL C)-(121 GLU N) -60.0 -10.0
 &rst     iat =  1765,  1767,  1779,  1781,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 121 GLU PHI:  (120 VAL C)-(121 GLU N)-(121 GLU CA)-(121 GLU C) -70.0 -30.0
 &rst     iat =  1779,  1781,  1783,  1794,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 121 GLU PSI:  (121 GLU N)-(121 GLU CA)-(121 GLU C)-(122 GLU N) -60.0 -10.0
 &rst     iat =  1781,  1783,  1794,  1796,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 122 GLU PHI:  (121 GLU C)-(122 GLU N)-(122 GLU CA)-(122 GLU C) -70.0 -30.0
 &rst     iat =  1794,  1796,  1798,  1809,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 122 GLU PSI:  (122 GLU N)-(122 GLU CA)-(122 GLU C)-(123 ALA N) -60.0 -10.0
 &rst     iat =  1796,  1798,  1809,  1811,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 123 ALA PHI:  (122 GLU C)-(123 ALA N)-(123 ALA CA)-(123 ALA C) -70.0 -30.0
 &rst     iat =  1809,  1811,  1813,  1819,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

# 123 ALA PSI:  (123 ALA N)-(123 ALA CA)-(123 ALA C)-(124 GLN N) -60.0 -10.0
 &rst     iat =  1811,  1813,  1819,  1821,
   r1 = -90.0, r2 = -60.0, r3 = -10.0, r4 =  20.0,
 &end

# 124 GLN PHI:  (123 ALA C)-(124 GLN N)-(124 GLN CA)-(124 GLN C) -70.0 -30.0
 &rst     iat =  1819,  1821,  1823,  1836,
   r1 = -100.0, r2 = -70.0, r3 = -30.0, r4 =  0.0,
 &end

#
#  chirality for residue 1 atoms:  N C HA2 HA3
 &rst iat=1,8,6,7, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 10., rk3=10.,  &end
#
#  chirality for residue 2 atoms:  CA OG HB2 HB3
 &rst iat=12,17,15,16, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=10,19,13,14, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=23,28,26,27, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=21,39,24,25, &end
#
#  chirality for residue 4 atoms:  CA CG2 OG1 HB
 &rst iat=43,47,51,46, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=41,53,44,45, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=57,62,60,61, &end
#
#  chirality for residue 5 atoms:  CB SD HG2 HG3
 &rst iat=59,65,63,64, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=55,70,58,59, &end
#
#  chirality for residue 6 atoms:  CA OG HB2 HB3
 &rst iat=74,79,77,78, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=72,81,75,76, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=85,90,88,89, &end
#
#  chirality for residue 7 atoms:  CB CD HG2 HG3
 &rst iat=87,93,91,92, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=83,96,86,87, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=98,106,101,102, &end
#
#  chirality for residue 9 atoms:  CA CG HB2 HB3
 &rst iat=110,115,113,114, &end
#
#  chirality for residue 9 atoms:  CB CD1 CD2 HG
 &rst iat=112,117,121,116, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=108,125,111,112, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=127,135,130,131, &end
#
#  chirality for residue 11 atoms:  CA CG HB2 HB3
 &rst iat=139,144,142,143, &end
#
#  chirality for residue 11 atoms:  CB CD HG2 HG3
 &rst iat=141,147,145,146, &end
#
#  chirality for residue 11 atoms:  CD NZ HE2 HE3
 &rst iat=147,153,151,152, &end
#
#  chirality for residue 11 atoms:  CG CE HD2 HD3
 &rst iat=144,150,148,149, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=137,157,140,141, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=161,166,164,165, &end
#
#  chirality for residue 12 atoms:  CB CD1 CD2 HG
 &rst iat=163,168,172,167, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=159,176,162,163, &end
#
#  chirality for residue 13 atoms:  CA CG2 CG1 HB
 &rst iat=180,184,188,183, &end
#
#  chirality for residue 13 atoms:  CB CD1 HG12 HG13
 &rst iat=182,191,189,190, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=178,195,181,182, &end
#
#  chirality for residue 14 atoms:  CA OG HB2 HB3
 &rst iat=199,204,202,203, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=197,206,200,201, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=210,215,213,214, &end
#
#  chirality for residue 15 atoms:  CB CD1 CD2 HG
 &rst iat=212,217,221,216, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=208,225,211,212, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=229,234,232,233, &end
#
#  chirality for residue 16 atoms:  CB CD HG2 HG3
 &rst iat=231,237,235,236, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=227,242,230,231, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=244,252,247,248, &end
#
#  chirality for residue 18 atoms:  CA CG2 OG1 HB
 &rst iat=256,260,264,259, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=254,266,257,258, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=270,275,273,274, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=272,278,276,277, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=268,281,271,272, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=283,291,286,287, &end
#
#  chirality for residue 21 atoms:  CA CG2 OG1 HB
 &rst iat=295,299,303,298, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=293,305,296,297, &end
#
#  chirality for residue 22 atoms:  CA CG2 CG1 HB
 &rst iat=309,313,317,312, &end
#
#  chirality for residue 22 atoms:  CB CD1 HG12 HG13
 &rst iat=311,320,318,319, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=307,324,310,311, &end
#
#  chirality for residue 23 atoms:  CA CG1 CG2 HB
 &rst iat=328,332,336,331, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=326,340,329,330, &end
#
#  chirality for residue 24 atoms:  CA CG2 OG1 HB
 &rst iat=344,348,352,347, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=342,354,345,346, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=358,363,361,362, &end
#
#  chirality for residue 25 atoms:  CB CD1 CD2 HG
 &rst iat=360,365,369,364, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=356,373,359,360, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=377,382,380,381, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=375,385,378,379, &end
#
#  chirality for residue 27 atoms:  CA OG HB2 HB3
 &rst iat=389,394,392,393, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=387,396,390,391, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=400,405,403,404, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=398,408,401,402, &end
#
#  chirality for residue 29 atoms:  CA CG HB2 HB3
 &rst iat=412,417,415,416, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=410,422,413,414, &end
#
#  chirality for residue 30 atoms:  CA CG2 CG1 HB
 &rst iat=426,430,434,429, &end
#
#  chirality for residue 30 atoms:  CB CD1 HG12 HG13
 &rst iat=428,437,435,436, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=424,441,427,428, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=445,450,448,449, &end
#
#  chirality for residue 31 atoms:  CB CD1 CD2 HG
 &rst iat=447,452,456,451, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=443,460,446,447, &end
#
#  chirality for residue 32 atoms:  CA CG HB2 HB3
 &rst iat=464,469,467,468, &end
#
#  chirality for residue 32 atoms:  CB CD1 CD2 HG
 &rst iat=466,471,475,470, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=462,479,465,466, &end
#
#  chirality for residue 33 atoms:  CA OG HB2 HB3
 &rst iat=483,488,486,487, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=481,490,484,485, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=494,499,497,498, &end
#
#  chirality for residue 34 atoms:  CB CD HG2 HG3
 &rst iat=496,502,500,501, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=492,505,495,496, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=509,514,512,513, &end
#
#  chirality for residue 35 atoms:  CB CD HG2 HG3
 &rst iat=511,517,515,516, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=507,520,510,511, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=524,529,527,528, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=526,532,530,531, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=522,537,525,526, &end
#
#  chirality for residue 37 atoms:  CA CG1 CG2 HB
 &rst iat=541,545,549,544, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=539,553,542,543, &end
#
#  chirality for residue 38 atoms:  CA CG HB2 HB3
 &rst iat=557,562,560,561, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=555,565,558,559, &end
#
#  chirality for residue 39 atoms:  CA CG1 CG2 HB
 &rst iat=569,573,577,572, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=567,581,570,571, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=585,590,588,589, &end
#
#  chirality for residue 40 atoms:  CB CD HG2 HG3
 &rst iat=587,593,591,592, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=583,596,586,587, &end
#
#  chirality for residue 41 atoms:  CA CG HB2 HB3
 &rst iat=600,605,603,604, &end
#
#  chirality for residue 41 atoms:  CB CD1 CD2 HG
 &rst iat=602,607,611,606, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=598,615,601,602, &end
#
#  chirality for residue 42 atoms:  CA CG1 CG2 HB
 &rst iat=619,623,627,622, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=617,631,620,621, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=635,640,638,639, &end
#
#  chirality for residue 43 atoms:  CB CD HG2 HG3
 &rst iat=637,643,641,642, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=633,648,636,637, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=652,657,655,656, &end
#
#  chirality for residue 44 atoms:  CB CD HG2 HG3
 &rst iat=654,660,658,659, &end
#
#  chirality for residue 44 atoms:  CG NE HD2 HD3
 &rst iat=657,663,661,662, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=650,672,653,654, &end
#
#  chirality for residue 45 atoms:  N C HA2 HA3
 &rst iat=674,679,677,678, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=683,688,686,687, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=681,691,684,685, &end
#
#  chirality for residue 47 atoms:  CA CG2 CG1 HB
 &rst iat=695,699,703,698, &end
#
#  chirality for residue 47 atoms:  CB CD1 HG12 HG13
 &rst iat=697,706,704,705, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=693,710,696,697, &end
#
#  chirality for residue 48 atoms:  CA CG2 CG1 HB
 &rst iat=714,718,722,717, &end
#
#  chirality for residue 48 atoms:  CB CD1 HG12 HG13
 &rst iat=716,725,723,724, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=712,729,715,716, &end
#
#  chirality for residue 49 atoms:  CA CG HB2 HB3
 &rst iat=733,738,736,737, &end
#
#  chirality for residue 49 atoms:  CB CD HG2 HG3
 &rst iat=735,741,739,740, &end
#
#  chirality for residue 49 atoms:  CD NZ HE2 HE3
 &rst iat=741,747,745,746, &end
#
#  chirality for residue 49 atoms:  CG CE HD2 HD3
 &rst iat=738,744,742,743, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=731,751,734,735, &end
#
#  chirality for residue 50 atoms:  CA CG1 CG2 HB
 &rst iat=755,759,763,758, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=753,767,756,757, &end
#
#  chirality for residue 51 atoms:  CA CG1 CG2 HB
 &rst iat=771,775,779,774, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=769,783,772,773, &end
#
#  chirality for residue 52 atoms:  CA CG HB2 HB3
 &rst iat=795,789,793,794, &end
#
#  chirality for residue 52 atoms:  CB CD HG2 HG3
 &rst iat=792,786,790,791, &end
#
#  chirality for residue 52 atoms:  CG N HD2 HD3
 &rst iat=789,785,787,788, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=785,797,796,792, &end
#
#  chirality for residue 53 atoms:  N C HA2 HA3
 &rst iat=799,804,802,803, &end
#
#  chirality for residue 54 atoms:  N C HA2 HA3
 &rst iat=806,811,809,810, &end
#
#  chirality for residue 55 atoms:  CA CG HB2 HB3
 &rst iat=815,820,818,819, &end
#
#  chirality for residue 55 atoms:  CB CD HG2 HG3
 &rst iat=817,823,821,822, &end
#
#  chirality for residue 55 atoms:  CD NZ HE2 HE3
 &rst iat=823,829,827,828, &end
#
#  chirality for residue 55 atoms:  CG CE HD2 HD3
 &rst iat=820,826,824,825, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=813,833,816,817, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=837,842,840,841, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=835,853,838,839, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=865,859,863,864, &end
#
#  chirality for residue 57 atoms:  CB CD HG2 HG3
 &rst iat=862,856,860,861, &end
#
#  chirality for residue 57 atoms:  CG N HD2 HD3
 &rst iat=859,855,857,858, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=855,867,866,862, &end
#
#  chirality for residue 58 atoms:  CA CG1 CG2 HB
 &rst iat=871,875,879,874, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=869,883,872,873, &end
#
#  chirality for residue 59 atoms:  CA CG HB2 HB3
 &rst iat=887,892,890,891, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=885,895,888,889, &end
#
#  chirality for residue 60 atoms:  N C HA2 HA3
 &rst iat=897,902,900,901, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=906,911,909,910, &end
#
#  chirality for residue 61 atoms:  CB CD HG2 HG3
 &rst iat=908,914,912,913, &end
#
#  chirality for residue 61 atoms:  CG NE HD2 HD3
 &rst iat=911,917,915,916, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=904,926,907,908, &end
#
#  chirality for residue 62 atoms:  CA CG1 CG2 HB
 &rst iat=930,934,938,933, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=928,942,931,932, &end
#
#  chirality for residue 63 atoms:  CA CG2 CG1 HB
 &rst iat=946,950,954,949, &end
#
#  chirality for residue 63 atoms:  CB CD1 HG12 HG13
 &rst iat=948,957,955,956, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=944,961,947,948, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=965,970,968,969, &end
#
#  chirality for residue 64 atoms:  CB CD HG2 HG3
 &rst iat=967,973,971,972, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=963,976,966,967, &end
#
#  chirality for residue 65 atoms:  N C HA2 HA3
 &rst iat=978,983,981,982, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=987,992,990,991, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=985,1000,988,989, &end
#
#  chirality for residue 67 atoms:  CA OG HB2 HB3
 &rst iat=1004,1009,1007,1008, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1002,1011,1005,1006, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1015,1020,1018,1019, &end
#
#  chirality for residue 68 atoms:  CB SD HG2 HG3
 &rst iat=1017,1023,1021,1022, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1013,1028,1016,1017, &end
#
#  chirality for residue 69 atoms:  CA CG1 CG2 HB
 &rst iat=1032,1036,1040,1035, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1030,1044,1033,1034, &end
#
#  chirality for residue 70 atoms:  CA CG HB2 HB3
 &rst iat=1048,1053,1051,1052, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1046,1056,1049,1050, &end
#
#  chirality for residue 71 atoms:  CA CG HB2 HB3
 &rst iat=1060,1065,1063,1064, &end
#
#  chirality for residue 71 atoms:  CB CD HG2 HG3
 &rst iat=1062,1068,1066,1067, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1058,1071,1061,1062, &end
#
#  chirality for residue 72 atoms:  CA OG HB2 HB3
 &rst iat=1075,1080,1078,1079, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1073,1082,1076,1077, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1086,1091,1089,1090, &end
#
#  chirality for residue 73 atoms:  CB CD1 CD2 HG
 &rst iat=1088,1093,1097,1092, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1084,1101,1087,1088, &end
#
#  chirality for residue 74 atoms:  CA CG2 CG1 HB
 &rst iat=1105,1109,1113,1108, &end
#
#  chirality for residue 74 atoms:  CB CD1 HG12 HG13
 &rst iat=1107,1116,1114,1115, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1103,1120,1106,1107, &end
#
#  chirality for residue 75 atoms:  CA CG2 OG1 HB
 &rst iat=1124,1128,1132,1127, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1122,1134,1125,1126, &end
#
#  chirality for residue 76 atoms:  N C HA2 HA3
 &rst iat=1136,1141,1139,1140, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1145,1150,1148,1149, &end
#
#  chirality for residue 77 atoms:  CB CD HG2 HG3
 &rst iat=1147,1153,1151,1152, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1143,1156,1146,1147, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1158,1166,1161,1162, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1170,1175,1173,1174, &end
#
#  chirality for residue 79 atoms:  CB SD HG2 HG3
 &rst iat=1172,1178,1176,1177, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1168,1183,1171,1172, &end
#
#  chirality for residue 80 atoms:  CA CG HB2 HB3
 &rst iat=1195,1189,1193,1194, &end
#
#  chirality for residue 80 atoms:  CB CD HG2 HG3
 &rst iat=1192,1186,1190,1191, &end
#
#  chirality for residue 80 atoms:  CG N HD2 HD3
 &rst iat=1189,1185,1187,1188, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1185,1197,1196,1192, &end
#
#  chirality for residue 81 atoms:  CA CG1 CG2 HB
 &rst iat=1201,1205,1209,1204, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1199,1213,1202,1203, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1215,1223,1218,1219, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1227,1232,1230,1231, &end
#
#  chirality for residue 83 atoms:  CB CD HG2 HG3
 &rst iat=1229,1235,1233,1234, &end
#
#  chirality for residue 83 atoms:  CD NZ HE2 HE3
 &rst iat=1235,1241,1239,1240, &end
#
#  chirality for residue 83 atoms:  CG CE HD2 HD3
 &rst iat=1232,1238,1236,1237, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1225,1245,1228,1229, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1249,1254,1252,1253, &end
#
#  chirality for residue 84 atoms:  CB CD HG2 HG3
 &rst iat=1251,1257,1255,1256, &end
#
#  chirality for residue 84 atoms:  CD NZ HE2 HE3
 &rst iat=1257,1263,1261,1262, &end
#
#  chirality for residue 84 atoms:  CG CE HD2 HD3
 &rst iat=1254,1260,1258,1259, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1247,1267,1250,1251, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1279,1273,1277,1278, &end
#
#  chirality for residue 85 atoms:  CB CD HG2 HG3
 &rst iat=1276,1270,1274,1275, &end
#
#  chirality for residue 85 atoms:  CG N HD2 HD3
 &rst iat=1273,1269,1271,1272, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1269,1281,1280,1276, &end
#
#  chirality for residue 86 atoms:  N C HA2 HA3
 &rst iat=1283,1288,1286,1287, &end
#
#  chirality for residue 87 atoms:  CA OG HB2 HB3
 &rst iat=1292,1297,1295,1296, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1290,1299,1293,1294, &end
#
#  chirality for residue 88 atoms:  CA CG2 OG1 HB
 &rst iat=1303,1307,1311,1306, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1301,1313,1304,1305, &end
#
#  chirality for residue 89 atoms:  CA CG1 CG2 HB
 &rst iat=1317,1321,1325,1320, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1315,1329,1318,1319, &end
#
#  chirality for residue 90 atoms:  CA CG2 CG1 HB
 &rst iat=1333,1337,1341,1336, &end
#
#  chirality for residue 90 atoms:  CB CD1 HG12 HG13
 &rst iat=1335,1344,1342,1343, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1331,1348,1334,1335, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1350,1358,1353,1354, &end
#
#  chirality for residue 92 atoms:  N C HA2 HA3
 &rst iat=1360,1365,1363,1364, &end
#
#  chirality for residue 93 atoms:  CA OG HB2 HB3
 &rst iat=1369,1374,1372,1373, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1367,1376,1370,1371, &end
#
#  chirality for residue 94 atoms:  CA CG2 CG1 HB
 &rst iat=1380,1384,1388,1383, &end
#
#  chirality for residue 94 atoms:  CB CD1 HG12 HG13
 &rst iat=1382,1391,1389,1390, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1378,1395,1381,1382, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1399,1404,1402,1403, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1397,1409,1400,1401, &end
#
#  chirality for residue 96 atoms:  CA CG HB2 HB3
 &rst iat=1413,1418,1416,1417, &end
#
#  chirality for residue 96 atoms:  CB CD HG2 HG3
 &rst iat=1415,1421,1419,1420, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1411,1426,1414,1415, &end
#
#  chirality for residue 97 atoms:  CA CG HB2 HB3
 &rst iat=1430,1435,1433,1434, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1428,1440,1431,1432, &end
#
#  chirality for residue 98 atoms:  N C HA2 HA3
 &rst iat=1442,1447,1445,1446, &end
#
#  chirality for residue 99 atoms:  CA OG HB2 HB3
 &rst iat=1451,1456,1454,1455, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1449,1458,1452,1453, &end
#
#  chirality for residue 100 atoms:  CA CG HB2 HB3
 &rst iat=1462,1467,1465,1466, &end
#
#  chirality for residue 100 atoms:  CB CD1 CD2 HG
 &rst iat=1464,1469,1473,1468, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1460,1477,1463,1464, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=1481,1486,1484,1485, &end
#
#  chirality for residue 101 atoms:  CB CD1 CD2 HG
 &rst iat=1483,1488,1492,1487, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1479,1496,1482,1483, &end
#
#  chirality for residue 102 atoms:  CA CG2 CG1 HB
 &rst iat=1500,1504,1508,1503, &end
#
#  chirality for residue 102 atoms:  CB CD1 HG12 HG13
 &rst iat=1502,1511,1509,1510, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1498,1515,1501,1502, &end
#
#  chirality for residue 103 atoms:  CA SG HB2 HB3
 &rst iat=1519,1524,1522,1523, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1517,1526,1520,1521, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1528,1536,1531,1532, &end
#
#  chirality for residue 105 atoms:  CA CG2 OG1 HB
 &rst iat=1540,1544,1548,1543, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1538,1550,1541,1542, &end
#
#  chirality for residue 106 atoms:  CA CG HB2 HB3
 &rst iat=1554,1559,1557,1558, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1552,1567,1555,1556, &end
#
#  chirality for residue 107 atoms:  CA CG1 CG2 HB
 &rst iat=1571,1575,1579,1574, &end
#
#  chirality for residue 107 atoms:  N C HA CB
 &rst iat=1569,1583,1572,1573, &end
#
#  chirality for residue 108 atoms:  N C HA2 HA3
 &rst iat=1585,1590,1588,1589, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=1592,1600,1595,1596, &end
#
#  chirality for residue 110 atoms:  CA CG HB2 HB3
 &rst iat=1604,1609,1607,1608, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=1602,1612,1605,1606, &end
#
#  chirality for residue 111 atoms:  CA CG2 OG1 HB
 &rst iat=1616,1620,1624,1619, &end
#
#  chirality for residue 111 atoms:  N C HA CB
 &rst iat=1614,1626,1617,1618, &end
#
#  chirality for residue 112 atoms:  CA CG2 OG1 HB
 &rst iat=1630,1634,1638,1633, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=1628,1640,1631,1632, &end
#
#  chirality for residue 113 atoms:  CA CG HB2 HB3
 &rst iat=1644,1649,1647,1648, &end
#
#  chirality for residue 113 atoms:  CB CD1 CD2 HG
 &rst iat=1646,1651,1655,1650, &end
#
#  chirality for residue 113 atoms:  N C HA CB
 &rst iat=1642,1659,1645,1646, &end
#
#  chirality for residue 114 atoms:  CA OG HB2 HB3
 &rst iat=1663,1668,1666,1667, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=1661,1670,1664,1665, &end
#
#  chirality for residue 115 atoms:  CA CG HB2 HB3
 &rst iat=1674,1679,1677,1678, &end
#
#  chirality for residue 115 atoms:  CB CD HG2 HG3
 &rst iat=1676,1682,1680,1681, &end
#
#  chirality for residue 115 atoms:  N C HA CB
 &rst iat=1672,1687,1675,1676, &end
#
#  chirality for residue 116 atoms:  CA CG2 CG1 HB
 &rst iat=1691,1695,1699,1694, &end
#
#  chirality for residue 116 atoms:  CB CD1 HG12 HG13
 &rst iat=1693,1702,1700,1701, &end
#
#  chirality for residue 116 atoms:  N C HA CB
 &rst iat=1689,1706,1692,1693, &end
#
#  chirality for residue 117 atoms:  CA CG1 CG2 HB
 &rst iat=1710,1714,1718,1713, &end
#
#  chirality for residue 117 atoms:  N C HA CB
 &rst iat=1708,1722,1711,1712, &end
#
#  chirality for residue 118 atoms:  CA CG HB2 HB3
 &rst iat=1726,1731,1729,1730, &end
#
#  chirality for residue 118 atoms:  CB CD HG2 HG3
 &rst iat=1728,1734,1732,1733, &end
#
#  chirality for residue 118 atoms:  CD NZ HE2 HE3
 &rst iat=1734,1740,1738,1739, &end
#
#  chirality for residue 118 atoms:  CG CE HD2 HD3
 &rst iat=1731,1737,1735,1736, &end
#
#  chirality for residue 118 atoms:  N C HA CB
 &rst iat=1724,1744,1727,1728, &end
#
#  chirality for residue 119 atoms:  CA CG HB2 HB3
 &rst iat=1748,1753,1751,1752, &end
#
#  chirality for residue 119 atoms:  CB CD1 CD2 HG
 &rst iat=1750,1755,1759,1754, &end
#
#  chirality for residue 119 atoms:  N C HA CB
 &rst iat=1746,1763,1749,1750, &end
#
#  chirality for residue 120 atoms:  CA CG1 CG2 HB
 &rst iat=1767,1771,1775,1770, &end
#
#  chirality for residue 120 atoms:  N C HA CB
 &rst iat=1765,1779,1768,1769, &end
#
#  chirality for residue 121 atoms:  CA CG HB2 HB3
 &rst iat=1783,1788,1786,1787, &end
#
#  chirality for residue 121 atoms:  CB CD HG2 HG3
 &rst iat=1785,1791,1789,1790, &end
#
#  chirality for residue 121 atoms:  N C HA CB
 &rst iat=1781,1794,1784,1785, &end
#
#  chirality for residue 122 atoms:  CA CG HB2 HB3
 &rst iat=1798,1803,1801,1802, &end
#
#  chirality for residue 122 atoms:  CB CD HG2 HG3
 &rst iat=1800,1806,1804,1805, &end
#
#  chirality for residue 122 atoms:  N C HA CB
 &rst iat=1796,1809,1799,1800, &end
#
#  chirality for residue 123 atoms:  N C HA CB
 &rst iat=1811,1819,1814,1815, &end
#
#  chirality for residue 124 atoms:  CA CG HB2 HB3
 &rst iat=1823,1828,1826,1827, &end
#
#  chirality for residue 124 atoms:  CB CD HG2 HG3
 &rst iat=1825,1831,1829,1830, &end
#
#  chirality for residue 124 atoms:  N C HA CB
 &rst iat=1821,1836,1824,1825, &end
#
#  trans-omega constraint for residue 2
 &rst iat=12,10,8,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 50., rk3=50.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=23,21,19,12, &end
#
#  trans-omega constraint for residue 4
 &rst iat=43,41,39,23, &end
#
#  trans-omega constraint for residue 5
 &rst iat=57,55,53,43, &end
#
#  trans-omega constraint for residue 6
 &rst iat=74,72,70,57, &end
#
#  trans-omega constraint for residue 7
 &rst iat=85,83,81,74, &end
#
#  trans-omega constraint for residue 8
 &rst iat=100,98,96,85, &end
#
#  trans-omega constraint for residue 9
 &rst iat=110,108,106,100, &end
#
#  trans-omega constraint for residue 10
 &rst iat=129,127,125,110, &end
#
#  trans-omega constraint for residue 11
 &rst iat=139,137,135,129, &end
#
#  trans-omega constraint for residue 12
 &rst iat=161,159,157,139, &end
#
#  trans-omega constraint for residue 13
 &rst iat=180,178,176,161, &end
#
#  trans-omega constraint for residue 14
 &rst iat=199,197,195,180, &end
#
#  trans-omega constraint for residue 15
 &rst iat=210,208,206,199, &end
#
#  trans-omega constraint for residue 16
 &rst iat=229,227,225,210, &end
#
#  trans-omega constraint for residue 17
 &rst iat=246,244,242,229, &end
#
#  trans-omega constraint for residue 18
 &rst iat=256,254,252,246, &end
#
#  trans-omega constraint for residue 19
 &rst iat=270,268,266,256, &end
#
#  trans-omega constraint for residue 20
 &rst iat=285,283,281,270, &end
#
#  trans-omega constraint for residue 21
 &rst iat=295,293,291,285, &end
#
#  trans-omega constraint for residue 22
 &rst iat=309,307,305,295, &end
#
#  trans-omega constraint for residue 23
 &rst iat=328,326,324,309, &end
#
#  trans-omega constraint for residue 24
 &rst iat=344,342,340,328, &end
#
#  trans-omega constraint for residue 25
 &rst iat=358,356,354,344, &end
#
#  trans-omega constraint for residue 26
 &rst iat=377,375,373,358, &end
#
#  trans-omega constraint for residue 27
 &rst iat=389,387,385,377, &end
#
#  trans-omega constraint for residue 28
 &rst iat=400,398,396,389, &end
#
#  trans-omega constraint for residue 29
 &rst iat=412,410,408,400, &end
#
#  trans-omega constraint for residue 30
 &rst iat=426,424,422,412, &end
#
#  trans-omega constraint for residue 31
 &rst iat=445,443,441,426, &end
#
#  trans-omega constraint for residue 32
 &rst iat=464,462,460,445, &end
#
#  trans-omega constraint for residue 33
 &rst iat=483,481,479,464, &end
#
#  trans-omega constraint for residue 34
 &rst iat=494,492,490,483, &end
#
#  trans-omega constraint for residue 35
 &rst iat=509,507,505,494, &end
#
#  trans-omega constraint for residue 36
 &rst iat=524,522,520,509, &end
#
#  trans-omega constraint for residue 37
 &rst iat=541,539,537,524, &end
#
#  trans-omega constraint for residue 38
 &rst iat=557,555,553,541, &end
#
#  trans-omega constraint for residue 39
 &rst iat=569,567,565,557, &end
#
#  trans-omega constraint for residue 40
 &rst iat=585,583,581,569, &end
#
#  trans-omega constraint for residue 41
 &rst iat=600,598,596,585, &end
#
#  trans-omega constraint for residue 42
 &rst iat=619,617,615,600, &end
#
#  trans-omega constraint for residue 43
 &rst iat=635,633,631,619, &end
#
#  trans-omega constraint for residue 44
 &rst iat=652,650,648,635, &end
#
#  trans-omega constraint for residue 45
 &rst iat=676,674,672,652, &end
#
#  trans-omega constraint for residue 46
 &rst iat=683,681,679,676, &end
#
#  trans-omega constraint for residue 47
 &rst iat=695,693,691,683, &end
#
#  trans-omega constraint for residue 48
 &rst iat=714,712,710,695, &end
#
#  trans-omega constraint for residue 49
 &rst iat=733,731,729,714, &end
#
#  trans-omega constraint for residue 50
 &rst iat=755,753,751,733, &end
#
#  trans-omega constraint for residue 51
 &rst iat=771,769,767,755, &end
#
#  trans-omega constraint for residue 52
 &rst iat=795,785,783,771, &end
#
#  trans-omega constraint for residue 53
 &rst iat=801,799,797,795, &end
#
#  trans-omega constraint for residue 54
 &rst iat=808,806,804,801, &end
#
#  trans-omega constraint for residue 55
 &rst iat=815,813,811,808, &end
#
#  trans-omega constraint for residue 56
 &rst iat=837,835,833,815, &end
#
#  trans-omega constraint for residue 57
 &rst iat=865,855,853,837, &end
#
#  trans-omega constraint for residue 58
 &rst iat=871,869,867,865, &end
#
#  trans-omega constraint for residue 59
 &rst iat=887,885,883,871, &end
#
#  trans-omega constraint for residue 60
 &rst iat=899,897,895,887, &end
#
#  trans-omega constraint for residue 61
 &rst iat=906,904,902,899, &end
#
#  trans-omega constraint for residue 62
 &rst iat=930,928,926,906, &end
#
#  trans-omega constraint for residue 63
 &rst iat=946,944,942,930, &end
#
#  trans-omega constraint for residue 64
 &rst iat=965,963,961,946, &end
#
#  trans-omega constraint for residue 65
 &rst iat=980,978,976,965, &end
#
#  trans-omega constraint for residue 66
 &rst iat=987,985,983,980, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1004,1002,1000,987, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1015,1013,1011,1004, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1032,1030,1028,1015, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1048,1046,1044,1032, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1060,1058,1056,1048, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1075,1073,1071,1060, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1086,1084,1082,1075, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1105,1103,1101,1086, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1124,1122,1120,1105, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1138,1136,1134,1124, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1145,1143,1141,1138, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1160,1158,1156,1145, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1170,1168,1166,1160, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1195,1185,1183,1170, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1201,1199,1197,1195, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1217,1215,1213,1201, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1227,1225,1223,1217, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1249,1247,1245,1227, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1279,1269,1267,1249, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1285,1283,1281,1279, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1292,1290,1288,1285, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1303,1301,1299,1292, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1317,1315,1313,1303, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1333,1331,1329,1317, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1352,1350,1348,1333, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1362,1360,1358,1352, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1369,1367,1365,1362, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1380,1378,1376,1369, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1399,1397,1395,1380, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1413,1411,1409,1399, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1430,1428,1426,1413, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1444,1442,1440,1430, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1451,1449,1447,1444, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1462,1460,1458,1451, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1481,1479,1477,1462, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1500,1498,1496,1481, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1519,1517,1515,1500, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1530,1528,1526,1519, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1540,1538,1536,1530, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1554,1552,1550,1540, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1571,1569,1567,1554, &end
#
#  trans-omega constraint for residue 108
 &rst iat=1587,1585,1583,1571, &end
#
#  trans-omega constraint for residue 109
 &rst iat=1594,1592,1590,1587, &end
#
#  trans-omega constraint for residue 110
 &rst iat=1604,1602,1600,1594, &end
#
#  trans-omega constraint for residue 111
 &rst iat=1616,1614,1612,1604, &end
#
#  trans-omega constraint for residue 112
 &rst iat=1630,1628,1626,1616, &end
#
#  trans-omega constraint for residue 113
 &rst iat=1644,1642,1640,1630, &end
#
#  trans-omega constraint for residue 114
 &rst iat=1663,1661,1659,1644, &end
#
#  trans-omega constraint for residue 115
 &rst iat=1674,1672,1670,1663, &end
#
#  trans-omega constraint for residue 116
 &rst iat=1691,1689,1687,1674, &end
#
#  trans-omega constraint for residue 117
 &rst iat=1710,1708,1706,1691, &end
#
#  trans-omega constraint for residue 118
 &rst iat=1726,1724,1722,1710, &end
#
#  trans-omega constraint for residue 119
 &rst iat=1748,1746,1744,1726, &end
#
#  trans-omega constraint for residue 120
 &rst iat=1767,1765,1763,1748, &end
#
#  trans-omega constraint for residue 121
 &rst iat=1783,1781,1779,1767, &end
#
#  trans-omega constraint for residue 122
 &rst iat=1798,1796,1794,1783, &end
#
#  trans-omega constraint for residue 123
 &rst iat=1813,1811,1809,1798, &end
#
#  trans-omega constraint for residue 124
 &rst iat=1823,1821,1819,1813, &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    SER   1           H        SER   1  17.596  -6.356  13.529
    2    HA   SER   1           HA       SER   1  15.445  -5.020  15.079
    3    HB2  SER   1           HB2      SER   1  17.128  -4.342  16.654
    4    HB3  SER   1           HB3      SER   1  17.279  -6.072  16.317
    5    HG   SER   1           HG       SER   1  19.068  -5.694  15.090
    6    H    GLU   2           H        GLU   2  17.805  -4.083  12.638
    7    HA   GLU   2           HA       GLU   2  17.157  -1.202  12.890
    8    HB2  GLU   2           HB2      GLU   2  18.758  -2.783  10.836
    9    HB3  GLU   2           HB3      GLU   2  18.518  -1.030  10.801
   10    HG2  GLU   2           HG2      GLU   2  19.623  -0.803  12.992
   11    HG3  GLU   2           HG3      GLU   2  19.837  -2.552  13.086
   12    H    ALA   3           H        ALA   3  16.288  -3.962  10.862
   13    HA   ALA   3           HA       ALA   3  14.622  -2.605   8.976
   14    HB1  ALA   3           HB1      ALA   3  14.291  -5.451  10.006
   15    HB2  ALA   3           HB2      ALA   3  13.684  -4.788   8.482
   16    HB3  ALA   3           HB3      ALA   3  15.432  -4.956   8.729
   17    H    LEU   4           H        LEU   4  13.723  -4.169  12.077
   18    HA   LEU   4           HA       LEU   4  11.095  -3.619  12.317
   19    HB2  LEU   4           HB2      LEU   4  12.512  -4.831  13.918
   20    HB3  LEU   4           HB3      LEU   4  13.258  -3.327  14.437
   21    HG   LEU   4           HG       LEU   4  11.165  -2.573  15.456
   22   HD11  LEU   4          HD11      LEU   4  10.125  -5.270  14.511
   23   HD12  LEU   4          HD12      LEU   4   9.284  -4.192  15.657
   24   HD13  LEU   4          HD13      LEU   4   9.566  -3.661  13.994
   25   HD21  LEU   4          HD21      LEU   4  12.725  -3.938  16.794
   26   HD22  LEU   4          HD22      LEU   4  11.041  -4.268  17.242
   27   HD23  LEU   4          HD23      LEU   4  11.928  -5.424  16.223
   28    H    ALA   5           H        ALA   5  13.526  -1.059  12.491
   29    HA   ALA   5           HA       ALA   5  11.516   0.992  13.280
   30    HB1  ALA   5           HB1      ALA   5  14.517   1.171  12.706
   31    HB2  ALA   5           HB2      ALA   5  13.471   2.527  13.170
   32    HB3  ALA   5           HB3      ALA   5  13.747   1.192  14.310
   33    H    LYS   6           H        LYS   6  13.555  -0.003  10.478
   34    HA   LYS   6           HA       LYS   6  12.825   2.131   8.767
   35    HB2  LYS   6           HB2      LYS   6  14.792   0.666   8.533
   36    HB3  LYS   6           HB3      LYS   6  13.749  -0.705   8.148
   37    HG2  LYS   6           HG2      LYS   6  13.106   0.205   6.067
   38    HG3  LYS   6           HG3      LYS   6  13.650   1.838   6.496
   39    HD2  LYS   6           HD2      LYS   6  15.134   0.763   4.866
   40    HD3  LYS   6           HD3      LYS   6  15.971   1.162   6.378
   41    HE2  LYS   6           HE2      LYS   6  15.932  -1.135   7.108
   42    HE3  LYS   6           HE3      LYS   6  14.890  -1.611   5.749
   43    HZ1  LYS   6           HZ1      LYS   6  16.638  -1.110   4.238
   44    HZ2  LYS   6           HZ2      LYS   6  17.611  -0.496   5.417
   45    HZ3  LYS   6           HZ3      LYS   6  17.243  -2.124   5.403
   46    H    LEU   7           H        LEU   7  11.214  -0.976   9.309
   47    HA   LEU   7           HA       LEU   7   9.405  -1.188   7.251
   48    HB2  LEU   7           HB2      LEU   7   9.418  -1.899  10.154
   49    HB3  LEU   7           HB3      LEU   7   7.814  -1.654   9.535
   50    HG   LEU   7           HG       LEU   7   8.463  -3.995   9.492
   51   HD11  LEU   7          HD11      LEU   7   7.717  -4.515   7.221
   52   HD12  LEU   7          HD12      LEU   7   6.784  -3.185   7.923
   53   HD13  LEU   7          HD13      LEU   7   8.039  -2.846   6.709
   54   HD21  LEU   7          HD21      LEU   7  10.019  -4.866   7.783
   55   HD22  LEU   7          HD22      LEU   7  10.535  -3.210   7.407
   56   HD23  LEU   7          HD23      LEU   7  10.830  -3.904   9.018
   57    H    ILE   8           H        ILE   8   8.929   0.965  10.070
   58    HA   ILE   8           HA       ILE   8   6.440   2.038   9.026
   59    HB   ILE   8           HB       ILE   8   8.187   2.796  11.375
   60   HG12  ILE   8          HG12      ILE   8   7.206   0.613  11.639
   61   HG13  ILE   8          HG13      ILE   8   6.391   1.743  12.709
   62   HG21  ILE   8          HG21      ILE   8   5.456   3.884  10.569
   63   HG22  ILE   8          HG22      ILE   8   6.158   4.032  12.186
   64   HG23  ILE   8          HG23      ILE   8   6.960   4.798  10.813
   65   HD11  ILE   8          HD11      ILE   8   4.513   1.862  10.957
   66   HD12  ILE   8          HD12      ILE   8   5.342   0.533  10.121
   67   HD13  ILE   8          HD13      ILE   8   4.738   0.291  11.766
   68    H    SER   9           H        SER   9   9.793   3.000   8.655
   69    HA   SER   9           HA       SER   9   9.260   5.771   7.949
   70    HB2  SER   9           HB2      SER   9  11.662   3.961   7.477
   71    HB3  SER   9           HB3      SER   9  11.601   5.674   7.039
   72    HG   SER   9           HG       SER   9  12.429   4.880   9.258
   73    H    LEU  10           H        LEU  10   9.323   2.712   6.182
   74    HA   LEU  10           HA       LEU  10   9.375   3.701   3.519
   75    HB2  LEU  10           HB2      LEU  10   8.518   1.142   4.863
   76    HB3  LEU  10           HB3      LEU  10   7.929   1.446   3.249
   77    HG   LEU  10           HG       LEU  10  10.297   1.794   2.458
   78   HD11  LEU  10          HD11      LEU  10  10.916   0.476   5.128
   79   HD12  LEU  10          HD12      LEU  10  12.077   0.775   3.810
   80   HD13  LEU  10          HD13      LEU  10  11.370   2.142   4.686
   81   HD21  LEU  10          HD21      LEU  10   9.020  -0.280   2.078
   82   HD22  LEU  10          HD22      LEU  10  10.725  -0.647   2.382
   83   HD23  LEU  10          HD23      LEU  10   9.515  -0.890   3.671
   84    H    GLN  11           H        GLN  11   6.709   4.056   5.733
   85    HA   GLN  11           HA       GLN  11   4.599   3.873   3.799
   86    HB2  GLN  11           HB2      GLN  11   4.705   5.408   6.428
   87    HB3  GLN  11           HB3      GLN  11   3.280   5.324   5.380
   88    HG2  GLN  11           HG2      GLN  11   3.336   2.844   5.597
   89    HG3  GLN  11           HG3      GLN  11   4.741   2.994   6.676
   90   HE21  GLN  11          HE22      GLN  11   1.232   3.634   6.373
   91   HE22  GLN  11          HE21      GLN  11   1.044   3.873   8.120
   92    H    ALA  12           H        ALA  12   3.953   5.091   2.176
   93    HA   ALA  12           HA       ALA  12   5.197   7.561   1.396
   94    HB1  ALA  12           HB1      ALA  12   2.668   6.178   0.410
   95    HB2  ALA  12           HB2      ALA  12   3.544   7.452  -0.431
   96    HB3  ALA  12           HB3      ALA  12   4.317   5.885  -0.176
   97    H    THR  13           H        THR  13   4.035   9.656   1.039
   98    HA   THR  13           HA       THR  13   2.694  10.373   3.588
   99    HB   THR  13           HB       THR  13   3.353  12.734   2.809
  100    HG1  THR  13           HG1      THR  13   4.011  12.666   0.802
  101   HG21  THR  13          HG21      THR  13   5.682  12.398   3.536
  102   HG22  THR  13          HG22      THR  13   4.568  11.458   4.544
  103   HG23  THR  13          HG23      THR  13   5.521  10.642   3.283
  104    H    GLU  14           H        GLU  14   1.850  10.355   0.215
  105    HA   GLU  14           HA       GLU  14  -0.765  11.598   0.944
  106    HB2  GLU  14           HB2      GLU  14  -0.827  12.921  -1.078
  107    HB3  GLU  14           HB3      GLU  14   0.580  13.322  -0.094
  108    HG2  GLU  14           HG2      GLU  14   1.990  11.917  -1.622
  109    HG3  GLU  14           HG3      GLU  14   0.554  11.589  -2.600
  110    H    ALA  15           H        ALA  15  -2.573  11.215  -0.539
  111    HA   ALA  15           HA       ALA  15  -2.428   8.718  -2.120
  112    HB1  ALA  15           HB1      ALA  15  -4.328   9.184   0.224
  113    HB2  ALA  15           HB2      ALA  15  -4.365   7.794  -0.880
  114    HB3  ALA  15           HB3      ALA  15  -2.974   8.032   0.200
  115    H    THR  16           H        THR  16  -4.025   8.578  -3.702
  116    HA   THR  16           HA       THR  16  -5.562  11.076  -4.299
  117    HB   THR  16           HB       THR  16  -5.307   8.625  -6.054
  118    HG1  THR  16           HG1      THR  16  -3.881   9.972  -7.201
  119   HG21  THR  16          HG21      THR  16  -5.977  10.200  -7.853
  120   HG22  THR  16          HG22      THR  16  -7.241  10.091  -6.633
  121   HG23  THR  16          HG23      THR  16  -6.160  11.500  -6.653
  122    H    ILE  17           H        ILE  17  -7.557  11.278  -3.434
  123    HA   ILE  17           HA       ILE  17  -9.382   8.957  -3.100
  124    HB   ILE  17           HB       ILE  17  -9.742  11.926  -2.480
  125   HG12  ILE  17          HG12      ILE  17  -9.156   9.537  -0.699
  126   HG13  ILE  17          HG13      ILE  17  -8.099  10.911  -0.991
  127   HG21  ILE  17          HG21      ILE  17 -11.913  10.837  -3.011
  128   HG22  ILE  17          HG22      ILE  17 -11.569   9.566  -1.809
  129   HG23  ILE  17          HG23      ILE  17 -11.820  11.261  -1.329
  130   HD11  ILE  17          HD11      ILE  17 -10.706  10.936   0.575
  131   HD12  ILE  17          HD12      ILE  17  -9.075  11.113   1.203
  132   HD13  ILE  17          HD13      ILE  17  -9.755  12.390   0.169
  133    H    VAL  18           H        VAL  18 -11.010   8.563  -4.533
  134    HA   VAL  18           HA       VAL  18 -11.588  10.671  -6.589
  135    HB   VAL  18           HB       VAL  18 -11.595   7.728  -7.196
  136   HG11  VAL  18          HG11      VAL  18 -13.228   8.979  -8.567
  137   HG12  VAL  18          HG12      VAL  18 -11.952  10.137  -9.014
  138   HG13  VAL  18          HG13      VAL  18 -11.845   8.443  -9.526
  139   HG21  VAL  18          HG21      VAL  18  -9.329   8.355  -6.940
  140   HG22  VAL  18          HG22      VAL  18  -9.648   8.406  -8.680
  141   HG23  VAL  18          HG23      VAL  18  -9.579   9.911  -7.734
  142    H    THR  19           H        THR  19 -13.461  11.380  -6.845
  143    HA   THR  19           HA       THR  19 -15.766  10.290  -5.282
  144    HB   THR  19           HB       THR  19 -14.931  13.172  -5.830
  145    HG1  THR  19           HG1      THR  19 -14.446  13.239  -3.686
  146   HG21  THR  19          HG21      THR  19 -16.694  13.706  -4.119
  147   HG22  THR  19          HG22      THR  19 -17.357  13.069  -5.624
  148   HG23  THR  19          HG23      THR  19 -17.233  12.017  -4.194
  149    H    LEU  20           H        LEU  20 -17.649   9.978  -6.384
  150    HA   LEU  20           HA       LEU  20 -17.931  11.035  -9.129
  151    HB2  LEU  20           HB2      LEU  20 -19.603   8.896  -7.750
  152    HB3  LEU  20           HB3      LEU  20 -19.564   9.344  -9.449
  153    HG   LEU  20           HG       LEU  20 -16.939   8.700  -9.174
  154   HD11  LEU  20          HD11      LEU  20 -16.696   6.687  -7.776
  155   HD12  LEU  20          HD12      LEU  20 -17.111   8.046  -6.742
  156   HD13  LEU  20          HD13      LEU  20 -18.356   6.864  -7.175
  157   HD21  LEU  20          HD21      LEU  20 -18.470   7.724 -10.770
  158   HD22  LEU  20          HD22      LEU  20 -17.517   6.450  -9.981
  159   HD23  LEU  20          HD23      LEU  20 -19.207   6.730  -9.480
  160    H    ASP  21           H        ASP  21 -19.759  12.275  -9.730
  161    HA   ASP  21           HA       ASP  21 -21.329  13.451  -7.485
  162    HB2  ASP  21           HB2      ASP  21 -18.930  14.531  -8.581
  163    HB3  ASP  21           HB3      ASP  21 -20.196  15.441  -9.356
  164    H    SER  22           H        SER  22 -21.799  12.091 -10.299
  165    HA   SER  22           HA       SER  22 -24.259  13.673 -10.919
  166    HB2  SER  22           HB2      SER  22 -22.182  12.873 -12.967
  167    HB3  SER  22           HB3      SER  22 -23.869  13.156 -13.407
  168    HG   SER  22           HG       SER  22 -22.474  15.051 -13.544
  169    H    ASP  23           H        ASP  23 -22.502  10.873 -12.039
  170    HA   ASP  23           HA       ASP  23 -24.159   8.924 -10.756
  171    HB2  ASP  23           HB2      ASP  23 -25.164   9.626 -13.204
  172    HB3  ASP  23           HB3      ASP  23 -23.962   8.457 -13.724
  173    H    ASN  24           H        ASN  24 -23.117   6.677 -11.943
  174    HA   ASN  24           HA       ASN  24 -20.306   6.561 -11.481
  175    HB2  ASN  24           HB2      ASN  24 -21.691   4.601 -11.436
  176    HB3  ASN  24           HB3      ASN  24 -22.235   4.848 -13.092
  177   HD21  ASN  24          HD22      ASN  24 -19.413   3.792 -11.210
  178   HD22  ASN  24          HD21      ASN  24 -19.011   2.785 -12.609
  179    H    ILE  25           H        ILE  25 -21.927   8.009 -14.092
  180    HA   ILE  25           HA       ILE  25 -19.982   7.826 -16.193
  181    HB   ILE  25           HB       ILE  25 -21.286   9.537 -17.274
  182   HG12  ILE  25          HG12      ILE  25 -22.510  10.071 -14.537
  183   HG13  ILE  25          HG13      ILE  25 -21.600  11.177 -15.555
  184   HG21  ILE  25          HG21      ILE  25 -22.167   7.196 -17.095
  185   HG22  ILE  25          HG22      ILE  25 -23.210   7.723 -15.761
  186   HG23  ILE  25          HG23      ILE  25 -23.414   8.419 -17.377
  187   HD11  ILE  25          HD11      ILE  25 -23.458  11.121 -17.231
  188   HD12  ILE  25          HD12      ILE  25 -24.407  10.148 -16.078
  189   HD13  ILE  25          HD13      ILE  25 -23.909  11.787 -15.646
  190    H    LEU  26           H        LEU  26 -20.003   9.824 -13.278
  191    HA   LEU  26           HA       LEU  26 -17.917  11.604 -14.491
  192    HB2  LEU  26           HB2      LEU  26 -19.962  12.770 -14.056
  193    HB3  LEU  26           HB3      LEU  26 -19.992  12.218 -12.385
  194    HG   LEU  26           HG       LEU  26 -17.435  13.582 -13.095
  195   HD11  LEU  26          HD11      LEU  26 -20.021  15.181 -13.132
  196   HD12  LEU  26          HD12      LEU  26 -18.371  15.838 -13.167
  197   HD13  LEU  26          HD13      LEU  26 -18.964  14.879 -14.534
  198   HD21  LEU  26          HD21      LEU  26 -18.062  13.039 -10.801
  199   HD22  LEU  26          HD22      LEU  26 -17.883  14.786 -11.033
  200   HD23  LEU  26          HD23      LEU  26 -19.510  14.072 -10.989
  201    H    LEU  27           H        LEU  27 -16.094  11.602 -13.652
  202    HA   LEU  27           HA       LEU  27 -15.533  10.616 -10.879
  203    HB2  LEU  27           HB2      LEU  27 -13.915   9.694 -13.290
  204    HB3  LEU  27           HB3      LEU  27 -13.443   9.524 -11.611
  205    HG   LEU  27           HG       LEU  27 -15.751   8.253 -11.342
  206   HD11  LEU  27          HD11      LEU  27 -16.286   6.879 -13.335
  207   HD12  LEU  27          HD12      LEU  27 -16.593   8.575 -13.667
  208   HD13  LEU  27          HD13      LEU  27 -15.126   7.811 -14.306
  209   HD21  LEU  27          HD21      LEU  27 -13.329   7.037 -12.731
  210   HD22  LEU  27          HD22      LEU  27 -13.539   7.259 -10.978
  211   HD23  LEU  27          HD23      LEU  27 -14.586   6.138 -11.852
  212    H    SER  28           H        SER  28 -14.372  11.919  -9.707
  213    HA   SER  28           HA       SER  28 -12.588  13.977 -10.912
  214    HB2  SER  28           HB2      SER  28 -14.966  14.784 -10.227
  215    HB3  SER  28           HB3      SER  28 -14.441  14.490  -8.560
  216    HG   SER  28           HG       SER  28 -13.559  16.324 -10.483
  217    H    GLU  29           H        GLU  29 -10.703  14.334  -9.697
  218    HA   GLU  29           HA       GLU  29 -10.255  12.370  -7.491
  219    HB2  GLU  29           HB2      GLU  29  -8.167  13.477  -9.366
  220    HB3  GLU  29           HB3      GLU  29  -8.071  12.078  -8.278
  221    HG2  GLU  29           HG2      GLU  29  -9.754  10.890  -9.666
  222    HG3  GLU  29           HG3      GLU  29  -9.829  12.260 -10.764
  223    H    GLU  30           H        GLU  30  -9.027  12.926  -5.655
  224    HA   GLU  30           HA       GLU  30  -7.895  15.687  -5.423
  225    HB2  GLU  30           HB2      GLU  30  -9.111  14.328  -3.002
  226    HB3  GLU  30           HB3      GLU  30  -8.575  15.986  -3.211
  227    HG2  GLU  30           HG2      GLU  30 -10.568  16.131  -4.920
  228    HG3  GLU  30           HG3      GLU  30 -11.108  14.640  -4.107
  229    H    GLN  31           H        GLN  31  -5.702  15.573  -4.907
  230    HA   GLN  31           HA       GLN  31  -4.667  13.091  -3.624
  231    HB2  GLN  31           HB2      GLN  31  -3.218  15.537  -4.694
  232    HB3  GLN  31           HB3      GLN  31  -2.439  14.196  -3.838
  233    HG2  GLN  31           HG2      GLN  31  -3.331  12.613  -5.540
  234    HG3  GLN  31           HG3      GLN  31  -3.832  14.010  -6.532
  235   HE21  GLN  31          HE22      GLN  31  -1.344  11.952  -5.492
  236   HE22  GLN  31          HE21      GLN  31  -0.250  13.192  -5.208
  237    H    VAL  32           H        VAL  32  -4.405  12.945  -1.474
  238    HA   VAL  32           HA       VAL  32  -4.542  15.405   0.208
  239    HB   VAL  32           HB       VAL  32  -6.023  14.359   1.747
  240   HG11  VAL  32          HG11      VAL  32  -7.227  13.954  -1.017
  241   HG12  VAL  32          HG12      VAL  32  -8.082  14.277   0.501
  242   HG13  VAL  32          HG13      VAL  32  -7.045  15.529  -0.203
  243   HG21  VAL  32          HG21      VAL  32  -5.353  11.985   1.539
  244   HG22  VAL  32          HG22      VAL  32  -7.093  12.195   1.398
  245   HG23  VAL  32          HG23      VAL  32  -6.120  11.911  -0.062
  246    H    ASP  33           H        ASP  33  -3.777  15.123   2.390
  247    HA   ASP  33           HA       ASP  33  -1.324  13.525   2.567
  248    HB2  ASP  33           HB2      ASP  33  -2.778  15.488   4.324
  249    HB3  ASP  33           HB3      ASP  33  -1.719  14.333   5.116
  250    H    VAL  34           H        VAL  34  -0.904  11.740   3.761
  251    HA   VAL  34           HA       VAL  34  -2.747   9.701   3.851
  252    HB   VAL  34           HB       VAL  34  -0.335   9.412   3.828
  253   HG11  VAL  34          HG11      VAL  34  -0.364   9.964   6.827
  254   HG12  VAL  34          HG12      VAL  34   1.018   9.406   5.863
  255   HG13  VAL  34          HG13      VAL  34   0.351  11.016   5.580
  256   HG21  VAL  34          HG21      VAL  34  -0.169   7.369   5.069
  257   HG22  VAL  34          HG22      VAL  34  -1.516   7.822   6.129
  258   HG23  VAL  34          HG23      VAL  34  -1.811   7.496   4.408
  259    H    GLU  35           H        GLU  35  -2.426  12.035   6.421
  260    HA   GLU  35           HA       GLU  35  -3.911  10.515   8.421
  261    HB2  GLU  35           HB2      GLU  35  -2.997  13.320   8.175
  262    HB3  GLU  35           HB3      GLU  35  -4.086  12.847   9.476
  263    HG2  GLU  35           HG2      GLU  35  -2.456  11.066  10.151
  264    HG3  GLU  35           HG3      GLU  35  -1.334  11.654   8.918
  265    H    LEU  36           H        LEU  36  -4.945  12.172   5.567
  266    HA   LEU  36           HA       LEU  36  -7.579  12.910   6.721
  267    HB2  LEU  36           HB2      LEU  36  -6.332  13.696   4.076
  268    HB3  LEU  36           HB3      LEU  36  -7.701  14.447   4.885
  269    HG   LEU  36           HG       LEU  36  -4.781  14.529   5.789
  270   HD11  LEU  36          HD11      LEU  36  -4.902  16.888   5.250
  271   HD12  LEU  36          HD12      LEU  36  -5.352  15.920   3.835
  272   HD13  LEU  36          HD13      LEU  36  -6.612  16.734   4.787
  273   HD21  LEU  36          HD21      LEU  36  -6.275  14.573   7.776
  274   HD22  LEU  36          HD22      LEU  36  -5.482  16.129   7.502
  275   HD23  LEU  36          HD23      LEU  36  -7.184  15.912   7.041
  276    H    VAL  37           H        VAL  37  -6.254  10.469   4.758
  277    HA   VAL  37           HA       VAL  37  -8.783   9.821   3.358
  278    HB   VAL  37           HB       VAL  37  -6.776   9.486   2.106
  279   HG11  VAL  37          HG11      VAL  37  -5.063   7.809   2.683
  280   HG12  VAL  37          HG12      VAL  37  -5.097   9.140   3.836
  281   HG13  VAL  37          HG13      VAL  37  -5.817   7.574   4.273
  282   HG21  VAL  37          HG21      VAL  37  -8.604   7.880   1.742
  283   HG22  VAL  37          HG22      VAL  37  -7.008   7.178   1.415
  284   HG23  VAL  37          HG23      VAL  37  -7.862   6.758   2.907
  285    H    GLN  38           H        GLN  38 -10.120   8.085   3.864
  286    HA   GLN  38           HA       GLN  38  -9.724   6.881   6.590
  287    HB2  GLN  38           HB2      GLN  38 -12.283   7.712   5.171
  288    HB3  GLN  38           HB3      GLN  38 -12.229   6.698   6.615
  289    HG2  GLN  38           HG2      GLN  38 -10.965   8.558   7.782
  290    HG3  GLN  38           HG3      GLN  38 -11.322   9.577   6.384
  291   HE21  GLN  38          HE22      GLN  38 -13.850   9.622   5.901
  292   HE22  GLN  38          HE21      GLN  38 -14.840   9.401   7.336
  293    H    ARG  39           H        ARG  39 -10.646   4.858   6.986
  294    HA   ARG  39           HA       ARG  39 -10.148   2.921   4.866
  295    HB2  ARG  39           HB2      ARG  39 -10.381   1.220   6.517
  296    HB3  ARG  39           HB3      ARG  39  -9.379   2.535   7.131
  297    HG2  ARG  39           HG2      ARG  39 -11.461   3.392   8.331
  298    HG3  ARG  39           HG3      ARG  39 -12.279   1.903   7.851
  299    HD2  ARG  39           HD2      ARG  39 -10.503   0.581   8.996
  300    HD3  ARG  39           HD3      ARG  39  -9.724   2.122   9.443
  301    HE   ARG  39           HE       ARG  39 -12.497   2.002  10.316
  302   HH11  ARG  39          HH11      ARG  39  -9.321   0.723  11.419
  303   HH12  ARG  39          HH12      ARG  39  -9.860   0.830  13.051
  304   HH21  ARG  39          HH21      ARG  39 -13.005   2.023  12.341
  305   HH22  ARG  39          HH22      ARG  39 -11.837   1.578  13.587
  306    H    GLY  40           H        GLY  40 -12.253   4.556   4.317
  307    HA2  GLY  40           HA2      GLY  40 -14.219   2.534   3.366
  308    HA3  GLY  40           HA3      GLY  40 -14.801   4.091   3.970
  309    H    ASP  41           H        ASP  41 -11.850   4.753   2.489
  310    HA   ASP  41           HA       ASP  41 -13.142   5.738   0.020
  311    HB2  ASP  41           HB2      ASP  41 -10.383   6.211   1.202
  312    HB3  ASP  41           HB3      ASP  41 -10.995   6.952  -0.272
  313    H    ILE  42           H        ILE  42 -11.997   5.519  -2.059
  314    HA   ILE  42           HA       ILE  42 -10.424   3.010  -2.407
  315    HB   ILE  42           HB       ILE  42 -12.518   4.066  -4.341
  316   HG12  ILE  42          HG12      ILE  42 -12.461   1.530  -2.638
  317   HG13  ILE  42          HG13      ILE  42 -13.505   2.916  -2.377
  318   HG21  ILE  42          HG21      ILE  42 -10.701   1.609  -4.534
  319   HG22  ILE  42          HG22      ILE  42 -11.943   2.091  -5.713
  320   HG23  ILE  42          HG23      ILE  42 -10.529   3.094  -5.497
  321   HD11  ILE  42          HD11      ILE  42 -14.824   1.236  -3.419
  322   HD12  ILE  42          HD12      ILE  42 -14.558   2.506  -4.628
  323   HD13  ILE  42          HD13      ILE  42 -13.645   0.980  -4.709
  324    H    ILE  43           H        ILE  43  -8.488   3.336  -3.267
  325    HA   ILE  43           HA       ILE  43  -7.801   6.060  -4.178
  326    HB   ILE  43           HB       ILE  43  -6.244   3.963  -2.627
  327   HG12  ILE  43          HG12      ILE  43  -7.986   4.798  -1.188
  328   HG13  ILE  43          HG13      ILE  43  -6.442   5.420  -0.660
  329   HG21  ILE  43          HG21      ILE  43  -4.653   5.311  -3.826
  330   HG22  ILE  43          HG22      ILE  43  -5.441   6.810  -3.299
  331   HG23  ILE  43          HG23      ILE  43  -4.608   5.764  -2.128
  332   HD11  ILE  43          HD11      ILE  43  -8.264   7.101  -0.538
  333   HD12  ILE  43          HD12      ILE  43  -6.952   7.635  -1.605
  334   HD13  ILE  43          HD13      ILE  43  -8.480   7.017  -2.277
  335    H    LYS  44           H        LYS  44  -6.783   6.432  -5.998
  336    HA   LYS  44           HA       LYS  44  -5.900   4.378  -7.832
  337    HB2  LYS  44           HB2      LYS  44  -5.040   7.301  -7.857
  338    HB3  LYS  44           HB3      LYS  44  -5.049   6.198  -9.216
  339    HG2  LYS  44           HG2      LYS  44  -7.478   7.236  -7.753
  340    HG3  LYS  44           HG3      LYS  44  -6.833   7.916  -9.239
  341    HD2  LYS  44           HD2      LYS  44  -7.968   5.145  -8.882
  342    HD3  LYS  44           HD3      LYS  44  -8.817   6.480  -9.639
  343    HE2  LYS  44           HE2      LYS  44  -6.343   5.045 -10.670
  344    HE3  LYS  44           HE3      LYS  44  -7.974   4.935 -11.317
  345    HZ1  LYS  44           HZ1      LYS  44  -6.717   6.429 -12.659
  346    HZ2  LYS  44           HZ2      LYS  44  -7.876   7.289 -11.875
  347    HZ3  LYS  44           HZ3      LYS  44  -6.308   7.406 -11.388
  348    H    VAL  45           H        VAL  45  -3.930   3.485  -8.165
  349    HA   VAL  45           HA       VAL  45  -1.548   4.988  -7.226
  350    HB   VAL  45           HB       VAL  45  -2.028   2.926  -5.911
  351   HG11  VAL  45          HG11      VAL  45  -1.144   1.447  -8.420
  352   HG12  VAL  45          HG12      VAL  45  -1.461   0.756  -6.824
  353   HG13  VAL  45          HG13      VAL  45  -2.788   1.481  -7.740
  354   HG21  VAL  45          HG21      VAL  45   0.214   3.966  -5.996
  355   HG22  VAL  45          HG22      VAL  45   0.328   2.205  -5.867
  356   HG23  VAL  45          HG23      VAL  45   0.624   2.997  -7.427
  357    H    VAL  46           H        VAL  46  -0.001   5.446  -8.611
  358    HA   VAL  46           HA       VAL  46  -0.560   4.913 -11.475
  359    HB   VAL  46           HB       VAL  46   0.559   6.987 -11.913
  360   HG11  VAL  46          HG11      VAL  46  -1.152   7.361  -9.444
  361   HG12  VAL  46          HG12      VAL  46  -0.819   8.540 -10.716
  362   HG13  VAL  46          HG13      VAL  46  -1.755   7.090 -11.093
  363   HG21  VAL  46          HG21      VAL  46   2.492   6.890 -10.487
  364   HG22  VAL  46          HG22      VAL  46   1.594   8.374 -10.173
  365   HG23  VAL  46          HG23      VAL  46   1.492   7.019  -9.035
  366    HA   PRO  47           HA       PRO  47   3.264   2.748 -12.297
  367    HB2  PRO  47           HB2      PRO  47   4.389   4.044 -14.480
  368    HB3  PRO  47           HB3      PRO  47   3.053   2.879 -14.555
  369    HG2  PRO  47           HG2      PRO  47   2.894   5.907 -14.476
  370    HG3  PRO  47           HG3      PRO  47   2.048   4.778 -15.589
  371    HD2  PRO  47           HD2      PRO  47   0.769   5.744 -13.464
  372    HD3  PRO  47           HD3      PRO  47   0.603   4.029 -13.865
  373    H    GLY  48           H        GLY  48   4.894   2.839 -10.945
  374    HA2  GLY  48           HA2      GLY  48   6.968   3.486 -10.134
  375    HA3  GLY  48           HA3      GLY  48   6.745   5.132 -10.738
  376    H    GLY  49           H        GLY  49   3.866   4.558  -9.200
  377    HA2  GLY  49           HA2      GLY  49   4.559   6.174  -6.918
  378    HA3  GLY  49           HA3      GLY  49   2.986   5.468  -7.275
  379    H    LYS  50           H        LYS  50   4.301   5.727  -4.697
  380    HA   LYS  50           HA       LYS  50   4.683   2.870  -3.887
  381    HB2  LYS  50           HB2      LYS  50   5.456   5.359  -2.335
  382    HB3  LYS  50           HB3      LYS  50   5.883   3.684  -1.970
  383    HG2  LYS  50           HG2      LYS  50   7.173   3.591  -4.123
  384    HG3  LYS  50           HG3      LYS  50   6.820   5.296  -4.383
  385    HD2  LYS  50           HD2      LYS  50   7.953   5.852  -2.224
  386    HD3  LYS  50           HD3      LYS  50   8.389   4.139  -2.052
  387    HE2  LYS  50           HE2      LYS  50   9.714   4.214  -4.095
  388    HE3  LYS  50           HE3      LYS  50   9.198   5.873  -4.421
  389    HZ1  LYS  50           HZ1      LYS  50  10.421   6.622  -2.508
  390    HZ2  LYS  50           HZ2      LYS  50  10.741   5.109  -1.989
  391    HZ3  LYS  50           HZ3      LYS  50  11.428   5.647  -3.377
  392    H    PHE  51           H        PHE  51   3.699   2.060  -2.043
  393    HA   PHE  51           HA       PHE  51   0.976   3.059  -1.676
  394    HB2  PHE  51           HB2      PHE  51   2.369   0.537  -0.780
  395    HB3  PHE  51           HB3      PHE  51   0.717   0.932  -0.328
  396    HD1  PHE  51           HD2      PHE  51  -0.981   1.471  -2.218
  397    HD2  PHE  51           HD1      PHE  51   2.735  -0.611  -2.845
  398    HE1  PHE  51           HE2      PHE  51  -1.861   0.520  -4.325
  399    HE2  PHE  51           HE1      PHE  51   1.847  -1.585  -4.937
  400    HZ   PHE  51           HZ       PHE  51  -0.458  -1.037  -5.682
  401    HA   PRO  52           HA       PRO  52   1.922   4.830   2.421
  402    HB2  PRO  52           HB2      PRO  52  -0.413   6.176   2.847
  403    HB3  PRO  52           HB3      PRO  52   0.794   6.711   1.649
  404    HG2  PRO  52           HG2      PRO  52  -1.737   5.128   1.178
  405    HG3  PRO  52           HG3      PRO  52  -1.115   6.540   0.267
  406    HD2  PRO  52           HD2      PRO  52  -0.750   3.934  -0.544
  407    HD3  PRO  52           HD3      PRO  52   0.419   5.240  -0.900
  408    H    VAL  53           H        VAL  53  -0.530   2.502   1.732
  409    HA   VAL  53           HA       VAL  53  -0.845   1.634   4.483
  410    HB   VAL  53           HB       VAL  53  -3.296   1.535   4.420
  411   HG11  VAL  53          HG11      VAL  53  -2.281   4.394   4.254
  412   HG12  VAL  53          HG12      VAL  53  -3.742   3.810   5.075
  413   HG13  VAL  53          HG13      VAL  53  -2.146   3.326   5.670
  414   HG21  VAL  53          HG21      VAL  53  -4.598   2.934   2.916
  415   HG22  VAL  53          HG22      VAL  53  -3.127   3.450   2.063
  416   HG23  VAL  53          HG23      VAL  53  -3.663   1.756   1.984
  417    H    ASP  54           H        ASP  54  -2.351  -0.413   4.402
  418    HA   ASP  54           HA       ASP  54  -1.594  -2.090   2.045
  419    HB2  ASP  54           HB2      ASP  54  -2.170  -3.976   3.387
  420    HB3  ASP  54           HB3      ASP  54  -1.101  -2.949   4.332
  421    H    GLY  55           H        GLY  55  -3.361  -3.517   1.173
  422    HA2  GLY  55           HA2      GLY  55  -6.072  -3.159   1.802
  423    HA3  GLY  55           HA3      GLY  55  -5.755  -1.994   0.528
  424    H    ARG  56           H        ARG  56  -7.584  -3.426  -0.202
  425    HA   ARG  56           HA       ARG  56  -6.642  -5.802  -1.748
  426    HB2  ARG  56           HB2      ARG  56  -8.530  -5.960  -0.045
  427    HB3  ARG  56           HB3      ARG  56  -9.509  -5.015  -1.164
  428    HG2  ARG  56           HG2      ARG  56  -9.212  -6.806  -2.894
  429    HG3  ARG  56           HG3      ARG  56  -8.194  -7.700  -1.753
  430    HD2  ARG  56           HD2      ARG  56 -10.307  -8.711  -1.533
  431    HD3  ARG  56           HD3      ARG  56 -10.150  -7.683  -0.127
  432    HE   ARG  56           HE       ARG  56 -11.885  -6.320  -0.889
  433   HH11  ARG  56          HH11      ARG  56 -11.154  -8.673  -3.424
  434   HH12  ARG  56          HH12      ARG  56 -12.493  -8.160  -4.403
  435   HH21  ARG  56          HH21      ARG  56 -13.612  -5.766  -2.212
  436   HH22  ARG  56          HH22      ARG  56 -13.892  -6.646  -3.686
  437    H    VAL  57           H        VAL  57  -6.993  -6.000  -3.902
  438    HA   VAL  57           HA       VAL  57  -7.073  -3.452  -5.433
  439    HB   VAL  57           HB       VAL  57  -5.948  -6.185  -6.138
  440   HG11  VAL  57          HG11      VAL  57  -5.743  -3.520  -7.592
  441   HG12  VAL  57          HG12      VAL  57  -4.784  -4.972  -7.980
  442   HG13  VAL  57          HG13      VAL  57  -6.526  -5.000  -8.183
  443   HG21  VAL  57          HG21      VAL  57  -4.409  -3.667  -5.406
  444   HG22  VAL  57          HG22      VAL  57  -4.623  -5.073  -4.336
  445   HG23  VAL  57          HG23      VAL  57  -3.732  -5.244  -5.848
  446    H    ILE  58           H        ILE  58  -8.669  -3.086  -6.889
  447    HA   ILE  58           HA       ILE  58 -10.328  -5.370  -7.929
  448    HB   ILE  58           HB       ILE  58 -12.345  -3.804  -7.433
  449   HG12  ILE  58          HG12      ILE  58 -10.431  -2.715  -5.330
  450   HG13  ILE  58          HG13      ILE  58 -10.754  -1.852  -6.848
  451   HG21  ILE  58          HG21      ILE  58 -10.942  -5.085  -5.058
  452   HG22  ILE  58          HG22      ILE  58 -12.673  -4.756  -5.246
  453   HG23  ILE  58          HG23      ILE  58 -11.894  -5.957  -6.282
  454   HD11  ILE  58          HD11      ILE  58 -12.126  -0.904  -5.124
  455   HD12  ILE  58          HD12      ILE  58 -13.170  -1.752  -6.282
  456   HD13  ILE  58          HD13      ILE  58 -12.799  -2.485  -4.696
  457    H    GLU  59           H        GLU  59  -8.302  -3.627  -9.198
  458    HA   GLU  59           HA       GLU  59  -9.511  -3.621 -11.795
  459    HB2  GLU  59           HB2      GLU  59 -10.235  -1.288 -10.846
  460    HB3  GLU  59           HB3      GLU  59  -8.511  -0.947 -10.789
  461    HG2  GLU  59           HG2      GLU  59  -9.085   0.084 -12.718
  462    HG3  GLU  59           HG3      GLU  59  -8.477  -1.441 -13.331
  463    H    GLY  60           H        GLY  60  -7.703  -4.002 -13.239
  464    HA2  GLY  60           HA2      GLY  60  -5.639  -3.328 -14.149
  465    HA3  GLY  60           HA3      GLY  60  -5.165  -2.612 -12.624
  466    H    HIS  61           H        HIS  61  -3.290  -3.729 -13.678
  467    HA   HIS  61           HA       HIS  61  -2.811  -6.419 -12.471
  468    HB2  HIS  61           HB2      HIS  61  -2.240  -7.381 -14.689
  469    HB3  HIS  61           HB3      HIS  61  -3.919  -6.908 -14.534
  470    HD1  HIS  61           HD1      HIS  61  -4.824  -5.072 -16.227
  471    HD2  HIS  61           HD2      HIS  61  -0.670  -5.797 -16.348
  472    HE1  HIS  61           HE1      HIS  61  -3.934  -3.870 -18.298
  473    H    SER  62           H        SER  62  -1.411  -4.148 -11.626
  474    HA   SER  62           HA       SER  62   1.143  -4.017 -13.023
  475    HB2  SER  62           HB2      SER  62  -0.055  -2.646 -10.685
  476    HB3  SER  62           HB3      SER  62   1.701  -2.812 -10.660
  477    HG   SER  62           HG       SER  62   1.791  -1.833 -12.621
  478    H    MET  63           H        MET  63   3.232  -4.398 -12.126
  479    HA   MET  63           HA       MET  63   3.332  -6.774 -10.336
  480    HB2  MET  63           HB2      MET  63   4.407  -7.084 -12.487
  481    HB3  MET  63           HB3      MET  63   5.422  -5.655 -12.219
  482    HG2  MET  63           HG2      MET  63   6.525  -6.666 -10.358
  483    HG3  MET  63           HG3      MET  63   5.349  -7.975 -10.248
  484    HE1  MET  63           HE1      MET  63   6.230 -10.469 -12.936
  485    HE2  MET  63           HE2      MET  63   5.475 -10.182 -11.352
  486    HE3  MET  63           HE3      MET  63   4.880  -9.320 -12.787
  487    H    VAL  64           H        VAL  64   3.948  -6.462  -8.333
  488    HA   VAL  64           HA       VAL  64   4.828  -3.743  -7.502
  489    HB   VAL  64           HB       VAL  64   3.172  -5.797  -6.016
  490   HG11  VAL  64          HG11      VAL  64   4.113  -3.004  -5.225
  491   HG12  VAL  64          HG12      VAL  64   2.825  -3.897  -4.400
  492   HG13  VAL  64          HG13      VAL  64   4.469  -4.545  -4.404
  493   HG21  VAL  64          HG21      VAL  64   1.911  -4.665  -7.825
  494   HG22  VAL  64          HG22      VAL  64   1.374  -4.093  -6.243
  495   HG23  VAL  64          HG23      VAL  64   2.451  -3.084  -7.228
  496    H    ASP  65           H        ASP  65   6.686  -3.428  -6.419
  497    HA   ASP  65           HA       ASP  65   8.369  -5.792  -5.829
  498    HB2  ASP  65           HB2      ASP  65   9.346  -4.036  -7.210
  499    HB3  ASP  65           HB3      ASP  65   9.035  -2.834  -5.945
  500    H    GLU  66           H        GLU  66   7.929  -6.643  -3.951
  501    HA   GLU  66           HA       GLU  66   7.709  -4.978  -1.490
  502    HB2  GLU  66           HB2      GLU  66   6.267  -6.820  -0.596
  503    HB3  GLU  66           HB3      GLU  66   5.580  -5.838  -1.881
  504    HG2  GLU  66           HG2      GLU  66   5.928  -7.610  -3.528
  505    HG3  GLU  66           HG3      GLU  66   6.756  -8.602  -2.328
  506    H    SER  67           H        SER  67  10.150  -6.103  -2.755
  507    HA   SER  67           HA       SER  67  10.988  -8.457  -1.523
  508    HB2  SER  67           HB2      SER  67  13.188  -7.933  -2.400
  509    HB3  SER  67           HB3      SER  67  11.934  -7.504  -3.573
  510    HG   SER  67           HG       SER  67  13.641  -5.855  -2.078
  511    H    LEU  68           H        LEU  68  11.100  -5.281  -0.003
  512    HA   LEU  68           HA       LEU  68  12.810  -6.297   2.191
  513    HB2  LEU  68           HB2      LEU  68  13.048  -4.013   1.389
  514    HB3  LEU  68           HB3      LEU  68  11.361  -3.669   1.676
  515    HG   LEU  68           HG       LEU  68  12.912  -2.614   3.247
  516   HD11  LEU  68          HD11      LEU  68  10.525  -3.105   3.866
  517   HD12  LEU  68          HD12      LEU  68  11.121  -4.499   4.799
  518   HD13  LEU  68          HD13      LEU  68  11.647  -2.863   5.213
  519   HD21  LEU  68          HD21      LEU  68  14.576  -4.411   3.497
  520   HD22  LEU  68          HD22      LEU  68  13.977  -3.813   5.054
  521   HD23  LEU  68          HD23      LEU  68  13.393  -5.372   4.422
  522    H    ILE  69           H        ILE  69   9.451  -5.350   1.615
  523    HA   ILE  69           HA       ILE  69   8.491  -5.696   4.280
  524    HB   ILE  69           HB       ILE  69   6.883  -5.876   1.702
  525   HG12  ILE  69          HG12      ILE  69   8.128  -3.713   1.892
  526   HG13  ILE  69          HG13      ILE  69   6.384  -3.565   1.857
  527   HG21  ILE  69          HG21      ILE  69   5.000  -5.086   3.256
  528   HG22  ILE  69          HG22      ILE  69   5.525  -6.759   3.472
  529   HG23  ILE  69          HG23      ILE  69   6.056  -5.511   4.611
  530   HD11  ILE  69          HD11      ILE  69   6.312  -3.175   4.281
  531   HD12  ILE  69          HD12      ILE  69   8.082  -3.379   4.376
  532   HD13  ILE  69          HD13      ILE  69   7.375  -2.019   3.477
  533    H    THR  70           H        THR  70   7.879  -7.933   1.500
  534    HA   THR  70           HA       THR  70   7.296 -10.111   3.451
  535    HB   THR  70           HB       THR  70   6.242 -11.244   1.558
  536    HG1  THR  70           HG1      THR  70   5.979  -9.786  -0.346
  537   HG21  THR  70          HG21      THR  70   4.346  -9.795   1.302
  538   HG22  THR  70          HG22      THR  70   4.974  -9.522   2.932
  539   HG23  THR  70          HG23      THR  70   5.302  -8.344   1.634
  540    H    GLY  71           H        GLY  71   9.827  -9.096   1.410
  541    HA2  GLY  71           HA2      GLY  71  11.993 -10.059   1.432
  542    HA3  GLY  71           HA3      GLY  71  11.332 -11.581   1.986
  543    H    GLU  72           H        GLU  72   9.352 -10.754  -0.550
  544    HA   GLU  72           HA       GLU  72  10.359 -12.781  -2.315
  545    HB2  GLU  72           HB2      GLU  72   8.377 -10.512  -2.771
  546    HB3  GLU  72           HB3      GLU  72   8.668 -11.826  -3.907
  547    HG2  GLU  72           HG2      GLU  72   7.602 -12.204  -1.077
  548    HG3  GLU  72           HG3      GLU  72   6.612 -12.071  -2.531
  549    H    ALA  73           H        ALA  73  12.410 -12.506  -3.221
  550    HA   ALA  73           HA       ALA  73  13.390  -9.902  -4.040
  551    HB1  ALA  73           HB1      ALA  73  15.323 -11.207  -4.838
  552    HB2  ALA  73           HB2      ALA  73  14.853 -11.714  -3.206
  553    HB3  ALA  73           HB3      ALA  73  14.417 -12.721  -4.607
  554    H    MET  74           H        MET  74  11.352 -12.195  -5.462
  555    HA   MET  74           HA       MET  74  11.680 -11.272  -8.274
  556    HB2  MET  74           HB2      MET  74  10.810 -13.818  -6.914
  557    HB3  MET  74           HB3      MET  74  10.091 -13.383  -8.445
  558    HG2  MET  74           HG2      MET  74  11.993 -14.832  -8.813
  559    HG3  MET  74           HG3      MET  74  12.281 -13.247  -9.518
  560    HE1  MET  74           HE1      MET  74  14.794 -13.896  -9.895
  561    HE2  MET  74           HE2      MET  74  15.870 -14.512  -8.620
  562    HE3  MET  74           HE3      MET  74  14.485 -15.487  -9.160
  563    HA   PRO  75           HA       PRO  75   8.353  -8.712  -6.644
  564    HB2  PRO  75           HB2      PRO  75   8.301  -7.836  -9.536
  565    HB3  PRO  75           HB3      PRO  75   8.130  -6.827  -8.064
  566    HG2  PRO  75           HG2      PRO  75  10.512  -6.953  -9.294
  567    HG3  PRO  75           HG3      PRO  75  10.460  -7.177  -7.512
  568    HD2  PRO  75           HD2      PRO  75  10.587  -9.310  -9.672
  569    HD3  PRO  75           HD3      PRO  75  11.557  -9.146  -8.179
  570    H    VAL  76           H        VAL  76   6.113  -8.528  -6.663
  571    HA   VAL  76           HA       VAL  76   4.865 -11.033  -7.614
  572    HB   VAL  76           HB       VAL  76   4.009  -9.016  -5.499
  573   HG11  VAL  76          HG11      VAL  76   2.886 -11.749  -6.226
  574   HG12  VAL  76          HG12      VAL  76   2.469 -10.845  -4.757
  575   HG13  VAL  76          HG13      VAL  76   2.036 -10.196  -6.344
  576   HG21  VAL  76          HG21      VAL  76   6.054 -10.250  -4.843
  577   HG22  VAL  76          HG22      VAL  76   4.668 -10.799  -3.901
  578   HG23  VAL  76          HG23      VAL  76   5.265 -11.789  -5.247
  579    H    ALA  77           H        ALA  77   3.414 -11.136  -9.236
  580    HA   ALA  77           HA       ALA  77   2.316  -8.696 -10.414
  581    HB1  ALA  77           HB1      ALA  77   1.328 -10.190 -12.047
  582    HB2  ALA  77           HB2      ALA  77   3.024 -10.641 -11.793
  583    HB3  ALA  77           HB3      ALA  77   1.724 -11.605 -11.058
  584    H    LYS  78           H        LYS  78   0.339  -7.905 -10.279
  585    HA   LYS  78           HA       LYS  78  -1.668  -9.145  -8.434
  586    HB2  LYS  78           HB2      LYS  78  -1.356  -6.217  -9.175
  587    HB3  LYS  78           HB3      LYS  78  -2.404  -6.882  -7.928
  588    HG2  LYS  78           HG2      LYS  78   0.645  -6.903  -7.874
  589    HG3  LYS  78           HG3      LYS  78  -0.390  -5.768  -7.020
  590    HD2  LYS  78           HD2      LYS  78  -1.277  -7.502  -5.599
  591    HD3  LYS  78           HD3      LYS  78  -0.441  -8.769  -6.520
  592    HE2  LYS  78           HE2      LYS  78   1.744  -7.908  -5.868
  593    HE3  LYS  78           HE3      LYS  78   1.013  -6.511  -5.069
  594    HZ1  LYS  78           HZ1      LYS  78   0.550  -9.315  -4.210
  595    HZ2  LYS  78           HZ2      LYS  78   1.598  -8.264  -3.460
  596    HZ3  LYS  78           HZ3      LYS  78  -0.010  -7.995  -3.466
  597    H    LYS  79           H        LYS  79  -3.866  -8.444  -8.830
  598    HA   LYS  79           HA       LYS  79  -4.865  -8.040 -11.585
  599    HB2  LYS  79           HB2      LYS  79  -6.132 -10.195 -11.527
  600    HB3  LYS  79           HB3      LYS  79  -4.395 -10.445 -11.558
  601    HG2  LYS  79           HG2      LYS  79  -4.351 -11.054  -9.223
  602    HG3  LYS  79           HG3      LYS  79  -6.000 -10.471  -8.963
  603    HD2  LYS  79           HD2      LYS  79  -5.959 -12.879  -9.013
  604    HD3  LYS  79           HD3      LYS  79  -6.919 -12.230 -10.350
  605    HE2  LYS  79           HE2      LYS  79  -5.091 -12.652 -11.934
  606    HE3  LYS  79           HE3      LYS  79  -4.024 -13.163 -10.612
  607    HZ1  LYS  79           HZ1      LYS  79  -5.001 -15.079 -11.715
  608    HZ2  LYS  79           HZ2      LYS  79  -5.519 -14.993 -10.171
  609    HZ3  LYS  79           HZ3      LYS  79  -6.540 -14.549 -11.360
  610    HA   PRO  80           HA       PRO  80  -8.448  -6.649  -9.095
  611    HB2  PRO  80           HB2      PRO  80 -10.665  -7.581 -10.438
  612    HB3  PRO  80           HB3      PRO  80  -9.720  -6.155 -10.966
  613    HG2  PRO  80           HG2      PRO  80  -9.481  -9.014 -11.961
  614    HG3  PRO  80           HG3      PRO  80  -9.601  -7.509 -12.929
  615    HD2  PRO  80           HD2      PRO  80  -7.201  -8.652 -12.451
  616    HD3  PRO  80           HD3      PRO  80  -7.386  -6.881 -12.397
  617    H    GLY  81           H        GLY  81  -9.341  -7.584  -7.288
  618    HA2  GLY  81           HA2      GLY  81  -9.919  -9.228  -5.751
  619    HA3  GLY  81           HA3      GLY  81  -9.791 -10.480  -6.991
  620    H    SER  82           H        SER  82  -7.329  -8.072  -5.908
  621    HA   SER  82           HA       SER  82  -5.529 -10.284  -4.961
  622    HB2  SER  82           HB2      SER  82  -4.963  -9.396  -7.266
  623    HB3  SER  82           HB3      SER  82  -4.611  -7.841  -6.508
  624    HG   SER  82           HG       SER  82  -3.322 -10.343  -6.217
  625    H    THR  83           H        THR  83  -3.597  -9.222  -3.587
  626    HA   THR  83           HA       THR  83  -4.633  -6.928  -1.987
  627    HB   THR  83           HB       THR  83  -3.656  -8.203   0.027
  628    HG1  THR  83           HG1      THR  83  -2.744  -9.959  -0.914
  629   HG21  THR  83          HG21      THR  83  -6.045  -7.740  -0.223
  630   HG22  THR  83          HG22      THR  83  -6.240  -9.160  -1.270
  631   HG23  THR  83          HG23      THR  83  -5.786  -9.360   0.437
  632    H    VAL  84           H        VAL  84  -3.147  -5.647  -0.925
  633    HA   VAL  84           HA       VAL  84  -0.260  -5.983  -1.595
  634    HB   VAL  84           HB       VAL  84  -0.109  -3.586  -2.188
  635   HG11  VAL  84          HG11      VAL  84  -0.975  -3.737  -4.452
  636   HG12  VAL  84          HG12      VAL  84  -0.234  -5.266  -3.958
  637   HG13  VAL  84          HG13      VAL  84  -2.003  -5.117  -4.004
  638   HG21  VAL  84          HG21      VAL  84  -2.193  -2.758  -1.096
  639   HG22  VAL  84          HG22      VAL  84  -2.039  -2.275  -2.787
  640   HG23  VAL  84          HG23      VAL  84  -3.150  -3.588  -2.345
  641    H    ILE  85           H        ILE  85   1.166  -4.569  -0.441
  642    HA   ILE  85           HA       ILE  85   0.177  -3.592   2.188
  643    HB   ILE  85           HB       ILE  85   2.674  -4.252   2.922
  644   HG12  ILE  85          HG12      ILE  85   3.198  -6.565   2.272
  645   HG13  ILE  85          HG13      ILE  85   1.923  -6.563   1.066
  646   HG21  ILE  85          HG21      ILE  85   0.281  -6.116   3.000
  647   HG22  ILE  85          HG22      ILE  85   1.702  -6.159   4.073
  648   HG23  ILE  85          HG23      ILE  85   0.620  -4.766   4.113
  649   HD11  ILE  85          HD11      ILE  85   4.153  -6.230   0.090
  650   HD12  ILE  85          HD12      ILE  85   3.132  -4.822  -0.217
  651   HD13  ILE  85          HD13      ILE  85   4.378  -4.744   1.039
  652    H    ALA  86           H        ALA  86   1.208  -1.938   3.190
  653    HA   ALA  86           HA       ALA  86   1.971   0.263   1.622
  654    HB1  ALA  86           HB1      ALA  86   2.493   1.307   3.784
  655    HB2  ALA  86           HB2      ALA  86   1.005   0.353   3.917
  656    HB3  ALA  86           HB3      ALA  86   2.514  -0.293   4.562
  657    H    GLY  87           H        GLY  87   3.901   1.298   1.221
  658    HA2  GLY  87           HA2      GLY  87   6.218   1.709   1.213
  659    HA3  GLY  87           HA3      GLY  87   6.464   0.281   2.231
  660    H    SER  88           H        SER  88   4.623  -0.897  -0.227
  661    HA   SER  88           HA       SER  88   6.961  -1.787  -1.802
  662    HB2  SER  88           HB2      SER  88   5.522  -3.406  -2.802
  663    HB3  SER  88           HB3      SER  88   5.431  -3.506  -1.047
  664    HG   SER  88           HG       SER  88   3.382  -2.574  -1.110
  665    H    ILE  89           H        ILE  89   6.883  -1.748  -4.133
  666    HA   ILE  89           HA       ILE  89   5.993   0.952  -5.052
  667    HB   ILE  89           HB       ILE  89   8.171  -0.660  -6.348
  668   HG12  ILE  89          HG12      ILE  89   8.862  -0.751  -4.045
  669   HG13  ILE  89          HG13      ILE  89   9.913   0.259  -5.003
  670   HG21  ILE  89          HG21      ILE  89   9.061   1.604  -6.872
  671   HG22  ILE  89          HG22      ILE  89   7.438   1.344  -7.514
  672   HG23  ILE  89          HG23      ILE  89   7.658   2.330  -6.058
  673   HD11  ILE  89          HD11      ILE  89   7.749   1.372  -3.162
  674   HD12  ILE  89          HD12      ILE  89   9.450   1.152  -2.719
  675   HD13  ILE  89          HD13      ILE  89   9.029   2.272  -4.017
  676    H    ASN  90           H        ASN  90   4.624   1.213  -6.772
  677    HA   ASN  90           HA       ASN  90   3.714  -1.178  -8.250
  678    HB2  ASN  90           HB2      ASN  90   2.101   0.353  -7.078
  679    HB3  ASN  90           HB3      ASN  90   2.632   1.674  -8.120
  680   HD21  ASN  90          HD22      ASN  90   1.597   1.810 -10.131
  681   HD22  ASN  90          HD21      ASN  90   0.657   0.454 -10.762
  682    H    GLN  91           H        GLN  91   3.781  -1.388 -10.543
  683    HA   GLN  91           HA       GLN  91   4.673   0.805 -12.243
  684    HB2  GLN  91           HB2      GLN  91   6.736  -0.537 -11.235
  685    HB3  GLN  91           HB3      GLN  91   6.202  -1.802 -12.352
  686    HG2  GLN  91           HG2      GLN  91   8.008  -0.510 -13.341
  687    HG3  GLN  91           HG3      GLN  91   6.529  -0.235 -14.256
  688   HE21  GLN  91          HE22      GLN  91   5.868   1.921 -14.519
  689   HE22  GLN  91          HE21      GLN  91   6.549   3.247 -13.593
  690    H    ASN  92           H        ASN  92   3.811   0.510 -14.350
  691    HA   ASN  92           HA       ASN  92   2.839  -0.327 -16.145
  692    HB2  ASN  92           HB2      ASN  92   5.082  -1.216 -16.487
  693    HB3  ASN  92           HB3      ASN  92   4.662  -2.663 -15.562
  694   HD21  ASN  92          HD22      ASN  92   3.610  -0.930 -18.475
  695   HD22  ASN  92          HD21      ASN  92   2.774  -2.403 -19.026
  696    H    GLY  93           H        GLY  93   0.599  -0.476 -15.621
  697    HA2  GLY  93           HA2      GLY  93  -0.928  -2.356 -16.062
  698    HA3  GLY  93           HA3      GLY  93  -0.310  -3.074 -14.584
  699    H    SER  94           H        SER  94  -0.336  -0.142 -13.525
  700    HA   SER  94           HA       SER  94  -1.550   1.112 -12.093
  701    HB2  SER  94           HB2      SER  94  -3.032   1.368 -14.703
  702    HB3  SER  94           HB3      SER  94  -3.304   2.435 -13.306
  703    HG   SER  94           HG       SER  94  -1.711   3.262 -14.722
  704    H    LEU  95           H        LEU  95  -2.573   0.603 -10.337
  705    HA   LEU  95           HA       LEU  95  -4.949  -1.181 -10.496
  706    HB2  LEU  95           HB2      LEU  95  -3.036  -0.676  -8.233
  707    HB3  LEU  95           HB3      LEU  95  -4.318  -1.874  -8.227
  708    HG   LEU  95           HG       LEU  95  -1.773  -1.835  -9.873
  709   HD11  LEU  95          HD11      LEU  95  -2.665  -3.662  -7.602
  710   HD12  LEU  95          HD12      LEU  95  -1.135  -3.769  -8.510
  711   HD13  LEU  95          HD13      LEU  95  -1.449  -2.366  -7.489
  712   HD21  LEU  95          HD21      LEU  95  -3.344  -2.921 -11.222
  713   HD22  LEU  95          HD22      LEU  95  -2.562  -4.276 -10.354
  714   HD23  LEU  95          HD23      LEU  95  -4.157  -3.713  -9.863
  715    H    LEU  96           H        LEU  96  -6.627  -1.024  -8.940
  716    HA   LEU  96           HA       LEU  96  -7.097   1.638  -7.612
  717    HB2  LEU  96           HB2      LEU  96  -9.032  -0.360  -8.827
  718    HB3  LEU  96           HB3      LEU  96  -9.534   0.750  -7.612
  719    HG   LEU  96           HG       LEU  96 -10.014   1.350 -10.045
  720   HD11  LEU  96          HD11      LEU  96  -8.756   3.297  -8.093
  721   HD12  LEU  96          HD12      LEU  96  -9.733   3.773  -9.510
  722   HD13  LEU  96          HD13      LEU  96 -10.460   2.829  -8.206
  723   HD21  LEU  96          HD21      LEU  96  -7.660   1.141 -10.951
  724   HD22  LEU  96          HD22      LEU  96  -8.459   2.680 -11.270
  725   HD23  LEU  96          HD23      LEU  96  -7.237   2.572  -9.986
  726    H    ILE  97           H        ILE  97  -6.844   1.449  -5.426
  727    HA   ILE  97           HA       ILE  97  -7.288  -1.225  -4.171
  728    HB   ILE  97           HB       ILE  97  -5.406   1.037  -3.433
  729   HG12  ILE  97          HG12      ILE  97  -3.724  -0.842  -3.480
  730   HG13  ILE  97          HG13      ILE  97  -4.967  -1.897  -4.149
  731   HG21  ILE  97          HG21      ILE  97  -6.095  -1.475  -1.844
  732   HG22  ILE  97          HG22      ILE  97  -4.711  -0.413  -1.503
  733   HG23  ILE  97          HG23      ILE  97  -6.342   0.209  -1.325
  734   HD11  ILE  97          HD11      ILE  97  -4.924  -0.728  -6.233
  735   HD12  ILE  97          HD12      ILE  97  -4.046   0.655  -5.530
  736   HD13  ILE  97          HD13      ILE  97  -3.247  -0.919  -5.749
  737    H    CYS  98           H        CYS  98  -8.896  -1.482  -2.728
  738    HA   CYS  98           HA       CYS  98 -10.248   0.935  -1.618
  739    HB2  CYS  98           HB2      CYS  98 -11.951  -0.629  -0.790
  740    HB3  CYS  98           HB3      CYS  98 -11.771  -0.674  -2.551
  741    HG   CYS  98           HG       CYS  98 -10.208  -2.686  -0.459
  742    H    ALA  99           H        ALA  99  -9.621   1.738   0.285
  743    HA   ALA  99           HA       ALA  99  -7.617   0.320   1.844
  744    HB1  ALA  99           HB1      ALA  99  -8.943   3.035   2.232
  745    HB2  ALA  99           HB2      ALA  99  -7.510   2.436   3.097
  746    HB3  ALA  99           HB3      ALA  99  -7.433   2.717   1.346
  747    H    THR 100           H        THR 100  -7.920  -0.889   3.548
  748    HA   THR 100           HA       THR 100 -10.431  -0.715   5.195
  749    HB   THR 100           HB       THR 100 -10.030  -3.094   5.760
  750    HG1  THR 100           HG1      THR 100  -7.666  -2.681   4.558
  751   HG21  THR 100          HG21      THR 100 -10.744  -4.047   3.656
  752   HG22  THR 100          HG22      THR 100 -11.495  -2.451   3.821
  753   HG23  THR 100          HG23      THR 100 -10.102  -2.668   2.739
  754    H    HIS 101           H        HIS 101  -7.143  -0.043   5.401
  755    HA   HIS 101           HA       HIS 101  -7.414   0.413   8.325
  756    HB2  HIS 101           HB2      HIS 101  -4.895  -0.576   6.939
  757    HB3  HIS 101           HB3      HIS 101  -5.111  -0.230   8.654
  758    HD1  HIS 101           HD1      HIS 101  -4.670  -3.118   6.690
  759    HD2  HIS 101           HD2      HIS 101  -7.502  -1.915   9.546
  760    HE1  HIS 101           HE1      HIS 101  -5.713  -5.263   7.611
  761    H    VAL 102           H        VAL 102  -6.419   2.315   9.032
  762    HA   VAL 102           HA       VAL 102  -5.484   4.233   6.973
  763    HB   VAL 102           HB       VAL 102  -5.681   5.923   8.759
  764   HG11  VAL 102          HG11      VAL 102  -8.225   4.324   8.340
  765   HG12  VAL 102          HG12      VAL 102  -8.071   6.051   8.717
  766   HG13  VAL 102          HG13      VAL 102  -7.505   5.445   7.157
  767   HG21  VAL 102          HG21      VAL 102  -5.391   4.454  10.760
  768   HG22  VAL 102          HG22      VAL 102  -6.843   5.455  10.832
  769   HG23  VAL 102          HG23      VAL 102  -6.994   3.740  10.437
  770    H    GLY 103           H        GLY 103  -3.760   5.903   8.566
  771    HA2  GLY 103           HA2      GLY 103  -1.330   4.563   7.698
  772    HA3  GLY 103           HA3      GLY 103  -1.500   6.178   8.403
  773    H    ALA 104           H        ALA 104  -2.844   5.382  10.821
  774    HA   ALA 104           HA       ALA 104  -0.735   4.185  12.452
  775    HB1  ALA 104           HB1      ALA 104  -3.597   5.009  13.109
  776    HB2  ALA 104           HB2      ALA 104  -2.341   4.556  14.282
  777    HB3  ALA 104           HB3      ALA 104  -2.142   6.013  13.292
  778    H    ASP 105           H        ASP 105  -4.031   3.164  11.508
  779    HA   ASP 105           HA       ASP 105  -4.030   0.737  12.976
  780    HB2  ASP 105           HB2      ASP 105  -5.961   2.244  12.260
  781    HB3  ASP 105           HB3      ASP 105  -5.839   1.509  10.661
  782    H    THR 106           H        THR 106  -2.453   1.263  10.105
  783    HA   THR 106           HA       THR 106  -2.944  -0.801   8.339
  784    HB   THR 106           HB       THR 106  -1.524   0.961   7.779
  785    HG1  THR 106           HG1      THR 106  -0.806  -0.517   6.555
  786   HG21  THR 106          HG21      THR 106   0.465   0.082   9.856
  787   HG22  THR 106          HG22      THR 106   0.749   1.316   8.613
  788   HG23  THR 106          HG23      THR 106  -0.474   1.573   9.860
  789    H    THR 107           H        THR 107  -2.244  -2.810   7.857
  790    HA   THR 107           HA       THR 107  -1.483  -4.598   9.983
  791    HB   THR 107           HB       THR 107  -2.701  -5.082   7.764
  792    HG1  THR 107           HG1      THR 107  -2.216  -7.152   8.000
  793   HG21  THR 107          HG21      THR 107  -1.416  -5.982   5.959
  794   HG22  THR 107          HG22      THR 107  -0.785  -4.355   6.268
  795   HG23  THR 107          HG23      THR 107   0.114  -5.780   6.837
  796    H    LEU 108           H        LEU 108   0.403  -2.473   7.964
  797    HA   LEU 108           HA       LEU 108   3.022  -3.616   8.253
  798    HB2  LEU 108           HB2      LEU 108   2.192  -1.681   6.769
  799    HB3  LEU 108           HB3      LEU 108   2.175  -0.702   8.226
  800    HG   LEU 108           HG       LEU 108   4.727  -1.377   8.418
  801   HD11  LEU 108          HD11      LEU 108   4.170  -1.764   5.430
  802   HD12  LEU 108          HD12      LEU 108   5.767  -1.638   6.185
  803   HD13  LEU 108          HD13      LEU 108   4.716  -3.026   6.551
  804   HD21  LEU 108          HD21      LEU 108   3.931   0.888   8.069
  805   HD22  LEU 108          HD22      LEU 108   5.250   0.569   6.934
  806   HD23  LEU 108          HD23      LEU 108   3.579   0.546   6.360
  807    H    SER 109           H        SER 109   1.017  -1.600  10.393
  808    HA   SER 109           HA       SER 109   3.059  -1.304  12.482
  809    HB2  SER 109           HB2      SER 109   1.314   0.448  12.010
  810    HB3  SER 109           HB3      SER 109   0.098  -0.676  12.645
  811    HG   SER 109           HG       SER 109   0.794   0.639  14.311
  812    H    GLN 110           H        GLN 110   0.598  -3.583  11.525
  813    HA   GLN 110           HA       GLN 110   0.305  -4.829  14.190
  814    HB2  GLN 110           HB2      GLN 110  -1.403  -4.854  12.238
  815    HB3  GLN 110           HB3      GLN 110  -0.413  -6.123  11.545
  816    HG2  GLN 110           HG2      GLN 110  -1.969  -7.343  12.716
  817    HG3  GLN 110           HG3      GLN 110  -0.647  -7.298  13.886
  818   HE21  GLN 110          HE22      GLN 110  -3.725  -5.727  12.934
  819   HE22  GLN 110          HE21      GLN 110  -4.026  -5.041  14.526
  820    H    ILE 111           H        ILE 111   2.124  -5.485  11.197
  821    HA   ILE 111           HA       ILE 111   3.445  -7.869  11.916
  822    HB   ILE 111           HB       ILE 111   4.178  -5.582  10.066
  823   HG12  ILE 111          HG12      ILE 111   3.381  -8.446   9.375
  824   HG13  ILE 111          HG13      ILE 111   2.182  -7.198   9.639
  825   HG21  ILE 111          HG21      ILE 111   5.665  -8.233  10.336
  826   HG22  ILE 111          HG22      ILE 111   5.897  -7.060   9.026
  827   HG23  ILE 111          HG23      ILE 111   6.325  -6.610  10.663
  828   HD11  ILE 111          HD11      ILE 111   3.270  -5.810   7.829
  829   HD12  ILE 111          HD12      ILE 111   4.298  -7.211   7.453
  830   HD13  ILE 111          HD13      ILE 111   2.541  -7.321   7.281
  831    H    VAL 112           H        VAL 112   4.613  -4.469  12.552
  832    HA   VAL 112           HA       VAL 112   7.042  -5.392  13.730
  833    HB   VAL 112           HB       VAL 112   7.254  -3.111  14.647
  834   HG11  VAL 112          HG11      VAL 112   7.721  -2.121  12.483
  835   HG12  VAL 112          HG12      VAL 112   8.083  -3.849  12.375
  836   HG13  VAL 112          HG13      VAL 112   6.581  -3.219  11.671
  837   HG21  VAL 112          HG21      VAL 112   4.872  -2.485  14.868
  838   HG22  VAL 112          HG22      VAL 112   5.800  -1.335  13.882
  839   HG23  VAL 112          HG23      VAL 112   4.734  -2.505  13.091
  840    H    LYS 113           H        LYS 113   4.071  -5.784  15.055
  841    HA   LYS 113           HA       LYS 113   4.898  -5.735  17.921
  842    HB2  LYS 113           HB2      LYS 113   2.408  -6.870  16.619
  843    HB3  LYS 113           HB3      LYS 113   2.751  -6.801  18.346
  844    HG2  LYS 113           HG2      LYS 113   2.697  -4.357  18.334
  845    HG3  LYS 113           HG3      LYS 113   2.544  -4.331  16.581
  846    HD2  LYS 113           HD2      LYS 113   0.373  -3.942  17.396
  847    HD3  LYS 113           HD3      LYS 113   0.403  -5.596  16.750
  848    HE2  LYS 113           HE2      LYS 113   0.907  -6.362  19.129
  849    HE3  LYS 113           HE3      LYS 113   0.568  -4.706  19.651
  850    HZ1  LYS 113           HZ1      LYS 113  -1.685  -4.995  18.660
  851    HZ2  LYS 113           HZ2      LYS 113  -1.309  -6.569  18.294
  852    HZ3  LYS 113           HZ3      LYS 113  -1.400  -6.104  19.851
  853    H    LEU 114           H        LEU 114   4.692  -7.889  15.180
  854    HA   LEU 114           HA       LEU 114   5.041 -10.414  16.662
  855    HB2  LEU 114           HB2      LEU 114   3.617  -9.685  14.381
  856    HB3  LEU 114           HB3      LEU 114   5.089 -10.342  13.674
  857    HG   LEU 114           HG       LEU 114   3.175 -11.750  15.567
  858   HD11  LEU 114          HD11      LEU 114   2.642 -13.102  13.555
  859   HD12  LEU 114          HD12      LEU 114   2.286 -11.390  13.291
  860   HD13  LEU 114          HD13      LEU 114   3.752 -12.107  12.587
  861   HD21  LEU 114          HD21      LEU 114   5.424 -12.665  15.892
  862   HD22  LEU 114          HD22      LEU 114   4.472 -13.808  14.945
  863   HD23  LEU 114          HD23      LEU 114   5.658 -12.767  14.126
  864    H    VAL 115           H        VAL 115   6.760  -8.311  14.360
  865    HA   VAL 115           HA       VAL 115   9.114  -9.963  14.089
  866    HB   VAL 115           HB       VAL 115   8.595  -7.042  13.440
  867   HG11  VAL 115          HG11      VAL 115  10.983  -8.760  12.632
  868   HG12  VAL 115          HG12      VAL 115  10.575  -7.179  11.933
  869   HG13  VAL 115          HG13      VAL 115  11.038  -7.294  13.627
  870   HG21  VAL 115          HG21      VAL 115   8.451  -7.865  11.124
  871   HG22  VAL 115          HG22      VAL 115   8.795  -9.518  11.663
  872   HG23  VAL 115          HG23      VAL 115   7.282  -8.728  12.128
  873    H    GLU 116           H        GLU 116   8.177  -7.680  16.553
  874    HA   GLU 116           HA       GLU 116  10.738  -7.132  17.737
  875    HB2  GLU 116           HB2      GLU 116   8.530  -6.026  18.148
  876    HB3  GLU 116           HB3      GLU 116   7.953  -7.476  18.957
  877    HG2  GLU 116           HG2      GLU 116   9.521  -7.149  20.774
  878    HG3  GLU 116           HG3      GLU 116  10.344  -5.849  19.884
  879    H    GLU 117           H        GLU 117   8.345  -9.564  19.018
  880    HA   GLU 117           HA       GLU 117  10.185 -11.152  20.234
  881    HB2  GLU 117           HB2      GLU 117   7.496 -11.941  19.044
  882    HB3  GLU 117           HB3      GLU 117   8.421 -12.884  20.227
  883    HG2  GLU 117           HG2      GLU 117   8.345 -10.392  21.447
  884    HG3  GLU 117           HG3      GLU 117   6.799 -10.444  20.611
  885    H    ALA 118           H        ALA 118  10.274 -10.944  16.850
  886    HA   ALA 118           HA       ALA 118  10.903 -13.712  16.274
  887    HB1  ALA 118           HB1      ALA 118  11.659 -11.207  14.722
  888    HB2  ALA 118           HB2      ALA 118  11.612 -12.867  14.112
  889    HB3  ALA 118           HB3      ALA 118  10.110 -12.043  14.566
  890    H    GLN 119           H        GLN 119  12.793 -10.918  17.327
  891    HA   GLN 119           HA       GLN 119  15.392 -12.112  16.832
  892    HB2  GLN 119           HB2      GLN 119  14.450  -9.587  18.220
  893    HB3  GLN 119           HB3      GLN 119  16.131 -10.094  18.286
  894    HG2  GLN 119           HG2      GLN 119  16.064  -8.628  16.471
  895    HG3  GLN 119           HG3      GLN 119  16.142 -10.244  15.741
  896   HE21  GLN 119          HE22      GLN 119  13.942  -7.673  16.790
  897   HE22  GLN 119          HE21      GLN 119  12.608  -8.284  15.809
  Start of MODEL    2
    1    H    SER   1           H        SER   1  18.101  -6.865  12.286
    2    HA   SER   1           HA       SER   1  16.074  -5.273  13.755
    3    HB2  SER   1           HB2      SER   1  18.073  -4.400  14.984
    4    HB3  SER   1           HB3      SER   1  17.772  -6.139  15.144
    5    HG   SER   1           HG       SER   1  19.960  -5.583  14.776
    6    H    GLU   2           H        GLU   2  18.303  -4.845  11.067
    7    HA   GLU   2           HA       GLU   2  17.993  -1.916  10.985
    8    HB2  GLU   2           HB2      GLU   2  19.964  -3.326  10.055
    9    HB3  GLU   2           HB3      GLU   2  18.897  -3.733   8.716
   10    HG2  GLU   2           HG2      GLU   2  18.653  -1.354   8.138
   11    HG3  GLU   2           HG3      GLU   2  19.620  -0.889   9.544
   12    H    ALA   3           H        ALA   3  16.561  -4.806   9.534
   13    HA   ALA   3           HA       ALA   3  14.652  -3.560   7.805
   14    HB1  ALA   3           HB1      ALA   3  13.450  -5.679   7.924
   15    HB2  ALA   3           HB2      ALA   3  15.194  -5.990   7.814
   16    HB3  ALA   3           HB3      ALA   3  14.358  -6.163   9.367
   17    H    LEU   4           H        LEU   4  14.230  -4.631  11.221
   18    HA   LEU   4           HA       LEU   4  11.743  -3.635  11.764
   19    HB2  LEU   4           HB2      LEU   4  13.385  -4.928  13.277
   20    HB3  LEU   4           HB3      LEU   4  14.108  -3.381  13.668
   21    HG   LEU   4           HG       LEU   4  11.740  -2.663  14.480
   22   HD11  LEU   4          HD11      LEU   4  11.450  -5.692  14.498
   23   HD12  LEU   4          HD12      LEU   4  10.315  -4.517  15.208
   24   HD13  LEU   4          HD13      LEU   4  10.547  -4.598  13.446
   25   HD21  LEU   4          HD21      LEU   4  12.071  -3.747  16.667
   26   HD22  LEU   4          HD22      LEU   4  13.268  -4.850  15.943
   27   HD23  LEU   4          HD23      LEU   4  13.583  -3.102  16.024
   28    H    ALA   5           H        ALA   5  14.610  -1.623  11.368
   29    HA   ALA   5           HA       ALA   5  13.269   0.844  12.280
   30    HB1  ALA   5           HB1      ALA   5  15.686   0.563  12.725
   31    HB2  ALA   5           HB2      ALA   5  16.003   0.419  10.986
   32    HB3  ALA   5           HB3      ALA   5  15.374   1.940  11.652
   33    H    LYS   6           H        LYS   6  14.577  -0.499   9.217
   34    HA   LYS   6           HA       LYS   6  13.779   1.540   7.439
   35    HB2  LYS   6           HB2      LYS   6  15.378  -0.182   6.879
   36    HB3  LYS   6           HB3      LYS   6  14.128  -1.437   6.946
   37    HG2  LYS   6           HG2      LYS   6  12.976  -0.532   5.045
   38    HG3  LYS   6           HG3      LYS   6  13.930   0.961   5.078
   39    HD2  LYS   6           HD2      LYS   6  15.923  -0.207   4.355
   40    HD3  LYS   6           HD3      LYS   6  15.105  -1.788   4.478
   41    HE2  LYS   6           HE2      LYS   6  13.500  -1.164   2.766
   42    HE3  LYS   6           HE3      LYS   6  14.107   0.498   2.732
   43    HZ1  LYS   6           HZ1      LYS   6  15.962  -1.702   2.090
   44    HZ2  LYS   6           HZ2      LYS   6  14.901  -1.166   0.929
   45    HZ3  LYS   6           HZ3      LYS   6  15.993  -0.147   1.605
   46    H    LEU   7           H        LEU   7  11.804  -1.201   8.567
   47    HA   LEU   7           HA       LEU   7   9.647  -0.971   6.780
   48    HB2  LEU   7           HB2      LEU   7  10.096  -2.044   9.532
   49    HB3  LEU   7           HB3      LEU   7   8.427  -1.676   9.155
   50    HG   LEU   7           HG       LEU   7   8.855  -3.996   8.795
   51   HD11  LEU   7          HD11      LEU   7   8.496  -2.679   6.082
   52   HD12  LEU   7          HD12      LEU   7   7.931  -4.276   6.606
   53   HD13  LEU   7          HD13      LEU   7   7.248  -2.819   7.346
   54   HD21  LEU   7          HD21      LEU   7  11.163  -4.143   8.269
   55   HD22  LEU   7          HD22      LEU   7  10.269  -4.805   6.902
   56   HD23  LEU   7          HD23      LEU   7  10.975  -3.176   6.781
   57    H    ILE   8           H        ILE   8  10.190   1.053   9.695
   58    HA   ILE   8           HA       ILE   8   7.658   2.506   9.309
   59    HB   ILE   8           HB       ILE   8  10.013   2.956  11.158
   60   HG12  ILE   8          HG12      ILE   8   8.691   1.015  11.762
   61   HG13  ILE   8          HG13      ILE   8   8.449   2.301  12.929
   62   HG21  ILE   8          HG21      ILE   8   7.462   4.593  10.876
   63   HG22  ILE   8          HG22      ILE   8   8.471   4.594  12.336
   64   HG23  ILE   8          HG23      ILE   8   9.145   5.152  10.807
   65   HD11  ILE   8          HD11      ILE   8   6.484   1.381  10.794
   66   HD12  ILE   8          HD12      ILE   8   6.323   1.268  12.550
   67   HD13  ILE   8          HD13      ILE   8   6.248   2.850  11.774
   68    H    SER   9           H        SER   9  11.024   2.943   8.282
   69    HA   SER   9           HA       SER   9  10.665   5.672   7.355
   70    HB2  SER   9           HB2      SER   9  12.719   3.598   6.498
   71    HB3  SER   9           HB3      SER   9  12.796   5.349   6.251
   72    HG   SER   9           HG       SER   9  13.992   4.955   8.022
   73    H    LEU  10           H        LEU  10  10.014   2.513   6.024
   74    HA   LEU  10           HA       LEU  10   9.912   3.056   3.259
   75    HB2  LEU  10           HB2      LEU  10   9.859   0.846   4.838
   76    HB3  LEU  10           HB3      LEU  10   8.141   0.991   4.542
   77    HG   LEU  10           HG       LEU  10   8.750   1.021   2.016
   78   HD11  LEU  10          HD11      LEU  10  11.173   1.532   2.237
   79   HD12  LEU  10          HD12      LEU  10  11.397   0.049   3.194
   80   HD13  LEU  10          HD13      LEU  10  10.935  -0.049   1.481
   81   HD21  LEU  10          HD21      LEU  10   7.825  -0.927   3.196
   82   HD22  LEU  10          HD22      LEU  10   9.036  -1.430   1.998
   83   HD23  LEU  10          HD23      LEU  10   9.452  -1.400   3.730
   84    H    GLN  11           H        GLN  11   7.624   4.015   5.638
   85    HA   GLN  11           HA       GLN  11   5.200   3.716   4.115
   86    HB2  GLN  11           HB2      GLN  11   5.926   5.035   6.721
   87    HB3  GLN  11           HB3      GLN  11   4.301   5.199   6.040
   88    HG2  GLN  11           HG2      GLN  11   4.084   2.770   5.829
   89    HG3  GLN  11           HG3      GLN  11   5.669   2.558   6.596
   90   HE21  GLN  11          HE22      GLN  11   5.121   1.765   8.647
   91   HE22  GLN  11          HE21      GLN  11   3.891   2.594   9.608
   92    H    ALA  12           H        ALA  12   3.958   5.207   2.978
   93    HA   ALA  12           HA       ALA  12   5.465   7.420   1.748
   94    HB1  ALA  12           HB1      ALA  12   2.769   6.186   1.069
   95    HB2  ALA  12           HB2      ALA  12   3.666   7.355   0.080
   96    HB3  ALA  12           HB3      ALA  12   4.333   5.732   0.348
   97    H    THR  13           H        THR  13   4.268   9.491   1.237
   98    HA   THR  13           HA       THR  13   3.189  10.545   3.805
   99    HB   THR  13           HB       THR  13   3.888  12.171   1.343
  100    HG1  THR  13           HG1      THR  13   5.690  10.915   1.818
  101   HG21  THR  13          HG21      THR  13   4.462  13.878   3.082
  102   HG22  THR  13          HG22      THR  13   2.768  13.389   3.169
  103   HG23  THR  13          HG23      THR  13   3.936  12.744   4.343
  104    H    GLU  14           H        GLU  14   2.123  10.376   0.389
  105    HA   GLU  14           HA       GLU  14  -0.533  11.402   1.317
  106    HB2  GLU  14           HB2      GLU  14  -0.769  12.611  -0.776
  107    HB3  GLU  14           HB3      GLU  14   0.615  13.188   0.150
  108    HG2  GLU  14           HG2      GLU  14   2.143  12.215  -1.389
  109    HG3  GLU  14           HG3      GLU  14   0.909  11.132  -2.053
  110    H    ALA  15           H        ALA  15  -2.398  11.012   0.026
  111    HA   ALA  15           HA       ALA  15  -2.335   8.671  -1.767
  112    HB1  ALA  15           HB1      ALA  15  -4.198   8.926   0.636
  113    HB2  ALA  15           HB2      ALA  15  -4.245   7.647  -0.599
  114    HB3  ALA  15           HB3      ALA  15  -2.849   7.776   0.495
  115    H    THR  16           H        THR  16  -3.930   8.680  -3.274
  116    HA   THR  16           HA       THR  16  -5.508  11.208  -3.567
  117    HB   THR  16           HB       THR  16  -4.673   9.250  -5.705
  118    HG1  THR  16           HG1      THR  16  -3.031  10.645  -4.784
  119   HG21  THR  16          HG21      THR  16  -6.795  10.356  -6.326
  120   HG22  THR  16          HG22      THR  16  -6.122  11.938  -5.865
  121   HG23  THR  16          HG23      THR  16  -5.460  11.040  -7.247
  122    H    ILE  17           H        ILE  17  -7.568  11.155  -2.951
  123    HA   ILE  17           HA       ILE  17  -9.101   8.613  -2.851
  124    HB   ILE  17           HB       ILE  17  -9.955  11.351  -1.810
  125   HG12  ILE  17          HG12      ILE  17  -8.424   9.204  -0.275
  126   HG13  ILE  17          HG13      ILE  17  -7.853  10.825  -0.665
  127   HG21  ILE  17          HG21      ILE  17 -10.834   8.519  -1.076
  128   HG22  ILE  17          HG22      ILE  17 -11.543  10.030  -0.467
  129   HG23  ILE  17          HG23      ILE  17 -11.732   9.611  -2.150
  130   HD11  ILE  17          HD11      ILE  17  -8.538  10.749   1.648
  131   HD12  ILE  17          HD12      ILE  17  -9.657  11.796   0.749
  132   HD13  ILE  17          HD13      ILE  17 -10.134  10.147   1.226
  133    H    VAL  18           H        VAL  18 -10.761   8.213  -4.286
  134    HA   VAL  18           HA       VAL  18 -11.674  10.512  -5.982
  135    HB   VAL  18           HB       VAL  18 -11.260   7.695  -6.964
  136   HG11  VAL  18          HG11      VAL  18 -12.125  10.258  -8.381
  137   HG12  VAL  18          HG12      VAL  18 -11.661   8.746  -9.192
  138   HG13  VAL  18          HG13      VAL  18 -13.097   8.779  -8.174
  139   HG21  VAL  18          HG21      VAL  18  -9.103   8.645  -6.670
  140   HG22  VAL  18          HG22      VAL  18  -9.498   8.972  -8.363
  141   HG23  VAL  18          HG23      VAL  18  -9.645  10.256  -7.170
  142    H    THR  19           H        THR  19 -13.676  10.844  -6.400
  143    HA   THR  19           HA       THR  19 -15.809   9.238  -5.017
  144    HB   THR  19           HB       THR  19 -15.557  12.268  -5.255
  145    HG1  THR  19           HG1      THR  19 -14.128  11.612  -3.766
  146   HG21  THR  19          HG21      THR  19 -17.384  12.300  -3.571
  147   HG22  THR  19          HG22      THR  19 -17.917  11.611  -5.100
  148   HG23  THR  19          HG23      THR  19 -17.552  10.536  -3.732
  149    H    LEU  20           H        LEU  20 -17.707   8.923  -6.122
  150    HA   LEU  20           HA       LEU  20 -17.888   9.955  -8.908
  151    HB2  LEU  20           HB2      LEU  20 -19.615   7.830  -7.604
  152    HB3  LEU  20           HB3      LEU  20 -19.549   8.276  -9.291
  153    HG   LEU  20           HG       LEU  20 -17.220   7.015  -7.768
  154   HD11  LEU  20          HD11      LEU  20 -19.163   5.755  -9.738
  155   HD12  LEU  20          HD12      LEU  20 -17.741   4.982  -9.012
  156   HD13  LEU  20          HD13      LEU  20 -19.106   5.463  -7.994
  157   HD21  LEU  20          HD21      LEU  20 -16.448   8.357  -9.686
  158   HD22  LEU  20          HD22      LEU  20 -16.266   6.634 -10.016
  159   HD23  LEU  20          HD23      LEU  20 -17.607   7.536 -10.754
  160    H    ASP  21           H        ASP  21 -18.243  12.103  -8.023
  161    HA   ASP  21           HA       ASP  21 -20.413  12.754  -6.263
  162    HB2  ASP  21           HB2      ASP  21 -18.361  14.202  -7.817
  163    HB3  ASP  21           HB3      ASP  21 -19.866  15.094  -7.704
  164    H    SER  22           H        SER  22 -20.587  11.840  -9.425
  165    HA   SER  22           HA       SER  22 -23.430  12.214  -9.406
  166    HB2  SER  22           HB2      SER  22 -22.038  13.431 -11.813
  167    HB3  SER  22           HB3      SER  22 -23.780  13.221 -11.593
  168    HG   SER  22           HG       SER  22 -22.716  14.436  -9.441
  169    H    ASP  23           H        ASP  23 -24.386  10.704 -10.310
  170    HA   ASP  23           HA       ASP  23 -24.307   8.332 -10.366
  171    HB2  ASP  23           HB2      ASP  23 -26.083   9.641 -11.530
  172    HB3  ASP  23           HB3      ASP  23 -25.211   9.441 -13.051
  173    H    ASN  24           H        ASN  24 -21.805   8.149 -10.453
  174    HA   ASN  24           HA       ASN  24 -19.908   7.171 -11.225
  175    HB2  ASN  24           HB2      ASN  24 -21.652   5.265 -11.631
  176    HB3  ASN  24           HB3      ASN  24 -21.409   5.620 -13.340
  177   HD21  ASN  24          HD22      ASN  24 -18.596   5.933 -13.378
  178   HD22  ASN  24          HD21      ASN  24 -18.018   4.304 -12.969
  179    H    ILE  25           H        ILE  25 -21.748   9.160 -13.283
  180    HA   ILE  25           HA       ILE  25 -20.061   9.399 -15.554
  181    HB   ILE  25           HB       ILE  25 -21.666  11.355 -15.923
  182   HG12  ILE  25          HG12      ILE  25 -23.165  10.320 -13.556
  183   HG13  ILE  25          HG13      ILE  25 -22.211  11.807 -13.580
  184   HG21  ILE  25          HG21      ILE  25 -21.882   9.062 -16.871
  185   HG22  ILE  25          HG22      ILE  25 -22.868   8.608 -15.469
  186   HG23  ILE  25          HG23      ILE  25 -23.433   9.856 -16.590
  187   HD11  ILE  25          HD11      ILE  25 -24.527  12.362 -13.902
  188   HD12  ILE  25          HD12      ILE  25 -23.660  12.672 -15.418
  189   HD13  ILE  25          HD13      ILE  25 -24.685  11.224 -15.247
  190    H    LEU  26           H        LEU  26 -19.889  10.949 -12.450
  191    HA   LEU  26           HA       LEU  26 -17.983  12.949 -13.625
  192    HB2  LEU  26           HB2      LEU  26 -20.072  14.009 -12.980
  193    HB3  LEU  26           HB3      LEU  26 -19.858  13.457 -11.315
  194    HG   LEU  26           HG       LEU  26 -17.492  14.877 -12.480
  195   HD11  LEU  26          HD11      LEU  26 -19.277  16.167 -13.481
  196   HD12  LEU  26          HD12      LEU  26 -20.078  16.342 -11.893
  197   HD13  LEU  26          HD13      LEU  26 -18.487  17.087 -12.183
  198   HD21  LEU  26          HD21      LEU  26 -17.620  14.237 -10.072
  199   HD22  LEU  26          HD22      LEU  26 -17.464  15.983 -10.299
  200   HD23  LEU  26          HD23      LEU  26 -19.047  15.290  -9.903
  201    H    LEU  27           H        LEU  27 -16.102  12.670 -13.013
  202    HA   LEU  27           HA       LEU  27 -15.410  11.222 -10.466
  203    HB2  LEU  27           HB2      LEU  27 -13.874  11.602 -13.047
  204    HB3  LEU  27           HB3      LEU  27 -13.059  11.216 -11.535
  205    HG   LEU  27           HG       LEU  27 -14.393   9.160 -11.273
  206   HD11  LEU  27          HD11      LEU  27 -15.599   8.236 -13.274
  207   HD12  LEU  27          HD12      LEU  27 -16.435   9.580 -12.513
  208   HD13  LEU  27          HD13      LEU  27 -15.520   9.847 -14.022
  209   HD21  LEU  27          HD21      LEU  27 -12.198   9.118 -12.384
  210   HD22  LEU  27          HD22      LEU  27 -13.275   7.889 -13.052
  211   HD23  LEU  27          HD23      LEU  27 -12.977   9.390 -13.959
  212    H    SER  28           H        SER  28 -14.687  12.270  -8.786
  213    HA   SER  28           HA       SER  28 -13.396  14.953  -9.075
  214    HB2  SER  28           HB2      SER  28 -15.695  15.158  -8.121
  215    HB3  SER  28           HB3      SER  28 -15.223  14.050  -6.816
  216    HG   SER  28           HG       SER  28 -14.826  16.059  -6.020
  217    H    GLU  29           H        GLU  29 -11.298  14.908  -8.316
  218    HA   GLU  29           HA       GLU  29 -10.464  12.534  -6.717
  219    HB2  GLU  29           HB2      GLU  29  -8.811  14.056  -8.733
  220    HB3  GLU  29           HB3      GLU  29  -8.413  12.541  -7.909
  221    HG2  GLU  29           HG2      GLU  29 -10.132  11.344  -9.132
  222    HG3  GLU  29           HG3      GLU  29 -10.729  12.819  -9.876
  223    H    GLU  30           H        GLU  30  -9.104  12.889  -4.957
  224    HA   GLU  30           HA       GLU  30  -8.338  15.702  -4.256
  225    HB2  GLU  30           HB2      GLU  30  -9.527  13.600  -2.408
  226    HB3  GLU  30           HB3      GLU  30  -9.010  15.210  -1.932
  227    HG2  GLU  30           HG2      GLU  30 -11.274  14.698  -3.902
  228    HG3  GLU  30           HG3      GLU  30 -11.482  14.736  -2.164
  229    H    GLN  31           H        GLN  31  -6.224  15.869  -3.494
  230    HA   GLN  31           HA       GLN  31  -4.845  13.341  -2.692
  231    HB2  GLN  31           HB2      GLN  31  -3.487  15.990  -3.201
  232    HB3  GLN  31           HB3      GLN  31  -2.771  14.374  -3.041
  233    HG2  GLN  31           HG2      GLN  31  -4.157  13.752  -5.132
  234    HG3  GLN  31           HG3      GLN  31  -4.260  15.513  -5.412
  235   HE21  GLN  31          HE22      GLN  31  -2.474  12.709  -5.588
  236   HE22  GLN  31          HE21      GLN  31  -1.046  13.346  -4.971
  237    H    VAL  32           H        VAL  32  -4.261  12.994  -0.658
  238    HA   VAL  32           HA       VAL  32  -4.391  15.194   1.358
  239    HB   VAL  32           HB       VAL  32  -5.630  13.849   2.879
  240   HG11  VAL  32          HG11      VAL  32  -7.151  13.772   0.254
  241   HG12  VAL  32          HG12      VAL  32  -7.826  13.780   1.891
  242   HG13  VAL  32          HG13      VAL  32  -6.956  15.206   1.296
  243   HG21  VAL  32          HG21      VAL  32  -6.630  11.692   2.379
  244   HG22  VAL  32          HG22      VAL  32  -5.888  11.675   0.760
  245   HG23  VAL  32          HG23      VAL  32  -4.885  11.560   2.220
  246    H    ASP  33           H        ASP  33  -3.437  14.643   3.381
  247    HA   ASP  33           HA       ASP  33  -0.955  13.037   3.220
  248    HB2  ASP  33           HB2      ASP  33  -2.320  14.481   5.540
  249    HB3  ASP  33           HB3      ASP  33  -0.861  13.520   5.730
  250    H    VAL  34           H        VAL  34  -0.620  11.028   4.169
  251    HA   VAL  34           HA       VAL  34  -2.754   9.218   4.147
  252    HB   VAL  34           HB       VAL  34  -0.331   8.801   3.685
  253   HG11  VAL  34          HG11      VAL  34  -0.144   8.319   6.688
  254   HG12  VAL  34          HG12      VAL  34   1.093   7.959   5.477
  255   HG13  VAL  34          HG13      VAL  34   0.639   9.640   5.788
  256   HG21  VAL  34          HG21      VAL  34  -2.020   6.983   3.700
  257   HG22  VAL  34          HG22      VAL  34  -0.389   6.455   4.146
  258   HG23  VAL  34          HG23      VAL  34  -1.617   6.652   5.399
  259    H    GLU  35           H        GLU  35  -2.253  11.250   6.676
  260    HA   GLU  35           HA       GLU  35  -3.464   9.653   8.830
  261    HB2  GLU  35           HB2      GLU  35  -3.254  12.602   8.607
  262    HB3  GLU  35           HB3      GLU  35  -3.490  11.656  10.069
  263    HG2  GLU  35           HG2      GLU  35  -1.197  10.671   9.700
  264    HG3  GLU  35           HG3      GLU  35  -0.955  11.856   8.396
  265    H    LEU  36           H        LEU  36  -4.688  11.452   6.131
  266    HA   LEU  36           HA       LEU  36  -7.283  12.072   7.440
  267    HB2  LEU  36           HB2      LEU  36  -6.099  13.119   4.864
  268    HB3  LEU  36           HB3      LEU  36  -7.387  13.851   5.815
  269    HG   LEU  36           HG       LEU  36  -4.426  13.677   6.592
  270   HD11  LEU  36          HD11      LEU  36  -6.170  16.033   5.833
  271   HD12  LEU  36          HD12      LEU  36  -4.463  16.099   6.340
  272   HD13  LEU  36          HD13      LEU  36  -4.897  15.287   4.826
  273   HD21  LEU  36          HD21      LEU  36  -5.071  15.178   8.469
  274   HD22  LEU  36          HD22      LEU  36  -6.783  14.928   8.036
  275   HD23  LEU  36          HD23      LEU  36  -5.791  13.575   8.622
  276    H    VAL  37           H        VAL  37  -6.134   9.812   5.313
  277    HA   VAL  37           HA       VAL  37  -8.682   9.350   3.881
  278    HB   VAL  37           HB       VAL  37  -6.562   9.045   2.690
  279   HG11  VAL  37          HG11      VAL  37  -5.990   6.724   4.579
  280   HG12  VAL  37          HG12      VAL  37  -5.057   7.177   3.139
  281   HG13  VAL  37          HG13      VAL  37  -5.102   8.259   4.536
  282   HG21  VAL  37          HG21      VAL  37  -8.557   7.724   2.048
  283   HG22  VAL  37          HG22      VAL  37  -7.019   6.929   1.659
  284   HG23  VAL  37          HG23      VAL  37  -7.969   6.375   3.047
  285    H    GLN  38           H        GLN  38  -9.956   7.487   4.262
  286    HA   GLN  38           HA       GLN  38  -9.362   5.982   6.766
  287    HB2  GLN  38           HB2      GLN  38 -11.629   5.980   7.455
  288    HB3  GLN  38           HB3      GLN  38 -11.168   7.633   7.122
  289    HG2  GLN  38           HG2      GLN  38 -12.527   7.685   5.134
  290    HG3  GLN  38           HG3      GLN  38 -12.721   5.920   5.127
  291   HE21  GLN  38          HE22      GLN  38 -13.366   8.726   7.282
  292   HE22  GLN  38          HE21      GLN  38 -14.854   7.953   7.851
  293    H    ARG  39           H        ARG  39 -10.339   3.938   7.021
  294    HA   ARG  39           HA       ARG  39  -9.825   2.230   4.703
  295    HB2  ARG  39           HB2      ARG  39  -9.998   0.400   6.228
  296    HB3  ARG  39           HB3      ARG  39  -8.985   1.675   6.908
  297    HG2  ARG  39           HG2      ARG  39 -11.416   2.307   7.994
  298    HG3  ARG  39           HG3      ARG  39 -11.619   0.574   7.824
  299    HD2  ARG  39           HD2      ARG  39  -9.550   0.184   9.128
  300    HD3  ARG  39           HD3      ARG  39  -9.262   1.939   9.207
  301    HE   ARG  39           HE       ARG  39 -11.847   1.448  10.275
  302   HH11  ARG  39          HH11      ARG  39  -8.565   0.503  11.245
  303   HH12  ARG  39          HH12      ARG  39  -8.970   0.777  12.927
  304   HH21  ARG  39          HH21      ARG  39 -12.174   1.653  12.501
  305   HH22  ARG  39          HH22      ARG  39 -10.861   1.208  13.575
  306    H    GLY  40           H        GLY  40 -11.820   3.696   3.885
  307    HA2  GLY  40           HA2      GLY  40 -14.012   1.833   3.358
  308    HA3  GLY  40           HA3      GLY  40 -14.466   3.226   4.348
  309    H    ASP  41           H        ASP  41 -11.960   3.587   1.845
  310    HA   ASP  41           HA       ASP  41 -13.856   4.798  -0.078
  311    HB2  ASP  41           HB2      ASP  41 -11.503   6.109   1.293
  312    HB3  ASP  41           HB3      ASP  41 -11.821   6.484  -0.394
  313    H    ILE  42           H        ILE  42 -12.591   5.294  -2.135
  314    HA   ILE  42           HA       ILE  42 -10.944   2.930  -2.950
  315    HB   ILE  42           HB       ILE  42 -12.777   4.620  -4.662
  316   HG12  ILE  42          HG12      ILE  42 -14.151   3.219  -3.260
  317   HG13  ILE  42          HG13      ILE  42 -14.134   2.593  -4.898
  318   HG21  ILE  42          HG21      ILE  42 -11.031   2.206  -5.331
  319   HG22  ILE  42          HG22      ILE  42 -12.296   2.870  -6.394
  320   HG23  ILE  42          HG23      ILE  42 -10.898   3.854  -5.982
  321   HD11  ILE  42          HD11      ILE  42 -12.526   0.809  -4.202
  322   HD12  ILE  42          HD12      ILE  42 -12.619   1.429  -2.533
  323   HD13  ILE  42          HD13      ILE  42 -14.054   0.760  -3.308
  324    H    ILE  43           H        ILE  43  -8.851   3.404  -3.313
  325    HA   ILE  43           HA       ILE  43  -8.023   6.180  -3.852
  326    HB   ILE  43           HB       ILE  43  -6.546   3.797  -2.668
  327   HG12  ILE  43          HG12      ILE  43  -8.321   4.256  -1.125
  328   HG13  ILE  43          HG13      ILE  43  -6.814   4.827  -0.446
  329   HG21  ILE  43          HG21      ILE  43  -5.018   5.478  -3.576
  330   HG22  ILE  43          HG22      ILE  43  -5.815   6.753  -2.639
  331   HG23  ILE  43          HG23      ILE  43  -4.935   5.451  -1.817
  332   HD11  ILE  43          HD11      ILE  43  -8.915   6.620  -1.750
  333   HD12  ILE  43          HD12      ILE  43  -8.697   6.371  -0.022
  334   HD13  ILE  43          HD13      ILE  43  -7.415   7.160  -0.965
  335    H    LYS  44           H        LYS  44  -7.153   6.648  -5.795
  336    HA   LYS  44           HA       LYS  44  -6.404   4.475  -7.629
  337    HB2  LYS  44           HB2      LYS  44  -6.725   7.444  -8.080
  338    HB3  LYS  44           HB3      LYS  44  -6.251   6.259  -9.310
  339    HG2  LYS  44           HG2      LYS  44  -8.342   4.917  -8.657
  340    HG3  LYS  44           HG3      LYS  44  -8.844   6.321  -7.712
  341    HD2  LYS  44           HD2      LYS  44  -9.969   6.495  -9.762
  342    HD3  LYS  44           HD3      LYS  44  -8.638   7.674  -9.865
  343    HE2  LYS  44           HE2      LYS  44  -7.334   6.204 -11.253
  344    HE3  LYS  44           HE3      LYS  44  -8.488   4.877 -11.015
  345    HZ1  LYS  44           HZ1      LYS  44 -10.129   6.083 -12.228
  346    HZ2  LYS  44           HZ2      LYS  44  -9.216   7.426 -12.323
  347    HZ3  LYS  44           HZ3      LYS  44  -8.746   6.082 -13.156
  348    H    VAL  45           H        VAL  45  -4.473   3.945  -8.416
  349    HA   VAL  45           HA       VAL  45  -2.085   5.508  -7.537
  350    HB   VAL  45           HB       VAL  45  -2.592   3.215  -6.495
  351   HG11  VAL  45          HG11      VAL  45  -1.429   2.220  -9.137
  352   HG12  VAL  45          HG12      VAL  45  -1.779   1.255  -7.693
  353   HG13  VAL  45          HG13      VAL  45  -3.104   2.035  -8.583
  354   HG21  VAL  45          HG21      VAL  45  -0.238   2.613  -6.340
  355   HG22  VAL  45          HG22      VAL  45   0.162   3.606  -7.756
  356   HG23  VAL  45          HG23      VAL  45  -0.410   4.369  -6.259
  357    H    VAL  46           H        VAL  46  -0.353   5.791  -8.931
  358    HA   VAL  46           HA       VAL  46  -0.608   4.796 -11.740
  359    HB   VAL  46           HB       VAL  46   0.563   6.770 -12.467
  360   HG11  VAL  46          HG11      VAL  46  -1.673   7.653 -10.623
  361   HG12  VAL  46          HG12      VAL  46  -1.072   8.455 -12.086
  362   HG13  VAL  46          HG13      VAL  46  -1.896   6.891 -12.218
  363   HG21  VAL  46          HG21      VAL  46   2.047   7.171 -10.529
  364   HG22  VAL  46          HG22      VAL  46   1.164   8.614 -11.028
  365   HG23  VAL  46          HG23      VAL  46   0.641   7.723  -9.586
  366    HA   PRO  47           HA       PRO  47   3.306   2.757 -11.567
  367    HB2  PRO  47           HB2      PRO  47   4.357   4.319 -13.905
  368    HB3  PRO  47           HB3      PRO  47   4.224   2.547 -13.684
  369    HG2  PRO  47           HG2      PRO  47   2.506   3.923 -15.290
  370    HG3  PRO  47           HG3      PRO  47   1.960   2.549 -14.289
  371    HD2  PRO  47           HD2      PRO  47   1.672   5.486 -13.764
  372    HD3  PRO  47           HD3      PRO  47   0.490   4.169 -13.504
  373    H    GLY  48           H        GLY  48   4.873   3.069 -10.184
  374    HA2  GLY  48           HA2      GLY  48   6.805   3.980  -9.167
  375    HA3  GLY  48           HA3      GLY  48   6.573   5.484 -10.056
  376    H    GLY  49           H        GLY  49   3.601   5.396  -8.943
  377    HA2  GLY  49           HA2      GLY  49   4.028   7.303  -6.944
  378    HA3  GLY  49           HA3      GLY  49   2.490   6.556  -7.361
  379    H    LYS  50           H        LYS  50   4.145   3.986  -6.404
  380    HA   LYS  50           HA       LYS  50   4.167   2.567  -4.610
  381    HB2  LYS  50           HB2      LYS  50   4.527   5.108  -2.996
  382    HB3  LYS  50           HB3      LYS  50   4.757   3.472  -2.385
  383    HG2  LYS  50           HG2      LYS  50   6.622   3.060  -3.776
  384    HG3  LYS  50           HG3      LYS  50   6.360   4.519  -4.745
  385    HD2  LYS  50           HD2      LYS  50   6.885   5.968  -2.919
  386    HD3  LYS  50           HD3      LYS  50   6.926   4.638  -1.756
  387    HE2  LYS  50           HE2      LYS  50   8.906   3.701  -2.708
  388    HE3  LYS  50           HE3      LYS  50   8.792   4.728  -4.152
  389    HZ1  LYS  50           HZ1      LYS  50  10.462   5.551  -2.620
  390    HZ2  LYS  50           HZ2      LYS  50   9.235   6.639  -2.739
  391    HZ3  LYS  50           HZ3      LYS  50   9.378   5.675  -1.409
  392    H    PHE  51           H        PHE  51   3.124   1.660  -2.780
  393    HA   PHE  51           HA       PHE  51   0.235   2.328  -2.645
  394    HB2  PHE  51           HB2      PHE  51   1.809  -0.059  -1.652
  395    HB3  PHE  51           HB3      PHE  51   0.089   0.177  -1.394
  396    HD1  PHE  51           HD1      PHE  51  -1.520   0.137  -3.318
  397    HD2  PHE  51           HD2      PHE  51   2.655  -0.811  -3.798
  398    HE1  PHE  51           HE1      PHE  51  -2.011  -0.959  -5.492
  399    HE2  PHE  51           HE2      PHE  51   2.168  -1.887  -5.964
  400    HZ   PHE  51           HZ       PHE  51  -0.170  -1.969  -6.826
  401    HA   PRO  52           HA       PRO  52   1.333   4.190   1.350
  402    HB2  PRO  52           HB2      PRO  52  -0.800   5.815   1.728
  403    HB3  PRO  52           HB3      PRO  52   0.410   6.121   0.449
  404    HG2  PRO  52           HG2      PRO  52  -2.294   4.787   0.171
  405    HG3  PRO  52           HG3      PRO  52  -1.578   6.071  -0.852
  406    HD2  PRO  52           HD2      PRO  52  -1.479   3.390  -1.498
  407    HD3  PRO  52           HD3      PRO  52  -0.216   4.563  -1.976
  408    H    VAL  53           H        VAL  53  -1.179   1.909   0.849
  409    HA   VAL  53           HA       VAL  53  -1.588   1.390   3.694
  410    HB   VAL  53           HB       VAL  53  -4.062   1.338   3.477
  411   HG11  VAL  53          HG11      VAL  53  -2.886   4.129   3.168
  412   HG12  VAL  53          HG12      VAL  53  -4.406   3.675   3.970
  413   HG13  VAL  53          HG13      VAL  53  -2.854   3.168   4.658
  414   HG21  VAL  53          HG21      VAL  53  -5.181   2.695   1.799
  415   HG22  VAL  53          HG22      VAL  53  -3.634   3.084   1.028
  416   HG23  VAL  53          HG23      VAL  53  -4.243   1.411   1.008
  417    H    ASP  54           H        ASP  54  -3.066  -0.668   3.910
  418    HA   ASP  54           HA       ASP  54  -2.451  -2.485   1.640
  419    HB2  ASP  54           HB2      ASP  54  -1.929  -4.210   2.924
  420    HB3  ASP  54           HB3      ASP  54  -1.259  -2.905   3.874
  421    H    GLY  55           H        GLY  55  -3.909  -3.993   0.894
  422    HA2  GLY  55           HA2      GLY  55  -6.574  -4.411   1.664
  423    HA3  GLY  55           HA3      GLY  55  -6.589  -2.895   0.765
  424    H    ARG  56           H        ARG  56  -7.994  -3.993  -0.677
  425    HA   ARG  56           HA       ARG  56  -6.706  -5.938  -2.556
  426    HB2  ARG  56           HB2      ARG  56  -8.736  -6.670  -1.268
  427    HB3  ARG  56           HB3      ARG  56  -9.686  -5.511  -2.203
  428    HG2  ARG  56           HG2      ARG  56  -9.118  -6.699  -4.292
  429    HG3  ARG  56           HG3      ARG  56  -8.019  -7.756  -3.403
  430    HD2  ARG  56           HD2      ARG  56  -9.980  -9.003  -3.850
  431    HD3  ARG  56           HD3      ARG  56  -9.919  -8.686  -2.127
  432    HE   ARG  56           HE       ARG  56 -11.907  -7.778  -4.078
  433   HH11  ARG  56          HH11      ARG  56 -10.986  -7.754  -0.676
  434   HH12  ARG  56          HH12      ARG  56 -12.388  -6.775  -0.257
  435   HH21  ARG  56          HH21      ARG  56 -13.725  -6.620  -3.388
  436   HH22  ARG  56          HH22      ARG  56 -13.985  -6.495  -1.681
  437    H    VAL  57           H        VAL  57  -6.699  -5.743  -4.675
  438    HA   VAL  57           HA       VAL  57  -7.218  -3.122  -5.998
  439    HB   VAL  57           HB       VAL  57  -5.683  -5.615  -6.895
  440   HG11  VAL  57          HG11      VAL  57  -6.025  -2.911  -8.248
  441   HG12  VAL  57          HG12      VAL  57  -4.887  -4.181  -8.767
  442   HG13  VAL  57          HG13      VAL  57  -6.611  -4.481  -8.843
  443   HG21  VAL  57          HG21      VAL  57  -4.563  -2.904  -6.106
  444   HG22  VAL  57          HG22      VAL  57  -4.461  -4.385  -5.131
  445   HG23  VAL  57          HG23      VAL  57  -3.648  -4.307  -6.694
  446    H    ILE  58           H        ILE  58  -9.007  -3.048  -7.374
  447    HA   ILE  58           HA       ILE  58 -10.037  -5.621  -8.529
  448    HB   ILE  58           HB       ILE  58 -12.414  -4.715  -8.013
  449   HG12  ILE  58          HG12      ILE  58 -10.944  -3.372  -5.719
  450   HG13  ILE  58          HG13      ILE  58 -11.430  -2.474  -7.172
  451   HG21  ILE  58          HG21      ILE  58 -10.782  -5.791  -5.693
  452   HG22  ILE  58          HG22      ILE  58 -12.529  -5.934  -5.942
  453   HG23  ILE  58          HG23      ILE  58 -11.427  -6.768  -7.033
  454   HD11  ILE  58          HD11      ILE  58 -13.324  -3.867  -5.241
  455   HD12  ILE  58          HD12      ILE  58 -13.082  -2.123  -5.453
  456   HD13  ILE  58          HD13      ILE  58 -13.799  -3.074  -6.768
  457    H    GLU  59           H        GLU  59  -8.547  -3.270  -9.596
  458    HA   GLU  59           HA       GLU  59  -9.813  -3.435 -12.161
  459    HB2  GLU  59           HB2      GLU  59 -10.654  -1.223 -10.565
  460    HB3  GLU  59           HB3      GLU  59  -9.457  -0.565 -11.659
  461    HG2  GLU  59           HG2      GLU  59 -11.993  -2.063 -12.360
  462    HG3  GLU  59           HG3      GLU  59 -11.700  -0.343 -12.563
  463    H    GLY  60           H        GLY  60  -8.223  -3.256 -13.712
  464    HA2  GLY  60           HA2      GLY  60  -6.252  -2.575 -14.723
  465    HA3  GLY  60           HA3      GLY  60  -5.778  -1.704 -13.270
  466    H    HIS  61           H        HIS  61  -3.812  -2.713 -14.208
  467    HA   HIS  61           HA       HIS  61  -3.095  -5.238 -12.811
  468    HB2  HIS  61           HB2      HIS  61  -1.991  -6.136 -14.830
  469    HB3  HIS  61           HB3      HIS  61  -3.742  -6.061 -14.941
  470    HD1  HIS  61           HD1      HIS  61  -1.923  -2.809 -15.737
  471    HD2  HIS  61           HD2      HIS  61  -3.484  -6.213 -17.644
  472    HE1  HIS  61           HE1      HIS  61  -2.102  -2.225 -18.224
  473    H    SER  62           H        SER  62  -1.019  -5.353 -12.066
  474    HA   SER  62           HA       SER  62   1.005  -3.495 -13.032
  475    HB2  SER  62           HB2      SER  62  -0.123  -3.239 -10.244
  476    HB3  SER  62           HB3      SER  62   1.506  -2.683 -10.629
  477    HG   SER  62           HG       SER  62  -0.569  -1.971 -12.371
  478    H    MET  63           H        MET  63   3.138  -3.854 -12.218
  479    HA   MET  63           HA       MET  63   3.546  -6.482 -10.903
  480    HB2  MET  63           HB2      MET  63   4.477  -6.460 -13.157
  481    HB3  MET  63           HB3      MET  63   5.444  -5.025 -12.779
  482    HG2  MET  63           HG2      MET  63   6.824  -6.178 -11.288
  483    HG3  MET  63           HG3      MET  63   5.661  -7.476 -11.020
  484    HE1  MET  63           HE1      MET  63   6.079  -9.946 -13.833
  485    HE2  MET  63           HE2      MET  63   5.516  -9.626 -12.178
  486    HE3  MET  63           HE3      MET  63   4.770  -8.782 -13.554
  487    H    VAL  64           H        VAL  64   4.465  -6.417  -8.995
  488    HA   VAL  64           HA       VAL  64   5.167  -3.775  -7.830
  489    HB   VAL  64           HB       VAL  64   3.580  -6.050  -6.590
  490   HG11  VAL  64          HG11      VAL  64   4.257  -3.288  -5.485
  491   HG12  VAL  64          HG12      VAL  64   3.074  -4.406  -4.785
  492   HG13  VAL  64          HG13      VAL  64   4.777  -4.857  -4.828
  493   HG21  VAL  64          HG21      VAL  64   2.213  -4.937  -8.242
  494   HG22  VAL  64          HG22      VAL  64   1.718  -4.323  -6.662
  495   HG23  VAL  64          HG23      VAL  64   2.762  -3.335  -7.707
  496    H    ASP  65           H        ASP  65   6.829  -3.543  -6.455
  497    HA   ASP  65           HA       ASP  65   8.674  -5.810  -5.985
  498    HB2  ASP  65           HB2      ASP  65   9.419  -3.615  -6.962
  499    HB3  ASP  65           HB3      ASP  65   8.962  -2.826  -5.456
  500    H    GLU  66           H        GLU  66   7.917  -7.013  -4.293
  501    HA   GLU  66           HA       GLU  66   7.501  -5.670  -1.660
  502    HB2  GLU  66           HB2      GLU  66   5.748  -7.243  -1.092
  503    HB3  GLU  66           HB3      GLU  66   5.310  -6.208  -2.444
  504    HG2  GLU  66           HG2      GLU  66   5.495  -7.988  -4.016
  505    HG3  GLU  66           HG3      GLU  66   6.368  -9.020  -2.876
  506    H    SER  67           H        SER  67   9.542  -7.700  -3.186
  507    HA   SER  67           HA       SER  67  10.147  -9.865  -1.614
  508    HB2  SER  67           HB2      SER  67  12.540  -9.522  -2.180
  509    HB3  SER  67           HB3      SER  67  11.477  -9.343  -3.576
  510    HG   SER  67           HG       SER  67  13.250  -7.693  -3.027
  511    H    LEU  68           H        LEU  68  10.725  -6.543  -0.565
  512    HA   LEU  68           HA       LEU  68  12.278  -7.321   1.797
  513    HB2  LEU  68           HB2      LEU  68  12.589  -5.216   0.541
  514    HB3  LEU  68           HB3      LEU  68  10.960  -4.705   0.913
  515    HG   LEU  68           HG       LEU  68  12.815  -3.574   2.135
  516   HD11  LEU  68          HD11      LEU  68  10.907  -4.891   4.088
  517   HD12  LEU  68          HD12      LEU  68  11.714  -3.328   4.217
  518   HD13  LEU  68          HD13      LEU  68  10.465  -3.570   2.983
  519   HD21  LEU  68          HD21      LEU  68  14.236  -5.553   2.573
  520   HD22  LEU  68          HD22      LEU  68  13.900  -4.604   4.033
  521   HD23  LEU  68          HD23      LEU  68  13.046  -6.130   3.761
  522    H    ILE  69           H        ILE  69   8.886  -6.645   1.081
  523    HA   ILE  69           HA       ILE  69   7.994  -6.320   3.822
  524    HB   ILE  69           HB       ILE  69   6.315  -6.860   1.340
  525   HG12  ILE  69          HG12      ILE  69   7.824  -4.849   0.983
  526   HG13  ILE  69          HG13      ILE  69   6.108  -4.657   0.770
  527   HG21  ILE  69          HG21      ILE  69   5.022  -7.158   3.337
  528   HG22  ILE  69          HG22      ILE  69   5.690  -5.690   4.077
  529   HG23  ILE  69          HG23      ILE  69   4.595  -5.571   2.695
  530   HD11  ILE  69          HD11      ILE  69   5.879  -3.540   2.924
  531   HD12  ILE  69          HD12      ILE  69   7.621  -3.768   3.248
  532   HD13  ILE  69          HD13      ILE  69   7.065  -2.742   1.897
  533    H    THR  70           H        THR  70   7.130  -8.752   1.309
  534    HA   THR  70           HA       THR  70   6.168 -10.650   3.316
  535    HB   THR  70           HB       THR  70   5.613 -11.961   1.160
  536    HG1  THR  70           HG1      THR  70   5.472 -10.336  -0.626
  537   HG21  THR  70          HG21      THR  70   3.666 -10.590   0.724
  538   HG22  THR  70          HG22      THR  70   3.988 -10.555   2.460
  539   HG23  THR  70          HG23      THR  70   4.436  -9.160   1.449
  540    H    GLY  71           H        GLY  71   9.134 -10.129   1.756
  541    HA2  GLY  71           HA2      GLY  71  11.148 -11.164   2.291
  542    HA3  GLY  71           HA3      GLY  71  10.290 -12.519   3.045
  543    H    GLU  72           H        GLU  72   9.512 -11.466  -0.106
  544    HA   GLU  72           HA       GLU  72  10.196 -14.087  -1.367
  545    HB2  GLU  72           HB2      GLU  72   8.822 -11.681  -2.607
  546    HB3  GLU  72           HB3      GLU  72   8.979 -13.285  -3.317
  547    HG2  GLU  72           HG2      GLU  72   7.357 -12.538  -0.852
  548    HG3  GLU  72           HG3      GLU  72   6.730 -12.969  -2.438
  549    H    ALA  73           H        ALA  73  10.879 -13.135  -4.023
  550    HA   ALA  73           HA       ALA  73  13.486 -11.817  -3.600
  551    HB1  ALA  73           HB1      ALA  73  13.332 -14.706  -4.540
  552    HB2  ALA  73           HB2      ALA  73  14.801 -13.716  -4.343
  553    HB3  ALA  73           HB3      ALA  73  13.853 -14.168  -2.925
  554    H    MET  74           H        MET  74  10.896 -11.654  -5.393
  555    HA   MET  74           HA       MET  74  12.208 -10.775  -7.819
  556    HB2  MET  74           HB2      MET  74  11.070 -12.248  -9.317
  557    HB3  MET  74           HB3      MET  74  12.013 -13.220  -8.211
  558    HG2  MET  74           HG2      MET  74   9.009 -12.761  -8.010
  559    HG3  MET  74           HG3      MET  74   9.767 -14.152  -8.753
  560    HE1  MET  74           HE1      MET  74  11.193 -16.224  -5.828
  561    HE2  MET  74           HE2      MET  74  10.805 -16.164  -7.558
  562    HE3  MET  74           HE3      MET  74  12.077 -15.112  -6.892
  563    HA   PRO  75           HA       PRO  75   8.610  -8.101  -7.848
  564    HB2  PRO  75           HB2      PRO  75   8.742  -8.433 -10.841
  565    HB3  PRO  75           HB3      PRO  75   8.552  -6.929  -9.878
  566    HG2  PRO  75           HG2      PRO  75  10.961  -7.573 -10.934
  567    HG3  PRO  75           HG3      PRO  75  10.856  -6.966  -9.248
  568    HD2  PRO  75           HD2      PRO  75  11.146  -9.835 -10.187
  569    HD3  PRO  75           HD3      PRO  75  11.972  -8.967  -8.862
  570    H    VAL  76           H        VAL  76   6.430  -8.289  -7.855
  571    HA   VAL  76           HA       VAL  76   5.240 -10.949  -8.527
  572    HB   VAL  76           HB       VAL  76   4.659  -8.926  -6.327
  573   HG11  VAL  76          HG11      VAL  76   3.317 -11.593  -6.865
  574   HG12  VAL  76          HG12      VAL  76   3.120 -10.622  -5.392
  575   HG13  VAL  76          HG13      VAL  76   2.538 -10.000  -6.939
  576   HG21  VAL  76          HG21      VAL  76   6.688 -10.237  -5.897
  577   HG22  VAL  76          HG22      VAL  76   5.398 -10.777  -4.824
  578   HG23  VAL  76          HG23      VAL  76   5.822 -11.747  -6.250
  579    H    ALA  77           H        ALA  77   3.331 -11.105  -9.692
  580    HA   ALA  77           HA       ALA  77   2.282  -8.655 -10.935
  581    HB1  ALA  77           HB1      ALA  77   1.052 -10.215 -12.355
  582    HB2  ALA  77           HB2      ALA  77   2.772 -10.647 -12.288
  583    HB3  ALA  77           HB3      ALA  77   1.580 -11.582 -11.353
  584    H    LYS  78           H        LYS  78   0.478  -7.658 -10.485
  585    HA   LYS  78           HA       LYS  78  -1.632  -8.837  -8.709
  586    HB2  LYS  78           HB2      LYS  78  -0.726  -5.937  -8.760
  587    HB3  LYS  78           HB3      LYS  78  -1.944  -6.635  -7.699
  588    HG2  LYS  78           HG2      LYS  78   1.020  -7.337  -7.649
  589    HG3  LYS  78           HG3      LYS  78   0.237  -6.122  -6.650
  590    HD2  LYS  78           HD2      LYS  78  -1.169  -7.896  -5.602
  591    HD3  LYS  78           HD3      LYS  78  -0.316  -9.126  -6.566
  592    HE2  LYS  78           HE2      LYS  78   1.842  -8.444  -5.567
  593    HE3  LYS  78           HE3      LYS  78   1.044  -7.133  -4.700
  594    HZ1  LYS  78           HZ1      LYS  78   0.589 -10.022  -4.207
  595    HZ2  LYS  78           HZ2      LYS  78   1.432  -8.966  -3.252
  596    HZ3  LYS  78           HZ3      LYS  78  -0.201  -8.789  -3.443
  597    H    LYS  79           H        LYS  79  -3.726  -8.346  -9.252
  598    HA   LYS  79           HA       LYS  79  -4.407  -6.899 -11.743
  599    HB2  LYS  79           HB2      LYS  79  -5.020  -8.885 -12.935
  600    HB3  LYS  79           HB3      LYS  79  -3.429  -9.130 -12.307
  601    HG2  LYS  79           HG2      LYS  79  -4.425 -10.417 -10.348
  602    HG3  LYS  79           HG3      LYS  79  -6.011 -10.247 -11.108
  603    HD2  LYS  79           HD2      LYS  79  -5.056 -12.423 -11.573
  604    HD3  LYS  79           HD3      LYS  79  -5.216 -11.497 -13.080
  605    HE2  LYS  79           HE2      LYS  79  -2.870 -11.013 -13.148
  606    HE3  LYS  79           HE3      LYS  79  -2.633 -11.588 -11.484
  607    HZ1  LYS  79           HZ1      LYS  79  -3.339 -13.302 -13.804
  608    HZ2  LYS  79           HZ2      LYS  79  -1.884 -13.235 -13.082
  609    HZ3  LYS  79           HZ3      LYS  79  -3.169 -13.826 -12.238
  610    HA   PRO  80           HA       PRO  80  -8.235  -6.405  -9.664
  611    HB2  PRO  80           HB2      PRO  80 -10.391  -7.200 -11.154
  612    HB3  PRO  80           HB3      PRO  80  -9.372  -5.784 -11.549
  613    HG2  PRO  80           HG2      PRO  80  -9.287  -8.530 -12.765
  614    HG3  PRO  80           HG3      PRO  80  -9.121  -6.949 -13.568
  615    HD2  PRO  80           HD2      PRO  80  -7.029  -8.608 -12.829
  616    HD3  PRO  80           HD3      PRO  80  -6.846  -6.843 -13.048
  617    H    GLY  81           H        GLY  81  -9.166  -7.309  -7.949
  618    HA2  GLY  81           HA2      GLY  81 -10.077  -8.946  -6.536
  619    HA3  GLY  81           HA3      GLY  81  -9.652 -10.217  -7.682
  620    H    SER  82           H        SER  82  -6.991  -7.985  -7.013
  621    HA   SER  82           HA       SER  82  -5.616 -10.275  -5.658
  622    HB2  SER  82           HB2      SER  82  -4.762  -9.492  -7.911
  623    HB3  SER  82           HB3      SER  82  -4.404  -7.931  -7.156
  624    HG   SER  82           HG       SER  82  -3.327 -10.488  -6.489
  625    H    THR  83           H        THR  83  -4.087  -9.773  -3.864
  626    HA   THR  83           HA       THR  83  -4.895  -7.300  -2.401
  627    HB   THR  83           HB       THR  83  -4.160  -8.470  -0.347
  628    HG1  THR  83           HG1      THR  83  -3.995 -10.658  -0.402
  629   HG21  THR  83          HG21      THR  83  -6.204  -9.792  -0.147
  630   HG22  THR  83          HG22      THR  83  -6.544  -8.299  -1.027
  631   HG23  THR  83          HG23      THR  83  -6.396  -9.838  -1.911
  632    H    VAL  84           H        VAL  84  -3.482  -6.040  -1.313
  633    HA   VAL  84           HA       VAL  84  -0.599  -6.213  -2.027
  634    HB   VAL  84           HB       VAL  84  -0.621  -3.807  -2.648
  635   HG11  VAL  84          HG11      VAL  84  -2.361  -5.542  -4.438
  636   HG12  VAL  84          HG12      VAL  84  -1.439  -4.099  -4.915
  637   HG13  VAL  84          HG13      VAL  84  -0.586  -5.549  -4.365
  638   HG21  VAL  84          HG21      VAL  84  -2.685  -2.691  -3.312
  639   HG22  VAL  84          HG22      VAL  84  -3.655  -4.079  -2.785
  640   HG23  VAL  84          HG23      VAL  84  -2.761  -3.111  -1.594
  641    H    ILE  85           H        ILE  85   0.737  -4.688  -0.905
  642    HA   ILE  85           HA       ILE  85  -0.253  -3.851   1.758
  643    HB   ILE  85           HB       ILE  85   2.232  -4.522   2.485
  644   HG12  ILE  85          HG12      ILE  85   2.826  -6.773   1.696
  645   HG13  ILE  85          HG13      ILE  85   1.549  -6.738   0.487
  646   HG21  ILE  85          HG21      ILE  85  -0.118  -6.445   2.421
  647   HG22  ILE  85          HG22      ILE  85   1.297  -6.530   3.497
  648   HG23  ILE  85          HG23      ILE  85   0.186  -5.165   3.626
  649   HD11  ILE  85          HD11      ILE  85   3.807  -6.207  -0.425
  650   HD12  ILE  85          HD12      ILE  85   2.656  -4.888  -0.675
  651   HD13  ILE  85          HD13      ILE  85   3.860  -4.757   0.611
  652    H    ALA  86           H        ALA  86   0.655  -2.192   2.801
  653    HA   ALA  86           HA       ALA  86   1.410   0.031   1.250
  654    HB1  ALA  86           HB1      ALA  86   0.265   0.110   3.453
  655    HB2  ALA  86           HB2      ALA  86   1.736  -0.464   4.244
  656    HB3  ALA  86           HB3      ALA  86   1.717   1.124   3.439
  657    H    GLY  87           H        GLY  87   3.341   1.178   1.033
  658    HA2  GLY  87           HA2      GLY  87   5.618   1.652   1.124
  659    HA3  GLY  87           HA3      GLY  87   5.869   0.297   2.225
  660    H    SER  88           H        SER  88   4.248  -1.062  -0.315
  661    HA   SER  88           HA       SER  88   6.685  -1.987  -1.695
  662    HB2  SER  88           HB2      SER  88   5.275  -3.541  -2.857
  663    HB3  SER  88           HB3      SER  88   4.978  -3.642  -1.124
  664    HG   SER  88           HG       SER  88   3.004  -2.640  -1.409
  665    H    ILE  89           H        ILE  89   6.847  -1.936  -4.037
  666    HA   ILE  89           HA       ILE  89   6.049   0.778  -4.993
  667    HB   ILE  89           HB       ILE  89   8.293  -0.789  -6.230
  668   HG12  ILE  89          HG12      ILE  89   8.897  -0.898  -3.860
  669   HG13  ILE  89          HG13      ILE  89   9.964   0.128  -4.788
  670   HG21  ILE  89          HG21      ILE  89   9.130   1.520  -6.657
  671   HG22  ILE  89          HG22      ILE  89   7.547   1.212  -7.371
  672   HG23  ILE  89          HG23      ILE  89   7.673   2.176  -5.885
  673   HD11  ILE  89          HD11      ILE  89   7.737   1.147  -2.975
  674   HD12  ILE  89          HD12      ILE  89   9.467   1.121  -2.604
  675   HD13  ILE  89          HD13      ILE  89   8.884   2.137  -3.919
  676    H    ASN  90           H        ASN  90   4.687   0.941  -6.669
  677    HA   ASN  90           HA       ASN  90   4.086  -1.366  -8.458
  678    HB2  ASN  90           HB2      ASN  90   2.181  -0.042  -7.691
  679    HB3  ASN  90           HB3      ASN  90   2.973   1.460  -8.164
  680   HD21  ASN  90          HD22      ASN  90   0.608   1.423  -9.065
  681   HD22  ASN  90          HD21      ASN  90   0.568   0.978 -10.772
  682    H    GLN  91           H        GLN  91   5.140  -1.609 -10.384
  683    HA   GLN  91           HA       GLN  91   6.396   0.774 -11.607
  684    HB2  GLN  91           HB2      GLN  91   8.037  -0.652 -10.167
  685    HB3  GLN  91           HB3      GLN  91   7.925  -1.834 -11.478
  686    HG2  GLN  91           HG2      GLN  91   9.566  -0.578 -12.460
  687    HG3  GLN  91           HG3      GLN  91   8.237   0.513 -12.895
  688   HE21  GLN  91          HE22      GLN  91   7.940   2.470 -11.619
  689   HE22  GLN  91          HE21      GLN  91   9.184   3.041 -10.518
  690    H    ASN  92           H        ASN  92   4.065  -0.097 -12.519
  691    HA   ASN  92           HA       ASN  92   4.719  -0.870 -15.254
  692    HB2  ASN  92           HB2      ASN  92   4.625  -3.078 -13.884
  693    HB3  ASN  92           HB3      ASN  92   2.883  -2.800 -13.805
  694   HD21  ASN  92          HD22      ASN  92   2.147  -4.517 -15.197
  695   HD22  ASN  92          HD21      ASN  92   2.747  -4.644 -16.831
  696    H    GLY  93           H        GLY  93   1.898  -0.255 -13.015
  697    HA2  GLY  93           HA2      GLY  93   0.451   0.901 -15.347
  698    HA3  GLY  93           HA3      GLY  93  -0.182  -0.594 -14.675
  699    H    SER  94           H        SER  94  -2.012   1.109 -14.689
  700    HA   SER  94           HA       SER  94  -2.066   2.681 -12.133
  701    HB2  SER  94           HB2      SER  94  -3.564   3.177 -14.727
  702    HB3  SER  94           HB3      SER  94  -3.771   4.081 -13.223
  703    HG   SER  94           HG       SER  94  -1.519   3.944 -14.917
  704    H    LEU  95           H        LEU  95  -3.365   1.949 -10.586
  705    HA   LEU  95           HA       LEU  95  -5.624   0.102 -11.253
  706    HB2  LEU  95           HB2      LEU  95  -4.132   0.114  -8.658
  707    HB3  LEU  95           HB3      LEU  95  -5.098  -1.151  -9.330
  708    HG   LEU  95           HG       LEU  95  -2.326  -0.363 -10.333
  709   HD11  LEU  95          HD11      LEU  95  -2.323  -1.136  -7.975
  710   HD12  LEU  95          HD12      LEU  95  -3.216  -2.593  -8.455
  711   HD13  LEU  95          HD13      LEU  95  -1.571  -2.311  -9.048
  712   HD21  LEU  95          HD21      LEU  95  -2.494  -2.702 -11.257
  713   HD22  LEU  95          HD22      LEU  95  -4.210  -2.710 -10.837
  714   HD23  LEU  95          HD23      LEU  95  -3.591  -1.530 -12.022
  715    H    LEU  96           H        LEU  96  -7.254  -0.160  -9.622
  716    HA   LEU  96           HA       LEU  96  -7.782   2.191  -7.824
  717    HB2  LEU  96           HB2      LEU  96  -9.667   0.266  -9.226
  718    HB3  LEU  96           HB3      LEU  96 -10.152   1.247  -7.861
  719    HG   LEU  96           HG       LEU  96  -9.799   3.306  -9.089
  720   HD11  LEU  96          HD11      LEU  96  -8.966   1.538 -11.425
  721   HD12  LEU  96          HD12      LEU  96  -9.519   3.202 -11.614
  722   HD13  LEU  96          HD13      LEU  96  -8.048   2.864 -10.687
  723   HD21  LEU  96          HD21      LEU  96 -11.975   2.175  -9.188
  724   HD22  LEU  96          HD22      LEU  96 -11.631   3.055 -10.679
  725   HD23  LEU  96          HD23      LEU  96 -11.459   1.289 -10.643
  726    H    ILE  97           H        ILE  97  -7.381   1.728  -5.738
  727    HA   ILE  97           HA       ILE  97  -7.634  -1.094  -4.768
  728    HB   ILE  97           HB       ILE  97  -5.945   1.135  -3.576
  729   HG12  ILE  97          HG12      ILE  97  -4.094  -0.627  -4.489
  730   HG13  ILE  97          HG13      ILE  97  -5.314  -0.863  -5.735
  731   HG21  ILE  97          HG21      ILE  97  -4.866  -0.674  -2.321
  732   HG22  ILE  97          HG22      ILE  97  -6.596  -0.672  -1.986
  733   HG23  ILE  97          HG23      ILE  97  -5.911  -1.877  -3.098
  734   HD11  ILE  97          HD11      ILE  97  -3.586   0.807  -6.320
  735   HD12  ILE  97          HD12      ILE  97  -5.192   1.542  -6.315
  736   HD13  ILE  97          HD13      ILE  97  -4.081   1.818  -4.951
  737    H    CYS  98           H        CYS  98  -9.097  -1.559  -3.191
  738    HA   CYS  98           HA       CYS  98 -10.512   0.687  -1.846
  739    HB2  CYS  98           HB2      CYS  98 -12.043  -1.010  -1.001
  740    HB3  CYS  98           HB3      CYS  98 -11.926  -1.076  -2.763
  741    HG   CYS  98           HG       CYS  98 -10.163  -2.907  -0.667
  742    H    ALA  99           H        ALA  99  -9.728   1.493   0.033
  743    HA   ALA  99           HA       ALA  99  -7.513   0.172   1.325
  744    HB1  ALA  99           HB1      ALA  99  -9.121   2.648   2.091
  745    HB2  ALA  99           HB2      ALA  99  -7.557   2.165   2.782
  746    HB3  ALA  99           HB3      ALA  99  -7.666   2.615   1.069
  747    H    THR 100           H        THR 100  -7.489  -1.177   3.039
  748    HA   THR 100           HA       THR 100 -10.019  -1.525   4.625
  749    HB   THR 100           HB       THR 100  -8.771  -3.365   2.994
  750    HG1  THR 100           HG1      THR 100 -10.632  -3.948   3.453
  751   HG21  THR 100          HG21      THR 100  -8.052  -4.225   5.815
  752   HG22  THR 100          HG22      THR 100  -7.882  -5.153   4.318
  753   HG23  THR 100          HG23      THR 100  -6.877  -3.715   4.576
  754    H    HIS 101           H        HIS 101  -6.760  -0.525   4.961
  755    HA   HIS 101           HA       HIS 101  -7.289  -0.163   7.844
  756    HB2  HIS 101           HB2      HIS 101  -4.656  -1.129   6.659
  757    HB3  HIS 101           HB3      HIS 101  -4.952  -0.703   8.342
  758    HD1  HIS 101           HD1      HIS 101  -4.354  -3.691   6.588
  759    HD2  HIS 101           HD2      HIS 101  -7.407  -2.378   9.154
  760    HE1  HIS 101           HE1      HIS 101  -5.505  -5.792   7.467
  761    H    VAL 102           H        VAL 102  -6.504   1.845   8.561
  762    HA   VAL 102           HA       VAL 102  -5.395   3.734   6.577
  763    HB   VAL 102           HB       VAL 102  -7.124   4.406   8.241
  764   HG11  VAL 102          HG11      VAL 102  -4.866   4.208  10.281
  765   HG12  VAL 102          HG12      VAL 102  -6.450   4.969  10.528
  766   HG13  VAL 102          HG13      VAL 102  -6.360   3.233  10.248
  767   HG21  VAL 102          HG21      VAL 102  -6.154   6.565   8.652
  768   HG22  VAL 102          HG22      VAL 102  -4.525   5.946   8.380
  769   HG23  VAL 102          HG23      VAL 102  -5.703   5.984   7.042
  770    H    GLY 103           H        GLY 103  -3.122   4.907   7.428
  771    HA2  GLY 103           HA2      GLY 103  -1.317   2.763   6.869
  772    HA3  GLY 103           HA3      GLY 103  -0.887   4.393   7.300
  773    H    ALA 104           H        ALA 104  -2.014   4.517   9.931
  774    HA   ALA 104           HA       ALA 104  -0.034   3.154  11.512
  775    HB1  ALA 104           HB1      ALA 104  -2.668   4.462  12.336
  776    HB2  ALA 104           HB2      ALA 104  -1.301   4.086  13.405
  777    HB3  ALA 104           HB3      ALA 104  -1.114   5.299  12.124
  778    H    ASP 105           H        ASP 105  -3.287   2.264  10.600
  779    HA   ASP 105           HA       ASP 105  -3.601  -0.004  12.437
  780    HB2  ASP 105           HB2      ASP 105  -5.445   1.550  11.836
  781    HB3  ASP 105           HB3      ASP 105  -5.331   1.018  10.160
  782    H    THR 106           H        THR 106  -1.980   0.382   9.464
  783    HA   THR 106           HA       THR 106  -2.803  -1.985   8.072
  784    HB   THR 106           HB       THR 106  -0.714  -1.782   6.761
  785    HG1  THR 106           HG1      THR 106  -0.113   0.503   8.271
  786   HG21  THR 106          HG21      THR 106  -2.263   0.767   7.032
  787   HG22  THR 106          HG22      THR 106  -1.061   0.433   5.768
  788   HG23  THR 106          HG23      THR 106  -2.526  -0.561   5.901
  789    H    THR 107           H        THR 107  -1.720  -3.924   7.605
  790    HA   THR 107           HA       THR 107  -0.555  -5.316   9.814
  791    HB   THR 107           HB       THR 107  -1.659  -6.382   7.892
  792    HG1  THR 107           HG1      THR 107  -0.376  -7.568   9.234
  793   HG21  THR 107          HG21      THR 107  -0.500  -6.880   5.842
  794   HG22  THR 107          HG22      THR 107  -0.556  -5.122   6.026
  795   HG23  THR 107          HG23      THR 107   0.952  -6.009   6.371
  796    H    LEU 108           H        LEU 108   0.995  -3.375   7.298
  797    HA   LEU 108           HA       LEU 108   3.730  -3.990   7.742
  798    HB2  LEU 108           HB2      LEU 108   2.650  -2.565   5.896
  799    HB3  LEU 108           HB3      LEU 108   2.441  -1.300   7.091
  800    HG   LEU 108           HG       LEU 108   5.070  -1.534   7.419
  801   HD11  LEU 108          HD11      LEU 108   4.594  -2.649   4.617
  802   HD12  LEU 108          HD12      LEU 108   6.157  -2.074   5.229
  803   HD13  LEU 108          HD13      LEU 108   5.375  -3.497   5.963
  804   HD21  LEU 108          HD21      LEU 108   5.440   0.171   5.759
  805   HD22  LEU 108          HD22      LEU 108   3.952  -0.266   4.896
  806   HD23  LEU 108          HD23      LEU 108   3.862   0.449   6.525
  807    H    SER 109           H        SER 109   1.656  -1.527   9.296
  808    HA   SER 109           HA       SER 109   3.670  -0.579  11.153
  809    HB2  SER 109           HB2      SER 109   0.667  -0.162  10.967
  810    HB3  SER 109           HB3      SER 109   1.733   0.681  12.115
  811    HG   SER 109           HG       SER 109   1.228   1.555   9.807
  812    H    GLN 110           H        GLN 110   1.263  -3.141  11.284
  813    HA   GLN 110           HA       GLN 110   1.361  -3.565  14.148
  814    HB2  GLN 110           HB2      GLN 110  -0.469  -4.327  12.686
  815    HB3  GLN 110           HB3      GLN 110   0.603  -5.420  11.867
  816    HG2  GLN 110           HG2      GLN 110  -0.500  -6.814  13.313
  817    HG3  GLN 110           HG3      GLN 110   1.038  -6.575  14.130
  818   HE21  GLN 110          HE22      GLN 110  -2.285  -5.265  13.911
  819   HE22  GLN 110          HE21      GLN 110  -2.379  -4.793  15.618
  820    H    ILE 111           H        ILE 111   3.107  -5.091  11.389
  821    HA   ILE 111           HA       ILE 111   4.284  -7.199  12.764
  822    HB   ILE 111           HB       ILE 111   5.230  -5.609  10.367
  823   HG12  ILE 111          HG12      ILE 111   4.258  -8.494  10.472
  824   HG13  ILE 111          HG13      ILE 111   3.109  -7.175  10.443
  825   HG21  ILE 111          HG21      ILE 111   6.503  -8.159  11.472
  826   HG22  ILE 111          HG22      ILE 111   6.808  -7.500   9.856
  827   HG23  ILE 111          HG23      ILE 111   7.296  -6.581  11.267
  828   HD11  ILE 111          HD11      ILE 111   3.425  -7.964   8.187
  829   HD12  ILE 111          HD12      ILE 111   4.114  -6.334   8.310
  830   HD13  ILE 111          HD13      ILE 111   5.182  -7.760   8.288
  831    H    VAL 112           H        VAL 112   5.910  -4.003  12.297
  832    HA   VAL 112           HA       VAL 112   8.162  -4.765  13.890
  833    HB   VAL 112           HB       VAL 112   8.814  -2.433  13.872
  834   HG11  VAL 112          HG11      VAL 112   7.673  -3.133  11.144
  835   HG12  VAL 112          HG12      VAL 112   9.086  -2.124  11.545
  836   HG13  VAL 112          HG13      VAL 112   9.136  -3.870  11.826
  837   HG21  VAL 112          HG21      VAL 112   6.652  -1.290  14.198
  838   HG22  VAL 112          HG22      VAL 112   7.474  -0.717  12.752
  839   HG23  VAL 112          HG23      VAL 112   6.104  -1.831  12.590
  840    H    LYS 113           H        LYS 113   5.051  -3.664  14.929
  841    HA   LYS 113           HA       LYS 113   5.996  -2.867  17.629
  842    HB2  LYS 113           HB2      LYS 113   3.196  -3.087  16.451
  843    HB3  LYS 113           HB3      LYS 113   3.552  -2.720  18.138
  844    HG2  LYS 113           HG2      LYS 113   5.050  -0.782  17.216
  845    HG3  LYS 113           HG3      LYS 113   4.226  -1.060  15.691
  846    HD2  LYS 113           HD2      LYS 113   2.959   0.652  16.678
  847    HD3  LYS 113           HD3      LYS 113   2.013  -0.808  17.038
  848    HE2  LYS 113           HE2      LYS 113   3.327  -0.922  19.243
  849    HE3  LYS 113           HE3      LYS 113   3.985   0.667  18.839
  850    HZ1  LYS 113           HZ1      LYS 113   2.007   0.858  20.272
  851    HZ2  LYS 113           HZ2      LYS 113   1.676   1.505  18.793
  852    HZ3  LYS 113           HZ3      LYS 113   1.106   0.023  19.194
  853    H    LEU 114           H        LEU 114   4.578  -5.656  15.996
  854    HA   LEU 114           HA       LEU 114   4.159  -7.244  18.375
  855    HB2  LEU 114           HB2      LEU 114   3.254  -7.373  15.852
  856    HB3  LEU 114           HB3      LEU 114   4.627  -8.470  15.665
  857    HG   LEU 114           HG       LEU 114   2.304  -8.722  17.615
  858   HD11  LEU 114          HD11      LEU 114   3.067 -10.348  15.150
  859   HD12  LEU 114          HD12      LEU 114   1.703 -10.677  16.235
  860   HD13  LEU 114          HD13      LEU 114   1.719  -9.194  15.267
  861   HD21  LEU 114          HD21      LEU 114   4.219  -9.715  18.676
  862   HD22  LEU 114          HD22      LEU 114   3.256 -11.038  18.013
  863   HD23  LEU 114          HD23      LEU 114   4.725 -10.505  17.158
  864    H    VAL 115           H        VAL 115   6.771  -7.145  15.957
  865    HA   VAL 115           HA       VAL 115   8.438  -9.136  17.202
  866    HB   VAL 115           HB       VAL 115   9.316  -6.783  15.495
  867   HG11  VAL 115          HG11      VAL 115  10.855  -9.252  16.444
  868   HG12  VAL 115          HG12      VAL 115  11.385  -8.188  15.122
  869   HG13  VAL 115          HG13      VAL 115  11.269  -7.551  16.759
  870   HG21  VAL 115          HG21      VAL 115   8.926  -9.744  14.842
  871   HG22  VAL 115          HG22      VAL 115   7.834  -8.439  14.347
  872   HG23  VAL 115          HG23      VAL 115   9.481  -8.477  13.717
  873    H    GLU 116           H        GLU 116   8.649  -5.539  17.715
  874    HA   GLU 116           HA       GLU 116  10.434  -5.703  19.836
  875    HB2  GLU 116           HB2      GLU 116   9.494  -3.696  18.465
  876    HB3  GLU 116           HB3      GLU 116   8.262  -3.596  19.733
  877    HG2  GLU 116           HG2      GLU 116  10.097  -3.365  21.424
  878    HG3  GLU 116           HG3      GLU 116  11.289  -3.545  20.120
  879    H    GLU 117           H        GLU 117   7.013  -6.517  20.008
  880    HA   GLU 117           HA       GLU 117   6.884  -6.485  22.960
  881    HB2  GLU 117           HB2      GLU 117   5.018  -7.386  20.735
  882    HB3  GLU 117           HB3      GLU 117   4.692  -7.722  22.426
  883    HG2  GLU 117           HG2      GLU 117   5.354  -4.875  21.821
  884    HG3  GLU 117           HG3      GLU 117   3.887  -5.491  21.084
  885    H    ALA 118           H        ALA 118   7.549  -8.752  20.316
  886    HA   ALA 118           HA       ALA 118   7.348 -11.131  21.892
  887    HB1  ALA 118           HB1      ALA 118   8.878 -10.648  19.306
  888    HB2  ALA 118           HB2      ALA 118   8.305 -12.205  19.946
  889    HB3  ALA 118           HB3      ALA 118   7.135 -10.989  19.416
  890    H    GLN 119           H        GLN 119  10.247  -8.968  21.187
  891    HA   GLN 119           HA       GLN 119  12.168 -10.511  22.542
  892    HB2  GLN 119           HB2      GLN 119  11.818  -7.593  21.836
  893    HB3  GLN 119           HB3      GLN 119  13.306  -8.270  22.516
  894    HG2  GLN 119           HG2      GLN 119  12.556  -7.887  19.813
  895    HG3  GLN 119           HG3      GLN 119  14.095  -8.428  20.478
  896   HE21  GLN 119          HE22      GLN 119  11.061  -9.394  19.065
  897   HE22  GLN 119          HE21      GLN 119  11.339 -11.090  19.317
  Start of MODEL    3
    1    H    SER   1           H        SER   1  19.302  -4.615  14.638
    2    HA   SER   1           HA       SER   1  16.930  -3.665  16.050
    3    HB2  SER   1           HB2      SER   1  18.576  -2.143  17.162
    4    HB3  SER   1           HB3      SER   1  19.018  -3.854  17.270
    5    HG   SER   1           HG       SER   1  20.673  -3.566  15.947
    6    H    GLU   2           H        GLU   2  19.042  -2.379  13.466
    7    HA   GLU   2           HA       GLU   2  17.561   0.156  13.339
    8    HB2  GLU   2           HB2      GLU   2  19.744  -1.055  11.599
    9    HB3  GLU   2           HB3      GLU   2  19.031   0.541  11.339
   10    HG2  GLU   2           HG2      GLU   2  19.668   1.148  13.713
   11    HG3  GLU   2           HG3      GLU   2  20.547  -0.384  13.820
   12    H    ALA   3           H        ALA   3  17.524  -2.928  11.488
   13    HA   ALA   3           HA       ALA   3  15.721  -2.219   9.500
   14    HB1  ALA   3           HB1      ALA   3  15.797  -4.845  11.052
   15    HB2  ALA   3           HB2      ALA   3  15.228  -4.595   9.392
   16    HB3  ALA   3           HB3      ALA   3  16.950  -4.397   9.774
   17    H    LEU   4           H        LEU   4  15.026  -2.656  12.944
   18    HA   LEU   4           HA       LEU   4  12.212  -3.181  12.697
   19    HB2  LEU   4           HB2      LEU   4  13.778  -3.629  14.691
   20    HB3  LEU   4           HB3      LEU   4  13.703  -1.910  15.027
   21    HG   LEU   4           HG       LEU   4  11.156  -2.154  15.237
   22   HD11  LEU   4          HD11      LEU   4  11.987  -5.077  15.242
   23   HD12  LEU   4          HD12      LEU   4  10.384  -4.470  15.741
   24   HD13  LEU   4          HD13      LEU   4  10.910  -4.302  14.057
   25   HD21  LEU   4          HD21      LEU   4  12.641  -1.982  17.185
   26   HD22  LEU   4          HD22      LEU   4  11.297  -3.094  17.497
   27   HD23  LEU   4          HD23      LEU   4  12.917  -3.736  17.144
   28    H    ALA   5           H        ALA   5  14.044  -0.165  12.502
   29    HA   ALA   5           HA       ALA   5  11.669   1.540  12.838
   30    HB1  ALA   5           HB1      ALA   5  13.276   3.344  12.430
   31    HB2  ALA   5           HB2      ALA   5  13.856   2.279  13.723
   32    HB3  ALA   5           HB3      ALA   5  14.555   2.161  12.093
   33    H    LYS   6           H        LYS   6  13.352  -0.235  10.298
   34    HA   LYS   6           HA       LYS   6  13.076   1.710   8.208
   35    HB2  LYS   6           HB2      LYS   6  14.796  -0.168   8.507
   36    HB3  LYS   6           HB3      LYS   6  13.569  -1.281   7.891
   37    HG2  LYS   6           HG2      LYS   6  13.486  -0.063   5.771
   38    HG3  LYS   6           HG3      LYS   6  14.544   1.201   6.422
   39    HD2  LYS   6           HD2      LYS   6  16.360  -0.508   6.700
   40    HD3  LYS   6           HD3      LYS   6  15.315  -1.707   5.901
   41    HE2  LYS   6           HE2      LYS   6  15.209  -0.266   3.886
   42    HE3  LYS   6           HE3      LYS   6  16.181   0.963   4.701
   43    HZ1  LYS   6           HZ1      LYS   6  17.971  -0.775   4.855
   44    HZ2  LYS   6           HZ2      LYS   6  17.093  -1.738   3.879
   45    HZ3  LYS   6           HZ3      LYS   6  17.601  -0.293   3.308
   46    H    LEU   7           H        LEU   7  11.216  -1.194   8.991
   47    HA   LEU   7           HA       LEU   7   9.382  -1.328   6.896
   48    HB2  LEU   7           HB2      LEU   7   9.153  -1.825   9.877
   49    HB3  LEU   7           HB3      LEU   7   7.756  -2.059   8.851
   50    HG   LEU   7           HG       LEU   7   9.007  -4.128   9.449
   51   HD11  LEU   7          HD11      LEU   7   7.483  -4.172   7.622
   52   HD12  LEU   7          HD12      LEU   7   8.691  -3.506   6.495
   53   HD13  LEU   7          HD13      LEU   7   8.895  -5.131   7.180
   54   HD21  LEU   7          HD21      LEU   7  11.323  -3.340   9.231
   55   HD22  LEU   7          HD22      LEU   7  11.015  -4.775   8.256
   56   HD23  LEU   7          HD23      LEU   7  11.112  -3.196   7.463
   57    H    ILE   8           H        ILE   8   9.151   0.854   9.707
   58    HA   ILE   8           HA       ILE   8   6.666   2.103   8.839
   59    HB   ILE   8           HB       ILE   8   8.717   2.865  10.935
   60   HG12  ILE   8          HG12      ILE   8   7.549   0.785  11.451
   61   HG13  ILE   8          HG13      ILE   8   7.096   2.063  12.561
   62   HG21  ILE   8          HG21      ILE   8   6.027   4.170  10.369
   63   HG22  ILE   8          HG22      ILE   8   6.954   4.376  11.871
   64   HG23  ILE   8          HG23      ILE   8   7.630   4.929  10.344
   65   HD11  ILE   8          HD11      ILE   8   4.930   2.348  11.331
   66   HD12  ILE   8          HD12      ILE   8   5.393   1.002  10.259
   67   HD13  ILE   8          HD13      ILE   8   5.150   0.722  11.986
   68    H    SER   9           H        SER   9  10.082   2.792   8.240
   69    HA   SER   9           HA       SER   9   9.679   5.543   7.353
   70    HB2  SER   9           HB2      SER   9  12.016   3.634   6.998
   71    HB3  SER   9           HB3      SER   9  12.023   5.360   6.599
   72    HG   SER   9           HG       SER   9  12.795   4.562   8.777
   73    H    LEU  10           H        LEU  10   9.711   2.359   5.719
   74    HA   LEU  10           HA       LEU  10   9.710   3.405   3.042
   75    HB2  LEU  10           HB2      LEU  10   8.718   0.796   4.252
   76    HB3  LEU  10           HB3      LEU  10   8.364   1.220   2.587
   77    HG   LEU  10           HG       LEU  10  10.877   1.539   2.207
   78   HD11  LEU  10          HD11      LEU  10  10.922  -0.129   4.760
   79   HD12  LEU  10          HD12      LEU  10  12.296   0.095   3.653
   80   HD13  LEU  10          HD13      LEU  10  11.655   1.484   4.532
   81   HD21  LEU  10          HD21      LEU  10   9.591  -0.318   1.278
   82   HD22  LEU  10          HD22      LEU  10  11.155  -0.904   1.839
   83   HD23  LEU  10          HD23      LEU  10   9.690  -1.198   2.815
   84    H    GLN  11           H        GLN  11   7.102   3.429   5.432
   85    HA   GLN  11           HA       GLN  11   4.909   3.216   3.639
   86    HB2  GLN  11           HB2      GLN  11   5.059   4.455   6.384
   87    HB3  GLN  11           HB3      GLN  11   3.586   4.286   5.422
   88    HG2  GLN  11           HG2      GLN  11   4.100   1.798   5.221
   89    HG3  GLN  11           HG3      GLN  11   5.313   2.010   6.488
   90   HE21  GLN  11          HE22      GLN  11   4.348   3.246   8.564
   91   HE22  GLN  11          HE21      GLN  11   2.707   2.776   8.932
   92    H    ALA  12           H        ALA  12   3.869   4.557   2.354
   93    HA   ALA  12           HA       ALA  12   5.254   6.768   1.323
   94    HB1  ALA  12           HB1      ALA  12   2.352   5.999   0.822
   95    HB2  ALA  12           HB2      ALA  12   3.429   6.886  -0.268
   96    HB3  ALA  12           HB3      ALA  12   3.748   5.178   0.092
   97    H    THR  13           H        THR  13   4.527   8.919   0.892
   98    HA   THR  13           HA       THR  13   3.608  10.301   3.330
   99    HB   THR  13           HB       THR  13   4.560  11.359   0.636
  100    HG1  THR  13           HG1      THR  13   5.841  10.325   2.844
  101   HG21  THR  13          HG21      THR  13   3.435  13.124   2.010
  102   HG22  THR  13          HG22      THR  13   4.580  12.768   3.327
  103   HG23  THR  13          HG23      THR  13   5.164  13.404   1.781
  104    H    GLU  14           H        GLU  14   2.299   9.580   0.102
  105    HA   GLU  14           HA       GLU  14  -0.151  11.148   0.727
  106    HB2  GLU  14           HB2      GLU  14  -0.012  12.142  -1.515
  107    HB3  GLU  14           HB3      GLU  14   1.302  12.629  -0.450
  108    HG2  GLU  14           HG2      GLU  14   2.860  11.146  -1.610
  109    HG3  GLU  14           HG3      GLU  14   1.540  10.441  -2.552
  110    H    ALA  15           H        ALA  15  -1.925  10.893  -0.686
  111    HA   ALA  15           HA       ALA  15  -2.133   8.425  -2.289
  112    HB1  ALA  15           HB1      ALA  15  -2.822   7.877   0.070
  113    HB2  ALA  15           HB2      ALA  15  -4.055   9.147  -0.026
  114    HB3  ALA  15           HB3      ALA  15  -4.153   7.728  -1.093
  115    H    THR  16           H        THR  16  -3.964   8.434  -3.657
  116    HA   THR  16           HA       THR  16  -5.298  11.084  -4.139
  117    HB   THR  16           HB       THR  16  -4.699   8.974  -6.215
  118    HG1  THR  16           HG1      THR  16  -2.912  10.179  -5.272
  119   HG21  THR  16          HG21      THR  16  -5.264  10.767  -7.818
  120   HG22  THR  16          HG22      THR  16  -6.655  10.383  -6.807
  121   HG23  THR  16          HG23      THR  16  -5.702  11.846  -6.476
  122    H    ILE  17           H        ILE  17  -7.349  11.035  -3.365
  123    HA   ILE  17           HA       ILE  17  -8.887   8.503  -3.226
  124    HB   ILE  17           HB       ILE  17  -9.714  11.266  -2.259
  125   HG12  ILE  17          HG12      ILE  17  -8.352   9.062  -0.670
  126   HG13  ILE  17          HG13      ILE  17  -7.663  10.626  -1.086
  127   HG21  ILE  17          HG21      ILE  17 -10.777   8.481  -1.600
  128   HG22  ILE  17          HG22      ILE  17 -11.370  10.006  -0.903
  129   HG23  ILE  17          HG23      ILE  17 -11.599   9.693  -2.602
  130   HD11  ILE  17          HD11      ILE  17  -9.985  10.128   0.816
  131   HD12  ILE  17          HD12      ILE  17  -8.362  10.677   1.213
  132   HD13  ILE  17          HD13      ILE  17  -9.441  11.741   0.284
  133    H    VAL  18           H        VAL  18 -10.666   7.983  -4.542
  134    HA   VAL  18           HA       VAL  18 -11.372  10.025  -6.606
  135    HB   VAL  18           HB       VAL  18 -11.422   8.330  -8.309
  136   HG11  VAL  18          HG11      VAL  18  -8.705   8.288  -6.936
  137   HG12  VAL  18          HG12      VAL  18  -9.060   8.165  -8.675
  138   HG13  VAL  18          HG13      VAL  18  -9.347   9.684  -7.810
  139   HG21  VAL  18          HG21      VAL  18 -11.803   6.292  -6.928
  140   HG22  VAL  18          HG22      VAL  18 -10.439   6.140  -8.040
  141   HG23  VAL  18          HG23      VAL  18 -10.141   6.424  -6.313
  142    H    THR  19           H        THR  19 -13.296  10.186  -7.429
  143    HA   THR  19           HA       THR  19 -15.533   8.387  -6.527
  144    HB   THR  19           HB       THR  19 -15.596  11.429  -6.444
  145    HG1  THR  19           HG1      THR  19 -14.458  10.796  -4.737
  146   HG21  THR  19          HG21      THR  19 -17.725  11.075  -5.190
  147   HG22  THR  19          HG22      THR  19 -17.840  10.543  -6.866
  148   HG23  THR  19          HG23      THR  19 -17.641   9.340  -5.566
  149    H    LEU  20           H        LEU  20 -16.996   7.895  -8.145
  150    HA   LEU  20           HA       LEU  20 -16.769   9.278 -10.750
  151    HB2  LEU  20           HB2      LEU  20 -18.465   6.911  -9.905
  152    HB3  LEU  20           HB3      LEU  20 -18.595   7.737 -11.438
  153    HG   LEU  20           HG       LEU  20 -16.211   7.273 -11.939
  154   HD11  LEU  20          HD11      LEU  20 -16.330   5.539  -9.428
  155   HD12  LEU  20          HD12      LEU  20 -15.106   5.368 -10.707
  156   HD13  LEU  20          HD13      LEU  20 -15.174   6.849  -9.766
  157   HD21  LEU  20          HD21      LEU  20 -18.075   5.859 -12.735
  158   HD22  LEU  20          HD22      LEU  20 -16.581   4.935 -12.497
  159   HD23  LEU  20          HD23      LEU  20 -17.895   4.838 -11.296
  160    H    ASP  21           H        ASP  21 -17.308  11.339 -10.237
  161    HA   ASP  21           HA       ASP  21 -19.773  12.043  -8.865
  162    HB2  ASP  21           HB2      ASP  21 -17.415  13.484 -10.016
  163    HB3  ASP  21           HB3      ASP  21 -18.904  14.400  -9.937
  164    H    SER  22           H        SER  22 -19.101  11.304 -12.146
  165    HA   SER  22           HA       SER  22 -21.906  11.497 -12.697
  166    HB2  SER  22           HB2      SER  22 -20.171  12.891 -14.729
  167    HB3  SER  22           HB3      SER  22 -21.911  12.620 -14.781
  168    HG   SER  22           HG       SER  22 -21.415  13.822 -12.492
  169    H    ASP  23           H        ASP  23 -22.438   9.761 -13.662
  170    HA   ASP  23           HA       ASP  23 -21.524   7.465 -13.671
  171    HB2  ASP  23           HB2      ASP  23 -23.767   8.008 -14.449
  172    HB3  ASP  23           HB3      ASP  23 -23.143   8.341 -16.068
  173    H    ASN  24           H        ASN  24 -19.263   7.711 -13.966
  174    HA   ASN  24           HA       ASN  24 -17.251   7.112 -14.782
  175    HB2  ASN  24           HB2      ASN  24 -18.697   5.846 -17.175
  176    HB3  ASN  24           HB3      ASN  24 -17.037   5.572 -16.727
  177   HD21  ASN  24          HD22      ASN  24 -20.332   4.995 -15.475
  178   HD22  ASN  24          HD21      ASN  24 -19.778   3.391 -15.062
  179    H    ILE  25           H        ILE  25 -19.428   8.908 -16.947
  180    HA   ILE  25           HA       ILE  25 -17.710   9.871 -18.859
  181    HB   ILE  25           HB       ILE  25 -19.572  11.651 -18.917
  182   HG12  ILE  25          HG12      ILE  25 -20.941   9.972 -16.846
  183   HG13  ILE  25          HG13      ILE  25 -20.170  11.532 -16.533
  184   HG21  ILE  25          HG21      ILE  25 -21.150  10.028 -19.895
  185   HG22  ILE  25          HG22      ILE  25 -19.500   9.557 -20.286
  186   HG23  ILE  25          HG23      ILE  25 -20.371   8.709 -19.002
  187   HD11  ILE  25          HD11      ILE  25 -22.557  11.808 -16.827
  188   HD12  ILE  25          HD12      ILE  25 -21.704  12.606 -18.164
  189   HD13  ILE  25          HD13      ILE  25 -22.515  11.036 -18.412
  190    H    LEU  26           H        LEU  26 -17.758  10.789 -15.542
  191    HA   LEU  26           HA       LEU  26 -16.116  13.237 -16.133
  192    HB2  LEU  26           HB2      LEU  26 -18.260  13.823 -15.217
  193    HB3  LEU  26           HB3      LEU  26 -18.098  12.639 -13.923
  194    HG   LEU  26           HG       LEU  26 -16.270  13.993 -12.914
  195   HD11  LEU  26          HD11      LEU  26 -17.031  15.971 -15.094
  196   HD12  LEU  26          HD12      LEU  26 -15.993  16.320 -13.689
  197   HD13  LEU  26          HD13      LEU  26 -15.448  15.164 -14.922
  198   HD21  LEU  26          HD21      LEU  26 -18.664  14.302 -12.267
  199   HD22  LEU  26          HD22      LEU  26 -17.717  15.784 -12.095
  200   HD23  LEU  26          HD23      LEU  26 -18.812  15.578 -13.480
  201    H    LEU  27           H        LEU  27 -16.658  11.505 -13.268
  202    HA   LEU  27           HA       LEU  27 -15.352  10.576 -11.595
  203    HB2  LEU  27           HB2      LEU  27 -14.660   9.136 -13.589
  204    HB3  LEU  27           HB3      LEU  27 -13.151  10.032 -13.596
  205    HG   LEU  27           HG       LEU  27 -14.164   8.595 -11.106
  206   HD11  LEU  27          HD11      LEU  27 -12.428   7.470 -13.340
  207   HD12  LEU  27          HD12      LEU  27 -12.863   6.641 -11.826
  208   HD13  LEU  27          HD13      LEU  27 -14.113   7.020 -13.017
  209   HD21  LEU  27          HD21      LEU  27 -12.243  10.022 -10.622
  210   HD22  LEU  27          HD22      LEU  27 -11.684   8.358 -10.676
  211   HD23  LEU  27          HD23      LEU  27 -11.386   9.428 -12.055
  212    H    SER  28           H        SER  28 -14.073  11.357 -10.003
  213    HA   SER  28           HA       SER  28 -12.594  13.916 -10.515
  214    HB2  SER  28           HB2      SER  28 -14.912  14.280  -9.682
  215    HB3  SER  28           HB3      SER  28 -14.533  13.300  -8.255
  216    HG   SER  28           HG       SER  28 -14.348  15.669  -8.127
  217    H    GLU  29           H        GLU  29 -10.719  14.265  -9.205
  218    HA   GLU  29           HA       GLU  29  -9.888  11.981  -7.470
  219    HB2  GLU  29           HB2      GLU  29  -8.144  13.632  -9.315
  220    HB3  GLU  29           HB3      GLU  29  -7.649  12.261  -8.323
  221    HG2  GLU  29           HG2      GLU  29  -9.117  10.795  -9.735
  222    HG3  GLU  29           HG3      GLU  29  -9.451  12.179 -10.777
  223    H    GLU  30           H        GLU  30  -9.170  12.641  -5.456
  224    HA   GLU  30           HA       GLU  30  -8.355  15.499  -5.031
  225    HB2  GLU  30           HB2      GLU  30  -9.076  13.448  -2.916
  226    HB3  GLU  30           HB3      GLU  30  -8.754  15.153  -2.660
  227    HG2  GLU  30           HG2      GLU  30 -11.149  13.995  -4.149
  228    HG3  GLU  30           HG3      GLU  30 -11.124  14.503  -2.468
  229    H    GLN  31           H        GLN  31  -6.163  15.911  -4.366
  230    HA   GLN  31           HA       GLN  31  -4.421  13.515  -3.955
  231    HB2  GLN  31           HB2      GLN  31  -3.866  16.269  -5.069
  232    HB3  GLN  31           HB3      GLN  31  -2.621  15.254  -4.379
  233    HG2  GLN  31           HG2      GLN  31  -3.787  13.392  -6.002
  234    HG3  GLN  31           HG3      GLN  31  -4.221  14.847  -6.900
  235   HE21  GLN  31          HE21      GLN  31  -1.346  13.639  -5.077
  236   HE22  GLN  31          HE22      GLN  31  -0.185  14.036  -6.329
  237    H    VAL  32           H        VAL  32  -4.022  13.069  -1.927
  238    HA   VAL  32           HA       VAL  32  -4.034  15.225   0.132
  239    HB   VAL  32           HB       VAL  32  -5.375  13.909   1.538
  240   HG11  VAL  32          HG11      VAL  32  -6.739  13.685  -1.159
  241   HG12  VAL  32          HG12      VAL  32  -7.497  13.779   0.436
  242   HG13  VAL  32          HG13      VAL  32  -6.617  15.181  -0.198
  243   HG21  VAL  32          HG21      VAL  32  -5.416  11.671  -0.521
  244   HG22  VAL  32          HG22      VAL  32  -4.564  11.620   1.040
  245   HG23  VAL  32          HG23      VAL  32  -6.318  11.718   1.008
  246    H    ASP  33           H        ASP  33  -3.002  14.769   2.081
  247    HA   ASP  33           HA       ASP  33  -0.609  13.073   2.010
  248    HB2  ASP  33           HB2      ASP  33  -1.032  15.351   3.261
  249    HB3  ASP  33           HB3      ASP  33  -1.722  14.347   4.520
  250    H    VAL  34           H        VAL  34  -0.187  11.297   3.418
  251    HA   VAL  34           HA       VAL  34  -2.183   9.312   3.513
  252    HB   VAL  34           HB       VAL  34   0.216   8.869   3.480
  253   HG11  VAL  34          HG11      VAL  34   0.229   9.483   6.470
  254   HG12  VAL  34          HG12      VAL  34   1.579   8.870   5.497
  255   HG13  VAL  34          HG13      VAL  34   0.962  10.496   5.210
  256   HG21  VAL  34          HG21      VAL  34  -1.477   7.112   4.197
  257   HG22  VAL  34          HG22      VAL  34   0.201   6.832   4.705
  258   HG23  VAL  34          HG23      VAL  34  -0.995   7.434   5.868
  259    H    GLU  35           H        GLU  35  -1.687  11.772   5.923
  260    HA   GLU  35           HA       GLU  35  -3.165  10.433   8.060
  261    HB2  GLU  35           HB2      GLU  35  -1.408  12.297   8.195
  262    HB3  GLU  35           HB3      GLU  35  -2.718  13.399   7.747
  263    HG2  GLU  35           HG2      GLU  35  -2.497  13.379  10.155
  264    HG3  GLU  35           HG3      GLU  35  -4.001  12.556   9.730
  265    H    LEU  36           H        LEU  36  -4.210  11.943   5.131
  266    HA   LEU  36           HA       LEU  36  -6.830  12.753   6.206
  267    HB2  LEU  36           HB2      LEU  36  -5.553  13.148   3.503
  268    HB3  LEU  36           HB3      LEU  36  -7.007  13.954   4.075
  269    HG   LEU  36           HG       LEU  36  -4.167  14.371   5.115
  270   HD11  LEU  36          HD11      LEU  36  -6.078  16.223   3.635
  271   HD12  LEU  36          HD12      LEU  36  -4.466  16.650   4.249
  272   HD13  LEU  36          HD13      LEU  36  -4.622  15.460   2.959
  273   HD21  LEU  36          HD21      LEU  36  -5.690  14.623   6.986
  274   HD22  LEU  36          HD22      LEU  36  -5.160  16.221   6.465
  275   HD23  LEU  36          HD23      LEU  36  -6.783  15.641   6.021
  276    H    VAL  37           H        VAL  37  -5.720   9.907   4.951
  277    HA   VAL  37           HA       VAL  37  -8.299   9.190   3.630
  278    HB   VAL  37           HB       VAL  37  -6.453   8.665   2.276
  279   HG11  VAL  37          HG11      VAL  37  -4.681   7.033   2.934
  280   HG12  VAL  37          HG12      VAL  37  -4.592   8.564   3.794
  281   HG13  VAL  37          HG13      VAL  37  -5.253   7.127   4.613
  282   HG21  VAL  37          HG21      VAL  37  -8.265   7.009   2.313
  283   HG22  VAL  37          HG22      VAL  37  -6.702   6.288   1.904
  284   HG23  VAL  37          HG23      VAL  37  -7.381   6.048   3.521
  285    H    GLN  38           H        GLN  38  -9.633   7.581   4.366
  286    HA   GLN  38           HA       GLN  38  -9.047   6.356   7.040
  287    HB2  GLN  38           HB2      GLN  38 -11.403   6.454   7.564
  288    HB3  GLN  38           HB3      GLN  38 -10.792   8.055   7.216
  289    HG2  GLN  38           HG2      GLN  38 -11.924   8.060   5.042
  290    HG3  GLN  38           HG3      GLN  38 -12.358   6.354   5.215
  291   HE21  GLN  38          HE22      GLN  38 -12.795   9.429   7.022
  292   HE22  GLN  38          HE21      GLN  38 -14.316   8.829   7.699
  293    H    ARG  39           H        ARG  39 -10.221   4.322   7.472
  294    HA   ARG  39           HA       ARG  39  -9.663   2.364   5.472
  295    HB2  ARG  39           HB2      ARG  39 -10.197   0.772   7.170
  296    HB3  ARG  39           HB3      ARG  39  -9.422   2.143   7.954
  297    HG2  ARG  39           HG2      ARG  39 -11.917   2.948   8.329
  298    HG3  ARG  39           HG3      ARG  39 -12.333   1.275   8.008
  299    HD2  ARG  39           HD2      ARG  39 -10.909   0.502   9.855
  300    HD3  ARG  39           HD3      ARG  39 -10.309   2.141  10.105
  301    HE   ARG  39           HE       ARG  39 -12.204   2.701  11.270
  302   HH11  ARG  39          HH11      ARG  39 -13.004  -0.278   9.548
  303   HH12  ARG  39          HH12      ARG  39 -14.653  -0.215  10.153
  304   HH21  ARG  39          HH21      ARG  39 -14.129   2.422  12.251
  305   HH22  ARG  39          HH22      ARG  39 -15.113   1.003  11.880
  306    H    GLY  40           H        GLY  40 -11.738   4.153   4.543
  307    HA2  GLY  40           HA2      GLY  40 -13.626   2.162   3.469
  308    HA3  GLY  40           HA3      GLY  40 -14.333   3.551   4.304
  309    H    ASP  41           H        ASP  41 -11.367   4.323   2.642
  310    HA   ASP  41           HA       ASP  41 -12.860   5.654   0.443
  311    HB2  ASP  41           HB2      ASP  41 -10.038   5.949   1.512
  312    HB3  ASP  41           HB3      ASP  41 -10.661   6.836   0.127
  313    H    ILE  42           H        ILE  42 -11.877   5.697  -1.724
  314    HA   ILE  42           HA       ILE  42 -10.358   3.227  -2.463
  315    HB   ILE  42           HB       ILE  42 -12.616   4.553  -3.991
  316   HG12  ILE  42          HG12      ILE  42 -12.239   1.707  -2.930
  317   HG13  ILE  42          HG13      ILE  42 -13.232   2.942  -2.167
  318   HG21  ILE  42          HG21      ILE  42 -10.819   3.983  -5.589
  319   HG22  ILE  42          HG22      ILE  42 -10.716   2.339  -4.914
  320   HG23  ILE  42          HG23      ILE  42 -12.164   2.887  -5.789
  321   HD11  ILE  42          HD11      ILE  42 -14.686   1.477  -3.364
  322   HD12  ILE  42          HD12      ILE  42 -14.667   3.032  -4.219
  323   HD13  ILE  42          HD13      ILE  42 -13.759   1.635  -4.858
  324    H    ILE  43           H        ILE  43  -8.477   3.533  -3.386
  325    HA   ILE  43           HA       ILE  43  -7.643   6.258  -4.139
  326    HB   ILE  43           HB       ILE  43  -6.084   3.879  -3.063
  327   HG12  ILE  43          HG12      ILE  43  -7.575   4.524  -1.298
  328   HG13  ILE  43          HG13      ILE  43  -5.948   5.026  -0.902
  329   HG21  ILE  43          HG21      ILE  43  -5.246   6.776  -3.411
  330   HG22  ILE  43          HG22      ILE  43  -4.312   5.548  -2.534
  331   HG23  ILE  43          HG23      ILE  43  -4.598   5.363  -4.261
  332   HD11  ILE  43          HD11      ILE  43  -8.175   6.848  -1.900
  333   HD12  ILE  43          HD12      ILE  43  -7.556   6.740  -0.255
  334   HD13  ILE  43          HD13      ILE  43  -6.518   7.379  -1.541
  335    H    LYS  44           H        LYS  44  -6.890   6.647  -6.218
  336    HA   LYS  44           HA       LYS  44  -6.035   4.356  -7.915
  337    HB2  LYS  44           HB2      LYS  44  -7.575   6.117  -8.802
  338    HB3  LYS  44           HB3      LYS  44  -6.219   7.246  -8.765
  339    HG2  LYS  44           HG2      LYS  44  -4.924   5.869 -10.276
  340    HG3  LYS  44           HG3      LYS  44  -6.051   4.519 -10.156
  341    HD2  LYS  44           HD2      LYS  44  -6.855   7.190 -11.315
  342    HD3  LYS  44           HD3      LYS  44  -6.092   5.899 -12.270
  343    HE2  LYS  44           HE2      LYS  44  -7.964   4.372 -11.611
  344    HE3  LYS  44           HE3      LYS  44  -8.759   5.763 -10.836
  345    HZ1  LYS  44           HZ1      LYS  44  -8.052   5.587 -13.710
  346    HZ2  LYS  44           HZ2      LYS  44  -9.555   5.394 -13.098
  347    HZ3  LYS  44           HZ3      LYS  44  -8.797   6.868 -12.986
  348    H    VAL  45           H        VAL  45  -4.033   3.711  -8.177
  349    HA   VAL  45           HA       VAL  45  -1.838   5.332  -7.006
  350    HB   VAL  45           HB       VAL  45  -2.222   3.030  -6.228
  351   HG11  VAL  45          HG11      VAL  45  -1.144   2.126  -8.928
  352   HG12  VAL  45          HG12      VAL  45  -1.534   1.106  -7.533
  353   HG13  VAL  45          HG13      VAL  45  -2.827   1.970  -8.386
  354   HG21  VAL  45          HG21      VAL  45   0.504   3.422  -7.529
  355   HG22  VAL  45          HG22      VAL  45  -0.016   4.117  -5.977
  356   HG23  VAL  45          HG23      VAL  45   0.111   2.360  -6.164
  357    H    VAL  46           H        VAL  46  -0.164   6.186  -8.090
  358    HA   VAL  46           HA       VAL  46  -0.280   6.269 -11.005
  359    HB   VAL  46           HB       VAL  46   1.468   7.973 -10.837
  360   HG11  VAL  46          HG11      VAL  46  -0.740   8.395  -8.793
  361   HG12  VAL  46          HG12      VAL  46   0.220   9.656  -9.604
  362   HG13  VAL  46          HG13      VAL  46  -0.868   8.633 -10.544
  363   HG21  VAL  46          HG21      VAL  46   2.291   8.779  -8.672
  364   HG22  VAL  46          HG22      VAL  46   1.526   7.405  -7.854
  365   HG23  VAL  46          HG23      VAL  46   2.844   7.142  -9.016
  366    HA   PRO  47           HA       PRO  47   3.170   3.537 -11.983
  367    HB2  PRO  47           HB2      PRO  47   4.452   4.888 -14.024
  368    HB3  PRO  47           HB3      PRO  47   2.924   3.983 -14.228
  369    HG2  PRO  47           HG2      PRO  47   3.273   6.958 -13.745
  370    HG3  PRO  47           HG3      PRO  47   2.274   6.147 -14.993
  371    HD2  PRO  47           HD2      PRO  47   1.152   7.014 -12.717
  372    HD3  PRO  47           HD3      PRO  47   0.682   5.429 -13.380
  373    H    GLY  48           H        GLY  48   4.998   3.262 -10.840
  374    HA2  GLY  48           HA2      GLY  48   7.004   3.702  -9.758
  375    HA3  GLY  48           HA3      GLY  48   6.885   5.419 -10.157
  376    H    GLY  49           H        GLY  49   3.893   4.756  -8.917
  377    HA2  GLY  49           HA2      GLY  49   4.348   6.210  -6.517
  378    HA3  GLY  49           HA3      GLY  49   2.849   5.422  -7.001
  379    H    LYS  50           H        LYS  50   3.751   5.642  -4.370
  380    HA   LYS  50           HA       LYS  50   4.450   2.820  -3.601
  381    HB2  LYS  50           HB2      LYS  50   4.865   5.386  -2.029
  382    HB3  LYS  50           HB3      LYS  50   5.287   3.745  -1.499
  383    HG2  LYS  50           HG2      LYS  50   6.866   3.554  -3.402
  384    HG3  LYS  50           HG3      LYS  50   6.481   5.205  -3.883
  385    HD2  LYS  50           HD2      LYS  50   7.241   5.983  -1.574
  386    HD3  LYS  50           HD3      LYS  50   7.730   4.310  -1.260
  387    HE2  LYS  50           HE2      LYS  50   9.716   5.376  -1.933
  388    HE3  LYS  50           HE3      LYS  50   9.184   4.448  -3.340
  389    HZ1  LYS  50           HZ1      LYS  50   8.935   7.373  -2.930
  390    HZ2  LYS  50           HZ2      LYS  50   9.828   6.622  -4.060
  391    HZ3  LYS  50           HZ3      LYS  50   8.207   6.577  -4.198
  392    H    PHE  51           H        PHE  51   3.240   1.708  -2.179
  393    HA   PHE  51           HA       PHE  51   0.501   2.568  -1.864
  394    HB2  PHE  51           HB2      PHE  51   1.948   0.133  -0.840
  395    HB3  PHE  51           HB3      PHE  51   0.219   0.406  -0.629
  396    HD1  PHE  51           HD2      PHE  51  -1.106   1.041  -2.884
  397    HD2  PHE  51           HD1      PHE  51   2.610  -1.131  -2.712
  398    HE1  PHE  51           HE2      PHE  51  -1.509   0.160  -5.169
  399    HE2  PHE  51           HE1      PHE  51   2.207  -1.992  -5.002
  400    HZ   PHE  51           HZ       PHE  51   0.145  -1.360  -6.234
  401    HA   PRO  52           HA       PRO  52   1.218   4.473   2.139
  402    HB2  PRO  52           HB2      PRO  52  -1.151   5.735   2.478
  403    HB3  PRO  52           HB3      PRO  52  -0.026   6.188   1.163
  404    HG2  PRO  52           HG2      PRO  52  -2.469   4.397   1.008
  405    HG3  PRO  52           HG3      PRO  52  -2.005   5.736  -0.086
  406    HD2  PRO  52           HD2      PRO  52  -1.457   3.092  -0.623
  407    HD3  PRO  52           HD3      PRO  52  -0.420   4.445  -1.169
  408    H    VAL  53           H        VAL  53  -1.170   1.963   1.752
  409    HA   VAL  53           HA       VAL  53  -1.179   1.228   4.542
  410    HB   VAL  53           HB       VAL  53  -3.656   1.083   4.727
  411   HG11  VAL  53          HG11      VAL  53  -2.629   3.942   4.604
  412   HG12  VAL  53          HG12      VAL  53  -3.961   3.309   5.585
  413   HG13  VAL  53          HG13      VAL  53  -2.295   2.802   5.919
  414   HG21  VAL  53          HG21      VAL  53  -4.223   1.508   2.324
  415   HG22  VAL  53          HG22      VAL  53  -5.077   2.568   3.465
  416   HG23  VAL  53          HG23      VAL  53  -3.700   3.201   2.545
  417    H    ASP  54           H        ASP  54  -2.517  -0.928   4.735
  418    HA   ASP  54           HA       ASP  54  -2.086  -2.483   2.247
  419    HB2  ASP  54           HB2      ASP  54  -1.787  -4.372   3.394
  420    HB3  ASP  54           HB3      ASP  54  -1.116  -3.221   4.532
  421    H    GLY  55           H        GLY  55  -3.684  -3.660   1.201
  422    HA2  GLY  55           HA2      GLY  55  -6.434  -3.736   1.939
  423    HA3  GLY  55           HA3      GLY  55  -6.163  -2.268   1.005
  424    H    ARG  56           H        ARG  56  -7.845  -3.497  -0.244
  425    HA   ARG  56           HA       ARG  56  -6.704  -5.620  -2.003
  426    HB2  ARG  56           HB2      ARG  56  -8.680  -5.968  -0.328
  427    HB3  ARG  56           HB3      ARG  56  -9.674  -5.262  -1.597
  428    HG2  ARG  56           HG2      ARG  56  -9.137  -7.026  -3.134
  429    HG3  ARG  56           HG3      ARG  56  -7.781  -7.576  -2.146
  430    HD2  ARG  56           HD2      ARG  56 -10.681  -7.808  -1.303
  431    HD3  ARG  56           HD3      ARG  56  -9.696  -9.097  -2.031
  432    HE   ARG  56           HE       ARG  56  -8.396  -7.994   0.316
  433   HH11  ARG  56          HH11      ARG  56 -10.976 -10.309  -0.491
  434   HH12  ARG  56          HH12      ARG  56 -10.935 -10.906   1.144
  435   HH21  ARG  56          HH21      ARG  56  -8.207  -9.096   2.128
  436   HH22  ARG  56          HH22      ARG  56  -9.211 -10.510   2.428
  437    H    VAL  57           H        VAL  57  -7.119  -5.774  -4.169
  438    HA   VAL  57           HA       VAL  57  -7.237  -3.148  -5.564
  439    HB   VAL  57           HB       VAL  57  -6.097  -5.821  -6.477
  440   HG11  VAL  57          HG11      VAL  57  -5.784  -3.010  -7.606
  441   HG12  VAL  57          HG12      VAL  57  -4.950  -4.474  -8.193
  442   HG13  VAL  57          HG13      VAL  57  -6.693  -4.342  -8.355
  443   HG21  VAL  57          HG21      VAL  57  -4.742  -5.065  -4.607
  444   HG22  VAL  57          HG22      VAL  57  -3.858  -4.789  -6.109
  445   HG23  VAL  57          HG23      VAL  57  -4.657  -3.432  -5.284
  446    H    ILE  58           H        ILE  58  -8.875  -2.748  -6.960
  447    HA   ILE  58           HA       ILE  58 -10.577  -5.004  -7.973
  448    HB   ILE  58           HB       ILE  58 -12.579  -3.553  -7.202
  449   HG12  ILE  58          HG12      ILE  58 -10.538  -2.550  -5.184
  450   HG13  ILE  58          HG13      ILE  58 -11.006  -1.584  -6.602
  451   HG21  ILE  58          HG21      ILE  58 -10.938  -4.901  -5.025
  452   HG22  ILE  58          HG22      ILE  58 -12.696  -4.684  -5.090
  453   HG23  ILE  58          HG23      ILE  58 -11.903  -5.761  -6.240
  454   HD11  ILE  58          HD11      ILE  58 -13.377  -1.632  -5.864
  455   HD12  ILE  58          HD12      ILE  58 -12.877  -2.470  -4.372
  456   HD13  ILE  58          HD13      ILE  58 -12.295  -0.829  -4.714
  457    H    GLU  59           H        GLU  59  -8.723  -3.106  -9.366
  458    HA   GLU  59           HA       GLU  59 -10.262  -3.061 -11.762
  459    HB2  GLU  59           HB2      GLU  59 -10.957  -0.785 -10.644
  460    HB3  GLU  59           HB3      GLU  59  -9.309  -0.269 -11.009
  461    HG2  GLU  59           HG2      GLU  59  -9.668  -0.767 -13.412
  462    HG3  GLU  59           HG3      GLU  59 -11.289  -1.360 -13.048
  463    H    GLY  60           H        GLY  60  -8.789  -3.220 -13.513
  464    HA2  GLY  60           HA2      GLY  60  -6.905  -2.569 -14.772
  465    HA3  GLY  60           HA3      GLY  60  -6.193  -1.831 -13.355
  466    H    HIS  61           H        HIS  61  -4.325  -2.882 -14.427
  467    HA   HIS  61           HA       HIS  61  -3.642  -5.242 -12.874
  468    HB2  HIS  61           HB2      HIS  61  -3.163  -6.845 -14.464
  469    HB3  HIS  61           HB3      HIS  61  -4.753  -6.264 -14.904
  470    HD1  HIS  61           HD1      HIS  61  -1.300  -6.738 -16.240
  471    HD2  HIS  61           HD2      HIS  61  -4.822  -4.651 -17.227
  472    HE1  HIS  61           HE1      HIS  61  -1.023  -5.968 -18.662
  473    H    SER  62           H        SER  62  -1.688  -5.032 -12.140
  474    HA   SER  62           HA       SER  62   0.430  -3.545 -13.621
  475    HB2  SER  62           HB2      SER  62  -1.052  -1.999 -12.181
  476    HB3  SER  62           HB3      SER  62  -0.276  -2.753 -10.781
  477    HG   SER  62           HG       SER  62   1.189  -1.630 -12.925
  478    H    MET  63           H        MET  63   2.578  -3.467 -12.265
  479    HA   MET  63           HA       MET  63   2.908  -6.081 -10.878
  480    HB2  MET  63           HB2      MET  63   3.868  -6.160 -13.092
  481    HB3  MET  63           HB3      MET  63   4.820  -4.698 -12.785
  482    HG2  MET  63           HG2      MET  63   6.171  -5.772 -11.173
  483    HG3  MET  63           HG3      MET  63   5.056  -7.127 -10.985
  484    HE1  MET  63           HE1      MET  63   4.374  -8.450 -13.553
  485    HE2  MET  63           HE2      MET  63   5.768  -9.527 -13.799
  486    HE3  MET  63           HE3      MET  63   5.120  -9.276 -12.165
  487    H    VAL  64           H        VAL  64   3.824  -6.089  -9.002
  488    HA   VAL  64           HA       VAL  64   4.759  -3.549  -7.748
  489    HB   VAL  64           HB       VAL  64   3.189  -5.874  -6.567
  490   HG11  VAL  64          HG11      VAL  64   4.156  -3.299  -5.258
  491   HG12  VAL  64          HG12      VAL  64   2.954  -4.409  -4.555
  492   HG13  VAL  64          HG13      VAL  64   4.604  -4.959  -4.808
  493   HG21  VAL  64          HG21      VAL  64   1.790  -4.440  -7.993
  494   HG22  VAL  64          HG22      VAL  64   1.398  -4.150  -6.296
  495   HG23  VAL  64          HG23      VAL  64   2.408  -2.992  -7.187
  496    H    ASP  65           H        ASP  65   6.494  -3.516  -6.437
  497    HA   ASP  65           HA       ASP  65   8.266  -5.919  -6.331
  498    HB2  ASP  65           HB2      ASP  65   9.081  -3.765  -7.281
  499    HB3  ASP  65           HB3      ASP  65   8.849  -3.001  -5.710
  500    H    GLU  66           H        GLU  66   7.988  -7.191  -4.557
  501    HA   GLU  66           HA       GLU  66   7.287  -5.956  -1.930
  502    HB2  GLU  66           HB2      GLU  66   6.808  -8.820  -2.682
  503    HB3  GLU  66           HB3      GLU  66   6.180  -7.870  -1.310
  504    HG2  GLU  66           HG2      GLU  66   4.776  -6.571  -2.868
  505    HG3  GLU  66           HG3      GLU  66   5.299  -7.623  -4.191
  506    H    SER  67           H        SER  67  10.089  -6.616  -3.130
  507    HA   SER  67           HA       SER  67  11.155  -8.828  -1.770
  508    HB2  SER  67           HB2      SER  67  13.294  -8.064  -2.612
  509    HB3  SER  67           HB3      SER  67  12.036  -7.868  -3.837
  510    HG   SER  67           HG       SER  67  12.005  -5.568  -2.620
  511    H    LEU  68           H        LEU  68  10.327  -6.092  -0.100
  512    HA   LEU  68           HA       LEU  68  12.392  -6.561   2.027
  513    HB2  LEU  68           HB2      LEU  68  12.639  -4.343   1.034
  514    HB3  LEU  68           HB3      LEU  68  10.944  -3.993   1.264
  515    HG   LEU  68           HG       LEU  68  12.433  -2.795   2.777
  516   HD11  LEU  68          HD11      LEU  68  10.761  -4.610   4.526
  517   HD12  LEU  68          HD12      LEU  68  11.160  -2.902   4.728
  518   HD13  LEU  68          HD13      LEU  68  10.051  -3.396   3.437
  519   HD21  LEU  68          HD21      LEU  68  13.512  -3.844   4.693
  520   HD22  LEU  68          HD22      LEU  68  13.038  -5.452   4.115
  521   HD23  LEU  68          HD23      LEU  68  14.177  -4.469   3.171
  522    H    ILE  69           H        ILE  69   9.009  -5.850   1.217
  523    HA   ILE  69           HA       ILE  69   8.053  -6.169   3.936
  524    HB   ILE  69           HB       ILE  69   6.426  -6.144   1.371
  525   HG12  ILE  69          HG12      ILE  69   7.875  -4.093   1.547
  526   HG13  ILE  69          HG13      ILE  69   6.157  -3.802   1.500
  527   HG21  ILE  69          HG21      ILE  69   5.723  -5.667   4.299
  528   HG22  ILE  69          HG22      ILE  69   4.663  -5.223   2.953
  529   HG23  ILE  69          HG23      ILE  69   5.085  -6.922   3.217
  530   HD11  ILE  69          HD11      ILE  69   7.489  -2.371   3.088
  531   HD12  ILE  69          HD12      ILE  69   6.091  -3.191   3.777
  532   HD13  ILE  69          HD13      ILE  69   7.732  -3.816   4.098
  533    H    THR  70           H        THR  70   7.376  -8.208   1.003
  534    HA   THR  70           HA       THR  70   6.835 -10.524   2.802
  535    HB   THR  70           HB       THR  70   5.758 -11.571   0.965
  536    HG1  THR  70           HG1      THR  70   5.589 -10.101  -1.003
  537   HG21  THR  70          HG21      THR  70   4.439  -9.811   2.181
  538   HG22  THR  70          HG22      THR  70   4.860  -8.666   0.880
  539   HG23  THR  70          HG23      THR  70   3.909 -10.120   0.520
  540    H    GLY  71           H        GLY  71   9.369  -9.323   0.847
  541    HA2  GLY  71           HA2      GLY  71  11.486 -10.153   0.543
  542    HA3  GLY  71           HA3      GLY  71  11.072 -11.536   1.548
  543    H    GLU  72           H        GLU  72   8.999 -11.186  -1.120
  544    HA   GLU  72           HA       GLU  72   9.612 -13.645  -2.271
  545    HB2  GLU  72           HB2      GLU  72   8.309 -11.192  -3.499
  546    HB3  GLU  72           HB3      GLU  72   8.499 -12.677  -4.430
  547    HG2  GLU  72           HG2      GLU  72   7.077 -12.466  -1.748
  548    HG3  GLU  72           HG3      GLU  72   6.265 -12.511  -3.308
  549    H    ALA  73           H        ALA  73  10.986 -10.584  -3.519
  550    HA   ALA  73           HA       ALA  73  12.988 -10.131  -4.447
  551    HB1  ALA  73           HB1      ALA  73  13.881 -12.969  -3.877
  552    HB2  ALA  73           HB2      ALA  73  14.902 -11.588  -4.313
  553    HB3  ALA  73           HB3      ALA  73  14.036 -11.592  -2.763
  554    H    MET  74           H        MET  74  10.635 -11.335  -5.754
  555    HA   MET  74           HA       MET  74  11.573 -11.066  -8.471
  556    HB2  MET  74           HB2      MET  74  11.571 -13.540  -8.150
  557    HB3  MET  74           HB3      MET  74   9.910 -13.473  -7.551
  558    HG2  MET  74           HG2      MET  74   9.170 -12.546  -9.710
  559    HG3  MET  74           HG3      MET  74  10.826 -12.611 -10.319
  560    HE1  MET  74           HE1      MET  74  12.075 -14.780 -11.072
  561    HE2  MET  74           HE2      MET  74  11.964 -15.450  -9.425
  562    HE3  MET  74           HE3      MET  74  11.463 -16.428 -10.818
  563    HA   PRO  75           HA       PRO  75   8.053  -8.471  -7.648
  564    HB2  PRO  75           HB2      PRO  75   7.375  -7.511 -10.104
  565    HB3  PRO  75           HB3      PRO  75   8.870  -7.049  -9.244
  566    HG2  PRO  75           HG2      PRO  75   8.549  -9.200 -11.372
  567    HG3  PRO  75           HG3      PRO  75   9.762  -7.876 -11.315
  568    HD2  PRO  75           HD2      PRO  75  10.368 -10.358 -10.427
  569    HD3  PRO  75           HD3      PRO  75  10.938  -8.916  -9.532
  570    H    VAL  76           H        VAL  76   5.762  -8.165  -7.985
  571    HA   VAL  76           HA       VAL  76   4.351 -10.735  -8.643
  572    HB   VAL  76           HB       VAL  76   3.787  -8.809  -6.352
  573   HG11  VAL  76          HG11      VAL  76   2.348 -10.643  -5.516
  574   HG12  VAL  76          HG12      VAL  76   1.775 -10.058  -7.085
  575   HG13  VAL  76          HG13      VAL  76   2.682 -11.583  -6.977
  576   HG21  VAL  76          HG21      VAL  76   5.904  -9.993  -5.905
  577   HG22  VAL  76          HG22      VAL  76   4.620 -10.614  -4.870
  578   HG23  VAL  76          HG23      VAL  76   5.125 -11.548  -6.288
  579    H    ALA  77           H        ALA  77   2.815 -10.570 -10.141
  580    HA   ALA  77           HA       ALA  77   1.727  -7.983 -10.966
  581    HB1  ALA  77           HB1      ALA  77   0.532  -9.301 -12.659
  582    HB2  ALA  77           HB2      ALA  77   2.262  -9.671 -12.638
  583    HB3  ALA  77           HB3      ALA  77   1.100 -10.802 -11.902
  584    H    LYS  78           H        LYS  78  -0.245  -7.232 -10.745
  585    HA   LYS  78           HA       LYS  78  -2.203  -8.519  -8.862
  586    HB2  LYS  78           HB2      LYS  78  -1.667  -5.560  -9.283
  587    HB3  LYS  78           HB3      LYS  78  -2.724  -6.258  -8.062
  588    HG2  LYS  78           HG2      LYS  78   0.311  -6.497  -8.187
  589    HG3  LYS  78           HG3      LYS  78  -0.608  -5.438  -7.125
  590    HD2  LYS  78           HD2      LYS  78  -1.553  -7.317  -5.913
  591    HD3  LYS  78           HD3      LYS  78  -0.795  -8.482  -7.017
  592    HE2  LYS  78           HE2      LYS  78   1.436  -7.786  -6.344
  593    HE3  LYS  78           HE3      LYS  78   0.776  -6.478  -5.348
  594    HZ1  LYS  78           HZ1      LYS  78   0.277  -9.364  -4.857
  595    HZ2  LYS  78           HZ2      LYS  78   1.356  -8.432  -4.017
  596    HZ3  LYS  78           HZ3      LYS  78  -0.269  -8.132  -3.936
  597    H    LYS  79           H        LYS  79  -4.446  -7.787  -9.082
  598    HA   LYS  79           HA       LYS  79  -5.478  -6.929 -11.695
  599    HB2  LYS  79           HB2      LYS  79  -6.541  -9.082 -12.178
  600    HB3  LYS  79           HB3      LYS  79  -4.818  -9.322 -12.050
  601    HG2  LYS  79           HG2      LYS  79  -5.014 -10.436  -9.948
  602    HG3  LYS  79           HG3      LYS  79  -6.639  -9.824  -9.661
  603    HD2  LYS  79           HD2      LYS  79  -6.874 -12.088 -10.250
  604    HD3  LYS  79           HD3      LYS  79  -7.488 -11.152 -11.608
  605    HE2  LYS  79           HE2      LYS  79  -5.494 -11.547 -12.916
  606    HE3  LYS  79           HE3      LYS  79  -4.625 -12.174 -11.505
  607    HZ1  LYS  79           HZ1      LYS  79  -5.344 -14.038 -12.768
  608    HZ2  LYS  79           HZ2      LYS  79  -6.292 -13.984 -11.428
  609    HZ3  LYS  79           HZ3      LYS  79  -6.894 -13.473 -12.878
  610    HA   PRO  80           HA       PRO  80  -9.115  -6.240  -8.995
  611    HB2  PRO  80           HB2      PRO  80 -11.290  -7.323 -10.326
  612    HB3  PRO  80           HB3      PRO  80 -10.565  -5.736 -10.726
  613    HG2  PRO  80           HG2      PRO  80  -9.998  -8.424 -12.032
  614    HG3  PRO  80           HG3      PRO  80 -10.389  -6.863 -12.831
  615    HD2  PRO  80           HD2      PRO  80  -7.837  -7.615 -12.622
  616    HD3  PRO  80           HD3      PRO  80  -8.289  -5.936 -12.240
  617    H    GLY  81           H        GLY  81  -9.619  -7.384  -7.203
  618    HA2  GLY  81           HA2      GLY  81  -9.982  -9.203  -5.785
  619    HA3  GLY  81           HA3      GLY  81  -9.962 -10.316  -7.157
  620    H    SER  82           H        SER  82  -7.487  -7.902  -6.085
  621    HA   SER  82           HA       SER  82  -5.592 -10.096  -5.350
  622    HB2  SER  82           HB2      SER  82  -5.227  -9.147  -7.690
  623    HB3  SER  82           HB3      SER  82  -4.819  -7.614  -6.908
  624    HG   SER  82           HG       SER  82  -3.478 -10.104  -6.837
  625    H    THR  83           H        THR  83  -3.707  -9.120  -3.954
  626    HA   THR  83           HA       THR  83  -4.770  -6.904  -2.230
  627    HB   THR  83           HB       THR  83  -3.971  -7.994  -0.283
  628    HG1  THR  83           HG1      THR  83  -3.013  -9.982  -2.066
  629   HG21  THR  83          HG21      THR  83  -5.365  -9.984  -0.126
  630   HG22  THR  83          HG22      THR  83  -6.227  -8.697  -0.974
  631   HG23  THR  83          HG23      THR  83  -5.537 -10.055  -1.890
  632    H    VAL  84           H        VAL  84  -3.349  -5.525  -1.197
  633    HA   VAL  84           HA       VAL  84  -0.449  -5.723  -1.865
  634    HB   VAL  84           HB       VAL  84  -0.370  -3.272  -2.241
  635   HG11  VAL  84          HG11      VAL  84  -1.152  -3.319  -4.547
  636   HG12  VAL  84          HG12      VAL  84  -0.341  -4.836  -4.126
  637   HG13  VAL  84          HG13      VAL  84  -2.113  -4.774  -4.225
  638   HG21  VAL  84          HG21      VAL  84  -2.525  -2.622  -1.172
  639   HG22  VAL  84          HG22      VAL  84  -2.359  -2.014  -2.825
  640   HG23  VAL  84          HG23      VAL  84  -3.403  -3.412  -2.500
  641    H    ILE  85           H        ILE  85   0.899  -4.286  -0.604
  642    HA   ILE  85           HA       ILE  85  -0.036  -3.713   2.138
  643    HB   ILE  85           HB       ILE  85   2.513  -4.418   2.672
  644   HG12  ILE  85          HG12      ILE  85   3.032  -6.631   1.744
  645   HG13  ILE  85          HG13      ILE  85   1.677  -6.546   0.634
  646   HG21  ILE  85          HG21      ILE  85   0.547  -5.098   3.921
  647   HG22  ILE  85          HG22      ILE  85   0.133  -6.300   2.675
  648   HG23  ILE  85          HG23      ILE  85   1.612  -6.476   3.642
  649   HD11  ILE  85          HD11      ILE  85   3.916  -6.062  -0.397
  650   HD12  ILE  85          HD12      ILE  85   2.759  -4.742  -0.618
  651   HD13  ILE  85          HD13      ILE  85   4.033  -4.606   0.615
  652    H    ALA  86           H        ALA  86   1.085  -2.082   3.238
  653    HA   ALA  86           HA       ALA  86   1.733   0.141   1.572
  654    HB1  ALA  86           HB1      ALA  86   2.129  -0.220   4.570
  655    HB2  ALA  86           HB2      ALA  86   2.095   1.321   3.687
  656    HB3  ALA  86           HB3      ALA  86   0.649   0.306   3.785
  657    H    GLY  87           H        GLY  87   3.647   1.280   1.306
  658    HA2  GLY  87           HA2      GLY  87   5.951   1.721   1.326
  659    HA3  GLY  87           HA3      GLY  87   6.212   0.316   2.365
  660    H    SER  88           H        SER  88   4.466  -0.951  -0.149
  661    HA   SER  88           HA       SER  88   6.889  -1.721  -1.686
  662    HB2  SER  88           HB2      SER  88   4.190  -2.922  -1.310
  663    HB3  SER  88           HB3      SER  88   4.885  -3.051  -2.937
  664    HG   SER  88           HG       SER  88   6.583  -4.093  -2.222
  665    H    ILE  89           H        ILE  89   6.853  -1.626  -4.012
  666    HA   ILE  89           HA       ILE  89   5.838   1.045  -4.844
  667    HB   ILE  89           HB       ILE  89   8.118  -0.299  -6.238
  668   HG12  ILE  89          HG12      ILE  89   8.862  -0.634  -3.960
  669   HG13  ILE  89          HG13      ILE  89   9.829   0.547  -4.809
  670   HG21  ILE  89          HG21      ILE  89   7.221   1.800  -7.109
  671   HG22  ILE  89          HG22      ILE  89   7.448   2.589  -5.536
  672   HG23  ILE  89          HG23      ILE  89   8.856   2.056  -6.483
  673   HD11  ILE  89          HD11      ILE  89   9.403   1.157  -2.444
  674   HD12  ILE  89          HD12      ILE  89   8.833   2.382  -3.582
  675   HD13  ILE  89          HD13      ILE  89   7.670   1.293  -2.789
  676    H    ASN  90           H        ASN  90   4.635   1.297  -6.619
  677    HA   ASN  90           HA       ASN  90   3.855  -1.097  -8.219
  678    HB2  ASN  90           HB2      ASN  90   2.116   0.331  -7.014
  679    HB3  ASN  90           HB3      ASN  90   2.519   1.644  -8.120
  680   HD21  ASN  90          HD22      ASN  90   1.463   1.536 -10.183
  681   HD22  ASN  90          HD21      ASN  90   0.693   0.013 -10.680
  682    H    GLN  91           H        GLN  91   4.335  -1.271 -10.409
  683    HA   GLN  91           HA       GLN  91   6.395   0.593 -11.348
  684    HB2  GLN  91           HB2      GLN  91   6.683  -1.857 -11.422
  685    HB3  GLN  91           HB3      GLN  91   5.331  -1.990 -12.542
  686    HG2  GLN  91           HG2      GLN  91   7.366  -2.113 -13.802
  687    HG3  GLN  91           HG3      GLN  91   6.573  -0.589 -14.198
  688   HE21  GLN  91          HE22      GLN  91   9.026  -1.813 -11.725
  689   HE22  GLN  91          HE21      GLN  91  10.087  -0.441 -11.982
  690    H    ASN  92           H        ASN  92   3.680  -0.844 -13.224
  691    HA   ASN  92           HA       ASN  92   2.643   1.685 -14.193
  692    HB2  ASN  92           HB2      ASN  92   4.664   1.246 -15.674
  693    HB3  ASN  92           HB3      ASN  92   3.953  -0.290 -16.147
  694   HD21  ASN  92          HD22      ASN  92   2.540  -0.254 -17.962
  695   HD22  ASN  92          HD21      ASN  92   1.856   1.257 -18.546
  696    H    GLY  93           H        GLY  93   0.410   1.215 -15.126
  697    HA2  GLY  93           HA2      GLY  93  -0.933  -0.650 -15.962
  698    HA3  GLY  93           HA3      GLY  93  -0.476  -1.561 -14.539
  699    H    SER  94           H        SER  94  -1.107   1.733 -13.895
  700    HA   SER  94           HA       SER  94  -2.678   2.675 -12.455
  701    HB2  SER  94           HB2      SER  94  -3.904   2.201 -15.187
  702    HB3  SER  94           HB3      SER  94  -4.548   3.366 -14.008
  703    HG   SER  94           HG       SER  94  -2.663   4.476 -14.021
  704    H    LEU  95           H        LEU  95  -3.220   1.372 -10.754
  705    HA   LEU  95           HA       LEU  95  -5.631  -0.382 -10.977
  706    HB2  LEU  95           HB2      LEU  95  -3.458  -0.149  -8.887
  707    HB3  LEU  95           HB3      LEU  95  -4.811  -1.262  -8.776
  708    HG   LEU  95           HG       LEU  95  -2.548  -1.313 -10.800
  709   HD11  LEU  95          HD11      LEU  95  -3.155  -2.979  -8.318
  710   HD12  LEU  95          HD12      LEU  95  -1.900  -3.363  -9.506
  711   HD13  LEU  95          HD13      LEU  95  -1.784  -1.876  -8.565
  712   HD21  LEU  95          HD21      LEU  95  -3.451  -3.597 -11.308
  713   HD22  LEU  95          HD22      LEU  95  -4.876  -3.227 -10.323
  714   HD23  LEU  95          HD23      LEU  95  -4.537  -2.275 -11.779
  715    H    LEU  96           H        LEU  96  -7.229  -0.377  -9.401
  716    HA   LEU  96           HA       LEU  96  -7.403   2.027  -7.623
  717    HB2  LEU  96           HB2      LEU  96  -9.633   0.338  -8.818
  718    HB3  LEU  96           HB3      LEU  96  -9.872   1.482  -7.511
  719    HG   LEU  96           HG       LEU  96  -8.831   2.235 -10.279
  720   HD11  LEU  96          HD11      LEU  96 -11.507   2.886  -8.981
  721   HD12  LEU  96          HD12      LEU  96 -10.941   3.338 -10.608
  722   HD13  LEU  96          HD13      LEU  96 -11.267   1.639 -10.220
  723   HD21  LEU  96          HD21      LEU  96  -7.954   3.788  -8.703
  724   HD22  LEU  96          HD22      LEU  96  -9.387   4.571  -9.376
  725   HD23  LEU  96          HD23      LEU  96  -9.462   3.841  -7.767
  726    H    ILE  97           H        ILE  97  -7.046   1.719  -5.596
  727    HA   ILE  97           HA       ILE  97  -7.272  -1.001  -4.417
  728    HB   ILE  97           HB       ILE  97  -5.769   1.276  -3.152
  729   HG12  ILE  97          HG12      ILE  97  -4.845   1.400  -5.379
  730   HG13  ILE  97          HG13      ILE  97  -3.693   0.851  -4.186
  731   HG21  ILE  97          HG21      ILE  97  -5.353  -1.737  -3.182
  732   HG22  ILE  97          HG22      ILE  97  -4.398  -0.558  -2.252
  733   HG23  ILE  97          HG23      ILE  97  -6.113  -0.791  -1.892
  734   HD11  ILE  97          HD11      ILE  97  -3.551  -0.333  -6.382
  735   HD12  ILE  97          HD12      ILE  97  -3.767  -1.404  -4.989
  736   HD13  ILE  97          HD13      ILE  97  -5.147  -1.048  -6.063
  737    H    CYS  98           H        CYS  98  -8.868  -1.312  -2.904
  738    HA   CYS  98           HA       CYS  98 -10.183   1.042  -1.660
  739    HB2  CYS  98           HB2      CYS  98 -11.729  -0.539  -0.664
  740    HB3  CYS  98           HB3      CYS  98 -11.657  -0.710  -2.417
  741    HG   CYS  98           HG       CYS  98  -9.827  -2.736  -2.274
  742    H    ALA  99           H        ALA  99  -9.337   1.998   0.118
  743    HA   ALA  99           HA       ALA  99  -7.342   0.646   1.738
  744    HB1  ALA  99           HB1      ALA  99  -8.771   3.338   1.958
  745    HB2  ALA  99           HB2      ALA  99  -7.413   2.813   2.969
  746    HB3  ALA  99           HB3      ALA  99  -7.178   3.041   1.222
  747    H    THR 100           H        THR 100  -7.996  -0.898   3.111
  748    HA   THR 100           HA       THR 100 -10.530  -0.580   4.674
  749    HB   THR 100           HB       THR 100 -10.395  -3.102   4.802
  750    HG1  THR 100           HG1      THR 100  -8.996  -4.088   3.326
  751   HG21  THR 100          HG21      THR 100 -11.152  -3.516   2.535
  752   HG22  THR 100          HG22      THR 100 -11.775  -1.946   3.065
  753   HG23  THR 100          HG23      THR 100 -10.394  -2.024   1.949
  754    H    HIS 101           H        HIS 101  -7.364  -0.048   5.234
  755    HA   HIS 101           HA       HIS 101  -7.752  -0.388   8.132
  756    HB2  HIS 101           HB2      HIS 101  -5.129  -1.097   6.768
  757    HB3  HIS 101           HB3      HIS 101  -5.587  -1.380   8.443
  758    HD1  HIS 101           HD1      HIS 101  -6.022  -2.824   4.917
  759    HD2  HIS 101           HD2      HIS 101  -7.029  -3.640   8.930
  760    HE1  HIS 101           HE1      HIS 101  -7.005  -5.170   4.935
  761    H    VAL 102           H        VAL 102  -6.716   1.305   9.315
  762    HA   VAL 102           HA       VAL 102  -5.288   3.423   7.760
  763    HB   VAL 102           HB       VAL 102  -5.058   4.607   9.924
  764   HG11  VAL 102          HG11      VAL 102  -7.885   3.956   9.024
  765   HG12  VAL 102          HG12      VAL 102  -7.389   5.379   9.965
  766   HG13  VAL 102          HG13      VAL 102  -6.790   5.166   8.312
  767   HG21  VAL 102          HG21      VAL 102  -5.338   2.677  11.486
  768   HG22  VAL 102          HG22      VAL 102  -6.426   4.029  11.828
  769   HG23  VAL 102          HG23      VAL 102  -7.055   2.590  11.020
  770    H    GLY 103           H        GLY 103  -3.047   4.148   8.732
  771    HA2  GLY 103           HA2      GLY 103  -1.341   2.002   8.031
  772    HA3  GLY 103           HA3      GLY 103  -0.843   3.513   8.739
  773    H    ALA 104           H        ALA 104  -2.061   3.332  11.306
  774    HA   ALA 104           HA       ALA 104  -0.313   1.628  12.763
  775    HB1  ALA 104           HB1      ALA 104  -1.688   2.269  14.688
  776    HB2  ALA 104           HB2      ALA 104  -1.448   3.676  13.638
  777    HB3  ALA 104           HB3      ALA 104  -2.996   2.809  13.615
  778    H    ASP 105           H        ASP 105  -3.616   1.013  11.556
  779    HA   ASP 105           HA       ASP 105  -3.922  -1.488  13.015
  780    HB2  ASP 105           HB2      ASP 105  -5.732   0.234  12.497
  781    HB3  ASP 105           HB3      ASP 105  -5.698  -0.392  10.847
  782    H    THR 106           H        THR 106  -2.248  -0.729  10.199
  783    HA   THR 106           HA       THR 106  -2.943  -2.919   8.503
  784    HB   THR 106           HB       THR 106  -0.794  -2.532   7.352
  785    HG1  THR 106           HG1      THR 106  -0.235  -0.469   9.142
  786   HG21  THR 106          HG21      THR 106  -2.254   0.019   7.976
  787   HG22  THR 106          HG22      THR 106  -1.093  -0.223   6.654
  788   HG23  THR 106          HG23      THR 106  -2.623  -1.132   6.691
  789    H    THR 107           H        THR 107  -1.709  -4.745   7.876
  790    HA   THR 107           HA       THR 107  -0.599  -6.333  10.045
  791    HB   THR 107           HB       THR 107  -1.773  -7.262   8.069
  792    HG1  THR 107           HG1      THR 107  -0.847  -8.955   8.656
  793   HG21  THR 107          HG21      THR 107   0.855  -6.857   6.580
  794   HG22  THR 107          HG22      THR 107  -0.587  -7.715   6.011
  795   HG23  THR 107          HG23      THR 107  -0.653  -5.964   6.250
  796    H    LEU 108           H        LEU 108   0.857  -4.146   7.657
  797    HA   LEU 108           HA       LEU 108   3.588  -4.736   8.087
  798    HB2  LEU 108           HB2      LEU 108   2.570  -3.231   6.313
  799    HB3  LEU 108           HB3      LEU 108   2.244  -2.042   7.570
  800    HG   LEU 108           HG       LEU 108   4.762  -1.990   8.051
  801   HD11  LEU 108          HD11      LEU 108   4.750  -3.547   5.432
  802   HD12  LEU 108          HD12      LEU 108   6.181  -2.754   6.150
  803   HD13  LEU 108          HD13      LEU 108   5.391  -4.121   6.981
  804   HD21  LEU 108          HD21      LEU 108   5.256  -0.534   6.200
  805   HD22  LEU 108          HD22      LEU 108   3.986  -1.268   5.210
  806   HD23  LEU 108          HD23      LEU 108   3.551  -0.311   6.647
  807    H    SER 109           H        SER 109   1.433  -2.442   9.841
  808    HA   SER 109           HA       SER 109   3.402  -1.763  11.852
  809    HB2  SER 109           HB2      SER 109   0.403  -1.451  11.677
  810    HB3  SER 109           HB3      SER 109   1.312  -1.027  13.143
  811    HG   SER 109           HG       SER 109   1.021   0.392  10.921
  812    H    GLN 110           H        GLN 110   1.285  -4.593  11.497
  813    HA   GLN 110           HA       GLN 110   1.667  -5.410  14.272
  814    HB2  GLN 110           HB2      GLN 110  -0.254  -6.230  13.003
  815    HB3  GLN 110           HB3      GLN 110   0.797  -7.096  11.915
  816    HG2  GLN 110           HG2      GLN 110   0.122  -8.728  13.404
  817    HG3  GLN 110           HG3      GLN 110   1.749  -8.377  13.930
  818   HE21  GLN 110          HE22      GLN 110  -1.652  -7.519  14.437
  819   HE22  GLN 110          HE21      GLN 110  -1.503  -7.320  16.183
  820    H    ILE 111           H        ILE 111   3.396  -6.096  11.197
  821    HA   ILE 111           HA       ILE 111   5.138  -8.087  12.181
  822    HB   ILE 111           HB       ILE 111   5.588  -5.961  10.062
  823   HG12  ILE 111          HG12      ILE 111   5.133  -8.973   9.814
  824   HG13  ILE 111          HG13      ILE 111   3.830  -7.798   9.756
  825   HG21  ILE 111          HG21      ILE 111   7.402  -8.320  10.745
  826   HG22  ILE 111          HG22      ILE 111   7.546  -7.302   9.294
  827   HG23  ILE 111          HG23      ILE 111   7.825  -6.600  10.879
  828   HD11  ILE 111          HD11      ILE 111   4.379  -8.367   7.505
  829   HD12  ILE 111          HD12      ILE 111   4.929  -6.703   7.777
  830   HD13  ILE 111          HD13      ILE 111   6.100  -8.046   7.750
  831    H    VAL 112           H        VAL 112   5.864  -4.523  12.174
  832    HA   VAL 112           HA       VAL 112   8.150  -4.826  13.830
  833    HB   VAL 112           HB       VAL 112   7.890  -2.425  14.426
  834   HG11  VAL 112          HG11      VAL 112   7.660  -3.090  11.469
  835   HG12  VAL 112          HG12      VAL 112   8.355  -1.614  12.181
  836   HG13  VAL 112          HG13      VAL 112   9.144  -3.171  12.456
  837   HG21  VAL 112          HG21      VAL 112   5.408  -2.216  14.331
  838   HG22  VAL 112          HG22      VAL 112   6.234  -1.047  13.298
  839   HG23  VAL 112          HG23      VAL 112   5.469  -2.473  12.571
  840    H    LYS 113           H        LYS 113   4.767  -4.810  14.825
  841    HA   LYS 113           HA       LYS 113   5.363  -4.342  17.667
  842    HB2  LYS 113           HB2      LYS 113   2.884  -5.189  16.188
  843    HB3  LYS 113           HB3      LYS 113   2.989  -5.234  17.945
  844    HG2  LYS 113           HG2      LYS 113   3.608  -2.823  18.004
  845    HG3  LYS 113           HG3      LYS 113   3.388  -2.738  16.250
  846    HD2  LYS 113           HD2      LYS 113   1.224  -3.569  18.249
  847    HD3  LYS 113           HD3      LYS 113   1.398  -1.935  17.580
  848    HE2  LYS 113           HE2      LYS 113   1.031  -2.705  15.333
  849    HE3  LYS 113           HE3      LYS 113   1.139  -4.392  15.821
  850    HZ1  LYS 113           HZ1      LYS 113  -1.005  -2.638  16.848
  851    HZ2  LYS 113           HZ2      LYS 113  -1.151  -3.534  15.455
  852    HZ3  LYS 113           HZ3      LYS 113  -0.922  -4.251  16.942
  853    H    LEU 114           H        LEU 114   4.902  -7.156  15.569
  854    HA   LEU 114           HA       LEU 114   4.833  -9.271  17.516
  855    HB2  LEU 114           HB2      LEU 114   4.288  -9.108  14.938
  856    HB3  LEU 114           HB3      LEU 114   6.004  -9.452  14.729
  857    HG   LEU 114           HG       LEU 114   3.904 -11.191  16.079
  858   HD11  LEU 114          HD11      LEU 114   3.834 -11.098  13.597
  859   HD12  LEU 114          HD12      LEU 114   5.538 -11.596  13.539
  860   HD13  LEU 114          HD13      LEU 114   4.297 -12.691  14.204
  861   HD21  LEU 114          HD21      LEU 114   6.899 -11.577  15.758
  862   HD22  LEU 114          HD22      LEU 114   5.928 -11.525  17.257
  863   HD23  LEU 114          HD23      LEU 114   5.768 -12.894  16.157
  864    H    VAL 115           H        VAL 115   7.482  -7.782  15.689
  865    HA   VAL 115           HA       VAL 115   9.540  -9.318  17.102
  866    HB   VAL 115           HB       VAL 115   9.832  -6.888  15.303
  867   HG11  VAL 115          HG11      VAL 115  11.905  -8.834  16.443
  868   HG12  VAL 115          HG12      VAL 115  12.208  -7.645  15.165
  869   HG13  VAL 115          HG13      VAL 115  11.796  -7.094  16.791
  870   HG21  VAL 115          HG21      VAL 115   8.956  -8.834  14.094
  871   HG22  VAL 115          HG22      VAL 115  10.668  -8.631  13.691
  872   HG23  VAL 115          HG23      VAL 115  10.177  -9.886  14.839
  873    H    GLU 116           H        GLU 116   8.533  -5.861  17.388
  874    HA   GLU 116           HA       GLU 116   9.997  -5.221  19.638
  875    HB2  GLU 116           HB2      GLU 116   8.539  -3.747  18.269
  876    HB3  GLU 116           HB3      GLU 116   7.122  -4.341  19.129
  877    HG2  GLU 116           HG2      GLU 116   9.491  -2.973  20.468
  878    HG3  GLU 116           HG3      GLU 116   8.154  -2.075  19.761
  879    H    GLU 117           H        GLU 117   7.065  -7.246  19.706
  880    HA   GLU 117           HA       GLU 117   6.786  -7.298  22.608
  881    HB2  GLU 117           HB2      GLU 117   5.762  -8.997  20.303
  882    HB3  GLU 117           HB3      GLU 117   5.410  -9.403  21.979
  883    HG2  GLU 117           HG2      GLU 117   4.857  -6.600  21.142
  884    HG3  GLU 117           HG3      GLU 117   3.803  -7.858  20.478
  885    H    ALA 118           H        ALA 118   8.812  -8.996  20.352
  886    HA   ALA 118           HA       ALA 118   9.313 -11.319  22.011
  887    HB1  ALA 118           HB1      ALA 118  10.997 -10.180  19.739
  888    HB2  ALA 118           HB2      ALA 118  11.046 -11.826  20.367
  889    HB3  ALA 118           HB3      ALA 118   9.598 -11.249  19.533
  890    H    GLN 119           H        GLN 119  11.234  -8.308  21.475
  891    HA   GLN 119           HA       GLN 119  12.967  -8.547  23.649
  892    HB2  GLN 119           HB2      GLN 119  11.784  -6.106  22.262
  893    HB3  GLN 119           HB3      GLN 119  13.044  -6.024  23.457
  894    HG2  GLN 119           HG2      GLN 119  14.376  -5.938  21.664
  895    HG3  GLN 119           HG3      GLN 119  14.320  -7.706  21.865
  896   HE21  GLN 119          HE22      GLN 119  13.084  -8.934  20.384
  897   HE22  GLN 119          HE21      GLN 119  11.953  -8.096  19.326
  Start of MODEL    4
    1    H    SER   1           H        SER   1  19.757  -3.778  14.526
    2    HA   SER   1           HA       SER   1  17.068  -3.242  15.502
    3    HB2  SER   1           HB2      SER   1  19.602  -1.586  15.805
    4    HB3  SER   1           HB3      SER   1  18.133  -1.481  16.798
    5    HG   SER   1           HG       SER   1  19.787  -2.762  17.756
    6    H    GLU   2           H        GLU   2  18.989  -1.834  12.837
    7    HA   GLU   2           HA       GLU   2  17.117   0.425  12.551
    8    HB2  GLU   2           HB2      GLU   2  19.413  -0.632  10.862
    9    HB3  GLU   2           HB3      GLU   2  18.313   0.594  10.253
   10    HG2  GLU   2           HG2      GLU   2  19.951   0.854  12.801
   11    HG3  GLU   2           HG3      GLU   2  20.331   1.603  11.246
   12    H    ALA   3           H        ALA   3  17.325  -2.868  11.232
   13    HA   ALA   3           HA       ALA   3  15.297  -2.681   9.311
   14    HB1  ALA   3           HB1      ALA   3  15.871  -4.985  11.225
   15    HB2  ALA   3           HB2      ALA   3  15.048  -5.098   9.672
   16    HB3  ALA   3           HB3      ALA   3  16.757  -4.647   9.718
   17    H    LEU   4           H        LEU   4  14.949  -2.766  12.855
   18    HA   LEU   4           HA       LEU   4  12.065  -2.977  12.925
   19    HB2  LEU   4           HB2      LEU   4  13.780  -3.408  14.819
   20    HB3  LEU   4           HB3      LEU   4  13.906  -1.656  14.951
   21    HG   LEU   4           HG       LEU   4  11.375  -1.621  15.405
   22   HD11  LEU   4          HD11      LEU   4  11.996  -4.554  15.886
   23   HD12  LEU   4          HD12      LEU   4  10.468  -3.732  16.306
   24   HD13  LEU   4          HD13      LEU   4  10.928  -3.940  14.604
   25   HD21  LEU   4          HD21      LEU   4  13.225  -3.040  17.371
   26   HD22  LEU   4          HD22      LEU   4  13.070  -1.282  17.167
   27   HD23  LEU   4          HD23      LEU   4  11.698  -2.218  17.770
   28    H    ALA   5           H        ALA   5  14.282  -0.255  12.421
   29    HA   ALA   5           HA       ALA   5  12.191   1.781  12.799
   30    HB1  ALA   5           HB1      ALA   5  14.436   2.321  13.548
   31    HB2  ALA   5           HB2      ALA   5  15.103   1.978  11.941
   32    HB3  ALA   5           HB3      ALA   5  13.991   3.341  12.169
   33    H    LYS   6           H        LYS   6  13.709  -0.111  10.148
   34    HA   LYS   6           HA       LYS   6  13.057   1.543   7.998
   35    HB2  LYS   6           HB2      LYS   6  14.499  -0.462   7.888
   36    HB3  LYS   6           HB3      LYS   6  13.066  -1.502   8.001
   37    HG2  LYS   6           HG2      LYS   6  12.185  -0.604   5.897
   38    HG3  LYS   6           HG3      LYS   6  13.478   0.610   5.831
   39    HD2  LYS   6           HD2      LYS   6  15.160  -1.170   5.594
   40    HD3  LYS   6           HD3      LYS   6  13.883  -2.406   5.688
   41    HE2  LYS   6           HE2      LYS   6  12.848  -1.561   3.639
   42    HE3  LYS   6           HE3      LYS   6  13.970  -0.190   3.593
   43    HZ1  LYS   6           HZ1      LYS   6  14.885  -3.013   3.430
   44    HZ2  LYS   6           HZ2      LYS   6  14.641  -2.046   2.089
   45    HZ3  LYS   6           HZ3      LYS   6  15.780  -1.689   3.189
   46    H    LEU   7           H        LEU   7  10.893  -0.830   9.562
   47    HA   LEU   7           HA       LEU   7   8.701  -0.616   7.760
   48    HB2  LEU   7           HB2      LEU   7   8.958  -1.223  10.712
   49    HB3  LEU   7           HB3      LEU   7   7.373  -1.135   9.971
   50    HG   LEU   7           HG       LEU   7   8.110  -3.423  10.219
   51   HD11  LEU   7          HD11      LEU   7   8.051  -2.707   7.264
   52   HD12  LEU   7          HD12      LEU   7   7.604  -4.250   8.016
   53   HD13  LEU   7          HD13      LEU   7   6.634  -2.806   8.335
   54   HD21  LEU   7          HD21      LEU   7  10.320  -2.860   8.210
   55   HD22  LEU   7          HD22      LEU   7  10.541  -3.138   9.962
   56   HD23  LEU   7          HD23      LEU   7   9.891  -4.419   8.932
   57    H    ILE   8           H        ILE   8   9.670   1.632  10.333
   58    HA   ILE   8           HA       ILE   8   7.307   3.303  10.102
   59    HB   ILE   8           HB       ILE   8   9.969   3.930  11.384
   60   HG12  ILE   8          HG12      ILE   8   8.912   1.963  12.386
   61   HG13  ILE   8          HG13      ILE   8   8.910   3.331  13.486
   62   HG21  ILE   8          HG21      ILE   8   7.268   5.325  11.487
   63   HG22  ILE   8          HG22      ILE   8   8.579   5.616  12.644
   64   HG23  ILE   8          HG23      ILE   8   8.817   5.991  10.934
   65   HD11  ILE   8          HD11      ILE   8   6.487   3.700  12.971
   66   HD12  ILE   8          HD12      ILE   8   6.522   2.276  11.898
   67   HD13  ILE   8          HD13      ILE   8   6.813   2.098  13.638
   68    H    SER   9           H        SER   9  10.628   3.448   8.784
   69    HA   SER   9           HA       SER   9  10.212   5.991   7.409
   70    HB2  SER   9           HB2      SER   9  12.414   3.920   7.089
   71    HB3  SER   9           HB3      SER   9  12.456   5.608   6.546
   72    HG   SER   9           HG       SER   9  13.516   5.126   8.594
   73    H    LEU  10           H        LEU  10   9.599   2.699   6.653
   74    HA   LEU  10           HA       LEU  10   9.327   2.777   3.796
   75    HB2  LEU  10           HB2      LEU  10   9.718   0.811   5.189
   76    HB3  LEU  10           HB3      LEU  10   8.140   1.022   5.956
   77    HG   LEU  10           HG       LEU  10   7.053   0.521   3.776
   78   HD11  LEU  10          HD11      LEU  10   9.940   0.085   2.867
   79   HD12  LEU  10          HD12      LEU  10   8.527  -0.525   1.999
   80   HD13  LEU  10          HD13      LEU  10   8.762   1.219   2.161
   81   HD21  LEU  10          HD21      LEU  10   7.543  -1.250   5.405
   82   HD22  LEU  10          HD22      LEU  10   7.727  -1.863   3.749
   83   HD23  LEU  10          HD23      LEU  10   9.168  -1.459   4.707
   84    H    GLN  11           H        GLN  11   7.281   3.950   6.405
   85    HA   GLN  11           HA       GLN  11   4.785   3.602   4.988
   86    HB2  GLN  11           HB2      GLN  11   5.583   4.568   7.685
   87    HB3  GLN  11           HB3      GLN  11   4.015   5.072   7.086
   88    HG2  GLN  11           HG2      GLN  11   3.283   2.801   6.738
   89    HG3  GLN  11           HG3      GLN  11   4.890   2.160   7.133
   90   HE21  GLN  11          HE22      GLN  11   5.569   2.060   9.287
   91   HE22  GLN  11          HE21      GLN  11   4.459   2.508  10.601
   92    H    ALA  12           H        ALA  12   3.349   5.122   4.266
   93    HA   ALA  12           HA       ALA  12   4.540   7.135   2.641
   94    HB1  ALA  12           HB1      ALA  12   1.619   6.426   3.149
   95    HB2  ALA  12           HB2      ALA  12   2.239   7.363   1.774
   96    HB3  ALA  12           HB3      ALA  12   2.690   5.664   1.952
   97    H    THR  13           H        THR  13   3.904   9.309   2.365
   98    HA   THR  13           HA       THR  13   3.035  10.796   4.818
   99    HB   THR  13           HB       THR  13   3.944  12.798   3.539
  100    HG1  THR  13           HG1      THR  13   4.684  12.467   1.609
  101   HG21  THR  13          HG21      THR  13   5.904  10.531   4.143
  102   HG22  THR  13          HG22      THR  13   6.296  12.262   4.021
  103   HG23  THR  13          HG23      THR  13   5.251  11.677   5.326
  104    H    GLU  14           H        GLU  14   2.265  10.469   1.351
  105    HA   GLU  14           HA       GLU  14  -0.330  11.855   1.806
  106    HB2  GLU  14           HB2      GLU  14  -0.044  13.030  -0.321
  107    HB3  GLU  14           HB3      GLU  14   1.207  13.463   0.843
  108    HG2  GLU  14           HG2      GLU  14   2.833  12.006  -0.305
  109    HG3  GLU  14           HG3      GLU  14   1.574  11.445  -1.411
  110    H    ALA  15           H        ALA  15  -2.029  11.408   0.302
  111    HA   ALA  15           HA       ALA  15  -1.776   9.011  -1.403
  112    HB1  ALA  15           HB1      ALA  15  -3.833   9.287   0.828
  113    HB2  ALA  15           HB2      ALA  15  -3.745   7.961  -0.354
  114    HB3  ALA  15           HB3      ALA  15  -2.441   8.179   0.826
  115    H    THR  16           H        THR  16  -3.629   8.655  -2.815
  116    HA   THR  16           HA       THR  16  -5.013  11.216  -3.580
  117    HB   THR  16           HB       THR  16  -4.287   8.996  -5.499
  118    HG1  THR  16           HG1      THR  16  -2.395   9.651  -5.198
  119   HG21  THR  16          HG21      THR  16  -6.047  10.505  -6.300
  120   HG22  THR  16          HG22      THR  16  -5.059  11.921  -5.888
  121   HG23  THR  16          HG23      THR  16  -4.540  10.806  -7.175
  122    H    ILE  17           H        ILE  17  -7.074  11.129  -2.941
  123    HA   ILE  17           HA       ILE  17  -8.598   8.583  -2.891
  124    HB   ILE  17           HB       ILE  17  -9.389  11.379  -1.987
  125   HG12  ILE  17          HG12      ILE  17  -8.425   8.973  -0.388
  126   HG13  ILE  17          HG13      ILE  17  -7.554  10.483  -0.621
  127   HG21  ILE  17          HG21      ILE  17 -10.786   8.692  -1.569
  128   HG22  ILE  17          HG22      ILE  17 -11.299  10.251  -0.879
  129   HG23  ILE  17          HG23      ILE  17 -11.363  10.017  -2.605
  130   HD11  ILE  17          HD11      ILE  17 -10.112  10.115   0.973
  131   HD12  ILE  17          HD12      ILE  17  -8.507  10.464   1.589
  132   HD13  ILE  17          HD13      ILE  17  -9.359  11.692   0.622
  133    H    VAL  18           H        VAL  18 -10.188   8.023  -4.336
  134    HA   VAL  18           HA       VAL  18 -10.809   9.950  -6.531
  135    HB   VAL  18           HB       VAL  18 -11.057   6.941  -6.548
  136   HG11  VAL  18          HG11      VAL  18 -11.317   7.241  -9.007
  137   HG12  VAL  18          HG12      VAL  18 -12.643   7.965  -8.108
  138   HG13  VAL  18          HG13      VAL  18 -11.360   9.001  -8.776
  139   HG21  VAL  18          HG21      VAL  18  -8.913   8.730  -7.722
  140   HG22  VAL  18          HG22      VAL  18  -8.715   7.460  -6.498
  141   HG23  VAL  18          HG23      VAL  18  -9.163   7.026  -8.151
  142    H    THR  19           H        THR  19 -12.790  10.463  -6.967
  143    HA   THR  19           HA       THR  19 -15.045   9.646  -5.159
  144    HB   THR  19           HB       THR  19 -14.483  12.445  -6.213
  145    HG1  THR  19           HG1      THR  19 -12.787  11.981  -4.956
  146   HG21  THR  19          HG21      THR  19 -16.776  12.059  -5.344
  147   HG22  THR  19          HG22      THR  19 -16.081  11.475  -3.809
  148   HG23  THR  19          HG23      THR  19 -15.843  13.157  -4.312
  149    H    LEU  20           H        LEU  20 -17.091   9.455  -6.096
  150    HA   LEU  20           HA       LEU  20 -17.204   9.709  -9.066
  151    HB2  LEU  20           HB2      LEU  20 -19.039   8.098  -7.259
  152    HB3  LEU  20           HB3      LEU  20 -19.065   8.161  -9.013
  153    HG   LEU  20           HG       LEU  20 -16.735   7.085  -7.359
  154   HD11  LEU  20          HD11      LEU  20 -17.462   4.883  -8.089
  155   HD12  LEU  20          HD12      LEU  20 -18.757   5.683  -7.188
  156   HD13  LEU  20          HD13      LEU  20 -18.837   5.585  -8.961
  157   HD21  LEU  20          HD21      LEU  20 -15.977   7.914  -9.546
  158   HD22  LEU  20          HD22      LEU  20 -15.959   6.149  -9.526
  159   HD23  LEU  20          HD23      LEU  20 -17.265   7.009 -10.369
  160    H    ASP  21           H        ASP  21 -18.366  11.289  -9.987
  161    HA   ASP  21           HA       ASP  21 -19.994  12.975  -8.130
  162    HB2  ASP  21           HB2      ASP  21 -17.610  13.669  -9.100
  163    HB3  ASP  21           HB3      ASP  21 -18.563  14.166 -10.465
  164    H    SER  22           H        SER  22 -20.975  10.987 -10.445
  165    HA   SER  22           HA       SER  22 -23.203  12.817 -11.205
  166    HB2  SER  22           HB2      SER  22 -21.625  11.280 -13.258
  167    HB3  SER  22           HB3      SER  22 -23.304  11.776 -13.510
  168    HG   SER  22           HG       SER  22 -21.699  13.211 -14.315
  169    H    ASP  23           H        ASP  23 -22.313   9.517 -12.157
  170    HA   ASP  23           HA       ASP  23 -24.072   8.106 -10.418
  171    HB2  ASP  23           HB2      ASP  23 -25.792   9.003 -11.989
  172    HB3  ASP  23           HB3      ASP  23 -24.950   8.258 -13.345
  173    H    ASN  24           H        ASN  24 -21.674   7.657 -10.341
  174    HA   ASN  24           HA       ASN  24 -19.730   6.715 -10.775
  175    HB2  ASN  24           HB2      ASN  24 -19.716   4.297 -11.332
  176    HB3  ASN  24           HB3      ASN  24 -20.798   4.764 -10.040
  177   HD21  ASN  24          HD22      ASN  24 -22.901   4.288 -10.218
  178   HD22  ASN  24          HD21      ASN  24 -23.552   3.412 -11.608
  179    H    ILE  25           H        ILE  25 -21.390   7.380 -13.679
  180    HA   ILE  25           HA       ILE  25 -19.261   6.792 -15.490
  181    HB   ILE  25           HB       ILE  25 -20.507   8.245 -17.049
  182   HG12  ILE  25          HG12      ILE  25 -22.388   8.804 -14.704
  183   HG13  ILE  25          HG13      ILE  25 -21.264   9.965 -15.411
  184   HG21  ILE  25          HG21      ILE  25 -22.427   6.804 -17.221
  185   HG22  ILE  25          HG22      ILE  25 -21.072   5.843 -16.631
  186   HG23  ILE  25          HG23      ILE  25 -22.336   6.373 -15.501
  187   HD11  ILE  25          HD11      ILE  25 -23.679   8.716 -16.777
  188   HD12  ILE  25          HD12      ILE  25 -23.462  10.400 -16.280
  189   HD13  ILE  25          HD13      ILE  25 -22.474   9.739 -17.601
  190    H    LEU  26           H        LEU  26 -19.118   9.057 -13.113
  191    HA   LEU  26           HA       LEU  26 -17.147  10.767 -14.575
  192    HB2  LEU  26           HB2      LEU  26 -19.222  11.994 -14.399
  193    HB3  LEU  26           HB3      LEU  26 -19.359  11.629 -12.682
  194    HG   LEU  26           HG       LEU  26 -17.486  13.059 -12.140
  195   HD11  LEU  26          HD11      LEU  26 -17.245  13.617 -15.113
  196   HD12  LEU  26          HD12      LEU  26 -16.406  14.489 -13.805
  197   HD13  LEU  26          HD13      LEU  26 -16.034  12.794 -14.095
  198   HD21  LEU  26          HD21      LEU  26 -19.725  14.116 -12.424
  199   HD22  LEU  26          HD22      LEU  26 -18.416  15.236 -12.819
  200   HD23  LEU  26          HD23      LEU  26 -19.343  14.460 -14.119
  201    H    LEU  27           H        LEU  27 -15.321  10.717 -13.742
  202    HA   LEU  27           HA       LEU  27 -14.803   9.968 -10.861
  203    HB2  LEU  27           HB2      LEU  27 -13.143   9.376 -13.338
  204    HB3  LEU  27           HB3      LEU  27 -12.503   9.296 -11.703
  205    HG   LEU  27           HG       LEU  27 -14.206   7.569 -11.111
  206   HD11  LEU  27          HD11      LEU  27 -14.762   7.590 -14.111
  207   HD12  LEU  27          HD12      LEU  27 -15.188   6.253 -13.021
  208   HD13  LEU  27          HD13      LEU  27 -15.941   7.819 -12.794
  209   HD21  LEU  27          HD21      LEU  27 -11.918   6.965 -11.678
  210   HD22  LEU  27          HD22      LEU  27 -13.026   5.756 -12.315
  211   HD23  LEU  27          HD23      LEU  27 -12.318   6.953 -13.420
  212    H    SER  28           H        SER  28 -13.856  11.383  -9.570
  213    HA   SER  28           HA       SER  28 -12.112  13.583 -10.610
  214    HB2  SER  28           HB2      SER  28 -14.397  14.462 -10.332
  215    HB3  SER  28           HB3      SER  28 -14.461  13.810  -8.688
  216    HG   SER  28           HG       SER  28 -13.950  15.868  -8.448
  217    H    GLU  29           H        GLU  29 -10.331  14.041  -9.208
  218    HA   GLU  29           HA       GLU  29 -10.158  12.265  -6.814
  219    HB2  GLU  29           HB2      GLU  29  -7.747  12.923  -8.484
  220    HB3  GLU  29           HB3      GLU  29  -7.995  11.686  -7.255
  221    HG2  GLU  29           HG2      GLU  29  -8.036  10.413  -9.132
  222    HG3  GLU  29           HG3      GLU  29  -9.752  10.660  -8.835
  223    H    GLU  30           H        GLU  30  -8.992  12.773  -5.071
  224    HA   GLU  30           HA       GLU  30  -8.238  15.637  -4.587
  225    HB2  GLU  30           HB2      GLU  30  -9.157  13.745  -2.411
  226    HB3  GLU  30           HB3      GLU  30  -9.099  15.503  -2.411
  227    HG2  GLU  30           HG2      GLU  30 -11.005  15.442  -4.118
  228    HG3  GLU  30           HG3      GLU  30 -11.106  13.695  -3.824
  229    H    GLN  31           H        GLN  31  -6.288  15.991  -3.305
  230    HA   GLN  31           HA       GLN  31  -4.711  13.510  -2.709
  231    HB2  GLN  31           HB2      GLN  31  -3.455  16.197  -3.208
  232    HB3  GLN  31           HB3      GLN  31  -2.713  14.605  -2.934
  233    HG2  GLN  31           HG2      GLN  31  -4.141  13.966  -5.113
  234    HG3  GLN  31           HG3      GLN  31  -3.922  15.696  -5.437
  235   HE21  GLN  31          HE21      GLN  31  -2.278  12.609  -4.808
  236   HE22  GLN  31          HE22      GLN  31  -0.727  13.128  -5.487
  237    H    VAL  32           H        VAL  32  -4.152  13.129  -0.693
  238    HA   VAL  32           HA       VAL  32  -4.605  15.222   1.404
  239    HB   VAL  32           HB       VAL  32  -5.795  13.644   2.762
  240   HG11  VAL  32          HG11      VAL  32  -7.104  13.625   0.023
  241   HG12  VAL  32          HG12      VAL  32  -7.891  13.499   1.606
  242   HG13  VAL  32          HG13      VAL  32  -7.096  15.013   1.136
  243   HG21  VAL  32          HG21      VAL  32  -4.779  11.506   2.024
  244   HG22  VAL  32          HG22      VAL  32  -6.537  11.451   1.999
  245   HG23  VAL  32          HG23      VAL  32  -5.642  11.636   0.474
  246    H    ASP  33           H        ASP  33  -3.750  14.789   3.452
  247    HA   ASP  33           HA       ASP  33  -1.151  13.400   3.525
  248    HB2  ASP  33           HB2      ASP  33  -2.787  15.043   5.472
  249    HB3  ASP  33           HB3      ASP  33  -1.527  13.979   6.087
  250    H    VAL  34           H        VAL  34  -0.678  11.497   4.702
  251    HA   VAL  34           HA       VAL  34  -2.568   9.451   4.526
  252    HB   VAL  34           HB       VAL  34  -0.099   9.217   4.557
  253   HG11  VAL  34          HG11      VAL  34   0.442  10.551   6.563
  254   HG12  VAL  34          HG12      VAL  34  -0.357   9.339   7.592
  255   HG13  VAL  34          HG13      VAL  34   1.090   8.911   6.678
  256   HG21  VAL  34          HG21      VAL  34  -1.591   7.243   4.723
  257   HG22  VAL  34          HG22      VAL  34  -0.033   7.012   5.535
  258   HG23  VAL  34          HG23      VAL  34  -1.486   7.331   6.496
  259    H    GLU  35           H        GLU  35  -2.172  11.611   7.237
  260    HA   GLU  35           HA       GLU  35  -3.600  10.149   9.253
  261    HB2  GLU  35           HB2      GLU  35  -3.181  13.043   8.749
  262    HB3  GLU  35           HB3      GLU  35  -3.985  12.446  10.202
  263    HG2  GLU  35           HG2      GLU  35  -1.999  11.332  10.966
  264    HG3  GLU  35           HG3      GLU  35  -1.182  11.566   9.420
  265    H    LEU  36           H        LEU  36  -4.737  11.815   6.393
  266    HA   LEU  36           HA       LEU  36  -7.473  12.200   7.463
  267    HB2  LEU  36           HB2      LEU  36  -6.237  13.189   4.887
  268    HB3  LEU  36           HB3      LEU  36  -7.707  13.777   5.649
  269    HG   LEU  36           HG       LEU  36  -4.860  14.149   6.691
  270   HD11  LEU  36          HD11      LEU  36  -6.863  16.105   5.505
  271   HD12  LEU  36          HD12      LEU  36  -5.259  16.512   6.144
  272   HD13  LEU  36          HD13      LEU  36  -5.403  15.492   4.703
  273   HD21  LEU  36          HD21      LEU  36  -6.433  14.023   8.589
  274   HD22  LEU  36          HD22      LEU  36  -5.865  15.676   8.346
  275   HD23  LEU  36          HD23      LEU  36  -7.494  15.215   7.802
  276    H    VAL  37           H        VAL  37  -5.998   9.790   5.648
  277    HA   VAL  37           HA       VAL  37  -8.402   9.216   3.985
  278    HB   VAL  37           HB       VAL  37  -6.310   9.060   2.813
  279   HG11  VAL  37          HG11      VAL  37  -5.524   6.845   4.751
  280   HG12  VAL  37          HG12      VAL  37  -4.678   7.267   3.247
  281   HG13  VAL  37          HG13      VAL  37  -4.746   8.435   4.564
  282   HG21  VAL  37          HG21      VAL  37  -8.155   7.600   2.138
  283   HG22  VAL  37          HG22      VAL  37  -6.575   6.861   1.828
  284   HG23  VAL  37          HG23      VAL  37  -7.545   6.307   3.201
  285    H    GLN  38           H        GLN  38  -9.691   7.453   4.293
  286    HA   GLN  38           HA       GLN  38  -9.513   6.079   6.956
  287    HB2  GLN  38           HB2      GLN  38 -11.913   7.173   5.464
  288    HB3  GLN  38           HB3      GLN  38 -12.018   6.180   6.919
  289    HG2  GLN  38           HG2      GLN  38 -10.898   7.881   8.245
  290    HG3  GLN  38           HG3      GLN  38 -10.658   8.905   6.816
  291   HE21  GLN  38          HE22      GLN  38 -13.290   8.612   5.677
  292   HE22  GLN  38          HE21      GLN  38 -14.406   9.193   6.893
  293    H    ARG  39           H        ARG  39 -10.858   4.130   7.046
  294    HA   ARG  39           HA       ARG  39 -10.045   2.364   4.873
  295    HB2  ARG  39           HB2      ARG  39 -10.554   0.557   6.303
  296    HB3  ARG  39           HB3      ARG  39  -9.818   1.824   7.274
  297    HG2  ARG  39           HG2      ARG  39 -12.313   2.483   7.826
  298    HG3  ARG  39           HG3      ARG  39 -12.690   0.871   7.192
  299    HD2  ARG  39           HD2      ARG  39 -11.172  -0.158   8.835
  300    HD3  ARG  39           HD3      ARG  39 -10.679   1.451   9.408
  301    HE   ARG  39           HE       ARG  39 -13.542   1.128   9.590
  302   HH11  ARG  39          HH11      ARG  39 -10.574   0.308  11.304
  303   HH12  ARG  39          HH12      ARG  39 -11.421   0.219  12.835
  304   HH21  ARG  39          HH21      ARG  39 -14.499   0.998  11.589
  305   HH22  ARG  39          HH22      ARG  39 -13.574   0.446  12.962
  306    H    GLY  40           H        GLY  40 -12.473   4.272   4.632
  307    HA2  GLY  40           HA2      GLY  40 -14.083   2.414   2.924
  308    HA3  GLY  40           HA3      GLY  40 -14.739   3.855   3.703
  309    H    ASP  41           H        ASP  41 -11.589   4.621   2.567
  310    HA   ASP  41           HA       ASP  41 -12.689   5.993   0.190
  311    HB2  ASP  41           HB2      ASP  41  -9.986   6.091   1.563
  312    HB3  ASP  41           HB3      ASP  41 -10.389   6.991   0.106
  313    H    ILE  42           H        ILE  42 -11.852   5.845  -1.892
  314    HA   ILE  42           HA       ILE  42 -10.484   3.287  -2.650
  315    HB   ILE  42           HB       ILE  42 -12.330   5.025  -4.297
  316   HG12  ILE  42          HG12      ILE  42 -13.650   3.887  -2.608
  317   HG13  ILE  42          HG13      ILE  42 -13.918   3.187  -4.189
  318   HG21  ILE  42          HG21      ILE  42 -12.237   3.104  -5.902
  319   HG22  ILE  42          HG22      ILE  42 -10.701   3.951  -5.725
  320   HG23  ILE  42          HG23      ILE  42 -10.935   2.385  -4.925
  321   HD11  ILE  42          HD11      ILE  42 -13.851   1.453  -2.482
  322   HD12  ILE  42          HD12      ILE  42 -12.498   1.247  -3.606
  323   HD13  ILE  42          HD13      ILE  42 -12.227   1.946  -1.989
  324    H    ILE  43           H        ILE  43  -8.413   3.508  -3.406
  325    HA   ILE  43           HA       ILE  43  -7.428   6.189  -4.129
  326    HB   ILE  43           HB       ILE  43  -6.047   3.694  -3.083
  327   HG12  ILE  43          HG12      ILE  43  -7.554   4.376  -1.351
  328   HG13  ILE  43          HG13      ILE  43  -5.914   4.762  -0.884
  329   HG21  ILE  43          HG21      ILE  43  -4.182   5.171  -2.468
  330   HG22  ILE  43          HG22      ILE  43  -4.456   5.148  -4.209
  331   HG23  ILE  43          HG23      ILE  43  -4.991   6.538  -3.248
  332   HD11  ILE  43          HD11      ILE  43  -7.954   6.767  -1.927
  333   HD12  ILE  43          HD12      ILE  43  -7.499   6.531  -0.246
  334   HD13  ILE  43          HD13      ILE  43  -6.301   7.158  -1.395
  335    H    LYS  44           H        LYS  44  -6.729   6.601  -6.212
  336    HA   LYS  44           HA       LYS  44  -5.941   4.386  -7.988
  337    HB2  LYS  44           HB2      LYS  44  -7.249   6.215  -8.861
  338    HB3  LYS  44           HB3      LYS  44  -5.922   7.347  -8.561
  339    HG2  LYS  44           HG2      LYS  44  -4.504   6.238 -10.142
  340    HG3  LYS  44           HG3      LYS  44  -5.526   4.799 -10.207
  341    HD2  LYS  44           HD2      LYS  44  -6.484   7.508 -11.158
  342    HD3  LYS  44           HD3      LYS  44  -5.607   6.356 -12.192
  343    HE2  LYS  44           HE2      LYS  44  -7.375   4.637 -11.669
  344    HE3  LYS  44           HE3      LYS  44  -8.295   5.913 -10.845
  345    HZ1  LYS  44           HZ1      LYS  44  -8.433   7.117 -12.913
  346    HZ2  LYS  44           HZ2      LYS  44  -7.488   6.008 -13.698
  347    HZ3  LYS  44           HZ3      LYS  44  -8.968   5.576 -13.174
  348    H    VAL  45           H        VAL  45  -4.046   3.503  -8.098
  349    HA   VAL  45           HA       VAL  45  -1.616   4.994  -7.242
  350    HB   VAL  45           HB       VAL  45  -2.190   2.908  -6.050
  351   HG11  VAL  45          HG11      VAL  45  -1.515   1.479  -8.645
  352   HG12  VAL  45          HG12      VAL  45  -1.785   0.745  -7.064
  353   HG13  VAL  45          HG13      VAL  45  -3.116   1.591  -7.861
  354   HG21  VAL  45          HG21      VAL  45   0.053   1.958  -6.053
  355   HG22  VAL  45          HG22      VAL  45   0.432   2.733  -7.606
  356   HG23  VAL  45          HG23      VAL  45   0.157   3.723  -6.152
  357    H    VAL  46           H        VAL  46  -0.039   5.507  -8.614
  358    HA   VAL  46           HA       VAL  46  -0.461   4.995 -11.480
  359    HB   VAL  46           HB       VAL  46   1.015   6.866 -11.852
  360   HG11  VAL  46          HG11      VAL  46  -0.787   7.566  -9.515
  361   HG12  VAL  46          HG12      VAL  46  -0.207   8.637 -10.798
  362   HG13  VAL  46          HG13      VAL  46  -1.340   7.334 -11.191
  363   HG21  VAL  46          HG21      VAL  46   2.049   8.126  -9.992
  364   HG22  VAL  46          HG22      VAL  46   1.617   6.808  -8.886
  365   HG23  VAL  46          HG23      VAL  46   2.758   6.525 -10.204
  366    HA   PRO  47           HA       PRO  47   3.207   2.457 -12.196
  367    HB2  PRO  47           HB2      PRO  47   4.382   3.667 -14.401
  368    HB3  PRO  47           HB3      PRO  47   2.983   2.546 -14.477
  369    HG2  PRO  47           HG2      PRO  47   2.968   5.576 -14.424
  370    HG3  PRO  47           HG3      PRO  47   2.073   4.496 -15.532
  371    HD2  PRO  47           HD2      PRO  47   0.816   5.522 -13.419
  372    HD3  PRO  47           HD3      PRO  47   0.591   3.799 -13.798
  373    H    GLY  48           H        GLY  48   5.096   2.452 -11.250
  374    HA2  GLY  48           HA2      GLY  48   7.107   3.099 -10.291
  375    HA3  GLY  48           HA3      GLY  48   6.827   4.782 -10.752
  376    H    GLY  49           H        GLY  49   3.958   4.025  -9.365
  377    HA2  GLY  49           HA2      GLY  49   4.517   5.485  -6.975
  378    HA3  GLY  49           HA3      GLY  49   2.989   4.726  -7.406
  379    H    LYS  50           H        LYS  50   3.956   4.868  -4.797
  380    HA   LYS  50           HA       LYS  50   4.506   1.990  -4.122
  381    HB2  LYS  50           HB2      LYS  50   4.978   4.443  -2.399
  382    HB3  LYS  50           HB3      LYS  50   5.343   2.764  -1.967
  383    HG2  LYS  50           HG2      LYS  50   6.997   2.664  -3.821
  384    HG3  LYS  50           HG3      LYS  50   6.632   4.352  -4.211
  385    HD2  LYS  50           HD2      LYS  50   7.311   4.985  -1.859
  386    HD3  LYS  50           HD3      LYS  50   7.809   3.302  -1.604
  387    HE2  LYS  50           HE2      LYS  50   9.391   3.530  -3.546
  388    HE3  LYS  50           HE3      LYS  50   8.905   5.222  -3.712
  389    HZ1  LYS  50           HZ1      LYS  50   9.754   5.615  -1.456
  390    HZ2  LYS  50           HZ2      LYS  50  10.197   4.038  -1.310
  391    HZ3  LYS  50           HZ3      LYS  50  10.941   4.987  -2.421
  392    H    PHE  51           H        PHE  51   3.155   0.927  -2.787
  393    HA   PHE  51           HA       PHE  51   0.438   1.889  -2.542
  394    HB2  PHE  51           HB2      PHE  51   1.808  -0.553  -1.387
  395    HB3  PHE  51           HB3      PHE  51   0.082  -0.240  -1.256
  396    HD1  PHE  51           HD2      PHE  51  -1.308  -0.003  -3.402
  397    HD2  PHE  51           HD1      PHE  51   2.709  -1.540  -3.362
  398    HE1  PHE  51           HE2      PHE  51  -1.636  -0.963  -5.667
  399    HE2  PHE  51           HE1      PHE  51   2.417  -2.389  -5.665
  400    HZ   PHE  51           HZ       PHE  51   0.233  -2.110  -6.830
  401    HA   PRO  52           HA       PRO  52   1.250   3.972   1.359
  402    HB2  PRO  52           HB2      PRO  52  -1.124   5.284   1.744
  403    HB3  PRO  52           HB3      PRO  52   0.062   5.748   0.495
  404    HG2  PRO  52           HG2      PRO  52  -2.397   3.993   0.159
  405    HG3  PRO  52           HG3      PRO  52  -1.899   5.401  -0.834
  406    HD2  PRO  52           HD2      PRO  52  -1.326   2.875  -1.614
  407    HD3  PRO  52           HD3      PRO  52  -0.144   4.189  -1.836
  408    H    VAL  53           H        VAL  53  -1.228   1.509   1.139
  409    HA   VAL  53           HA       VAL  53  -1.223   0.888   3.929
  410    HB   VAL  53           HB       VAL  53  -3.821   0.981   4.066
  411   HG11  VAL  53          HG11      VAL  53  -2.249   3.530   4.561
  412   HG12  VAL  53          HG12      VAL  53  -3.760   3.022   5.335
  413   HG13  VAL  53          HG13      VAL  53  -2.277   2.106   5.629
  414   HG21  VAL  53          HG21      VAL  53  -3.379   3.447   2.340
  415   HG22  VAL  53          HG22      VAL  53  -4.207   1.959   1.805
  416   HG23  VAL  53          HG23      VAL  53  -4.878   2.941   3.126
  417    H    ASP  54           H        ASP  54  -2.307  -1.221   4.294
  418    HA   ASP  54           HA       ASP  54  -2.232  -2.718   1.771
  419    HB2  ASP  54           HB2      ASP  54  -1.954  -4.652   2.898
  420    HB3  ASP  54           HB3      ASP  54  -1.026  -3.471   3.816
  421    H    GLY  55           H        GLY  55  -3.757  -3.960   0.781
  422    HA2  GLY  55           HA2      GLY  55  -6.487  -4.223   1.541
  423    HA3  GLY  55           HA3      GLY  55  -6.307  -2.714   0.648
  424    H    ARG  56           H        ARG  56  -7.712  -3.577  -0.906
  425    HA   ARG  56           HA       ARG  56  -6.667  -5.788  -2.653
  426    HB2  ARG  56           HB2      ARG  56  -8.443  -6.601  -1.348
  427    HB3  ARG  56           HB3      ARG  56  -9.433  -5.184  -1.638
  428    HG2  ARG  56           HG2      ARG  56  -9.777  -5.844  -3.984
  429    HG3  ARG  56           HG3      ARG  56  -8.681  -7.221  -3.776
  430    HD2  ARG  56           HD2      ARG  56 -11.017  -7.932  -3.674
  431    HD3  ARG  56           HD3      ARG  56 -10.182  -8.245  -2.157
  432    HE   ARG  56           HE       ARG  56 -12.136  -5.996  -2.662
  433   HH11  ARG  56          HH11      ARG  56 -10.623  -8.107  -0.229
  434   HH12  ARG  56          HH12      ARG  56 -11.803  -7.598   0.954
  435   HH21  ARG  56          HH21      ARG  56 -13.319  -5.268  -1.053
  436   HH22  ARG  56          HH22      ARG  56 -13.209  -5.938   0.558
  437    H    VAL  57           H        VAL  57  -6.945  -5.787  -4.783
  438    HA   VAL  57           HA       VAL  57  -7.060  -3.152  -6.159
  439    HB   VAL  57           HB       VAL  57  -6.092  -5.861  -7.184
  440   HG11  VAL  57          HG11      VAL  57  -5.603  -3.021  -8.171
  441   HG12  VAL  57          HG12      VAL  57  -4.883  -4.500  -8.856
  442   HG13  VAL  57          HG13      VAL  57  -6.617  -4.243  -8.970
  443   HG21  VAL  57          HG21      VAL  57  -4.428  -3.662  -5.932
  444   HG22  VAL  57          HG22      VAL  57  -4.656  -5.305  -5.310
  445   HG23  VAL  57          HG23      VAL  57  -3.786  -5.052  -6.824
  446    H    ILE  58           H        ILE  58  -8.777  -2.699  -7.520
  447    HA   ILE  58           HA       ILE  58 -10.359  -4.964  -8.680
  448    HB   ILE  58           HB       ILE  58 -12.455  -3.485  -7.974
  449   HG12  ILE  58          HG12      ILE  58 -10.622  -2.981  -5.614
  450   HG13  ILE  58          HG13      ILE  58 -10.841  -1.761  -6.890
  451   HG21  ILE  58          HG21      ILE  58 -12.803  -4.952  -6.099
  452   HG22  ILE  58          HG22      ILE  58 -12.029  -5.852  -7.407
  453   HG23  ILE  58          HG23      ILE  58 -11.077  -5.327  -6.000
  454   HD11  ILE  58          HD11      ILE  58 -13.266  -1.712  -6.506
  455   HD12  ILE  58          HD12      ILE  58 -13.078  -2.852  -5.145
  456   HD13  ILE  58          HD13      ILE  58 -12.338  -1.239  -5.071
  457    H    GLU  59           H        GLU  59  -8.508  -2.980  -9.892
  458    HA   GLU  59           HA       GLU  59 -10.030  -2.812 -12.342
  459    HB2  GLU  59           HB2      GLU  59 -10.696  -0.635 -11.091
  460    HB3  GLU  59           HB3      GLU  59  -8.993  -0.205 -11.155
  461    HG2  GLU  59           HG2      GLU  59 -10.150   0.940 -12.907
  462    HG3  GLU  59           HG3      GLU  59  -9.019  -0.194 -13.612
  463    H    GLY  60           H        GLY  60  -8.549  -3.061 -14.035
  464    HA2  GLY  60           HA2      GLY  60  -6.726  -2.368 -15.325
  465    HA3  GLY  60           HA3      GLY  60  -6.004  -1.602 -13.931
  466    H    HIS  61           H        HIS  61  -4.103  -2.445 -14.886
  467    HA   HIS  61           HA       HIS  61  -3.334  -5.097 -13.799
  468    HB2  HIS  61           HB2      HIS  61  -2.368  -5.921 -15.826
  469    HB3  HIS  61           HB3      HIS  61  -4.059  -5.548 -16.130
  470    HD1  HIS  61           HD1      HIS  61  -0.566  -4.619 -17.285
  471    HD2  HIS  61           HD2      HIS  61  -4.530  -3.233 -17.640
  472    HE1  HIS  61           HE1      HIS  61  -0.567  -2.932 -19.196
  473    H    SER  62           H        SER  62  -1.347  -5.109 -12.928
  474    HA   SER  62           HA       SER  62   0.793  -3.513 -14.057
  475    HB2  SER  62           HB2      SER  62  -0.508  -2.119 -12.147
  476    HB3  SER  62           HB3      SER  62   0.679  -2.959 -11.131
  477    HG   SER  62           HG       SER  62   1.029  -0.848 -12.505
  478    H    MET  63           H        MET  63   2.842  -3.776 -12.595
  479    HA   MET  63           HA       MET  63   3.066  -6.559 -11.511
  480    HB2  MET  63           HB2      MET  63   4.144  -6.260 -13.741
  481    HB3  MET  63           HB3      MET  63   5.135  -4.965 -13.074
  482    HG2  MET  63           HG2      MET  63   6.639  -6.423 -12.373
  483    HG3  MET  63           HG3      MET  63   5.461  -7.240 -11.345
  484    HE1  MET  63           HE1      MET  63   4.505  -9.519 -11.718
  485    HE2  MET  63           HE2      MET  63   3.439  -8.702 -12.890
  486    HE3  MET  63           HE3      MET  63   4.226 -10.238 -13.310
  487    H    VAL  64           H        VAL  64   3.938  -6.721  -9.514
  488    HA   VAL  64           HA       VAL  64   4.848  -4.225  -8.167
  489    HB   VAL  64           HB       VAL  64   2.941  -6.372  -7.199
  490   HG11  VAL  64          HG11      VAL  64   4.064  -4.024  -5.614
  491   HG12  VAL  64          HG12      VAL  64   2.685  -5.033  -5.124
  492   HG13  VAL  64          HG13      VAL  64   4.288  -5.748  -5.258
  493   HG21  VAL  64          HG21      VAL  64   1.885  -4.711  -8.643
  494   HG22  VAL  64          HG22      VAL  64   1.428  -4.355  -6.970
  495   HG23  VAL  64          HG23      VAL  64   2.672  -3.389  -7.773
  496    H    ASP  65           H        ASP  65   6.395  -4.229  -6.701
  497    HA   ASP  65           HA       ASP  65   7.962  -6.759  -6.296
  498    HB2  ASP  65           HB2      ASP  65   9.195  -5.057  -7.478
  499    HB3  ASP  65           HB3      ASP  65   8.858  -3.868  -6.210
  500    H    GLU  66           H        GLU  66   7.377  -7.724  -4.485
  501    HA   GLU  66           HA       GLU  66   6.598  -6.235  -2.064
  502    HB2  GLU  66           HB2      GLU  66   6.306  -9.174  -2.708
  503    HB3  GLU  66           HB3      GLU  66   5.526  -8.262  -1.394
  504    HG2  GLU  66           HG2      GLU  66   4.290  -6.946  -3.140
  505    HG3  GLU  66           HG3      GLU  66   4.946  -8.046  -4.367
  506    H    SER  67           H        SER  67   9.470  -6.507  -2.706
  507    HA   SER  67           HA       SER  67  10.886  -8.546  -1.724
  508    HB2  SER  67           HB2      SER  67  12.734  -7.013  -1.443
  509    HB3  SER  67           HB3      SER  67  11.800  -6.577  -2.888
  510    HG   SER  67           HG       SER  67  10.977  -4.823  -1.821
  511    H    LEU  68           H        LEU  68   9.450  -6.165   0.501
  512    HA   LEU  68           HA       LEU  68  10.983  -7.262   2.797
  513    HB2  LEU  68           HB2      LEU  68  10.768  -4.767   2.127
  514    HB3  LEU  68           HB3      LEU  68   9.122  -4.858   2.676
  515    HG   LEU  68           HG       LEU  68  10.389  -3.806   4.341
  516   HD11  LEU  68          HD11      LEU  68  10.101  -6.630   5.419
  517   HD12  LEU  68          HD12      LEU  68  10.136  -5.117   6.333
  518   HD13  LEU  68          HD13      LEU  68   8.770  -5.457   5.264
  519   HD21  LEU  68          HD21      LEU  68  12.637  -4.559   3.669
  520   HD22  LEU  68          HD22      LEU  68  12.374  -4.655   5.415
  521   HD23  LEU  68          HD23      LEU  68  12.334  -6.136   4.433
  522    H    ILE  69           H        ILE  69   7.611  -6.422   1.948
  523    HA   ILE  69           HA       ILE  69   6.609  -7.429   4.416
  524    HB   ILE  69           HB       ILE  69   4.758  -7.209   2.056
  525   HG12  ILE  69          HG12      ILE  69   5.998  -5.183   1.782
  526   HG13  ILE  69          HG13      ILE  69   4.421  -4.830   2.427
  527   HG21  ILE  69          HG21      ILE  69   3.803  -7.996   4.146
  528   HG22  ILE  69          HG22      ILE  69   4.520  -6.648   5.046
  529   HG23  ILE  69          HG23      ILE  69   3.235  -6.349   3.868
  530   HD11  ILE  69          HD11      ILE  69   7.018  -4.771   3.997
  531   HD12  ILE  69          HD12      ILE  69   6.062  -3.390   3.431
  532   HD13  ILE  69          HD13      ILE  69   5.406  -4.465   4.683
  533    H    THR  70           H        THR  70   6.193  -8.981   1.159
  534    HA   THR  70           HA       THR  70   5.509 -11.529   2.500
  535    HB   THR  70           HB       THR  70   4.880 -12.361   0.356
  536    HG1  THR  70           HG1      THR  70   4.954 -10.643  -1.380
  537   HG21  THR  70          HG21      THR  70   3.306 -10.781   1.618
  538   HG22  THR  70          HG22      THR  70   3.821  -9.508   0.489
  539   HG23  THR  70          HG23      THR  70   3.009 -10.966  -0.114
  540    H    GLY  71           H        GLY  71   8.264 -10.019   1.057
  541    HA2  GLY  71           HA2      GLY  71  10.441 -10.664   1.368
  542    HA3  GLY  71           HA3      GLY  71   9.919 -12.248   1.924
  543    H    GLU  72           H        GLU  72   8.463 -11.714  -0.996
  544    HA   GLU  72           HA       GLU  72   9.625 -13.867  -2.243
  545    HB2  GLU  72           HB2      GLU  72   8.163 -11.517  -3.492
  546    HB3  GLU  72           HB3      GLU  72   8.561 -12.970  -4.398
  547    HG2  GLU  72           HG2      GLU  72   6.891 -13.050  -1.858
  548    HG3  GLU  72           HG3      GLU  72   6.210 -12.809  -3.462
  549    H    ALA  73           H        ALA  73  10.411 -10.526  -3.282
  550    HA   ALA  73           HA       ALA  73  12.250  -9.557  -4.053
  551    HB1  ALA  73           HB1      ALA  73  13.868 -12.046  -3.464
  552    HB2  ALA  73           HB2      ALA  73  14.475 -10.419  -3.803
  553    HB3  ALA  73           HB3      ALA  73  13.562 -10.721  -2.313
  554    H    MET  74           H        MET  74  10.338 -10.803  -5.572
  555    HA   MET  74           HA       MET  74  11.580 -10.845  -8.188
  556    HB2  MET  74           HB2      MET  74  10.440 -12.893  -8.882
  557    HB3  MET  74           HB3      MET  74  11.778 -13.175  -7.776
  558    HG2  MET  74           HG2      MET  74  10.174 -13.545  -5.944
  559    HG3  MET  74           HG3      MET  74   8.827 -13.206  -7.043
  560    HE1  MET  74           HE1      MET  74   7.667 -15.298  -6.345
  561    HE2  MET  74           HE2      MET  74   8.275 -16.965  -6.479
  562    HE3  MET  74           HE3      MET  74   8.945 -15.861  -5.255
  563    HA   PRO  75           HA       PRO  75   7.905  -8.599  -9.031
  564    HB2  PRO  75           HB2      PRO  75   7.837  -9.939 -11.731
  565    HB3  PRO  75           HB3      PRO  75   7.767  -8.195 -11.309
  566    HG2  PRO  75           HG2      PRO  75  10.056  -9.300 -12.241
  567    HG3  PRO  75           HG3      PRO  75  10.078  -8.085 -10.924
  568    HD2  PRO  75           HD2      PRO  75  10.374 -11.087 -10.686
  569    HD3  PRO  75           HD3      PRO  75  11.194  -9.756  -9.836
  570    H    VAL  76           H        VAL  76   5.830  -8.773  -8.534
  571    HA   VAL  76           HA       VAL  76   4.326 -11.345  -8.832
  572    HB   VAL  76           HB       VAL  76   4.107  -9.116  -6.766
  573   HG11  VAL  76          HG11      VAL  76   2.515 -10.589  -5.584
  574   HG12  VAL  76          HG12      VAL  76   1.875 -10.073  -7.153
  575   HG13  VAL  76          HG13      VAL  76   2.528 -11.707  -6.955
  576   HG21  VAL  76          HG21      VAL  76   6.061 -10.557  -6.373
  577   HG22  VAL  76          HG22      VAL  76   4.821 -10.883  -5.162
  578   HG23  VAL  76          HG23      VAL  76   5.049 -12.010  -6.517
  579    H    ALA  77           H        ALA  77   2.281 -11.351  -9.787
  580    HA   ALA  77           HA       ALA  77   1.666  -8.926 -11.367
  581    HB1  ALA  77           HB1      ALA  77   0.528 -11.740 -11.497
  582    HB2  ALA  77           HB2      ALA  77   0.206 -10.425 -12.644
  583    HB3  ALA  77           HB3      ALA  77   1.843 -11.093 -12.501
  584    H    LYS  78           H        LYS  78  -0.011  -7.580 -11.088
  585    HA   LYS  78           HA       LYS  78  -2.250  -8.346  -9.233
  586    HB2  LYS  78           HB2      LYS  78  -1.108  -5.555  -9.594
  587    HB3  LYS  78           HB3      LYS  78  -2.412  -6.030  -8.513
  588    HG2  LYS  78           HG2      LYS  78   0.519  -6.801  -8.284
  589    HG3  LYS  78           HG3      LYS  78  -0.364  -5.627  -7.302
  590    HD2  LYS  78           HD2      LYS  78  -1.683  -7.346  -6.241
  591    HD3  LYS  78           HD3      LYS  78  -1.024  -8.588  -7.316
  592    HE2  LYS  78           HE2      LYS  78   1.276  -8.088  -6.465
  593    HE3  LYS  78           HE3      LYS  78   0.584  -6.935  -5.321
  594    HZ1  LYS  78           HZ1      LYS  78  -0.030  -9.838  -5.383
  595    HZ2  LYS  78           HZ2      LYS  78   0.962  -9.060  -4.289
  596    HZ3  LYS  78           HZ3      LYS  78  -0.653  -8.755  -4.318
  597    H    LYS  79           H        LYS  79  -4.295  -7.980  -9.850
  598    HA   LYS  79           HA       LYS  79  -5.020  -6.383 -12.180
  599    HB2  LYS  79           HB2      LYS  79  -5.785  -8.165 -13.494
  600    HB3  LYS  79           HB3      LYS  79  -4.242  -8.714 -12.919
  601    HG2  LYS  79           HG2      LYS  79  -5.500  -9.955 -11.043
  602    HG3  LYS  79           HG3      LYS  79  -6.981  -9.574 -11.927
  603    HD2  LYS  79           HD2      LYS  79  -4.624 -11.164 -13.005
  604    HD3  LYS  79           HD3      LYS  79  -6.171 -11.823 -12.440
  605    HE2  LYS  79           HE2      LYS  79  -7.237 -10.220 -14.200
  606    HE3  LYS  79           HE3      LYS  79  -5.617 -10.123 -14.894
  607    HZ1  LYS  79           HZ1      LYS  79  -7.282 -12.558 -14.582
  608    HZ2  LYS  79           HZ2      LYS  79  -6.854 -11.846 -15.974
  609    HZ3  LYS  79           HZ3      LYS  79  -5.694 -12.597 -15.079
  610    HA   PRO  80           HA       PRO  80  -8.775  -6.028  -9.646
  611    HB2  PRO  80           HB2      PRO  80 -10.955  -7.070 -11.041
  612    HB3  PRO  80           HB3      PRO  80 -10.265  -5.439 -11.291
  613    HG2  PRO  80           HG2      PRO  80  -9.639  -7.971 -12.835
  614    HG3  PRO  80           HG3      PRO  80 -10.054  -6.351 -13.485
  615    HD2  PRO  80           HD2      PRO  80  -7.505  -7.085 -13.342
  616    HD3  PRO  80           HD3      PRO  80  -7.965  -5.456 -12.782
  617    H    GLY  81           H        GLY  81  -9.573  -7.178  -7.958
  618    HA2  GLY  81           HA2      GLY  81 -10.262  -8.999  -6.672
  619    HA3  GLY  81           HA3      GLY  81  -9.992 -10.096  -8.027
  620    H    SER  82           H        SER  82  -7.279  -7.970  -7.255
  621    HA   SER  82           HA       SER  82  -5.820 -10.301  -6.031
  622    HB2  SER  82           HB2      SER  82  -4.675  -7.892  -7.490
  623    HB3  SER  82           HB3      SER  82  -3.755  -9.198  -6.744
  624    HG   SER  82           HG       SER  82  -5.141 -10.572  -8.293
  625    H    THR  83           H        THR  83  -4.118  -9.597  -4.336
  626    HA   THR  83           HA       THR  83  -5.059  -7.194  -2.808
  627    HB   THR  83           HB       THR  83  -4.321  -8.318  -0.788
  628    HG1  THR  83           HG1      THR  83  -3.846 -10.543  -0.930
  629   HG21  THR  83          HG21      THR  83  -6.687  -8.589  -1.554
  630   HG22  THR  83          HG22      THR  83  -6.227 -10.103  -2.363
  631   HG23  THR  83          HG23      THR  83  -6.097  -9.960  -0.600
  632    H    VAL  84           H        VAL  84  -3.588  -5.921  -1.712
  633    HA   VAL  84           HA       VAL  84  -0.699  -6.164  -2.432
  634    HB   VAL  84           HB       VAL  84  -0.695  -3.666  -2.771
  635   HG11  VAL  84          HG11      VAL  84  -2.260  -5.349  -4.754
  636   HG12  VAL  84          HG12      VAL  84  -1.501  -3.787  -5.102
  637   HG13  VAL  84          HG13      VAL  84  -0.495  -5.169  -4.649
  638   HG21  VAL  84          HG21      VAL  84  -2.727  -2.508  -3.381
  639   HG22  VAL  84          HG22      VAL  84  -3.711  -3.960  -3.116
  640   HG23  VAL  84          HG23      VAL  84  -2.918  -3.150  -1.746
  641    H    ILE  85           H        ILE  85   0.747  -4.912  -1.165
  642    HA   ILE  85           HA       ILE  85  -0.192  -4.168   1.533
  643    HB   ILE  85           HB       ILE  85   2.211  -5.204   2.173
  644   HG12  ILE  85          HG12      ILE  85   2.365  -7.535   1.361
  645   HG13  ILE  85          HG13      ILE  85   1.107  -7.240   0.170
  646   HG21  ILE  85          HG21      ILE  85  -0.466  -6.615   2.161
  647   HG22  ILE  85          HG22      ILE  85   0.934  -7.102   3.135
  648   HG23  ILE  85          HG23      ILE  85   0.196  -5.523   3.406
  649   HD11  ILE  85          HD11      ILE  85   2.589  -5.644  -1.010
  650   HD12  ILE  85          HD12      ILE  85   3.806  -5.844   0.273
  651   HD13  ILE  85          HD13      ILE  85   3.390  -7.207  -0.779
  652    H    ALA  86           H        ALA  86   0.880  -2.612   2.604
  653    HA   ALA  86           HA       ALA  86   1.706  -0.540   0.914
  654    HB1  ALA  86           HB1      ALA  86   2.013  -0.672   3.933
  655    HB2  ALA  86           HB2      ALA  86   1.870   0.781   2.926
  656    HB3  ALA  86           HB3      ALA  86   0.495  -0.326   3.089
  657    H    GLY  87           H        GLY  87   3.636   0.692   0.775
  658    HA2  GLY  87           HA2      GLY  87   5.973   1.093   0.894
  659    HA3  GLY  87           HA3      GLY  87   6.138  -0.320   1.955
  660    H    SER  88           H        SER  88   4.421  -1.460  -0.627
  661    HA   SER  88           HA       SER  88   6.844  -2.433  -2.068
  662    HB2  SER  88           HB2      SER  88   3.949  -3.309  -2.285
  663    HB3  SER  88           HB3      SER  88   5.333  -4.027  -3.131
  664    HG   SER  88           HG       SER  88   4.726  -3.970  -0.382
  665    H    ILE  89           H        ILE  89   6.913  -2.322  -4.392
  666    HA   ILE  89           HA       ILE  89   5.953   0.338  -5.323
  667    HB   ILE  89           HB       ILE  89   8.119  -1.096  -6.786
  668   HG12  ILE  89          HG12      ILE  89   8.915  -1.542  -4.533
  669   HG13  ILE  89          HG13      ILE  89   9.928  -0.406  -5.387
  670   HG21  ILE  89          HG21      ILE  89   7.653   1.809  -5.971
  671   HG22  ILE  89          HG22      ILE  89   9.008   1.227  -6.959
  672   HG23  ILE  89          HG23      ILE  89   7.355   1.086  -7.562
  673   HD11  ILE  89          HD11      ILE  89   9.085   1.465  -4.081
  674   HD12  ILE  89          HD12      ILE  89   7.895   0.422  -3.267
  675   HD13  ILE  89          HD13      ILE  89   9.628   0.176  -2.999
  676    H    ASN  90           H        ASN  90   5.045   0.662  -7.361
  677    HA   ASN  90           HA       ASN  90   3.885  -1.728  -8.737
  678    HB2  ASN  90           HB2      ASN  90   2.364  -0.229  -7.406
  679    HB3  ASN  90           HB3      ASN  90   2.901   1.144  -8.359
  680   HD21  ASN  90          HD22      ASN  90   1.633   1.626 -10.089
  681   HD22  ASN  90          HD21      ASN  90   0.487   0.491 -10.783
  682    H    GLN  91           H        GLN  91   4.070  -1.922 -11.030
  683    HA   GLN  91           HA       GLN  91   5.236   0.282 -12.614
  684    HB2  GLN  91           HB2      GLN  91   7.030  -1.145 -11.341
  685    HB3  GLN  91           HB3      GLN  91   6.598  -2.429 -12.455
  686    HG2  GLN  91           HG2      GLN  91   8.475  -1.449 -13.436
  687    HG3  GLN  91           HG3      GLN  91   7.165  -0.694 -14.343
  688   HE21  GLN  91          HE22      GLN  91   6.757   1.663 -13.939
  689   HE22  GLN  91          HE21      GLN  91   7.894   2.556 -12.925
  690    H    ASN  92           H        ASN  92   4.592   0.215 -14.722
  691    HA   ASN  92           HA       ASN  92   4.186  -0.455 -16.776
  692    HB2  ASN  92           HB2      ASN  92   5.134  -2.708 -16.462
  693    HB3  ASN  92           HB3      ASN  92   3.552  -3.281 -15.919
  694   HD21  ASN  92          HD22      ASN  92   2.158  -4.048 -17.523
  695   HD22  ASN  92          HD21      ASN  92   2.342  -3.638 -19.221
  696    H    GLY  93           H        GLY  93   2.086  -0.037 -14.270
  697    HA2  GLY  93           HA2      GLY  93   0.142   1.015 -16.019
  698    HA3  GLY  93           HA3      GLY  93  -0.369  -0.601 -15.584
  699    H    SER  94           H        SER  94  -1.898   1.595 -15.034
  700    HA   SER  94           HA       SER  94  -1.631   2.238 -12.156
  701    HB2  SER  94           HB2      SER  94  -3.108   4.079 -12.509
  702    HB3  SER  94           HB3      SER  94  -1.810   4.143 -13.700
  703    HG   SER  94           HG       SER  94  -3.419   3.046 -15.151
  704    H    LEU  95           H        LEU  95  -3.184   1.817 -10.664
  705    HA   LEU  95           HA       LEU  95  -5.452   0.013 -11.423
  706    HB2  LEU  95           HB2      LEU  95  -3.485  -0.170  -9.130
  707    HB3  LEU  95           HB3      LEU  95  -4.834  -1.256  -9.366
  708    HG   LEU  95           HG       LEU  95  -2.411  -1.020 -11.212
  709   HD11  LEU  95          HD11      LEU  95  -3.022  -2.991  -8.969
  710   HD12  LEU  95          HD12      LEU  95  -1.692  -3.137 -10.138
  711   HD13  LEU  95          HD13      LEU  95  -1.716  -1.785  -9.001
  712   HD21  LEU  95          HD21      LEU  95  -4.376  -1.955 -12.309
  713   HD22  LEU  95          HD22      LEU  95  -3.220  -3.265 -11.964
  714   HD23  LEU  95          HD23      LEU  95  -4.662  -3.072 -10.962
  715    H    LEU  96           H        LEU  96  -7.146  -0.144  -9.774
  716    HA   LEU  96           HA       LEU  96  -7.292   2.181  -7.888
  717    HB2  LEU  96           HB2      LEU  96  -9.546   0.688  -9.258
  718    HB3  LEU  96           HB3      LEU  96  -9.795   1.682  -7.847
  719    HG   LEU  96           HG       LEU  96  -8.462   2.834 -10.328
  720   HD11  LEU  96          HD11      LEU  96 -11.427   2.944  -9.634
  721   HD12  LEU  96          HD12      LEU  96 -10.609   3.759 -10.989
  722   HD13  LEU  96          HD13      LEU  96 -10.725   1.996 -10.954
  723   HD21  LEU  96          HD21      LEU  96  -8.249   4.119  -8.207
  724   HD22  LEU  96          HD22      LEU  96  -9.320   4.955  -9.353
  725   HD23  LEU  96          HD23      LEU  96 -10.007   4.058  -7.998
  726    H    ILE  97           H        ILE  97  -7.113   1.781  -5.866
  727    HA   ILE  97           HA       ILE  97  -7.297  -0.999  -4.848
  728    HB   ILE  97           HB       ILE  97  -5.772   1.294  -3.596
  729   HG12  ILE  97          HG12      ILE  97  -4.849   1.226  -5.832
  730   HG13  ILE  97          HG13      ILE  97  -3.707   0.672  -4.630
  731   HG21  ILE  97          HG21      ILE  97  -6.125  -0.647  -2.172
  732   HG22  ILE  97          HG22      ILE  97  -5.501  -1.732  -3.424
  733   HG23  ILE  97          HG23      ILE  97  -4.418  -0.568  -2.639
  734   HD11  ILE  97          HD11      ILE  97  -3.987  -1.621  -5.275
  735   HD12  ILE  97          HD12      ILE  97  -5.340  -1.224  -6.365
  736   HD13  ILE  97          HD13      ILE  97  -3.698  -0.669  -6.739
  737    H    CYS  98           H        CYS  98  -8.848  -1.445  -3.334
  738    HA   CYS  98           HA       CYS  98 -10.173   0.807  -1.901
  739    HB2  CYS  98           HB2      CYS  98 -11.746  -0.887  -1.085
  740    HB3  CYS  98           HB3      CYS  98 -11.713  -0.767  -2.845
  741    HG   CYS  98           HG       CYS  98  -9.996  -2.890  -1.021
  742    H    ALA  99           H        ALA  99  -9.179   1.541  -0.192
  743    HA   ALA  99           HA       ALA  99  -7.267  -0.075   1.357
  744    HB1  ALA  99           HB1      ALA  99  -8.275   2.792   1.642
  745    HB2  ALA  99           HB2      ALA  99  -6.988   2.052   2.612
  746    HB3  ALA  99           HB3      ALA  99  -6.763   2.274   0.861
  747    H    THR 100           H        THR 100  -7.983  -1.429   2.916
  748    HA   THR 100           HA       THR 100 -10.460  -0.705   4.436
  749    HB   THR 100           HB       THR 100 -10.615  -2.576   2.766
  750    HG1  THR 100           HG1      THR 100 -12.211  -2.389   4.176
  751   HG21  THR 100          HG21      THR 100  -9.225  -4.182   4.941
  752   HG22  THR 100          HG22      THR 100  -9.951  -4.790   3.444
  753   HG23  THR 100          HG23      THR 100  -8.502  -3.775   3.364
  754    H    HIS 101           H        HIS 101  -7.293  -0.567   4.946
  755    HA   HIS 101           HA       HIS 101  -7.664  -0.742   7.865
  756    HB2  HIS 101           HB2      HIS 101  -5.053  -1.504   6.516
  757    HB3  HIS 101           HB3      HIS 101  -5.521  -1.740   8.193
  758    HD1  HIS 101           HD1      HIS 101  -5.808  -3.331   4.742
  759    HD2  HIS 101           HD2      HIS 101  -6.947  -4.021   8.736
  760    HE1  HIS 101           HE1      HIS 101  -6.704  -5.711   4.831
  761    H    VAL 102           H        VAL 102  -6.830   1.114   8.857
  762    HA   VAL 102           HA       VAL 102  -5.536   3.184   7.163
  763    HB   VAL 102           HB       VAL 102  -5.726   4.600   9.241
  764   HG11  VAL 102          HG11      VAL 102  -8.085   5.076   8.868
  765   HG12  VAL 102          HG12      VAL 102  -7.264   4.766   7.331
  766   HG13  VAL 102          HG13      VAL 102  -8.304   3.518   8.051
  767   HG21  VAL 102          HG21      VAL 102  -7.249   3.979  10.981
  768   HG22  VAL 102          HG22      VAL 102  -7.662   2.452  10.187
  769   HG23  VAL 102          HG23      VAL 102  -6.037   2.693  10.879
  770    H    GLY 103           H        GLY 103  -3.709   4.511   8.708
  771    HA2  GLY 103           HA2      GLY 103  -1.477   2.882   7.970
  772    HA3  GLY 103           HA3      GLY 103  -1.449   4.440   8.802
  773    H    ALA 104           H        ALA 104  -2.924   3.640  11.189
  774    HA   ALA 104           HA       ALA 104  -0.808   2.286  12.655
  775    HB1  ALA 104           HB1      ALA 104  -3.650   2.980  13.506
  776    HB2  ALA 104           HB2      ALA 104  -2.295   2.582  14.575
  777    HB3  ALA 104           HB3      ALA 104  -2.244   4.067  13.614
  778    H    ASP 105           H        ASP 105  -3.890   1.259  11.277
  779    HA   ASP 105           HA       ASP 105  -3.852  -1.375  12.517
  780    HB2  ASP 105           HB2      ASP 105  -5.900   0.044  12.043
  781    HB3  ASP 105           HB3      ASP 105  -5.726  -0.416  10.351
  782    H    THR 106           H        THR 106  -2.191  -0.209   9.794
  783    HA   THR 106           HA       THR 106  -2.584  -2.525   8.077
  784    HB   THR 106           HB       THR 106  -2.017  -0.115   7.423
  785    HG1  THR 106           HG1      THR 106  -1.762  -2.374   6.189
  786   HG21  THR 106          HG21      THR 106   0.845  -1.083   7.496
  787   HG22  THR 106          HG22      THR 106   0.219   0.529   7.088
  788   HG23  THR 106          HG23      THR 106   0.163  -0.047   8.763
  789    H    THR 107           H        THR 107  -0.970  -4.061   7.407
  790    HA   THR 107           HA       THR 107   0.089  -5.422   9.560
  791    HB   THR 107           HB       THR 107  -0.423  -6.462   7.429
  792    HG1  THR 107           HG1      THR 107   0.763  -7.763   8.661
  793   HG21  THR 107          HG21      THR 107   0.723  -4.832   5.891
  794   HG22  THR 107          HG22      THR 107   2.285  -5.509   6.436
  795   HG23  THR 107          HG23      THR 107   1.117  -6.534   5.592
  796    H    LEU 108           H        LEU 108   1.954  -3.035   7.656
  797    HA   LEU 108           HA       LEU 108   4.541  -3.511   8.725
  798    HB2  LEU 108           HB2      LEU 108   3.160  -0.899   7.966
  799    HB3  LEU 108           HB3      LEU 108   4.846  -1.009   8.421
  800    HG   LEU 108           HG       LEU 108   5.367  -2.379   6.447
  801   HD11  LEU 108          HD11      LEU 108   2.431  -1.983   5.766
  802   HD12  LEU 108          HD12      LEU 108   3.684  -2.473   4.598
  803   HD13  LEU 108          HD13      LEU 108   3.312  -3.535   5.941
  804   HD21  LEU 108          HD21      LEU 108   5.497   0.062   6.410
  805   HD22  LEU 108          HD22      LEU 108   4.973  -0.537   4.823
  806   HD23  LEU 108          HD23      LEU 108   3.780   0.166   5.950
  807    H    SER 109           H        SER 109   1.956  -1.412   9.995
  808    HA   SER 109           HA       SER 109   3.383  -0.526  12.338
  809    HB2  SER 109           HB2      SER 109   0.450  -0.483  11.530
  810    HB3  SER 109           HB3      SER 109   1.097   0.319  12.977
  811    HG   SER 109           HG       SER 109   0.941   1.478  10.770
  812    H    GLN 110           H        GLN 110   1.327  -3.255  11.601
  813    HA   GLN 110           HA       GLN 110   0.981  -4.158  14.387
  814    HB2  GLN 110           HB2      GLN 110  -0.598  -4.767  12.622
  815    HB3  GLN 110           HB3      GLN 110   0.647  -5.597  11.756
  816    HG2  GLN 110           HG2      GLN 110  -0.574  -7.269  12.746
  817    HG3  GLN 110           HG3      GLN 110   0.929  -7.220  13.661
  818   HE21  GLN 110          HE22      GLN 110  -2.071  -5.190  13.865
  819   HE22  GLN 110          HE21      GLN 110  -2.420  -5.685  15.503
  820    H    ILE 111           H        ILE 111   3.252  -5.040  11.727
  821    HA   ILE 111           HA       ILE 111   4.655  -7.100  13.014
  822    HB   ILE 111           HB       ILE 111   5.476  -5.087  10.902
  823   HG12  ILE 111          HG12      ILE 111   5.144  -8.089  10.557
  824   HG13  ILE 111          HG13      ILE 111   3.727  -7.057  10.573
  825   HG21  ILE 111          HG21      ILE 111   7.127  -7.462  11.876
  826   HG22  ILE 111          HG22      ILE 111   7.446  -6.550  10.393
  827   HG23  ILE 111          HG23      ILE 111   7.595  -5.747  11.946
  828   HD11  ILE 111          HD11      ILE 111   4.607  -5.736   8.677
  829   HD12  ILE 111          HD12      ILE 111   6.053  -6.750   8.622
  830   HD13  ILE 111          HD13      ILE 111   4.462  -7.449   8.276
  831    H    VAL 112           H        VAL 112   5.599  -3.581  13.054
  832    HA   VAL 112           HA       VAL 112   7.800  -4.066  14.784
  833    HB   VAL 112           HB       VAL 112   7.874  -1.678  15.218
  834   HG11  VAL 112          HG11      VAL 112   7.298  -2.299  12.304
  835   HG12  VAL 112          HG12      VAL 112   8.256  -0.945  12.946
  836   HG13  VAL 112          HG13      VAL 112   8.835  -2.605  13.150
  837   HG21  VAL 112          HG21      VAL 112   5.305  -1.474  13.565
  838   HG22  VAL 112          HG22      VAL 112   5.413  -1.190  15.314
  839   HG23  VAL 112          HG23      VAL 112   6.268  -0.127  14.195
  840    H    LYS 113           H        LYS 113   4.464  -3.975  15.699
  841    HA   LYS 113           HA       LYS 113   5.028  -3.447  18.560
  842    HB2  LYS 113           HB2      LYS 113   2.549  -4.513  17.123
  843    HB3  LYS 113           HB3      LYS 113   2.704  -4.376  18.872
  844    HG2  LYS 113           HG2      LYS 113   3.139  -1.915  18.618
  845    HG3  LYS 113           HG3      LYS 113   2.866  -2.075  16.890
  846    HD2  LYS 113           HD2      LYS 113   0.860  -1.233  17.905
  847    HD3  LYS 113           HD3      LYS 113   0.540  -2.884  17.326
  848    HE2  LYS 113           HE2      LYS 113   0.813  -3.789  19.555
  849    HE3  LYS 113           HE3      LYS 113   1.453  -2.249  20.147
  850    HZ1  LYS 113           HZ1      LYS 113  -0.729  -1.266  19.781
  851    HZ2  LYS 113           HZ2      LYS 113  -1.340  -2.705  19.243
  852    HZ3  LYS 113           HZ3      LYS 113  -0.849  -2.549  20.814
  853    H    LEU 114           H        LEU 114   4.986  -6.226  16.424
  854    HA   LEU 114           HA       LEU 114   5.274  -8.209  18.598
  855    HB2  LEU 114           HB2      LEU 114   4.219  -8.409  16.144
  856    HB3  LEU 114           HB3      LEU 114   5.893  -8.733  15.688
  857    HG   LEU 114           HG       LEU 114   4.193 -10.263  17.692
  858   HD11  LEU 114          HD11      LEU 114   5.290 -11.051  14.955
  859   HD12  LEU 114          HD12      LEU 114   4.323 -12.078  16.036
  860   HD13  LEU 114          HD13      LEU 114   3.599 -10.633  15.315
  861   HD21  LEU 114          HD21      LEU 114   6.107 -11.911  17.634
  862   HD22  LEU 114          HD22      LEU 114   7.070 -10.677  16.790
  863   HD23  LEU 114          HD23      LEU 114   6.479 -10.385  18.448
  864    H    VAL 115           H        VAL 115   7.425  -6.986  15.973
  865    HA   VAL 115           HA       VAL 115   9.644  -8.417  17.030
  866    HB   VAL 115           HB       VAL 115   9.730  -6.137  15.031
  867   HG11  VAL 115          HG11      VAL 115  11.618  -8.508  15.463
  868   HG12  VAL 115          HG12      VAL 115  11.726  -7.327  14.143
  869   HG13  VAL 115          HG13      VAL 115  12.008  -6.812  15.800
  870   HG21  VAL 115          HG21      VAL 115   9.362  -9.140  14.597
  871   HG22  VAL 115          HG22      VAL 115   8.143  -7.893  14.276
  872   HG23  VAL 115          HG23      VAL 115   9.616  -7.936  13.318
  873    H    GLU 116           H        GLU 116   8.466  -5.306  18.073
  874    HA   GLU 116           HA       GLU 116  10.944  -4.423  19.296
  875    HB2  GLU 116           HB2      GLU 116   8.950  -2.985  18.867
  876    HB3  GLU 116           HB3      GLU 116   8.093  -3.801  20.167
  877    HG2  GLU 116           HG2      GLU 116  10.821  -2.617  20.760
  878    HG3  GLU 116           HG3      GLU 116   9.504  -1.501  20.448
  879    H    GLU 117           H        GLU 117   8.510  -6.922  20.250
  880    HA   GLU 117           HA       GLU 117   9.491  -7.195  22.973
  881    HB2  GLU 117           HB2      GLU 117   7.784  -9.037  21.263
  882    HB3  GLU 117           HB3      GLU 117   7.920  -9.031  23.019
  883    HG2  GLU 117           HG2      GLU 117   6.719  -6.814  21.295
  884    HG3  GLU 117           HG3      GLU 117   5.827  -8.056  22.107
  885    H    ALA 118           H        ALA 118  10.639  -8.038  19.907
  886    HA   ALA 118           HA       ALA 118  11.770 -10.678  20.578
  887    HB1  ALA 118           HB1      ALA 118  11.892  -9.201  17.930
  888    HB2  ALA 118           HB2      ALA 118  12.328 -10.884  18.259
  889    HB3  ALA 118           HB3      ALA 118  10.636 -10.381  18.382
  890    H    GLN 119           H        GLN 119  12.663  -7.441  21.006
  891    HA   GLN 119           HA       GLN 119  15.495  -7.693  20.386
  892    HB2  GLN 119           HB2      GLN 119  14.076  -5.555  22.010
  893    HB3  GLN 119           HB3      GLN 119  15.715  -5.483  21.368
  894    HG2  GLN 119           HG2      GLN 119  13.100  -5.426  19.831
  895    HG3  GLN 119           HG3      GLN 119  14.351  -4.195  19.885
  896   HE21  GLN 119          HE21      GLN 119  13.095  -6.765  18.059
  897   HE22  GLN 119          HE22      GLN 119  14.497  -7.057  17.021
  Start of MODEL    5
    1    H    SER   1           H        SER   1  18.379  -4.557  14.873
    2    HA   SER   1           HA       SER   1  15.837  -3.467  16.005
    3    HB2  SER   1           HB2      SER   1  18.722  -3.068  16.875
    4    HB3  SER   1           HB3      SER   1  17.303  -2.352  17.651
    5    HG   SER   1           HG       SER   1  16.536  -4.462  18.073
    6    H    GLU   2           H        GLU   2  18.787  -2.390  14.197
    7    HA   GLU   2           HA       GLU   2  17.641   0.276  13.854
    8    HB2  GLU   2           HB2      GLU   2  19.442   0.749  12.378
    9    HB3  GLU   2           HB3      GLU   2  20.054  -0.040  13.832
   10    HG2  GLU   2           HG2      GLU   2  20.334  -2.148  12.615
   11    HG3  GLU   2           HG3      GLU   2  19.578  -1.461  11.172
   12    H    ALA   3           H        ALA   3  17.282  -2.784  12.067
   13    HA   ALA   3           HA       ALA   3  16.047  -1.689   9.740
   14    HB1  ALA   3           HB1      ALA   3  15.619  -4.395  11.073
   15    HB2  ALA   3           HB2      ALA   3  15.310  -3.976   9.377
   16    HB3  ALA   3           HB3      ALA   3  16.965  -4.016   9.977
   17    H    LEU   4           H        LEU   4  14.895  -1.612  12.956
   18    HA   LEU   4           HA       LEU   4  12.189  -2.282  12.728
   19    HB2  LEU   4           HB2      LEU   4  13.484  -1.843  14.828
   20    HB3  LEU   4           HB3      LEU   4  13.487  -0.132  14.460
   21    HG   LEU   4           HG       LEU   4  10.925  -0.190  14.578
   22   HD11  LEU   4          HD11      LEU   4  10.654  -2.637  14.271
   23   HD12  LEU   4          HD12      LEU   4  11.589  -2.906  15.766
   24   HD13  LEU   4          HD13      LEU   4  10.001  -2.130  15.841
   25   HD21  LEU   4          HD21      LEU   4  12.237   0.644  16.475
   26   HD22  LEU   4          HD22      LEU   4  10.901  -0.339  17.075
   27   HD23  LEU   4          HD23      LEU   4  12.536  -1.018  17.039
   28    H    ALA   5           H        ALA   5  13.470   1.228  12.431
   29    HA   ALA   5           HA       ALA   5  11.069   2.126  11.410
   30    HB1  ALA   5           HB1      ALA   5  13.896   3.215  11.108
   31    HB2  ALA   5           HB2      ALA   5  12.385   4.134  10.946
   32    HB3  ALA   5           HB3      ALA   5  12.836   3.456  12.516
   33    H    LYS   6           H        LYS   6  13.077  -0.022   9.607
   34    HA   LYS   6           HA       LYS   6  12.956   1.398   7.060
   35    HB2  LYS   6           HB2      LYS   6  14.651  -0.307   7.460
   36    HB3  LYS   6           HB3      LYS   6  13.411  -1.569   7.580
   37    HG2  LYS   6           HG2      LYS   6  12.833  -1.388   5.286
   38    HG3  LYS   6           HG3      LYS   6  13.562   0.216   5.126
   39    HD2  LYS   6           HD2      LYS   6  15.802  -0.745   5.372
   40    HD3  LYS   6           HD3      LYS   6  15.115  -2.378   5.502
   41    HE2  LYS   6           HE2      LYS   6  14.203  -2.250   3.259
   42    HE3  LYS   6           HE3      LYS   6  14.588  -0.530   3.133
   43    HZ1  LYS   6           HZ1      LYS   6  16.160  -2.071   1.974
   44    HZ2  LYS   6           HZ2      LYS   6  16.916  -1.068   3.074
   45    HZ3  LYS   6           HZ3      LYS   6  16.664  -2.625   3.434
   46    H    LEU   7           H        LEU   7  10.982  -1.129   8.562
   47    HA   LEU   7           HA       LEU   7   8.894  -1.465   6.714
   48    HB2  LEU   7           HB2      LEU   7   8.926  -1.283   9.757
   49    HB3  LEU   7           HB3      LEU   7   7.451  -1.625   8.889
   50    HG   LEU   7           HG       LEU   7   8.536  -3.609   9.870
   51   HD11  LEU   7          HD11      LEU   7   8.307  -3.676   6.834
   52   HD12  LEU   7          HD12      LEU   7   8.289  -5.084   7.914
   53   HD13  LEU   7          HD13      LEU   7   6.991  -3.892   8.017
   54   HD21  LEU   7          HD21      LEU   7  10.901  -3.025   9.466
   55   HD22  LEU   7          HD22      LEU   7  10.460  -4.646   8.904
   56   HD23  LEU   7          HD23      LEU   7  10.664  -3.343   7.722
   57    H    ILE   8           H        ILE   8   9.169   1.090   9.181
   58    HA   ILE   8           HA       ILE   8   6.776   2.496   8.438
   59    HB   ILE   8           HB       ILE   8   9.205   3.398  10.022
   60   HG12  ILE   8          HG12      ILE   8   8.119   1.404  10.985
   61   HG13  ILE   8          HG13      ILE   8   7.992   2.817  12.019
   62   HG21  ILE   8          HG21      ILE   8   6.455   4.653   9.737
   63   HG22  ILE   8          HG22      ILE   8   7.576   5.014  11.070
   64   HG23  ILE   8          HG23      ILE   8   8.037   5.385   9.402
   65   HD11  ILE   8          HD11      ILE   8   5.626   3.116  11.322
   66   HD12  ILE   8          HD12      ILE   8   5.762   1.685  10.268
   67   HD13  ILE   8          HD13      ILE   8   5.916   1.521  12.023
   68    H    SER   9           H        SER   9  10.106   2.706   7.327
   69    HA   SER   9           HA       SER   9   9.862   5.341   6.078
   70    HB2  SER   9           HB2      SER   9  12.049   3.243   5.868
   71    HB3  SER   9           HB3      SER   9  12.130   4.917   5.293
   72    HG   SER   9           HG       SER   9  11.836   3.987   7.960
   73    H    LEU  10           H        LEU  10   9.511   1.964   5.006
   74    HA   LEU  10           HA       LEU  10   9.367   2.578   2.195
   75    HB2  LEU  10           HB2      LEU  10   8.571   0.251   3.925
   76    HB3  LEU  10           HB3      LEU  10   7.804   0.416   2.356
   77    HG   LEU  10           HG       LEU  10  10.106   0.608   1.295
   78   HD11  LEU  10          HD11      LEU  10  10.971  -0.585   3.953
   79   HD12  LEU  10          HD12      LEU  10  11.977  -0.399   2.496
   80   HD13  LEU  10          HD13      LEU  10  11.421   1.036   3.368
   81   HD21  LEU  10          HD21      LEU  10  10.436  -1.850   1.341
   82   HD22  LEU  10          HD22      LEU  10   9.282  -1.959   2.700
   83   HD23  LEU  10          HD23      LEU  10   8.747  -1.404   1.103
   84    H    GLN  11           H        GLN  11   6.990   3.146   4.740
   85    HA   GLN  11           HA       GLN  11   4.683   3.076   2.999
   86    HB2  GLN  11           HB2      GLN  11   5.029   4.441   5.704
   87    HB3  GLN  11           HB3      GLN  11   3.509   4.136   4.863
   88    HG2  GLN  11           HG2      GLN  11   3.899   1.698   5.022
   89    HG3  GLN  11           HG3      GLN  11   5.393   1.980   5.923
   90   HE21  GLN  11          HE22      GLN  11   1.863   2.051   6.091
   91   HE22  GLN  11          HE21      GLN  11   1.798   2.540   7.778
   92    H    ALA  12           H        ALA  12   3.587   4.596   1.954
   93    HA   ALA  12           HA       ALA  12   4.834   7.147   1.310
   94    HB1  ALA  12           HB1      ALA  12   2.070   6.036   0.712
   95    HB2  ALA  12           HB2      ALA  12   2.792   7.481  -0.030
   96    HB3  ALA  12           HB3      ALA  12   3.506   5.879  -0.316
   97    H    THR  13           H        THR  13   4.020   9.240   1.790
   98    HA   THR  13           HA       THR  13   2.651   9.447   4.432
   99    HB   THR  13           HB       THR  13   4.186  11.720   3.204
  100    HG1  THR  13           HG1      THR  13   6.047  10.956   4.116
  101   HG21  THR  13          HG21      THR  13   2.860  11.831   5.400
  102   HG22  THR  13          HG22      THR  13   4.006  10.652   6.048
  103   HG23  THR  13          HG23      THR  13   4.567  12.255   5.551
  104    H    GLU  14           H        GLU  14   1.949   9.708   1.245
  105    HA   GLU  14           HA       GLU  14  -0.320  11.575   1.584
  106    HB2  GLU  14           HB2      GLU  14   0.265  12.542  -0.622
  107    HB3  GLU  14           HB3      GLU  14   1.325  12.995   0.692
  108    HG2  GLU  14           HG2      GLU  14   2.027  10.756  -1.251
  109    HG3  GLU  14           HG3      GLU  14   2.378  12.442  -1.593
  110    H    ALA  15           H        ALA  15  -2.001  11.355   0.002
  111    HA   ALA  15           HA       ALA  15  -2.004   8.940  -1.698
  112    HB1  ALA  15           HB1      ALA  15  -4.058   9.413   0.505
  113    HB2  ALA  15           HB2      ALA  15  -4.094   8.108  -0.703
  114    HB3  ALA  15           HB3      ALA  15  -2.800   8.156   0.508
  115    H    THR  16           H        THR  16  -3.731   8.874  -3.198
  116    HA   THR  16           HA       THR  16  -5.164  11.472  -3.698
  117    HB   THR  16           HB       THR  16  -4.414   9.372  -5.742
  118    HG1  THR  16           HG1      THR  16  -2.762  10.815  -4.873
  119   HG21  THR  16          HG21      THR  16  -6.528  10.566  -6.354
  120   HG22  THR  16          HG22      THR  16  -5.727  12.122  -6.054
  121   HG23  THR  16          HG23      THR  16  -5.190  11.066  -7.380
  122    H    ILE  17           H        ILE  17  -7.192  11.415  -2.977
  123    HA   ILE  17           HA       ILE  17  -8.764   8.895  -3.051
  124    HB   ILE  17           HB       ILE  17  -9.779  11.585  -2.097
  125   HG12  ILE  17          HG12      ILE  17  -8.359   9.464  -0.434
  126   HG13  ILE  17          HG13      ILE  17  -7.785  11.097  -0.764
  127   HG21  ILE  17          HG21      ILE  17 -10.659   8.724  -1.504
  128   HG22  ILE  17          HG22      ILE  17 -11.446  10.206  -0.924
  129   HG23  ILE  17          HG23      ILE  17 -11.469   9.835  -2.632
  130   HD11  ILE  17          HD11      ILE  17 -10.177  10.339   0.943
  131   HD12  ILE  17          HD12      ILE  17  -8.655  11.061   1.462
  132   HD13  ILE  17          HD13      ILE  17  -9.775  12.010   0.462
  133    H    VAL  18           H        VAL  18 -10.214   8.424  -4.616
  134    HA   VAL  18           HA       VAL  18 -10.850  10.540  -6.636
  135    HB   VAL  18           HB       VAL  18 -10.826   8.827  -8.366
  136   HG11  VAL  18          HG11      VAL  18  -8.157   8.874  -6.905
  137   HG12  VAL  18          HG12      VAL  18  -8.464   8.822  -8.659
  138   HG13  VAL  18          HG13      VAL  18  -8.817  10.285  -7.741
  139   HG21  VAL  18          HG21      VAL  18 -11.163   6.763  -7.048
  140   HG22  VAL  18          HG22      VAL  18  -9.679   6.683  -8.009
  141   HG23  VAL  18          HG23      VAL  18  -9.583   6.988  -6.268
  142    H    THR  19           H        THR  19 -12.841  10.789  -7.353
  143    HA   THR  19           HA       THR  19 -15.037   9.048  -6.255
  144    HB   THR  19           HB       THR  19 -14.706  12.055  -6.001
  145    HG1  THR  19           HG1      THR  19 -15.008   9.964  -4.106
  146   HG21  THR  19          HG21      THR  19 -17.051  11.729  -6.375
  147   HG22  THR  19          HG22      THR  19 -17.072  10.256  -5.384
  148   HG23  THR  19          HG23      THR  19 -16.833  11.843  -4.624
  149    H    LEU  20           H        LEU  20 -16.793   8.784  -7.465
  150    HA   LEU  20           HA       LEU  20 -17.081  10.289 -10.030
  151    HB2  LEU  20           HB2      LEU  20 -18.534   7.734  -9.297
  152    HB3  LEU  20           HB3      LEU  20 -18.435   8.534 -10.858
  153    HG   LEU  20           HG       LEU  20 -16.216   6.994  -9.465
  154   HD11  LEU  20          HD11      LEU  20 -17.805   6.478 -12.021
  155   HD12  LEU  20          HD12      LEU  20 -16.477   5.478 -11.398
  156   HD13  LEU  20          HD13      LEU  20 -17.987   5.612 -10.487
  157   HD21  LEU  20          HD21      LEU  20 -15.223   8.848 -10.684
  158   HD22  LEU  20          HD22      LEU  20 -14.945   7.347 -11.574
  159   HD23  LEU  20          HD23      LEU  20 -16.193   8.491 -12.123
  160    H    ASP  21           H        ASP  21 -19.002  11.558 -10.269
  161    HA   ASP  21           HA       ASP  21 -21.150  11.162  -8.248
  162    HB2  ASP  21           HB2      ASP  21 -19.135  12.976  -7.731
  163    HB3  ASP  21           HB3      ASP  21 -20.365  14.007  -8.416
  164    H    SER  22           H        SER  22 -21.078  10.908 -11.170
  165    HA   SER  22           HA       SER  22 -23.681  12.207 -11.608
  166    HB2  SER  22           HB2      SER  22 -21.467  12.779 -13.592
  167    HB3  SER  22           HB3      SER  22 -23.191  12.959 -13.943
  168    HG   SER  22           HG       SER  22 -22.156  14.914 -13.243
  169    H    ASP  23           H        ASP  23 -21.348  10.625 -13.767
  170    HA   ASP  23           HA       ASP  23 -22.687   8.119 -13.931
  171    HB2  ASP  23           HB2      ASP  23 -24.254   9.620 -15.291
  172    HB3  ASP  23           HB3      ASP  23 -22.943   9.845 -16.442
  173    H    ASN  24           H        ASN  24 -20.239   8.556 -13.202
  174    HA   ASN  24           HA       ASN  24 -18.034   8.381 -13.433
  175    HB2  ASN  24           HB2      ASN  24 -18.854   6.335 -14.883
  176    HB3  ASN  24           HB3      ASN  24 -18.151   7.269 -16.217
  177   HD21  ASN  24          HD22      ASN  24 -15.821   8.250 -14.808
  178   HD22  ASN  24          HD21      ASN  24 -14.906   6.765 -14.511
  179    H    ILE  25           H        ILE  25 -19.646  10.197 -15.966
  180    HA   ILE  25           HA       ILE  25 -17.406  11.526 -17.053
  181    HB   ILE  25           HB       ILE  25 -19.032  13.105 -17.933
  182   HG12  ILE  25          HG12      ILE  25 -21.059  11.764 -16.069
  183   HG13  ILE  25          HG13      ILE  25 -20.509  13.438 -15.997
  184   HG21  ILE  25          HG21      ILE  25 -20.253  10.316 -18.015
  185   HG22  ILE  25          HG22      ILE  25 -20.180  11.534 -19.301
  186   HG23  ILE  25          HG23      ILE  25 -18.717  10.697 -18.791
  187   HD11  ILE  25          HD11      ILE  25 -22.221  12.164 -18.154
  188   HD12  ILE  25          HD12      ILE  25 -22.667  13.434 -17.007
  189   HD13  ILE  25          HD13      ILE  25 -21.500  13.787 -18.300
  190    H    LEU  26           H        LEU  26 -19.322  12.386 -14.187
  191    HA   LEU  26           HA       LEU  26 -17.509  14.607 -13.541
  192    HB2  LEU  26           HB2      LEU  26 -19.817  14.866 -12.989
  193    HB3  LEU  26           HB3      LEU  26 -19.828  13.367 -12.047
  194    HG   LEU  26           HG       LEU  26 -18.492  14.316 -10.308
  195   HD11  LEU  26          HD11      LEU  26 -18.141  16.720 -12.132
  196   HD12  LEU  26          HD12      LEU  26 -17.722  16.693 -10.403
  197   HD13  LEU  26          HD13      LEU  26 -16.859  15.638 -11.525
  198   HD21  LEU  26          HD21      LEU  26 -20.916  15.015 -10.413
  199   HD22  LEU  26          HD22      LEU  26 -19.850  16.133  -9.539
  200   HD23  LEU  26          HD23      LEU  26 -20.396  16.519 -11.184
  201    H    LEU  27           H        LEU  27 -15.660  13.754 -13.482
  202    HA   LEU  27           HA       LEU  27 -14.887  11.710 -11.431
  203    HB2  LEU  27           HB2      LEU  27 -14.349  11.261 -13.834
  204    HB3  LEU  27           HB3      LEU  27 -13.360  12.718 -13.868
  205    HG   LEU  27           HG       LEU  27 -11.831  11.710 -12.172
  206   HD11  LEU  27          HD11      LEU  27 -13.604   9.256 -12.542
  207   HD12  LEU  27          HD12      LEU  27 -12.027   9.257 -11.727
  208   HD13  LEU  27          HD13      LEU  27 -13.365  10.163 -11.020
  209   HD21  LEU  27          HD21      LEU  27 -11.466  11.418 -14.621
  210   HD22  LEU  27          HD22      LEU  27 -10.828  10.062 -13.678
  211   HD23  LEU  27          HD23      LEU  27 -12.359   9.888 -14.566
  212    H    SER  28           H        SER  28 -13.807  12.367  -9.626
  213    HA   SER  28           HA       SER  28 -12.676  15.140  -9.506
  214    HB2  SER  28           HB2      SER  28 -14.928  15.295  -8.729
  215    HB3  SER  28           HB3      SER  28 -14.784  13.819  -7.770
  216    HG   SER  28           HG       SER  28 -14.519  15.379  -6.343
  217    H    GLU  29           H        GLU  29 -10.715  15.299  -8.417
  218    HA   GLU  29           HA       GLU  29  -9.745  12.876  -6.985
  219    HB2  GLU  29           HB2      GLU  29  -8.202  14.474  -9.054
  220    HB3  GLU  29           HB3      GLU  29  -7.656  13.047  -8.165
  221    HG2  GLU  29           HG2      GLU  29  -9.541  11.743  -9.276
  222    HG3  GLU  29           HG3      GLU  29  -9.877  13.164 -10.257
  223    H    GLU  30           H        GLU  30  -8.738  13.243  -5.124
  224    HA   GLU  30           HA       GLU  30  -8.084  16.041  -4.244
  225    HB2  GLU  30           HB2      GLU  30  -9.159  13.606  -2.769
  226    HB3  GLU  30           HB3      GLU  30  -8.604  15.056  -1.956
  227    HG2  GLU  30           HG2      GLU  30 -10.803  15.337  -4.006
  228    HG3  GLU  30           HG3      GLU  30 -11.169  14.572  -2.457
  229    H    GLN  31           H        GLN  31  -5.786  16.282  -3.928
  230    HA   GLN  31           HA       GLN  31  -4.202  13.879  -3.232
  231    HB2  GLN  31           HB2      GLN  31  -3.477  16.745  -3.955
  232    HB3  GLN  31           HB3      GLN  31  -2.317  15.544  -3.392
  233    HG2  GLN  31           HG2      GLN  31  -2.837  14.087  -5.292
  234    HG3  GLN  31           HG3      GLN  31  -3.950  15.320  -5.959
  235   HE21  GLN  31          HE22      GLN  31  -0.725  14.275  -5.477
  236   HE22  GLN  31          HE21      GLN  31  -0.196  15.805  -5.112
  237    H    VAL  32           H        VAL  32  -3.871  13.411  -1.177
  238    HA   VAL  32           HA       VAL  32  -4.201  15.483   0.960
  239    HB   VAL  32           HB       VAL  32  -5.535  13.939   2.251
  240   HG11  VAL  32          HG11      VAL  32  -6.774  14.180  -0.508
  241   HG12  VAL  32          HG12      VAL  32  -7.614  14.013   1.043
  242   HG13  VAL  32          HG13      VAL  32  -6.696  15.486   0.696
  243   HG21  VAL  32          HG21      VAL  32  -6.421  11.852   1.425
  244   HG22  VAL  32          HG22      VAL  32  -5.580  12.042  -0.124
  245   HG23  VAL  32          HG23      VAL  32  -4.662  11.767   1.374
  246    H    ASP  33           H        ASP  33  -3.630  14.597   3.109
  247    HA   ASP  33           HA       ASP  33  -1.001  13.262   3.134
  248    HB2  ASP  33           HB2      ASP  33  -1.551  15.232   4.576
  249    HB3  ASP  33           HB3      ASP  33  -2.726  14.246   5.435
  250    H    VAL  34           H        VAL  34  -0.627  11.236   3.990
  251    HA   VAL  34           HA       VAL  34  -2.590   9.225   3.700
  252    HB   VAL  34           HB       VAL  34  -0.146   8.869   3.639
  253   HG11  VAL  34          HG11      VAL  34  -0.301   8.746   6.686
  254   HG12  VAL  34          HG12      VAL  34   1.103   8.391   5.675
  255   HG13  VAL  34          HG13      VAL  34   0.475  10.045   5.760
  256   HG21  VAL  34          HG21      VAL  34  -1.837   7.015   3.783
  257   HG22  VAL  34          HG22      VAL  34  -0.207   6.605   4.354
  258   HG23  VAL  34          HG23      VAL  34  -1.510   6.924   5.519
  259    H    GLU  35           H        GLU  35  -2.046  11.215   6.534
  260    HA   GLU  35           HA       GLU  35  -3.491   9.514   8.407
  261    HB2  GLU  35           HB2      GLU  35  -1.782  11.269   8.933
  262    HB3  GLU  35           HB3      GLU  35  -2.951  12.512   8.466
  263    HG2  GLU  35           HG2      GLU  35  -4.436  11.872  10.288
  264    HG3  GLU  35           HG3      GLU  35  -3.454  10.439  10.647
  265    H    LEU  36           H        LEU  36  -4.519  11.720   5.885
  266    HA   LEU  36           HA       LEU  36  -7.180  12.166   7.050
  267    HB2  LEU  36           HB2      LEU  36  -6.011  12.968   4.360
  268    HB3  LEU  36           HB3      LEU  36  -7.547  13.513   5.019
  269    HG   LEU  36           HG       LEU  36  -4.805  14.134   6.195
  270   HD11  LEU  36          HD11      LEU  36  -6.819  15.885   4.729
  271   HD12  LEU  36          HD12      LEU  36  -5.312  16.441   5.484
  272   HD13  LEU  36          HD13      LEU  36  -5.246  15.341   4.103
  273   HD21  LEU  36          HD21      LEU  36  -7.569  15.070   7.049
  274   HD22  LEU  36          HD22      LEU  36  -6.438  14.061   7.992
  275   HD23  LEU  36          HD23      LEU  36  -6.025  15.735   7.628
  276    H    VAL  37           H        VAL  37  -5.790   9.667   5.172
  277    HA   VAL  37           HA       VAL  37  -8.398   8.953   3.944
  278    HB   VAL  37           HB       VAL  37  -6.764   8.740   2.343
  279   HG11  VAL  37          HG11      VAL  37  -4.795   7.283   2.453
  280   HG12  VAL  37          HG12      VAL  37  -4.709   8.628   3.591
  281   HG13  VAL  37          HG13      VAL  37  -5.093   6.992   4.179
  282   HG21  VAL  37          HG21      VAL  37  -8.456   6.946   2.421
  283   HG22  VAL  37          HG22      VAL  37  -6.925   6.406   1.705
  284   HG23  VAL  37          HG23      VAL  37  -7.337   5.931   3.358
  285    H    GLN  38           H        GLN  38  -9.599   8.519   5.627
  286    HA   GLN  38           HA       GLN  38  -9.043   6.488   7.635
  287    HB2  GLN  38           HB2      GLN  38 -10.471   8.720   7.766
  288    HB3  GLN  38           HB3      GLN  38 -11.646   7.852   6.787
  289    HG2  GLN  38           HG2      GLN  38 -11.884   6.211   8.513
  290    HG3  GLN  38           HG3      GLN  38 -10.568   6.929   9.479
  291   HE21  GLN  38          HE22      GLN  38 -13.709   7.914   8.049
  292   HE22  GLN  38          HE21      GLN  38 -13.932   9.129   9.317
  293    H    ARG  39           H        ARG  39 -10.593   4.540   7.733
  294    HA   ARG  39           HA       ARG  39 -10.258   3.181   5.165
  295    HB2  ARG  39           HB2      ARG  39 -10.928   1.176   6.258
  296    HB3  ARG  39           HB3      ARG  39  -9.804   2.054   7.292
  297    HG2  ARG  39           HG2      ARG  39 -12.162   2.972   8.287
  298    HG3  ARG  39           HG3      ARG  39 -12.726   1.421   7.660
  299    HD2  ARG  39           HD2      ARG  39 -11.059   0.232   9.016
  300    HD3  ARG  39           HD3      ARG  39 -10.319   1.757   9.468
  301    HE   ARG  39           HE       ARG  39 -12.171   2.319  10.852
  302   HH11  ARG  39          HH11      ARG  39 -12.685  -0.931   9.600
  303   HH12  ARG  39          HH12      ARG  39 -13.558  -1.400  11.049
  304   HH21  ARG  39          HH21      ARG  39 -13.375   1.714  12.512
  305   HH22  ARG  39          HH22      ARG  39 -14.037   0.104  12.608
  306    H    GLY  40           H        GLY  40 -11.682   2.820   3.533
  307    HA2  GLY  40           HA2      GLY  40 -13.992   1.901   3.143
  308    HA3  GLY  40           HA3      GLY  40 -14.587   3.322   3.995
  309    H    ASP  41           H        ASP  41 -11.820   4.051   1.973
  310    HA   ASP  41           HA       ASP  41 -13.644   4.891  -0.258
  311    HB2  ASP  41           HB2      ASP  41 -11.216   6.295   0.869
  312    HB3  ASP  41           HB3      ASP  41 -11.991   6.730  -0.653
  313    H    ILE  42           H        ILE  42 -12.419   5.371  -2.259
  314    HA   ILE  42           HA       ILE  42 -10.670   3.074  -3.054
  315    HB   ILE  42           HB       ILE  42 -12.560   4.703  -4.775
  316   HG12  ILE  42          HG12      ILE  42 -13.842   3.096  -3.513
  317   HG13  ILE  42          HG13      ILE  42 -13.716   2.580  -5.181
  318   HG21  ILE  42          HG21      ILE  42 -10.572   2.528  -5.525
  319   HG22  ILE  42          HG22      ILE  42 -11.889   3.094  -6.579
  320   HG23  ILE  42          HG23      ILE  42 -10.619   4.213  -6.096
  321   HD11  ILE  42          HD11      ILE  42 -12.261   1.425  -2.788
  322   HD12  ILE  42          HD12      ILE  42 -13.497   0.648  -3.778
  323   HD13  ILE  42          HD13      ILE  42 -11.895   0.951  -4.468
  324    H    ILE  43           H        ILE  43  -8.599   3.605  -3.476
  325    HA   ILE  43           HA       ILE  43  -7.816   6.425  -3.939
  326    HB   ILE  43           HB       ILE  43  -6.425   4.041  -2.652
  327   HG12  ILE  43          HG12      ILE  43  -8.199   4.704  -1.180
  328   HG13  ILE  43          HG13      ILE  43  -6.660   5.203  -0.503
  329   HG21  ILE  43          HG21      ILE  43  -5.493   6.931  -2.800
  330   HG22  ILE  43          HG22      ILE  43  -4.741   5.652  -1.831
  331   HG23  ILE  43          HG23      ILE  43  -4.753   5.527  -3.587
  332   HD11  ILE  43          HD11      ILE  43  -8.373   6.914  -0.156
  333   HD12  ILE  43          HD12      ILE  43  -7.095   7.546  -1.212
  334   HD13  ILE  43          HD13      ILE  43  -8.661   7.033  -1.887
  335    H    LYS  44           H        LYS  44  -6.804   6.907  -5.819
  336    HA   LYS  44           HA       LYS  44  -5.977   4.872  -7.767
  337    HB2  LYS  44           HB2      LYS  44  -7.133   6.910  -8.375
  338    HB3  LYS  44           HB3      LYS  44  -5.735   7.862  -7.827
  339    HG2  LYS  44           HG2      LYS  44  -4.309   6.638  -9.490
  340    HG3  LYS  44           HG3      LYS  44  -5.732   5.750 -10.058
  341    HD2  LYS  44           HD2      LYS  44  -5.615   8.765  -9.964
  342    HD3  LYS  44           HD3      LYS  44  -4.929   7.848 -11.317
  343    HE2  LYS  44           HE2      LYS  44  -7.113   6.882 -11.837
  344    HE3  LYS  44           HE3      LYS  44  -7.838   7.708 -10.451
  345    HZ1  LYS  44           HZ1      LYS  44  -7.281   9.833 -11.506
  346    HZ2  LYS  44           HZ2      LYS  44  -6.651   9.069 -12.818
  347    HZ3  LYS  44           HZ3      LYS  44  -8.258   8.918 -12.457
  348    H    VAL  45           H        VAL  45  -3.971   3.997  -8.066
  349    HA   VAL  45           HA       VAL  45  -1.620   5.457  -6.999
  350    HB   VAL  45           HB       VAL  45  -2.131   3.093  -6.242
  351   HG11  VAL  45          HG11      VAL  45  -0.886   2.326  -8.922
  352   HG12  VAL  45          HG12      VAL  45  -1.318   1.246  -7.591
  353   HG13  VAL  45          HG13      VAL  45  -2.591   2.108  -8.471
  354   HG21  VAL  45          HG21      VAL  45   0.052   4.225  -5.874
  355   HG22  VAL  45          HG22      VAL  45   0.246   2.489  -6.150
  356   HG23  VAL  45          HG23      VAL  45   0.625   3.638  -7.450
  357    H    VAL  46           H        VAL  46  -0.067   6.267  -8.287
  358    HA   VAL  46           HA       VAL  46  -0.432   6.228 -11.166
  359    HB   VAL  46           HB       VAL  46   1.442   7.744 -11.300
  360   HG11  VAL  46          HG11      VAL  46  -0.394   8.484  -8.995
  361   HG12  VAL  46          HG12      VAL  46   0.527   9.598 -10.025
  362   HG13  VAL  46          HG13      VAL  46  -0.779   8.629 -10.721
  363   HG21  VAL  46          HG21      VAL  46   2.947   6.824  -9.580
  364   HG22  VAL  46          HG22      VAL  46   2.660   8.550  -9.356
  365   HG23  VAL  46          HG23      VAL  46   1.841   7.375  -8.310
  366    HA   PRO  47           HA       PRO  47   2.556   3.114 -12.398
  367    HB2  PRO  47           HB2      PRO  47   3.649   5.078 -14.388
  368    HB3  PRO  47           HB3      PRO  47   3.083   3.414 -14.646
  369    HG2  PRO  47           HG2      PRO  47   1.539   5.541 -15.382
  370    HG3  PRO  47           HG3      PRO  47   0.786   4.107 -14.609
  371    HD2  PRO  47           HD2      PRO  47   1.605   6.724 -13.329
  372    HD3  PRO  47           HD3      PRO  47   0.060   5.838 -13.185
  373    H    GLY  48           H        GLY  48   4.679   2.581 -11.709
  374    HA2  GLY  48           HA2      GLY  48   6.677   2.851 -10.588
  375    HA3  GLY  48           HA3      GLY  48   6.696   4.552 -11.035
  376    H    GLY  49           H        GLY  49   3.750   3.989  -9.456
  377    HA2  GLY  49           HA2      GLY  49   4.484   5.576  -7.201
  378    HA3  GLY  49           HA3      GLY  49   2.923   4.846  -7.528
  379    H    LYS  50           H        LYS  50   3.358   5.009  -5.065
  380    HA   LYS  50           HA       LYS  50   4.243   2.341  -4.008
  381    HB2  LYS  50           HB2      LYS  50   4.726   5.109  -2.831
  382    HB3  LYS  50           HB3      LYS  50   5.004   3.592  -1.962
  383    HG2  LYS  50           HG2      LYS  50   6.745   2.924  -3.472
  384    HG3  LYS  50           HG3      LYS  50   6.423   4.274  -4.572
  385    HD2  LYS  50           HD2      LYS  50   7.140   5.902  -2.923
  386    HD3  LYS  50           HD3      LYS  50   7.332   4.641  -1.686
  387    HE2  LYS  50           HE2      LYS  50   9.114   3.585  -2.929
  388    HE3  LYS  50           HE3      LYS  50   8.893   4.671  -4.311
  389    HZ1  LYS  50           HZ1      LYS  50   9.775   6.472  -3.045
  390    HZ2  LYS  50           HZ2      LYS  50   9.622   5.662  -1.610
  391    HZ3  LYS  50           HZ3      LYS  50  10.755   5.221  -2.696
  392    H    PHE  51           H        PHE  51   3.005   1.445  -2.382
  393    HA   PHE  51           HA       PHE  51   0.260   2.446  -2.268
  394    HB2  PHE  51           HB2      PHE  51   1.480  -0.097  -1.191
  395    HB3  PHE  51           HB3      PHE  51  -0.230   0.305  -1.124
  396    HD1  PHE  51           HD2      PHE  51  -1.575   0.544  -3.265
  397    HD2  PHE  51           HD1      PHE  51   2.476  -0.904  -3.242
  398    HE1  PHE  51           HE2      PHE  51  -1.868  -0.379  -5.558
  399    HE2  PHE  51           HE1      PHE  51   2.191  -1.790  -5.526
  400    HZ   PHE  51           HZ       PHE  51   0.010  -1.525  -6.698
  401    HA   PRO  52           HA       PRO  52   0.952   4.298   1.771
  402    HB2  PRO  52           HB2      PRO  52  -1.426   5.570   2.129
  403    HB3  PRO  52           HB3      PRO  52  -0.254   6.067   0.875
  404    HG2  PRO  52           HG2      PRO  52  -2.718   4.335   0.557
  405    HG3  PRO  52           HG3      PRO  52  -2.190   5.713  -0.457
  406    HD2  PRO  52           HD2      PRO  52  -1.684   3.093  -1.116
  407    HD3  PRO  52           HD3      PRO  52  -0.569   4.429  -1.533
  408    H    VAL  53           H        VAL  53  -1.472   1.846   1.353
  409    HA   VAL  53           HA       VAL  53  -1.587   1.094   4.145
  410    HB   VAL  53           HB       VAL  53  -4.040   1.076   4.309
  411   HG11  VAL  53          HG11      VAL  53  -2.954   3.902   4.026
  412   HG12  VAL  53          HG12      VAL  53  -4.319   3.355   5.017
  413   HG13  VAL  53          HG13      VAL  53  -2.672   2.836   5.419
  414   HG21  VAL  53          HG21      VAL  53  -5.408   2.514   2.938
  415   HG22  VAL  53          HG22      VAL  53  -4.008   3.019   1.971
  416   HG23  VAL  53          HG23      VAL  53  -4.590   1.335   1.894
  417    H    ASP  54           H        ASP  54  -3.288  -0.944   4.196
  418    HA   ASP  54           HA       ASP  54  -2.653  -2.560   1.775
  419    HB2  ASP  54           HB2      ASP  54  -2.652  -4.496   3.032
  420    HB3  ASP  54           HB3      ASP  54  -1.697  -3.329   3.929
  421    H    GLY  55           H        GLY  55  -4.157  -3.758   0.677
  422    HA2  GLY  55           HA2      GLY  55  -6.995  -3.752   1.226
  423    HA3  GLY  55           HA3      GLY  55  -6.550  -2.386   0.220
  424    H    ARG  56           H        ARG  56  -8.252  -3.875  -0.953
  425    HA   ARG  56           HA       ARG  56  -6.817  -5.690  -2.843
  426    HB2  ARG  56           HB2      ARG  56  -8.916  -6.448  -1.570
  427    HB3  ARG  56           HB3      ARG  56  -9.827  -5.405  -2.669
  428    HG2  ARG  56           HG2      ARG  56  -8.908  -6.695  -4.612
  429    HG3  ARG  56           HG3      ARG  56  -7.971  -7.683  -3.480
  430    HD2  ARG  56           HD2      ARG  56  -9.855  -8.952  -4.125
  431    HD3  ARG  56           HD3      ARG  56 -10.082  -8.485  -2.441
  432    HE   ARG  56           HE       ARG  56 -11.585  -6.613  -3.361
  433   HH11  ARG  56          HH11      ARG  56 -11.478  -9.750  -5.037
  434   HH12  ARG  56          HH12      ARG  56 -13.039  -9.437  -5.751
  435   HH21  ARG  56          HH21      ARG  56 -13.458  -6.410  -4.163
  436   HH22  ARG  56          HH22      ARG  56 -14.174  -7.580  -5.261
  437    H    VAL  57           H        VAL  57  -6.779  -5.426  -4.998
  438    HA   VAL  57           HA       VAL  57  -7.191  -2.738  -6.175
  439    HB   VAL  57           HB       VAL  57  -5.935  -5.302  -7.270
  440   HG11  VAL  57          HG11      VAL  57  -6.083  -2.489  -8.429
  441   HG12  VAL  57          HG12      VAL  57  -5.045  -3.791  -9.061
  442   HG13  VAL  57          HG13      VAL  57  -6.786  -3.970  -9.118
  443   HG21  VAL  57          HG21      VAL  57  -4.544  -4.319  -5.473
  444   HG22  VAL  57          HG22      VAL  57  -3.777  -4.183  -7.057
  445   HG23  VAL  57          HG23      VAL  57  -4.548  -2.762  -6.330
  446    H    ILE  58           H        ILE  58  -8.966  -2.361  -7.440
  447    HA   ILE  58           HA       ILE  58 -10.317  -4.636  -8.819
  448    HB   ILE  58           HB       ILE  58 -12.563  -3.618  -8.130
  449   HG12  ILE  58          HG12      ILE  58 -10.953  -2.530  -5.785
  450   HG13  ILE  58          HG13      ILE  58 -11.424  -1.510  -7.159
  451   HG21  ILE  58          HG21      ILE  58 -10.997  -4.941  -5.886
  452   HG22  ILE  58          HG22      ILE  58 -12.746  -4.981  -6.179
  453   HG23  ILE  58          HG23      ILE  58 -11.655  -5.795  -7.298
  454   HD11  ILE  58          HD11      ILE  58 -13.809  -2.010  -6.730
  455   HD12  ILE  58          HD12      ILE  58 -13.343  -2.947  -5.284
  456   HD13  ILE  58          HD13      ILE  58 -13.014  -1.207  -5.363
  457    H    GLU  59           H        GLU  59  -8.556  -2.520  -9.672
  458    HA   GLU  59           HA       GLU  59  -9.830  -2.111 -12.194
  459    HB2  GLU  59           HB2      GLU  59 -10.584  -0.057 -10.705
  460    HB3  GLU  59           HB3      GLU  59  -8.890   0.410 -10.795
  461    HG2  GLU  59           HG2      GLU  59 -10.035   1.619 -12.469
  462    HG3  GLU  59           HG3      GLU  59  -9.058   0.413 -13.303
  463    H    GLY  60           H        GLY  60  -8.135  -2.500 -13.594
  464    HA2  GLY  60           HA2      GLY  60  -6.088  -2.022 -14.625
  465    HA3  GLY  60           HA3      GLY  60  -5.503  -1.241 -13.171
  466    H    HIS  61           H        HIS  61  -3.778  -2.629 -14.290
  467    HA   HIS  61           HA       HIS  61  -3.225  -4.974 -12.594
  468    HB2  HIS  61           HB2      HIS  61  -2.790  -6.487 -14.507
  469    HB3  HIS  61           HB3      HIS  61  -4.478  -6.067 -14.283
  470    HD1  HIS  61           HD1      HIS  61  -5.674  -4.709 -16.317
  471    HD2  HIS  61           HD2      HIS  61  -1.577  -5.620 -16.732
  472    HE1  HIS  61           HE1      HIS  61  -5.129  -4.427 -18.776
  473    H    SER  62           H        SER  62  -1.232  -4.926 -11.940
  474    HA   SER  62           HA       SER  62   0.989  -3.848 -13.584
  475    HB2  SER  62           HB2      SER  62  -0.079  -2.038 -12.023
  476    HB3  SER  62           HB3      SER  62   0.725  -2.917 -10.721
  477    HG   SER  62           HG       SER  62   1.951  -1.193 -11.721
  478    H    MET  63           H        MET  63   3.139  -4.359 -12.667
  479    HA   MET  63           HA       MET  63   3.124  -6.818 -10.993
  480    HB2  MET  63           HB2      MET  63   4.334  -6.942 -13.083
  481    HB3  MET  63           HB3      MET  63   5.337  -5.550 -12.641
  482    HG2  MET  63           HG2      MET  63   6.404  -6.735 -10.892
  483    HG3  MET  63           HG3      MET  63   5.182  -8.007 -10.865
  484    HE1  MET  63           HE1      MET  63   6.065 -10.421 -13.623
  485    HE2  MET  63           HE2      MET  63   5.268 -10.156 -12.056
  486    HE3  MET  63           HE3      MET  63   4.720  -9.268 -13.501
  487    H    VAL  64           H        VAL  64   3.682  -6.775  -8.922
  488    HA   VAL  64           HA       VAL  64   4.597  -4.189  -7.757
  489    HB   VAL  64           HB       VAL  64   2.729  -6.298  -6.658
  490   HG11  VAL  64          HG11      VAL  64   4.068  -5.509  -4.754
  491   HG12  VAL  64          HG12      VAL  64   3.789  -3.817  -5.232
  492   HG13  VAL  64          HG13      VAL  64   2.445  -4.829  -4.676
  493   HG21  VAL  64          HG21      VAL  64   1.708  -4.708  -8.244
  494   HG22  VAL  64          HG22      VAL  64   1.159  -4.342  -6.600
  495   HG23  VAL  64          HG23      VAL  64   2.409  -3.342  -7.361
  496    H    ASP  65           H        ASP  65   6.166  -4.036  -6.310
  497    HA   ASP  65           HA       ASP  65   7.843  -6.443  -5.800
  498    HB2  ASP  65           HB2      ASP  65   8.912  -4.718  -7.149
  499    HB3  ASP  65           HB3      ASP  65   8.578  -3.501  -5.909
  500    H    GLU  66           H        GLU  66   7.124  -7.271  -3.958
  501    HA   GLU  66           HA       GLU  66   7.034  -5.597  -1.501
  502    HB2  GLU  66           HB2      GLU  66   5.587  -7.509  -0.630
  503    HB3  GLU  66           HB3      GLU  66   4.920  -6.335  -1.745
  504    HG2  GLU  66           HG2      GLU  66   4.139  -8.640  -2.161
  505    HG3  GLU  66           HG3      GLU  66   4.866  -7.865  -3.562
  506    H    SER  67           H        SER  67   9.420  -6.878  -2.827
  507    HA   SER  67           HA       SER  67  10.273  -9.220  -1.571
  508    HB2  SER  67           HB2      SER  67  12.556  -8.572  -2.165
  509    HB3  SER  67           HB3      SER  67  11.453  -8.213  -3.494
  510    HG   SER  67           HG       SER  67  13.128  -6.565  -2.470
  511    H    LEU  68           H        LEU  68  10.434  -5.966  -0.129
  512    HA   LEU  68           HA       LEU  68  12.116  -6.947   2.084
  513    HB2  LEU  68           HB2      LEU  68  12.273  -4.661   1.095
  514    HB3  LEU  68           HB3      LEU  68  10.623  -4.320   1.559
  515    HG   LEU  68           HG       LEU  68  12.352  -3.181   2.875
  516   HD11  LEU  68          HD11      LEU  68  11.343  -3.250   4.961
  517   HD12  LEU  68          HD12      LEU  68  10.049  -3.734   3.852
  518   HD13  LEU  68          HD13      LEU  68  10.891  -4.942   4.837
  519   HD21  LEU  68          HD21      LEU  68  14.059  -4.944   2.971
  520   HD22  LEU  68          HD22      LEU  68  13.655  -4.328   4.587
  521   HD23  LEU  68          HD23      LEU  68  13.026  -5.897   4.058
  522    H    ILE  69           H        ILE  69   8.713  -6.566   1.431
  523    HA   ILE  69           HA       ILE  69   7.783  -6.599   4.178
  524    HB   ILE  69           HB       ILE  69   6.174  -7.330   1.709
  525   HG12  ILE  69          HG12      ILE  69   7.362  -5.221   1.129
  526   HG13  ILE  69          HG13      ILE  69   5.631  -5.115   1.166
  527   HG21  ILE  69          HG21      ILE  69   5.448  -6.060   4.375
  528   HG22  ILE  69          HG22      ILE  69   4.332  -6.258   3.013
  529   HG23  ILE  69          HG23      ILE  69   5.022  -7.684   3.800
  530   HD11  ILE  69          HD11      ILE  69   7.381  -4.155   3.461
  531   HD12  ILE  69          HD12      ILE  69   6.773  -3.132   2.137
  532   HD13  ILE  69          HD13      ILE  69   5.624  -3.908   3.232
  533    H    THR  70           H        THR  70   7.643  -8.943   1.499
  534    HA   THR  70           HA       THR  70   6.951 -11.193   3.274
  535    HB   THR  70           HB       THR  70   6.469 -12.313   1.120
  536    HG1  THR  70           HG1      THR  70   6.683 -10.762  -0.757
  537   HG21  THR  70          HG21      THR  70   5.333  -9.487   1.021
  538   HG22  THR  70          HG22      THR  70   4.630 -10.970   0.355
  539   HG23  THR  70          HG23      THR  70   4.738 -10.763   2.111
  540    H    GLY  71           H        GLY  71   9.780 -10.082   1.548
  541    HA2  GLY  71           HA2      GLY  71  11.896 -10.976   1.461
  542    HA3  GLY  71           HA3      GLY  71  11.318 -12.517   2.118
  543    H    GLU  72           H        GLU  72   9.177 -11.830  -0.378
  544    HA   GLU  72           HA       GLU  72  10.223 -13.884  -2.110
  545    HB2  GLU  72           HB2      GLU  72   8.164 -11.748  -2.741
  546    HB3  GLU  72           HB3      GLU  72   8.506 -13.169  -3.713
  547    HG2  GLU  72           HG2      GLU  72   7.244 -13.151  -0.949
  548    HG3  GLU  72           HG3      GLU  72   6.437 -13.395  -2.462
  549    H    ALA  73           H        ALA  73  12.124 -13.631  -3.261
  550    HA   ALA  73           HA       ALA  73  12.970 -10.968  -4.149
  551    HB1  ALA  73           HB1      ALA  73  14.480 -12.597  -3.035
  552    HB2  ALA  73           HB2      ALA  73  14.366 -13.647  -4.466
  553    HB3  ALA  73           HB3      ALA  73  15.072 -12.012  -4.585
  554    H    MET  74           H        MET  74  10.980 -13.234  -5.384
  555    HA   MET  74           HA       MET  74  11.281 -12.536  -8.255
  556    HB2  MET  74           HB2      MET  74   9.730 -14.558  -6.613
  557    HB3  MET  74           HB3      MET  74   9.184 -14.140  -8.215
  558    HG2  MET  74           HG2      MET  74  11.965 -15.197  -7.602
  559    HG3  MET  74           HG3      MET  74  10.596 -16.183  -8.120
  560    HE1  MET  74           HE1      MET  74  13.053 -16.647  -9.712
  561    HE2  MET  74           HE2      MET  74  11.474 -17.253 -10.260
  562    HE3  MET  74           HE3      MET  74  12.544 -16.413 -11.402
  563    HA   PRO  75           HA       PRO  75   8.032  -9.492  -7.373
  564    HB2  PRO  75           HB2      PRO  75   7.564  -8.460  -9.791
  565    HB3  PRO  75           HB3      PRO  75   9.151  -8.261  -8.992
  566    HG2  PRO  75           HG2      PRO  75   8.375 -10.355 -11.058
  567    HG3  PRO  75           HG3      PRO  75   9.782  -9.250 -11.089
  568    HD2  PRO  75           HD2      PRO  75   9.934 -11.825 -10.135
  569    HD3  PRO  75           HD3      PRO  75  10.903 -10.496  -9.426
  570    H    VAL  76           H        VAL  76   5.770  -9.035  -7.805
  571    HA   VAL  76           HA       VAL  76   4.303 -11.545  -8.543
  572    HB   VAL  76           HB       VAL  76   3.566  -9.661  -6.277
  573   HG11  VAL  76          HG11      VAL  76   2.799 -12.546  -6.918
  574   HG12  VAL  76          HG12      VAL  76   2.292 -11.640  -5.486
  575   HG13  VAL  76          HG13      VAL  76   1.737 -11.126  -7.092
  576   HG21  VAL  76          HG21      VAL  76   5.750 -10.603  -5.680
  577   HG22  VAL  76          HG22      VAL  76   4.492 -11.382  -4.740
  578   HG23  VAL  76          HG23      VAL  76   5.203 -12.235  -6.130
  579    H    ALA  77           H        ALA  77   2.870 -11.374 -10.068
  580    HA   ALA  77           HA       ALA  77   2.131  -8.755 -11.161
  581    HB1  ALA  77           HB1      ALA  77   1.477 -11.601 -12.008
  582    HB2  ALA  77           HB2      ALA  77   1.079 -10.135 -12.924
  583    HB3  ALA  77           HB3      ALA  77   2.775 -10.572 -12.648
  584    H    LYS  78           H        LYS  78   0.246  -7.668 -10.942
  585    HA   LYS  78           HA       LYS  78  -1.949  -8.870  -9.307
  586    HB2  LYS  78           HB2      LYS  78  -1.255  -5.928  -9.686
  587    HB3  LYS  78           HB3      LYS  78  -2.468  -6.579  -8.605
  588    HG2  LYS  78           HG2      LYS  78   0.544  -6.970  -8.363
  589    HG3  LYS  78           HG3      LYS  78  -0.453  -5.876  -7.405
  590    HD2  LYS  78           HD2      LYS  78  -1.629  -7.681  -6.347
  591    HD3  LYS  78           HD3      LYS  78  -0.861  -8.891  -7.393
  592    HE2  LYS  78           HE2      LYS  78   1.309  -8.478  -6.423
  593    HE3  LYS  78           HE3      LYS  78   0.677  -7.134  -5.447
  594    HZ1  LYS  78           HZ1      LYS  78  -0.407  -9.882  -5.221
  595    HZ2  LYS  78           HZ2      LYS  78   0.816  -9.349  -4.250
  596    HZ3  LYS  78           HZ3      LYS  78  -0.657  -8.627  -4.212
  597    H    LYS  79           H        LYS  79  -4.047  -8.178  -9.714
  598    HA   LYS  79           HA       LYS  79  -4.864  -7.396 -12.462
  599    HB2  LYS  79           HB2      LYS  79  -6.260  -9.463 -12.611
  600    HB3  LYS  79           HB3      LYS  79  -4.539  -9.826 -12.580
  601    HG2  LYS  79           HG2      LYS  79  -4.675 -10.642 -10.310
  602    HG3  LYS  79           HG3      LYS  79  -6.274  -9.925 -10.089
  603    HD2  LYS  79           HD2      LYS  79  -6.513 -12.292 -10.305
  604    HD3  LYS  79           HD3      LYS  79  -7.310 -11.432 -11.615
  605    HE2  LYS  79           HE2      LYS  79  -6.281 -13.325 -12.574
  606    HE3  LYS  79           HE3      LYS  79  -5.365 -11.900 -13.088
  607    HZ1  LYS  79           HZ1      LYS  79  -3.635 -12.459 -11.567
  608    HZ2  LYS  79           HZ2      LYS  79  -4.528 -13.606 -10.800
  609    HZ3  LYS  79           HZ3      LYS  79  -3.999 -13.837 -12.355
  610    HA   PRO  80           HA       PRO  80  -8.537  -5.869 -10.250
  611    HB2  PRO  80           HB2      PRO  80 -10.656  -6.783 -11.795
  612    HB3  PRO  80           HB3      PRO  80  -9.674  -5.336 -12.169
  613    HG2  PRO  80           HG2      PRO  80  -9.362  -8.151 -13.260
  614    HG3  PRO  80           HG3      PRO  80  -9.371  -6.602 -14.167
  615    HD2  PRO  80           HD2      PRO  80  -7.046  -7.774 -13.545
  616    HD3  PRO  80           HD3      PRO  80  -7.223  -6.015 -13.362
  617    H    GLY  81           H        GLY  81  -9.270  -6.751  -8.402
  618    HA2  GLY  81           HA2      GLY  81  -9.940  -8.313  -6.823
  619    HA3  GLY  81           HA3      GLY  81 -10.099  -9.553  -8.065
  620    H    SER  82           H        SER  82  -7.428  -7.517  -6.834
  621    HA   SER  82           HA       SER  82  -5.843  -9.928  -5.986
  622    HB2  SER  82           HB2      SER  82  -5.256  -9.052  -8.290
  623    HB3  SER  82           HB3      SER  82  -4.714  -7.558  -7.511
  624    HG   SER  82           HG       SER  82  -3.741 -10.213  -7.100
  625    H    THR  83           H        THR  83  -4.193  -9.485  -4.231
  626    HA   THR  83           HA       THR  83  -5.032  -7.115  -2.634
  627    HB   THR  83           HB       THR  83  -4.173  -8.243  -0.689
  628    HG1  THR  83           HG1      THR  83  -3.541 -10.380  -0.821
  629   HG21  THR  83          HG21      THR  83  -6.008 -10.056  -2.303
  630   HG22  THR  83          HG22      THR  83  -5.780 -10.085  -0.546
  631   HG23  THR  83          HG23      THR  83  -6.511  -8.664  -1.317
  632    H    VAL  84           H        VAL  84  -3.618  -5.789  -1.563
  633    HA   VAL  84           HA       VAL  84  -0.702  -6.047  -2.080
  634    HB   VAL  84           HB       VAL  84  -0.532  -3.598  -2.452
  635   HG11  VAL  84          HG11      VAL  84  -2.198  -5.016  -4.563
  636   HG12  VAL  84          HG12      VAL  84  -1.122  -3.624  -4.799
  637   HG13  VAL  84          HG13      VAL  84  -0.445  -5.191  -4.332
  638   HG21  VAL  84          HG21      VAL  84  -2.733  -2.882  -1.531
  639   HG22  VAL  84          HG22      VAL  84  -2.452  -2.293  -3.176
  640   HG23  VAL  84          HG23      VAL  84  -3.547  -3.661  -2.907
  641    H    ILE  85           H        ILE  85   0.592  -4.680  -0.699
  642    HA   ILE  85           HA       ILE  85  -0.586  -3.985   1.926
  643    HB   ILE  85           HB       ILE  85   1.933  -4.726   2.696
  644   HG12  ILE  85          HG12      ILE  85   2.349  -7.029   1.991
  645   HG13  ILE  85          HG13      ILE  85   1.066  -6.952   0.792
  646   HG21  ILE  85          HG21      ILE  85  -0.546  -6.470   2.735
  647   HG22  ILE  85          HG22      ILE  85   0.873  -6.622   3.793
  648   HG23  ILE  85          HG23      ILE  85  -0.137  -5.181   3.893
  649   HD11  ILE  85          HD11      ILE  85   2.325  -5.383  -0.558
  650   HD12  ILE  85          HD12      ILE  85   3.457  -5.066   0.771
  651   HD13  ILE  85          HD13      ILE  85   3.441  -6.651  -0.040
  652    H    ALA  86           H        ALA  86   0.421  -2.390   3.098
  653    HA   ALA  86           HA       ALA  86   1.146  -0.145   1.594
  654    HB1  ALA  86           HB1      ALA  86   0.101  -0.191   3.872
  655    HB2  ALA  86           HB2      ALA  86   1.655  -0.663   4.556
  656    HB3  ALA  86           HB3      ALA  86   1.480   0.922   3.760
  657    H    GLY  87           H        GLY  87   3.001   0.916   1.142
  658    HA2  GLY  87           HA2      GLY  87   5.210   1.486   1.093
  659    HA3  GLY  87           HA3      GLY  87   5.598   0.185   2.233
  660    H    SER  88           H        SER  88   3.974  -1.329  -0.236
  661    HA   SER  88           HA       SER  88   6.426  -2.223  -1.598
  662    HB2  SER  88           HB2      SER  88   4.928  -3.712  -2.845
  663    HB3  SER  88           HB3      SER  88   4.779  -3.908  -1.096
  664    HG   SER  88           HG       SER  88   2.800  -2.889  -1.142
  665    H    ILE  89           H        ILE  89   6.522  -2.223  -3.990
  666    HA   ILE  89           HA       ILE  89   5.767   0.483  -5.000
  667    HB   ILE  89           HB       ILE  89   7.958  -1.069  -6.302
  668   HG12  ILE  89          HG12      ILE  89   8.626  -1.404  -3.982
  669   HG13  ILE  89          HG13      ILE  89   9.709  -0.347  -4.854
  670   HG21  ILE  89          HG21      ILE  89   8.898   1.240  -6.530
  671   HG22  ILE  89          HG22      ILE  89   7.290   1.072  -7.237
  672   HG23  ILE  89          HG23      ILE  89   7.476   1.879  -5.670
  673   HD11  ILE  89          HD11      ILE  89   8.848   1.624  -3.727
  674   HD12  ILE  89          HD12      ILE  89   7.604   0.658  -2.899
  675   HD13  ILE  89          HD13      ILE  89   9.322   0.399  -2.540
  676    H    ASN  90           H        ASN  90   4.949   0.793  -7.054
  677    HA   ASN  90           HA       ASN  90   3.778  -1.576  -8.428
  678    HB2  ASN  90           HB2      ASN  90   2.338   0.264  -7.429
  679    HB3  ASN  90           HB3      ASN  90   3.079   1.399  -8.545
  680   HD21  ASN  90          HD22      ASN  90   2.579   1.036 -10.899
  681   HD22  ASN  90          HD21      ASN  90   0.931   0.469 -11.097
  682    H    GLN  91           H        GLN  91   4.135  -1.982 -10.638
  683    HA   GLN  91           HA       GLN  91   6.168  -0.391 -12.039
  684    HB2  GLN  91           HB2      GLN  91   6.189  -2.893 -11.945
  685    HB3  GLN  91           HB3      GLN  91   4.761  -2.902 -12.958
  686    HG2  GLN  91           HG2      GLN  91   6.600  -3.323 -14.386
  687    HG3  GLN  91           HG3      GLN  91   6.199  -1.650 -14.729
  688   HE21  GLN  91          HE22      GLN  91   7.697   0.064 -13.875
  689   HE22  GLN  91          HE21      GLN  91   9.299  -0.423 -13.314
  690    H    ASN  92           H        ASN  92   4.075  -1.559 -14.447
  691    HA   ASN  92           HA       ASN  92   3.848   1.185 -15.353
  692    HB2  ASN  92           HB2      ASN  92   4.665  -0.581 -16.806
  693    HB3  ASN  92           HB3      ASN  92   3.203  -1.528 -16.571
  694   HD21  ASN  92          HD22      ASN  92   1.323  -1.051 -17.733
  695   HD22  ASN  92          HD21      ASN  92   1.359   0.097 -19.069
  696    H    GLY  93           H        GLY  93   1.398  -1.292 -14.421
  697    HA2  GLY  93           HA2      GLY  93  -0.794   0.159 -15.513
  698    HA3  GLY  93           HA3      GLY  93  -0.903  -1.119 -14.306
  699    H    SER  94           H        SER  94  -1.964   1.853 -14.783
  700    HA   SER  94           HA       SER  94  -1.595   2.854 -12.003
  701    HB2  SER  94           HB2      SER  94  -1.642   4.533 -13.793
  702    HB3  SER  94           HB3      SER  94  -3.245   3.977 -14.298
  703    HG   SER  94           HG       SER  94  -2.725   4.793 -11.612
  704    H    LEU  95           H        LEU  95  -2.926   2.214 -10.447
  705    HA   LEU  95           HA       LEU  95  -5.290   0.522 -11.172
  706    HB2  LEU  95           HB2      LEU  95  -3.694   0.117  -8.669
  707    HB3  LEU  95           HB3      LEU  95  -4.731  -1.003  -9.489
  708    HG   LEU  95           HG       LEU  95  -1.935  -0.148 -10.367
  709   HD11  LEU  95          HD11      LEU  95  -2.958  -2.713  -9.067
  710   HD12  LEU  95          HD12      LEU  95  -1.306  -2.421  -9.648
  711   HD13  LEU  95          HD13      LEU  95  -1.933  -1.479  -8.298
  712   HD21  LEU  95          HD21      LEU  95  -2.169  -2.051 -11.929
  713   HD22  LEU  95          HD22      LEU  95  -3.816  -2.319 -11.322
  714   HD23  LEU  95          HD23      LEU  95  -3.415  -0.848 -12.247
  715    H    LEU  96           H        LEU  96  -6.996   0.388  -9.578
  716    HA   LEU  96           HA       LEU  96  -6.999   2.606  -7.569
  717    HB2  LEU  96           HB2      LEU  96  -9.396   1.732  -9.198
  718    HB3  LEU  96           HB3      LEU  96  -9.466   2.635  -7.715
  719    HG   LEU  96           HG       LEU  96  -8.161   4.488  -8.707
  720   HD11  LEU  96          HD11      LEU  96  -8.146   4.649 -11.247
  721   HD12  LEU  96          HD12      LEU  96  -6.940   3.575 -10.576
  722   HD13  LEU  96          HD13      LEU  96  -8.418   2.899 -11.294
  723   HD21  LEU  96          HD21      LEU  96 -10.641   4.480  -8.677
  724   HD22  LEU  96          HD22      LEU  96  -9.985   5.363 -10.065
  725   HD23  LEU  96          HD23      LEU  96 -10.647   3.727 -10.286
  726    H    ILE  97           H        ILE  97  -7.053   2.007  -5.613
  727    HA   ILE  97           HA       ILE  97  -7.634  -0.841  -4.911
  728    HB   ILE  97           HB       ILE  97  -5.709   1.072  -3.537
  729   HG12  ILE  97          HG12      ILE  97  -4.036  -0.705  -4.728
  730   HG13  ILE  97          HG13      ILE  97  -5.299  -0.676  -5.951
  731   HG21  ILE  97          HG21      ILE  97  -6.469  -0.853  -2.153
  732   HG22  ILE  97          HG22      ILE  97  -5.917  -1.966  -3.428
  733   HG23  ILE  97          HG23      ILE  97  -4.759  -0.954  -2.551
  734   HD11  ILE  97          HD11      ILE  97  -5.003   1.806  -6.158
  735   HD12  ILE  97          HD12      ILE  97  -3.773   1.743  -4.877
  736   HD13  ILE  97          HD13      ILE  97  -3.503   0.931  -6.430
  737    H    CYS  98           H        CYS  98  -8.910  -1.332  -3.160
  738    HA   CYS  98           HA       CYS  98 -10.393   0.870  -1.883
  739    HB2  CYS  98           HB2      CYS  98 -11.690  -0.887  -0.787
  740    HB3  CYS  98           HB3      CYS  98 -11.678  -1.058  -2.542
  741    HG   CYS  98           HG       CYS  98  -9.879  -2.939  -2.658
  742    H    ALA  99           H        ALA  99  -9.248   2.078  -0.486
  743    HA   ALA  99           HA       ALA  99  -7.480   0.927   1.499
  744    HB1  ALA  99           HB1      ALA  99  -8.687   3.690   1.081
  745    HB2  ALA  99           HB2      ALA  99  -7.497   3.286   2.331
  746    HB3  ALA  99           HB3      ALA  99  -7.057   3.125   0.617
  747    H    THR 100           H        THR 100  -8.768  -0.645   2.394
  748    HA   THR 100           HA       THR 100 -11.182   0.113   3.968
  749    HB   THR 100           HB       THR 100 -11.424  -1.544   2.160
  750    HG1  THR 100           HG1      THR 100 -12.875  -1.907   3.616
  751   HG21  THR 100          HG21      THR 100  -9.143  -2.627   2.350
  752   HG22  THR 100          HG22      THR 100  -9.747  -3.432   3.820
  753   HG23  THR 100          HG23      THR 100 -10.508  -3.740   2.249
  754    H    HIS 101           H        HIS 101  -8.044   0.140   4.578
  755    HA   HIS 101           HA       HIS 101  -8.421  -0.474   7.440
  756    HB2  HIS 101           HB2      HIS 101  -5.983  -1.374   5.856
  757    HB3  HIS 101           HB3      HIS 101  -6.300  -1.654   7.562
  758    HD1  HIS 101           HD1      HIS 101  -6.673  -3.253   4.265
  759    HD2  HIS 101           HD2      HIS 101  -8.437  -3.451   8.081
  760    HE1  HIS 101           HE1      HIS 101  -7.928  -5.485   4.365
  761    H    VAL 102           H        VAL 102  -7.049   0.756   8.798
  762    HA   VAL 102           HA       VAL 102  -5.347   2.884   7.535
  763    HB   VAL 102           HB       VAL 102  -5.484   4.045   9.719
  764   HG11  VAL 102          HG11      VAL 102  -8.181   3.569   8.410
  765   HG12  VAL 102          HG12      VAL 102  -7.693   4.974   9.384
  766   HG13  VAL 102          HG13      VAL 102  -6.919   4.670   7.818
  767   HG21  VAL 102          HG21      VAL 102  -6.133   2.001  11.094
  768   HG22  VAL 102          HG22      VAL 102  -7.074   3.458  11.397
  769   HG23  VAL 102          HG23      VAL 102  -7.767   2.158  10.416
  770    H    GLY 103           H        GLY 103  -3.368   3.519   8.997
  771    HA2  GLY 103           HA2      GLY 103  -1.560   1.429   9.044
  772    HA3  GLY 103           HA3      GLY 103  -1.400   2.958   9.905
  773    H    ALA 104           H        ALA 104  -3.749   2.291  11.757
  774    HA   ALA 104           HA       ALA 104  -2.350   0.828  13.781
  775    HB1  ALA 104           HB1      ALA 104  -4.520   0.850  14.947
  776    HB2  ALA 104           HB2      ALA 104  -4.139   2.439  14.265
  777    HB3  ALA 104           HB3      ALA 104  -5.331   1.391  13.464
  778    H    ASP 105           H        ASP 105  -4.769  -0.270  11.354
  779    HA   ASP 105           HA       ASP 105  -4.990  -2.964  12.429
  780    HB2  ASP 105           HB2      ASP 105  -6.855  -1.930  11.313
  781    HB3  ASP 105           HB3      ASP 105  -5.904  -1.667   9.844
  782    H    THR 106           H        THR 106  -2.624  -1.510  10.303
  783    HA   THR 106           HA       THR 106  -2.538  -3.763   8.517
  784    HB   THR 106           HB       THR 106  -2.054  -1.417   7.851
  785    HG1  THR 106           HG1      THR 106  -1.683  -3.048   6.504
  786   HG21  THR 106          HG21      THR 106  -0.321  -0.881   9.593
  787   HG22  THR 106          HG22      THR 106   0.758  -2.015   8.778
  788   HG23  THR 106          HG23      THR 106   0.190  -0.569   7.924
  789    H    THR 107           H        THR 107  -1.140  -5.457   8.259
  790    HA   THR 107           HA       THR 107   0.320  -6.442  10.471
  791    HB   THR 107           HB       THR 107   0.867  -7.129   7.560
  792    HG1  THR 107           HG1      THR 107  -1.108  -7.935   9.402
  793   HG21  THR 107          HG21      THR 107   1.274  -9.406   8.528
  794   HG22  THR 107          HG22      THR 107   2.453  -8.215   9.084
  795   HG23  THR 107          HG23      THR 107   1.129  -8.719  10.158
  796    H    LEU 108           H        LEU 108   1.370  -4.158   7.999
  797    HA   LEU 108           HA       LEU 108   4.177  -4.366   8.363
  798    HB2  LEU 108           HB2      LEU 108   2.637  -2.966   6.681
  799    HB3  LEU 108           HB3      LEU 108   2.797  -1.717   7.909
  800    HG   LEU 108           HG       LEU 108   5.372  -2.129   7.710
  801   HD11  LEU 108          HD11      LEU 108   5.242  -4.207   6.324
  802   HD12  LEU 108          HD12      LEU 108   4.376  -3.295   5.063
  803   HD13  LEU 108          HD13      LEU 108   6.060  -2.886   5.462
  804   HD21  LEU 108          HD21      LEU 108   4.258  -0.121   6.963
  805   HD22  LEU 108          HD22      LEU 108   5.454  -0.609   5.749
  806   HD23  LEU 108          HD23      LEU 108   3.737  -0.917   5.450
  807    H    SER 109           H        SER 109   1.817  -2.283  10.146
  808    HA   SER 109           HA       SER 109   3.764  -1.386  12.060
  809    HB2  SER 109           HB2      SER 109   1.992  -0.311  13.191
  810    HB3  SER 109           HB3      SER 109   1.783  -0.084  11.449
  811    HG   SER 109           HG       SER 109  -0.171  -0.666  11.974
  812    H    GLN 110           H        GLN 110   1.684  -4.237  11.883
  813    HA   GLN 110           HA       GLN 110   1.932  -4.959  14.669
  814    HB2  GLN 110           HB2      GLN 110   0.260  -5.874  12.927
  815    HB3  GLN 110           HB3      GLN 110   1.564  -6.900  12.363
  816    HG2  GLN 110           HG2      GLN 110   0.377  -8.231  13.866
  817    HG3  GLN 110           HG3      GLN 110   1.809  -7.755  14.776
  818   HE21  GLN 110          HE22      GLN 110  -1.648  -6.983  14.242
  819   HE22  GLN 110          HE21      GLN 110  -1.790  -6.015  15.694
  820    H    ILE 111           H        ILE 111   3.881  -5.768  11.788
  821    HA   ILE 111           HA       ILE 111   5.769  -7.514  12.940
  822    HB   ILE 111           HB       ILE 111   6.070  -5.435  10.744
  823   HG12  ILE 111          HG12      ILE 111   6.042  -8.472  10.556
  824   HG13  ILE 111          HG13      ILE 111   4.563  -7.539  10.505
  825   HG21  ILE 111          HG21      ILE 111   8.108  -7.552  11.586
  826   HG22  ILE 111          HG22      ILE 111   8.188  -6.603  10.090
  827   HG23  ILE 111          HG23      ILE 111   8.339  -5.789  11.634
  828   HD11  ILE 111          HD11      ILE 111   5.200  -8.032   8.248
  829   HD12  ILE 111          HD12      ILE 111   5.441  -6.294   8.505
  830   HD13  ILE 111          HD13      ILE 111   6.835  -7.402   8.487
  831    H    VAL 112           H        VAL 112   6.110  -3.925  12.720
  832    HA   VAL 112           HA       VAL 112   8.385  -3.873  14.408
  833    HB   VAL 112           HB       VAL 112   8.188  -1.479  14.532
  834   HG11  VAL 112          HG11      VAL 112   7.440  -2.439  11.742
  835   HG12  VAL 112          HG12      VAL 112   8.344  -0.976  12.179
  836   HG13  VAL 112          HG13      VAL 112   9.064  -2.566  12.456
  837   HG21  VAL 112          HG21      VAL 112   5.726  -1.231  14.800
  838   HG22  VAL 112          HG22      VAL 112   6.391  -0.225  13.510
  839   HG23  VAL 112          HG23      VAL 112   5.538  -1.726  13.102
  840    H    LYS 113           H        LYS 113   5.001  -3.933  15.368
  841    HA   LYS 113           HA       LYS 113   5.494  -3.189  18.151
  842    HB2  LYS 113           HB2      LYS 113   3.239  -4.676  16.743
  843    HB3  LYS 113           HB3      LYS 113   3.287  -4.459  18.495
  844    HG2  LYS 113           HG2      LYS 113   3.180  -2.068  18.319
  845    HG3  LYS 113           HG3      LYS 113   3.454  -2.111  16.584
  846    HD2  LYS 113           HD2      LYS 113   1.127  -1.637  17.059
  847    HD3  LYS 113           HD3      LYS 113   1.294  -3.168  16.177
  848    HE2  LYS 113           HE2      LYS 113   1.096  -4.427  18.264
  849    HE3  LYS 113           HE3      LYS 113   1.073  -2.917  19.191
  850    HZ1  LYS 113           HZ1      LYS 113  -0.998  -2.337  18.018
  851    HZ2  LYS 113           HZ2      LYS 113  -1.035  -3.770  17.252
  852    HZ3  LYS 113           HZ3      LYS 113  -1.211  -3.707  18.880
  853    H    LEU 114           H        LEU 114   5.235  -6.369  16.473
  854    HA   LEU 114           HA       LEU 114   5.771  -7.807  18.919
  855    HB2  LEU 114           HB2      LEU 114   5.047  -8.434  16.152
  856    HB3  LEU 114           HB3      LEU 114   6.267  -9.560  16.753
  857    HG   LEU 114           HG       LEU 114   3.642  -8.900  18.107
  858   HD11  LEU 114          HD11      LEU 114   2.916 -11.136  17.340
  859   HD12  LEU 114          HD12      LEU 114   3.300 -10.072  15.975
  860   HD13  LEU 114          HD13      LEU 114   4.452 -11.333  16.467
  861   HD21  LEU 114          HD21      LEU 114   5.697 -11.106  18.659
  862   HD22  LEU 114          HD22      LEU 114   5.333  -9.746  19.737
  863   HD23  LEU 114          HD23      LEU 114   4.108 -10.981  19.440
  864    H    VAL 115           H        VAL 115   7.921  -6.823  16.214
  865    HA   VAL 115           HA       VAL 115  10.152  -8.340  17.241
  866    HB   VAL 115           HB       VAL 115   9.755  -7.444  14.863
  867   HG11  VAL 115          HG11      VAL 115  10.602  -5.342  14.249
  868   HG12  VAL 115          HG12      VAL 115   9.615  -5.024  15.688
  869   HG13  VAL 115          HG13      VAL 115  11.377  -5.095  15.840
  870   HG21  VAL 115          HG21      VAL 115  11.763  -8.695  15.559
  871   HG22  VAL 115          HG22      VAL 115  12.123  -7.463  14.343
  872   HG23  VAL 115          HG23      VAL 115  12.547  -7.184  16.048
  873    H    GLU 116           H        GLU 116   8.775  -5.413  18.323
  874    HA   GLU 116           HA       GLU 116  11.128  -4.412  19.780
  875    HB2  GLU 116           HB2      GLU 116   9.338  -2.918  19.006
  876    HB3  GLU 116           HB3      GLU 116   8.155  -3.775  19.977
  877    HG2  GLU 116           HG2      GLU 116  10.585  -2.383  21.162
  878    HG3  GLU 116           HG3      GLU 116   9.053  -1.561  20.869
  879    H    GLU 117           H        GLU 117   8.447  -6.730  20.332
  880    HA   GLU 117           HA       GLU 117   8.901  -6.926  23.226
  881    HB2  GLU 117           HB2      GLU 117   7.258  -8.558  21.258
  882    HB3  GLU 117           HB3      GLU 117   7.280  -8.822  22.988
  883    HG2  GLU 117           HG2      GLU 117   6.556  -6.060  21.961
  884    HG3  GLU 117           HG3      GLU 117   5.424  -7.382  21.792
  885    H    ALA 118           H        ALA 118  10.508  -8.087  20.456
  886    HA   ALA 118           HA       ALA 118  11.409 -10.636  21.613
  887    HB1  ALA 118           HB1      ALA 118  11.195 -10.323  19.170
  888    HB2  ALA 118           HB2      ALA 118  12.459  -9.080  19.219
  889    HB3  ALA 118           HB3      ALA 118  12.834 -10.760  19.665
  890    H    GLN 119           H        GLN 119  13.255  -7.631  20.797
  891    HA   GLN 119           HA       GLN 119  15.273  -7.844  22.548
  892    HB2  GLN 119           HB2      GLN 119  13.807  -5.397  21.532
  893    HB3  GLN 119           HB3      GLN 119  15.183  -5.237  22.585
  894    HG2  GLN 119           HG2      GLN 119  16.481  -5.268  20.780
  895    HG3  GLN 119           HG3      GLN 119  16.191  -7.016  20.719
  896   HE21  GLN 119          HE22      GLN 119  14.584  -7.838  19.305
  897   HE22  GLN 119          HE21      GLN 119  13.550  -6.720  18.436
  Start of MODEL    6
    1    H    SER   1           H        SER   1  19.041  -6.074  13.020
    2    HA   SER   1           HA       SER   1  17.459  -3.944  14.287
    3    HB2  SER   1           HB2      SER   1  20.460  -4.236  13.919
    4    HB3  SER   1           HB3      SER   1  19.659  -2.937  14.819
    5    HG   SER   1           HG       SER   1  20.098  -5.565  15.525
    6    H    GLU   2           H        GLU   2  18.379  -4.482  11.080
    7    HA   GLU   2           HA       GLU   2  18.297  -1.586  10.312
    8    HB2  GLU   2           HB2      GLU   2  19.108  -4.106   8.831
    9    HB3  GLU   2           HB3      GLU   2  18.872  -2.563   8.038
   10    HG2  GLU   2           HG2      GLU   2  20.677  -1.542   9.252
   11    HG3  GLU   2           HG3      GLU   2  20.798  -2.909  10.360
   12    H    ALA   3           H        ALA   3  16.684  -4.734   9.793
   13    HA   ALA   3           HA       ALA   3  14.524  -3.773   8.173
   14    HB1  ALA   3           HB1      ALA   3  14.681  -6.144  10.088
   15    HB2  ALA   3           HB2      ALA   3  13.456  -5.905   8.825
   16    HB3  ALA   3           HB3      ALA   3  15.155  -6.148   8.375
   17    H    LEU   4           H        LEU   4  14.914  -4.051  11.684
   18    HA   LEU   4           HA       LEU   4  12.370  -3.198  12.560
   19    HB2  LEU   4           HB2      LEU   4  14.215  -4.043  14.032
   20    HB3  LEU   4           HB3      LEU   4  15.089  -2.540  13.776
   21    HG   LEU   4           HG       LEU   4  13.134  -1.305  14.853
   22   HD11  LEU   4          HD11      LEU   4  12.405  -4.128  15.700
   23   HD12  LEU   4          HD12      LEU   4  11.626  -2.623  16.240
   24   HD13  LEU   4          HD13      LEU   4  11.468  -3.144  14.555
   25   HD21  LEU   4          HD21      LEU   4  15.189  -1.781  16.093
   26   HD22  LEU   4          HD22      LEU   4  13.761  -1.926  17.134
   27   HD23  LEU   4          HD23      LEU   4  14.571  -3.392  16.527
   28    H    ALA   5           H        ALA   5  14.992  -1.184  11.240
   29    HA   ALA   5           HA       ALA   5  13.566   1.335  11.754
   30    HB1  ALA   5           HB1      ALA   5  15.395   2.338  10.484
   31    HB2  ALA   5           HB2      ALA   5  16.028   1.265  11.744
   32    HB3  ALA   5           HB3      ALA   5  16.023   0.738  10.051
   33    H    LYS   6           H        LYS   6  14.257  -0.815   8.984
   34    HA   LYS   6           HA       LYS   6  13.111   0.814   6.996
   35    HB2  LYS   6           HB2      LYS   6  14.667  -1.122   6.627
   36    HB3  LYS   6           HB3      LYS   6  13.298  -2.224   6.852
   37    HG2  LYS   6           HG2      LYS   6  12.156  -1.262   4.905
   38    HG3  LYS   6           HG3      LYS   6  13.381   0.008   4.767
   39    HD2  LYS   6           HD2      LYS   6  15.083  -1.760   4.269
   40    HD3  LYS   6           HD3      LYS   6  13.789  -2.975   4.260
   41    HE2  LYS   6           HE2      LYS   6  12.654  -1.712   2.404
   42    HE3  LYS   6           HE3      LYS   6  13.922  -0.492   2.488
   43    HZ1  LYS   6           HZ1      LYS   6  14.562  -1.856   0.736
   44    HZ2  LYS   6           HZ2      LYS   6  15.506  -2.393   1.966
   45    HZ3  LYS   6           HZ3      LYS   6  14.174  -3.251   1.465
   46    H    LEU   7           H        LEU   7  11.360  -1.539   9.050
   47    HA   LEU   7           HA       LEU   7   8.904  -1.443   7.584
   48    HB2  LEU   7           HB2      LEU   7   9.663  -2.064  10.433
   49    HB3  LEU   7           HB3      LEU   7   7.973  -1.783  10.067
   50    HG   LEU   7           HG       LEU   7   8.342  -4.111  10.085
   51   HD11  LEU   7          HD11      LEU   7   7.440  -4.796   7.989
   52   HD12  LEU   7          HD12      LEU   7   6.821  -3.169   8.323
   53   HD13  LEU   7          HD13      LEU   7   8.122  -3.406   7.135
   54   HD21  LEU   7          HD21      LEU   7  10.692  -4.316   9.629
   55   HD22  LEU   7          HD22      LEU   7   9.791  -5.289   8.462
   56   HD23  LEU   7          HD23      LEU   7  10.474  -3.726   7.963
   57    H    ILE   8           H        ILE   8  10.135   0.895   9.976
   58    HA   ILE   8           HA       ILE   8   7.759   2.595   9.717
   59    HB   ILE   8           HB       ILE   8  10.475   3.117  10.939
   60   HG12  ILE   8          HG12      ILE   8   9.203   1.478  12.179
   61   HG13  ILE   8          HG13      ILE   8   9.264   2.985  13.077
   62   HG21  ILE   8          HG21      ILE   8   8.012   4.912  10.869
   63   HG22  ILE   8          HG22      ILE   8   9.379   5.122  11.983
   64   HG23  ILE   8          HG23      ILE   8   9.632   5.272  10.245
   65   HD11  ILE   8          HD11      ILE   8   7.055   2.030  13.304
   66   HD12  ILE   8          HD12      ILE   8   6.895   3.467  12.290
   67   HD13  ILE   8          HD13      ILE   8   6.871   1.846  11.556
   68    H    SER   9           H        SER   9  10.968   2.446   8.144
   69    HA   SER   9           HA       SER   9  10.725   4.943   6.749
   70    HB2  SER   9           HB2      SER   9  12.334   2.545   5.828
   71    HB3  SER   9           HB3      SER   9  12.648   4.259   5.523
   72    HG   SER   9           HG       SER   9  12.965   4.484   7.822
   73    H    LEU  10           H        LEU  10   9.604   1.681   5.959
   74    HA   LEU  10           HA       LEU  10   9.120   1.954   3.177
   75    HB2  LEU  10           HB2      LEU  10   8.207   0.200   5.465
   76    HB3  LEU  10           HB3      LEU  10   7.291   0.100   3.981
   77    HG   LEU  10           HG       LEU  10  10.308  -0.179   3.876
   78   HD11  LEU  10          HD11      LEU  10   8.271  -2.371   4.468
   79   HD12  LEU  10          HD12      LEU  10   9.961  -2.645   3.989
   80   HD13  LEU  10          HD13      LEU  10   9.600  -1.843   5.520
   81   HD21  LEU  10          HD21      LEU  10   9.017   0.066   1.757
   82   HD22  LEU  10          HD22      LEU  10   9.762  -1.530   1.890
   83   HD23  LEU  10          HD23      LEU  10   8.024  -1.340   2.219
   84    H    GLN  11           H        GLN  11   7.430   3.513   5.743
   85    HA   GLN  11           HA       GLN  11   4.790   3.370   4.488
   86    HB2  GLN  11           HB2      GLN  11   5.861   4.337   7.114
   87    HB3  GLN  11           HB3      GLN  11   4.215   4.717   6.622
   88    HG2  GLN  11           HG2      GLN  11   3.730   2.331   6.218
   89    HG3  GLN  11           HG3      GLN  11   5.392   1.918   6.690
   90   HE21  GLN  11          HE22      GLN  11   5.882   1.664   8.843
   91   HE22  GLN  11          HE21      GLN  11   4.717   2.109  10.105
   92    H    ALA  12           H        ALA  12   3.542   5.074   3.811
   93    HA   ALA  12           HA       ALA  12   5.074   7.375   2.661
   94    HB1  ALA  12           HB1      ALA  12   2.574   5.942   1.692
   95    HB2  ALA  12           HB2      ALA  12   3.373   7.298   0.873
   96    HB3  ALA  12           HB3      ALA  12   4.222   5.750   1.046
   97    H    THR  13           H        THR  13   4.121   9.415   2.445
   98    HA   THR  13           HA       THR  13   2.445  10.174   4.764
   99    HB   THR  13           HB       THR  13   4.092  11.913   2.895
  100    HG1  THR  13           HG1      THR  13   5.513  10.630   3.777
  101   HG21  THR  13          HG21      THR  13   3.156  12.429   5.738
  102   HG22  THR  13          HG22      THR  13   4.226  13.466   4.777
  103   HG23  THR  13          HG23      THR  13   2.548  13.242   4.279
  104    H    GLU  14           H        GLU  14   2.225  10.266   1.200
  105    HA   GLU  14           HA       GLU  14  -0.356  11.728   1.396
  106    HB2  GLU  14           HB2      GLU  14   0.301  12.953  -0.596
  107    HB3  GLU  14           HB3      GLU  14   1.346  13.287   0.768
  108    HG2  GLU  14           HG2      GLU  14   2.092  11.338  -1.449
  109    HG3  GLU  14           HG3      GLU  14   2.434  13.058  -1.522
  110    H    ALA  15           H        ALA  15  -1.893  11.420  -0.278
  111    HA   ALA  15           HA       ALA  15  -1.560   9.103  -2.090
  112    HB1  ALA  15           HB1      ALA  15  -3.783   9.326  -0.009
  113    HB2  ALA  15           HB2      ALA  15  -3.590   8.029  -1.212
  114    HB3  ALA  15           HB3      ALA  15  -2.396   8.220   0.086
  115    H    THR  16           H        THR  16  -3.466   8.838  -3.485
  116    HA   THR  16           HA       THR  16  -5.023  11.358  -4.037
  117    HB   THR  16           HB       THR  16  -4.135   9.297  -6.069
  118    HG1  THR  16           HG1      THR  16  -2.528  10.761  -5.460
  119   HG21  THR  16          HG21      THR  16  -6.329  10.208  -6.731
  120   HG22  THR  16          HG22      THR  16  -5.766  11.861  -6.391
  121   HG23  THR  16          HG23      THR  16  -5.057  10.920  -7.726
  122    H    ILE  17           H        ILE  17  -7.042  11.142  -3.214
  123    HA   ILE  17           HA       ILE  17  -8.461   8.518  -3.235
  124    HB   ILE  17           HB       ILE  17  -9.365  11.220  -2.158
  125   HG12  ILE  17          HG12      ILE  17  -8.348   8.772  -0.671
  126   HG13  ILE  17          HG13      ILE  17  -7.502  10.300  -0.851
  127   HG21  ILE  17          HG21      ILE  17 -11.301   9.841  -2.830
  128   HG22  ILE  17          HG22      ILE  17 -10.659   8.460  -1.910
  129   HG23  ILE  17          HG23      ILE  17 -11.223   9.938  -1.098
  130   HD11  ILE  17          HD11      ILE  17 -10.036   9.784   0.755
  131   HD12  ILE  17          HD12      ILE  17  -8.443  10.228   1.356
  132   HD13  ILE  17          HD13      ILE  17  -9.388  11.412   0.426
  133    H    VAL  18           H        VAL  18 -10.172   8.065  -4.619
  134    HA   VAL  18           HA       VAL  18 -10.806  10.107  -6.720
  135    HB   VAL  18           HB       VAL  18 -11.362   7.135  -6.719
  136   HG11  VAL  18          HG11      VAL  18 -11.697   9.245  -8.899
  137   HG12  VAL  18          HG12      VAL  18 -11.880   7.495  -9.121
  138   HG13  VAL  18          HG13      VAL  18 -13.007   8.362  -8.081
  139   HG21  VAL  18          HG21      VAL  18  -8.993   7.424  -6.927
  140   HG22  VAL  18          HG22      VAL  18  -9.630   7.147  -8.555
  141   HG23  VAL  18          HG23      VAL  18  -9.191   8.783  -8.054
  142    H    THR  19           H        THR  19 -12.643  11.235  -6.552
  143    HA   THR  19           HA       THR  19 -15.018   9.991  -5.244
  144    HB   THR  19           HB       THR  19 -14.004  12.827  -4.896
  145    HG1  THR  19           HG1      THR  19 -13.863  12.157  -2.774
  146   HG21  THR  19          HG21      THR  19 -15.955  13.045  -3.328
  147   HG22  THR  19          HG22      THR  19 -16.453  12.925  -5.015
  148   HG23  THR  19          HG23      THR  19 -16.585  11.503  -3.954
  149    H    LEU  20           H        LEU  20 -16.969  10.359  -6.164
  150    HA   LEU  20           HA       LEU  20 -16.879  11.419  -8.959
  151    HB2  LEU  20           HB2      LEU  20 -18.773   9.329  -7.863
  152    HB3  LEU  20           HB3      LEU  20 -18.512   9.792  -9.543
  153    HG   LEU  20           HG       LEU  20 -16.468   8.396  -7.747
  154   HD11  LEU  20          HD11      LEU  20 -17.868   7.253 -10.172
  155   HD12  LEU  20          HD12      LEU  20 -16.870   6.427  -8.977
  156   HD13  LEU  20          HD13      LEU  20 -18.463   7.022  -8.502
  157   HD21  LEU  20          HD21      LEU  20 -15.309   9.752  -9.438
  158   HD22  LEU  20          HD22      LEU  20 -15.199   8.040  -9.858
  159   HD23  LEU  20          HD23      LEU  20 -16.352   9.089 -10.715
  160    H    ASP  21           H        ASP  21 -18.072  13.149  -9.509
  161    HA   ASP  21           HA       ASP  21 -19.758  14.288  -7.347
  162    HB2  ASP  21           HB2      ASP  21 -17.534  15.289  -8.342
  163    HB3  ASP  21           HB3      ASP  21 -18.588  15.901  -9.588
  164    H    SER  22           H        SER  22 -20.655  12.728  -9.946
  165    HA   SER  22           HA       SER  22 -23.159  14.302 -10.292
  166    HB2  SER  22           HB2      SER  22 -21.501  13.448 -12.651
  167    HB3  SER  22           HB3      SER  22 -23.251  13.562 -12.772
  168    HG   SER  22           HG       SER  22 -22.035  15.466 -13.360
  169    H    ASP  23           H        ASP  23 -22.451  11.536 -12.279
  170    HA   ASP  23           HA       ASP  23 -23.942   9.634 -10.555
  171    HB2  ASP  23           HB2      ASP  23 -25.591  10.736 -12.022
  172    HB3  ASP  23           HB3      ASP  23 -24.603  10.381 -13.443
  173    H    ASN  24           H        ASN  24 -21.459   9.325 -10.449
  174    HA   ASN  24           HA       ASN  24 -19.528   8.453 -10.906
  175    HB2  ASN  24           HB2      ASN  24 -19.409   6.106 -11.471
  176    HB3  ASN  24           HB3      ASN  24 -20.717   6.452 -10.363
  177   HD21  ASN  24          HD22      ASN  24 -22.786   5.847 -10.981
  178   HD22  ASN  24          HD21      ASN  24 -23.042   4.940 -12.462
  179    H    ILE  25           H        ILE  25 -21.114   9.373 -13.703
  180    HA   ILE  25           HA       ILE  25 -18.975   9.065 -15.588
  181    HB   ILE  25           HB       ILE  25 -20.233  10.701 -16.951
  182   HG12  ILE  25          HG12      ILE  25 -22.149  10.911 -14.580
  183   HG13  ILE  25          HG13      ILE  25 -21.020  12.175 -15.071
  184   HG21  ILE  25          HG21      ILE  25 -22.145   9.288 -17.315
  185   HG22  ILE  25          HG22      ILE  25 -20.775   8.266 -16.863
  186   HG23  ILE  25          HG23      ILE  25 -22.044   8.625 -15.673
  187   HD11  ILE  25          HD11      ILE  25 -22.158  12.316 -17.286
  188   HD12  ILE  25          HD12      ILE  25 -23.370  11.148 -16.702
  189   HD13  ILE  25          HD13      ILE  25 -23.204  12.722 -15.910
  190    H    LEU  26           H        LEU  26 -19.086  11.209 -12.975
  191    HA   LEU  26           HA       LEU  26 -17.242  13.173 -14.277
  192    HB2  LEU  26           HB2      LEU  26 -19.365  14.217 -13.818
  193    HB3  LEU  26           HB3      LEU  26 -19.381  13.572 -12.170
  194    HG   LEU  26           HG       LEU  26 -17.583  15.010 -11.476
  195   HD11  LEU  26          HD11      LEU  26 -17.480  16.022 -14.336
  196   HD12  LEU  26          HD12      LEU  26 -16.648  16.750 -12.938
  197   HD13  LEU  26          HD13      LEU  26 -16.190  15.136 -13.478
  198   HD21  LEU  26          HD21      LEU  26 -19.587  16.609 -13.127
  199   HD22  LEU  26          HD22      LEU  26 -19.886  15.947 -11.506
  200   HD23  LEU  26          HD23      LEU  26 -18.649  17.190 -11.726
  201    H    LEU  27           H        LEU  27 -15.364  12.628 -13.719
  202    HA   LEU  27           HA       LEU  27 -14.719  11.461 -11.043
  203    HB2  LEU  27           HB2      LEU  27 -13.156  11.615 -13.625
  204    HB3  LEU  27           HB3      LEU  27 -12.401  11.201 -12.094
  205    HG   LEU  27           HG       LEU  27 -13.810   9.247 -11.809
  206   HD11  LEU  27          HD11      LEU  27 -15.043   9.978 -14.495
  207   HD12  LEU  27          HD12      LEU  27 -15.188   8.383 -13.727
  208   HD13  LEU  27          HD13      LEU  27 -15.893   9.792 -12.944
  209   HD21  LEU  27          HD21      LEU  27 -11.688   9.099 -13.074
  210   HD22  LEU  27          HD22      LEU  27 -12.876   7.893 -13.606
  211   HD23  LEU  27          HD23      LEU  27 -12.583   9.347 -14.588
  212    H    SER  28           H        SER  28 -13.849  12.509  -9.430
  213    HA   SER  28           HA       SER  28 -12.453  15.112  -9.796
  214    HB2  SER  28           HB2      SER  28 -14.892  15.463  -9.456
  215    HB3  SER  28           HB3      SER  28 -14.816  14.590  -7.928
  216    HG   SER  28           HG       SER  28 -13.778  16.231  -7.027
  217    H    GLU  29           H        GLU  29 -10.506  13.941  -9.322
  218    HA   GLU  29           HA       GLU  29 -10.353  12.415  -6.829
  219    HB2  GLU  29           HB2      GLU  29  -7.996  13.085  -8.603
  220    HB3  GLU  29           HB3      GLU  29  -8.184  11.807  -7.414
  221    HG2  GLU  29           HG2      GLU  29  -8.410  10.596  -9.305
  222    HG3  GLU  29           HG3      GLU  29 -10.099  10.904  -8.908
  223    H    GLU  30           H        GLU  30  -8.889  12.793  -5.121
  224    HA   GLU  30           HA       GLU  30  -8.222  15.679  -4.556
  225    HB2  GLU  30           HB2      GLU  30  -9.029  13.479  -2.604
  226    HB3  GLU  30           HB3      GLU  30  -8.617  15.133  -2.190
  227    HG2  GLU  30           HG2      GLU  30 -11.051  14.258  -3.801
  228    HG3  GLU  30           HG3      GLU  30 -11.033  14.664  -2.088
  229    H    GLN  31           H        GLN  31  -6.083  16.107  -3.956
  230    HA   GLN  31           HA       GLN  31  -4.266  13.811  -3.432
  231    HB2  GLN  31           HB2      GLN  31  -3.793  16.767  -4.005
  232    HB3  GLN  31           HB3      GLN  31  -2.552  15.676  -3.371
  233    HG2  GLN  31           HG2      GLN  31  -2.956  14.168  -5.341
  234    HG3  GLN  31           HG3      GLN  31  -3.923  15.473  -6.082
  235   HE21  GLN  31          HE22      GLN  31  -0.919  14.275  -5.063
  236   HE22  GLN  31          HE21      GLN  31  -0.244  15.778  -4.832
  237    H    VAL  32           H        VAL  32  -3.971  13.255  -1.368
  238    HA   VAL  32           HA       VAL  32  -4.643  15.202   0.813
  239    HB   VAL  32           HB       VAL  32  -5.855  13.456   1.973
  240   HG11  VAL  32          HG11      VAL  32  -6.970  13.659  -0.842
  241   HG12  VAL  32          HG12      VAL  32  -7.863  13.340   0.654
  242   HG13  VAL  32          HG13      VAL  32  -7.107  14.923   0.404
  243   HG21  VAL  32          HG21      VAL  32  -4.709  11.437   1.115
  244   HG22  VAL  32          HG22      VAL  32  -6.453  11.327   0.980
  245   HG23  VAL  32          HG23      VAL  32  -5.481  11.679  -0.470
  246    H    ASP  33           H        ASP  33  -3.894  14.714   2.865
  247    HA   ASP  33           HA       ASP  33  -1.354  13.225   3.047
  248    HB2  ASP  33           HB2      ASP  33  -1.775  15.343   4.323
  249    HB3  ASP  33           HB3      ASP  33  -3.022  14.510   5.248
  250    H    VAL  34           H        VAL  34  -1.118  11.252   3.967
  251    HA   VAL  34           HA       VAL  34  -3.131   9.318   3.813
  252    HB   VAL  34           HB       VAL  34  -0.642   8.978   3.842
  253   HG11  VAL  34          HG11      VAL  34   0.495   8.513   5.940
  254   HG12  VAL  34          HG12      VAL  34  -0.137  10.163   5.974
  255   HG13  VAL  34          HG13      VAL  34  -0.961   8.870   6.875
  256   HG21  VAL  34          HG21      VAL  34  -2.175   7.040   5.607
  257   HG22  VAL  34          HG22      VAL  34  -2.243   7.086   3.833
  258   HG23  VAL  34          HG23      VAL  34  -0.716   6.716   4.654
  259    H    GLU  35           H        GLU  35  -2.669  11.495   6.494
  260    HA   GLU  35           HA       GLU  35  -4.081   9.943   8.490
  261    HB2  GLU  35           HB2      GLU  35  -2.473  11.929   8.700
  262    HB3  GLU  35           HB3      GLU  35  -3.851  12.965   8.319
  263    HG2  GLU  35           HG2      GLU  35  -5.022  12.123  10.325
  264    HG3  GLU  35           HG3      GLU  35  -3.702  10.984  10.641
  265    H    LEU  36           H        LEU  36  -5.215  11.765   5.728
  266    HA   LEU  36           HA       LEU  36  -7.829  12.385   6.908
  267    HB2  LEU  36           HB2      LEU  36  -6.770  12.867   4.104
  268    HB3  LEU  36           HB3      LEU  36  -8.203  13.597   4.822
  269    HG   LEU  36           HG       LEU  36  -5.318  14.090   5.680
  270   HD11  LEU  36          HD11      LEU  36  -7.366  15.917   4.353
  271   HD12  LEU  36          HD12      LEU  36  -5.709  16.352   4.827
  272   HD13  LEU  36          HD13      LEU  36  -5.973  15.163   3.546
  273   HD21  LEU  36          HD21      LEU  36  -6.764  14.262   7.652
  274   HD22  LEU  36          HD22      LEU  36  -6.266  15.868   7.120
  275   HD23  LEU  36          HD23      LEU  36  -7.906  15.292   6.751
  276    H    VAL  37           H        VAL  37  -6.741   9.562   5.497
  277    HA   VAL  37           HA       VAL  37  -9.308   9.007   4.110
  278    HB   VAL  37           HB       VAL  37  -7.169   8.570   2.949
  279   HG11  VAL  37          HG11      VAL  37  -6.929   6.162   4.809
  280   HG12  VAL  37          HG12      VAL  37  -5.913   6.533   3.402
  281   HG13  VAL  37          HG13      VAL  37  -5.869   7.584   4.819
  282   HG21  VAL  37          HG21      VAL  37  -9.302   7.511   2.267
  283   HG22  VAL  37          HG22      VAL  37  -7.876   6.520   1.914
  284   HG23  VAL  37          HG23      VAL  37  -8.913   6.105   3.283
  285    H    GLN  38           H        GLN  38 -10.676   7.435   4.583
  286    HA   GLN  38           HA       GLN  38 -10.373   5.765   7.036
  287    HB2  GLN  38           HB2      GLN  38 -12.830   7.230   5.958
  288    HB3  GLN  38           HB3      GLN  38 -12.916   5.926   7.151
  289    HG2  GLN  38           HG2      GLN  38 -11.632   7.172   8.754
  290    HG3  GLN  38           HG3      GLN  38 -11.220   8.409   7.568
  291   HE21  GLN  38          HE22      GLN  38 -14.500   7.062   8.374
  292   HE22  GLN  38          HE21      GLN  38 -15.091   8.699   8.573
  293    H    ARG  39           H        ARG  39 -11.774   3.772   6.862
  294    HA   ARG  39           HA       ARG  39 -11.226   2.481   4.253
  295    HB2  ARG  39           HB2      ARG  39 -11.860   0.410   5.245
  296    HB3  ARG  39           HB3      ARG  39 -10.835   1.283   6.384
  297    HG2  ARG  39           HG2      ARG  39 -13.193   2.104   7.325
  298    HG3  ARG  39           HG3      ARG  39 -13.794   0.655   6.526
  299    HD2  ARG  39           HD2      ARG  39 -12.278  -0.743   7.871
  300    HD3  ARG  39           HD3      ARG  39 -11.494   0.701   8.522
  301    HE   ARG  39           HE       ARG  39 -13.264   1.132   9.940
  302   HH11  ARG  39          HH11      ARG  39 -14.053  -1.838   8.199
  303   HH12  ARG  39          HH12      ARG  39 -15.506  -2.057   9.143
  304   HH21  ARG  39          HH21      ARG  39 -15.144   0.766  11.030
  305   HH22  ARG  39          HH22      ARG  39 -16.160  -0.576  10.585
  306    H    GLY  40           H        GLY  40 -12.813   1.734   2.680
  307    HA2  GLY  40           HA2      GLY  40 -15.076   1.429   1.986
  308    HA3  GLY  40           HA3      GLY  40 -15.606   2.699   3.085
  309    H    ASP  41           H        ASP  41 -12.696   2.923   1.013
  310    HA   ASP  41           HA       ASP  41 -13.963   4.707  -0.942
  311    HB2  ASP  41           HB2      ASP  41 -11.900   5.631   1.094
  312    HB3  ASP  41           HB3      ASP  41 -12.079   6.411  -0.478
  313    H    ILE  42           H        ILE  42 -12.325   5.393  -2.635
  314    HA   ILE  42           HA       ILE  42 -10.462   3.124  -3.196
  315    HB   ILE  42           HB       ILE  42 -12.451   4.408  -5.087
  316   HG12  ILE  42          HG12      ILE  42 -12.127   1.572  -4.003
  317   HG13  ILE  42          HG13      ILE  42 -13.392   2.702  -3.547
  318   HG21  ILE  42          HG21      ILE  42 -11.558   2.906  -6.828
  319   HG22  ILE  42          HG22      ILE  42 -10.302   3.985  -6.269
  320   HG23  ILE  42          HG23      ILE  42 -10.321   2.300  -5.699
  321   HD11  ILE  42          HD11      ILE  42 -14.329   1.096  -5.032
  322   HD12  ILE  42          HD12      ILE  42 -14.236   2.638  -5.916
  323   HD13  ILE  42          HD13      ILE  42 -13.061   1.334  -6.236
  324    H    ILE  43           H        ILE  43  -8.455   3.583  -3.696
  325    HA   ILE  43           HA       ILE  43  -7.609   6.355  -4.176
  326    HB   ILE  43           HB       ILE  43  -6.049   3.934  -3.206
  327   HG12  ILE  43          HG12      ILE  43  -7.859   4.084  -1.641
  328   HG13  ILE  43          HG13      ILE  43  -6.363   4.597  -0.894
  329   HG21  ILE  43          HG21      ILE  43  -4.676   5.862  -3.916
  330   HG22  ILE  43          HG22      ILE  43  -5.522   6.893  -2.750
  331   HG23  ILE  43          HG23      ILE  43  -4.527   5.540  -2.186
  332   HD11  ILE  43          HD11      ILE  43  -7.034   6.926  -0.966
  333   HD12  ILE  43          HD12      ILE  43  -8.484   6.533  -1.923
  334   HD13  ILE  43          HD13      ILE  43  -8.350   5.967  -0.259
  335    H    LYS  44           H        LYS  44  -6.690   6.862  -6.147
  336    HA   LYS  44           HA       LYS  44  -5.771   4.774  -7.983
  337    HB2  LYS  44           HB2      LYS  44  -6.930   6.801  -8.763
  338    HB3  LYS  44           HB3      LYS  44  -5.497   7.754  -8.343
  339    HG2  LYS  44           HG2      LYS  44  -4.116   6.509  -9.888
  340    HG3  LYS  44           HG3      LYS  44  -5.354   5.281 -10.143
  341    HD2  LYS  44           HD2      LYS  44  -5.723   8.165 -10.965
  342    HD3  LYS  44           HD3      LYS  44  -4.984   6.919 -11.999
  343    HE2  LYS  44           HE2      LYS  44  -7.074   5.538 -11.746
  344    HE3  LYS  44           HE3      LYS  44  -7.813   6.904 -10.888
  345    HZ1  LYS  44           HZ1      LYS  44  -8.438   6.983 -13.168
  346    HZ2  LYS  44           HZ2      LYS  44  -7.459   8.251 -12.899
  347    HZ3  LYS  44           HZ3      LYS  44  -6.895   6.924 -13.721
  348    H    VAL  45           H        VAL  45  -3.839   3.869  -8.172
  349    HA   VAL  45           HA       VAL  45  -1.440   5.331  -7.173
  350    HB   VAL  45           HB       VAL  45  -2.073   3.024  -6.245
  351   HG11  VAL  45          HG11      VAL  45  -0.810   2.038  -8.841
  352   HG12  VAL  45          HG12      VAL  45  -1.308   1.070  -7.452
  353   HG13  VAL  45          HG13      VAL  45  -2.531   1.917  -8.427
  354   HG21  VAL  45          HG21      VAL  45   0.146   4.095  -5.917
  355   HG22  VAL  45          HG22      VAL  45   0.284   2.342  -6.081
  356   HG23  VAL  45          HG23      VAL  45   0.718   3.392  -7.446
  357    H    VAL  46           H        VAL  46   0.097   5.957  -8.580
  358    HA   VAL  46           HA       VAL  46  -0.271   5.566 -11.460
  359    HB   VAL  46           HB       VAL  46   1.612   7.185 -11.627
  360   HG11  VAL  46          HG11      VAL  46  -0.556   8.101  -9.698
  361   HG12  VAL  46          HG12      VAL  46   0.413   9.108 -10.789
  362   HG13  VAL  46          HG13      VAL  46  -0.741   7.948 -11.460
  363   HG21  VAL  46          HG21      VAL  46   2.884   6.610  -9.589
  364   HG22  VAL  46          HG22      VAL  46   2.491   8.325  -9.680
  365   HG23  VAL  46          HG23      VAL  46   1.577   7.283  -8.582
  366    HA   PRO  47           HA       PRO  47   3.079   2.554 -12.123
  367    HB2  PRO  47           HB2      PRO  47   4.533   3.704 -14.183
  368    HB3  PRO  47           HB3      PRO  47   3.012   2.806 -14.427
  369    HG2  PRO  47           HG2      PRO  47   3.380   5.808 -14.182
  370    HG3  PRO  47           HG3      PRO  47   2.436   4.903 -15.411
  371    HD2  PRO  47           HD2      PRO  47   1.184   5.988 -13.309
  372    HD3  PRO  47           HD3      PRO  47   0.758   4.344 -13.834
  373    H    GLY  48           H        GLY  48   5.023   2.402 -10.993
  374    HA2  GLY  48           HA2      GLY  48   6.971   3.081  -9.914
  375    HA3  GLY  48           HA3      GLY  48   6.759   4.705 -10.545
  376    H    GLY  49           H        GLY  49   3.815   4.304  -9.180
  377    HA2  GLY  49           HA2      GLY  49   4.418   5.839  -6.814
  378    HA3  GLY  49           HA3      GLY  49   2.854   5.183  -7.282
  379    H    LYS  50           H        LYS  50   3.189   5.179  -4.719
  380    HA   LYS  50           HA       LYS  50   4.011   2.419  -3.855
  381    HB2  LYS  50           HB2      LYS  50   3.988   5.002  -2.241
  382    HB3  LYS  50           HB3      LYS  50   4.459   3.402  -1.650
  383    HG2  LYS  50           HG2      LYS  50   6.346   3.359  -3.265
  384    HG3  LYS  50           HG3      LYS  50   5.893   4.972  -3.841
  385    HD2  LYS  50           HD2      LYS  50   6.222   5.870  -1.539
  386    HD3  LYS  50           HD3      LYS  50   6.786   4.269  -1.014
  387    HE2  LYS  50           HE2      LYS  50   8.606   4.370  -2.712
  388    HE3  LYS  50           HE3      LYS  50   8.036   5.963  -3.226
  389    HZ1  LYS  50           HZ1      LYS  50   9.089   5.340  -0.508
  390    HZ2  LYS  50           HZ2      LYS  50   9.870   6.192  -1.643
  391    HZ3  LYS  50           HZ3      LYS  50   8.516   6.800  -0.980
  392    H    PHE  51           H        PHE  51   2.709   1.339  -2.356
  393    HA   PHE  51           HA       PHE  51  -0.141   2.174  -2.301
  394    HB2  PHE  51           HB2      PHE  51   1.192  -0.383  -1.380
  395    HB3  PHE  51           HB3      PHE  51  -0.533  -0.056  -1.327
  396    HD1  PHE  51           HD1      PHE  51   2.339  -0.774  -3.528
  397    HD2  PHE  51           HD2      PHE  51  -1.901  -0.086  -3.397
  398    HE1  PHE  51           HE1      PHE  51   2.170  -1.506  -5.873
  399    HE2  PHE  51           HE2      PHE  51  -2.081  -0.929  -5.737
  400    HZ   PHE  51           HZ       PHE  51  -0.050  -1.594  -6.991
  401    HA   PRO  52           HA       PRO  52   1.006   3.826   1.749
  402    HB2  PRO  52           HB2      PRO  52  -0.962   5.636   2.143
  403    HB3  PRO  52           HB3      PRO  52   0.229   5.815   0.819
  404    HG2  PRO  52           HG2      PRO  52  -2.575   4.666   0.649
  405    HG3  PRO  52           HG3      PRO  52  -1.822   5.905  -0.402
  406    HD2  PRO  52           HD2      PRO  52  -1.896   3.237  -1.064
  407    HD3  PRO  52           HD3      PRO  52  -0.562   4.324  -1.547
  408    H    VAL  53           H        VAL  53  -1.609   1.754   1.279
  409    HA   VAL  53           HA       VAL  53  -2.024   1.112   4.060
  410    HB   VAL  53           HB       VAL  53  -4.519   1.148   3.896
  411   HG11  VAL  53          HG11      VAL  53  -3.264   3.913   3.846
  412   HG12  VAL  53          HG12      VAL  53  -4.796   3.432   4.600
  413   HG13  VAL  53          HG13      VAL  53  -3.265   2.810   5.237
  414   HG21  VAL  53          HG21      VAL  53  -4.694   1.474   1.428
  415   HG22  VAL  53          HG22      VAL  53  -5.626   2.658   2.364
  416   HG23  VAL  53          HG23      VAL  53  -4.079   3.133   1.636
  417    H    ASP  54           H        ASP  54  -3.733  -0.885   4.025
  418    HA   ASP  54           HA       ASP  54  -2.938  -2.564   1.698
  419    HB2  ASP  54           HB2      ASP  54  -2.638  -4.361   2.949
  420    HB3  ASP  54           HB3      ASP  54  -2.136  -3.150   4.112
  421    H    GLY  55           H        GLY  55  -4.430  -3.773   0.534
  422    HA2  GLY  55           HA2      GLY  55  -7.228  -3.915   1.106
  423    HA3  GLY  55           HA3      GLY  55  -6.918  -2.441   0.193
  424    H    ARG  56           H        ARG  56  -8.291  -3.287  -1.381
  425    HA   ARG  56           HA       ARG  56  -7.242  -5.579  -3.019
  426    HB2  ARG  56           HB2      ARG  56  -9.571  -5.521  -1.606
  427    HB3  ARG  56           HB3      ARG  56 -10.161  -4.961  -3.168
  428    HG2  ARG  56           HG2      ARG  56  -9.246  -6.965  -4.266
  429    HG3  ARG  56           HG3      ARG  56  -8.460  -7.468  -2.768
  430    HD2  ARG  56           HD2      ARG  56 -11.454  -7.378  -3.288
  431    HD3  ARG  56           HD3      ARG  56 -10.406  -8.808  -3.148
  432    HE   ARG  56           HE       ARG  56 -10.300  -7.166  -0.757
  433   HH11  ARG  56          HH11      ARG  56 -12.431  -9.626  -2.200
  434   HH12  ARG  56          HH12      ARG  56 -12.756 -10.294  -0.625
  435   HH21  ARG  56          HH21      ARG  56 -11.017  -7.838   1.060
  436   HH22  ARG  56          HH22      ARG  56 -12.211  -9.133   1.185
  437    H    VAL  57           H        VAL  57  -6.940  -5.412  -5.143
  438    HA   VAL  57           HA       VAL  57  -7.143  -2.727  -6.413
  439    HB   VAL  57           HB       VAL  57  -5.793  -5.230  -7.495
  440   HG11  VAL  57          HG11      VAL  57  -5.479  -2.272  -8.186
  441   HG12  VAL  57          HG12      VAL  57  -4.548  -3.614  -8.893
  442   HG13  VAL  57          HG13      VAL  57  -6.276  -3.502  -9.191
  443   HG21  VAL  57          HG21      VAL  57  -4.663  -4.719  -5.416
  444   HG22  VAL  57          HG22      VAL  57  -3.642  -4.244  -6.776
  445   HG23  VAL  57          HG23      VAL  57  -4.525  -3.007  -5.860
  446    H    ILE  58           H        ILE  58  -8.746  -2.338  -7.896
  447    HA   ILE  58           HA       ILE  58 -10.082  -4.647  -9.263
  448    HB   ILE  58           HB       ILE  58 -12.323  -3.476  -8.624
  449   HG12  ILE  58          HG12      ILE  58 -10.673  -2.583  -6.236
  450   HG13  ILE  58          HG13      ILE  58 -11.048  -1.487  -7.583
  451   HG21  ILE  58          HG21      ILE  58 -11.616  -5.735  -7.891
  452   HG22  ILE  58          HG22      ILE  58 -10.829  -5.011  -6.469
  453   HG23  ILE  58          HG23      ILE  58 -12.583  -4.886  -6.690
  454   HD11  ILE  58          HD11      ILE  58 -13.086  -2.819  -5.758
  455   HD12  ILE  58          HD12      ILE  58 -12.646  -1.101  -5.831
  456   HD13  ILE  58          HD13      ILE  58 -13.472  -1.851  -7.206
  457    H    GLU  59           H        GLU  59  -8.299  -2.512 -10.179
  458    HA   GLU  59           HA       GLU  59  -9.457  -2.397 -12.749
  459    HB2  GLU  59           HB2      GLU  59 -10.359  -0.215 -11.304
  460    HB3  GLU  59           HB3      GLU  59  -8.883   0.439 -11.972
  461    HG2  GLU  59           HG2      GLU  59  -9.614  -0.088 -14.248
  462    HG3  GLU  59           HG3      GLU  59 -10.997  -0.997 -13.635
  463    H    GLY  60           H        GLY  60  -7.716  -2.556 -14.159
  464    HA2  GLY  60           HA2      GLY  60  -5.684  -1.916 -15.103
  465    HA3  GLY  60           HA3      GLY  60  -5.208  -1.094 -13.623
  466    H    HIS  61           H        HIS  61  -3.289  -2.356 -14.762
  467    HA   HIS  61           HA       HIS  61  -2.789  -4.861 -13.238
  468    HB2  HIS  61           HB2      HIS  61  -2.002  -6.048 -15.190
  469    HB3  HIS  61           HB3      HIS  61  -3.678  -5.565 -15.389
  470    HD1  HIS  61           HD1      HIS  61  -0.495  -5.522 -17.264
  471    HD2  HIS  61           HD2      HIS  61  -3.972  -3.165 -16.998
  472    HE1  HIS  61           HE1      HIS  61  -0.539  -4.081 -19.351
  473    H    SER  62           H        SER  62  -0.808  -5.029 -12.334
  474    HA   SER  62           HA       SER  62   1.551  -3.912 -13.582
  475    HB2  SER  62           HB2      SER  62   0.359  -2.608 -11.153
  476    HB3  SER  62           HB3      SER  62   2.108  -2.655 -11.282
  477    HG   SER  62           HG       SER  62   0.415  -1.827 -13.401
  478    H    MET  63           H        MET  63   3.582  -4.193 -12.261
  479    HA   MET  63           HA       MET  63   3.415  -6.649 -10.567
  480    HB2  MET  63           HB2      MET  63   4.716  -6.948 -12.597
  481    HB3  MET  63           HB3      MET  63   5.773  -5.595 -12.159
  482    HG2  MET  63           HG2      MET  63   6.649  -6.736 -10.294
  483    HG3  MET  63           HG3      MET  63   5.355  -7.936 -10.272
  484    HE1  MET  63           HE1      MET  63   5.038  -9.165 -13.048
  485    HE2  MET  63           HE2      MET  63   6.248 -10.462 -13.006
  486    HE3  MET  63           HE3      MET  63   5.276 -10.114 -11.560
  487    H    VAL  64           H        VAL  64   3.998  -6.545  -8.497
  488    HA   VAL  64           HA       VAL  64   4.802  -3.889  -7.423
  489    HB   VAL  64           HB       VAL  64   2.772  -5.882  -6.405
  490   HG11  VAL  64          HG11      VAL  64   3.808  -4.931  -4.446
  491   HG12  VAL  64          HG12      VAL  64   3.753  -3.289  -5.140
  492   HG13  VAL  64          HG13      VAL  64   2.257  -4.125  -4.690
  493   HG21  VAL  64          HG21      VAL  64   1.935  -4.532  -8.258
  494   HG22  VAL  64          HG22      VAL  64   1.251  -3.887  -6.760
  495   HG23  VAL  64          HG23      VAL  64   2.600  -3.057  -7.548
  496    H    ASP  65           H        ASP  65   6.315  -3.639  -5.944
  497    HA   ASP  65           HA       ASP  65   8.082  -5.902  -5.357
  498    HB2  ASP  65           HB2      ASP  65   8.869  -3.824  -6.415
  499    HB3  ASP  65           HB3      ASP  65   8.329  -2.892  -5.024
  500    H    GLU  66           H        GLU  66   7.309  -7.063  -3.695
  501    HA   GLU  66           HA       GLU  66   6.800  -5.760  -1.062
  502    HB2  GLU  66           HB2      GLU  66   4.965  -7.297  -0.684
  503    HB3  GLU  66           HB3      GLU  66   4.680  -6.260  -2.077
  504    HG2  GLU  66           HG2      GLU  66   5.172  -8.113  -3.613
  505    HG3  GLU  66           HG3      GLU  66   5.609  -9.158  -2.260
  506    H    SER  67           H        SER  67   8.974  -7.662  -2.382
  507    HA   SER  67           HA       SER  67   9.173  -9.939  -0.749
  508    HB2  SER  67           HB2      SER  67  11.597 -10.079  -1.339
  509    HB3  SER  67           HB3      SER  67  10.487  -9.929  -2.689
  510    HG   SER  67           HG       SER  67  12.428  -8.618  -2.754
  511    H    LEU  68           H        LEU  68   9.508  -6.860   0.604
  512    HA   LEU  68           HA       LEU  68  10.995  -7.926   2.950
  513    HB2  LEU  68           HB2      LEU  68  11.284  -5.604   1.822
  514    HB3  LEU  68           HB3      LEU  68   9.774  -5.168   2.584
  515    HG   LEU  68           HG       LEU  68  11.735  -4.315   3.730
  516   HD11  LEU  68          HD11      LEU  68  10.544  -6.383   5.589
  517   HD12  LEU  68          HD12      LEU  68  11.216  -4.799   5.976
  518   HD13  LEU  68          HD13      LEU  68   9.686  -4.909   5.083
  519   HD21  LEU  68          HD21      LEU  68  13.328  -6.134   3.199
  520   HD22  LEU  68          HD22      LEU  68  13.333  -5.687   4.913
  521   HD23  LEU  68          HD23      LEU  68  12.522  -7.174   4.393
  522    H    ILE  69           H        ILE  69   7.696  -7.061   1.926
  523    HA   ILE  69           HA       ILE  69   6.607  -7.075   4.636
  524    HB   ILE  69           HB       ILE  69   5.146  -6.994   1.971
  525   HG12  ILE  69          HG12      ILE  69   6.677  -5.063   2.105
  526   HG13  ILE  69          HG13      ILE  69   4.985  -4.620   2.125
  527   HG21  ILE  69          HG21      ILE  69   4.276  -6.451   4.840
  528   HG22  ILE  69          HG22      ILE  69   3.360  -5.899   3.433
  529   HG23  ILE  69          HG23      ILE  69   3.606  -7.628   3.695
  530   HD11  ILE  69          HD11      ILE  69   6.184  -3.229   3.673
  531   HD12  ILE  69          HD12      ILE  69   5.076  -4.268   4.575
  532   HD13  ILE  69          HD13      ILE  69   6.817  -4.647   4.550
  533    H    THR  70           H        THR  70   5.730  -9.049   1.728
  534    HA   THR  70           HA       THR  70   4.600 -11.162   3.393
  535    HB   THR  70           HB       THR  70   4.189 -12.189   1.069
  536    HG1  THR  70           HG1      THR  70   4.285 -10.362  -0.522
  537   HG21  THR  70          HG21      THR  70   3.117  -9.376   1.568
  538   HG22  THR  70          HG22      THR  70   2.363 -10.650   0.588
  539   HG23  THR  70          HG23      THR  70   2.499 -10.856   2.338
  540    H    GLY  71           H        GLY  71   7.669 -10.548   2.205
  541    HA2  GLY  71           HA2      GLY  71   9.678 -11.699   2.730
  542    HA3  GLY  71           HA3      GLY  71   8.732 -13.032   3.412
  543    H    GLU  72           H        GLU  72   8.126 -11.773   0.253
  544    HA   GLU  72           HA       GLU  72   8.680 -14.234  -1.242
  545    HB2  GLU  72           HB2      GLU  72   8.092 -11.360  -2.083
  546    HB3  GLU  72           HB3      GLU  72   8.222 -12.700  -3.209
  547    HG2  GLU  72           HG2      GLU  72   6.178 -12.626  -0.949
  548    HG3  GLU  72           HG3      GLU  72   5.878 -12.022  -2.577
  549    H    ALA  73           H        ALA  73  10.102 -13.610  -3.422
  550    HA   ALA  73           HA       ALA  73  12.685 -12.403  -2.548
  551    HB1  ALA  73           HB1      ALA  73  13.930 -14.206  -3.601
  552    HB2  ALA  73           HB2      ALA  73  12.908 -14.816  -2.288
  553    HB3  ALA  73           HB3      ALA  73  12.416 -15.063  -3.985
  554    H    MET  74           H        MET  74  10.190 -12.543  -4.923
  555    HA   MET  74           HA       MET  74  11.581 -10.464  -6.366
  556    HB2  MET  74           HB2      MET  74  11.080 -11.430  -8.600
  557    HB3  MET  74           HB3      MET  74  12.349 -12.256  -7.706
  558    HG2  MET  74           HG2      MET  74  10.790 -14.050  -7.091
  559    HG3  MET  74           HG3      MET  74   9.479 -13.233  -7.959
  560    HE1  MET  74           HE1      MET  74   9.223 -15.757  -8.996
  561    HE2  MET  74           HE2      MET  74  10.476 -16.529  -9.997
  562    HE3  MET  74           HE3      MET  74  10.739 -16.319  -8.253
  563    HA   PRO  75           HA       PRO  75   7.717  -8.443  -6.259
  564    HB2  PRO  75           HB2      PRO  75   8.216  -8.003  -9.220
  565    HB3  PRO  75           HB3      PRO  75   7.557  -6.829  -8.033
  566    HG2  PRO  75           HG2      PRO  75  10.159  -6.727  -8.640
  567    HG3  PRO  75           HG3      PRO  75   9.693  -6.705  -6.911
  568    HD2  PRO  75           HD2      PRO  75  10.711  -9.033  -8.553
  569    HD3  PRO  75           HD3      PRO  75  11.120  -8.539  -6.886
  570    H    VAL  76           H        VAL  76   5.510  -8.430  -6.820
  571    HA   VAL  76           HA       VAL  76   4.549 -11.031  -7.961
  572    HB   VAL  76           HB       VAL  76   3.380  -9.301  -5.751
  573   HG11  VAL  76          HG11      VAL  76   2.524 -12.027  -6.822
  574   HG12  VAL  76          HG12      VAL  76   1.915 -11.282  -5.334
  575   HG13  VAL  76          HG13      VAL  76   1.580 -10.521  -6.889
  576   HG21  VAL  76          HG21      VAL  76   5.447 -10.471  -5.025
  577   HG22  VAL  76          HG22      VAL  76   4.018 -11.165  -4.263
  578   HG23  VAL  76          HG23      VAL  76   4.780 -12.008  -5.624
  579    H    ALA  77           H        ALA  77   3.054 -11.070  -9.557
  580    HA   ALA  77           HA       ALA  77   2.229  -8.594 -10.822
  581    HB1  ALA  77           HB1      ALA  77   1.439 -11.477 -11.384
  582    HB2  ALA  77           HB2      ALA  77   1.168 -10.086 -12.454
  583    HB3  ALA  77           HB3      ALA  77   2.823 -10.616 -12.098
  584    H    LYS  78           H        LYS  78   0.358  -7.567 -10.829
  585    HA   LYS  78           HA       LYS  78  -1.968  -8.502  -9.191
  586    HB2  LYS  78           HB2      LYS  78  -0.961  -5.644  -9.437
  587    HB3  LYS  78           HB3      LYS  78  -2.225  -6.231  -8.365
  588    HG2  LYS  78           HG2      LYS  78   0.746  -6.909  -8.131
  589    HG3  LYS  78           HG3      LYS  78  -0.089  -5.622  -7.291
  590    HD2  LYS  78           HD2      LYS  78  -1.508  -7.270  -6.101
  591    HD3  LYS  78           HD3      LYS  78  -0.715  -8.601  -6.973
  592    HE2  LYS  78           HE2      LYS  78   1.457  -7.998  -5.995
  593    HE3  LYS  78           HE3      LYS  78   0.748  -6.587  -5.203
  594    HZ1  LYS  78           HZ1      LYS  78   0.020  -9.401  -4.578
  595    HZ2  LYS  78           HZ2      LYS  78   0.977  -8.415  -3.658
  596    HZ3  LYS  78           HZ3      LYS  78  -0.623  -8.090  -3.868
  597    H    LYS  79           H        LYS  79  -3.956  -7.967  -9.945
  598    HA   LYS  79           HA       LYS  79  -4.408  -6.320 -12.344
  599    HB2  LYS  79           HB2      LYS  79  -5.145  -8.044 -13.754
  600    HB3  LYS  79           HB3      LYS  79  -3.665  -8.626 -13.085
  601    HG2  LYS  79           HG2      LYS  79  -4.887 -10.015 -11.421
  602    HG3  LYS  79           HG3      LYS  79  -6.428  -9.488 -12.111
  603    HD2  LYS  79           HD2      LYS  79  -4.246 -10.924 -13.677
  604    HD3  LYS  79           HD3      LYS  79  -5.628 -11.737 -12.929
  605    HE2  LYS  79           HE2      LYS  79  -7.206 -10.606 -14.333
  606    HE3  LYS  79           HE3      LYS  79  -5.996  -9.464 -14.920
  607    HZ1  LYS  79           HZ1      LYS  79  -4.886 -11.189 -16.071
  608    HZ2  LYS  79           HZ2      LYS  79  -5.911 -12.366 -15.504
  609    HZ3  LYS  79           HZ3      LYS  79  -6.457 -11.191 -16.526
  610    HA   PRO  80           HA       PRO  80  -8.295  -5.738 -10.240
  611    HB2  PRO  80           HB2      PRO  80 -10.501  -6.444 -11.688
  612    HB3  PRO  80           HB3      PRO  80  -9.470  -5.028 -12.070
  613    HG2  PRO  80           HG2      PRO  80  -9.342  -7.805 -13.279
  614    HG3  PRO  80           HG3      PRO  80  -9.380  -6.239 -14.145
  615    HD2  PRO  80           HD2      PRO  80  -7.097  -7.560 -13.676
  616    HD3  PRO  80           HD3      PRO  80  -7.126  -5.773 -13.585
  617    H    GLY  81           H        GLY  81  -9.463  -6.696  -8.654
  618    HA2  GLY  81           HA2      GLY  81 -10.328  -8.354  -7.282
  619    HA3  GLY  81           HA3      GLY  81  -9.973  -9.589  -8.491
  620    H    SER  82           H        SER  82  -7.234  -7.518  -7.764
  621    HA   SER  82           HA       SER  82  -5.896  -9.837  -6.434
  622    HB2  SER  82           HB2      SER  82  -4.819  -7.314  -7.735
  623    HB3  SER  82           HB3      SER  82  -3.821  -8.404  -6.773
  624    HG   SER  82           HG       SER  82  -4.214 -10.067  -8.138
  625    H    THR  83           H        THR  83  -4.354  -9.357  -4.549
  626    HA   THR  83           HA       THR  83  -5.489  -7.247  -2.773
  627    HB   THR  83           HB       THR  83  -4.772  -8.638  -0.920
  628    HG1  THR  83           HG1      THR  83  -3.309 -10.019  -1.344
  629   HG21  THR  83          HG21      THR  83  -6.360 -10.515  -1.178
  630   HG22  THR  83          HG22      THR  83  -7.071  -8.996  -1.743
  631   HG23  THR  83          HG23      THR  83  -6.491 -10.201  -2.909
  632    H    VAL  84           H        VAL  84  -4.097  -5.933  -1.611
  633    HA   VAL  84           HA       VAL  84  -1.172  -6.135  -2.130
  634    HB   VAL  84           HB       VAL  84  -1.093  -3.649  -2.480
  635   HG11  VAL  84          HG11      VAL  84  -2.537  -5.251  -4.616
  636   HG12  VAL  84          HG12      VAL  84  -1.649  -3.730  -4.860
  637   HG13  VAL  84          HG13      VAL  84  -0.789  -5.182  -4.341
  638   HG21  VAL  84          HG21      VAL  84  -3.363  -3.062  -1.654
  639   HG22  VAL  84          HG22      VAL  84  -3.049  -2.466  -3.289
  640   HG23  VAL  84          HG23      VAL  84  -4.075  -3.892  -3.057
  641    H    ILE  85           H        ILE  85   0.165  -4.945  -0.796
  642    HA   ILE  85           HA       ILE  85  -0.943  -4.105   1.822
  643    HB   ILE  85           HB       ILE  85   1.458  -4.990   2.647
  644   HG12  ILE  85          HG12      ILE  85   1.792  -7.323   1.906
  645   HG13  ILE  85          HG13      ILE  85   0.612  -7.107   0.621
  646   HG21  ILE  85          HG21      ILE  85  -1.100  -6.613   2.551
  647   HG22  ILE  85          HG22      ILE  85   0.279  -6.889   3.645
  648   HG23  ILE  85          HG23      ILE  85  -0.637  -5.392   3.768
  649   HD11  ILE  85          HD11      ILE  85   2.114  -5.286  -0.328
  650   HD12  ILE  85          HD12      ILE  85   3.295  -5.690   0.923
  651   HD13  ILE  85          HD13      ILE  85   2.822  -6.905  -0.287
  652    H    ALA  86           H        ALA  86   0.133  -2.633   3.056
  653    HA   ALA  86           HA       ALA  86   0.926  -0.399   1.548
  654    HB1  ALA  86           HB1      ALA  86   1.217  -0.852   4.542
  655    HB2  ALA  86           HB2      ALA  86   1.151   0.714   3.704
  656    HB3  ALA  86           HB3      ALA  86  -0.271  -0.342   3.725
  657    H    GLY  87           H        GLY  87   2.814   0.733   1.352
  658    HA2  GLY  87           HA2      GLY  87   5.078   1.246   1.424
  659    HA3  GLY  87           HA3      GLY  87   5.383  -0.125   2.502
  660    H    SER  88           H        SER  88   3.669  -1.387  -0.069
  661    HA   SER  88           HA       SER  88   6.084  -2.299  -1.471
  662    HB2  SER  88           HB2      SER  88   4.658  -3.720  -2.751
  663    HB3  SER  88           HB3      SER  88   4.361  -3.935  -1.029
  664    HG   SER  88           HG       SER  88   2.407  -2.894  -1.221
  665    H    ILE  89           H        ILE  89   6.423  -2.013  -3.732
  666    HA   ILE  89           HA       ILE  89   5.590   0.713  -4.643
  667    HB   ILE  89           HB       ILE  89   8.013  -0.665  -5.742
  668   HG12  ILE  89          HG12      ILE  89   8.399  -0.980  -3.363
  669   HG13  ILE  89          HG13      ILE  89   9.505   0.169  -4.069
  670   HG21  ILE  89          HG21      ILE  89   7.355   2.255  -5.147
  671   HG22  ILE  89          HG22      ILE  89   8.841   1.656  -5.902
  672   HG23  ILE  89          HG23      ILE  89   7.292   1.458  -6.730
  673   HD11  ILE  89          HD11      ILE  89   8.384   2.045  -3.018
  674   HD12  ILE  89          HD12      ILE  89   7.053   1.008  -2.455
  675   HD13  ILE  89          HD13      ILE  89   8.683   0.798  -1.799
  676    H    ASN  90           H        ASN  90   4.775   1.067  -6.681
  677    HA   ASN  90           HA       ASN  90   3.851  -1.291  -8.182
  678    HB2  ASN  90           HB2      ASN  90   2.322   0.588  -7.370
  679    HB3  ASN  90           HB3      ASN  90   3.149   1.662  -8.498
  680   HD21  ASN  90          HD22      ASN  90   1.660   1.971 -10.143
  681   HD22  ASN  90          HD21      ASN  90   0.874   0.644 -10.984
  682    H    GLN  91           H        GLN  91   4.155  -1.632 -10.445
  683    HA   GLN  91           HA       GLN  91   5.642   0.307 -12.077
  684    HB2  GLN  91           HB2      GLN  91   7.344  -0.960 -10.700
  685    HB3  GLN  91           HB3      GLN  91   6.845  -2.441 -11.496
  686    HG2  GLN  91           HG2      GLN  91   7.896   0.008 -12.989
  687    HG3  GLN  91           HG3      GLN  91   8.953  -1.227 -12.317
  688   HE21  GLN  91          HE22      GLN  91   6.994  -0.416 -15.026
  689   HE22  GLN  91          HE21      GLN  91   7.119  -1.984 -15.832
  690    H    ASN  92           H        ASN  92   4.420   0.352 -13.869
  691    HA   ASN  92           HA       ASN  92   4.594  -0.868 -16.028
  692    HB2  ASN  92           HB2      ASN  92   3.951  -3.133 -15.228
  693    HB3  ASN  92           HB3      ASN  92   2.339  -2.506 -14.834
  694   HD21  ASN  92          HD22      ASN  92   0.781  -2.414 -16.550
  695   HD22  ASN  92          HD21      ASN  92   1.297  -2.692 -18.222
  696    H    GLY  93           H        GLY  93   1.767  -0.052 -13.957
  697    HA2  GLY  93           HA2      GLY  93   1.025   2.214 -15.645
  698    HA3  GLY  93           HA3      GLY  93  -0.023   0.823 -15.884
  699    H    SER  94           H        SER  94  -1.333   2.876 -15.171
  700    HA   SER  94           HA       SER  94  -1.463   3.314 -12.309
  701    HB2  SER  94           HB2      SER  94  -3.306   4.369 -14.473
  702    HB3  SER  94           HB3      SER  94  -3.148   4.976 -12.815
  703    HG   SER  94           HG       SER  94  -1.251   5.044 -14.936
  704    H    LEU  95           H        LEU  95  -2.865   2.510 -10.835
  705    HA   LEU  95           HA       LEU  95  -5.104   0.714 -11.714
  706    HB2  LEU  95           HB2      LEU  95  -3.788   0.151  -9.124
  707    HB3  LEU  95           HB3      LEU  95  -4.473  -0.952 -10.269
  708    HG   LEU  95           HG       LEU  95  -1.720   0.331 -10.571
  709   HD11  LEU  95          HD11      LEU  95  -1.958  -1.063  -8.508
  710   HD12  LEU  95          HD12      LEU  95  -2.489  -2.426  -9.515
  711   HD13  LEU  95          HD13      LEU  95  -0.852  -1.755  -9.682
  712   HD21  LEU  95          HD21      LEU  95  -2.850  -0.586 -12.663
  713   HD22  LEU  95          HD22      LEU  95  -1.356  -1.402 -12.208
  714   HD23  LEU  95          HD23      LEU  95  -2.922  -2.158 -11.834
  715    H    LEU  96           H        LEU  96  -6.731   0.299 -10.051
  716    HA   LEU  96           HA       LEU  96  -7.035   2.505  -8.038
  717    HB2  LEU  96           HB2      LEU  96  -9.131   1.162  -9.760
  718    HB3  LEU  96           HB3      LEU  96  -9.544   2.081  -8.323
  719    HG   LEU  96           HG       LEU  96  -7.879   3.323 -10.555
  720   HD11  LEU  96          HD11      LEU  96  -9.994   2.606 -11.544
  721   HD12  LEU  96          HD12      LEU  96 -10.903   3.389 -10.230
  722   HD13  LEU  96          HD13      LEU  96  -9.943   4.363 -11.372
  723   HD21  LEU  96          HD21      LEU  96  -7.957   4.459  -8.300
  724   HD22  LEU  96          HD22      LEU  96  -8.677   5.406  -9.611
  725   HD23  LEU  96          HD23      LEU  96  -9.718   4.557  -8.459
  726    H    ILE  97           H        ILE  97  -7.037   1.947  -6.040
  727    HA   ILE  97           HA       ILE  97  -7.615  -0.881  -5.256
  728    HB   ILE  97           HB       ILE  97  -5.808   1.105  -3.828
  729   HG12  ILE  97          HG12      ILE  97  -4.075  -0.756  -4.730
  730   HG13  ILE  97          HG13      ILE  97  -5.233  -0.846  -6.052
  731   HG21  ILE  97          HG21      ILE  97  -6.742  -0.711  -2.395
  732   HG22  ILE  97          HG22      ILE  97  -6.095  -1.917  -3.532
  733   HG23  ILE  97          HG23      ILE  97  -5.002  -0.863  -2.615
  734   HD11  ILE  97          HD11      ILE  97  -4.907   1.634  -6.432
  735   HD12  ILE  97          HD12      ILE  97  -3.744   1.640  -5.089
  736   HD13  ILE  97          HD13      ILE  97  -3.426   0.699  -6.561
  737    H    CYS  98           H        CYS  98  -9.180  -1.275  -3.817
  738    HA   CYS  98           HA       CYS  98 -10.591   0.984  -2.498
  739    HB2  CYS  98           HB2      CYS  98 -11.969  -0.724  -3.642
  740    HB3  CYS  98           HB3      CYS  98 -11.287  -1.977  -2.595
  741    HG   CYS  98           HG       CYS  98 -12.830   0.817  -1.613
  742    H    ALA  99           H        ALA  99 -10.148   1.562  -0.505
  743    HA   ALA  99           HA       ALA  99  -8.291  -0.013   1.165
  744    HB1  ALA  99           HB1      ALA  99  -9.555   2.738   1.524
  745    HB2  ALA  99           HB2      ALA  99  -8.332   2.003   2.585
  746    HB3  ALA  99           HB3      ALA  99  -7.924   2.399   0.901
  747    H    THR 100           H        THR 100  -9.310  -1.741   2.056
  748    HA   THR 100           HA       THR 100 -11.867  -1.371   3.569
  749    HB   THR 100           HB       THR 100 -11.745  -3.841   3.859
  750    HG1  THR 100           HG1      THR 100  -9.532  -4.151   3.722
  751   HG21  THR 100          HG21      THR 100 -11.371  -3.108   0.919
  752   HG22  THR 100          HG22      THR 100 -12.248  -4.500   1.590
  753   HG23  THR 100          HG23      THR 100 -12.875  -2.863   1.830
  754    H    HIS 101           H        HIS 101  -8.573  -0.983   4.061
  755    HA   HIS 101           HA       HIS 101  -8.841  -1.259   6.993
  756    HB2  HIS 101           HB2      HIS 101  -6.415  -1.962   5.297
  757    HB3  HIS 101           HB3      HIS 101  -6.562  -2.153   7.026
  758    HD1  HIS 101           HD1      HIS 101  -6.712  -4.199   4.084
  759    HD2  HIS 101           HD2      HIS 101  -8.732  -3.971   7.748
  760    HE1  HIS 101           HE1      HIS 101  -7.991  -6.381   4.306
  761    H    VAL 102           H        VAL 102  -8.091   0.455   8.094
  762    HA   VAL 102           HA       VAL 102  -6.839   2.739   6.666
  763    HB   VAL 102           HB       VAL 102  -8.812   2.892   8.269
  764   HG11  VAL 102          HG11      VAL 102  -8.479   2.944  10.580
  765   HG12  VAL 102          HG12      VAL 102  -7.687   1.455  10.069
  766   HG13  VAL 102          HG13      VAL 102  -6.709   2.885  10.459
  767   HG21  VAL 102          HG21      VAL 102  -7.525   4.837   7.439
  768   HG22  VAL 102          HG22      VAL 102  -8.208   5.053   9.051
  769   HG23  VAL 102          HG23      VAL 102  -6.481   4.734   8.882
  770    H    GLY 103           H        GLY 103  -4.912   3.883   8.157
  771    HA2  GLY 103           HA2      GLY 103  -2.746   2.150   7.637
  772    HA3  GLY 103           HA3      GLY 103  -2.684   3.668   8.514
  773    H    ALA 104           H        ALA 104  -4.368   2.880  10.784
  774    HA   ALA 104           HA       ALA 104  -2.461   1.552  12.433
  775    HB1  ALA 104           HB1      ALA 104  -5.454   1.994  12.833
  776    HB2  ALA 104           HB2      ALA 104  -4.287   1.560  14.099
  777    HB3  ALA 104           HB3      ALA 104  -4.148   3.122  13.276
  778    H    ASP 105           H        ASP 105  -5.074   0.238  10.473
  779    HA   ASP 105           HA       ASP 105  -4.940  -2.473  11.589
  780    HB2  ASP 105           HB2      ASP 105  -7.008  -1.344  10.668
  781    HB3  ASP 105           HB3      ASP 105  -6.352  -1.680   9.075
  782    H    THR 106           H        THR 106  -2.768  -0.769   9.648
  783    HA   THR 106           HA       THR 106  -2.080  -3.075   7.940
  784    HB   THR 106           HB       THR 106  -0.316  -1.821   6.987
  785    HG1  THR 106           HG1      THR 106  -1.040   0.240   8.769
  786   HG21  THR 106          HG21      THR 106  -2.536  -1.479   6.020
  787   HG22  THR 106          HG22      THR 106  -2.848  -0.140   7.139
  788   HG23  THR 106          HG23      THR 106  -1.557   0.002   5.926
  789    H    THR 107           H        THR 107  -0.261  -4.333   8.055
  790    HA   THR 107           HA       THR 107   0.579  -4.942  10.714
  791    HB   THR 107           HB       THR 107   0.281  -6.581   8.923
  792    HG1  THR 107           HG1      THR 107   1.533  -7.235  10.640
  793   HG21  THR 107          HG21      THR 107   2.961  -5.643   7.823
  794   HG22  THR 107          HG22      THR 107   1.983  -7.009   7.256
  795   HG23  THR 107          HG23      THR 107   1.384  -5.365   7.037
  796    H    LEU 108           H        LEU 108   2.115  -2.720   8.462
  797    HA   LEU 108           HA       LEU 108   4.779  -3.183   9.091
  798    HB2  LEU 108           HB2      LEU 108   3.394  -0.659   8.140
  799    HB3  LEU 108           HB3      LEU 108   5.132  -0.758   8.381
  800    HG   LEU 108           HG       LEU 108   5.281  -2.622   6.734
  801   HD11  LEU 108          HD11      LEU 108   2.338  -1.992   6.287
  802   HD12  LEU 108          HD12      LEU 108   3.372  -2.819   5.104
  803   HD13  LEU 108          HD13      LEU 108   3.082  -3.575   6.662
  804   HD21  LEU 108          HD21      LEU 108   5.704  -0.283   6.162
  805   HD22  LEU 108          HD22      LEU 108   4.989  -1.151   4.795
  806   HD23  LEU 108          HD23      LEU 108   3.976  -0.058   5.770
  807    H    SER 109           H        SER 109   2.878  -0.537  10.673
  808    HA   SER 109           HA       SER 109   5.110  -0.037  12.536
  809    HB2  SER 109           HB2      SER 109   2.305   1.120  12.544
  810    HB3  SER 109           HB3      SER 109   3.563   1.495  13.718
  811    HG   SER 109           HG       SER 109   3.668   3.036  12.197
  812    H    GLN 110           H        GLN 110   2.560  -2.284  12.423
  813    HA   GLN 110           HA       GLN 110   2.388  -2.796  15.297
  814    HB2  GLN 110           HB2      GLN 110   0.562  -3.278  13.649
  815    HB3  GLN 110           HB3      GLN 110   1.537  -4.549  12.965
  816    HG2  GLN 110           HG2      GLN 110   0.039  -5.653  14.347
  817    HG3  GLN 110           HG3      GLN 110   1.562  -5.682  15.241
  818   HE21  GLN 110          HE22      GLN 110  -1.545  -3.791  14.929
  819   HE22  GLN 110          HE21      GLN 110  -1.360  -3.100  16.523
  820    H    ILE 111           H        ILE 111   4.195  -4.255  12.564
  821    HA   ILE 111           HA       ILE 111   5.379  -6.431  13.886
  822    HB   ILE 111           HB       ILE 111   6.313  -4.725  11.558
  823   HG12  ILE 111          HG12      ILE 111   5.369  -7.625  11.554
  824   HG13  ILE 111          HG13      ILE 111   4.237  -6.289  11.465
  825   HG21  ILE 111          HG21      ILE 111   7.616  -7.298  12.558
  826   HG22  ILE 111          HG22      ILE 111   7.955  -6.536  10.995
  827   HG23  ILE 111          HG23      ILE 111   8.381  -5.693  12.468
  828   HD11  ILE 111          HD11      ILE 111   6.436  -6.866   9.433
  829   HD12  ILE 111          HD12      ILE 111   4.701  -7.085   9.221
  830   HD13  ILE 111          HD13      ILE 111   5.356  -5.452   9.404
  831    H    VAL 112           H        VAL 112   6.778  -3.092  13.656
  832    HA   VAL 112           HA       VAL 112   9.229  -3.796  14.828
  833    HB   VAL 112           HB       VAL 112   9.577  -1.403  15.241
  834   HG11  VAL 112          HG11      VAL 112   8.281  -1.935  12.539
  835   HG12  VAL 112          HG12      VAL 112   9.498  -0.702  12.928
  836   HG13  VAL 112          HG13      VAL 112   9.937  -2.408  12.996
  837   HG21  VAL 112          HG21      VAL 112   7.269  -0.725  15.908
  838   HG22  VAL 112          HG22      VAL 112   7.953   0.277  14.628
  839   HG23  VAL 112          HG23      VAL 112   6.743  -0.955  14.224
  840    H    LYS 113           H        LYS 113   6.268  -3.519  16.510
  841    HA   LYS 113           HA       LYS 113   7.444  -2.879  19.143
  842    HB2  LYS 113           HB2      LYS 113   4.708  -3.922  18.417
  843    HB3  LYS 113           HB3      LYS 113   5.214  -3.307  20.002
  844    HG2  LYS 113           HG2      LYS 113   5.743  -1.086  18.961
  845    HG3  LYS 113           HG3      LYS 113   5.094  -1.671  17.423
  846    HD2  LYS 113           HD2      LYS 113   3.570  -1.333  20.021
  847    HD3  LYS 113           HD3      LYS 113   3.412  -0.368  18.535
  848    HE2  LYS 113           HE2      LYS 113   2.847  -2.559  17.340
  849    HE3  LYS 113           HE3      LYS 113   2.723  -3.302  18.940
  850    HZ1  LYS 113           HZ1      LYS 113   0.578  -2.567  18.137
  851    HZ2  LYS 113           HZ2      LYS 113   0.975  -1.669  19.463
  852    HZ3  LYS 113           HZ3      LYS 113   1.089  -1.052  17.913
  853    H    LEU 114           H        LEU 114   6.852  -5.701  17.186
  854    HA   LEU 114           HA       LEU 114   7.229  -7.691  19.322
  855    HB2  LEU 114           HB2      LEU 114   5.729  -7.777  17.106
  856    HB3  LEU 114           HB3      LEU 114   7.249  -8.272  16.359
  857    HG   LEU 114           HG       LEU 114   5.752  -9.675  18.590
  858   HD11  LEU 114          HD11      LEU 114   6.443 -10.504  15.732
  859   HD12  LEU 114          HD12      LEU 114   5.494 -11.436  16.907
  860   HD13  LEU 114          HD13      LEU 114   4.856  -9.915  16.270
  861   HD21  LEU 114          HD21      LEU 114   8.082 -10.008  19.044
  862   HD22  LEU 114          HD22      LEU 114   7.486 -11.477  18.265
  863   HD23  LEU 114          HD23      LEU 114   8.434 -10.301  17.313
  864    H    VAL 115           H        VAL 115   8.898  -6.728  16.281
  865    HA   VAL 115           HA       VAL 115  11.151  -8.352  16.678
  866    HB   VAL 115           HB       VAL 115  10.871  -5.825  15.010
  867   HG11  VAL 115          HG11      VAL 115  12.946  -8.057  14.787
  868   HG12  VAL 115          HG12      VAL 115  12.691  -6.754  13.599
  869   HG13  VAL 115          HG13      VAL 115  13.278  -6.367  15.211
  870   HG21  VAL 115          HG21      VAL 115  10.557  -8.776  14.294
  871   HG22  VAL 115          HG22      VAL 115   9.239  -7.598  14.430
  872   HG23  VAL 115          HG23      VAL 115  10.447  -7.414  13.159
  873    H    GLU 116           H        GLU 116  10.598  -5.163  18.041
  874    HA   GLU 116           HA       GLU 116  13.317  -4.545  18.791
  875    HB2  GLU 116           HB2      GLU 116  11.360  -2.981  18.668
  876    HB3  GLU 116           HB3      GLU 116  10.633  -3.826  20.031
  877    HG2  GLU 116           HG2      GLU 116  13.127  -3.067  21.040
  878    HG3  GLU 116           HG3      GLU 116  12.767  -1.768  19.919
  879    H    GLU 117           H        GLU 117  10.937  -6.869  20.165
  880    HA   GLU 117           HA       GLU 117  12.253  -7.032  22.794
  881    HB2  GLU 117           HB2      GLU 117  10.084  -8.700  21.481
  882    HB3  GLU 117           HB3      GLU 117  10.592  -8.803  23.154
  883    HG2  GLU 117           HG2      GLU 117   9.540  -6.145  22.156
  884    HG3  GLU 117           HG3      GLU 117   8.421  -7.476  22.379
  885    H    ALA 118           H        ALA 118  12.828  -8.188  19.621
  886    HA   ALA 118           HA       ALA 118  13.284 -11.010  20.279
  887    HB1  ALA 118           HB1      ALA 118  13.654  -9.550  17.635
  888    HB2  ALA 118           HB2      ALA 118  13.564 -11.291  17.897
  889    HB3  ALA 118           HB3      ALA 118  12.130 -10.292  18.179
  890    H    GLN 119           H        GLN 119  15.239  -8.121  19.897
  891    HA   GLN 119           HA       GLN 119  17.794  -9.533  19.549
  892    HB2  GLN 119           HB2      GLN 119  17.049  -6.603  19.902
  893    HB3  GLN 119           HB3      GLN 119  18.678  -7.195  19.927
  894    HG2  GLN 119           HG2      GLN 119  18.675  -6.603  17.774
  895    HG3  GLN 119           HG3      GLN 119  18.123  -8.270  17.593
  896   HE21  GLN 119          HE22      GLN 119  15.993  -8.643  16.951
  897   HE22  GLN 119          HE21      GLN 119  14.797  -7.366  17.155
  Start of MODEL    7
    1    H    SER   1           H        SER   1  19.901  -4.296  13.540
    2    HA   SER   1           HA       SER   1  17.203  -3.646  14.579
    3    HB2  SER   1           HB2      SER   1  20.032  -3.170  15.532
    4    HB3  SER   1           HB3      SER   1  18.693  -2.203  16.170
    5    HG   SER   1           HG       SER   1  18.996  -5.030  16.298
    6    H    GLU   2           H        GLU   2  19.794  -1.987  12.775
    7    HA   GLU   2           HA       GLU   2  18.409   0.569  12.676
    8    HB2  GLU   2           HB2      GLU   2  20.889   0.115  12.359
    9    HB3  GLU   2           HB3      GLU   2  20.505  -0.533  10.761
   10    HG2  GLU   2           HG2      GLU   2  19.594   1.663  10.088
   11    HG3  GLU   2           HG3      GLU   2  19.847   2.287  11.725
   12    H    ALA   3           H        ALA   3  18.479  -2.316  10.531
   13    HA   ALA   3           HA       ALA   3  16.637  -1.322   8.598
   14    HB1  ALA   3           HB1      ALA   3  17.166  -4.209   9.391
   15    HB2  ALA   3           HB2      ALA   3  16.581  -3.606   7.833
   16    HB3  ALA   3           HB3      ALA   3  18.235  -3.247   8.339
   17    H    LEU   4           H        LEU   4  16.053  -2.560  11.833
   18    HA   LEU   4           HA       LEU   4  13.250  -3.230  11.537
   19    HB2  LEU   4           HB2      LEU   4  14.811  -3.880  13.432
   20    HB3  LEU   4           HB3      LEU   4  14.759  -2.209  13.964
   21    HG   LEU   4           HG       LEU   4  12.290  -2.418  14.336
   22   HD11  LEU   4          HD11      LEU   4  12.921  -5.336  13.793
   23   HD12  LEU   4          HD12      LEU   4  11.442  -4.755  14.599
   24   HD13  LEU   4          HD13      LEU   4  11.768  -4.316  12.905
   25   HD21  LEU   4          HD21      LEU   4  13.967  -2.685  16.167
   26   HD22  LEU   4          HD22      LEU   4  12.545  -3.701  16.417
   27   HD23  LEU   4          HD23      LEU   4  14.061  -4.423  15.818
   28    H    ALA   5           H        ALA   5  14.982  -0.118  11.811
   29    HA   ALA   5           HA       ALA   5  12.571   1.438  12.372
   30    HB1  ALA   5           HB1      ALA   5  15.367   2.263  11.477
   31    HB2  ALA   5           HB2      ALA   5  14.089   3.338  12.058
   32    HB3  ALA   5           HB3      ALA   5  14.804   2.147  13.160
   33    H    LYS   6           H        LYS   6  13.976  -0.028   9.554
   34    HA   LYS   6           HA       LYS   6  13.196   1.935   7.592
   35    HB2  LYS   6           HB2      LYS   6  14.935   0.100   7.353
   36    HB3  LYS   6           HB3      LYS   6  13.597  -1.042   7.128
   37    HG2  LYS   6           HG2      LYS   6  12.903   0.041   5.088
   38    HG3  LYS   6           HG3      LYS   6  13.954   1.433   5.397
   39    HD2  LYS   6           HD2      LYS   6  14.951   0.008   3.687
   40    HD3  LYS   6           HD3      LYS   6  15.955   0.027   5.138
   41    HE2  LYS   6           HE2      LYS   6  14.913  -2.170   5.808
   42    HE3  LYS   6           HE3      LYS   6  14.034  -2.178   4.268
   43    HZ1  LYS   6           HZ1      LYS   6  16.157  -3.432   4.285
   44    HZ2  LYS   6           HZ2      LYS   6  16.134  -2.276   3.103
   45    HZ3  LYS   6           HZ3      LYS   6  16.994  -2.033   4.475
   46    H    LEU   7           H        LEU   7  11.409  -0.672   9.138
   47    HA   LEU   7           HA       LEU   7   9.131  -0.742   7.406
   48    HB2  LEU   7           HB2      LEU   7   9.573  -1.266  10.357
   49    HB3  LEU   7           HB3      LEU   7   7.970  -1.371   9.658
   50    HG   LEU   7           HG       LEU   7   8.995  -3.557   9.932
   51   HD11  LEU   7          HD11      LEU   7   7.345  -3.233   8.139
   52   HD12  LEU   7          HD12      LEU   7   8.651  -2.873   6.985
   53   HD13  LEU   7          HD13      LEU   7   8.533  -4.477   7.727
   54   HD21  LEU   7          HD21      LEU   7  11.375  -2.953   9.532
   55   HD22  LEU   7          HD22      LEU   7  10.836  -4.356   8.596
   56   HD23  LEU   7          HD23      LEU   7  11.012  -2.790   7.792
   57    H    ILE   8           H        ILE   8   9.942   1.467  10.118
   58    HA   ILE   8           HA       ILE   8   7.465   2.943   9.972
   59    HB   ILE   8           HB       ILE   8  10.156   3.769  11.088
   60   HG12  ILE   8          HG12      ILE   8   9.253   1.737  12.167
   61   HG13  ILE   8          HG13      ILE   8   9.381   3.111  13.252
   62   HG21  ILE   8          HG21      ILE   8   7.403   5.019  11.389
   63   HG22  ILE   8          HG22      ILE   8   8.785   5.388  12.444
   64   HG23  ILE   8          HG23      ILE   8   8.861   5.761  10.725
   65   HD11  ILE   8          HD11      ILE   8   6.803   2.073  11.992
   66   HD12  ILE   8          HD12      ILE   8   7.330   1.860  13.668
   67   HD13  ILE   8          HD13      ILE   8   6.932   3.470  13.099
   68    H    SER   9           H        SER   9  10.673   3.358   8.421
   69    HA   SER   9           HA       SER   9  10.107   5.898   7.152
   70    HB2  SER   9           HB2      SER   9  12.081   3.704   6.406
   71    HB3  SER   9           HB3      SER   9  12.119   5.381   5.832
   72    HG   SER   9           HG       SER   9  13.481   4.695   7.689
   73    H    LEU  10           H        LEU  10   9.304   2.580   6.365
   74    HA   LEU  10           HA       LEU  10   8.777   2.975   3.548
   75    HB2  LEU  10           HB2      LEU  10   8.475   0.783   5.590
   76    HB3  LEU  10           HB3      LEU  10   7.509   0.671   4.132
   77    HG   LEU  10           HG       LEU  10  10.511   1.140   3.969
   78   HD11  LEU  10          HD11      LEU  10   9.039  -1.532   3.998
   79   HD12  LEU  10          HD12      LEU  10  10.760  -1.277   3.631
   80   HD13  LEU  10          HD13      LEU  10  10.150  -0.937   5.257
   81   HD21  LEU  10          HD21      LEU  10   9.138   1.542   1.919
   82   HD22  LEU  10          HD22      LEU  10  10.165   0.115   1.735
   83   HD23  LEU  10          HD23      LEU  10   8.436  -0.080   2.094
   84    H    GLN  11           H        GLN  11   6.894   3.513   6.487
   85    HA   GLN  11           HA       GLN  11   4.280   3.206   5.291
   86    HB2  GLN  11           HB2      GLN  11   5.231   4.690   7.778
   87    HB3  GLN  11           HB3      GLN  11   3.544   4.567   7.278
   88    HG2  GLN  11           HG2      GLN  11   3.611   2.130   7.438
   89    HG3  GLN  11           HG3      GLN  11   5.314   2.165   7.902
   90   HE21  GLN  11          HE22      GLN  11   2.038   3.149   8.914
   91   HE22  GLN  11          HE21      GLN  11   2.415   3.200  10.632
   92    H    ALA  12           H        ALA  12   2.907   4.708   4.442
   93    HA   ALA  12           HA       ALA  12   4.262   6.844   2.959
   94    HB1  ALA  12           HB1      ALA  12   1.415   5.803   2.823
   95    HB2  ALA  12           HB2      ALA  12   2.206   6.857   1.629
   96    HB3  ALA  12           HB3      ALA  12   2.790   5.198   1.858
   97    H    THR  13           H        THR  13   3.259   8.892   2.565
   98    HA   THR  13           HA       THR  13   2.244  10.180   5.069
   99    HB   THR  13           HB       THR  13   4.003  11.363   2.895
  100    HG1  THR  13           HG1      THR  13   5.683  10.628   3.939
  101   HG21  THR  13          HG21      THR  13   3.458  12.204   5.779
  102   HG22  THR  13          HG22      THR  13   4.667  12.938   4.702
  103   HG23  THR  13          HG23      THR  13   2.947  13.070   4.310
  104    H    GLU  14           H        GLU  14   1.751  10.023   1.545
  105    HA   GLU  14           HA       GLU  14  -0.812  11.469   1.890
  106    HB2  GLU  14           HB2      GLU  14  -0.437  12.841  -0.081
  107    HB3  GLU  14           HB3      GLU  14   0.812  13.139   1.131
  108    HG2  GLU  14           HG2      GLU  14   2.320  11.553  -0.158
  109    HG3  GLU  14           HG3      GLU  14   1.089  11.484  -1.414
  110    H    ALA  15           H        ALA  15  -2.457  10.978   0.314
  111    HA   ALA  15           HA       ALA  15  -1.993   8.588  -1.410
  112    HB1  ALA  15           HB1      ALA  15  -3.952   7.477  -0.414
  113    HB2  ALA  15           HB2      ALA  15  -2.697   7.757   0.811
  114    HB3  ALA  15           HB3      ALA  15  -4.132   8.806   0.750
  115    H    THR  16           H        THR  16  -3.364   8.406  -3.175
  116    HA   THR  16           HA       THR  16  -4.797  10.888  -3.914
  117    HB   THR  16           HB       THR  16  -4.216   8.587  -5.785
  118    HG1  THR  16           HG1      THR  16  -2.313   9.101  -4.868
  119   HG21  THR  16          HG21      THR  16  -5.699  10.377  -6.616
  120   HG22  THR  16          HG22      THR  16  -4.487  11.601  -6.174
  121   HG23  THR  16          HG23      THR  16  -4.135  10.408  -7.447
  122    H    ILE  17           H        ILE  17  -6.885  10.909  -3.242
  123    HA   ILE  17           HA       ILE  17  -8.621   8.524  -3.431
  124    HB   ILE  17           HB       ILE  17  -9.345  11.420  -2.794
  125   HG12  ILE  17          HG12      ILE  17  -8.700   9.120  -0.935
  126   HG13  ILE  17          HG13      ILE  17  -7.770  10.601  -1.123
  127   HG21  ILE  17          HG21      ILE  17 -11.442  10.460  -1.905
  128   HG22  ILE  17          HG22      ILE  17 -11.269  10.035  -3.580
  129   HG23  ILE  17          HG23      ILE  17 -10.897   8.821  -2.335
  130   HD11  ILE  17          HD11      ILE  17 -10.540  10.360   0.114
  131   HD12  ILE  17          HD12      ILE  17  -9.027  10.718   0.929
  132   HD13  ILE  17          HD13      ILE  17  -9.705  11.902  -0.212
  133    H    VAL  18           H        VAL  18 -10.054   8.109  -5.065
  134    HA   VAL  18           HA       VAL  18 -10.400  10.224  -7.156
  135    HB   VAL  18           HB       VAL  18 -10.882   8.485  -8.820
  136   HG11  VAL  18          HG11      VAL  18  -8.762   9.745  -8.614
  137   HG12  VAL  18          HG12      VAL  18  -8.079   8.436  -7.641
  138   HG13  VAL  18          HG13      VAL  18  -8.552   8.148  -9.339
  139   HG21  VAL  18          HG21      VAL  18 -11.227   6.505  -7.316
  140   HG22  VAL  18          HG22      VAL  18  -9.984   6.235  -8.550
  141   HG23  VAL  18          HG23      VAL  18  -9.508   6.577  -6.876
  142    H    THR  19           H        THR  19 -12.191  11.040  -7.495
  143    HA   THR  19           HA       THR  19 -14.731   9.887  -6.375
  144    HB   THR  19           HB       THR  19 -13.489  12.602  -5.815
  145    HG1  THR  19           HG1      THR  19 -13.283  11.825  -3.814
  146   HG21  THR  19          HG21      THR  19 -15.413  12.902  -4.261
  147   HG22  THR  19          HG22      THR  19 -15.944  12.865  -5.946
  148   HG23  THR  19          HG23      THR  19 -16.146  11.422  -4.919
  149    H    LEU  20           H        LEU  20 -16.559  10.424  -7.403
  150    HA   LEU  20           HA       LEU  20 -16.372  11.953  -9.964
  151    HB2  LEU  20           HB2      LEU  20 -18.630  10.200  -8.910
  152    HB3  LEU  20           HB3      LEU  20 -18.643  11.108 -10.396
  153    HG   LEU  20           HG       LEU  20 -18.279   8.846 -10.934
  154   HD11  LEU  20          HD11      LEU  20 -15.521   9.991 -11.189
  155   HD12  LEU  20          HD12      LEU  20 -16.391   8.976 -12.333
  156   HD13  LEU  20          HD13      LEU  20 -16.868  10.683 -12.115
  157   HD21  LEU  20          HD21      LEU  20 -17.210   8.058  -8.792
  158   HD22  LEU  20          HD22      LEU  20 -16.415   7.489 -10.275
  159   HD23  LEU  20          HD23      LEU  20 -15.684   8.793  -9.343
  160    H    ASP  21           H        ASP  21 -16.637  14.071  -9.729
  161    HA   ASP  21           HA       ASP  21 -18.535  15.060  -7.678
  162    HB2  ASP  21           HB2      ASP  21 -16.013  15.912  -8.292
  163    HB3  ASP  21           HB3      ASP  21 -16.977  17.034  -9.233
  164    H    SER  22           H        SER  22 -18.785  14.157 -10.636
  165    HA   SER  22           HA       SER  22 -21.463  14.953 -10.937
  166    HB2  SER  22           HB2      SER  22 -19.716  16.153 -13.100
  167    HB3  SER  22           HB3      SER  22 -21.447  15.892 -13.233
  168    HG   SER  22           HG       SER  22 -21.527  17.149 -11.151
  169    H    ASP  23           H        ASP  23 -22.530  13.693 -12.194
  170    HA   ASP  23           HA       ASP  23 -22.623  11.232 -12.322
  171    HB2  ASP  23           HB2      ASP  23 -24.257  12.824 -13.355
  172    HB3  ASP  23           HB3      ASP  23 -23.407  12.658 -14.893
  173    H    ASN  24           H        ASN  24 -20.164  10.865 -12.476
  174    HA   ASN  24           HA       ASN  24 -18.421   9.623 -13.234
  175    HB2  ASN  24           HB2      ASN  24 -19.846   7.820 -13.939
  176    HB3  ASN  24           HB3      ASN  24 -20.153   8.618 -15.485
  177   HD21  ASN  24          HD22      ASN  24 -17.577   6.977 -13.711
  178   HD22  ASN  24          HD21      ASN  24 -16.686   6.851 -15.249
  179    H    ILE  25           H        ILE  25 -19.982  11.784 -15.464
  180    HA   ILE  25           HA       ILE  25 -17.949  12.431 -17.253
  181    HB   ILE  25           HB       ILE  25 -19.282  14.575 -17.441
  182   HG12  ILE  25          HG12      ILE  25 -21.114  13.405 -15.364
  183   HG13  ILE  25          HG13      ILE  25 -19.973  14.719 -15.065
  184   HG21  ILE  25          HG21      ILE  25 -21.200  13.408 -18.442
  185   HG22  ILE  25          HG22      ILE  25 -19.722  12.487 -18.734
  186   HG23  ILE  25          HG23      ILE  25 -20.849  11.958 -17.479
  187   HD11  ILE  25          HD11      ILE  25 -21.104  16.071 -16.840
  188   HD12  ILE  25          HD12      ILE  25 -22.324  14.782 -16.994
  189   HD13  ILE  25          HD13      ILE  25 -22.151  15.664 -15.470
  190    H    LEU  26           H        LEU  26 -17.909  13.160 -13.893
  191    HA   LEU  26           HA       LEU  26 -15.590  14.973 -14.325
  192    HB2  LEU  26           HB2      LEU  26 -17.589  16.288 -13.828
  193    HB3  LEU  26           HB3      LEU  26 -17.830  15.344 -12.366
  194    HG   LEU  26           HG       LEU  26 -15.874  16.333 -11.309
  195   HD11  LEU  26          HD11      LEU  26 -15.520  17.696 -13.995
  196   HD12  LEU  26          HD12      LEU  26 -14.657  18.148 -12.503
  197   HD13  LEU  26          HD13      LEU  26 -14.393  16.550 -13.211
  198   HD21  LEU  26          HD21      LEU  26 -18.032  17.612 -11.279
  199   HD22  LEU  26          HD22      LEU  26 -16.585  18.635 -11.175
  200   HD23  LEU  26          HD23      LEU  26 -17.482  18.507 -12.708
  201    H    LEU  27           H        LEU  27 -15.124  12.543 -14.212
  202    HA   LEU  27           HA       LEU  27 -14.314  11.494 -11.640
  203    HB2  LEU  27           HB2      LEU  27 -14.609  10.230 -13.825
  204    HB3  LEU  27           HB3      LEU  27 -13.087  10.905 -14.378
  205    HG   LEU  27           HG       LEU  27 -13.268   9.350 -11.760
  206   HD11  LEU  27          HD11      LEU  27 -14.304   7.947 -13.487
  207   HD12  LEU  27          HD12      LEU  27 -12.916   8.213 -14.558
  208   HD13  LEU  27          HD13      LEU  27 -12.715   7.306 -13.039
  209   HD21  LEU  27          HD21      LEU  27 -11.117  10.491 -12.170
  210   HD22  LEU  27          HD22      LEU  27 -10.924   8.743 -12.316
  211   HD23  LEU  27          HD23      LEU  27 -11.015   9.742 -13.780
  212    H    SER  28           H        SER  28 -12.927  12.261 -10.291
  213    HA   SER  28           HA       SER  28 -10.790  14.123 -11.203
  214    HB2  SER  28           HB2      SER  28 -11.557  15.779  -9.615
  215    HB3  SER  28           HB3      SER  28 -12.904  15.333 -10.653
  216    HG   SER  28           HG       SER  28 -13.457  13.774  -8.897
  217    H    GLU  29           H        GLU  29  -9.056  14.412  -9.692
  218    HA   GLU  29           HA       GLU  29  -8.803  12.182  -7.712
  219    HB2  GLU  29           HB2      GLU  29  -6.587  13.509  -9.299
  220    HB3  GLU  29           HB3      GLU  29  -6.441  12.167  -8.167
  221    HG2  GLU  29           HG2      GLU  29  -6.729  10.688  -9.791
  222    HG3  GLU  29           HG3      GLU  29  -8.324  11.331 -10.156
  223    H    GLU  30           H        GLU  30  -7.889  12.607  -5.737
  224    HA   GLU  30           HA       GLU  30  -6.921  15.376  -5.121
  225    HB2  GLU  30           HB2      GLU  30  -8.632  13.833  -3.143
  226    HB3  GLU  30           HB3      GLU  30  -8.155  15.522  -3.147
  227    HG2  GLU  30           HG2      GLU  30  -9.632  15.630  -5.340
  228    HG3  GLU  30           HG3      GLU  30 -10.293  14.095  -4.728
  229    H    GLN  31           H        GLN  31  -4.716  15.091  -4.550
  230    HA   GLN  31           HA       GLN  31  -3.967  12.754  -2.933
  231    HB2  GLN  31           HB2      GLN  31  -2.417  15.178  -3.895
  232    HB3  GLN  31           HB3      GLN  31  -1.763  13.981  -2.761
  233    HG2  GLN  31           HG2      GLN  31  -2.283  12.181  -4.408
  234    HG3  GLN  31           HG3      GLN  31  -2.610  13.441  -5.630
  235   HE21  GLN  31          HE22      GLN  31  -0.315  11.595  -3.918
  236   HE22  GLN  31          HE21      GLN  31   0.648  12.914  -3.561
  237    H    VAL  32           H        VAL  32  -4.417  12.635  -0.851
  238    HA   VAL  32           HA       VAL  32  -4.678  15.130   0.784
  239    HB   VAL  32           HB       VAL  32  -6.291  14.056   2.165
  240   HG11  VAL  32          HG11      VAL  32  -7.131  13.630  -0.729
  241   HG12  VAL  32          HG12      VAL  32  -8.188  13.897   0.667
  242   HG13  VAL  32          HG13      VAL  32  -7.113  15.196   0.115
  243   HG21  VAL  32          HG21      VAL  32  -5.527  11.700   2.047
  244   HG22  VAL  32          HG22      VAL  32  -7.252  11.866   1.738
  245   HG23  VAL  32          HG23      VAL  32  -6.134  11.594   0.380
  246    H    ASP  33           H        ASP  33  -4.267  14.767   3.148
  247    HA   ASP  33           HA       ASP  33  -1.718  13.363   3.530
  248    HB2  ASP  33           HB2      ASP  33  -3.546  15.013   5.320
  249    HB3  ASP  33           HB3      ASP  33  -2.084  14.238   5.906
  250    H    VAL  34           H        VAL  34  -1.388  11.484   4.646
  251    HA   VAL  34           HA       VAL  34  -3.367   9.537   4.456
  252    HB   VAL  34           HB       VAL  34  -0.933   9.159   4.455
  253   HG11  VAL  34          HG11      VAL  34  -0.275  10.388   6.476
  254   HG12  VAL  34          HG12      VAL  34  -1.144   9.218   7.495
  255   HG13  VAL  34          HG13      VAL  34   0.262   8.708   6.548
  256   HG21  VAL  34          HG21      VAL  34  -2.533   7.269   4.566
  257   HG22  VAL  34          HG22      VAL  34  -0.984   6.917   5.346
  258   HG23  VAL  34          HG23      VAL  34  -2.407   7.284   6.337
  259    H    GLU  35           H        GLU  35  -2.894  11.587   7.255
  260    HA   GLU  35           HA       GLU  35  -4.485  10.195   9.176
  261    HB2  GLU  35           HB2      GLU  35  -3.044  12.079   9.677
  262    HB3  GLU  35           HB3      GLU  35  -3.968  13.155   8.628
  263    HG2  GLU  35           HG2      GLU  35  -5.844  13.165  10.130
  264    HG3  GLU  35           HG3      GLU  35  -5.178  11.844  11.082
  265    H    LEU  36           H        LEU  36  -5.426  11.928   6.268
  266    HA   LEU  36           HA       LEU  36  -8.197  12.386   7.160
  267    HB2  LEU  36           HB2      LEU  36  -6.792  13.345   4.647
  268    HB3  LEU  36           HB3      LEU  36  -8.253  13.987   5.375
  269    HG   LEU  36           HG       LEU  36  -5.438  14.213   6.521
  270   HD11  LEU  36          HD11      LEU  36  -7.293  16.329   5.364
  271   HD12  LEU  36          HD12      LEU  36  -5.657  16.575   5.998
  272   HD13  LEU  36          HD13      LEU  36  -5.894  15.622   4.525
  273   HD21  LEU  36          HD21      LEU  36  -8.045  15.414   7.531
  274   HD22  LEU  36          HD22      LEU  36  -7.111  14.133   8.338
  275   HD23  LEU  36          HD23      LEU  36  -6.414  15.749   8.160
  276    H    VAL  37           H        VAL  37  -6.693   9.966   5.312
  277    HA   VAL  37           HA       VAL  37  -9.071   9.547   3.573
  278    HB   VAL  37           HB       VAL  37  -6.941   9.343   2.494
  279   HG11  VAL  37          HG11      VAL  37  -5.392   7.487   2.936
  280   HG12  VAL  37          HG12      VAL  37  -5.512   8.553   4.335
  281   HG13  VAL  37          HG13      VAL  37  -6.354   6.989   4.341
  282   HG21  VAL  37          HG21      VAL  37  -8.828   7.971   1.691
  283   HG22  VAL  37          HG22      VAL  37  -7.244   7.243   1.374
  284   HG23  VAL  37          HG23      VAL  37  -8.254   6.610   2.683
  285    H    GLN  38           H        GLN  38 -10.423   7.814   3.682
  286    HA   GLN  38           HA       GLN  38 -10.587   6.440   6.336
  287    HB2  GLN  38           HB2      GLN  38 -12.797   7.499   4.514
  288    HB3  GLN  38           HB3      GLN  38 -13.038   6.625   6.013
  289    HG2  GLN  38           HG2      GLN  38 -12.069   8.433   7.314
  290    HG3  GLN  38           HG3      GLN  38 -11.521   9.235   5.841
  291   HE21  GLN  38          HE22      GLN  38 -14.469   8.173   7.452
  292   HE22  GLN  38          HE21      GLN  38 -15.490   9.238   6.519
  293    H    ARG  39           H        ARG  39 -11.614   4.443   6.470
  294    HA   ARG  39           HA       ARG  39 -10.844   2.673   4.301
  295    HB2  ARG  39           HB2      ARG  39 -11.218   0.857   5.719
  296    HB3  ARG  39           HB3      ARG  39 -10.408   2.131   6.617
  297    HG2  ARG  39           HG2      ARG  39 -12.571   2.690   7.705
  298    HG3  ARG  39           HG3      ARG  39 -13.385   1.384   6.818
  299    HD2  ARG  39           HD2      ARG  39 -11.933  -0.289   7.820
  300    HD3  ARG  39           HD3      ARG  39 -10.904   0.989   8.471
  301    HE   ARG  39           HE       ARG  39 -12.325   1.309  10.262
  302   HH11  ARG  39          HH11      ARG  39 -13.972  -0.950   8.080
  303   HH12  ARG  39          HH12      ARG  39 -15.040  -1.478   9.358
  304   HH21  ARG  39          HH21      ARG  39 -13.520   0.329  11.843
  305   HH22  ARG  39          HH22      ARG  39 -14.709  -0.859  11.423
  306    H    GLY  40           H        GLY  40 -13.112   4.313   3.686
  307    HA2  GLY  40           HA2      GLY  40 -15.015   2.205   2.683
  308    HA3  GLY  40           HA3      GLY  40 -15.519   3.832   3.130
  309    H    ASP  41           H        ASP  41 -12.514   3.956   1.450
  310    HA   ASP  41           HA       ASP  41 -13.968   4.776  -1.041
  311    HB2  ASP  41           HB2      ASP  41 -11.823   6.223   0.535
  312    HB3  ASP  41           HB3      ASP  41 -12.318   6.687  -1.093
  313    H    ILE  42           H        ILE  42 -12.349   5.431  -2.795
  314    HA   ILE  42           HA       ILE  42 -10.651   3.038  -3.369
  315    HB   ILE  42           HB       ILE  42 -12.433   4.592  -5.271
  316   HG12  ILE  42          HG12      ILE  42 -12.571   1.689  -4.314
  317   HG13  ILE  42          HG13      ILE  42 -13.613   2.985  -3.737
  318   HG21  ILE  42          HG21      ILE  42 -10.572   2.228  -5.823
  319   HG22  ILE  42          HG22      ILE  42 -11.695   2.966  -6.992
  320   HG23  ILE  42          HG23      ILE  42 -10.336   3.894  -6.400
  321   HD11  ILE  42          HD11      ILE  42 -14.478   3.302  -6.071
  322   HD12  ILE  42          HD12      ILE  42 -13.582   1.836  -6.545
  323   HD13  ILE  42          HD13      ILE  42 -14.861   1.735  -5.329
  324    H    ILE  43           H        ILE  43  -8.592   3.415  -3.655
  325    HA   ILE  43           HA       ILE  43  -7.581   6.124  -4.207
  326    HB   ILE  43           HB       ILE  43  -6.281   3.692  -2.925
  327   HG12  ILE  43          HG12      ILE  43  -8.089   4.257  -1.470
  328   HG13  ILE  43          HG13      ILE  43  -6.591   4.776  -0.734
  329   HG21  ILE  43          HG21      ILE  43  -5.396   6.602  -2.852
  330   HG22  ILE  43          HG22      ILE  43  -4.610   5.239  -2.041
  331   HG23  ILE  43          HG23      ILE  43  -4.642   5.314  -3.805
  332   HD11  ILE  43          HD11      ILE  43  -7.074   7.127  -1.299
  333   HD12  ILE  43          HD12      ILE  43  -8.547   6.635  -2.164
  334   HD13  ILE  43          HD13      ILE  43  -8.439   6.396  -0.427
  335    H    LYS  44           H        LYS  44  -6.672   6.479  -6.176
  336    HA   LYS  44           HA       LYS  44  -5.810   4.289  -7.921
  337    HB2  LYS  44           HB2      LYS  44  -7.126   6.341  -8.544
  338    HB3  LYS  44           HB3      LYS  44  -5.636   7.291  -8.367
  339    HG2  LYS  44           HG2      LYS  44  -4.567   5.988 -10.134
  340    HG3  LYS  44           HG3      LYS  44  -5.896   4.818 -10.124
  341    HD2  LYS  44           HD2      LYS  44  -7.445   6.764 -10.814
  342    HD3  LYS  44           HD3      LYS  44  -5.949   7.685 -11.160
  343    HE2  LYS  44           HE2      LYS  44  -5.192   5.805 -12.602
  344    HE3  LYS  44           HE3      LYS  44  -6.643   4.908 -12.168
  345    HZ1  LYS  44           HZ1      LYS  44  -8.006   6.548 -13.324
  346    HZ2  LYS  44           HZ2      LYS  44  -6.655   7.426 -13.769
  347    HZ3  LYS  44           HZ3      LYS  44  -6.925   5.885 -14.294
  348    H    VAL  45           H        VAL  45  -3.727   3.671  -8.440
  349    HA   VAL  45           HA       VAL  45  -1.518   5.125  -7.068
  350    HB   VAL  45           HB       VAL  45  -2.146   2.776  -6.364
  351   HG11  VAL  45          HG11      VAL  45  -0.593   1.967  -8.853
  352   HG12  VAL  45          HG12      VAL  45  -1.278   0.908  -7.608
  353   HG13  VAL  45          HG13      VAL  45  -2.351   1.847  -8.676
  354   HG21  VAL  45          HG21      VAL  45  -0.022   3.869  -5.722
  355   HG22  VAL  45          HG22      VAL  45   0.191   2.131  -5.984
  356   HG23  VAL  45          HG23      VAL  45   0.742   3.286  -7.217
  357    H    VAL  46           H        VAL  46   0.202   5.888  -8.119
  358    HA   VAL  46           HA       VAL  46   0.114   5.970 -11.032
  359    HB   VAL  46           HB       VAL  46   1.873   7.622 -10.882
  360   HG11  VAL  46          HG11      VAL  46  -0.461   8.301 -10.411
  361   HG12  VAL  46          HG12      VAL  46  -0.152   8.112  -8.672
  362   HG13  VAL  46          HG13      VAL  46   0.742   9.320  -9.606
  363   HG21  VAL  46          HG21      VAL  46   2.092   6.990  -7.924
  364   HG22  VAL  46          HG22      VAL  46   3.332   6.742  -9.165
  365   HG23  VAL  46          HG23      VAL  46   2.821   8.377  -8.750
  366    HA   PRO  47           HA       PRO  47   3.470   3.111 -12.024
  367    HB2  PRO  47           HB2      PRO  47   4.887   4.471 -13.959
  368    HB3  PRO  47           HB3      PRO  47   3.331   3.644 -14.273
  369    HG2  PRO  47           HG2      PRO  47   3.773   6.582 -13.636
  370    HG3  PRO  47           HG3      PRO  47   2.819   5.874 -14.977
  371    HD2  PRO  47           HD2      PRO  47   1.585   6.672 -12.737
  372    HD3  PRO  47           HD3      PRO  47   1.118   5.122 -13.477
  373    H    GLY  48           H        GLY  48   5.502   2.799 -11.118
  374    HA2  GLY  48           HA2      GLY  48   7.359   3.211  -9.828
  375    HA3  GLY  48           HA3      GLY  48   7.277   4.916 -10.266
  376    H    GLY  49           H        GLY  49   4.271   4.305  -8.969
  377    HA2  GLY  49           HA2      GLY  49   4.824   5.758  -6.567
  378    HA3  GLY  49           HA3      GLY  49   3.275   5.097  -7.071
  379    H    LYS  50           H        LYS  50   3.454   5.048  -4.553
  380    HA   LYS  50           HA       LYS  50   4.180   2.244  -3.731
  381    HB2  LYS  50           HB2      LYS  50   4.163   4.721  -1.965
  382    HB3  LYS  50           HB3      LYS  50   4.611   3.071  -1.498
  383    HG2  LYS  50           HG2      LYS  50   6.499   3.168  -3.154
  384    HG3  LYS  50           HG3      LYS  50   6.090   4.864  -3.460
  385    HD2  LYS  50           HD2      LYS  50   6.486   5.404  -1.066
  386    HD3  LYS  50           HD3      LYS  50   6.854   3.702  -0.755
  387    HE2  LYS  50           HE2      LYS  50   8.946   4.805  -0.925
  388    HE3  LYS  50           HE3      LYS  50   8.755   3.848  -2.397
  389    HZ1  LYS  50           HZ1      LYS  50   8.100   5.916  -3.550
  390    HZ2  LYS  50           HZ2      LYS  50   8.347   6.772  -2.155
  391    HZ3  LYS  50           HZ3      LYS  50   9.597   5.988  -2.900
  392    H    PHE  51           H        PHE  51   2.834   1.201  -2.206
  393    HA   PHE  51           HA       PHE  51  -0.002   2.048  -2.315
  394    HB2  PHE  51           HB2      PHE  51   1.292  -0.478  -1.293
  395    HB3  PHE  51           HB3      PHE  51  -0.433  -0.143  -1.221
  396    HD1  PHE  51           HD1      PHE  51   2.423  -0.733  -3.525
  397    HD2  PHE  51           HD2      PHE  51  -1.846  -0.318  -3.206
  398    HE1  PHE  51           HE1      PHE  51   2.196  -1.482  -5.857
  399    HE2  PHE  51           HE2      PHE  51  -2.079  -1.144  -5.542
  400    HZ   PHE  51           HZ       PHE  51  -0.044  -1.690  -6.883
  401    HA   PRO  52           HA       PRO  52   0.834   3.891   1.667
  402    HB2  PRO  52           HB2      PRO  52  -1.293   5.556   1.923
  403    HB3  PRO  52           HB3      PRO  52  -0.078   5.760   0.625
  404    HG2  PRO  52           HG2      PRO  52  -2.779   4.395   0.431
  405    HG3  PRO  52           HG3      PRO  52  -2.076   5.624  -0.666
  406    HD2  PRO  52           HD2      PRO  52  -1.940   2.920  -1.162
  407    HD3  PRO  52           HD3      PRO  52  -0.671   4.073  -1.671
  408    H    VAL  53           H        VAL  53  -1.844   1.763   1.293
  409    HA   VAL  53           HA       VAL  53  -2.042   1.110   4.097
  410    HB   VAL  53           HB       VAL  53  -4.585   1.182   4.047
  411   HG11  VAL  53          HG11      VAL  53  -3.170   3.862   4.274
  412   HG12  VAL  53          HG12      VAL  53  -4.716   3.392   5.008
  413   HG13  VAL  53          HG13      VAL  53  -3.220   2.607   5.531
  414   HG21  VAL  53          HG21      VAL  53  -5.683   2.884   2.754
  415   HG22  VAL  53          HG22      VAL  53  -4.148   3.432   2.055
  416   HG23  VAL  53          HG23      VAL  53  -4.800   1.826   1.631
  417    H    ASP  54           H        ASP  54  -3.503  -0.914   4.272
  418    HA   ASP  54           HA       ASP  54  -3.080  -2.587   1.879
  419    HB2  ASP  54           HB2      ASP  54  -3.791  -4.460   3.261
  420    HB3  ASP  54           HB3      ASP  54  -2.425  -3.583   3.929
  421    H    GLY  55           H        GLY  55  -4.642  -3.776   0.819
  422    HA2  GLY  55           HA2      GLY  55  -7.434  -3.662   1.235
  423    HA3  GLY  55           HA3      GLY  55  -7.029  -2.287   0.204
  424    H    ARG  56           H        ARG  56  -8.545  -3.481  -1.158
  425    HA   ARG  56           HA       ARG  56  -7.187  -5.621  -2.768
  426    HB2  ARG  56           HB2      ARG  56  -9.279  -6.198  -1.429
  427    HB3  ARG  56           HB3      ARG  56 -10.180  -5.276  -2.640
  428    HG2  ARG  56           HG2      ARG  56  -9.327  -6.793  -4.419
  429    HG3  ARG  56           HG3      ARG  56  -8.319  -7.626  -3.224
  430    HD2  ARG  56           HD2      ARG  56 -10.262  -8.968  -3.687
  431    HD3  ARG  56           HD3      ARG  56 -10.303  -8.414  -2.020
  432    HE   ARG  56           HE       ARG  56 -12.079  -7.584  -4.254
  433   HH11  ARG  56          HH11      ARG  56 -11.498  -7.321  -0.774
  434   HH12  ARG  56          HH12      ARG  56 -13.017  -6.494  -0.556
  435   HH21  ARG  56          HH21      ARG  56 -13.869  -6.629  -3.904
  436   HH22  ARG  56          HH22      ARG  56 -14.320  -5.968  -2.344
  437    H    VAL  57           H        VAL  57  -7.026  -5.556  -4.897
  438    HA   VAL  57           HA       VAL  57  -7.228  -2.966  -6.313
  439    HB   VAL  57           HB       VAL  57  -6.081  -5.697  -7.070
  440   HG11  VAL  57          HG11      VAL  57  -5.920  -3.029  -8.519
  441   HG12  VAL  57          HG12      VAL  57  -4.978  -4.485  -8.935
  442   HG13  VAL  57          HG13      VAL  57  -6.726  -4.506  -9.089
  443   HG21  VAL  57          HG21      VAL  57  -3.868  -4.739  -6.800
  444   HG22  VAL  57          HG22      VAL  57  -4.557  -3.179  -6.310
  445   HG23  VAL  57          HG23      VAL  57  -4.746  -4.613  -5.278
  446    H    ILE  58           H        ILE  58  -8.941  -2.651  -7.732
  447    HA   ILE  58           HA       ILE  58 -10.342  -5.041  -8.868
  448    HB   ILE  58           HB       ILE  58 -12.555  -3.732  -8.406
  449   HG12  ILE  58          HG12      ILE  58 -10.930  -2.777  -6.026
  450   HG13  ILE  58          HG13      ILE  58 -11.210  -1.738  -7.441
  451   HG21  ILE  58          HG21      ILE  58 -11.181  -5.175  -6.109
  452   HG22  ILE  58          HG22      ILE  58 -12.922  -4.998  -6.385
  453   HG23  ILE  58          HG23      ILE  58 -11.960  -5.967  -7.498
  454   HD11  ILE  58          HD11      ILE  58 -12.847  -1.170  -5.772
  455   HD12  ILE  58          HD12      ILE  58 -13.664  -1.950  -7.134
  456   HD13  ILE  58          HD13      ILE  58 -13.381  -2.855  -5.623
  457    H    GLU  59           H        GLU  59  -8.457  -3.044  -9.898
  458    HA   GLU  59           HA       GLU  59  -9.554  -3.038 -12.536
  459    HB2  GLU  59           HB2      GLU  59 -10.412  -0.801 -11.332
  460    HB3  GLU  59           HB3      GLU  59  -8.734  -0.309 -11.485
  461    HG2  GLU  59           HG2      GLU  59  -9.969   0.562 -13.338
  462    HG3  GLU  59           HG3      GLU  59  -8.878  -0.671 -13.965
  463    H    GLY  60           H        GLY  60  -7.749  -3.091 -14.013
  464    HA2  GLY  60           HA2      GLY  60  -5.711  -2.121 -14.788
  465    HA3  GLY  60           HA3      GLY  60  -5.199  -1.818 -13.143
  466    H    HIS  61           H        HIS  61  -3.357  -2.776 -14.496
  467    HA   HIS  61           HA       HIS  61  -3.112  -5.734 -14.016
  468    HB2  HIS  61           HB2      HIS  61  -2.321  -6.032 -16.318
  469    HB3  HIS  61           HB3      HIS  61  -3.957  -5.431 -16.236
  470    HD1  HIS  61           HD1      HIS  61  -0.412  -3.902 -16.935
  471    HD2  HIS  61           HD2      HIS  61  -4.518  -3.460 -17.804
  472    HE1  HIS  61           HE1      HIS  61  -0.576  -2.124 -18.734
  473    H    SER  62           H        SER  62  -1.758  -3.771 -12.428
  474    HA   SER  62           HA       SER  62   0.895  -3.411 -13.565
  475    HB2  SER  62           HB2      SER  62  -0.535  -1.736 -12.144
  476    HB3  SER  62           HB3      SER  62   0.210  -2.529 -10.760
  477    HG   SER  62           HG       SER  62   1.730  -1.649 -12.964
  478    H    MET  63           H        MET  63   2.895  -3.560 -12.116
  479    HA   MET  63           HA       MET  63   2.908  -6.218 -10.757
  480    HB2  MET  63           HB2      MET  63   4.076  -6.299 -12.878
  481    HB3  MET  63           HB3      MET  63   5.126  -4.959 -12.396
  482    HG2  MET  63           HG2      MET  63   6.186  -6.233 -10.722
  483    HG3  MET  63           HG3      MET  63   4.930  -7.473 -10.710
  484    HE1  MET  63           HE1      MET  63   5.670  -9.783 -13.635
  485    HE2  MET  63           HE2      MET  63   4.957  -9.625 -12.016
  486    HE3  MET  63           HE3      MET  63   4.356  -8.618 -13.354
  487    H    VAL  64           H        VAL  64   3.723  -6.338  -8.788
  488    HA   VAL  64           HA       VAL  64   4.558  -3.814  -7.416
  489    HB   VAL  64           HB       VAL  64   2.675  -5.990  -6.436
  490   HG11  VAL  64          HG11      VAL  64   3.563  -3.376  -5.144
  491   HG12  VAL  64          HG12      VAL  64   2.200  -4.363  -4.582
  492   HG13  VAL  64          HG13      VAL  64   3.832  -5.025  -4.532
  493   HG21  VAL  64          HG21      VAL  64   1.571  -4.640  -8.139
  494   HG22  VAL  64          HG22      VAL  64   0.971  -4.138  -6.553
  495   HG23  VAL  64          HG23      VAL  64   2.174  -3.151  -7.410
  496    H    ASP  65           H        ASP  65   6.180  -3.833  -6.036
  497    HA   ASP  65           HA       ASP  65   7.755  -6.295  -5.539
  498    HB2  ASP  65           HB2      ASP  65   8.880  -4.229  -6.230
  499    HB3  ASP  65           HB3      ASP  65   8.216  -3.368  -4.837
  500    H    GLU  66           H        GLU  66   6.973  -7.599  -3.943
  501    HA   GLU  66           HA       GLU  66   5.805  -6.411  -1.459
  502    HB2  GLU  66           HB2      GLU  66   5.728  -9.307  -2.368
  503    HB3  GLU  66           HB3      GLU  66   4.798  -8.534  -1.079
  504    HG2  GLU  66           HG2      GLU  66   3.737  -7.082  -2.892
  505    HG3  GLU  66           HG3      GLU  66   4.457  -8.197  -4.065
  506    H    SER  67           H        SER  67   8.661  -7.778  -2.520
  507    HA   SER  67           HA       SER  67   9.529  -9.714  -0.929
  508    HB2  SER  67           HB2      SER  67  11.818  -9.085  -1.341
  509    HB3  SER  67           HB3      SER  67  10.835  -8.711  -2.758
  510    HG   SER  67           HG       SER  67  10.744  -6.499  -1.820
  511    H    LEU  68           H        LEU  68   9.555  -6.394   0.407
  512    HA   LEU  68           HA       LEU  68  11.040  -7.310   2.769
  513    HB2  LEU  68           HB2      LEU  68  11.218  -5.067   1.490
  514    HB3  LEU  68           HB3      LEU  68   9.658  -4.641   2.141
  515    HG   LEU  68           HG       LEU  68  11.456  -3.451   3.166
  516   HD11  LEU  68          HD11      LEU  68  10.473  -5.288   5.353
  517   HD12  LEU  68          HD12      LEU  68  10.939  -3.593   5.448
  518   HD13  LEU  68          HD13      LEU  68   9.460  -4.037   4.584
  519   HD21  LEU  68          HD21      LEU  68  13.289  -5.042   2.976
  520   HD22  LEU  68          HD22      LEU  68  13.124  -4.417   4.627
  521   HD23  LEU  68          HD23      LEU  68  12.552  -6.056   4.243
  522    H    ILE  69           H        ILE  69   7.658  -6.898   1.919
  523    HA   ILE  69           HA       ILE  69   6.797  -6.959   4.754
  524    HB   ILE  69           HB       ILE  69   5.010  -6.956   2.301
  525   HG12  ILE  69          HG12      ILE  69   6.346  -4.968   2.030
  526   HG13  ILE  69          HG13      ILE  69   4.726  -4.545   2.543
  527   HG21  ILE  69          HG21      ILE  69   4.590  -6.294   5.248
  528   HG22  ILE  69          HG22      ILE  69   3.411  -5.922   3.982
  529   HG23  ILE  69          HG23      ILE  69   3.847  -7.603   4.312
  530   HD11  ILE  69          HD11      ILE  69   5.561  -4.214   4.876
  531   HD12  ILE  69          HD12      ILE  69   7.208  -4.538   4.300
  532   HD13  ILE  69          HD13      ILE  69   6.308  -3.132   3.683
  533    H    THR  70           H        THR  70   6.184  -8.917   1.780
  534    HA   THR  70           HA       THR  70   5.089 -11.129   3.364
  535    HB   THR  70           HB       THR  70   4.756 -12.191   1.159
  536    HG1  THR  70           HG1      THR  70   5.258 -10.859  -0.649
  537   HG21  THR  70          HG21      THR  70   3.070 -10.511   1.978
  538   HG22  THR  70          HG22      THR  70   3.922  -9.251   1.065
  539   HG23  THR  70          HG23      THR  70   3.167 -10.618   0.216
  540    H    GLY  71           H        GLY  71   8.203 -10.302   2.164
  541    HA2  GLY  71           HA2      GLY  71  10.214 -11.322   2.575
  542    HA3  GLY  71           HA3      GLY  71   9.420 -12.824   3.097
  543    H    GLU  72           H        GLU  72   8.198 -11.703   0.167
  544    HA   GLU  72           HA       GLU  72   9.266 -13.758  -1.547
  545    HB2  GLU  72           HB2      GLU  72   7.805 -11.142  -2.080
  546    HB3  GLU  72           HB3      GLU  72   8.275 -12.220  -3.383
  547    HG2  GLU  72           HG2      GLU  72   6.421 -12.970  -1.093
  548    HG3  GLU  72           HG3      GLU  72   5.948 -12.565  -2.736
  549    H    ALA  73           H        ALA  73  10.097 -12.652  -3.857
  550    HA   ALA  73           HA       ALA  73  12.588 -11.179  -3.370
  551    HB1  ALA  73           HB1      ALA  73  12.704 -14.015  -4.471
  552    HB2  ALA  73           HB2      ALA  73  14.063 -12.916  -4.155
  553    HB3  ALA  73           HB3      ALA  73  13.121 -13.567  -2.800
  554    H    MET  74           H        MET  74  10.252 -12.528  -5.608
  555    HA   MET  74           HA       MET  74  11.323 -10.694  -7.721
  556    HB2  MET  74           HB2      MET  74   9.804 -13.287  -8.074
  557    HB3  MET  74           HB3      MET  74  10.119 -12.118  -9.364
  558    HG2  MET  74           HG2      MET  74  12.556 -12.344  -9.006
  559    HG3  MET  74           HG3      MET  74  12.264 -13.500  -7.711
  560    HE1  MET  74           HE1      MET  74  10.593 -13.170 -11.372
  561    HE2  MET  74           HE2      MET  74  12.331 -12.846 -11.562
  562    HE3  MET  74           HE3      MET  74  11.620 -14.329 -12.234
  563    HA   PRO  75           HA       PRO  75   7.619  -8.322  -7.161
  564    HB2  PRO  75           HB2      PRO  75   7.949  -7.713 -10.094
  565    HB3  PRO  75           HB3      PRO  75   7.594  -6.587  -8.741
  566    HG2  PRO  75           HG2      PRO  75  10.102  -6.776  -9.724
  567    HG3  PRO  75           HG3      PRO  75   9.856  -6.766  -7.944
  568    HD2  PRO  75           HD2      PRO  75  10.308  -9.156  -9.767
  569    HD3  PRO  75           HD3      PRO  75  11.062  -8.749  -8.199
  570    H    VAL  76           H        VAL  76   5.440  -8.382  -7.467
  571    HA   VAL  76           HA       VAL  76   4.363 -10.867  -8.691
  572    HB   VAL  76           HB       VAL  76   3.233  -9.144  -6.451
  573   HG11  VAL  76          HG11      VAL  76   2.564 -11.978  -7.368
  574   HG12  VAL  76          HG12      VAL  76   1.912 -11.181  -5.922
  575   HG13  VAL  76          HG13      VAL  76   1.514 -10.549  -7.519
  576   HG21  VAL  76          HG21      VAL  76   5.364 -10.076  -5.689
  577   HG22  VAL  76          HG22      VAL  76   4.039 -10.959  -4.941
  578   HG23  VAL  76          HG23      VAL  76   4.906 -11.678  -6.309
  579    H    ALA  77           H        ALA  77   2.828 -10.838 -10.232
  580    HA   ALA  77           HA       ALA  77   1.842  -8.306 -11.295
  581    HB1  ALA  77           HB1      ALA  77   1.146 -11.183 -12.012
  582    HB2  ALA  77           HB2      ALA  77   0.753  -9.735 -12.962
  583    HB3  ALA  77           HB3      ALA  77   2.443 -10.215 -12.740
  584    H    LYS  78           H        LYS  78  -0.011  -7.307 -10.926
  585    HA   LYS  78           HA       LYS  78  -2.185  -8.575  -9.292
  586    HB2  LYS  78           HB2      LYS  78  -1.579  -5.627  -9.759
  587    HB3  LYS  78           HB3      LYS  78  -2.827  -6.275  -8.698
  588    HG2  LYS  78           HG2      LYS  78   0.183  -6.556  -8.330
  589    HG3  LYS  78           HG3      LYS  78  -0.892  -5.490  -7.427
  590    HD2  LYS  78           HD2      LYS  78  -2.095  -7.359  -6.463
  591    HD3  LYS  78           HD3      LYS  78  -1.134  -8.526  -7.396
  592    HE2  LYS  78           HE2      LYS  78   0.900  -7.919  -6.230
  593    HE3  LYS  78           HE3      LYS  78   0.088  -6.602  -5.382
  594    HZ1  LYS  78           HZ1      LYS  78  -0.581  -9.490  -5.008
  595    HZ2  LYS  78           HZ2      LYS  78   0.350  -8.599  -4.006
  596    HZ3  LYS  78           HZ3      LYS  78  -1.239  -8.244  -4.167
  597    H    LYS  79           H        LYS  79  -4.356  -8.076  -9.731
  598    HA   LYS  79           HA       LYS  79  -5.211  -7.078 -12.322
  599    HB2  LYS  79           HB2      LYS  79  -6.165  -9.160 -13.115
  600    HB3  LYS  79           HB3      LYS  79  -4.476  -9.438 -12.758
  601    HG2  LYS  79           HG2      LYS  79  -5.269 -10.323 -10.485
  602    HG3  LYS  79           HG3      LYS  79  -6.897 -10.316 -11.169
  603    HD2  LYS  79           HD2      LYS  79  -4.529 -11.823 -12.342
  604    HD3  LYS  79           HD3      LYS  79  -5.682 -12.513 -11.201
  605    HE2  LYS  79           HE2      LYS  79  -7.517 -12.197 -12.783
  606    HE3  LYS  79           HE3      LYS  79  -6.422 -11.426 -13.948
  607    HZ1  LYS  79           HZ1      LYS  79  -6.022 -14.179 -12.913
  608    HZ2  LYS  79           HZ2      LYS  79  -6.796 -13.869 -14.333
  609    HZ3  LYS  79           HZ3      LYS  79  -5.217 -13.460 -14.152
  610    HA   PRO  80           HA       PRO  80  -8.800  -6.201  -9.761
  611    HB2  PRO  80           HB2      PRO  80 -11.040  -7.310 -11.024
  612    HB3  PRO  80           HB3      PRO  80 -10.297  -5.730 -11.413
  613    HG2  PRO  80           HG2      PRO  80  -9.814  -8.400 -12.753
  614    HG3  PRO  80           HG3      PRO  80 -10.112  -6.808 -13.524
  615    HD2  PRO  80           HD2      PRO  80  -7.619  -7.743 -13.303
  616    HD3  PRO  80           HD3      PRO  80  -7.932  -6.029 -12.941
  617    H    GLY  81           H        GLY  81  -9.712  -7.067  -7.974
  618    HA2  GLY  81           HA2      GLY  81 -10.466  -8.632  -6.442
  619    HA3  GLY  81           HA3      GLY  81 -10.214  -9.936  -7.599
  620    H    SER  82           H        SER  82  -7.369  -7.787  -7.033
  621    HA   SER  82           HA       SER  82  -6.050 -10.119  -5.665
  622    HB2  SER  82           HB2      SER  82  -4.896  -7.655  -7.040
  623    HB3  SER  82           HB3      SER  82  -3.953  -8.889  -6.198
  624    HG   SER  82           HG       SER  82  -5.664  -9.867  -8.128
  625    H    THR  83           H        THR  83  -4.989  -9.769  -3.532
  626    HA   THR  83           HA       THR  83  -5.660  -7.148  -2.299
  627    HB   THR  83           HB       THR  83  -5.075  -8.039  -0.187
  628    HG1  THR  83           HG1      THR  83  -4.780 -10.470  -0.260
  629   HG21  THR  83          HG21      THR  83  -6.835  -9.668   0.084
  630   HG22  THR  83          HG22      THR  83  -7.362  -8.450  -1.079
  631   HG23  THR  83          HG23      THR  83  -6.831 -10.051  -1.652
  632    H    VAL  84           H        VAL  84  -4.178  -5.892  -1.190
  633    HA   VAL  84           HA       VAL  84  -1.271  -6.284  -1.683
  634    HB   VAL  84           HB       VAL  84  -1.076  -3.799  -2.101
  635   HG11  VAL  84          HG11      VAL  84  -2.551  -5.365  -4.241
  636   HG12  VAL  84          HG12      VAL  84  -1.518  -3.937  -4.477
  637   HG13  VAL  84          HG13      VAL  84  -0.808  -5.445  -3.882
  638   HG21  VAL  84          HG21      VAL  84  -3.355  -3.101  -1.365
  639   HG22  VAL  84          HG22      VAL  84  -2.958  -2.564  -3.004
  640   HG23  VAL  84          HG23      VAL  84  -4.045  -3.942  -2.771
  641    H    ILE  85           H        ILE  85   0.093  -5.101  -0.347
  642    HA   ILE  85           HA       ILE  85  -0.979  -4.194   2.275
  643    HB   ILE  85           HB       ILE  85   1.595  -4.732   2.919
  644   HG12  ILE  85          HG12      ILE  85   2.250  -6.964   2.144
  645   HG13  ILE  85          HG13      ILE  85   0.895  -7.046   1.032
  646   HG21  ILE  85          HG21      ILE  85   0.750  -6.746   4.013
  647   HG22  ILE  85          HG22      ILE  85  -0.393  -5.406   4.137
  648   HG23  ILE  85          HG23      ILE  85  -0.702  -6.723   2.983
  649   HD11  ILE  85          HD11      ILE  85   3.122  -4.976   0.862
  650   HD12  ILE  85          HD12      ILE  85   3.095  -6.508  -0.045
  651   HD13  ILE  85          HD13      ILE  85   1.860  -5.278  -0.354
  652    H    ALA  86           H        ALA  86   0.040  -2.473   3.315
  653    HA   ALA  86           HA       ALA  86   0.842  -0.312   1.634
  654    HB1  ALA  86           HB1      ALA  86   1.181  -0.638   4.645
  655    HB2  ALA  86           HB2      ALA  86   1.150   0.889   3.732
  656    HB3  ALA  86           HB3      ALA  86  -0.307  -0.111   3.840
  657    H    GLY  87           H        GLY  87   2.871   0.752   1.480
  658    HA2  GLY  87           HA2      GLY  87   5.208   1.050   1.624
  659    HA3  GLY  87           HA3      GLY  87   5.327  -0.345   2.698
  660    H    SER  88           H        SER  88   3.589  -1.443   0.078
  661    HA   SER  88           HA       SER  88   5.934  -2.585  -1.288
  662    HB2  SER  88           HB2      SER  88   4.300  -3.710  -2.710
  663    HB3  SER  88           HB3      SER  88   4.057  -4.043  -0.998
  664    HG   SER  88           HG       SER  88   2.205  -2.836  -1.012
  665    H    ILE  89           H        ILE  89   6.413  -2.252  -3.491
  666    HA   ILE  89           HA       ILE  89   5.801   0.533  -4.386
  667    HB   ILE  89           HB       ILE  89   8.218  -0.996  -5.298
  668   HG12  ILE  89          HG12      ILE  89   8.419  -1.200  -2.882
  669   HG13  ILE  89          HG13      ILE  89   9.605  -0.100  -3.547
  670   HG21  ILE  89          HG21      ILE  89   9.135   1.313  -5.479
  671   HG22  ILE  89          HG22      ILE  89   7.679   1.083  -6.452
  672   HG23  ILE  89          HG23      ILE  89   7.581   1.964  -4.917
  673   HD11  ILE  89          HD11      ILE  89   7.075   0.837  -2.133
  674   HD12  ILE  89          HD12      ILE  89   8.673   0.671  -1.386
  675   HD13  ILE  89          HD13      ILE  89   8.436   1.835  -2.695
  676    H    ASN  90           H        ASN  90   5.010   0.981  -6.372
  677    HA   ASN  90           HA       ASN  90   4.084  -1.290  -8.009
  678    HB2  ASN  90           HB2      ASN  90   2.559   0.573  -7.054
  679    HB3  ASN  90           HB3      ASN  90   3.320   1.653  -8.218
  680   HD21  ASN  90          HD22      ASN  90   1.951   1.854 -10.005
  681   HD22  ASN  90          HD21      ASN  90   1.136   0.432 -10.687
  682    H    GLN  91           H        GLN  91   4.425  -1.486 -10.217
  683    HA   GLN  91           HA       GLN  91   6.765  -0.058 -11.293
  684    HB2  GLN  91           HB2      GLN  91   6.585  -2.568 -11.210
  685    HB3  GLN  91           HB3      GLN  91   5.318  -2.475 -12.419
  686    HG2  GLN  91           HG2      GLN  91   7.205  -2.873 -13.710
  687    HG3  GLN  91           HG3      GLN  91   7.101  -1.118 -13.837
  688   HE21  GLN  91          HE22      GLN  91   8.720   0.183 -12.536
  689   HE22  GLN  91          HE21      GLN  91  10.087  -0.648 -11.810
  690    H    ASN  92           H        ASN  92   4.108  -1.288 -13.297
  691    HA   ASN  92           HA       ASN  92   3.188   1.304 -14.293
  692    HB2  ASN  92           HB2      ASN  92   5.179   0.973 -15.682
  693    HB3  ASN  92           HB3      ASN  92   4.766  -0.709 -15.978
  694   HD21  ASN  92          HD22      ASN  92   3.731   2.552 -16.869
  695   HD22  ASN  92          HD21      ASN  92   2.627   1.883 -18.068
  696    H    GLY  93           H        GLY  93   1.057   0.891 -15.539
  697    HA2  GLY  93           HA2      GLY  93  -0.470  -0.686 -16.350
  698    HA3  GLY  93           HA3      GLY  93  -0.019  -1.841 -15.116
  699    H    SER  94           H        SER  94  -0.495   1.532 -14.372
  700    HA   SER  94           HA       SER  94  -1.837   2.396 -12.600
  701    HB2  SER  94           HB2      SER  94  -2.009   3.242 -14.982
  702    HB3  SER  94           HB3      SER  94  -3.549   2.382 -15.087
  703    HG   SER  94           HG       SER  94  -3.760   4.558 -14.463
  704    H    LEU  95           H        LEU  95  -2.646   1.291 -10.920
  705    HA   LEU  95           HA       LEU  95  -5.082  -0.401 -11.258
  706    HB2  LEU  95           HB2      LEU  95  -3.266  -0.131  -8.863
  707    HB3  LEU  95           HB3      LEU  95  -4.563  -1.283  -9.041
  708    HG   LEU  95           HG       LEU  95  -1.893  -1.250 -10.485
  709   HD11  LEU  95          HD11      LEU  95  -1.389  -3.195  -9.123
  710   HD12  LEU  95          HD12      LEU  95  -1.885  -1.864  -8.072
  711   HD13  LEU  95          HD13      LEU  95  -3.024  -3.174  -8.421
  712   HD21  LEU  95          HD21      LEU  95  -2.723  -3.673 -11.068
  713   HD22  LEU  95          HD22      LEU  95  -4.334  -3.036 -10.753
  714   HD23  LEU  95          HD23      LEU  95  -3.336  -2.278 -12.008
  715    H    LEU  96           H        LEU  96  -6.830  -0.206  -9.881
  716    HA   LEU  96           HA       LEU  96  -6.968   2.189  -8.085
  717    HB2  LEU  96           HB2      LEU  96  -9.245   0.998  -9.715
  718    HB3  LEU  96           HB3      LEU  96  -9.444   2.054  -8.335
  719    HG   LEU  96           HG       LEU  96  -8.089   3.826  -9.537
  720   HD11  LEU  96          HD11      LEU  96  -8.214   3.666 -12.080
  721   HD12  LEU  96          HD12      LEU  96  -6.992   2.625 -11.347
  722   HD13  LEU  96          HD13      LEU  96  -8.539   1.950 -11.901
  723   HD21  LEU  96          HD21      LEU  96 -10.554   3.867  -9.344
  724   HD22  LEU  96          HD22      LEU  96 -10.000   4.548 -10.883
  725   HD23  LEU  96          HD23      LEU  96 -10.681   2.908 -10.841
  726    H    ILE  97           H        ILE  97  -7.091   1.697  -6.039
  727    HA   ILE  97           HA       ILE  97  -7.747  -1.096  -5.212
  728    HB   ILE  97           HB       ILE  97  -5.924   0.906  -3.824
  729   HG12  ILE  97          HG12      ILE  97  -4.183  -0.966  -4.683
  730   HG13  ILE  97          HG13      ILE  97  -5.332  -1.087  -6.009
  731   HG21  ILE  97          HG21      ILE  97  -6.199  -2.112  -3.487
  732   HG22  ILE  97          HG22      ILE  97  -5.134  -1.032  -2.571
  733   HG23  ILE  97          HG23      ILE  97  -6.880  -0.897  -2.379
  734   HD11  ILE  97          HD11      ILE  97  -3.916   1.462  -5.097
  735   HD12  ILE  97          HD12      ILE  97  -3.454   0.458  -6.483
  736   HD13  ILE  97          HD13      ILE  97  -4.980   1.331  -6.514
  737    H    CYS  98           H        CYS  98  -9.375  -1.414  -3.799
  738    HA   CYS  98           HA       CYS  98 -10.715   0.930  -2.554
  739    HB2  CYS  98           HB2      CYS  98 -12.459  -0.619  -1.875
  740    HB3  CYS  98           HB3      CYS  98 -12.210  -0.628  -3.618
  741    HG   CYS  98           HG       CYS  98 -10.553  -2.797  -3.522
  742    H    ALA  99           H        ALA  99 -10.113   1.624  -0.615
  743    HA   ALA  99           HA       ALA  99  -8.208   0.060   0.981
  744    HB1  ALA  99           HB1      ALA  99  -9.455   2.814   1.380
  745    HB2  ALA  99           HB2      ALA  99  -8.150   2.109   2.359
  746    HB3  ALA  99           HB3      ALA  99  -7.872   2.472   0.643
  747    H    THR 100           H        THR 100  -8.780  -1.224   2.587
  748    HA   THR 100           HA       THR 100 -11.430  -0.792   3.950
  749    HB   THR 100           HB       THR 100 -11.161  -2.801   2.376
  750    HG1  THR 100           HG1      THR 100 -12.911  -2.467   3.689
  751   HG21  THR 100          HG21      THR 100 -10.338  -4.844   3.291
  752   HG22  THR 100          HG22      THR 100  -9.032  -3.657   3.426
  753   HG23  THR 100          HG23      THR 100  -9.993  -4.093   4.860
  754    H    HIS 101           H        HIS 101  -8.248  -0.401   4.609
  755    HA   HIS 101           HA       HIS 101  -8.957  -0.261   7.474
  756    HB2  HIS 101           HB2      HIS 101  -6.430  -1.501   6.326
  757    HB3  HIS 101           HB3      HIS 101  -6.624  -0.991   7.997
  758    HD1  HIS 101           HD1      HIS 101  -7.237  -3.937   5.839
  759    HD2  HIS 101           HD2      HIS 101  -8.732  -2.289   9.412
  760    HE1  HIS 101           HE1      HIS 101  -8.630  -5.779   6.962
  761    H    VAL 102           H        VAL 102  -7.945   1.365   8.602
  762    HA   VAL 102           HA       VAL 102  -6.638   3.559   7.094
  763    HB   VAL 102           HB       VAL 102  -6.883   4.814   9.237
  764   HG11  VAL 102          HG11      VAL 102  -9.491   3.666   8.173
  765   HG12  VAL 102          HG12      VAL 102  -9.262   5.207   9.023
  766   HG13  VAL 102          HG13      VAL 102  -8.551   4.977   7.420
  767   HG21  VAL 102          HG21      VAL 102  -6.976   2.842  10.792
  768   HG22  VAL 102          HG22      VAL 102  -8.307   3.982  11.004
  769   HG23  VAL 102          HG23      VAL 102  -8.595   2.457  10.150
  770    H    GLY 103           H        GLY 103  -4.823   4.728   8.708
  771    HA2  GLY 103           HA2      GLY 103  -2.575   3.111   8.037
  772    HA3  GLY 103           HA3      GLY 103  -2.571   4.608   8.963
  773    H    ALA 104           H        ALA 104  -4.168   3.714  11.209
  774    HA   ALA 104           HA       ALA 104  -2.180   2.631  12.877
  775    HB1  ALA 104           HB1      ALA 104  -5.214   2.689  13.190
  776    HB2  ALA 104           HB2      ALA 104  -4.053   2.433  14.507
  777    HB3  ALA 104           HB3      ALA 104  -4.079   3.983  13.644
  778    H    ASP 105           H        ASP 105  -4.381   0.853  10.845
  779    HA   ASP 105           HA       ASP 105  -4.021  -1.717  12.287
  780    HB2  ASP 105           HB2      ASP 105  -6.213  -1.043  11.177
  781    HB3  ASP 105           HB3      ASP 105  -5.368  -1.233   9.637
  782    H    THR 106           H        THR 106  -2.111   0.063  10.124
  783    HA   THR 106           HA       THR 106  -1.676  -2.004   8.143
  784    HB   THR 106           HB       THR 106   0.170  -0.634   7.254
  785    HG1  THR 106           HG1      THR 106  -0.599   1.146   9.319
  786   HG21  THR 106          HG21      THR 106  -2.073  -0.315   6.394
  787   HG22  THR 106          HG22      THR 106  -2.466   0.813   7.702
  788   HG23  THR 106          HG23      THR 106  -1.234   1.245   6.490
  789    H    THR 107           H        THR 107  -0.190  -3.527   7.912
  790    HA   THR 107           HA       THR 107   0.774  -4.596  10.323
  791    HB   THR 107           HB       THR 107   0.085  -5.864   8.275
  792    HG1  THR 107           HG1      THR 107   1.845  -7.467   8.719
  793   HG21  THR 107          HG21      THR 107   2.996  -5.546   7.430
  794   HG22  THR 107          HG22      THR 107   1.753  -6.560   6.670
  795   HG23  THR 107          HG23      THR 107   1.605  -4.799   6.604
  796    H    LEU 108           H        LEU 108   2.545  -2.492   8.180
  797    HA   LEU 108           HA       LEU 108   5.213  -3.039   8.966
  798    HB2  LEU 108           HB2      LEU 108   3.738  -0.482   8.220
  799    HB3  LEU 108           HB3      LEU 108   5.465  -0.508   8.562
  800    HG   LEU 108           HG       LEU 108   5.898  -1.985   6.666
  801   HD11  LEU 108          HD11      LEU 108   2.899  -1.803   6.132
  802   HD12  LEU 108          HD12      LEU 108   4.112  -2.372   4.971
  803   HD13  LEU 108          HD13      LEU 108   3.842  -3.299   6.430
  804   HD21  LEU 108          HD21      LEU 108   5.805   0.468   6.409
  805   HD22  LEU 108          HD22      LEU 108   5.302  -0.354   4.925
  806   HD23  LEU 108          HD23      LEU 108   4.076   0.356   6.005
  807    H    SER 109           H        SER 109   2.767  -0.969  10.542
  808    HA   SER 109           HA       SER 109   4.415  -0.135  12.752
  809    HB2  SER 109           HB2      SER 109   2.417   0.762  13.671
  810    HB3  SER 109           HB3      SER 109   2.305   0.998  11.923
  811    HG   SER 109           HG       SER 109   0.891  -0.818  11.834
  812    H    GLN 110           H        GLN 110   2.560  -2.976  12.113
  813    HA   GLN 110           HA       GLN 110   2.385  -3.927  14.889
  814    HB2  GLN 110           HB2      GLN 110   0.708  -4.415  13.011
  815    HB3  GLN 110           HB3      GLN 110   1.884  -5.525  12.355
  816    HG2  GLN 110           HG2      GLN 110   0.429  -6.875  13.594
  817    HG3  GLN 110           HG3      GLN 110   1.876  -6.755  14.600
  818   HE21  GLN 110          HE22      GLN 110  -1.251  -4.999  14.014
  819   HE22  GLN 110          HE21      GLN 110  -1.437  -4.508  15.669
  820    H    ILE 111           H        ILE 111   4.267  -4.811  11.997
  821    HA   ILE 111           HA       ILE 111   5.695  -7.016  12.958
  822    HB   ILE 111           HB       ILE 111   6.343  -4.889  10.891
  823   HG12  ILE 111          HG12      ILE 111   5.716  -7.853  10.513
  824   HG13  ILE 111          HG13      ILE 111   4.446  -6.652  10.627
  825   HG21  ILE 111          HG21      ILE 111   7.958  -7.424  11.413
  826   HG22  ILE 111          HG22      ILE 111   8.164  -6.343  10.026
  827   HG23  ILE 111          HG23      ILE 111   8.544  -5.758  11.634
  828   HD11  ILE 111          HD11      ILE 111   5.401  -5.446   8.656
  829   HD12  ILE 111          HD12      ILE 111   6.595  -6.755   8.473
  830   HD13  ILE 111          HD13      ILE 111   4.869  -7.102   8.302
  831    H    VAL 112           H        VAL 112   6.836  -3.563  13.069
  832    HA   VAL 112           HA       VAL 112   9.197  -4.153  14.439
  833    HB   VAL 112           HB       VAL 112   9.285  -1.782  15.050
  834   HG11  VAL 112          HG11      VAL 112   8.287  -2.212  12.207
  835   HG12  VAL 112          HG12      VAL 112   9.334  -0.903  12.794
  836   HG13  VAL 112          HG13      VAL 112   9.934  -2.566  12.783
  837   HG21  VAL 112          HG21      VAL 112   7.565  -0.223  14.403
  838   HG22  VAL 112          HG22      VAL 112   6.525  -1.520  13.787
  839   HG23  VAL 112          HG23      VAL 112   6.864  -1.384  15.531
  840    H    LYS 113           H        LYS 113   6.044  -4.192  15.887
  841    HA   LYS 113           HA       LYS 113   7.041  -3.832  18.653
  842    HB2  LYS 113           HB2      LYS 113   4.380  -4.924  17.725
  843    HB3  LYS 113           HB3      LYS 113   4.837  -4.445  19.367
  844    HG2  LYS 113           HG2      LYS 113   5.251  -2.090  18.448
  845    HG3  LYS 113           HG3      LYS 113   4.460  -2.635  16.965
  846    HD2  LYS 113           HD2      LYS 113   3.272  -2.471  19.752
  847    HD3  LYS 113           HD3      LYS 113   2.814  -1.514  18.330
  848    HE2  LYS 113           HE2      LYS 113   2.077  -3.660  17.215
  849    HE3  LYS 113           HE3      LYS 113   2.467  -4.516  18.712
  850    HZ1  LYS 113           HZ1      LYS 113   0.806  -3.096  19.847
  851    HZ2  LYS 113           HZ2      LYS 113   0.372  -2.431  18.398
  852    HZ3  LYS 113           HZ3      LYS 113   0.148  -4.043  18.713
  853    H    LEU 114           H        LEU 114   6.498  -6.434  16.373
  854    HA   LEU 114           HA       LEU 114   6.603  -8.637  18.345
  855    HB2  LEU 114           HB2      LEU 114   5.078  -8.256  16.148
  856    HB3  LEU 114           HB3      LEU 114   6.478  -8.958  15.341
  857    HG   LEU 114           HG       LEU 114   4.787 -10.201  17.541
  858   HD11  LEU 114          HD11      LEU 114   5.147 -10.931  14.608
  859   HD12  LEU 114          HD12      LEU 114   4.104 -11.767  15.772
  860   HD13  LEU 114          HD13      LEU 114   3.735 -10.100  15.301
  861   HD21  LEU 114          HD21      LEU 114   6.996 -11.037  17.843
  862   HD22  LEU 114          HD22      LEU 114   6.113 -12.293  16.957
  863   HD23  LEU 114          HD23      LEU 114   7.244 -11.241  16.082
  864    H    VAL 115           H        VAL 115   8.456  -7.497  15.485
  865    HA   VAL 115           HA       VAL 115  10.521  -9.495  15.809
  866    HB   VAL 115           HB       VAL 115  10.393  -6.991  14.092
  867   HG11  VAL 115          HG11      VAL 115  12.303  -9.369  13.949
  868   HG12  VAL 115          HG12      VAL 115  12.133  -8.112  12.704
  869   HG13  VAL 115          HG13      VAL 115  12.738  -7.679  14.299
  870   HG21  VAL 115          HG21      VAL 115   8.637  -8.643  13.527
  871   HG22  VAL 115          HG22      VAL 115   9.885  -8.628  12.278
  872   HG23  VAL 115          HG23      VAL 115   9.853  -9.936  13.474
  873    H    GLU 116           H        GLU 116  10.065  -6.327  17.245
  874    HA   GLU 116           HA       GLU 116  12.764  -5.833  18.075
  875    HB2  GLU 116           HB2      GLU 116  10.938  -4.247  18.207
  876    HB3  GLU 116           HB3      GLU 116  10.116  -5.184  19.450
  877    HG2  GLU 116           HG2      GLU 116  12.960  -4.255  19.908
  878    HG3  GLU 116           HG3      GLU 116  11.678  -3.053  19.933
  879    H    GLU 117           H        GLU 117  10.375  -8.291  19.245
  880    HA   GLU 117           HA       GLU 117  11.850  -8.835  21.709
  881    HB2  GLU 117           HB2      GLU 117   9.472 -10.113  20.290
  882    HB3  GLU 117           HB3      GLU 117  10.092 -10.618  21.856
  883    HG2  GLU 117           HG2      GLU 117   9.170  -7.742  21.448
  884    HG3  GLU 117           HG3      GLU 117   8.013  -9.041  21.593
  885    H    ALA 118           H        ALA 118  12.220  -9.547  18.421
  886    HA   ALA 118           HA       ALA 118  13.028 -12.391  18.690
  887    HB1  ALA 118           HB1      ALA 118  12.955 -10.672  16.188
  888    HB2  ALA 118           HB2      ALA 118  13.200 -12.421  16.290
  889    HB3  ALA 118           HB3      ALA 118  11.637 -11.726  16.746
  890    H    GLN 119           H        GLN 119  14.441  -9.223  18.539
  891    HA   GLN 119           HA       GLN 119  17.095  -9.767  17.635
  892    HB2  GLN 119           HB2      GLN 119  15.940  -7.659  19.469
  893    HB3  GLN 119           HB3      GLN 119  17.561  -7.570  18.771
  894    HG2  GLN 119           HG2      GLN 119  14.886  -6.919  17.641
  895    HG3  GLN 119           HG3      GLN 119  16.440  -6.129  17.380
  896   HE21  GLN 119          HE22      GLN 119  14.159  -8.368  16.185
  897   HE22  GLN 119          HE21      GLN 119  15.275  -9.492  15.557
  Start of MODEL    8
    1    H    SER   1           H        SER   1  18.079  -4.326  15.526
    2    HA   SER   1           HA       SER   1  15.356  -3.203  15.932
    3    HB2  SER   1           HB2      SER   1  18.048  -2.373  17.058
    4    HB3  SER   1           HB3      SER   1  16.483  -1.643  17.452
    5    HG   SER   1           HG       SER   1  17.070  -3.156  19.009
    6    H    GLU   2           H        GLU   2  18.412  -2.627  14.210
    7    HA   GLU   2           HA       GLU   2  17.616  -0.069  13.111
    8    HB2  GLU   2           HB2      GLU   2  19.996  -1.107  13.399
    9    HB3  GLU   2           HB3      GLU   2  19.657  -1.968  11.895
   10    HG2  GLU   2           HG2      GLU   2  19.201   0.213  10.780
   11    HG3  GLU   2           HG3      GLU   2  19.472   1.039  12.317
   12    H    ALA   3           H        ALA   3  17.071  -3.445  12.156
   13    HA   ALA   3           HA       ALA   3  15.996  -2.836   9.513
   14    HB1  ALA   3           HB1      ALA   3  15.769  -5.287  11.316
   15    HB2  ALA   3           HB2      ALA   3  15.319  -5.204   9.602
   16    HB3  ALA   3           HB3      ALA   3  17.013  -5.025  10.077
   17    H    LEU   4           H        LEU   4  14.811  -2.782  12.820
   18    HA   LEU   4           HA       LEU   4  12.025  -3.196  12.473
   19    HB2  LEU   4           HB2      LEU   4  13.420  -3.100  14.550
   20    HB3  LEU   4           HB3      LEU   4  13.325  -1.342  14.473
   21    HG   LEU   4           HG       LEU   4  10.775  -2.979  14.396
   22   HD11  LEU   4          HD11      LEU   4  12.342  -2.202  16.881
   23   HD12  LEU   4          HD12      LEU   4  10.732  -2.972  16.834
   24   HD13  LEU   4          HD13      LEU   4  12.155  -3.840  16.219
   25   HD21  LEU   4          HD21      LEU   4  11.475  -0.234  15.558
   26   HD22  LEU   4          HD22      LEU   4  10.488  -0.538  14.115
   27   HD23  LEU   4          HD23      LEU   4   9.898  -1.029  15.701
   28    H    ALA   5           H        ALA   5  14.076  -0.249  11.797
   29    HA   ALA   5           HA       ALA   5  11.797   1.552  11.831
   30    HB1  ALA   5           HB1      ALA   5  13.968   2.207  12.764
   31    HB2  ALA   5           HB2      ALA   5  14.764   1.879  11.207
   32    HB3  ALA   5           HB3      ALA   5  13.568   3.190  11.344
   33    H    LYS   6           H        LYS   6  13.235  -0.667   9.542
   34    HA   LYS   6           HA       LYS   6  12.894   0.996   7.187
   35    HB2  LYS   6           HB2      LYS   6  14.453  -0.916   7.322
   36    HB3  LYS   6           HB3      LYS   6  13.086  -2.041   7.409
   37    HG2  LYS   6           HG2      LYS   6  12.374  -1.500   5.185
   38    HG3  LYS   6           HG3      LYS   6  13.392  -0.050   5.126
   39    HD2  LYS   6           HD2      LYS   6  15.426  -1.416   5.122
   40    HD3  LYS   6           HD3      LYS   6  14.461  -2.909   5.221
   41    HE2  LYS   6           HE2      LYS   6  13.446  -2.496   3.065
   42    HE3  LYS   6           HE3      LYS   6  14.063  -0.846   3.020
   43    HZ1  LYS   6           HZ1      LYS   6  16.273  -1.661   2.775
   44    HZ2  LYS   6           HZ2      LYS   6  15.799  -3.251   2.904
   45    HZ3  LYS   6           HZ3      LYS   6  15.325  -2.352   1.621
   46    H    LEU   7           H        LEU   7  10.775  -1.203   8.951
   47    HA   LEU   7           HA       LEU   7   8.517  -1.124   7.163
   48    HB2  LEU   7           HB2      LEU   7   8.883  -1.576  10.129
   49    HB3  LEU   7           HB3      LEU   7   7.282  -1.552   9.416
   50    HG   LEU   7           HG       LEU   7   8.101  -3.817   9.789
   51   HD11  LEU   7          HD11      LEU   7   7.548  -4.772   7.628
   52   HD12  LEU   7          HD12      LEU   7   6.503  -3.393   7.985
   53   HD13  LEU   7          HD13      LEU   7   7.834  -3.223   6.815
   54   HD21  LEU   7          HD21      LEU   7  10.530  -3.458   9.364
   55   HD22  LEU   7          HD22      LEU   7   9.847  -4.844   8.500
   56   HD23  LEU   7          HD23      LEU   7  10.169  -3.343   7.617
   57    H    ILE   8           H        ILE   8   9.720   1.220   9.531
   58    HA   ILE   8           HA       ILE   8   7.441   2.998   9.232
   59    HB   ILE   8           HB       ILE   8  10.168   3.590  10.370
   60   HG12  ILE   8          HG12      ILE   8   9.075   1.884  11.632
   61   HG13  ILE   8          HG13      ILE   8   9.023   3.392  12.543
   62   HG21  ILE   8          HG21      ILE   8   7.612   5.232  10.377
   63   HG22  ILE   8          HG22      ILE   8   9.043   5.549  11.386
   64   HG23  ILE   8          HG23      ILE   8   9.171   5.650   9.626
   65   HD11  ILE   8          HD11      ILE   8   6.933   2.225  12.816
   66   HD12  ILE   8          HD12      ILE   8   6.598   3.626  11.781
   67   HD13  ILE   8          HD13      ILE   8   6.737   1.994  11.085
   68    H    SER   9           H        SER   9  10.611   2.657   7.559
   69    HA   SER   9           HA       SER   9  10.398   5.113   6.062
   70    HB2  SER   9           HB2      SER   9  11.852   2.538   5.298
   71    HB3  SER   9           HB3      SER   9  12.142   4.152   4.642
   72    HG   SER   9           HG       SER   9  13.632   3.422   6.274
   73    H    LEU  10           H        LEU  10   9.134   1.854   5.644
   74    HA   LEU  10           HA       LEU  10   8.392   2.032   2.850
   75    HB2  LEU  10           HB2      LEU  10   7.883   0.154   5.182
   76    HB3  LEU  10           HB3      LEU  10   7.084  -0.110   3.647
   77    HG   LEU  10           HG       LEU  10  10.112   0.206   3.762
   78   HD11  LEU  10          HD11      LEU  10   8.518  -2.356   4.112
   79   HD12  LEU  10          HD12      LEU  10  10.258  -2.262   3.770
   80   HD13  LEU  10          HD13      LEU  10   9.621  -1.629   5.290
   81   HD21  LEU  10          HD21      LEU  10   8.941   0.301   1.551
   82   HD22  LEU  10          HD22      LEU  10  10.050  -1.062   1.697
   83   HD23  LEU  10          HD23      LEU  10   8.303  -1.331   1.854
   84    H    GLN  11           H        GLN  11   6.995   3.402   5.638
   85    HA   GLN  11           HA       GLN  11   4.246   3.454   4.578
   86    HB2  GLN  11           HB2      GLN  11   5.555   4.270   7.142
   87    HB3  GLN  11           HB3      GLN  11   3.957   4.884   6.742
   88    HG2  GLN  11           HG2      GLN  11   3.051   2.648   6.450
   89    HG3  GLN  11           HG3      GLN  11   4.642   1.913   6.680
   90   HE21  GLN  11          HE22      GLN  11   5.434   1.657   8.785
   91   HE22  GLN  11          HE21      GLN  11   4.508   2.240  10.184
   92    H    ALA  12           H        ALA  12   3.058   5.459   4.377
   93    HA   ALA  12           HA       ALA  12   4.618   7.334   2.670
   94    HB1  ALA  12           HB1      ALA  12   2.513   7.591   1.429
   95    HB2  ALA  12           HB2      ALA  12   3.000   5.892   1.539
   96    HB3  ALA  12           HB3      ALA  12   1.698   6.513   2.584
   97    H    THR  13           H        THR  13   3.990   9.522   2.434
   98    HA   THR  13           HA       THR  13   2.987  10.881   4.858
   99    HB   THR  13           HB       THR  13   3.577  12.932   3.498
  100    HG1  THR  13           HG1      THR  13   4.672  12.653   1.621
  101   HG21  THR  13          HG21      THR  13   6.004  12.650   3.654
  102   HG22  THR  13          HG22      THR  13   5.215  11.943   5.074
  103   HG23  THR  13          HG23      THR  13   5.826  10.889   3.779
  104    H    GLU  14           H        GLU  14   2.076  10.688   1.403
  105    HA   GLU  14           HA       GLU  14  -0.695  11.468   2.075
  106    HB2  GLU  14           HB2      GLU  14  -0.753  13.188   0.345
  107    HB3  GLU  14           HB3      GLU  14   0.429  13.560   1.600
  108    HG2  GLU  14           HG2      GLU  14   2.243  12.748   0.062
  109    HG3  GLU  14           HG3      GLU  14   1.017  12.460  -1.177
  110    H    ALA  15           H        ALA  15  -2.263  11.129   0.382
  111    HA   ALA  15           HA       ALA  15  -1.540   9.189  -1.742
  112    HB1  ALA  15           HB1      ALA  15  -3.288   7.623  -1.001
  113    HB2  ALA  15           HB2      ALA  15  -2.060   7.834   0.262
  114    HB3  ALA  15           HB3      ALA  15  -3.635   8.650   0.409
  115    H    THR  16           H        THR  16  -3.175   8.916  -3.358
  116    HA   THR  16           HA       THR  16  -4.955  11.295  -3.650
  117    HB   THR  16           HB       THR  16  -3.975   9.362  -5.761
  118    HG1  THR  16           HG1      THR  16  -2.398  10.802  -5.001
  119   HG21  THR  16          HG21      THR  16  -6.168  10.312  -6.410
  120   HG22  THR  16          HG22      THR  16  -5.601  11.941  -5.978
  121   HG23  THR  16          HG23      THR  16  -4.873  11.060  -7.347
  122    H    ILE  17           H        ILE  17  -6.951  11.018  -2.885
  123    HA   ILE  17           HA       ILE  17  -8.427   8.453  -3.091
  124    HB   ILE  17           HB       ILE  17  -9.325  11.195  -2.105
  125   HG12  ILE  17          HG12      ILE  17  -8.453   8.770  -0.495
  126   HG13  ILE  17          HG13      ILE  17  -7.581  10.290  -0.637
  127   HG21  ILE  17          HG21      ILE  17 -10.694   8.475  -1.883
  128   HG22  ILE  17          HG22      ILE  17 -11.284   9.996  -1.167
  129   HG23  ILE  17          HG23      ILE  17 -11.232   9.838  -2.894
  130   HD11  ILE  17          HD11      ILE  17 -10.259   9.865   0.752
  131   HD12  ILE  17          HD12      ILE  17  -8.707  10.187   1.497
  132   HD13  ILE  17          HD13      ILE  17  -9.478  11.450   0.508
  133    H    VAL  18           H        VAL  18 -10.053   8.088  -4.611
  134    HA   VAL  18           HA       VAL  18 -10.670  10.339  -6.500
  135    HB   VAL  18           HB       VAL  18 -10.390   7.476  -7.377
  136   HG11  VAL  18          HG11      VAL  18 -10.847  10.045  -8.933
  137   HG12  VAL  18          HG12      VAL  18 -10.485   8.463  -9.654
  138   HG13  VAL  18          HG13      VAL  18 -11.985   8.693  -8.762
  139   HG21  VAL  18          HG21      VAL  18  -8.447   9.774  -7.561
  140   HG22  VAL  18          HG22      VAL  18  -8.184   8.161  -6.894
  141   HG23  VAL  18          HG23      VAL  18  -8.382   8.366  -8.641
  142    H    THR  19           H        THR  19 -12.619  10.771  -6.996
  143    HA   THR  19           HA       THR  19 -14.906   9.320  -5.718
  144    HB   THR  19           HB       THR  19 -14.520  12.322  -6.057
  145    HG1  THR  19           HG1      THR  19 -13.685  12.461  -4.212
  146   HG21  THR  19          HG21      THR  19 -16.492  10.702  -4.387
  147   HG22  THR  19          HG22      THR  19 -16.272  12.465  -4.277
  148   HG23  THR  19          HG23      THR  19 -16.873  11.754  -5.773
  149    H    LEU  20           H        LEU  20 -16.789   9.144  -6.910
  150    HA   LEU  20           HA       LEU  20 -16.916  10.423  -9.611
  151    HB2  LEU  20           HB2      LEU  20 -18.655   8.217  -8.450
  152    HB3  LEU  20           HB3      LEU  20 -18.723   8.864 -10.085
  153    HG   LEU  20           HG       LEU  20 -16.365   7.331  -8.903
  154   HD11  LEU  20          HD11      LEU  20 -18.488   6.482 -10.915
  155   HD12  LEU  20          HD12      LEU  20 -17.094   5.518 -10.389
  156   HD13  LEU  20          HD13      LEU  20 -18.370   5.934  -9.234
  157   HD21  LEU  20          HD21      LEU  20 -15.569   7.216 -11.247
  158   HD22  LEU  20          HD22      LEU  20 -16.894   8.288 -11.754
  159   HD23  LEU  20          HD23      LEU  20 -15.624   8.882 -10.665
  160    H    ASP  21           H        ASP  21 -18.305  12.085  -9.977
  161    HA   ASP  21           HA       ASP  21 -20.139  12.903  -7.754
  162    HB2  ASP  21           HB2      ASP  21 -17.705  14.177  -8.577
  163    HB3  ASP  21           HB3      ASP  21 -18.995  15.181  -9.137
  164    H    SER  22           H        SER  22 -20.827  11.565 -10.363
  165    HA   SER  22           HA       SER  22 -23.114  13.319 -10.928
  166    HB2  SER  22           HB2      SER  22 -21.201  12.752 -13.215
  167    HB3  SER  22           HB3      SER  22 -22.841  13.387 -13.398
  168    HG   SER  22           HG       SER  22 -21.431  14.771 -11.529
  169    H    ASP  23           H        ASP  23 -21.768  10.741 -12.994
  170    HA   ASP  23           HA       ASP  23 -23.622   8.733 -12.189
  171    HB2  ASP  23           HB2      ASP  23 -25.218  10.235 -13.443
  172    HB3  ASP  23           HB3      ASP  23 -24.239  10.030 -14.892
  173    H    ASN  24           H        ASN  24 -21.113   8.510 -12.160
  174    HA   ASN  24           HA       ASN  24 -19.167   7.560 -12.789
  175    HB2  ASN  24           HB2      ASN  24 -20.428   5.563 -13.114
  176    HB3  ASN  24           HB3      ASN  24 -20.950   6.051 -14.718
  177   HD21  ASN  24          HD22      ASN  24 -18.635   4.206 -13.132
  178   HD22  ASN  24          HD21      ASN  24 -17.720   3.980 -14.645
  179    H    ILE  25           H        ILE  25 -20.833   9.184 -15.455
  180    HA   ILE  25           HA       ILE  25 -18.708   9.526 -17.230
  181    HB   ILE  25           HB       ILE  25 -20.003  11.446 -18.069
  182   HG12  ILE  25          HG12      ILE  25 -21.806  11.059 -15.635
  183   HG13  ILE  25          HG13      ILE  25 -20.705  12.414 -15.882
  184   HG21  ILE  25          HG21      ILE  25 -21.939  10.198 -18.743
  185   HG22  ILE  25          HG22      ILE  25 -20.595   9.061 -18.582
  186   HG23  ILE  25          HG23      ILE  25 -21.847   9.143 -17.323
  187   HD11  ILE  25          HD11      ILE  25 -21.983  13.047 -17.940
  188   HD12  ILE  25          HD12      ILE  25 -23.164  11.770 -17.553
  189   HD13  ILE  25          HD13      ILE  25 -22.930  13.127 -16.441
  190    H    LEU  26           H        LEU  26 -18.575  10.676 -14.137
  191    HA   LEU  26           HA       LEU  26 -16.686  12.885 -14.810
  192    HB2  LEU  26           HB2      LEU  26 -18.846  13.859 -14.438
  193    HB3  LEU  26           HB3      LEU  26 -18.986  13.072 -12.866
  194    HG   LEU  26           HG       LEU  26 -16.464  14.662 -13.220
  195   HD11  LEU  26          HD11      LEU  26 -19.183  16.014 -13.072
  196   HD12  LEU  26          HD12      LEU  26 -17.605  16.804 -12.883
  197   HD13  LEU  26          HD13      LEU  26 -18.041  16.064 -14.445
  198   HD21  LEU  26          HD21      LEU  26 -17.104  13.684 -11.057
  199   HD22  LEU  26          HD22      LEU  26 -17.086  15.449 -10.983
  200   HD23  LEU  26          HD23      LEU  26 -18.636  14.594 -11.143
  201    H    LEU  27           H        LEU  27 -14.984  12.731 -13.849
  202    HA   LEU  27           HA       LEU  27 -14.523  11.164 -11.309
  203    HB2  LEU  27           HB2      LEU  27 -12.780  11.373 -13.782
  204    HB3  LEU  27           HB3      LEU  27 -12.099  11.010 -12.207
  205    HG   LEU  27           HG       LEU  27 -13.521   8.997 -12.008
  206   HD11  LEU  27          HD11      LEU  27 -15.403   9.415 -13.496
  207   HD12  LEU  27          HD12      LEU  27 -14.316   9.623 -14.889
  208   HD13  LEU  27          HD13      LEU  27 -14.512   8.037 -14.114
  209   HD21  LEU  27          HD21      LEU  27 -11.207   8.905 -12.867
  210   HD22  LEU  27          HD22      LEU  27 -12.223   7.666 -13.610
  211   HD23  LEU  27          HD23      LEU  27 -11.810   9.135 -14.524
  212    H    SER  28           H        SER  28 -13.560  12.094  -9.670
  213    HA   SER  28           HA       SER  28 -12.200  14.753  -9.859
  214    HB2  SER  28           HB2      SER  28 -14.595  15.040  -9.269
  215    HB3  SER  28           HB3      SER  28 -14.415  13.863  -7.963
  216    HG   SER  28           HG       SER  28 -14.214  15.687  -6.968
  217    H    GLU  29           H        GLU  29 -10.392  14.905  -8.420
  218    HA   GLU  29           HA       GLU  29  -9.879  12.497  -6.714
  219    HB2  GLU  29           HB2      GLU  29  -7.755  14.013  -8.216
  220    HB3  GLU  29           HB3      GLU  29  -7.627  12.474  -7.337
  221    HG2  GLU  29           HG2      GLU  29  -8.954  11.328  -8.985
  222    HG3  GLU  29           HG3      GLU  29  -9.286  12.821  -9.857
  223    H    GLU  30           H        GLU  30  -8.710  12.801  -4.805
  224    HA   GLU  30           HA       GLU  30  -8.038  15.609  -3.959
  225    HB2  GLU  30           HB2      GLU  30  -9.051  13.477  -2.058
  226    HB3  GLU  30           HB3      GLU  30  -8.741  15.167  -1.712
  227    HG2  GLU  30           HG2      GLU  30 -10.962  14.004  -3.419
  228    HG3  GLU  30           HG3      GLU  30 -11.123  14.700  -1.812
  229    H    GLN  31           H        GLN  31  -5.895  15.883  -3.257
  230    HA   GLN  31           HA       GLN  31  -4.265  13.468  -2.681
  231    HB2  GLN  31           HB2      GLN  31  -3.593  16.405  -3.160
  232    HB3  GLN  31           HB3      GLN  31  -2.432  15.156  -2.689
  233    HG2  GLN  31           HG2      GLN  31  -2.822  13.937  -4.741
  234    HG3  GLN  31           HG3      GLN  31  -4.072  15.088  -5.266
  235   HE21  GLN  31          HE21      GLN  31  -0.620  16.062  -4.091
  236   HE22  GLN  31          HE22      GLN  31  -0.659  14.595  -4.732
  237    H    VAL  32           H        VAL  32  -4.417  12.868  -0.548
  238    HA   VAL  32           HA       VAL  32  -4.783  15.009   1.525
  239    HB   VAL  32           HB       VAL  32  -6.169  13.600   2.783
  240   HG11  VAL  32          HG11      VAL  32  -7.184  13.388  -0.072
  241   HG12  VAL  32          HG12      VAL  32  -8.141  13.423   1.419
  242   HG13  VAL  32          HG13      VAL  32  -7.240  14.866   0.919
  243   HG21  VAL  32          HG21      VAL  32  -6.931  11.378   2.110
  244   HG22  VAL  32          HG22      VAL  32  -5.850  11.405   0.694
  245   HG23  VAL  32          HG23      VAL  32  -5.190  11.372   2.345
  246    H    ASP  33           H        ASP  33  -3.858  14.698   3.586
  247    HA   ASP  33           HA       ASP  33  -1.374  13.155   3.658
  248    HB2  ASP  33           HB2      ASP  33  -2.926  14.552   5.867
  249    HB3  ASP  33           HB3      ASP  33  -1.362  13.779   6.082
  250    H    VAL  34           H        VAL  34  -0.942  11.267   4.849
  251    HA   VAL  34           HA       VAL  34  -2.841   9.267   4.492
  252    HB   VAL  34           HB       VAL  34  -0.355   9.069   4.527
  253   HG11  VAL  34          HG11      VAL  34   0.095  10.121   6.717
  254   HG12  VAL  34          HG12      VAL  34  -0.702   8.759   7.544
  255   HG13  VAL  34          HG13      VAL  34   0.770   8.492   6.609
  256   HG21  VAL  34          HG21      VAL  34  -1.739   6.894   6.131
  257   HG22  VAL  34          HG22      VAL  34  -1.838   7.078   4.366
  258   HG23  VAL  34          HG23      VAL  34  -0.278   6.755   5.139
  259    H    GLU  35           H        GLU  35  -2.635  11.208   7.365
  260    HA   GLU  35           HA       GLU  35  -4.143   9.454   9.124
  261    HB2  GLU  35           HB2      GLU  35  -3.762  12.398   9.082
  262    HB3  GLU  35           HB3      GLU  35  -4.590  11.547  10.352
  263    HG2  GLU  35           HG2      GLU  35  -2.448  11.803  11.234
  264    HG3  GLU  35           HG3      GLU  35  -2.438  10.141  10.652
  265    H    LEU  36           H        LEU  36  -5.069  11.432   6.414
  266    HA   LEU  36           HA       LEU  36  -7.832  11.827   7.329
  267    HB2  LEU  36           HB2      LEU  36  -6.419  12.851   4.871
  268    HB3  LEU  36           HB3      LEU  36  -7.906  13.481   5.577
  269    HG   LEU  36           HG       LEU  36  -5.135  13.588   6.887
  270   HD11  LEU  36          HD11      LEU  36  -6.765  15.821   5.662
  271   HD12  LEU  36          HD12      LEU  36  -5.136  15.900   6.380
  272   HD13  LEU  36          HD13      LEU  36  -5.393  15.001   4.884
  273   HD21  LEU  36          HD21      LEU  36  -6.892  13.549   8.604
  274   HD22  LEU  36          HD22      LEU  36  -6.193  15.167   8.468
  275   HD23  LEU  36          HD23      LEU  36  -7.785  14.828   7.749
  276    H    VAL  37           H        VAL  37  -6.362   9.416   5.608
  277    HA   VAL  37           HA       VAL  37  -8.722   8.754   3.924
  278    HB   VAL  37           HB       VAL  37  -6.739   8.409   2.743
  279   HG11  VAL  37          HG11      VAL  37  -5.036   8.357   4.447
  280   HG12  VAL  37          HG12      VAL  37  -5.640   6.811   5.091
  281   HG13  VAL  37          HG13      VAL  37  -4.902   6.895   3.477
  282   HG21  VAL  37          HG21      VAL  37  -8.407   6.609   2.521
  283   HG22  VAL  37          HG22      VAL  37  -6.755   6.040   2.228
  284   HG23  VAL  37          HG23      VAL  37  -7.555   5.654   3.757
  285    H    GLN  38           H        GLN  38 -10.118   7.123   4.403
  286    HA   GLN  38           HA       GLN  38  -9.899   5.874   7.117
  287    HB2  GLN  38           HB2      GLN  38 -12.253   5.981   7.292
  288    HB3  GLN  38           HB3      GLN  38 -11.783   7.518   6.590
  289    HG2  GLN  38           HG2      GLN  38 -12.410   6.451   4.306
  290    HG3  GLN  38           HG3      GLN  38 -13.078   5.115   5.236
  291   HE21  GLN  38          HE22      GLN  38 -14.988   5.507   6.439
  292   HE22  GLN  38          HE21      GLN  38 -15.746   7.112   6.367
  293    H    ARG  39           H        ARG  39 -10.814   3.670   7.333
  294    HA   ARG  39           HA       ARG  39 -10.008   1.860   5.242
  295    HB2  ARG  39           HB2      ARG  39 -10.534   0.139   6.776
  296    HB3  ARG  39           HB3      ARG  39  -9.833   1.467   7.690
  297    HG2  ARG  39           HG2      ARG  39 -12.422   2.105   8.015
  298    HG3  ARG  39           HG3      ARG  39 -12.646   0.400   7.648
  299    HD2  ARG  39           HD2      ARG  39 -11.110  -0.215   9.515
  300    HD3  ARG  39           HD3      ARG  39 -10.867   1.496   9.854
  301    HE   ARG  39           HE       ARG  39 -12.885   1.576  10.980
  302   HH11  ARG  39          HH11      ARG  39 -12.914  -1.488   9.238
  303   HH12  ARG  39          HH12      ARG  39 -14.452  -1.941   9.955
  304   HH21  ARG  39          HH21      ARG  39 -14.694   0.952  11.830
  305   HH22  ARG  39          HH22      ARG  39 -15.456  -0.579  11.386
  306    H    GLY  40           H        GLY  40 -11.777   3.524   4.109
  307    HA2  GLY  40           HA2      GLY  40 -13.783   1.805   2.866
  308    HA3  GLY  40           HA3      GLY  40 -14.466   3.106   3.848
  309    H    ASP  41           H        ASP  41 -11.466   4.114   2.391
  310    HA   ASP  41           HA       ASP  41 -12.900   5.521   0.185
  311    HB2  ASP  41           HB2      ASP  41 -10.173   5.900   1.447
  312    HB3  ASP  41           HB3      ASP  41 -10.735   6.799   0.042
  313    H    ILE  42           H        ILE  42 -11.745   5.741  -1.898
  314    HA   ILE  42           HA       ILE  42 -10.344   3.240  -2.763
  315    HB   ILE  42           HB       ILE  42 -12.011   5.123  -4.435
  316   HG12  ILE  42          HG12      ILE  42 -13.538   3.952  -2.982
  317   HG13  ILE  42          HG13      ILE  42 -13.630   3.313  -4.608
  318   HG21  ILE  42          HG21      ILE  42 -10.627   2.481  -5.079
  319   HG22  ILE  42          HG22      ILE  42 -11.799   3.299  -6.139
  320   HG23  ILE  42          HG23      ILE  42 -10.268   4.082  -5.753
  321   HD11  ILE  42          HD11      ILE  42 -12.266   1.956  -2.259
  322   HD12  ILE  42          HD12      ILE  42 -13.802   1.506  -3.005
  323   HD13  ILE  42          HD13      ILE  42 -12.299   1.327  -3.926
  324    H    ILE  43           H        ILE  43  -8.182   3.549  -3.182
  325    HA   ILE  43           HA       ILE  43  -7.188   6.264  -3.758
  326    HB   ILE  43           HB       ILE  43  -5.792   3.794  -2.661
  327   HG12  ILE  43          HG12      ILE  43  -7.464   4.376  -1.031
  328   HG13  ILE  43          HG13      ILE  43  -5.877   4.811  -0.432
  329   HG21  ILE  43          HG21      ILE  43  -4.182   5.335  -3.627
  330   HG22  ILE  43          HG22      ILE  43  -4.895   6.702  -2.755
  331   HG23  ILE  43          HG23      ILE  43  -4.065   5.405  -1.871
  332   HD11  ILE  43          HD11      ILE  43  -7.893   6.768  -1.616
  333   HD12  ILE  43          HD12      ILE  43  -7.574   6.520   0.098
  334   HD13  ILE  43          HD13      ILE  43  -6.305   7.198  -0.937
  335    H    LYS  44           H        LYS  44  -6.285   6.727  -5.714
  336    HA   LYS  44           HA       LYS  44  -5.523   4.621  -7.626
  337    HB2  LYS  44           HB2      LYS  44  -6.725   6.597  -8.295
  338    HB3  LYS  44           HB3      LYS  44  -5.352   7.622  -7.835
  339    HG2  LYS  44           HG2      LYS  44  -3.937   6.616  -9.505
  340    HG3  LYS  44           HG3      LYS  44  -5.090   5.309  -9.820
  341    HD2  LYS  44           HD2      LYS  44  -5.755   8.222 -10.300
  342    HD3  LYS  44           HD3      LYS  44  -4.955   7.191 -11.514
  343    HE2  LYS  44           HE2      LYS  44  -6.848   5.582 -11.358
  344    HE3  LYS  44           HE3      LYS  44  -7.692   6.688 -10.263
  345    HZ1  LYS  44           HZ1      LYS  44  -6.877   7.384 -13.030
  346    HZ2  LYS  44           HZ2      LYS  44  -8.393   6.883 -12.597
  347    HZ3  LYS  44           HZ3      LYS  44  -7.785   8.314 -12.063
  348    H    VAL  45           H        VAL  45  -3.522   3.848  -8.128
  349    HA   VAL  45           HA       VAL  45  -1.140   5.307  -7.087
  350    HB   VAL  45           HB       VAL  45  -1.660   3.166  -5.957
  351   HG11  VAL  45          HG11      VAL  45  -0.916   1.842  -8.595
  352   HG12  VAL  45          HG12      VAL  45  -1.187   1.034  -7.043
  353   HG13  VAL  45          HG13      VAL  45  -2.528   1.875  -7.837
  354   HG21  VAL  45          HG21      VAL  45   0.645   4.024  -5.962
  355   HG22  VAL  45          HG22      VAL  45   0.624   2.259  -6.006
  356   HG23  VAL  45          HG23      VAL  45   0.983   3.173  -7.485
  357    H    VAL  46           H        VAL  46   0.488   5.830  -8.414
  358    HA   VAL  46           HA       VAL  46  -0.013   5.565 -11.299
  359    HB   VAL  46           HB       VAL  46   1.585   7.357 -11.576
  360   HG11  VAL  46          HG11      VAL  46  -0.196   8.013  -9.209
  361   HG12  VAL  46          HG12      VAL  46   0.416   9.110 -10.463
  362   HG13  VAL  46          HG13      VAL  46  -0.760   7.862 -10.891
  363   HG21  VAL  46          HG21      VAL  46   2.175   7.167  -8.609
  364   HG22  VAL  46          HG22      VAL  46   3.295   6.814  -9.932
  365   HG23  VAL  46          HG23      VAL  46   2.699   8.460  -9.696
  366    HA   PRO  47           HA       PRO  47   3.430   2.875 -12.388
  367    HB2  PRO  47           HB2      PRO  47   4.551   4.143 -14.585
  368    HB3  PRO  47           HB3      PRO  47   3.076   3.132 -14.631
  369    HG2  PRO  47           HG2      PRO  47   3.259   6.155 -14.398
  370    HG3  PRO  47           HG3      PRO  47   2.227   5.190 -15.504
  371    HD2  PRO  47           HD2      PRO  47   1.193   6.168 -13.246
  372    HD3  PRO  47           HD3      PRO  47   0.814   4.496 -13.719
  373    H    GLY  48           H        GLY  48   5.195   2.717 -11.264
  374    HA2  GLY  48           HA2      GLY  48   7.299   3.103 -10.458
  375    HA3  GLY  48           HA3      GLY  48   7.274   4.776 -11.027
  376    H    GLY  49           H        GLY  49   4.389   4.448  -9.368
  377    HA2  GLY  49           HA2      GLY  49   5.348   5.791  -6.962
  378    HA3  GLY  49           HA3      GLY  49   3.687   5.374  -7.371
  379    H    LYS  50           H        LYS  50   4.390   5.129  -4.816
  380    HA   LYS  50           HA       LYS  50   4.753   2.191  -4.314
  381    HB2  LYS  50           HB2      LYS  50   5.241   4.518  -2.416
  382    HB3  LYS  50           HB3      LYS  50   5.436   2.800  -2.047
  383    HG2  LYS  50           HG2      LYS  50   7.190   2.662  -3.848
  384    HG3  LYS  50           HG3      LYS  50   7.088   4.427  -4.022
  385    HD2  LYS  50           HD2      LYS  50   7.673   4.667  -1.595
  386    HD3  LYS  50           HD3      LYS  50   7.806   2.899  -1.482
  387    HE2  LYS  50           HE2      LYS  50   9.580   3.017  -3.296
  388    HE3  LYS  50           HE3      LYS  50   9.541   4.778  -3.145
  389    HZ1  LYS  50           HZ1      LYS  50  10.230   4.567  -0.856
  390    HZ2  LYS  50           HZ2      LYS  50  10.115   2.907  -0.913
  391    HZ3  LYS  50           HZ3      LYS  50  11.279   3.668  -1.756
  392    H    PHE  51           H        PHE  51   3.442   1.136  -2.829
  393    HA   PHE  51           HA       PHE  51   0.698   2.099  -2.657
  394    HB2  PHE  51           HB2      PHE  51   2.069  -0.371  -1.591
  395    HB3  PHE  51           HB3      PHE  51   0.373  -0.018  -1.300
  396    HD1  PHE  51           HD2      PHE  51   2.849  -0.981  -3.870
  397    HD2  PHE  51           HD1      PHE  51  -1.294  -0.141  -3.094
  398    HE1  PHE  51           HE2      PHE  51   2.260  -1.967  -6.048
  399    HE2  PHE  51           HE1      PHE  51  -1.897  -1.168  -5.285
  400    HZ   PHE  51           HZ       PHE  51  -0.114  -2.069  -6.768
  401    HA   PRO  52           HA       PRO  52   1.475   4.044   1.329
  402    HB2  PRO  52           HB2      PRO  52  -0.716   5.592   1.553
  403    HB3  PRO  52           HB3      PRO  52   0.451   5.807   0.213
  404    HG2  PRO  52           HG2      PRO  52  -2.182   4.300   0.156
  405    HG3  PRO  52           HG3      PRO  52  -1.572   5.514  -1.011
  406    HD2  PRO  52           HD2      PRO  52  -1.308   2.782  -1.372
  407    HD3  PRO  52           HD3      PRO  52  -0.155   3.988  -2.017
  408    H    VAL  53           H        VAL  53  -1.070   1.710   1.046
  409    HA   VAL  53           HA       VAL  53  -1.148   1.184   3.890
  410    HB   VAL  53           HB       VAL  53  -3.710   1.042   3.882
  411   HG11  VAL  53          HG11      VAL  53  -2.518   3.830   3.990
  412   HG12  VAL  53          HG12      VAL  53  -3.990   3.244   4.788
  413   HG13  VAL  53          HG13      VAL  53  -2.412   2.616   5.283
  414   HG21  VAL  53          HG21      VAL  53  -4.011   1.587   1.445
  415   HG22  VAL  53          HG22      VAL  53  -4.950   2.611   2.555
  416   HG23  VAL  53          HG23      VAL  53  -3.476   3.250   1.812
  417    H    ASP  54           H        ASP  54  -2.707  -0.884   4.175
  418    HA   ASP  54           HA       ASP  54  -2.137  -2.628   1.831
  419    HB2  ASP  54           HB2      ASP  54  -1.487  -4.329   3.000
  420    HB3  ASP  54           HB3      ASP  54  -0.935  -3.089   4.104
  421    H    GLY  55           H        GLY  55  -3.633  -3.923   0.925
  422    HA2  GLY  55           HA2      GLY  55  -6.306  -4.319   1.824
  423    HA3  GLY  55           HA3      GLY  55  -6.268  -2.802   0.935
  424    H    ARG  56           H        ARG  56  -7.723  -3.759  -0.552
  425    HA   ARG  56           HA       ARG  56  -6.551  -5.793  -2.420
  426    HB2  ARG  56           HB2      ARG  56  -8.546  -6.444  -1.015
  427    HB3  ARG  56           HB3      ARG  56  -9.507  -5.300  -1.957
  428    HG2  ARG  56           HG2      ARG  56  -9.010  -6.580  -4.024
  429    HG3  ARG  56           HG3      ARG  56  -7.919  -7.634  -3.112
  430    HD2  ARG  56           HD2      ARG  56  -9.949  -8.806  -3.459
  431    HD3  ARG  56           HD3      ARG  56  -9.816  -8.443  -1.743
  432    HE   ARG  56           HE       ARG  56 -11.461  -6.611  -2.067
  433   HH11  ARG  56          HH11      ARG  56 -11.673  -9.272  -4.376
  434   HH12  ARG  56          HH12      ARG  56 -13.251  -8.743  -4.892
  435   HH21  ARG  56          HH21      ARG  56 -13.387  -6.128  -2.684
  436   HH22  ARG  56          HH22      ARG  56 -14.073  -6.799  -4.170
  437    H    VAL  57           H        VAL  57  -6.623  -5.593  -4.588
  438    HA   VAL  57           HA       VAL  57  -7.035  -2.900  -5.778
  439    HB   VAL  57           HB       VAL  57  -5.691  -5.444  -6.777
  440   HG11  VAL  57          HG11      VAL  57  -4.974  -4.119  -8.744
  441   HG12  VAL  57          HG12      VAL  57  -6.710  -4.361  -8.726
  442   HG13  VAL  57          HG13      VAL  57  -6.039  -2.787  -8.238
  443   HG21  VAL  57          HG21      VAL  57  -4.531  -2.683  -6.235
  444   HG22  VAL  57          HG22      VAL  57  -4.410  -4.063  -5.123
  445   HG23  VAL  57          HG23      VAL  57  -3.644  -4.148  -6.711
  446    H    ILE  58           H        ILE  58  -8.743  -2.509  -7.067
  447    HA   ILE  58           HA       ILE  58 -10.293  -4.771  -8.251
  448    HB   ILE  58           HB       ILE  58 -12.421  -3.569  -7.476
  449   HG12  ILE  58          HG12      ILE  58 -10.630  -2.576  -5.245
  450   HG13  ILE  58          HG13      ILE  58 -11.051  -1.539  -6.628
  451   HG21  ILE  58          HG21      ILE  58 -11.674  -5.786  -6.653
  452   HG22  ILE  58          HG22      ILE  58 -10.777  -4.979  -5.345
  453   HG23  ILE  58          HG23      ILE  58 -12.538  -4.845  -5.435
  454   HD11  ILE  58          HD11      ILE  58 -12.603  -1.014  -4.882
  455   HD12  ILE  58          HD12      ILE  58 -13.485  -1.893  -6.137
  456   HD13  ILE  58          HD13      ILE  58 -13.017  -2.723  -4.629
  457    H    GLU  59           H        GLU  59  -8.463  -2.787  -9.358
  458    HA   GLU  59           HA       GLU  59  -9.950  -2.436 -11.791
  459    HB2  GLU  59           HB2      GLU  59 -10.528  -0.306 -10.452
  460    HB3  GLU  59           HB3      GLU  59  -8.816   0.068 -10.456
  461    HG2  GLU  59           HG2      GLU  59  -9.940   1.306 -12.213
  462    HG3  GLU  59           HG3      GLU  59  -8.819   0.167 -12.933
  463    H    GLY  60           H        GLY  60  -8.463  -2.764 -13.440
  464    HA2  GLY  60           HA2      GLY  60  -6.547  -2.246 -14.695
  465    HA3  GLY  60           HA3      GLY  60  -5.784  -1.541 -13.281
  466    H    HIS  61           H        HIS  61  -4.061  -2.790 -14.448
  467    HA   HIS  61           HA       HIS  61  -3.596  -5.484 -13.278
  468    HB2  HIS  61           HB2      HIS  61  -3.195  -6.325 -15.744
  469    HB3  HIS  61           HB3      HIS  61  -4.794  -6.328 -15.023
  470    HD1  HIS  61           HD1      HIS  61  -6.676  -5.087 -16.349
  471    HD2  HIS  61           HD2      HIS  61  -2.752  -4.021 -17.468
  472    HE1  HIS  61           HE1      HIS  61  -6.896  -3.456 -18.277
  473    H    SER  62           H        SER  62  -1.720  -4.842 -12.322
  474    HA   SER  62           HA       SER  62   0.503  -3.732 -13.990
  475    HB2  SER  62           HB2      SER  62  -0.928  -2.284 -12.157
  476    HB3  SER  62           HB3      SER  62   0.394  -2.876 -11.154
  477    HG   SER  62           HG       SER  62   1.718  -1.921 -12.980
  478    H    MET  63           H        MET  63   2.719  -3.851 -12.854
  479    HA   MET  63           HA       MET  63   2.958  -6.482 -11.495
  480    HB2  MET  63           HB2      MET  63   3.720  -6.441 -13.802
  481    HB3  MET  63           HB3      MET  63   4.817  -5.095 -13.454
  482    HG2  MET  63           HG2      MET  63   6.242  -6.433 -12.178
  483    HG3  MET  63           HG3      MET  63   5.015  -7.667 -11.876
  484    HE1  MET  63           HE1      MET  63   5.057 -10.018 -14.816
  485    HE2  MET  63           HE2      MET  63   4.841  -9.828 -13.062
  486    HE3  MET  63           HE3      MET  63   3.822  -8.902 -14.192
  487    H    VAL  64           H        VAL  64   3.878  -6.525  -9.606
  488    HA   VAL  64           HA       VAL  64   4.900  -3.998  -8.418
  489    HB   VAL  64           HB       VAL  64   3.123  -6.162  -7.242
  490   HG11  VAL  64          HG11      VAL  64   4.127  -3.610  -5.913
  491   HG12  VAL  64          HG12      VAL  64   2.849  -4.661  -5.292
  492   HG13  VAL  64          HG13      VAL  64   4.495  -5.279  -5.423
  493   HG21  VAL  64          HG21      VAL  64   1.886  -4.712  -8.767
  494   HG22  VAL  64          HG22      VAL  64   1.464  -4.274  -7.111
  495   HG23  VAL  64          HG23      VAL  64   2.597  -3.266  -8.030
  496    H    ASP  65           H        ASP  65   6.566  -3.957  -7.015
  497    HA   ASP  65           HA       ASP  65   8.136  -6.472  -6.604
  498    HB2  ASP  65           HB2      ASP  65   9.348  -4.731  -7.757
  499    HB3  ASP  65           HB3      ASP  65   8.957  -3.555  -6.495
  500    H    GLU  66           H        GLU  66   7.547  -7.448  -4.781
  501    HA   GLU  66           HA       GLU  66   6.932  -5.924  -2.316
  502    HB2  GLU  66           HB2      GLU  66   6.462  -8.852  -2.898
  503    HB3  GLU  66           HB3      GLU  66   5.816  -7.870  -1.559
  504    HG2  GLU  66           HG2      GLU  66   4.559  -6.512  -3.254
  505    HG3  GLU  66           HG3      GLU  66   5.051  -7.680  -4.491
  506    H    SER  67           H        SER  67   9.747  -6.391  -3.195
  507    HA   SER  67           HA       SER  67  11.161  -8.407  -2.196
  508    HB2  SER  67           HB2      SER  67  13.056  -6.778  -2.186
  509    HB3  SER  67           HB3      SER  67  12.046  -6.685  -3.642
  510    HG   SER  67           HG       SER  67  12.654  -4.646  -2.488
  511    H    LEU  68           H        LEU  68   9.605  -6.399   0.080
  512    HA   LEU  68           HA       LEU  68  11.471  -7.295   2.217
  513    HB2  LEU  68           HB2      LEU  68  11.675  -4.825   1.602
  514    HB3  LEU  68           HB3      LEU  68  10.058  -4.604   2.231
  515    HG   LEU  68           HG       LEU  68  11.849  -3.907   3.755
  516   HD11  LEU  68          HD11      LEU  68   9.673  -4.689   4.715
  517   HD12  LEU  68          HD12      LEU  68  10.427  -6.272   5.014
  518   HD13  LEU  68          HD13      LEU  68  11.062  -4.829   5.805
  519   HD21  LEU  68          HD21      LEU  68  13.542  -5.610   3.137
  520   HD22  LEU  68          HD22      LEU  68  13.324  -5.414   4.888
  521   HD23  LEU  68          HD23      LEU  68  12.627  -6.820   4.069
  522    H    ILE  69           H        ILE  69   8.136  -6.162   1.514
  523    HA   ILE  69           HA       ILE  69   7.180  -7.024   4.085
  524    HB   ILE  69           HB       ILE  69   5.285  -6.850   1.740
  525   HG12  ILE  69          HG12      ILE  69   6.399  -4.767   1.534
  526   HG13  ILE  69          HG13      ILE  69   4.843  -4.499   2.275
  527   HG21  ILE  69          HG21      ILE  69   5.023  -6.420   4.752
  528   HG22  ILE  69          HG22      ILE  69   3.732  -6.093   3.589
  529   HG23  ILE  69          HG23      ILE  69   4.327  -7.737   3.793
  530   HD11  ILE  69          HD11      ILE  69   7.501  -4.469   3.733
  531   HD12  ILE  69          HD12      ILE  69   6.497  -3.074   3.270
  532   HD13  ILE  69          HD13      ILE  69   5.908  -4.221   4.489
  533    H    THR  70           H        THR  70   6.555  -8.678   0.915
  534    HA   THR  70           HA       THR  70   5.987 -11.203   2.383
  535    HB   THR  70           HB       THR  70   5.278 -12.048   0.161
  536    HG1  THR  70           HG1      THR  70   4.994 -10.197  -1.395
  537   HG21  THR  70          HG21      THR  70   3.618 -10.929   1.671
  538   HG22  THR  70          HG22      THR  70   3.946  -9.387   0.845
  539   HG23  THR  70          HG23      THR  70   3.238 -10.748  -0.048
  540    H    GLY  71           H        GLY  71   8.608  -9.634   0.845
  541    HA2  GLY  71           HA2      GLY  71  10.803 -10.237   0.809
  542    HA3  GLY  71           HA3      GLY  71  10.375 -11.760   1.587
  543    H    GLU  72           H        GLU  72   8.689 -11.424  -1.265
  544    HA   GLU  72           HA       GLU  72   9.653 -13.702  -2.442
  545    HB2  GLU  72           HB2      GLU  72   8.431 -11.370  -3.964
  546    HB3  GLU  72           HB3      GLU  72   8.471 -13.050  -4.501
  547    HG2  GLU  72           HG2      GLU  72   7.033 -12.141  -1.987
  548    HG3  GLU  72           HG3      GLU  72   6.274 -12.281  -3.569
  549    H    ALA  73           H        ALA  73  10.774 -10.448  -3.502
  550    HA   ALA  73           HA       ALA  73  12.690  -9.734  -4.388
  551    HB1  ALA  73           HB1      ALA  73  13.983 -12.407  -3.781
  552    HB2  ALA  73           HB2      ALA  73  14.788 -10.875  -4.164
  553    HB3  ALA  73           HB3      ALA  73  13.874 -11.033  -2.653
  554    H    MET  74           H        MET  74  10.722 -10.354  -5.865
  555    HA   MET  74           HA       MET  74  11.725 -10.751  -8.532
  556    HB2  MET  74           HB2      MET  74  10.133 -12.589  -9.094
  557    HB3  MET  74           HB3      MET  74  11.416 -13.123  -8.014
  558    HG2  MET  74           HG2      MET  74   9.951 -13.078  -6.120
  559    HG3  MET  74           HG3      MET  74   8.654 -12.296  -7.025
  560    HE1  MET  74           HE1      MET  74   7.007 -13.448  -8.632
  561    HE2  MET  74           HE2      MET  74   8.346 -13.862  -9.727
  562    HE3  MET  74           HE3      MET  74   7.192 -15.112  -9.228
  563    HA   PRO  75           HA       PRO  75   7.986  -8.251  -9.007
  564    HB2  PRO  75           HB2      PRO  75   7.497  -8.357 -11.664
  565    HB3  PRO  75           HB3      PRO  75   8.918  -7.508 -10.985
  566    HG2  PRO  75           HG2      PRO  75   8.773 -10.301 -12.163
  567    HG3  PRO  75           HG3      PRO  75   9.975  -9.016 -12.512
  568    HD2  PRO  75           HD2      PRO  75  10.441 -11.035 -10.721
  569    HD3  PRO  75           HD3      PRO  75  11.097  -9.388 -10.484
  570    H    VAL  76           H        VAL  76   5.863  -8.546  -8.736
  571    HA   VAL  76           HA       VAL  76   4.580 -11.178  -9.412
  572    HB   VAL  76           HB       VAL  76   4.058  -9.375  -7.010
  573   HG11  VAL  76          HG11      VAL  76   2.792 -11.327  -6.138
  574   HG12  VAL  76          HG12      VAL  76   2.066 -10.695  -7.614
  575   HG13  VAL  76          HG13      VAL  76   3.048 -12.177  -7.673
  576   HG21  VAL  76          HG21      VAL  76   6.263 -10.436  -6.755
  577   HG22  VAL  76          HG22      VAL  76   5.101 -11.192  -5.667
  578   HG23  VAL  76          HG23      VAL  76   5.570 -12.022  -7.167
  579    H    ALA  77           H        ALA  77   2.471 -11.177 -10.257
  580    HA   ALA  77           HA       ALA  77   1.669  -8.586 -11.454
  581    HB1  ALA  77           HB1      ALA  77   1.948 -10.530 -12.915
  582    HB2  ALA  77           HB2      ALA  77   0.717 -11.419 -11.989
  583    HB3  ALA  77           HB3      ALA  77   0.267  -9.967 -12.908
  584    H    LYS  78           H        LYS  78  -0.092  -7.457 -10.947
  585    HA   LYS  78           HA       LYS  78  -2.155  -8.600  -9.079
  586    HB2  LYS  78           HB2      LYS  78  -1.373  -5.686  -9.407
  587    HB3  LYS  78           HB3      LYS  78  -2.531  -6.339  -8.250
  588    HG2  LYS  78           HG2      LYS  78   0.469  -6.863  -8.270
  589    HG3  LYS  78           HG3      LYS  78  -0.382  -5.740  -7.217
  590    HD2  LYS  78           HD2      LYS  78  -1.568  -7.559  -6.110
  591    HD3  LYS  78           HD3      LYS  78  -0.816  -8.758  -7.186
  592    HE2  LYS  78           HE2      LYS  78   1.412  -8.166  -6.322
  593    HE3  LYS  78           HE3      LYS  78   0.702  -6.911  -5.295
  594    HZ1  LYS  78           HZ1      LYS  78   0.192  -9.832  -5.031
  595    HZ2  LYS  78           HZ2      LYS  78   1.093  -8.868  -4.019
  596    HZ3  LYS  78           HZ3      LYS  78  -0.526  -8.660  -4.122
  597    H    LYS  79           H        LYS  79  -4.341  -7.759  -9.317
  598    HA   LYS  79           HA       LYS  79  -5.343  -6.744 -11.839
  599    HB2  LYS  79           HB2      LYS  79  -6.587  -8.864 -12.379
  600    HB3  LYS  79           HB3      LYS  79  -4.857  -8.907 -12.669
  601    HG2  LYS  79           HG2      LYS  79  -4.526 -10.338 -10.724
  602    HG3  LYS  79           HG3      LYS  79  -6.207 -10.099 -10.208
  603    HD2  LYS  79           HD2      LYS  79  -5.903 -12.288 -11.304
  604    HD3  LYS  79           HD3      LYS  79  -7.038 -11.258 -12.191
  605    HE2  LYS  79           HE2      LYS  79  -5.253 -10.655 -13.806
  606    HE3  LYS  79           HE3      LYS  79  -4.099 -11.661 -12.915
  607    HZ1  LYS  79           HZ1      LYS  79  -6.542 -12.668 -14.290
  608    HZ2  LYS  79           HZ2      LYS  79  -4.983 -12.843 -14.808
  609    HZ3  LYS  79           HZ3      LYS  79  -5.461 -13.585 -13.451
  610    HA   PRO  80           HA       PRO  80  -8.963  -6.094  -9.183
  611    HB2  PRO  80           HB2      PRO  80 -11.119  -7.305 -10.509
  612    HB3  PRO  80           HB3      PRO  80 -10.503  -5.651 -10.809
  613    HG2  PRO  80           HG2      PRO  80  -9.778  -8.209 -12.285
  614    HG3  PRO  80           HG3      PRO  80 -10.251  -6.620 -12.980
  615    HD2  PRO  80           HD2      PRO  80  -7.663  -7.195 -12.843
  616    HD3  PRO  80           HD3      PRO  80  -8.207  -5.612 -12.255
  617    H    GLY  81           H        GLY  81  -9.577  -7.155  -7.378
  618    HA2  GLY  81           HA2      GLY  81 -10.035  -8.888  -5.897
  619    HA3  GLY  81           HA3      GLY  81 -10.068 -10.052  -7.223
  620    H    SER  82           H        SER  82  -7.391  -7.774  -6.343
  621    HA   SER  82           HA       SER  82  -5.685 -10.129  -5.582
  622    HB2  SER  82           HB2      SER  82  -5.218  -9.211  -7.877
  623    HB3  SER  82           HB3      SER  82  -4.860  -7.645  -7.126
  624    HG   SER  82           HG       SER  82  -3.529 -10.105  -6.609
  625    H    THR  83           H        THR  83  -4.319  -9.824  -3.710
  626    HA   THR  83           HA       THR  83  -4.927  -7.369  -2.180
  627    HB   THR  83           HB       THR  83  -3.828  -8.531  -0.282
  628    HG1  THR  83           HG1      THR  83  -2.717 -10.189  -0.830
  629   HG21  THR  83          HG21      THR  83  -6.291  -8.513  -0.621
  630   HG22  THR  83          HG22      THR  83  -6.151 -10.026  -1.543
  631   HG23  THR  83          HG23      THR  83  -5.722  -9.983   0.183
  632    H    VAL  84           H        VAL  84  -3.480  -5.984  -1.402
  633    HA   VAL  84           HA       VAL  84  -0.643  -6.181  -2.262
  634    HB   VAL  84           HB       VAL  84  -0.708  -3.748  -2.825
  635   HG11  VAL  84          HG11      VAL  84  -1.674  -4.014  -5.042
  636   HG12  VAL  84          HG12      VAL  84  -0.774  -5.461  -4.578
  637   HG13  VAL  84          HG13      VAL  84  -2.548  -5.478  -4.525
  638   HG21  VAL  84          HG21      VAL  84  -2.771  -3.091  -1.623
  639   HG22  VAL  84          HG22      VAL  84  -2.826  -2.655  -3.336
  640   HG23  VAL  84          HG23      VAL  84  -3.740  -4.058  -2.757
  641    H    ILE  85           H        ILE  85   0.818  -4.833  -1.180
  642    HA   ILE  85           HA       ILE  85   0.018  -3.973   1.549
  643    HB   ILE  85           HB       ILE  85   2.369  -4.917   2.223
  644   HG12  ILE  85          HG12      ILE  85   2.879  -7.121   1.310
  645   HG13  ILE  85          HG13      ILE  85   1.604  -6.980   0.107
  646   HG21  ILE  85          HG21      ILE  85  -0.148  -6.600   1.971
  647   HG22  ILE  85          HG22      ILE  85   1.242  -7.014   2.987
  648   HG23  ILE  85          HG23      ILE  85   0.332  -5.549   3.328
  649   HD11  ILE  85          HD11      ILE  85   3.884  -6.563  -0.795
  650   HD12  ILE  85          HD12      ILE  85   2.798  -5.181  -1.007
  651   HD13  ILE  85          HD13      ILE  85   4.028  -5.140   0.259
  652    H    ALA  86           H        ALA  86   1.073  -2.359   2.541
  653    HA   ALA  86           HA       ALA  86   1.878  -0.271   0.841
  654    HB1  ALA  86           HB1      ALA  86   2.251   0.990   2.911
  655    HB2  ALA  86           HB2      ALA  86   0.766   0.030   3.023
  656    HB3  ALA  86           HB3      ALA  86   2.234  -0.515   3.851
  657    H    GLY  87           H        GLY  87   3.792   0.812   0.502
  658    HA2  GLY  87           HA2      GLY  87   6.099   1.223   0.488
  659    HA3  GLY  87           HA3      GLY  87   6.342  -0.133   1.588
  660    H    SER  88           H        SER  88   4.556  -1.467  -0.827
  661    HA   SER  88           HA       SER  88   6.898  -2.460  -2.344
  662    HB2  SER  88           HB2      SER  88   5.339  -3.910  -3.497
  663    HB3  SER  88           HB3      SER  88   5.223  -4.118  -1.750
  664    HG   SER  88           HG       SER  88   3.252  -3.034  -1.769
  665    H    ILE  89           H        ILE  89   6.930  -2.263  -4.688
  666    HA   ILE  89           HA       ILE  89   6.093   0.488  -5.497
  667    HB   ILE  89           HB       ILE  89   8.153  -0.940  -7.098
  668   HG12  ILE  89          HG12      ILE  89   8.970  -1.624  -4.904
  669   HG13  ILE  89          HG13      ILE  89  10.030  -0.490  -5.709
  670   HG21  ILE  89          HG21      ILE  89   7.864   1.899  -6.015
  671   HG22  ILE  89          HG22      ILE  89   9.156   1.346  -7.095
  672   HG23  ILE  89          HG23      ILE  89   7.470   1.336  -7.648
  673   HD11  ILE  89          HD11      ILE  89   8.109   0.289  -3.470
  674   HD12  ILE  89          HD12      ILE  89   9.840  -0.043  -3.303
  675   HD13  ILE  89          HD13      ILE  89   9.302   1.332  -4.270
  676    H    ASN  90           H        ASN  90   5.046   0.917  -7.444
  677    HA   ASN  90           HA       ASN  90   3.934  -1.462  -8.875
  678    HB2  ASN  90           HB2      ASN  90   2.371   0.053  -7.588
  679    HB3  ASN  90           HB3      ASN  90   2.840   1.380  -8.649
  680   HD21  ASN  90          HD22      ASN  90   1.558   1.565 -10.498
  681   HD22  ASN  90          HD21      ASN  90   0.650   0.172 -11.126
  682    H    GLN  91           H        GLN  91   3.839  -1.562 -11.169
  683    HA   GLN  91           HA       GLN  91   4.932   0.665 -12.790
  684    HB2  GLN  91           HB2      GLN  91   6.727  -1.107 -12.039
  685    HB3  GLN  91           HB3      GLN  91   5.855  -2.179 -13.146
  686    HG2  GLN  91           HG2      GLN  91   7.740  -1.341 -14.328
  687    HG3  GLN  91           HG3      GLN  91   6.341  -0.511 -15.004
  688   HE21  GLN  91          HE22      GLN  91   6.262   1.819 -14.764
  689   HE22  GLN  91          HE21      GLN  91   7.475   2.682 -13.804
  690    H    ASN  92           H        ASN  92   3.781   0.808 -14.752
  691    HA   ASN  92           HA       ASN  92   2.517   0.418 -16.487
  692    HB2  ASN  92           HB2      ASN  92   4.696  -0.661 -17.072
  693    HB3  ASN  92           HB3      ASN  92   4.009  -2.225 -16.649
  694   HD21  ASN  92          HD22      ASN  92   1.934  -2.824 -17.887
  695   HD22  ASN  92          HD21      ASN  92   1.798  -2.229 -19.536
  696    H    GLY  93           H        GLY  93   0.363   0.339 -15.910
  697    HA2  GLY  93           HA2      GLY  93  -1.260  -1.588 -16.338
  698    HA3  GLY  93           HA3      GLY  93  -0.739  -2.103 -14.741
  699    H    SER  94           H        SER  94  -0.691   1.027 -14.233
  700    HA   SER  94           HA       SER  94  -1.979   2.481 -13.010
  701    HB2  SER  94           HB2      SER  94  -3.614   2.040 -15.510
  702    HB3  SER  94           HB3      SER  94  -3.728   3.456 -14.454
  703    HG   SER  94           HG       SER  94  -2.356   3.664 -16.327
  704    H    LEU  95           H        LEU  95  -2.653   1.504 -11.085
  705    HA   LEU  95           HA       LEU  95  -5.219  -0.036 -11.081
  706    HB2  LEU  95           HB2      LEU  95  -3.018   0.056  -9.011
  707    HB3  LEU  95           HB3      LEU  95  -4.388  -1.037  -9.002
  708    HG   LEU  95           HG       LEU  95  -2.016  -1.031 -10.888
  709   HD11  LEU  95          HD11      LEU  95  -2.850  -2.919  -8.644
  710   HD12  LEU  95          HD12      LEU  95  -1.465  -3.160  -9.729
  711   HD13  LEU  95          HD13      LEU  95  -1.480  -1.784  -8.624
  712   HD21  LEU  95          HD21      LEU  95  -4.467  -2.830 -10.711
  713   HD22  LEU  95          HD22      LEU  95  -3.914  -1.840 -12.081
  714   HD23  LEU  95          HD23      LEU  95  -2.990  -3.271 -11.578
  715    H    LEU  96           H        LEU  96  -6.620   0.044  -9.298
  716    HA   LEU  96           HA       LEU  96  -6.298   2.292  -7.394
  717    HB2  LEU  96           HB2      LEU  96  -8.979   1.510  -8.596
  718    HB3  LEU  96           HB3      LEU  96  -8.720   2.542  -7.205
  719    HG   LEU  96           HG       LEU  96  -7.167   3.911  -8.947
  720   HD11  LEU  96          HD11      LEU  96  -9.410   2.784 -10.659
  721   HD12  LEU  96          HD12      LEU  96  -8.240   4.009 -11.148
  722   HD13  LEU  96          HD13      LEU  96  -7.692   2.354 -10.854
  723   HD21  LEU  96          HD21      LEU  96 -10.193   4.081  -8.688
  724   HD22  LEU  96          HD22      LEU  96  -8.983   4.881  -7.655
  725   HD23  LEU  96          HD23      LEU  96  -9.165   5.360  -9.351
  726    H    ILE  97           H        ILE  97  -6.506   1.816  -5.355
  727    HA   ILE  97           HA       ILE  97  -7.111  -0.991  -4.542
  728    HB   ILE  97           HB       ILE  97  -5.562   1.038  -2.900
  729   HG12  ILE  97          HG12      ILE  97  -3.510  -0.371  -3.645
  730   HG13  ILE  97          HG13      ILE  97  -4.443  -0.737  -5.090
  731   HG21  ILE  97          HG21      ILE  97  -5.523  -2.008  -2.930
  732   HG22  ILE  97          HG22      ILE  97  -4.691  -0.947  -1.779
  733   HG23  ILE  97          HG23      ILE  97  -6.450  -1.021  -1.780
  734   HD11  ILE  97          HD11      ILE  97  -3.835   2.103  -4.132
  735   HD12  ILE  97          HD12      ILE  97  -2.775   1.182  -5.206
  736   HD13  ILE  97          HD13      ILE  97  -4.396   1.606  -5.750
  737    H    CYS  98           H        CYS  98  -8.824  -1.371  -3.171
  738    HA   CYS  98           HA       CYS  98 -10.197   0.952  -1.922
  739    HB2  CYS  98           HB2      CYS  98 -11.843  -0.679  -1.158
  740    HB3  CYS  98           HB3      CYS  98 -11.668  -0.680  -2.913
  741    HG   CYS  98           HG       CYS  98  -9.979  -2.678  -0.930
  742    H    ALA  99           H        ALA  99  -9.493   1.716  -0.012
  743    HA   ALA  99           HA       ALA  99  -7.531   0.235   1.517
  744    HB1  ALA  99           HB1      ALA  99  -7.584   2.245   2.960
  745    HB2  ALA  99           HB2      ALA  99  -7.434   2.679   1.243
  746    HB3  ALA  99           HB3      ALA  99  -8.997   2.852   2.073
  747    H    THR 100           H        THR 100  -7.945  -1.264   2.985
  748    HA   THR 100           HA       THR 100 -10.528  -1.350   4.499
  749    HB   THR 100           HB       THR 100  -9.880  -3.824   4.701
  750    HG1  THR 100           HG1      THR 100  -8.315  -4.529   3.178
  751   HG21  THR 100          HG21      THR 100 -11.517  -3.069   2.987
  752   HG22  THR 100          HG22      THR 100 -10.183  -2.818   1.837
  753   HG23  THR 100          HG23      THR 100 -10.549  -4.449   2.442
  754    H    HIS 101           H        HIS 101  -7.318  -0.511   4.974
  755    HA   HIS 101           HA       HIS 101  -7.552  -0.811   7.906
  756    HB2  HIS 101           HB2      HIS 101  -5.042  -1.236   6.225
  757    HB3  HIS 101           HB3      HIS 101  -5.169  -1.369   7.974
  758    HD1  HIS 101           HD1      HIS 101  -6.123  -3.274   4.765
  759    HD2  HIS 101           HD2      HIS 101  -5.910  -3.729   8.944
  760    HE1  HIS 101           HE1      HIS 101  -6.683  -5.712   5.247
  761    H    VAL 102           H        VAL 102  -6.995   1.110   8.967
  762    HA   VAL 102           HA       VAL 102  -5.807   3.354   7.425
  763    HB   VAL 102           HB       VAL 102  -5.715   4.524   9.626
  764   HG11  VAL 102          HG11      VAL 102  -8.443   3.469   8.804
  765   HG12  VAL 102          HG12      VAL 102  -8.115   4.955   9.726
  766   HG13  VAL 102          HG13      VAL 102  -7.544   4.815   8.054
  767   HG21  VAL 102          HG21      VAL 102  -5.644   2.543  11.144
  768   HG22  VAL 102          HG22      VAL 102  -6.893   3.725  11.560
  769   HG23  VAL 102          HG23      VAL 102  -7.347   2.224  10.746
  770    H    GLY 103           H        GLY 103  -3.661   4.386   8.533
  771    HA2  GLY 103           HA2      GLY 103  -1.729   2.415   7.692
  772    HA3  GLY 103           HA3      GLY 103  -1.367   3.970   8.393
  773    H    ALA 104           H        ALA 104  -2.635   3.605  10.938
  774    HA   ALA 104           HA       ALA 104  -0.765   2.141  12.485
  775    HB1  ALA 104           HB1      ALA 104  -3.596   3.107  13.097
  776    HB2  ALA 104           HB2      ALA 104  -2.388   2.663  14.307
  777    HB3  ALA 104           HB3      ALA 104  -2.104   4.061  13.262
  778    H    ASP 105           H        ASP 105  -3.779   1.084  11.016
  779    HA   ASP 105           HA       ASP 105  -3.914  -1.494  12.431
  780    HB2  ASP 105           HB2      ASP 105  -5.948  -0.161  11.964
  781    HB3  ASP 105           HB3      ASP 105  -5.654  -0.345  10.239
  782    H    THR 106           H        THR 106  -2.079  -0.384   9.781
  783    HA   THR 106           HA       THR 106  -2.511  -2.651   8.016
  784    HB   THR 106           HB       THR 106  -0.511  -1.950   6.799
  785    HG1  THR 106           HG1      THR 106  -0.261   0.144   8.664
  786   HG21  THR 106          HG21      THR 106  -2.377   0.330   7.426
  787   HG22  THR 106          HG22      THR 106  -1.236   0.265   6.067
  788   HG23  THR 106          HG23      THR 106  -2.573  -0.905   6.180
  789    H    THR 107           H        THR 107  -1.086  -4.369   7.470
  790    HA   THR 107           HA       THR 107   0.014  -5.757   9.677
  791    HB   THR 107           HB       THR 107  -0.665  -6.933   7.699
  792    HG1  THR 107           HG1      THR 107   0.987  -7.859   9.024
  793   HG21  THR 107          HG21      THR 107   0.134  -5.351   5.933
  794   HG22  THR 107          HG22      THR 107   1.808  -5.851   6.289
  795   HG23  THR 107          HG23      THR 107   0.637  -7.024   5.660
  796    H    LEU 108           H        LEU 108   1.676  -3.370   7.638
  797    HA   LEU 108           HA       LEU 108   4.367  -3.853   8.483
  798    HB2  LEU 108           HB2      LEU 108   2.865  -1.305   7.736
  799    HB3  LEU 108           HB3      LEU 108   4.556  -1.306   8.205
  800    HG   LEU 108           HG       LEU 108   5.129  -2.756   6.275
  801   HD11  LEU 108          HD11      LEU 108   2.221  -2.292   5.505
  802   HD12  LEU 108          HD12      LEU 108   3.498  -2.855   4.396
  803   HD13  LEU 108          HD13      LEU 108   3.033  -3.870   5.761
  804   HD21  LEU 108          HD21      LEU 108   5.327  -0.334   6.242
  805   HD22  LEU 108          HD22      LEU 108   4.799  -0.897   4.645
  806   HD23  LEU 108          HD23      LEU 108   3.620  -0.170   5.777
  807    H    SER 109           H        SER 109   1.846  -1.742   9.888
  808    HA   SER 109           HA       SER 109   3.353  -0.880  12.181
  809    HB2  SER 109           HB2      SER 109   0.365  -1.009  11.631
  810    HB3  SER 109           HB3      SER 109   1.090  -0.262  13.069
  811    HG   SER 109           HG       SER 109   0.710   0.898  10.770
  812    H    GLN 110           H        GLN 110   1.353  -3.708  11.494
  813    HA   GLN 110           HA       GLN 110   1.077  -4.549  14.267
  814    HB2  GLN 110           HB2      GLN 110  -0.365  -5.206  12.222
  815    HB3  GLN 110           HB3      GLN 110   0.901  -6.338  11.816
  816    HG2  GLN 110           HG2      GLN 110  -0.664  -7.607  12.989
  817    HG3  GLN 110           HG3      GLN 110   0.634  -7.353  14.158
  818   HE21  GLN 110          HE22      GLN 110  -2.408  -5.741  13.016
  819   HE22  GLN 110          HE21      GLN 110  -2.840  -5.149  14.592
  820    H    ILE 111           H        ILE 111   3.348  -5.437  11.660
  821    HA   ILE 111           HA       ILE 111   4.945  -7.318  13.074
  822    HB   ILE 111           HB       ILE 111   5.647  -5.356  10.863
  823   HG12  ILE 111          HG12      ILE 111   5.292  -8.374  10.657
  824   HG13  ILE 111          HG13      ILE 111   3.921  -7.290  10.516
  825   HG21  ILE 111          HG21      ILE 111   7.314  -7.680  11.935
  826   HG22  ILE 111          HG22      ILE 111   7.657  -6.789  10.441
  827   HG23  ILE 111          HG23      ILE 111   7.752  -5.958  11.984
  828   HD11  ILE 111          HD11      ILE 111   5.037  -6.110   8.619
  829   HD12  ILE 111          HD12      ILE 111   6.341  -7.319   8.675
  830   HD13  ILE 111          HD13      ILE 111   4.680  -7.816   8.303
  831    H    VAL 112           H        VAL 112   5.568  -3.757  12.744
  832    HA   VAL 112           HA       VAL 112   7.761  -3.881  14.559
  833    HB   VAL 112           HB       VAL 112   7.750  -1.443  14.620
  834   HG11  VAL 112          HG11      VAL 112   7.311  -2.546  11.827
  835   HG12  VAL 112          HG12      VAL 112   8.226  -1.087  12.286
  836   HG13  VAL 112          HG13      VAL 112   8.818  -2.682  12.767
  837   HG21  VAL 112          HG21      VAL 112   6.178  -0.136  13.276
  838   HG22  VAL 112          HG22      VAL 112   5.259  -1.600  12.891
  839   HG23  VAL 112          HG23      VAL 112   5.310  -0.990  14.558
  840    H    LYS 113           H        LYS 113   4.361  -3.527  15.307
  841    HA   LYS 113           HA       LYS 113   4.761  -2.646  18.061
  842    HB2  LYS 113           HB2      LYS 113   2.440  -3.941  16.583
  843    HB3  LYS 113           HB3      LYS 113   2.374  -3.506  18.298
  844    HG2  LYS 113           HG2      LYS 113   2.696  -1.171  17.847
  845    HG3  LYS 113           HG3      LYS 113   3.137  -1.462  16.187
  846    HD2  LYS 113           HD2      LYS 113   0.983  -0.633  16.087
  847    HD3  LYS 113           HD3      LYS 113   0.788  -2.369  15.790
  848    HE2  LYS 113           HE2      LYS 113   0.142  -2.729  18.120
  849    HE3  LYS 113           HE3      LYS 113   0.514  -1.044  18.512
  850    HZ1  LYS 113           HZ1      LYS 113  -1.590  -1.858  16.577
  851    HZ2  LYS 113           HZ2      LYS 113  -1.902  -1.411  18.134
  852    HZ3  LYS 113           HZ3      LYS 113  -1.263  -0.336  17.070
  853    H    LEU 114           H        LEU 114   4.231  -5.877  16.586
  854    HA   LEU 114           HA       LEU 114   4.431  -7.263  19.100
  855    HB2  LEU 114           HB2      LEU 114   3.436  -7.875  16.671
  856    HB3  LEU 114           HB3      LEU 114   5.006  -8.676  16.517
  857    HG   LEU 114           HG       LEU 114   2.878  -9.157  18.641
  858   HD11  LEU 114          HD11      LEU 114   3.872 -10.906  16.344
  859   HD12  LEU 114          HD12      LEU 114   2.629 -11.338  17.537
  860   HD13  LEU 114          HD13      LEU 114   2.323 -10.027  16.395
  861   HD21  LEU 114          HD21      LEU 114   5.598 -10.449  18.218
  862   HD22  LEU 114          HD22      LEU 114   5.004  -9.607  19.677
  863   HD23  LEU 114          HD23      LEU 114   4.310 -11.165  19.224
  864    H    VAL 115           H        VAL 115   6.865  -6.657  16.520
  865    HA   VAL 115           HA       VAL 115   8.874  -8.318  17.802
  866    HB   VAL 115           HB       VAL 115   8.633  -7.565  15.314
  867   HG11  VAL 115          HG11      VAL 115  10.568  -5.426  16.209
  868   HG12  VAL 115          HG12      VAL 115   9.915  -5.707  14.584
  869   HG13  VAL 115          HG13      VAL 115   8.857  -5.107  15.884
  870   HG21  VAL 115          HG21      VAL 115  10.372  -9.098  16.131
  871   HG22  VAL 115          HG22      VAL 115  11.004  -7.994  14.900
  872   HG23  VAL 115          HG23      VAL 115  11.382  -7.718  16.612
  873    H    GLU 116           H        GLU 116   7.846  -5.174  18.572
  874    HA   GLU 116           HA       GLU 116  10.276  -4.164  19.859
  875    HB2  GLU 116           HB2      GLU 116   8.507  -2.715  19.027
  876    HB3  GLU 116           HB3      GLU 116   7.316  -3.492  20.051
  877    HG2  GLU 116           HG2      GLU 116   9.688  -1.882  21.052
  878    HG3  GLU 116           HG3      GLU 116   8.089  -1.209  20.767
  879    H    GLU 117           H        GLU 117   7.667  -6.390  20.734
  880    HA   GLU 117           HA       GLU 117   7.846  -6.067  23.585
  881    HB2  GLU 117           HB2      GLU 117   6.729  -8.296  21.844
  882    HB3  GLU 117           HB3      GLU 117   6.449  -8.173  23.556
  883    HG2  GLU 117           HG2      GLU 117   5.645  -5.943  21.629
  884    HG3  GLU 117           HG3      GLU 117   4.629  -7.326  21.976
  885    H    ALA 118           H        ALA 118   9.862  -7.775  21.382
  886    HA   ALA 118           HA       ALA 118  10.738  -9.892  23.181
  887    HB1  ALA 118           HB1      ALA 118  10.677 -10.246  20.778
  888    HB2  ALA 118           HB2      ALA 118  11.730  -8.853  20.488
  889    HB3  ALA 118           HB3      ALA 118  12.366 -10.286  21.337
  890    H    GLN 119           H        GLN 119  12.564  -7.196  21.708
  891    HA   GLN 119           HA       GLN 119  14.698  -7.052  23.319
  892    HB2  GLN 119           HB2      GLN 119  13.222  -4.772  22.007
  893    HB3  GLN 119           HB3      GLN 119  14.770  -4.554  22.793
  894    HG2  GLN 119           HG2      GLN 119  15.264  -4.821  20.513
  895    HG3  GLN 119           HG3      GLN 119  15.746  -6.354  21.292
  896   HE21  GLN 119          HE22      GLN 119  13.048  -4.690  19.683
  897   HE22  GLN 119          HE21      GLN 119  12.296  -6.186  19.157
  Start of MODEL    9
    1    H    SER   1           H        SER   1  18.288  -7.053  12.195
    2    HA   SER   1           HA       SER   1  17.707  -4.790  13.777
    3    HB2  SER   1           HB2      SER   1  20.177  -4.384  13.744
    4    HB3  SER   1           HB3      SER   1  19.728  -6.040  14.155
    5    HG   SER   1           HG       SER   1  20.414  -6.753  12.236
    6    H    GLU   2           H        GLU   2  18.458  -4.868  10.317
    7    HA   GLU   2           HA       GLU   2  18.454  -1.874  10.222
    8    HB2  GLU   2           HB2      GLU   2  19.348  -3.995   8.256
    9    HB3  GLU   2           HB3      GLU   2  19.119  -2.301   7.794
   10    HG2  GLU   2           HG2      GLU   2  20.735  -1.563   9.481
   11    HG3  GLU   2           HG3      GLU   2  20.950  -3.222  10.047
   12    H    ALA   3           H        ALA   3  16.207  -4.405   9.908
   13    HA   ALA   3           HA       ALA   3  14.422  -2.965   8.045
   14    HB1  ALA   3           HB1      ALA   3  13.921  -5.455   9.715
   15    HB2  ALA   3           HB2      ALA   3  12.908  -4.817   8.408
   16    HB3  ALA   3           HB3      ALA   3  14.525  -5.439   8.040
   17    H    LEU   4           H        LEU   4  14.710  -3.538  11.513
   18    HA   LEU   4           HA       LEU   4  12.217  -2.992  12.367
   19    HB2  LEU   4           HB2      LEU   4  14.298  -3.792  13.653
   20    HB3  LEU   4           HB3      LEU   4  14.637  -2.094  13.945
   21    HG   LEU   4           HG       LEU   4  12.282  -1.927  14.988
   22   HD11  LEU   4          HD11      LEU   4  12.668  -4.946  14.977
   23   HD12  LEU   4          HD12      LEU   4  11.381  -4.068  15.844
   24   HD13  LEU   4          HD13      LEU   4  11.411  -4.083  14.074
   25   HD21  LEU   4          HD21      LEU   4  13.055  -2.893  17.118
   26   HD22  LEU   4          HD22      LEU   4  14.380  -3.731  16.277
   27   HD23  LEU   4          HD23      LEU   4  14.335  -1.953  16.335
   28    H    ALA   5           H        ALA   5  14.550  -0.233  11.979
   29    HA   ALA   5           HA       ALA   5  12.484   1.684  12.829
   30    HB1  ALA   5           HB1      ALA   5  15.216   2.191  11.591
   31    HB2  ALA   5           HB2      ALA   5  14.171   3.354  12.414
   32    HB3  ALA   5           HB3      ALA   5  14.887   2.028  13.331
   33    H    LYS   6           H        LYS   6  13.746   0.375   9.834
   34    HA   LYS   6           HA       LYS   6  12.620   2.250   8.017
   35    HB2  LYS   6           HB2      LYS   6  14.525   0.594   7.684
   36    HB3  LYS   6           HB3      LYS   6  13.311  -0.643   7.369
   37    HG2  LYS   6           HG2      LYS   6  12.560   0.505   5.381
   38    HG3  LYS   6           HG3      LYS   6  13.428   1.991   5.837
   39    HD2  LYS   6           HD2      LYS   6  15.593   0.741   5.659
   40    HD3  LYS   6           HD3      LYS   6  14.702  -0.669   5.057
   41    HE2  LYS   6           HE2      LYS   6  13.952   0.607   3.094
   42    HE3  LYS   6           HE3      LYS   6  14.667   2.091   3.752
   43    HZ1  LYS   6           HZ1      LYS   6  16.136   1.064   2.119
   44    HZ2  LYS   6           HZ2      LYS   6  16.851   1.052   3.601
   45    HZ3  LYS   6           HZ3      LYS   6  16.212  -0.328   2.993
   46    H    LEU   7           H        LEU   7  11.186  -0.740   9.345
   47    HA   LEU   7           HA       LEU   7   8.832  -0.826   7.759
   48    HB2  LEU   7           HB2      LEU   7   9.522  -1.631  10.577
   49    HB3  LEU   7           HB3      LEU   7   7.823  -1.491  10.180
   50    HG   LEU   7           HG       LEU   7   8.419  -3.756   9.994
   51   HD11  LEU   7          HD11      LEU   7   8.213  -2.798   7.117
   52   HD12  LEU   7          HD12      LEU   7   7.660  -4.329   7.812
   53   HD13  LEU   7          HD13      LEU   7   6.857  -2.815   8.264
   54   HD21  LEU   7          HD21      LEU   7  10.799  -3.644   9.639
   55   HD22  LEU   7          HD22      LEU   7  10.060  -4.616   8.357
   56   HD23  LEU   7          HD23      LEU   7  10.575  -2.948   8.018
   57    H    ILE   8           H        ILE   8   9.449   1.244  10.614
   58    HA   ILE   8           HA       ILE   8   6.881   2.572  10.441
   59    HB   ILE   8           HB       ILE   8   9.481   3.329  11.809
   60   HG12  ILE   8          HG12      ILE   8   8.453   1.305  12.727
   61   HG13  ILE   8          HG13      ILE   8   8.403   2.637  13.867
   62   HG21  ILE   8          HG21      ILE   8   6.780   4.711  11.948
   63   HG22  ILE   8          HG22      ILE   8   8.070   4.911  13.153
   64   HG23  ILE   8          HG23      ILE   8   8.351   5.401  11.486
   65   HD11  ILE   8          HD11      ILE   8   6.322   1.402  13.981
   66   HD12  ILE   8          HD12      ILE   8   5.975   2.994  13.308
   67   HD13  ILE   8          HD13      ILE   8   6.051   1.569  12.242
   68    H    SER   9           H        SER   9  10.080   3.296   8.959
   69    HA   SER   9           HA       SER   9   9.308   5.854   7.868
   70    HB2  SER   9           HB2      SER   9  11.415   3.864   6.945
   71    HB3  SER   9           HB3      SER   9  11.279   5.549   6.416
   72    HG   SER   9           HG       SER   9  12.764   4.994   8.226
   73    H    LEU  10           H        LEU  10   8.614   2.559   6.838
   74    HA   LEU  10           HA       LEU  10   7.996   3.188   4.070
   75    HB2  LEU  10           HB2      LEU  10   7.667   0.812   5.912
   76    HB3  LEU  10           HB3      LEU  10   6.896   0.822   4.337
   77    HG   LEU  10           HG       LEU  10   9.872   1.399   4.581
   78   HD11  LEU  10          HD11      LEU  10  10.261  -0.991   4.081
   79   HD12  LEU  10          HD12      LEU  10   9.531  -0.763   5.671
   80   HD13  LEU  10          HD13      LEU  10   8.528  -1.326   4.313
   81   HD21  LEU  10          HD21      LEU  10   8.203   0.130   2.378
   82   HD22  LEU  10          HD22      LEU  10   8.665   1.851   2.409
   83   HD23  LEU  10          HD23      LEU  10   9.913   0.601   2.285
   84    H    GLN  11           H        GLN  11   6.284   3.780   7.022
   85    HA   GLN  11           HA       GLN  11   3.611   3.680   5.838
   86    HB2  GLN  11           HB2      GLN  11   4.603   4.895   8.437
   87    HB3  GLN  11           HB3      GLN  11   2.926   4.872   7.891
   88    HG2  GLN  11           HG2      GLN  11   2.899   2.431   7.887
   89    HG3  GLN  11           HG3      GLN  11   4.625   2.358   8.275
   90   HE21  GLN  11          HE22      GLN  11   1.408   2.737   9.639
   91   HE22  GLN  11          HE21      GLN  11   2.025   2.932  11.281
   92    H    ALA  12           H        ALA  12   2.893   5.064   4.436
   93    HA   ALA  12           HA       ALA  12   4.464   7.120   3.326
   94    HB1  ALA  12           HB1      ALA  12   2.975   5.613   2.106
   95    HB2  ALA  12           HB2      ALA  12   1.552   6.332   2.907
   96    HB3  ALA  12           HB3      ALA  12   2.526   7.288   1.775
   97    H    THR  13           H        THR  13   3.400   9.196   2.548
   98    HA   THR  13           HA       THR  13   2.417  10.827   4.866
   99    HB   THR  13           HB       THR  13   3.966  11.643   2.381
  100    HG1  THR  13           HG1      THR  13   5.666  11.650   3.631
  101   HG21  THR  13          HG21      THR  13   3.188  13.253   4.852
  102   HG22  THR  13          HG22      THR  13   4.361  13.771   3.619
  103   HG23  THR  13          HG23      THR  13   2.663  13.561   3.183
  104    H    GLU  14           H        GLU  14   1.778  10.232   1.326
  105    HA   GLU  14           HA       GLU  14  -0.739  11.794   1.623
  106    HB2  GLU  14           HB2      GLU  14  -0.214  13.113  -0.302
  107    HB3  GLU  14           HB3      GLU  14   1.070  13.273   0.891
  108    HG2  GLU  14           HG2      GLU  14   2.261  11.374  -0.523
  109    HG3  GLU  14           HG3      GLU  14   1.123  11.851  -1.785
  110    H    ALA  15           H        ALA  15  -2.284  11.579  -0.069
  111    HA   ALA  15           HA       ALA  15  -2.059   9.265  -1.887
  112    HB1  ALA  15           HB1      ALA  15  -4.271   9.552   0.196
  113    HB2  ALA  15           HB2      ALA  15  -4.173   8.300  -1.062
  114    HB3  ALA  15           HB3      ALA  15  -2.962   8.348   0.231
  115    H    THR  16           H        THR  16  -3.916   9.120  -3.317
  116    HA   THR  16           HA       THR  16  -5.441  11.666  -3.774
  117    HB   THR  16           HB       THR  16  -4.158   9.996  -5.947
  118    HG1  THR  16           HG1      THR  16  -3.194  12.151  -6.269
  119   HG21  THR  16          HG21      THR  16  -4.976  11.791  -7.462
  120   HG22  THR  16          HG22      THR  16  -6.315  10.901  -6.737
  121   HG23  THR  16          HG23      THR  16  -5.887  12.510  -6.109
  122    H    ILE  17           H        ILE  17  -7.488  11.370  -3.462
  123    HA   ILE  17           HA       ILE  17  -8.744   8.699  -3.625
  124    HB   ILE  17           HB       ILE  17 -10.163  11.269  -2.889
  125   HG12  ILE  17          HG12      ILE  17  -8.490   9.598  -0.968
  126   HG13  ILE  17          HG13      ILE  17  -8.188  11.268  -1.447
  127   HG21  ILE  17          HG21      ILE  17 -10.595   8.370  -2.035
  128   HG22  ILE  17          HG22      ILE  17 -11.619   9.755  -1.610
  129   HG23  ILE  17          HG23      ILE  17 -11.532   9.235  -3.273
  130   HD11  ILE  17          HD11      ILE  17 -10.495  10.276   0.255
  131   HD12  ILE  17          HD12      ILE  17  -9.159  11.324   0.725
  132   HD13  ILE  17          HD13      ILE  17 -10.377  11.925  -0.416
  133    H    VAL  18           H        VAL  18 -10.404   8.136  -5.087
  134    HA   VAL  18           HA       VAL  18 -10.956  10.123  -7.258
  135    HB   VAL  18           HB       VAL  18 -11.814   8.184  -8.568
  136   HG11  VAL  18          HG11      VAL  18  -9.568   7.557  -9.368
  137   HG12  VAL  18          HG12      VAL  18  -9.716   9.289  -9.091
  138   HG13  VAL  18          HG13      VAL  18  -8.846   8.290  -7.912
  139   HG21  VAL  18          HG21      VAL  18 -11.844   6.473  -6.671
  140   HG22  VAL  18          HG22      VAL  18 -11.020   5.965  -8.146
  141   HG23  VAL  18          HG23      VAL  18 -10.066   6.483  -6.741
  142    H    THR  19           H        THR  19 -12.763  11.145  -7.194
  143    HA   THR  19           HA       THR  19 -15.130   9.974  -5.809
  144    HB   THR  19           HB       THR  19 -14.360  12.907  -5.983
  145    HG1  THR  19           HG1      THR  19 -13.705  12.674  -3.881
  146   HG21  THR  19          HG21      THR  19 -16.364  11.424  -4.220
  147   HG22  THR  19          HG22      THR  19 -15.992  13.161  -4.153
  148   HG23  THR  19          HG23      THR  19 -16.777  12.485  -5.583
  149    H    LEU  20           H        LEU  20 -17.132  10.242  -6.739
  150    HA   LEU  20           HA       LEU  20 -17.053  10.732  -9.662
  151    HB2  LEU  20           HB2      LEU  20 -19.042   8.982  -8.165
  152    HB3  LEU  20           HB3      LEU  20 -18.717   9.039  -9.881
  153    HG   LEU  20           HG       LEU  20 -16.685   8.095  -7.795
  154   HD11  LEU  20          HD11      LEU  20 -18.526   6.598  -7.738
  155   HD12  LEU  20          HD12      LEU  20 -18.635   6.529  -9.499
  156   HD13  LEU  20          HD13      LEU  20 -17.232   5.829  -8.660
  157   HD21  LEU  20          HD21      LEU  20 -15.599   8.878  -9.825
  158   HD22  LEU  20          HD22      LEU  20 -15.536   7.113  -9.753
  159   HD23  LEU  20          HD23      LEU  20 -16.692   7.926 -10.834
  160    H    ASP  21           H        ASP  21 -18.672  11.722 -10.787
  161    HA   ASP  21           HA       ASP  21 -20.713  13.300  -9.243
  162    HB2  ASP  21           HB2      ASP  21 -18.314  14.229 -10.626
  163    HB3  ASP  21           HB3      ASP  21 -19.756  15.000 -11.279
  164    H    SER  22           H        SER  22 -20.101  11.668 -12.292
  165    HA   SER  22           HA       SER  22 -22.873  12.405 -13.200
  166    HB2  SER  22           HB2      SER  22 -20.530  11.457 -14.858
  167    HB3  SER  22           HB3      SER  22 -22.182  11.665 -15.465
  168    HG   SER  22           HG       SER  22 -22.089  13.813 -15.040
  169    H    ASP  23           H        ASP  23 -21.444  10.134 -11.624
  170    HA   ASP  23           HA       ASP  23 -22.277   8.205 -10.658
  171    HB2  ASP  23           HB2      ASP  23 -24.525   8.863 -11.684
  172    HB3  ASP  23           HB3      ASP  23 -24.184   7.656 -12.916
  173    H    ASN  24           H        ASN  24 -20.208   7.564 -10.902
  174    HA   ASN  24           HA       ASN  24 -18.299   6.726 -11.639
  175    HB2  ASN  24           HB2      ASN  24 -18.247   4.380 -12.189
  176    HB3  ASN  24           HB3      ASN  24 -19.373   4.723 -10.898
  177   HD21  ASN  24          HD22      ASN  24 -21.390   4.051 -11.124
  178   HD22  ASN  24          HD21      ASN  24 -21.979   3.183 -12.566
  179    H    ILE  25           H        ILE  25 -20.235   7.706 -14.221
  180    HA   ILE  25           HA       ILE  25 -18.143   7.314 -16.214
  181    HB   ILE  25           HB       ILE  25 -19.798   8.787 -17.527
  182   HG12  ILE  25          HG12      ILE  25 -21.849   7.861 -15.545
  183   HG13  ILE  25          HG13      ILE  25 -21.084   9.446 -15.427
  184   HG21  ILE  25          HG21      ILE  25 -20.540   6.024 -16.469
  185   HG22  ILE  25          HG22      ILE  25 -21.112   6.702 -18.011
  186   HG23  ILE  25          HG23      ILE  25 -19.391   6.336 -17.790
  187   HD11  ILE  25          HD11      ILE  25 -23.194   9.585 -16.651
  188   HD12  ILE  25          HD12      ILE  25 -21.840   9.993 -17.719
  189   HD13  ILE  25          HD13      ILE  25 -22.632   8.403 -17.839
  190    H    LEU  26           H        LEU  26 -18.501   9.623 -13.864
  191    HA   LEU  26           HA       LEU  26 -16.413  11.277 -15.222
  192    HB2  LEU  26           HB2      LEU  26 -18.515  12.499 -15.290
  193    HB3  LEU  26           HB3      LEU  26 -18.591  12.514 -13.525
  194    HG   LEU  26           HG       LEU  26 -16.010  13.447 -14.745
  195   HD11  LEU  26          HD11      LEU  26 -18.586  15.026 -14.977
  196   HD12  LEU  26          HD12      LEU  26 -16.953  15.683 -15.223
  197   HD13  LEU  26          HD13      LEU  26 -17.559  14.397 -16.294
  198   HD21  LEU  26          HD21      LEU  26 -16.032  15.093 -13.018
  199   HD22  LEU  26          HD22      LEU  26 -17.746  14.833 -12.691
  200   HD23  LEU  26          HD23      LEU  26 -16.553  13.587 -12.242
  201    H    LEU  27           H        LEU  27 -14.797  11.813 -14.060
  202    HA   LEU  27           HA       LEU  27 -14.560  11.013 -11.171
  203    HB2  LEU  27           HB2      LEU  27 -12.584  10.465 -13.396
  204    HB3  LEU  27           HB3      LEU  27 -12.016  10.779 -11.766
  205    HG   LEU  27           HG       LEU  27 -13.443   8.914 -10.902
  206   HD11  LEU  27          HD11      LEU  27 -15.074   8.610 -12.702
  207   HD12  LEU  27          HD12      LEU  27 -13.774   8.273 -13.869
  208   HD13  LEU  27          HD13      LEU  27 -14.113   7.148 -12.534
  209   HD21  LEU  27          HD21      LEU  27 -11.034   8.665 -11.327
  210   HD22  LEU  27          HD22      LEU  27 -11.900   7.159 -11.669
  211   HD23  LEU  27          HD23      LEU  27 -11.367   8.202 -13.006
  212    H    SER  28           H        SER  28 -13.892  12.486  -9.811
  213    HA   SER  28           HA       SER  28 -12.215  14.791 -10.706
  214    HB2  SER  28           HB2      SER  28 -14.677  15.380 -10.443
  215    HB3  SER  28           HB3      SER  28 -14.532  15.009  -8.732
  216    HG   SER  28           HG       SER  28 -12.853  16.652  -8.640
  217    H    GLU  29           H        GLU  29 -10.304  14.383  -9.728
  218    HA   GLU  29           HA       GLU  29 -10.261  12.680  -7.350
  219    HB2  GLU  29           HB2      GLU  29  -7.849  13.696  -8.859
  220    HB3  GLU  29           HB3      GLU  29  -7.963  12.365  -7.721
  221    HG2  GLU  29           HG2      GLU  29  -8.080  11.052  -9.515
  222    HG3  GLU  29           HG3      GLU  29  -9.783  11.507  -9.562
  223    H    GLU  30           H        GLU  30  -9.327  13.009  -5.394
  224    HA   GLU  30           HA       GLU  30  -8.929  15.858  -4.524
  225    HB2  GLU  30           HB2      GLU  30  -9.807  13.522  -2.796
  226    HB3  GLU  30           HB3      GLU  30  -9.770  15.234  -2.385
  227    HG2  GLU  30           HG2      GLU  30 -11.560  15.629  -4.121
  228    HG3  GLU  30           HG3      GLU  30 -11.599  13.886  -4.418
  229    H    GLN  31           H        GLN  31  -6.837  16.383  -3.655
  230    HA   GLN  31           HA       GLN  31  -4.981  14.121  -3.194
  231    HB2  GLN  31           HB2      GLN  31  -4.620  17.047  -3.952
  232    HB3  GLN  31           HB3      GLN  31  -3.297  16.061  -3.301
  233    HG2  GLN  31           HG2      GLN  31  -3.750  14.357  -5.036
  234    HG3  GLN  31           HG3      GLN  31  -4.858  15.495  -5.865
  235   HE21  GLN  31          HE22      GLN  31  -1.733  14.736  -4.654
  236   HE22  GLN  31          HE21      GLN  31  -1.131  16.264  -5.000
  237    H    VAL  32           H        VAL  32  -4.472  13.581  -1.219
  238    HA   VAL  32           HA       VAL  32  -4.985  15.483   1.033
  239    HB   VAL  32           HB       VAL  32  -6.146  13.755   2.239
  240   HG11  VAL  32          HG11      VAL  32  -7.463  14.026  -0.484
  241   HG12  VAL  32          HG12      VAL  32  -8.246  13.743   1.079
  242   HG13  VAL  32          HG13      VAL  32  -7.448  15.291   0.764
  243   HG21  VAL  32          HG21      VAL  32  -5.138  11.710   1.293
  244   HG22  VAL  32          HG22      VAL  32  -6.897  11.653   1.226
  245   HG23  VAL  32          HG23      VAL  32  -5.971  12.007  -0.250
  246    H    ASP  33           H        ASP  33  -4.125  14.964   3.011
  247    HA   ASP  33           HA       ASP  33  -1.559  13.470   3.011
  248    HB2  ASP  33           HB2      ASP  33  -3.030  14.874   5.260
  249    HB3  ASP  33           HB3      ASP  33  -1.452  14.098   5.388
  250    H    VAL  34           H        VAL  34  -1.245  11.502   4.054
  251    HA   VAL  34           HA       VAL  34  -3.358   9.718   3.693
  252    HB   VAL  34           HB       VAL  34  -0.895   9.230   3.590
  253   HG11  VAL  34          HG11      VAL  34  -1.240   8.626   6.560
  254   HG12  VAL  34          HG12      VAL  34   0.145   8.197   5.558
  255   HG13  VAL  34          HG13      VAL  34  -0.220   9.906   5.854
  256   HG21  VAL  34          HG21      VAL  34  -2.630   7.507   3.235
  257   HG22  VAL  34          HG22      VAL  34  -1.161   6.857   3.974
  258   HG23  VAL  34          HG23      VAL  34  -2.600   7.124   4.969
  259    H    GLU  35           H        GLU  35  -2.825  11.483   6.607
  260    HA   GLU  35           HA       GLU  35  -4.281   9.831   8.457
  261    HB2  GLU  35           HB2      GLU  35  -2.846  11.784   9.001
  262    HB3  GLU  35           HB3      GLU  35  -4.053  12.871   8.319
  263    HG2  GLU  35           HG2      GLU  35  -5.613  12.365  10.078
  264    HG3  GLU  35           HG3      GLU  35  -4.685  10.946  10.590
  265    H    LEU  36           H        LEU  36  -5.361  11.874   5.813
  266    HA   LEU  36           HA       LEU  36  -8.089  12.190   6.822
  267    HB2  LEU  36           HB2      LEU  36  -6.843  13.114   4.221
  268    HB3  LEU  36           HB3      LEU  36  -8.297  13.749   4.979
  269    HG   LEU  36           HG       LEU  36  -5.449  14.060   6.042
  270   HD11  LEU  36          HD11      LEU  36  -7.375  16.090   4.850
  271   HD12  LEU  36          HD12      LEU  36  -5.739  16.397   5.471
  272   HD13  LEU  36          HD13      LEU  36  -5.957  15.400   4.029
  273   HD21  LEU  36          HD21      LEU  36  -7.016  13.990   7.920
  274   HD22  LEU  36          HD22      LEU  36  -6.501  15.657   7.632
  275   HD23  LEU  36          HD23      LEU  36  -8.106  15.129   7.091
  276    H    VAL  37           H        VAL  37  -6.688   9.745   5.052
  277    HA   VAL  37           HA       VAL  37  -9.173   9.056   3.538
  278    HB   VAL  37           HB       VAL  37  -7.411   8.926   2.031
  279   HG11  VAL  37          HG11      VAL  37  -5.739   7.377   4.043
  280   HG12  VAL  37          HG12      VAL  37  -5.307   7.686   2.349
  281   HG13  VAL  37          HG13      VAL  37  -5.456   9.040   3.465
  282   HG21  VAL  37          HG21      VAL  37  -8.850   6.924   1.988
  283   HG22  VAL  37          HG22      VAL  37  -7.195   6.563   1.462
  284   HG23  VAL  37          HG23      VAL  37  -7.722   6.072   3.068
  285    H    GLN  38           H        GLN  38 -10.285   7.202   3.996
  286    HA   GLN  38           HA       GLN  38  -9.680   5.900   6.634
  287    HB2  GLN  38           HB2      GLN  38 -12.308   6.690   5.313
  288    HB3  GLN  38           HB3      GLN  38 -12.195   5.605   6.689
  289    HG2  GLN  38           HG2      GLN  38 -11.323   7.327   8.119
  290    HG3  GLN  38           HG3      GLN  38 -11.037   8.419   6.750
  291   HE21  GLN  38          HE22      GLN  38 -13.842   6.612   8.130
  292   HE22  GLN  38          HE21      GLN  38 -14.914   7.955   7.737
  293    H    ARG  39           H        ARG  39 -10.551   3.695   6.874
  294    HA   ARG  39           HA       ARG  39 -10.160   2.078   4.434
  295    HB2  ARG  39           HB2      ARG  39 -10.570   0.136   5.670
  296    HB3  ARG  39           HB3      ARG  39  -9.488   1.160   6.629
  297    HG2  ARG  39           HG2      ARG  39 -11.568   1.906   7.885
  298    HG3  ARG  39           HG3      ARG  39 -12.446   0.643   7.018
  299    HD2  ARG  39           HD2      ARG  39 -11.164  -1.109   8.011
  300    HD3  ARG  39           HD3      ARG  39  -9.997   0.040   8.709
  301    HE   ARG  39           HE       ARG  39 -12.127   0.920   9.965
  302   HH11  ARG  39          HH11      ARG  39 -11.384  -2.544   9.649
  303   HH12  ARG  39          HH12      ARG  39 -12.457  -2.887  10.996
  304   HH21  ARG  39          HH21      ARG  39 -13.334   0.368  11.549
  305   HH22  ARG  39          HH22      ARG  39 -13.686  -1.310  11.902
  306    H    GLY  40           H        GLY  40 -11.769   1.293   3.064
  307    HA2  GLY  40           HA2      GLY  40 -14.034   0.921   2.441
  308    HA3  GLY  40           HA3      GLY  40 -14.569   2.186   3.538
  309    H    ASP  41           H        ASP  41 -11.799   3.465   2.217
  310    HA   ASP  41           HA       ASP  41 -13.228   4.942   0.086
  311    HB2  ASP  41           HB2      ASP  41 -10.501   5.361   1.345
  312    HB3  ASP  41           HB3      ASP  41 -11.248   6.406   0.145
  313    H    ILE  42           H        ILE  42 -12.202   5.360  -1.989
  314    HA   ILE  42           HA       ILE  42 -10.551   3.084  -2.984
  315    HB   ILE  42           HB       ILE  42 -12.632   4.668  -4.517
  316   HG12  ILE  42          HG12      ILE  42 -12.669   1.794  -3.467
  317   HG13  ILE  42          HG13      ILE  42 -13.644   3.127  -2.850
  318   HG21  ILE  42          HG21      ILE  42 -10.705   3.915  -5.918
  319   HG22  ILE  42          HG22      ILE  42 -10.939   2.251  -5.334
  320   HG23  ILE  42          HG23      ILE  42 -12.173   3.053  -6.335
  321   HD11  ILE  42          HD11      ILE  42 -13.920   1.823  -5.575
  322   HD12  ILE  42          HD12      ILE  42 -15.057   1.797  -4.220
  323   HD13  ILE  42          HD13      ILE  42 -14.761   3.318  -5.087
  324    H    ILE  43           H        ILE  43  -8.568   3.593  -3.464
  325    HA   ILE  43           HA       ILE  43  -7.790   6.396  -4.077
  326    HB   ILE  43           HB       ILE  43  -6.343   4.107  -2.681
  327   HG12  ILE  43          HG12      ILE  43  -8.152   4.802  -1.238
  328   HG13  ILE  43          HG13      ILE  43  -6.625   5.346  -0.579
  329   HG21  ILE  43          HG21      ILE  43  -5.522   7.018  -3.001
  330   HG22  ILE  43          HG22      ILE  43  -4.725   5.845  -1.936
  331   HG23  ILE  43          HG23      ILE  43  -4.716   5.594  -3.678
  332   HD11  ILE  43          HD11      ILE  43  -8.448   7.044  -0.390
  333   HD12  ILE  43          HD12      ILE  43  -7.064   7.651  -1.323
  334   HD13  ILE  43          HD13      ILE  43  -8.557   7.122  -2.134
  335    H    LYS  44           H        LYS  44  -6.713   6.845  -5.918
  336    HA   LYS  44           HA       LYS  44  -5.908   4.684  -7.727
  337    HB2  LYS  44           HB2      LYS  44  -7.107   6.652  -8.510
  338    HB3  LYS  44           HB3      LYS  44  -5.737   7.684  -8.069
  339    HG2  LYS  44           HG2      LYS  44  -4.306   6.664  -9.681
  340    HG3  LYS  44           HG3      LYS  44  -5.377   5.279  -9.922
  341    HD2  LYS  44           HD2      LYS  44  -6.344   8.066 -10.548
  342    HD3  LYS  44           HD3      LYS  44  -5.297   7.178 -11.689
  343    HE2  LYS  44           HE2      LYS  44  -6.970   5.263 -11.555
  344    HE3  LYS  44           HE3      LYS  44  -8.040   6.361 -10.663
  345    HZ1  LYS  44           HZ1      LYS  44  -7.049   6.694 -13.435
  346    HZ2  LYS  44           HZ2      LYS  44  -8.577   6.385 -12.988
  347    HZ3  LYS  44           HZ3      LYS  44  -7.916   7.861 -12.641
  348    H    VAL  45           H        VAL  45  -3.992   3.799  -7.996
  349    HA   VAL  45           HA       VAL  45  -1.564   5.210  -6.999
  350    HB   VAL  45           HB       VAL  45  -2.196   3.173  -5.770
  351   HG11  VAL  45          HG11      VAL  45  -1.534   1.641  -8.316
  352   HG12  VAL  45          HG12      VAL  45  -1.870   0.968  -6.719
  353   HG13  VAL  45          HG13      VAL  45  -3.150   1.824  -7.591
  354   HG21  VAL  45          HG21      VAL  45   0.164   3.913  -5.867
  355   HG22  VAL  45          HG22      VAL  45   0.013   2.150  -5.743
  356   HG23  VAL  45          HG23      VAL  45   0.424   2.891  -7.300
  357    H    VAL  46           H        VAL  46   0.037   5.658  -8.339
  358    HA   VAL  46           HA       VAL  46  -0.310   5.219 -11.220
  359    HB   VAL  46           HB       VAL  46   1.554   6.806 -11.446
  360   HG11  VAL  46          HG11      VAL  46  -0.489   7.788  -9.431
  361   HG12  VAL  46          HG12      VAL  46   0.485   8.769 -10.536
  362   HG13  VAL  46          HG13      VAL  46  -0.733   7.661 -11.185
  363   HG21  VAL  46          HG21      VAL  46   2.994   6.253  -9.596
  364   HG22  VAL  46          HG22      VAL  46   2.499   7.939  -9.450
  365   HG23  VAL  46          HG23      VAL  46   1.761   6.700  -8.418
  366    HA   PRO  47           HA       PRO  47   3.053   2.224 -11.746
  367    HB2  PRO  47           HB2      PRO  47   4.335   3.102 -14.019
  368    HB3  PRO  47           HB3      PRO  47   2.772   2.231 -14.037
  369    HG2  PRO  47           HG2      PRO  47   3.236   5.230 -14.144
  370    HG3  PRO  47           HG3      PRO  47   2.184   4.231 -15.199
  371    HD2  PRO  47           HD2      PRO  47   1.150   5.586 -13.112
  372    HD3  PRO  47           HD3      PRO  47   0.582   3.941 -13.476
  373    H    GLY  48           H        GLY  48   5.049   2.113 -10.926
  374    HA2  GLY  48           HA2      GLY  48   7.182   2.698 -10.218
  375    HA3  GLY  48           HA3      GLY  48   6.913   4.376 -10.696
  376    H    GLY  49           H        GLY  49   4.221   3.969  -8.940
  377    HA2  GLY  49           HA2      GLY  49   5.395   5.318  -6.638
  378    HA3  GLY  49           HA3      GLY  49   3.683   5.023  -6.927
  379    H    LYS  50           H        LYS  50   4.944   4.843  -4.442
  380    HA   LYS  50           HA       LYS  50   4.857   1.948  -3.725
  381    HB2  LYS  50           HB2      LYS  50   5.691   4.442  -2.219
  382    HB3  LYS  50           HB3      LYS  50   5.341   2.935  -1.368
  383    HG2  LYS  50           HG2      LYS  50   7.087   1.749  -2.488
  384    HG3  LYS  50           HG3      LYS  50   7.364   3.079  -3.633
  385    HD2  LYS  50           HD2      LYS  50   8.119   4.536  -1.856
  386    HD3  LYS  50           HD3      LYS  50   7.807   3.313  -0.616
  387    HE2  LYS  50           HE2      LYS  50   9.634   2.651  -2.937
  388    HE3  LYS  50           HE3      LYS  50  10.235   3.740  -1.693
  389    HZ1  LYS  50           HZ1      LYS  50  10.106   2.132  -0.073
  390    HZ2  LYS  50           HZ2      LYS  50   9.130   1.101  -0.933
  391    HZ3  LYS  50           HZ3      LYS  50  10.699   1.312  -1.360
  392    H    PHE  51           H        PHE  51   3.227   1.018  -2.573
  393    HA   PHE  51           HA       PHE  51   0.638   2.266  -2.547
  394    HB2  PHE  51           HB2      PHE  51   1.660  -0.211  -1.129
  395    HB3  PHE  51           HB3      PHE  51  -0.027   0.284  -1.150
  396    HD1  PHE  51           HD1      PHE  51  -1.337   0.263  -3.294
  397    HD2  PHE  51           HD2      PHE  51   2.659  -1.310  -3.026
  398    HE1  PHE  51           HE1      PHE  51  -1.640  -0.917  -5.458
  399    HE2  PHE  51           HE2      PHE  51   2.390  -2.393  -5.231
  400    HZ   PHE  51           HZ       PHE  51   0.231  -2.205  -6.459
  401    HA   PRO  52           HA       PRO  52   1.276   4.293   1.435
  402    HB2  PRO  52           HB2      PRO  52  -0.846   5.974   1.508
  403    HB3  PRO  52           HB3      PRO  52   0.461   6.149   0.298
  404    HG2  PRO  52           HG2      PRO  52  -2.236   4.812  -0.058
  405    HG3  PRO  52           HG3      PRO  52  -1.443   6.007  -1.130
  406    HD2  PRO  52           HD2      PRO  52  -1.312   3.276  -1.545
  407    HD3  PRO  52           HD3      PRO  52  -0.008   4.403  -2.025
  408    H    VAL  53           H        VAL  53  -1.244   2.062   0.888
  409    HA   VAL  53           HA       VAL  53  -1.866   1.675   3.729
  410    HB   VAL  53           HB       VAL  53  -4.317   1.573   3.260
  411   HG11  VAL  53          HG11      VAL  53  -3.156   4.358   2.889
  412   HG12  VAL  53          HG12      VAL  53  -4.756   3.925   3.530
  413   HG13  VAL  53          HG13      VAL  53  -3.297   3.500   4.438
  414   HG21  VAL  53          HG21      VAL  53  -4.219   1.461   0.789
  415   HG22  VAL  53          HG22      VAL  53  -5.261   2.772   1.374
  416   HG23  VAL  53          HG23      VAL  53  -3.646   3.145   0.750
  417    H    ASP  54           H        ASP  54  -3.513  -0.358   3.789
  418    HA   ASP  54           HA       ASP  54  -2.713  -2.241   1.635
  419    HB2  ASP  54           HB2      ASP  54  -2.487  -4.051   3.005
  420    HB3  ASP  54           HB3      ASP  54  -1.537  -2.762   3.723
  421    H    GLY  55           H        GLY  55  -4.152  -3.790   0.900
  422    HA2  GLY  55           HA2      GLY  55  -6.875  -4.055   1.430
  423    HA3  GLY  55           HA3      GLY  55  -6.752  -2.552   0.525
  424    H    ARG  56           H        ARG  56  -8.076  -3.550  -1.007
  425    HA   ARG  56           HA       ARG  56  -6.845  -5.682  -2.727
  426    HB2  ARG  56           HB2      ARG  56  -9.011  -6.133  -1.439
  427    HB3  ARG  56           HB3      ARG  56  -9.797  -5.051  -2.591
  428    HG2  ARG  56           HG2      ARG  56  -9.122  -6.560  -4.457
  429    HG3  ARG  56           HG3      ARG  56  -8.256  -7.576  -3.300
  430    HD2  ARG  56           HD2      ARG  56 -10.265  -8.708  -3.707
  431    HD3  ARG  56           HD3      ARG  56 -10.463  -7.998  -2.113
  432    HE   ARG  56           HE       ARG  56 -11.921  -7.377  -4.605
  433   HH11  ARG  56          HH11      ARG  56 -11.591  -6.541  -1.216
  434   HH12  ARG  56          HH12      ARG  56 -12.904  -5.416  -1.271
  435   HH21  ARG  56          HH21      ARG  56 -13.721  -6.067  -4.552
  436   HH22  ARG  56          HH22      ARG  56 -14.058  -5.126  -3.114
  437    H    VAL  57           H        VAL  57  -6.764  -5.565  -4.888
  438    HA   VAL  57           HA       VAL  57  -6.934  -2.945  -6.270
  439    HB   VAL  57           HB       VAL  57  -5.969  -5.689  -7.219
  440   HG11  VAL  57          HG11      VAL  57  -5.695  -2.923  -8.478
  441   HG12  VAL  57          HG12      VAL  57  -4.893  -4.401  -9.065
  442   HG13  VAL  57          HG13      VAL  57  -6.644  -4.286  -9.113
  443   HG21  VAL  57          HG21      VAL  57  -4.222  -3.340  -6.440
  444   HG22  VAL  57          HG22      VAL  57  -4.468  -4.794  -5.446
  445   HG23  VAL  57          HG23      VAL  57  -3.698  -4.921  -7.030
  446    H    ILE  58           H        ILE  58  -8.749  -2.505  -7.495
  447    HA   ILE  58           HA       ILE  58 -10.200  -4.780  -8.774
  448    HB   ILE  58           HB       ILE  58 -12.409  -3.609  -8.106
  449   HG12  ILE  58          HG12      ILE  58 -10.721  -2.681  -5.753
  450   HG13  ILE  58          HG13      ILE  58 -11.129  -1.599  -7.101
  451   HG21  ILE  58          HG21      ILE  58 -10.901  -5.079  -5.917
  452   HG22  ILE  58          HG22      ILE  58 -12.650  -4.988  -6.175
  453   HG23  ILE  58          HG23      ILE  58 -11.649  -5.855  -7.334
  454   HD11  ILE  58          HD11      ILE  58 -13.131  -2.930  -5.229
  455   HD12  ILE  58          HD12      ILE  58 -12.706  -1.210  -5.316
  456   HD13  ILE  58          HD13      ILE  58 -13.555  -1.971  -6.671
  457    H    GLU  59           H        GLU  59  -8.395  -2.711  -9.789
  458    HA   GLU  59           HA       GLU  59  -9.760  -2.544 -12.300
  459    HB2  GLU  59           HB2      GLU  59 -10.426  -0.366 -10.829
  460    HB3  GLU  59           HB3      GLU  59  -8.853   0.180 -11.398
  461    HG2  GLU  59           HG2      GLU  59 -11.223  -0.715 -13.087
  462    HG3  GLU  59           HG3      GLU  59 -10.737   0.951 -12.810
  463    H    GLY  60           H        GLY  60  -8.142  -2.794 -13.842
  464    HA2  GLY  60           HA2      GLY  60  -6.145  -2.345 -14.938
  465    HA3  GLY  60           HA3      GLY  60  -5.561  -1.442 -13.546
  466    H    HIS  61           H        HIS  61  -3.668  -2.712 -14.486
  467    HA   HIS  61           HA       HIS  61  -3.195  -5.142 -12.896
  468    HB2  HIS  61           HB2      HIS  61  -2.840  -6.671 -14.605
  469    HB3  HIS  61           HB3      HIS  61  -4.362  -5.914 -14.983
  470    HD1  HIS  61           HD1      HIS  61  -4.341  -4.253 -17.193
  471    HD2  HIS  61           HD2      HIS  61  -0.865  -6.485 -16.387
  472    HE1  HIS  61           HE1      HIS  61  -2.961  -4.250 -19.341
  473    H    SER  62           H        SER  62  -1.263  -5.266 -12.159
  474    HA   SER  62           HA       SER  62   1.081  -4.161 -13.501
  475    HB2  SER  62           HB2      SER  62  -0.085  -2.830 -11.068
  476    HB3  SER  62           HB3      SER  62   1.653  -2.932 -11.188
  477    HG   SER  62           HG       SER  62   0.261  -1.109 -12.277
  478    H    MET  63           H        MET  63   3.107  -4.409 -12.193
  479    HA   MET  63           HA       MET  63   3.054  -6.990 -10.712
  480    HB2  MET  63           HB2      MET  63   4.100  -7.078 -12.915
  481    HB3  MET  63           HB3      MET  63   5.251  -5.818 -12.445
  482    HG2  MET  63           HG2      MET  63   6.301  -7.226 -10.867
  483    HG3  MET  63           HG3      MET  63   4.969  -8.384 -10.849
  484    HE1  MET  63           HE1      MET  63   5.386 -10.596 -13.897
  485    HE2  MET  63           HE2      MET  63   4.760 -10.442 -12.239
  486    HE3  MET  63           HE3      MET  63   4.184  -9.346 -13.513
  487    H    VAL  64           H        VAL  64   3.819  -7.015  -8.740
  488    HA   VAL  64           HA       VAL  64   4.782  -4.463  -7.543
  489    HB   VAL  64           HB       VAL  64   2.854  -6.548  -6.487
  490   HG11  VAL  64          HG11      VAL  64   3.921  -4.116  -4.992
  491   HG12  VAL  64          HG12      VAL  64   2.573  -5.146  -4.478
  492   HG13  VAL  64          HG13      VAL  64   4.203  -5.813  -4.567
  493   HG21  VAL  64          HG21      VAL  64   1.853  -4.945  -8.043
  494   HG22  VAL  64          HG22      VAL  64   1.333  -4.540  -6.398
  495   HG23  VAL  64          HG23      VAL  64   2.604  -3.592  -7.190
  496    H    ASP  65           H        ASP  65   6.367  -4.386  -6.125
  497    HA   ASP  65           HA       ASP  65   7.953  -6.877  -5.675
  498    HB2  ASP  65           HB2      ASP  65   8.975  -5.094  -7.026
  499    HB3  ASP  65           HB3      ASP  65   8.813  -3.968  -5.681
  500    H    GLU  66           H        GLU  66   7.032  -7.715  -3.869
  501    HA   GLU  66           HA       GLU  66   6.482  -6.109  -1.474
  502    HB2  GLU  66           HB2      GLU  66   6.053  -9.072  -1.875
  503    HB3  GLU  66           HB3      GLU  66   5.389  -8.014  -0.605
  504    HG2  GLU  66           HG2      GLU  66   4.078  -6.812  -2.340
  505    HG3  GLU  66           HG3      GLU  66   4.619  -8.002  -3.534
  506    H    SER  67           H        SER  67   9.316  -6.718  -2.359
  507    HA   SER  67           HA       SER  67  10.661  -8.655  -1.095
  508    HB2  SER  67           HB2      SER  67  12.635  -7.215  -1.533
  509    HB3  SER  67           HB3      SER  67  11.485  -7.208  -2.869
  510    HG   SER  67           HG       SER  67  12.157  -5.095  -2.381
  511    H    LEU  68           H        LEU  68   9.277  -6.237   0.835
  512    HA   LEU  68           HA       LEU  68  11.288  -6.618   3.023
  513    HB2  LEU  68           HB2      LEU  68  11.316  -4.397   1.702
  514    HB3  LEU  68           HB3      LEU  68   9.764  -4.051   2.425
  515    HG   LEU  68           HG       LEU  68  11.578  -2.865   3.478
  516   HD11  LEU  68          HD11      LEU  68  11.123  -3.194   5.756
  517   HD12  LEU  68          HD12      LEU  68   9.630  -3.629   4.904
  518   HD13  LEU  68          HD13      LEU  68  10.704  -4.897   5.543
  519   HD21  LEU  68          HD21      LEU  68  13.411  -4.461   3.093
  520   HD22  LEU  68          HD22      LEU  68  13.343  -3.883   4.763
  521   HD23  LEU  68          HD23      LEU  68  12.759  -5.514   4.377
  522    H    ILE  69           H        ILE  69   7.902  -6.030   2.144
  523    HA   ILE  69           HA       ILE  69   6.948  -6.375   4.913
  524    HB   ILE  69           HB       ILE  69   5.259  -6.398   2.393
  525   HG12  ILE  69          HG12      ILE  69   6.349  -4.254   2.401
  526   HG13  ILE  69          HG13      ILE  69   4.679  -4.073   2.879
  527   HG21  ILE  69          HG21      ILE  69   4.598  -6.062   5.354
  528   HG22  ILE  69          HG22      ILE  69   3.459  -5.714   4.044
  529   HG23  ILE  69          HG23      ILE  69   4.061  -7.353   4.266
  530   HD11  ILE  69          HD11      ILE  69   5.410  -3.866   5.261
  531   HD12  ILE  69          HD12      ILE  69   7.102  -3.970   4.720
  532   HD13  ILE  69          HD13      ILE  69   6.081  -2.613   4.191
  533    H    THR  70           H        THR  70   6.419  -8.359   1.918
  534    HA   THR  70           HA       THR  70   5.760 -10.678   3.665
  535    HB   THR  70           HB       THR  70   4.750 -11.683   1.729
  536    HG1  THR  70           HG1      THR  70   4.677 -10.255  -0.200
  537   HG21  THR  70          HG21      THR  70   2.939 -10.150   1.281
  538   HG22  THR  70          HG22      THR  70   3.407  -9.938   2.974
  539   HG23  THR  70          HG23      THR  70   3.913  -8.748   1.753
  540    H    GLY  71           H        GLY  71   8.383  -9.502   1.809
  541    HA2  GLY  71           HA2      GLY  71  10.530 -10.279   1.802
  542    HA3  GLY  71           HA3      GLY  71  10.012 -11.703   2.697
  543    H    GLU  72           H        GLU  72   8.222 -11.501  -0.110
  544    HA   GLU  72           HA       GLU  72   9.183 -13.800  -1.362
  545    HB2  GLU  72           HB2      GLU  72   7.952 -11.426  -2.810
  546    HB3  GLU  72           HB3      GLU  72   7.969 -13.088  -3.383
  547    HG2  GLU  72           HG2      GLU  72   6.564 -12.140  -0.849
  548    HG3  GLU  72           HG3      GLU  72   5.787 -12.267  -2.411
  549    H    ALA  73           H        ALA  73  10.046 -10.478  -2.412
  550    HA   ALA  73           HA       ALA  73  11.920  -9.501  -3.085
  551    HB1  ALA  73           HB1      ALA  73  13.462 -12.092  -2.837
  552    HB2  ALA  73           HB2      ALA  73  14.094 -10.447  -2.981
  553    HB3  ALA  73           HB3      ALA  73  13.214 -10.921  -1.516
  554    H    MET  74           H        MET  74  10.555 -12.130  -4.622
  555    HA   MET  74           HA       MET  74  11.558 -11.485  -7.314
  556    HB2  MET  74           HB2      MET  74  11.090 -13.805  -6.571
  557    HB3  MET  74           HB3      MET  74   9.378 -13.380  -6.375
  558    HG2  MET  74           HG2      MET  74   9.197 -12.866  -8.724
  559    HG3  MET  74           HG3      MET  74  10.924 -13.177  -8.970
  560    HE1  MET  74           HE1      MET  74  12.027 -15.525  -9.099
  561    HE2  MET  74           HE2      MET  74  11.561 -15.869  -7.415
  562    HE3  MET  74           HE3      MET  74  11.210 -17.048  -8.692
  563    HA   PRO  75           HA       PRO  75   8.083  -8.636  -8.058
  564    HB2  PRO  75           HB2      PRO  75   8.323  -9.568 -10.902
  565    HB3  PRO  75           HB3      PRO  75   8.303  -7.896 -10.255
  566    HG2  PRO  75           HG2      PRO  75  10.608  -9.039 -11.113
  567    HG3  PRO  75           HG3      PRO  75  10.582  -8.034  -9.626
  568    HD2  PRO  75           HD2      PRO  75  10.514 -11.068  -9.830
  569    HD3  PRO  75           HD3      PRO  75  11.484 -10.006  -8.770
  570    H    VAL  76           H        VAL  76   5.914  -8.949  -7.865
  571    HA   VAL  76           HA       VAL  76   4.705 -11.610  -8.538
  572    HB   VAL  76           HB       VAL  76   4.113  -9.655  -6.282
  573   HG11  VAL  76          HG11      VAL  76   2.032 -10.809  -6.918
  574   HG12  VAL  76          HG12      VAL  76   2.871 -12.377  -6.855
  575   HG13  VAL  76          HG13      VAL  76   2.647 -11.412  -5.382
  576   HG21  VAL  76          HG21      VAL  76   6.190 -10.899  -5.885
  577   HG22  VAL  76          HG22      VAL  76   4.925 -11.502  -4.821
  578   HG23  VAL  76          HG23      VAL  76   5.378 -12.434  -6.266
  579    H    ALA  77           H        ALA  77   2.779 -11.739  -9.667
  580    HA   ALA  77           HA       ALA  77   1.928  -9.359 -11.102
  581    HB1  ALA  77           HB1      ALA  77   2.181 -11.533 -12.199
  582    HB2  ALA  77           HB2      ALA  77   0.952 -12.246 -11.128
  583    HB3  ALA  77           HB3      ALA  77   0.496 -10.989 -12.291
  584    H    LYS  78           H        LYS  78   0.210  -8.087 -10.770
  585    HA   LYS  78           HA       LYS  78  -2.056  -8.969  -9.009
  586    HB2  LYS  78           HB2      LYS  78  -1.013  -6.133  -9.318
  587    HB3  LYS  78           HB3      LYS  78  -2.257  -6.684  -8.209
  588    HG2  LYS  78           HG2      LYS  78   0.696  -7.456  -8.056
  589    HG3  LYS  78           HG3      LYS  78  -0.077  -6.149  -7.178
  590    HD2  LYS  78           HD2      LYS  78  -1.513  -7.750  -5.968
  591    HD3  LYS  78           HD3      LYS  78  -0.805  -9.104  -6.873
  592    HE2  LYS  78           HE2      LYS  78   1.423  -8.607  -5.949
  593    HE3  LYS  78           HE3      LYS  78   0.787  -7.175  -5.130
  594    HZ1  LYS  78           HZ1      LYS  78   0.114  -9.998  -4.483
  595    HZ2  LYS  78           HZ2      LYS  78   0.925  -8.918  -3.549
  596    HZ3  LYS  78           HZ3      LYS  78  -0.666  -8.696  -3.832
  597    H    LYS  79           H        LYS  79  -4.116  -8.356  -9.574
  598    HA   LYS  79           HA       LYS  79  -4.799  -7.078 -12.158
  599    HB2  LYS  79           HB2      LYS  79  -5.030 -10.015 -11.379
  600    HB3  LYS  79           HB3      LYS  79  -6.288  -9.315 -12.368
  601    HG2  LYS  79           HG2      LYS  79  -4.616  -8.665 -14.084
  602    HG3  LYS  79           HG3      LYS  79  -3.321  -9.315 -13.067
  603    HD2  LYS  79           HD2      LYS  79  -3.849 -10.929 -14.779
  604    HD3  LYS  79           HD3      LYS  79  -4.326 -11.577 -13.205
  605    HE2  LYS  79           HE2      LYS  79  -6.694 -10.928 -13.664
  606    HE3  LYS  79           HE3      LYS  79  -6.197 -10.264 -15.230
  607    HZ1  LYS  79           HZ1      LYS  79  -5.466 -12.493 -15.861
  608    HZ2  LYS  79           HZ2      LYS  79  -5.998 -13.114 -14.413
  609    HZ3  LYS  79           HZ3      LYS  79  -7.056 -12.475 -15.498
  610    HA   PRO  80           HA       PRO  80  -8.451  -6.071  -9.661
  611    HB2  PRO  80           HB2      PRO  80 -10.692  -6.801 -11.094
  612    HB3  PRO  80           HB3      PRO  80  -9.720  -5.331 -11.421
  613    HG2  PRO  80           HG2      PRO  80  -9.547  -8.019 -12.797
  614    HG3  PRO  80           HG3      PRO  80  -9.612  -6.391 -13.539
  615    HD2  PRO  80           HD2      PRO  80  -7.253  -7.663 -13.228
  616    HD3  PRO  80           HD3      PRO  80  -7.397  -5.920 -12.933
  617    H    GLY  81           H        GLY  81  -9.353  -7.087  -7.967
  618    HA2  GLY  81           HA2      GLY  81 -10.078  -8.803  -6.575
  619    HA3  GLY  81           HA3      GLY  81  -9.967  -9.967  -7.894
  620    H    SER  82           H        SER  82  -7.342  -7.797  -6.744
  621    HA   SER  82           HA       SER  82  -5.829 -10.162  -5.648
  622    HB2  SER  82           HB2      SER  82  -4.741  -7.846  -7.307
  623    HB3  SER  82           HB3      SER  82  -3.739  -8.965  -6.386
  624    HG   SER  82           HG       SER  82  -5.535  -9.850  -8.411
  625    H    THR  83           H        THR  83  -4.454  -9.686  -3.767
  626    HA   THR  83           HA       THR  83  -5.117  -7.102  -2.455
  627    HB   THR  83           HB       THR  83  -4.165  -8.310  -0.411
  628    HG1  THR  83           HG1      THR  83  -3.864 -10.392  -0.538
  629   HG21  THR  83          HG21      THR  83  -6.552  -7.849  -0.738
  630   HG22  THR  83          HG22      THR  83  -6.708  -9.274  -1.792
  631   HG23  THR  83          HG23      THR  83  -6.330  -9.470  -0.062
  632    H    VAL  84           H        VAL  84  -3.657  -5.845  -1.382
  633    HA   VAL  84           HA       VAL  84  -0.752  -6.153  -1.945
  634    HB   VAL  84           HB       VAL  84  -0.640  -3.726  -2.550
  635   HG11  VAL  84          HG11      VAL  84  -2.275  -5.410  -4.479
  636   HG12  VAL  84          HG12      VAL  84  -1.284  -3.996  -4.879
  637   HG13  VAL  84          HG13      VAL  84  -0.511  -5.470  -4.271
  638   HG21  VAL  84          HG21      VAL  84  -3.657  -3.912  -2.959
  639   HG22  VAL  84          HG22      VAL  84  -2.856  -2.995  -1.667
  640   HG23  VAL  84          HG23      VAL  84  -2.604  -2.544  -3.357
  641    H    ILE  85           H        ILE  85   0.593  -4.648  -0.725
  642    HA   ILE  85           HA       ILE  85  -0.533  -3.636   1.805
  643    HB   ILE  85           HB       ILE  85   1.823  -4.518   2.763
  644   HG12  ILE  85          HG12      ILE  85   2.215  -6.851   2.257
  645   HG13  ILE  85          HG13      ILE  85   0.994  -6.848   0.987
  646   HG21  ILE  85          HG21      ILE  85  -0.767  -6.084   2.717
  647   HG22  ILE  85          HG22      ILE  85   0.572  -6.328   3.859
  648   HG23  ILE  85          HG23      ILE  85  -0.298  -4.794   3.860
  649   HD11  ILE  85          HD11      ILE  85   3.354  -6.715   0.164
  650   HD12  ILE  85          HD12      ILE  85   2.375  -5.340  -0.374
  651   HD13  ILE  85          HD13      ILE  85   3.510  -5.146   0.984
  652    H    ALA  86           H        ALA  86   0.570  -2.022   2.840
  653    HA   ALA  86           HA       ALA  86   1.527  -0.038   1.134
  654    HB1  ALA  86           HB1      ALA  86   0.308   0.352   3.236
  655    HB2  ALA  86           HB2      ALA  86   1.724  -0.188   4.166
  656    HB3  ALA  86           HB3      ALA  86   1.808   1.285   3.176
  657    H    GLY  87           H        GLY  87   3.481   1.118   1.008
  658    HA2  GLY  87           HA2      GLY  87   5.778   1.557   1.171
  659    HA3  GLY  87           HA3      GLY  87   5.939   0.199   2.293
  660    H    SER  88           H        SER  88   4.451  -1.279  -0.135
  661    HA   SER  88           HA       SER  88   6.918  -2.222  -1.507
  662    HB2  SER  88           HB2      SER  88   4.042  -3.189  -1.728
  663    HB3  SER  88           HB3      SER  88   5.471  -3.933  -2.477
  664    HG   SER  88           HG       SER  88   4.804  -3.681   0.257
  665    H    ILE  89           H        ILE  89   6.867  -2.356  -3.919
  666    HA   ILE  89           HA       ILE  89   5.943   0.272  -4.945
  667    HB   ILE  89           HB       ILE  89   7.773  -1.229  -6.672
  668   HG12  ILE  89          HG12      ILE  89   8.762  -2.055  -4.585
  669   HG13  ILE  89          HG13      ILE  89   9.818  -1.029  -5.526
  670   HG21  ILE  89          HG21      ILE  89   7.836   1.570  -5.465
  671   HG22  ILE  89          HG22      ILE  89   8.912   0.963  -6.742
  672   HG23  ILE  89          HG23      ILE  89   7.175   1.104  -7.043
  673   HD11  ILE  89          HD11      ILE  89   8.325  -0.103  -3.036
  674   HD12  ILE  89          HD12      ILE  89   9.999  -0.658  -3.097
  675   HD13  ILE  89          HD13      ILE  89   9.534   0.815  -3.968
  676    H    ASN  90           H        ASN  90   4.835   0.548  -6.858
  677    HA   ASN  90           HA       ASN  90   3.634  -1.836  -8.198
  678    HB2  ASN  90           HB2      ASN  90   2.092  -0.171  -7.094
  679    HB3  ASN  90           HB3      ASN  90   2.800   1.106  -8.074
  680   HD21  ASN  90          HD22      ASN  90   1.492   1.623  -9.771
  681   HD22  ASN  90          HD21      ASN  90   0.439   0.475 -10.579
  682    H    GLN  91           H        GLN  91   3.961  -2.133 -10.473
  683    HA   GLN  91           HA       GLN  91   4.893   0.103 -12.080
  684    HB2  GLN  91           HB2      GLN  91   6.986  -0.908 -11.096
  685    HB3  GLN  91           HB3      GLN  91   6.577  -2.438 -11.872
  686    HG2  GLN  91           HG2      GLN  91   8.279  -1.054 -13.106
  687    HG3  GLN  91           HG3      GLN  91   6.867  -1.467 -14.076
  688   HE21  GLN  91          HE22      GLN  91   8.185   1.242 -12.023
  689   HE22  GLN  91          HE21      GLN  91   7.294   2.470 -12.926
  690    H    ASN  92           H        ASN  92   4.424  -0.085 -14.236
  691    HA   ASN  92           HA       ASN  92   4.123  -1.335 -16.235
  692    HB2  ASN  92           HB2      ASN  92   3.568  -3.539 -15.244
  693    HB3  ASN  92           HB3      ASN  92   2.004  -2.875 -14.749
  694   HD21  ASN  92          HD22      ASN  92   0.382  -3.579 -16.072
  695   HD22  ASN  92          HD21      ASN  92   0.594  -3.861 -17.787
  696    H    GLY  93           H        GLY  93   1.319  -0.642 -14.080
  697    HA2  GLY  93           HA2      GLY  93   0.630   1.777 -15.588
  698    HA3  GLY  93           HA3      GLY  93  -0.474   0.431 -15.846
  699    H    SER  94           H        SER  94  -1.593   2.591 -14.949
  700    HA   SER  94           HA       SER  94  -1.633   2.923 -12.084
  701    HB2  SER  94           HB2      SER  94  -3.688   3.942 -14.076
  702    HB3  SER  94           HB3      SER  94  -3.374   4.549 -12.443
  703    HG   SER  94           HG       SER  94  -1.719   4.678 -14.743
  704    H    LEU  95           H        LEU  95  -3.014   2.141 -10.552
  705    HA   LEU  95           HA       LEU  95  -5.313   0.416 -11.411
  706    HB2  LEU  95           HB2      LEU  95  -3.834   0.019  -8.854
  707    HB3  LEU  95           HB3      LEU  95  -4.816  -1.119  -9.711
  708    HG   LEU  95           HG       LEU  95  -1.982  -0.258 -10.468
  709   HD11  LEU  95          HD11      LEU  95  -3.075  -2.716  -9.020
  710   HD12  LEU  95          HD12      LEU  95  -1.393  -2.488  -9.517
  711   HD13  LEU  95          HD13      LEU  95  -2.085  -1.423  -8.306
  712   HD21  LEU  95          HD21      LEU  95  -2.043  -2.180 -11.958
  713   HD22  LEU  95          HD22      LEU  95  -3.688  -2.591 -11.408
  714   HD23  LEU  95          HD23      LEU  95  -3.392  -1.117 -12.363
  715    H    LEU  96           H        LEU  96  -7.015   0.156  -9.787
  716    HA   LEU  96           HA       LEU  96  -7.234   2.420  -7.828
  717    HB2  LEU  96           HB2      LEU  96  -9.464   0.948  -9.274
  718    HB3  LEU  96           HB3      LEU  96  -9.706   1.862  -7.817
  719    HG   LEU  96           HG       LEU  96 -10.430   3.241  -9.541
  720   HD11  LEU  96          HD11      LEU  96  -8.999   4.296  -7.747
  721   HD12  LEU  96          HD12      LEU  96  -7.663   4.285  -8.924
  722   HD13  LEU  96          HD13      LEU  96  -9.135   5.214  -9.259
  723   HD21  LEU  96          HD21      LEU  96  -9.342   2.335 -11.514
  724   HD22  LEU  96          HD22      LEU  96  -9.060   4.059 -11.402
  725   HD23  LEU  96          HD23      LEU  96  -7.760   2.934 -10.974
  726    H    ILE  97           H        ILE  97  -7.096   1.957  -5.808
  727    HA   ILE  97           HA       ILE  97  -7.340  -0.864  -4.892
  728    HB   ILE  97           HB       ILE  97  -5.914   1.406  -3.480
  729   HG12  ILE  97          HG12      ILE  97  -4.812   1.361  -5.619
  730   HG13  ILE  97          HG13      ILE  97  -3.774   0.737  -4.357
  731   HG21  ILE  97          HG21      ILE  97  -5.653  -1.624  -3.306
  732   HG22  ILE  97          HG22      ILE  97  -4.654  -0.455  -2.417
  733   HG23  ILE  97          HG23      ILE  97  -6.392  -0.553  -2.107
  734   HD11  ILE  97          HD11      ILE  97  -3.633  -0.553  -6.477
  735   HD12  ILE  97          HD12      ILE  97  -4.119  -1.544  -5.090
  736   HD13  ILE  97          HD13      ILE  97  -5.327  -1.029  -6.294
  737    H    CYS  98           H        CYS  98  -9.014  -1.343  -3.506
  738    HA   CYS  98           HA       CYS  98 -10.360   0.901  -2.067
  739    HB2  CYS  98           HB2      CYS  98 -12.121  -0.685  -1.506
  740    HB3  CYS  98           HB3      CYS  98 -11.917  -0.498  -3.252
  741    HG   CYS  98           HG       CYS  98 -10.425  -2.811  -1.451
  742    H    ALA  99           H        ALA  99  -9.812   1.338  -0.082
  743    HA   ALA  99           HA       ALA  99  -7.673  -0.198   1.174
  744    HB1  ALA  99           HB1      ALA  99  -9.154   2.303   2.094
  745    HB2  ALA  99           HB2      ALA  99  -7.641   1.666   2.781
  746    HB3  ALA  99           HB3      ALA  99  -7.678   2.267   1.109
  747    H    THR 100           H        THR 100  -7.730  -1.548   2.911
  748    HA   THR 100           HA       THR 100 -10.311  -1.847   4.429
  749    HB   THR 100           HB       THR 100  -9.504  -4.100   5.041
  750    HG1  THR 100           HG1      THR 100  -7.805  -4.940   3.758
  751   HG21  THR 100          HG21      THR 100 -11.011  -3.811   3.087
  752   HG22  THR 100          HG22      THR 100  -9.596  -3.682   2.018
  753   HG23  THR 100          HG23      THR 100  -9.923  -5.190   2.904
  754    H    HIS 101           H        HIS 101  -7.038  -0.791   4.729
  755    HA   HIS 101           HA       HIS 101  -7.517  -0.323   7.622
  756    HB2  HIS 101           HB2      HIS 101  -4.950  -1.434   6.417
  757    HB3  HIS 101           HB3      HIS 101  -5.172  -0.943   8.097
  758    HD1  HIS 101           HD1      HIS 101  -6.020  -3.791   5.712
  759    HD2  HIS 101           HD2      HIS 101  -6.820  -2.510   9.638
  760    HE1  HIS 101           HE1      HIS 101  -7.237  -5.724   6.868
  761    H    VAL 102           H        VAL 102  -6.788   1.607   8.365
  762    HA   VAL 102           HA       VAL 102  -5.818   3.672   6.541
  763    HB   VAL 102           HB       VAL 102  -5.680   5.036   8.650
  764   HG11  VAL 102          HG11      VAL 102  -7.652   4.900   7.110
  765   HG12  VAL 102          HG12      VAL 102  -8.342   3.641   8.159
  766   HG13  VAL 102          HG13      VAL 102  -8.073   5.294   8.777
  767   HG21  VAL 102          HG21      VAL 102  -6.727   4.253  10.677
  768   HG22  VAL 102          HG22      VAL 102  -6.972   2.638   9.991
  769   HG23  VAL 102          HG23      VAL 102  -5.328   3.244  10.296
  770    H    GLY 103           H        GLY 103  -3.748   5.047   7.426
  771    HA2  GLY 103           HA2      GLY 103  -1.661   3.171   6.576
  772    HA3  GLY 103           HA3      GLY 103  -1.476   4.878   6.847
  773    H    ALA 104           H        ALA 104  -2.456   4.991   9.580
  774    HA   ALA 104           HA       ALA 104  -0.235   4.121  11.143
  775    HB1  ALA 104           HB1      ALA 104  -3.094   4.814  11.958
  776    HB2  ALA 104           HB2      ALA 104  -1.704   4.698  13.055
  777    HB3  ALA 104           HB3      ALA 104  -1.735   5.949  11.800
  778    H    ASP 105           H        ASP 105  -3.495   2.653  10.817
  779    HA   ASP 105           HA       ASP 105  -2.863   0.333  12.342
  780    HB2  ASP 105           HB2      ASP 105  -5.153   1.408  11.928
  781    HB3  ASP 105           HB3      ASP 105  -5.175   0.507  10.407
  782    H    THR 106           H        THR 106  -1.525   0.907   9.387
  783    HA   THR 106           HA       THR 106  -1.984  -1.599   7.991
  784    HB   THR 106           HB       THR 106   0.126  -1.120   6.779
  785    HG1  THR 106           HG1      THR 106   0.169   1.361   8.074
  786   HG21  THR 106          HG21      THR 106  -1.845  -0.371   5.746
  787   HG22  THR 106          HG22      THR 106  -1.938   1.051   6.781
  788   HG23  THR 106          HG23      THR 106  -0.624   0.913   5.592
  789    H    THR 107           H        THR 107  -0.751  -3.433   7.889
  790    HA   THR 107           HA       THR 107   0.139  -4.480  10.300
  791    HB   THR 107           HB       THR 107  -0.663  -5.767   8.353
  792    HG1  THR 107           HG1      THR 107   0.239  -6.958   9.925
  793   HG21  THR 107          HG21      THR 107   2.188  -5.550   7.289
  794   HG22  THR 107          HG22      THR 107   0.861  -6.516   6.621
  795   HG23  THR 107          HG23      THR 107   0.765  -4.753   6.569
  796    H    LEU 108           H        LEU 108   2.102  -2.551   8.184
  797    HA   LEU 108           HA       LEU 108   4.757  -3.180   8.858
  798    HB2  LEU 108           HB2      LEU 108   3.270  -0.541   8.493
  799    HB3  LEU 108           HB3      LEU 108   5.002  -0.604   8.775
  800    HG   LEU 108           HG       LEU 108   5.398  -1.754   6.675
  801   HD11  LEU 108          HD11      LEU 108   2.388  -1.568   6.263
  802   HD12  LEU 108          HD12      LEU 108   3.580  -1.961   4.997
  803   HD13  LEU 108          HD13      LEU 108   3.359  -3.074   6.346
  804   HD21  LEU 108          HD21      LEU 108   5.249   0.702   6.766
  805   HD22  LEU 108          HD22      LEU 108   4.680   0.099   5.196
  806   HD23  LEU 108          HD23      LEU 108   3.505   0.614   6.435
  807    H    SER 109           H        SER 109   2.406  -1.226  10.698
  808    HA   SER 109           HA       SER 109   4.163  -0.587  12.902
  809    HB2  SER 109           HB2      SER 109   2.154   0.247  13.968
  810    HB3  SER 109           HB3      SER 109   2.157   0.743  12.265
  811    HG   SER 109           HG       SER 109   0.616  -0.816  11.812
  812    H    GLN 110           H        GLN 110   2.173  -3.333  12.153
  813    HA   GLN 110           HA       GLN 110   2.068  -4.415  14.892
  814    HB2  GLN 110           HB2      GLN 110   0.267  -4.718  13.068
  815    HB3  GLN 110           HB3      GLN 110   1.345  -5.884  12.342
  816    HG2  GLN 110           HG2      GLN 110   0.020  -7.251  13.633
  817    HG3  GLN 110           HG3      GLN 110   1.393  -7.024  14.715
  818   HE21  GLN 110          HE22      GLN 110  -1.859  -5.667  13.896
  819   HE22  GLN 110          HE21      GLN 110  -2.178  -5.073  15.510
  820    H    ILE 111           H        ILE 111   3.843  -5.092  11.856
  821    HA   ILE 111           HA       ILE 111   5.324  -7.329  12.661
  822    HB   ILE 111           HB       ILE 111   5.974  -5.062  10.747
  823   HG12  ILE 111          HG12      ILE 111   5.279  -7.989  10.196
  824   HG13  ILE 111          HG13      ILE 111   4.054  -6.743  10.328
  825   HG21  ILE 111          HG21      ILE 111   7.570  -7.639  11.157
  826   HG22  ILE 111          HG22      ILE 111   7.793  -6.499   9.816
  827   HG23  ILE 111          HG23      ILE 111   8.152  -5.985  11.455
  828   HD11  ILE 111          HD11      ILE 111   5.109  -5.496   8.437
  829   HD12  ILE 111          HD12      ILE 111   6.247  -6.849   8.223
  830   HD13  ILE 111          HD13      ILE 111   4.511  -7.109   8.000
  831    H    VAL 112           H        VAL 112   6.328  -3.848  13.166
  832    HA   VAL 112           HA       VAL 112   8.682  -4.624  14.592
  833    HB   VAL 112           HB       VAL 112   8.789  -2.294  15.335
  834   HG11  VAL 112          HG11      VAL 112   8.016  -2.582  12.404
  835   HG12  VAL 112          HG12      VAL 112   8.972  -1.271  13.113
  836   HG13  VAL 112          HG13      VAL 112   9.619  -2.918  13.092
  837   HG21  VAL 112          HG21      VAL 112   6.321  -1.880  15.616
  838   HG22  VAL 112          HG22      VAL 112   7.169  -0.638  14.690
  839   HG23  VAL 112          HG23      VAL 112   6.171  -1.837  13.846
  840    H    LYS 113           H        LYS 113   5.431  -4.668  15.693
  841    HA   LYS 113           HA       LYS 113   6.095  -4.536  18.576
  842    HB2  LYS 113           HB2      LYS 113   3.496  -5.000  17.130
  843    HB3  LYS 113           HB3      LYS 113   3.703  -5.160  18.880
  844    HG2  LYS 113           HG2      LYS 113   4.577  -2.853  19.038
  845    HG3  LYS 113           HG3      LYS 113   4.343  -2.630  17.305
  846    HD2  LYS 113           HD2      LYS 113   2.140  -3.186  19.333
  847    HD3  LYS 113           HD3      LYS 113   2.546  -1.605  18.626
  848    HE2  LYS 113           HE2      LYS 113   2.111  -2.537  16.370
  849    HE3  LYS 113           HE3      LYS 113   1.582  -4.056  17.110
  850    HZ1  LYS 113           HZ1      LYS 113  -0.252  -2.364  16.569
  851    HZ2  LYS 113           HZ2      LYS 113  -0.251  -2.877  18.148
  852    HZ3  LYS 113           HZ3      LYS 113   0.360  -1.422  17.731
  853    H    LEU 114           H        LEU 114   5.766  -6.916  16.042
  854    HA   LEU 114           HA       LEU 114   5.931  -9.257  17.829
  855    HB2  LEU 114           HB2      LEU 114   5.796  -8.710  14.866
  856    HB3  LEU 114           HB3      LEU 114   6.626 -10.177  15.363
  857    HG   LEU 114           HG       LEU 114   3.767  -9.430  16.023
  858   HD11  LEU 114          HD11      LEU 114   4.892 -11.446  14.029
  859   HD12  LEU 114          HD12      LEU 114   3.173 -11.167  14.382
  860   HD13  LEU 114          HD13      LEU 114   4.131  -9.892  13.619
  861   HD21  LEU 114          HD21      LEU 114   3.676 -11.954  16.585
  862   HD22  LEU 114          HD22      LEU 114   5.459 -11.919  16.560
  863   HD23  LEU 114          HD23      LEU 114   4.549 -10.939  17.729
  864    H    VAL 115           H        VAL 115   8.103  -7.740  15.402
  865    HA   VAL 115           HA       VAL 115  10.265  -9.426  15.994
  866    HB   VAL 115           HB       VAL 115  10.221  -6.721  14.619
  867   HG11  VAL 115          HG11      VAL 115  12.392  -8.870  14.583
  868   HG12  VAL 115          HG12      VAL 115  12.311  -7.477  13.485
  869   HG13  VAL 115          HG13      VAL 115  12.562  -7.220  15.208
  870   HG21  VAL 115          HG21      VAL 115   8.826  -8.526  13.544
  871   HG22  VAL 115          HG22      VAL 115  10.213  -8.068  12.554
  872   HG23  VAL 115          HG23      VAL 115  10.257  -9.567  13.501
  873    H    GLU 116           H        GLU 116   9.335  -6.549  17.828
  874    HA   GLU 116           HA       GLU 116  11.979  -6.155  18.964
  875    HB2  GLU 116           HB2      GLU 116  10.021  -4.499  18.954
  876    HB3  GLU 116           HB3      GLU 116   9.360  -5.427  20.313
  877    HG2  GLU 116           HG2      GLU 116  11.566  -5.076  21.508
  878    HG3  GLU 116           HG3      GLU 116  12.106  -4.092  20.148
  879    H    GLU 117           H        GLU 117   9.393  -8.584  19.703
  880    HA   GLU 117           HA       GLU 117  10.601  -9.284  22.290
  881    HB2  GLU 117           HB2      GLU 117   8.247 -10.218  20.609
  882    HB3  GLU 117           HB3      GLU 117   8.803 -11.114  22.023
  883    HG2  GLU 117           HG2      GLU 117   8.330  -8.185  22.458
  884    HG3  GLU 117           HG3      GLU 117   6.933  -9.148  22.036
  885    H    ALA 118           H        ALA 118  11.218  -9.762  18.984
  886    HA   ALA 118           HA       ALA 118  11.712 -12.647  19.043
  887    HB1  ALA 118           HB1      ALA 118  12.421 -10.628  16.882
  888    HB2  ALA 118           HB2      ALA 118  12.286 -12.373  16.715
  889    HB3  ALA 118           HB3      ALA 118  10.816 -11.429  17.036
  890    H    GLN 119           H        GLN 119  13.619  -9.687  19.385
  891    HA   GLN 119           HA       GLN 119  16.224 -11.077  19.454
  892    HB2  GLN 119           HB2      GLN 119  15.384  -8.172  19.829
  893    HB3  GLN 119           HB3      GLN 119  16.998  -8.769  20.152
  894    HG2  GLN 119           HG2      GLN 119  17.131  -7.886  17.993
  895    HG3  GLN 119           HG3      GLN 119  17.076  -9.657  17.763
  896   HE21  GLN 119          HE22      GLN 119  14.870  -6.868  18.043
  897   HE22  GLN 119          HE21      GLN 119  13.668  -7.697  17.080
  Start of MODEL   10
    1    H    SER   1           H        SER   1  18.903  -4.385  13.705
    2    HA   SER   1           HA       SER   1  16.257  -3.461  14.727
    3    HB2  SER   1           HB2      SER   1  19.062  -2.641  15.522
    4    HB3  SER   1           HB3      SER   1  17.565  -2.028  16.252
    5    HG   SER   1           HG       SER   1  17.250  -3.899  17.256
    6    H    GLU   2           H        GLU   2  18.646  -2.534  12.363
    7    HA   GLU   2           HA       GLU   2  17.627   0.189  11.957
    8    HB2  GLU   2           HB2      GLU   2  19.943  -0.438  11.269
    9    HB3  GLU   2           HB3      GLU   2  19.279  -1.609  10.114
   10    HG2  GLU   2           HG2      GLU   2  18.076   0.250   8.956
   11    HG3  GLU   2           HG3      GLU   2  18.767   1.397  10.105
   12    H    ALA   3           H        ALA   3  17.167  -3.071  10.432
   13    HA   ALA   3           HA       ALA   3  15.277  -2.314   8.515
   14    HB1  ALA   3           HB1      ALA   3  15.713  -4.963   9.947
   15    HB2  ALA   3           HB2      ALA   3  14.833  -4.735   8.421
   16    HB3  ALA   3           HB3      ALA   3  16.573  -4.396   8.497
   17    H    LEU   4           H        LEU   4  14.881  -3.021  11.930
   18    HA   LEU   4           HA       LEU   4  12.024  -3.436  11.949
   19    HB2  LEU   4           HB2      LEU   4  13.630  -4.115  13.776
   20    HB3  LEU   4           HB3      LEU   4  13.850  -2.416  14.160
   21    HG   LEU   4           HG       LEU   4  11.370  -2.267  14.678
   22   HD11  LEU   4          HD11      LEU   4  11.630  -5.294  14.486
   23   HD12  LEU   4          HD12      LEU   4  10.227  -4.412  15.149
   24   HD13  LEU   4          HD13      LEU   4  10.637  -4.271  13.432
   25   HD21  LEU   4          HD21      LEU   4  13.065  -2.492  16.445
   26   HD22  LEU   4          HD22      LEU   4  11.583  -3.364  16.851
   27   HD23  LEU   4          HD23      LEU   4  13.013  -4.264  16.285
   28    H    ALA   5           H        ALA   5  14.026  -0.512  11.796
   29    HA   ALA   5           HA       ALA   5  11.725   1.282  12.266
   30    HB1  ALA   5           HB1      ALA   5  14.628   1.853  11.518
   31    HB2  ALA   5           HB2      ALA   5  13.364   3.066  11.803
   32    HB3  ALA   5           HB3      ALA   5  13.895   2.019  13.128
   33    H    LYS   6           H        LYS   6  13.999   0.305   9.654
   34    HA   LYS   6           HA       LYS   6  13.124   1.700   7.508
   35    HB2  LYS   6           HB2      LYS   6  15.054   0.063   7.817
   36    HB3  LYS   6           HB3      LYS   6  13.919  -1.206   7.317
   37    HG2  LYS   6           HG2      LYS   6  13.626  -0.158   5.145
   38    HG3  LYS   6           HG3      LYS   6  14.568   1.265   5.656
   39    HD2  LYS   6           HD2      LYS   6  16.554  -0.163   6.009
   40    HD3  LYS   6           HD3      LYS   6  15.629  -1.595   5.510
   41    HE2  LYS   6           HE2      LYS   6  15.356  -0.707   3.265
   42    HE3  LYS   6           HE3      LYS   6  16.065   0.841   3.746
   43    HZ1  LYS   6           HZ1      LYS   6  18.169  -0.239   4.105
   44    HZ2  LYS   6           HZ2      LYS   6  17.550  -1.729   3.941
   45    HZ3  LYS   6           HZ3      LYS   6  17.676  -0.727   2.618
   46    H    LEU   7           H        LEU   7  11.618  -1.399   8.534
   47    HA   LEU   7           HA       LEU   7   9.794  -1.893   6.512
   48    HB2  LEU   7           HB2      LEU   7   9.819  -2.236   9.495
   49    HB3  LEU   7           HB3      LEU   7   8.224  -2.231   8.789
   50    HG   LEU   7           HG       LEU   7   8.995  -4.472   9.098
   51   HD11  LEU   7          HD11      LEU   7   8.547  -5.394   6.897
   52   HD12  LEU   7          HD12      LEU   7   7.476  -4.036   7.249
   53   HD13  LEU   7          HD13      LEU   7   8.848  -3.823   6.131
   54   HD21  LEU   7          HD21      LEU   7  11.362  -4.337   8.936
   55   HD22  LEU   7          HD22      LEU   7  10.810  -5.439   7.679
   56   HD23  LEU   7          HD23      LEU   7  11.302  -3.785   7.252
   57    H    ILE   8           H        ILE   8   9.256   0.410   9.150
   58    HA   ILE   8           HA       ILE   8   6.736   1.388   8.091
   59    HB   ILE   8           HB       ILE   8   8.522   2.444  10.291
   60   HG12  ILE   8          HG12      ILE   8   7.706   0.240  10.788
   61   HG13  ILE   8          HG13      ILE   8   6.872   1.407  11.800
   62   HG21  ILE   8          HG21      ILE   8   5.697   3.290   9.539
   63   HG22  ILE   8          HG22      ILE   8   6.495   3.662  11.072
   64   HG23  ILE   8          HG23      ILE   8   7.164   4.300   9.572
   65   HD11  ILE   8          HD11      ILE   8   4.874   1.204  10.234
   66   HD12  ILE   8          HD12      ILE   8   5.752  -0.088   9.384
   67   HD13  ILE   8          HD13      ILE   8   5.317  -0.289  11.080
   68    H    SER   9           H        SER   9  10.050   2.302   7.506
   69    HA   SER   9           HA       SER   9   9.509   5.042   6.670
   70    HB2  SER   9           HB2      SER   9  11.962   3.304   6.200
   71    HB3  SER   9           HB3      SER   9  11.852   5.057   6.006
   72    HG   SER   9           HG       SER   9  12.772   4.326   8.009
   73    H    LEU  10           H        LEU  10   9.644   1.876   5.075
   74    HA   LEU  10           HA       LEU  10   9.712   2.774   2.370
   75    HB2  LEU  10           HB2      LEU  10   8.699   0.283   3.767
   76    HB3  LEU  10           HB3      LEU  10   8.218   0.576   2.115
   77    HG   LEU  10           HG       LEU  10  10.724   0.892   1.554
   78   HD11  LEU  10          HD11      LEU  10  10.908  -0.633   4.186
   79   HD12  LEU  10          HD12      LEU  10  12.228  -0.458   2.998
   80   HD13  LEU  10          HD13      LEU  10  11.610   0.969   3.839
   81   HD21  LEU  10          HD21      LEU  10   9.562  -1.799   2.360
   82   HD22  LEU  10          HD22      LEU  10   9.375  -0.984   0.796
   83   HD23  LEU  10          HD23      LEU  10  10.974  -1.545   1.286
   84    H    GLN  11           H        GLN  11   7.147   3.245   4.642
   85    HA   GLN  11           HA       GLN  11   4.945   3.219   2.770
   86    HB2  GLN  11           HB2      GLN  11   5.189   4.442   5.501
   87    HB3  GLN  11           HB3      GLN  11   3.710   4.407   4.530
   88    HG2  GLN  11           HG2      GLN  11   3.906   1.901   4.369
   89    HG3  GLN  11           HG3      GLN  11   5.270   1.972   5.501
   90   HE21  GLN  11          HE22      GLN  11   4.764   3.250   7.608
   91   HE22  GLN  11          HE21      GLN  11   3.133   2.975   8.241
   92    H    ALA  12           H        ALA  12   3.713   4.887   2.026
   93    HA   ALA  12           HA       ALA  12   5.069   7.370   1.186
   94    HB1  ALA  12           HB1      ALA  12   3.639   6.121  -0.391
   95    HB2  ALA  12           HB2      ALA  12   2.262   6.280   0.718
   96    HB3  ALA  12           HB3      ALA  12   2.951   7.723  -0.050
   97    H    THR  13           H        THR  13   4.151   9.455   1.654
   98    HA   THR  13           HA       THR  13   2.781   9.692   4.301
   99    HB   THR  13           HB       THR  13   4.343  11.791   2.805
  100    HG1  THR  13           HG1      THR  13   5.380  10.379   4.986
  101   HG21  THR  13          HG21      THR  13   3.493  11.528   5.714
  102   HG22  THR  13          HG22      THR  13   4.744  12.669   5.158
  103   HG23  THR  13          HG23      THR  13   3.089  12.832   4.582
  104    H    GLU  14           H        GLU  14   2.051   9.939   1.002
  105    HA   GLU  14           HA       GLU  14  -0.405  11.504   1.565
  106    HB2  GLU  14           HB2      GLU  14  -0.178  12.683  -0.524
  107    HB3  GLU  14           HB3      GLU  14   1.234  12.983   0.477
  108    HG2  GLU  14           HG2      GLU  14   1.209  10.940  -1.783
  109    HG3  GLU  14           HG3      GLU  14   1.607  12.635  -2.013
  110    H    ALA  15           H        ALA  15  -2.158  11.184   0.026
  111    HA   ALA  15           HA       ALA  15  -2.062   8.762  -1.670
  112    HB1  ALA  15           HB1      ALA  15  -4.072   9.136   0.593
  113    HB2  ALA  15           HB2      ALA  15  -4.092   7.825  -0.610
  114    HB3  ALA  15           HB3      ALA  15  -2.756   7.942   0.555
  115    H    THR  16           H        THR  16  -3.696   8.669  -3.273
  116    HA   THR  16           HA       THR  16  -5.322  11.159  -3.632
  117    HB   THR  16           HB       THR  16  -4.855   9.156  -5.830
  118    HG1  THR  16           HG1      THR  16  -3.261  10.393  -6.531
  119   HG21  THR  16          HG21      THR  16  -5.369  11.164  -7.226
  120   HG22  THR  16          HG22      THR  16  -6.714  10.772  -6.149
  121   HG23  THR  16          HG23      THR  16  -5.625  12.118  -5.754
  122    H    ILE  17           H        ILE  17  -7.360  10.993  -2.876
  123    HA   ILE  17           HA       ILE  17  -8.864   8.429  -2.993
  124    HB   ILE  17           HB       ILE  17  -9.947  11.072  -1.978
  125   HG12  ILE  17          HG12      ILE  17  -8.354   9.107  -0.295
  126   HG13  ILE  17          HG13      ILE  17  -7.877  10.752  -0.716
  127   HG21  ILE  17          HG21      ILE  17 -10.609   8.196  -1.250
  128   HG22  ILE  17          HG22      ILE  17 -11.500   9.655  -0.758
  129   HG23  ILE  17          HG23      ILE  17 -11.510   9.168  -2.438
  130   HD11  ILE  17          HD11      ILE  17 -10.229   9.975   1.045
  131   HD12  ILE  17          HD12      ILE  17  -8.730  10.762   1.533
  132   HD13  ILE  17          HD13      ILE  17  -9.876  11.632   0.496
  133    H    VAL  18           H        VAL  18 -10.273   7.971  -4.690
  134    HA   VAL  18           HA       VAL  18 -11.101  10.290  -6.402
  135    HB   VAL  18           HB       VAL  18 -10.261   7.571  -7.401
  136   HG11  VAL  18          HG11      VAL  18 -11.093  10.112  -8.867
  137   HG12  VAL  18          HG12      VAL  18 -10.377   8.678  -9.631
  138   HG13  VAL  18          HG13      VAL  18 -11.957   8.558  -8.860
  139   HG21  VAL  18          HG21      VAL  18  -8.285   8.699  -6.680
  140   HG22  VAL  18          HG22      VAL  18  -8.373   8.944  -8.426
  141   HG23  VAL  18          HG23      VAL  18  -8.846  10.249  -7.327
  142    H    THR  19           H        THR  19 -13.172  10.594  -6.789
  143    HA   THR  19           HA       THR  19 -15.133   8.381  -6.389
  144    HB   THR  19           HB       THR  19 -15.548  11.046  -5.013
  145    HG1  THR  19           HG1      THR  19 -13.821  10.298  -3.952
  146   HG21  THR  19          HG21      THR  19 -17.033   9.654  -3.557
  147   HG22  THR  19          HG22      THR  19 -17.555   9.695  -5.236
  148   HG23  THR  19          HG23      THR  19 -16.722   8.258  -4.609
  149    H    LEU  20           H        LEU  20 -17.118   8.615  -7.362
  150    HA   LEU  20           HA       LEU  20 -17.556  10.966  -9.144
  151    HB2  LEU  20           HB2      LEU  20 -18.791   8.709 -10.353
  152    HB3  LEU  20           HB3      LEU  20 -17.607   9.840 -10.937
  153    HG   LEU  20           HG       LEU  20 -15.795   8.376  -9.779
  154   HD11  LEU  20          HD11      LEU  20 -17.351   6.941  -8.395
  155   HD12  LEU  20          HD12      LEU  20 -18.089   6.348  -9.895
  156   HD13  LEU  20          HD13      LEU  20 -16.385   6.000  -9.536
  157   HD21  LEU  20          HD21      LEU  20 -16.194   8.549 -12.164
  158   HD22  LEU  20          HD22      LEU  20 -15.695   6.919 -11.679
  159   HD23  LEU  20          HD23      LEU  20 -17.408   7.242 -12.051
  160    H    ASP  21           H        ASP  21 -19.679  11.677  -9.531
  161    HA   ASP  21           HA       ASP  21 -21.895  10.537  -7.942
  162    HB2  ASP  21           HB2      ASP  21 -20.341  12.551  -6.843
  163    HB3  ASP  21           HB3      ASP  21 -21.552  13.495  -7.665
  164    H    SER  22           H        SER  22 -21.307  11.017 -10.834
  165    HA   SER  22           HA       SER  22 -23.815  12.469 -11.620
  166    HB2  SER  22           HB2      SER  22 -21.135  12.880 -12.979
  167    HB3  SER  22           HB3      SER  22 -22.692  13.598 -13.450
  168    HG   SER  22           HG       SER  22 -21.376  14.998 -12.215
  169    H    ASP  23           H        ASP  23 -22.297  11.773 -14.426
  170    HA   ASP  23           HA       ASP  23 -23.083   8.900 -14.555
  171    HB2  ASP  23           HB2      ASP  23 -24.480  10.516 -15.845
  172    HB3  ASP  23           HB3      ASP  23 -23.047  11.011 -16.746
  173    H    ASN  24           H        ASN  24 -20.844   8.914 -13.445
  174    HA   ASN  24           HA       ASN  24 -18.714   8.451 -13.334
  175    HB2  ASN  24           HB2      ASN  24 -19.386   6.897 -15.284
  176    HB3  ASN  24           HB3      ASN  24 -18.502   8.009 -16.317
  177   HD21  ASN  24          HD22      ASN  24 -16.130   8.143 -15.869
  178   HD22  ASN  24          HD21      ASN  24 -15.427   6.761 -14.998
  179    H    ILE  25           H        ILE  25 -19.282  10.627 -16.001
  180    HA   ILE  25           HA       ILE  25 -17.000  11.914 -16.497
  181    HB   ILE  25           HB       ILE  25 -18.315  13.991 -16.976
  182   HG12  ILE  25          HG12      ILE  25 -20.696  12.434 -15.860
  183   HG13  ILE  25          HG13      ILE  25 -19.926  13.805 -15.059
  184   HG21  ILE  25          HG21      ILE  25 -19.647  11.434 -17.959
  185   HG22  ILE  25          HG22      ILE  25 -19.547  12.997 -18.790
  186   HG23  ILE  25          HG23      ILE  25 -18.085  12.048 -18.538
  187   HD11  ILE  25          HD11      ILE  25 -20.523  15.261 -16.969
  188   HD12  ILE  25          HD12      ILE  25 -21.384  13.890 -17.722
  189   HD13  ILE  25          HD13      ILE  25 -21.933  14.539 -16.169
  190    H    LEU  26           H        LEU  26 -18.671  12.680 -13.451
  191    HA   LEU  26           HA       LEU  26 -17.327  14.996 -12.672
  192    HB2  LEU  26           HB2      LEU  26 -19.239  13.930 -11.486
  193    HB3  LEU  26           HB3      LEU  26 -18.189  12.612 -10.971
  194    HG   LEU  26           HG       LEU  26 -16.823  14.299  -9.648
  195   HD11  LEU  26          HD11      LEU  26 -19.212  16.101 -10.222
  196   HD12  LEU  26          HD12      LEU  26 -17.864  16.451  -9.125
  197   HD13  LEU  26          HD13      LEU  26 -17.567  16.374 -10.868
  198   HD21  LEU  26          HD21      LEU  26 -18.520  14.612  -7.872
  199   HD22  LEU  26          HD22      LEU  26 -19.746  13.999  -8.997
  200   HD23  LEU  26          HD23      LEU  26 -18.367  12.975  -8.457
  201    H    LEU  27           H        LEU  27 -16.182  11.885 -12.703
  202    HA   LEU  27           HA       LEU  27 -14.593  10.808 -10.991
  203    HB2  LEU  27           HB2      LEU  27 -14.357  10.509 -13.481
  204    HB3  LEU  27           HB3      LEU  27 -13.189  11.826 -13.486
  205    HG   LEU  27           HG       LEU  27 -11.690  10.466 -11.992
  206   HD11  LEU  27          HD11      LEU  27 -13.751   8.263 -12.430
  207   HD12  LEU  27          HD12      LEU  27 -12.153   8.059 -11.696
  208   HD13  LEU  27          HD13      LEU  27 -13.371   9.024 -10.867
  209   HD21  LEU  27          HD21      LEU  27 -11.460  10.369 -14.451
  210   HD22  LEU  27          HD22      LEU  27 -11.051   8.820 -13.695
  211   HD23  LEU  27          HD23      LEU  27 -12.621   9.020 -14.505
  212    H    SER  28           H        SER  28 -14.736  12.681  -9.336
  213    HA   SER  28           HA       SER  28 -12.704  14.703  -9.303
  214    HB2  SER  28           HB2      SER  28 -14.763  13.668  -7.334
  215    HB3  SER  28           HB3      SER  28 -13.539  14.825  -6.817
  216    HG   SER  28           HG       SER  28 -15.488  15.796  -7.534
  217    H    GLU  29           H        GLU  29 -10.699  14.804  -8.285
  218    HA   GLU  29           HA       GLU  29  -9.782  12.356  -6.852
  219    HB2  GLU  29           HB2      GLU  29  -8.122  14.155  -8.634
  220    HB3  GLU  29           HB3      GLU  29  -7.645  12.632  -7.856
  221    HG2  GLU  29           HG2      GLU  29  -9.095  11.353  -9.290
  222    HG3  GLU  29           HG3      GLU  29  -9.823  12.802  -9.969
  223    H    GLU  30           H        GLU  30  -8.989  12.713  -4.812
  224    HA   GLU  30           HA       GLU  30  -8.390  15.522  -3.935
  225    HB2  GLU  30           HB2      GLU  30  -9.265  13.189  -2.201
  226    HB3  GLU  30           HB3      GLU  30  -9.082  14.876  -1.737
  227    HG2  GLU  30           HG2      GLU  30 -11.015  15.474  -3.171
  228    HG3  GLU  30           HG3      GLU  30 -11.176  13.783  -3.669
  229    H    GLN  31           H        GLN  31  -6.222  15.841  -3.434
  230    HA   GLN  31           HA       GLN  31  -4.520  13.455  -2.891
  231    HB2  GLN  31           HB2      GLN  31  -3.779  16.286  -3.710
  232    HB3  GLN  31           HB3      GLN  31  -2.620  15.015  -3.274
  233    HG2  GLN  31           HG2      GLN  31  -3.497  13.590  -5.103
  234    HG3  GLN  31           HG3      GLN  31  -4.504  14.954  -5.671
  235   HE21  GLN  31          HE22      GLN  31  -1.449  13.518  -5.377
  236   HE22  GLN  31          HE21      GLN  31  -0.639  14.948  -5.216
  237    H    VAL  32           H        VAL  32  -4.070  13.076  -0.851
  238    HA   VAL  32           HA       VAL  32  -4.400  15.203   1.235
  239    HB   VAL  32           HB       VAL  32  -5.704  13.686   2.594
  240   HG11  VAL  32          HG11      VAL  32  -6.994  13.820  -0.153
  241   HG12  VAL  32          HG12      VAL  32  -7.800  13.688   1.417
  242   HG13  VAL  32          HG13      VAL  32  -6.916  15.169   1.007
  243   HG21  VAL  32          HG21      VAL  32  -5.727  11.728   0.263
  244   HG22  VAL  32          HG22      VAL  32  -4.832  11.498   1.783
  245   HG23  VAL  32          HG23      VAL  32  -6.595  11.579   1.803
  246    H    ASP  33           H        ASP  33  -3.746  14.402   3.392
  247    HA   ASP  33           HA       ASP  33  -1.100  13.107   3.355
  248    HB2  ASP  33           HB2      ASP  33  -1.651  15.062   4.795
  249    HB3  ASP  33           HB3      ASP  33  -2.719  14.005   5.720
  250    H    VAL  34           H        VAL  34  -0.595  11.114   4.283
  251    HA   VAL  34           HA       VAL  34  -2.505   8.998   4.058
  252    HB   VAL  34           HB       VAL  34  -0.049   8.805   3.769
  253   HG11  VAL  34          HG11      VAL  34   0.042   8.652   6.809
  254   HG12  VAL  34          HG12      VAL  34   1.378   8.342   5.689
  255   HG13  VAL  34          HG13      VAL  34   0.695   9.974   5.821
  256   HG21  VAL  34          HG21      VAL  34  -1.535   6.817   3.942
  257   HG22  VAL  34          HG22      VAL  34   0.125   6.527   4.491
  258   HG23  VAL  34          HG23      VAL  34  -1.174   6.729   5.677
  259    H    GLU  35           H        GLU  35  -1.934  11.103   6.801
  260    HA   GLU  35           HA       GLU  35  -3.585   9.365   8.558
  261    HB2  GLU  35           HB2      GLU  35  -1.536  10.800   9.280
  262    HB3  GLU  35           HB3      GLU  35  -2.658  12.155   9.200
  263    HG2  GLU  35           HG2      GLU  35  -2.661  11.488  11.456
  264    HG3  GLU  35           HG3      GLU  35  -4.154  10.814  10.836
  265    H    LEU  36           H        LEU  36  -4.193  11.871   6.233
  266    HA   LEU  36           HA       LEU  36  -6.803  12.639   7.411
  267    HB2  LEU  36           HB2      LEU  36  -5.300  13.548   4.935
  268    HB3  LEU  36           HB3      LEU  36  -6.861  14.179   5.443
  269    HG   LEU  36           HG       LEU  36  -4.295  14.423   7.074
  270   HD11  LEU  36          HD11      LEU  36  -5.821  16.473   5.406
  271   HD12  LEU  36          HD12      LEU  36  -4.385  16.792   6.405
  272   HD13  LEU  36          HD13      LEU  36  -4.246  15.752   4.984
  273   HD21  LEU  36          HD21      LEU  36  -5.536  16.095   8.357
  274   HD22  LEU  36          HD22      LEU  36  -7.027  15.661   7.478
  275   HD23  LEU  36          HD23      LEU  36  -6.208  14.475   8.533
  276    H    VAL  37           H        VAL  37  -5.619  10.292   5.204
  277    HA   VAL  37           HA       VAL  37  -8.212   9.937   3.823
  278    HB   VAL  37           HB       VAL  37  -6.176   9.424   2.597
  279   HG11  VAL  37          HG11      VAL  37  -5.706   7.151   4.568
  280   HG12  VAL  37          HG12      VAL  37  -4.799   7.468   3.075
  281   HG13  VAL  37          HG13      VAL  37  -4.730   8.627   4.405
  282   HG21  VAL  37          HG21      VAL  37  -8.289   8.208   2.073
  283   HG22  VAL  37          HG22      VAL  37  -6.814   7.330   1.639
  284   HG23  VAL  37          HG23      VAL  37  -7.724   6.856   3.083
  285    H    GLN  38           H        GLN  38  -9.663   8.258   4.229
  286    HA   GLN  38           HA       GLN  38  -9.343   6.734   6.794
  287    HB2  GLN  38           HB2      GLN  38 -11.853   7.933   5.566
  288    HB3  GLN  38           HB3      GLN  38 -11.842   6.834   6.930
  289    HG2  GLN  38           HG2      GLN  38 -10.546   8.455   8.264
  290    HG3  GLN  38           HG3      GLN  38 -10.568   9.602   6.913
  291   HE21  GLN  38          HE22      GLN  38 -13.046   9.885   6.107
  292   HE22  GLN  38          HE21      GLN  38 -14.186   9.855   7.463
  293    H    ARG  39           H        ARG  39 -10.616   4.819   6.895
  294    HA   ARG  39           HA       ARG  39 -10.486   3.169   4.436
  295    HB2  ARG  39           HB2      ARG  39 -11.077   1.308   5.801
  296    HB3  ARG  39           HB3      ARG  39  -9.869   2.257   6.669
  297    HG2  ARG  39           HG2      ARG  39 -12.068   3.359   7.752
  298    HG3  ARG  39           HG3      ARG  39 -12.801   1.838   7.251
  299    HD2  ARG  39           HD2      ARG  39 -11.093   0.601   8.554
  300    HD3  ARG  39           HD3      ARG  39 -10.324   2.128   8.986
  301    HE   ARG  39           HE       ARG  39 -12.928   1.058   9.964
  302   HH11  ARG  39          HH11      ARG  39 -10.707   3.815  10.216
  303   HH12  ARG  39          HH12      ARG  39 -11.295   4.149  11.848
  304   HH21  ARG  39          HH21      ARG  39 -13.707   1.826  11.910
  305   HH22  ARG  39          HH22      ARG  39 -12.889   3.196  12.675
  306    H    GLY  40           H        GLY  40 -12.257   2.557   3.125
  307    HA2  GLY  40           HA2      GLY  40 -14.734   2.234   3.085
  308    HA3  GLY  40           HA3      GLY  40 -14.875   3.849   3.763
  309    H    ASP  41           H        ASP  41 -12.311   4.117   1.644
  310    HA   ASP  41           HA       ASP  41 -14.054   4.823  -0.701
  311    HB2  ASP  41           HB2      ASP  41 -11.626   6.255   0.417
  312    HB3  ASP  41           HB3      ASP  41 -12.367   6.618  -1.143
  313    H    ILE  42           H        ILE  42 -12.321   5.357  -2.619
  314    HA   ILE  42           HA       ILE  42 -10.590   2.963  -3.000
  315    HB   ILE  42           HB       ILE  42 -12.348   4.286  -5.093
  316   HG12  ILE  42          HG12      ILE  42 -12.457   1.494  -3.848
  317   HG13  ILE  42          HG13      ILE  42 -13.594   2.801  -3.529
  318   HG21  ILE  42          HG21      ILE  42 -11.472   2.566  -6.635
  319   HG22  ILE  42          HG22      ILE  42 -10.165   3.564  -6.044
  320   HG23  ILE  42          HG23      ILE  42 -10.404   1.939  -5.357
  321   HD11  ILE  42          HD11      ILE  42 -13.271   1.310  -6.150
  322   HD12  ILE  42          HD12      ILE  42 -14.649   1.307  -5.044
  323   HD13  ILE  42          HD13      ILE  42 -14.256   2.783  -5.950
  324    H    ILE  43           H        ILE  43  -8.518   3.412  -3.394
  325    HA   ILE  43           HA       ILE  43  -7.669   6.172  -3.950
  326    HB   ILE  43           HB       ILE  43  -6.210   3.818  -2.694
  327   HG12  ILE  43          HG12      ILE  43  -8.017   4.251  -1.200
  328   HG13  ILE  43          HG13      ILE  43  -6.532   4.847  -0.489
  329   HG21  ILE  43          HG21      ILE  43  -4.627   5.468  -1.815
  330   HG22  ILE  43          HG22      ILE  43  -4.674   5.517  -3.577
  331   HG23  ILE  43          HG23      ILE  43  -5.496   6.773  -2.638
  332   HD11  ILE  43          HD11      ILE  43  -7.179   7.180  -1.094
  333   HD12  ILE  43          HD12      ILE  43  -8.695   6.557  -1.788
  334   HD13  ILE  43          HD13      ILE  43  -8.382   6.381  -0.062
  335    H    LYS  44           H        LYS  44  -6.611   6.588  -5.867
  336    HA   LYS  44           HA       LYS  44  -5.791   4.334  -7.588
  337    HB2  LYS  44           HB2      LYS  44  -5.913   7.298  -8.144
  338    HB3  LYS  44           HB3      LYS  44  -5.390   6.049  -9.294
  339    HG2  LYS  44           HG2      LYS  44  -7.608   4.846  -8.789
  340    HG3  LYS  44           HG3      LYS  44  -8.113   6.317  -7.961
  341    HD2  LYS  44           HD2      LYS  44  -9.033   6.471 -10.091
  342    HD3  LYS  44           HD3      LYS  44  -7.616   7.544 -10.159
  343    HE2  LYS  44           HE2      LYS  44  -6.338   5.852 -11.376
  344    HE3  LYS  44           HE3      LYS  44  -7.606   4.651 -11.095
  345    HZ1  LYS  44           HZ1      LYS  44  -7.865   7.036 -12.830
  346    HZ2  LYS  44           HZ2      LYS  44  -7.822   5.452 -13.299
  347    HZ3  LYS  44           HZ3      LYS  44  -9.102   6.002 -12.451
  348    H    VAL  45           H        VAL  45  -3.814   3.602  -7.983
  349    HA   VAL  45           HA       VAL  45  -1.455   5.098  -6.918
  350    HB   VAL  45           HB       VAL  45  -2.045   2.983  -5.790
  351   HG11  VAL  45          HG11      VAL  45  -1.284   1.593  -8.390
  352   HG12  VAL  45          HG12      VAL  45  -1.547   0.817  -6.822
  353   HG13  VAL  45          HG13      VAL  45  -2.891   1.634  -7.624
  354   HG21  VAL  45          HG21      VAL  45   0.294   3.806  -5.789
  355   HG22  VAL  45          HG22      VAL  45   0.226   2.042  -5.751
  356   HG23  VAL  45          HG23      VAL  45   0.635   2.884  -7.263
  357    H    VAL  46           H        VAL  46   0.213   5.652  -8.224
  358    HA   VAL  46           HA       VAL  46  -0.153   5.125 -11.116
  359    HB   VAL  46           HB       VAL  46   1.076   7.086 -11.566
  360   HG11  VAL  46          HG11      VAL  46  -0.261   8.795 -10.532
  361   HG12  VAL  46          HG12      VAL  46  -1.276   7.382 -10.861
  362   HG13  VAL  46          HG13      VAL  46  -0.717   7.720  -9.203
  363   HG21  VAL  46          HG21      VAL  46   2.890   6.940  -9.893
  364   HG22  VAL  46          HG22      VAL  46   2.121   8.528  -9.920
  365   HG23  VAL  46          HG23      VAL  46   1.740   7.387  -8.622
  366    HA   PRO  47           HA       PRO  47   3.541   2.745 -11.841
  367    HB2  PRO  47           HB2      PRO  47   4.408   4.850 -13.807
  368    HB3  PRO  47           HB3      PRO  47   4.360   3.069 -14.005
  369    HG2  PRO  47           HG2      PRO  47   2.414   4.588 -15.108
  370    HG3  PRO  47           HG3      PRO  47   1.983   3.084 -14.230
  371    HD2  PRO  47           HD2      PRO  47   1.905   5.929 -13.220
  372    HD3  PRO  47           HD3      PRO  47   0.650   4.658 -13.086
  373    H    GLY  48           H        GLY  48   5.575   2.605 -10.908
  374    HA2  GLY  48           HA2      GLY  48   7.468   3.236  -9.722
  375    HA3  GLY  48           HA3      GLY  48   7.271   4.875 -10.351
  376    H    GLY  49           H        GLY  49   4.352   4.494  -8.929
  377    HA2  GLY  49           HA2      GLY  49   5.050   5.942  -6.518
  378    HA3  GLY  49           HA3      GLY  49   3.446   5.425  -7.038
  379    H    LYS  50           H        LYS  50   4.355   5.363  -4.385
  380    HA   LYS  50           HA       LYS  50   4.727   2.474  -3.729
  381    HB2  LYS  50           HB2      LYS  50   4.914   4.988  -2.041
  382    HB3  LYS  50           HB3      LYS  50   5.128   3.342  -1.420
  383    HG2  LYS  50           HG2      LYS  50   7.104   2.983  -2.724
  384    HG3  LYS  50           HG3      LYS  50   6.860   4.472  -3.659
  385    HD2  LYS  50           HD2      LYS  50   7.180   5.839  -1.650
  386    HD3  LYS  50           HD3      LYS  50   7.401   4.384  -0.662
  387    HE2  LYS  50           HE2      LYS  50   9.396   3.765  -1.962
  388    HE3  LYS  50           HE3      LYS  50   9.150   5.140  -3.044
  389    HZ1  LYS  50           HZ1      LYS  50   9.452   6.618  -1.123
  390    HZ2  LYS  50           HZ2      LYS  50   9.733   5.371  -0.128
  391    HZ3  LYS  50           HZ3      LYS  50  10.792   5.703  -1.364
  392    H    PHE  51           H        PHE  51   3.398   1.361  -2.306
  393    HA   PHE  51           HA       PHE  51   0.568   2.118  -2.311
  394    HB2  PHE  51           HB2      PHE  51   2.108  -0.292  -1.352
  395    HB3  PHE  51           HB3      PHE  51   0.411  -0.070  -0.965
  396    HD1  PHE  51           HD1      PHE  51   2.738  -0.191  -3.941
  397    HD2  PHE  51           HD2      PHE  51  -1.258  -0.794  -2.454
  398    HE1  PHE  51           HE1      PHE  51   2.080  -1.120  -6.126
  399    HE2  PHE  51           HE2      PHE  51  -1.924  -1.716  -4.661
  400    HZ   PHE  51           HZ       PHE  51  -0.262  -1.888  -6.501
  401    HA   PRO  52           HA       PRO  52   1.211   4.224   1.590
  402    HB2  PRO  52           HB2      PRO  52  -1.166   5.502   1.890
  403    HB3  PRO  52           HB3      PRO  52  -0.039   5.885   0.555
  404    HG2  PRO  52           HG2      PRO  52  -2.466   4.068   0.469
  405    HG3  PRO  52           HG3      PRO  52  -2.025   5.383  -0.666
  406    HD2  PRO  52           HD2      PRO  52  -1.434   2.749  -1.158
  407    HD3  PRO  52           HD3      PRO  52  -0.364   4.084  -1.680
  408    H    VAL  53           H        VAL  53  -1.153   1.689   1.395
  409    HA   VAL  53           HA       VAL  53  -1.111   1.101   4.218
  410    HB   VAL  53           HB       VAL  53  -3.589   0.918   4.440
  411   HG11  VAL  53          HG11      VAL  53  -2.635   3.787   4.146
  412   HG12  VAL  53          HG12      VAL  53  -3.963   3.186   5.145
  413   HG13  VAL  53          HG13      VAL  53  -2.298   2.733   5.538
  414   HG21  VAL  53          HG21      VAL  53  -3.691   2.861   2.104
  415   HG22  VAL  53          HG22      VAL  53  -4.181   1.147   2.031
  416   HG23  VAL  53          HG23      VAL  53  -5.054   2.279   3.083
  417    H    ASP  54           H        ASP  54  -2.497  -1.060   4.509
  418    HA   ASP  54           HA       ASP  54  -2.070  -2.727   2.084
  419    HB2  ASP  54           HB2      ASP  54  -2.147  -4.667   3.421
  420    HB3  ASP  54           HB3      ASP  54  -0.969  -3.551   4.092
  421    H    GLY  55           H        GLY  55  -3.699  -4.086   1.268
  422    HA2  GLY  55           HA2      GLY  55  -6.448  -3.997   2.023
  423    HA3  GLY  55           HA3      GLY  55  -6.143  -2.623   0.971
  424    H    ARG  56           H        ARG  56  -7.479  -3.363  -0.558
  425    HA   ARG  56           HA       ARG  56  -6.598  -5.717  -2.211
  426    HB2  ARG  56           HB2      ARG  56  -8.671  -5.917  -0.566
  427    HB3  ARG  56           HB3      ARG  56  -9.539  -5.169  -1.906
  428    HG2  ARG  56           HG2      ARG  56  -8.754  -7.001  -3.409
  429    HG3  ARG  56           HG3      ARG  56  -7.874  -7.717  -2.054
  430    HD2  ARG  56           HD2      ARG  56 -10.885  -7.469  -2.381
  431    HD3  ARG  56           HD3      ARG  56  -9.900  -8.936  -2.364
  432    HE   ARG  56           HE       ARG  56  -9.631  -8.784   0.004
  433   HH11  ARG  56          HH11      ARG  56 -12.086  -6.437  -1.057
  434   HH12  ARG  56          HH12      ARG  56 -12.393  -6.045   0.628
  435   HH21  ARG  56          HH21      ARG  56 -10.291  -8.288   1.952
  436   HH22  ARG  56          HH22      ARG  56 -11.542  -7.048   2.191
  437    H    VAL  57           H        VAL  57  -6.898  -5.712  -4.375
  438    HA   VAL  57           HA       VAL  57  -7.325  -3.071  -5.706
  439    HB   VAL  57           HB       VAL  57  -5.637  -5.499  -6.413
  440   HG11  VAL  57          HG11      VAL  57  -6.639  -4.738  -8.524
  441   HG12  VAL  57          HG12      VAL  57  -6.172  -3.058  -8.162
  442   HG13  VAL  57          HG13      VAL  57  -4.942  -4.317  -8.454
  443   HG21  VAL  57          HG21      VAL  57  -3.787  -3.902  -6.361
  444   HG22  VAL  57          HG22      VAL  57  -4.913  -2.563  -6.046
  445   HG23  VAL  57          HG23      VAL  57  -4.662  -3.831  -4.826
  446    H    ILE  58           H        ILE  58  -8.939  -2.864  -7.156
  447    HA   ILE  58           HA       ILE  58 -10.297  -5.314  -8.233
  448    HB   ILE  58           HB       ILE  58 -12.510  -4.208  -7.655
  449   HG12  ILE  58          HG12      ILE  58 -10.851  -2.698  -5.601
  450   HG13  ILE  58          HG13      ILE  58 -11.345  -1.950  -7.131
  451   HG21  ILE  58          HG21      ILE  58 -11.557  -6.189  -6.479
  452   HG22  ILE  58          HG22      ILE  58 -10.837  -5.095  -5.279
  453   HG23  ILE  58          HG23      ILE  58 -12.597  -5.187  -5.465
  454   HD11  ILE  58          HD11      ILE  58 -13.726  -2.341  -6.578
  455   HD12  ILE  58          HD12      ILE  58 -13.235  -2.995  -4.994
  456   HD13  ILE  58          HD13      ILE  58 -12.902  -1.301  -5.401
  457    H    GLU  59           H        GLU  59  -8.577  -3.194  -9.541
  458    HA   GLU  59           HA       GLU  59 -10.066  -3.352 -11.990
  459    HB2  GLU  59           HB2      GLU  59 -10.497  -0.936 -10.489
  460    HB3  GLU  59           HB3      GLU  59  -9.464  -0.514 -11.831
  461    HG2  GLU  59           HG2      GLU  59 -12.146  -1.925 -12.045
  462    HG3  GLU  59           HG3      GLU  59 -11.867  -0.206 -12.303
  463    H    GLY  60           H        GLY  60  -8.652  -3.360 -13.698
  464    HA2  GLY  60           HA2      GLY  60  -6.837  -2.628 -14.986
  465    HA3  GLY  60           HA3      GLY  60  -6.113  -1.875 -13.582
  466    H    HIS  61           H        HIS  61  -4.248  -2.802 -14.537
  467    HA   HIS  61           HA       HIS  61  -3.515  -5.457 -13.426
  468    HB2  HIS  61           HB2      HIS  61  -2.599  -6.237 -15.575
  469    HB3  HIS  61           HB3      HIS  61  -4.341  -6.109 -15.549
  470    HD1  HIS  61           HD1      HIS  61  -5.445  -4.292 -17.249
  471    HD2  HIS  61           HD2      HIS  61  -1.270  -4.838 -17.396
  472    HE1  HIS  61           HE1      HIS  61  -4.666  -3.367 -19.494
  473    H    SER  62           H        SER  62  -1.562  -5.421 -12.506
  474    HA   SER  62           HA       SER  62   0.581  -3.820 -13.632
  475    HB2  SER  62           HB2      SER  62  -0.821  -2.344 -11.948
  476    HB3  SER  62           HB3      SER  62   0.145  -3.192 -10.725
  477    HG   SER  62           HG       SER  62   0.838  -1.138 -11.989
  478    H    MET  63           H        MET  63   2.593  -3.916 -12.223
  479    HA   MET  63           HA       MET  63   2.877  -6.547 -10.872
  480    HB2  MET  63           HB2      MET  63   3.798  -6.710 -13.121
  481    HB3  MET  63           HB3      MET  63   4.842  -5.310 -12.836
  482    HG2  MET  63           HG2      MET  63   6.177  -6.464 -11.293
  483    HG3  MET  63           HG3      MET  63   4.968  -7.726 -11.007
  484    HE1  MET  63           HE1      MET  63   4.912  -9.959 -12.114
  485    HE2  MET  63           HE2      MET  63   4.041  -9.097 -13.404
  486    HE3  MET  63           HE3      MET  63   5.348 -10.231 -13.813
  487    H    VAL  64           H        VAL  64   3.743  -6.443  -8.948
  488    HA   VAL  64           HA       VAL  64   4.673  -3.798  -7.906
  489    HB   VAL  64           HB       VAL  64   2.917  -5.899  -6.588
  490   HG11  VAL  64          HG11      VAL  64   3.870  -3.194  -5.550
  491   HG12  VAL  64          HG12      VAL  64   2.596  -4.174  -4.811
  492   HG13  VAL  64          HG13      VAL  64   4.248  -4.794  -4.870
  493   HG21  VAL  64          HG21      VAL  64   1.677  -4.638  -8.281
  494   HG22  VAL  64          HG22      VAL  64   1.197  -4.082  -6.674
  495   HG23  VAL  64          HG23      VAL  64   2.315  -3.105  -7.651
  496    H    ASP  65           H        ASP  65   6.378  -3.630  -6.639
  497    HA   ASP  65           HA       ASP  65   8.139  -5.972  -6.258
  498    HB2  ASP  65           HB2      ASP  65   8.879  -3.931  -7.489
  499    HB3  ASP  65           HB3      ASP  65   8.662  -2.981  -6.023
  500    H    GLU  66           H        GLU  66   7.886  -6.993  -4.410
  501    HA   GLU  66           HA       GLU  66   7.294  -5.534  -1.876
  502    HB2  GLU  66           HB2      GLU  66   6.841  -8.472  -2.445
  503    HB3  GLU  66           HB3      GLU  66   6.220  -7.498  -1.096
  504    HG2  GLU  66           HG2      GLU  66   4.827  -6.231  -2.783
  505    HG3  GLU  66           HG3      GLU  66   5.336  -7.409  -4.001
  506    H    SER  67           H        SER  67  10.092  -6.000  -3.037
  507    HA   SER  67           HA       SER  67  11.313  -8.250  -2.020
  508    HB2  SER  67           HB2      SER  67  13.344  -7.323  -2.683
  509    HB3  SER  67           HB3      SER  67  12.159  -6.616  -3.765
  510    HG   SER  67           HG       SER  67  12.201  -4.710  -2.427
  511    H    LEU  68           H        LEU  68  10.752  -5.367  -0.060
  512    HA   LEU  68           HA       LEU  68  12.453  -6.469   2.118
  513    HB2  LEU  68           HB2      LEU  68  12.719  -4.163   1.230
  514    HB3  LEU  68           HB3      LEU  68  11.076  -3.796   1.703
  515    HG   LEU  68           HG       LEU  68  12.906  -2.858   3.104
  516   HD11  LEU  68          HD11      LEU  68  11.128  -4.589   4.831
  517   HD12  LEU  68          HD12      LEU  68  11.819  -2.996   5.162
  518   HD13  LEU  68          HD13      LEU  68  10.540  -3.162   3.953
  519   HD21  LEU  68          HD21      LEU  68  14.411  -4.814   3.161
  520   HD22  LEU  68          HD22      LEU  68  14.032  -4.199   4.779
  521   HD23  LEU  68          HD23      LEU  68  13.244  -5.674   4.193
  522    H    ILE  69           H        ILE  69   9.097  -5.867   1.242
  523    HA   ILE  69           HA       ILE  69   8.029  -6.119   3.924
  524    HB   ILE  69           HB       ILE  69   6.506  -6.383   1.303
  525   HG12  ILE  69          HG12      ILE  69   7.783  -4.246   1.280
  526   HG13  ILE  69          HG13      ILE  69   6.047  -4.070   1.246
  527   HG21  ILE  69          HG21      ILE  69   5.702  -5.744   4.174
  528   HG22  ILE  69          HG22      ILE  69   4.642  -5.475   2.789
  529   HG23  ILE  69          HG23      ILE  69   5.182  -7.116   3.178
  530   HD11  ILE  69          HD11      ILE  69   5.971  -3.430   3.561
  531   HD12  ILE  69          HD12      ILE  69   7.722  -3.716   3.760
  532   HD13  ILE  69          HD13      ILE  69   7.132  -2.405   2.709
  533    H    THR  70           H        THR  70   7.473  -8.234   1.059
  534    HA   THR  70           HA       THR  70   7.070 -10.579   2.848
  535    HB   THR  70           HB       THR  70   6.065 -11.632   0.848
  536    HG1  THR  70           HG1      THR  70   5.586  -9.826  -0.803
  537   HG21  THR  70          HG21      THR  70   4.642 -10.269   2.418
  538   HG22  THR  70          HG22      THR  70   4.853  -8.875   1.333
  539   HG23  THR  70          HG23      THR  70   4.028 -10.339   0.760
  540    H    GLY  71           H        GLY  71   9.523  -9.187   1.031
  541    HA2  GLY  71           HA2      GLY  71  11.733  -9.961   1.010
  542    HA3  GLY  71           HA3      GLY  71  11.190 -11.594   1.386
  543    H    GLU  72           H        GLU  72   9.333 -10.464  -1.162
  544    HA   GLU  72           HA       GLU  72  10.489 -12.389  -2.959
  545    HB2  GLU  72           HB2      GLU  72   8.264 -10.349  -3.316
  546    HB3  GLU  72           HB3      GLU  72   8.668 -11.596  -4.490
  547    HG2  GLU  72           HG2      GLU  72   7.719 -12.083  -1.631
  548    HG3  GLU  72           HG3      GLU  72   6.749 -12.242  -3.094
  549    H    ALA  73           H        ALA  73  12.365 -12.069  -3.971
  550    HA   ALA  73           HA       ALA  73  13.268  -9.453  -4.867
  551    HB1  ALA  73           HB1      ALA  73  15.251 -10.702  -5.569
  552    HB2  ALA  73           HB2      ALA  73  14.781 -11.180  -3.927
  553    HB3  ALA  73           HB3      ALA  73  14.412 -12.247  -5.303
  554    H    MET  74           H        MET  74  11.321 -11.925  -6.245
  555    HA   MET  74           HA       MET  74  11.522 -10.683  -8.929
  556    HB2  MET  74           HB2      MET  74  12.073 -13.140  -8.779
  557    HB3  MET  74           HB3      MET  74  10.388 -13.426  -8.301
  558    HG2  MET  74           HG2      MET  74   9.604 -12.433 -10.371
  559    HG3  MET  74           HG3      MET  74  11.245 -11.937 -10.789
  560    HE1  MET  74           HE1      MET  74   8.675 -14.835 -10.575
  561    HE2  MET  74           HE2      MET  74   9.618 -16.266 -11.052
  562    HE3  MET  74           HE3      MET  74   9.913 -15.498  -9.480
  563    HA   PRO  75           HA       PRO  75   7.877  -8.832  -7.253
  564    HB2  PRO  75           HB2      PRO  75   6.989  -7.341  -9.367
  565    HB3  PRO  75           HB3      PRO  75   8.483  -6.980  -8.455
  566    HG2  PRO  75           HG2      PRO  75   8.236  -8.550 -11.042
  567    HG3  PRO  75           HG3      PRO  75   9.328  -7.166 -10.690
  568    HD2  PRO  75           HD2      PRO  75  10.171  -9.734 -10.479
  569    HD3  PRO  75           HD3      PRO  75  10.686  -8.507  -9.278
  570    H    VAL  76           H        VAL  76   5.558  -8.497  -7.573
  571    HA   VAL  76           HA       VAL  76   4.314 -11.075  -8.446
  572    HB   VAL  76           HB       VAL  76   3.418  -9.175  -6.247
  573   HG11  VAL  76          HG11      VAL  76   1.586 -10.589  -7.108
  574   HG12  VAL  76          HG12      VAL  76   2.601 -12.037  -6.925
  575   HG13  VAL  76          HG13      VAL  76   2.073 -11.130  -5.498
  576   HG21  VAL  76          HG21      VAL  76   5.024 -11.756  -6.044
  577   HG22  VAL  76          HG22      VAL  76   5.568 -10.131  -5.574
  578   HG23  VAL  76          HG23      VAL  76   4.272 -10.913  -4.672
  579    H    ALA  77           H        ALA  77   2.718 -11.066  -9.942
  580    HA   ALA  77           HA       ALA  77   1.694  -8.564 -11.026
  581    HB1  ALA  77           HB1      ALA  77   0.898 -11.451 -11.565
  582    HB2  ALA  77           HB2      ALA  77   0.436 -10.033 -12.533
  583    HB3  ALA  77           HB3      ALA  77   2.138 -10.526 -12.444
  584    H    LYS  78           H        LYS  78  -0.186  -7.581 -10.677
  585    HA   LYS  78           HA       LYS  78  -2.221  -8.771  -8.809
  586    HB2  LYS  78           HB2      LYS  78  -1.562  -5.826  -9.070
  587    HB3  LYS  78           HB3      LYS  78  -2.658  -6.565  -7.909
  588    HG2  LYS  78           HG2      LYS  78   0.365  -6.921  -7.985
  589    HG3  LYS  78           HG3      LYS  78  -0.510  -5.814  -6.943
  590    HD2  LYS  78           HD2      LYS  78  -1.582  -7.666  -5.754
  591    HD3  LYS  78           HD3      LYS  78  -0.766  -8.849  -6.798
  592    HE2  LYS  78           HE2      LYS  78   1.425  -8.136  -6.007
  593    HE3  LYS  78           HE3      LYS  78   0.724  -6.776  -5.123
  594    HZ1  LYS  78           HZ1      LYS  78   0.213  -9.623  -4.447
  595    HZ2  LYS  78           HZ2      LYS  78   1.248  -8.592  -3.637
  596    HZ3  LYS  78           HZ3      LYS  78  -0.385  -8.347  -3.659
  597    H    LYS  79           H        LYS  79  -4.393  -8.286  -9.187
  598    HA   LYS  79           HA       LYS  79  -5.279  -7.322 -11.842
  599    HB2  LYS  79           HB2      LYS  79  -6.279  -9.482 -12.374
  600    HB3  LYS  79           HB3      LYS  79  -4.566  -9.699 -12.103
  601    HG2  LYS  79           HG2      LYS  79  -5.016 -10.577  -9.831
  602    HG3  LYS  79           HG3      LYS  79  -6.750 -10.351 -10.068
  603    HD2  LYS  79           HD2      LYS  79  -4.993 -12.139 -11.806
  604    HD3  LYS  79           HD3      LYS  79  -5.943 -12.698 -10.420
  605    HE2  LYS  79           HE2      LYS  79  -8.024 -11.883 -11.514
  606    HE3  LYS  79           HE3      LYS  79  -7.078 -11.382 -12.930
  607    HZ1  LYS  79           HZ1      LYS  79  -6.451 -13.704 -13.257
  608    HZ2  LYS  79           HZ2      LYS  79  -7.301 -14.148 -11.905
  609    HZ3  LYS  79           HZ3      LYS  79  -8.092 -13.572 -13.208
  610    HA   PRO  80           HA       PRO  80  -8.993  -6.370  -9.447
  611    HB2  PRO  80           HB2      PRO  80 -11.148  -7.476 -10.817
  612    HB3  PRO  80           HB3      PRO  80 -10.339  -5.942 -11.259
  613    HG2  PRO  80           HG2      PRO  80  -9.779  -8.720 -12.368
  614    HG3  PRO  80           HG3      PRO  80 -10.076  -7.202 -13.281
  615    HD2  PRO  80           HD2      PRO  80  -7.562  -7.968 -12.886
  616    HD3  PRO  80           HD3      PRO  80  -8.002  -6.273 -12.566
  617    H    GLY  81           H        GLY  81  -9.587  -7.255  -7.596
  618    HA2  GLY  81           HA2      GLY  81 -10.262  -8.833  -6.021
  619    HA3  GLY  81           HA3      GLY  81 -10.235 -10.110  -7.241
  620    H    SER  82           H        SER  82  -7.511  -7.858  -6.430
  621    HA   SER  82           HA       SER  82  -5.924 -10.229  -5.470
  622    HB2  SER  82           HB2      SER  82  -5.267  -9.425  -7.718
  623    HB3  SER  82           HB3      SER  82  -4.950  -7.824  -7.036
  624    HG   SER  82           HG       SER  82  -3.675 -10.203  -6.109
  625    H    THR  83           H        THR  83  -4.216  -9.765  -3.806
  626    HA   THR  83           HA       THR  83  -5.090  -7.566  -2.011
  627    HB   THR  83           HB       THR  83  -4.036  -9.027  -0.254
  628    HG1  THR  83           HG1      THR  83  -2.767 -10.385  -1.503
  629   HG21  THR  83          HG21      THR  83  -5.925 -10.623  -0.185
  630   HG22  THR  83          HG22      THR  83  -6.491  -9.005  -0.619
  631   HG23  THR  83          HG23      THR  83  -6.331 -10.251  -1.872
  632    H    VAL  84           H        VAL  84  -3.650  -6.202  -1.026
  633    HA   VAL  84           HA       VAL  84  -0.800  -6.285  -1.915
  634    HB   VAL  84           HB       VAL  84  -0.928  -3.849  -2.398
  635   HG11  VAL  84          HG11      VAL  84  -2.783  -5.533  -4.132
  636   HG12  VAL  84          HG12      VAL  84  -1.893  -4.076  -4.614
  637   HG13  VAL  84          HG13      VAL  84  -1.007  -5.542  -4.193
  638   HG21  VAL  84          HG21      VAL  84  -3.004  -3.285  -1.144
  639   HG22  VAL  84          HG22      VAL  84  -3.077  -2.770  -2.832
  640   HG23  VAL  84          HG23      VAL  84  -3.957  -4.218  -2.319
  641    H    ILE  85           H        ILE  85   0.698  -5.026  -0.773
  642    HA   ILE  85           HA       ILE  85  -0.148  -4.253   1.980
  643    HB   ILE  85           HB       ILE  85   2.388  -4.798   2.536
  644   HG12  ILE  85          HG12      ILE  85   3.065  -6.993   1.638
  645   HG13  ILE  85          HG13      ILE  85   1.760  -6.958   0.456
  646   HG21  ILE  85          HG21      ILE  85   1.647  -6.842   3.546
  647   HG22  ILE  85          HG22      ILE  85   0.416  -5.591   3.700
  648   HG23  ILE  85          HG23      ILE  85   0.196  -6.888   2.501
  649   HD11  ILE  85          HD11      ILE  85   4.016  -6.280  -0.430
  650   HD12  ILE  85          HD12      ILE  85   2.760  -5.047  -0.658
  651   HD13  ILE  85          HD13      ILE  85   3.960  -4.855   0.628
  652    H    ALA  86           H        ALA  86   0.695  -2.605   3.025
  653    HA   ALA  86           HA       ALA  86   1.386  -0.248   1.669
  654    HB1  ALA  86           HB1      ALA  86   0.420  -0.473   3.990
  655    HB2  ALA  86           HB2      ALA  86   1.981  -1.043   4.554
  656    HB3  ALA  86           HB3      ALA  86   1.817   0.612   3.920
  657    H    GLY  87           H        GLY  87   3.279   0.783   1.227
  658    HA2  GLY  87           HA2      GLY  87   5.533   1.298   1.212
  659    HA3  GLY  87           HA3      GLY  87   5.880  -0.077   2.269
  660    H    SER  88           H        SER  88   4.145  -1.368  -0.282
  661    HA   SER  88           HA       SER  88   6.552  -2.272  -1.726
  662    HB2  SER  88           HB2      SER  88   5.012  -3.574  -3.087
  663    HB3  SER  88           HB3      SER  88   4.843  -3.911  -1.371
  664    HG   SER  88           HG       SER  88   2.888  -2.794  -1.351
  665    H    ILE  89           H        ILE  89   6.764  -2.022  -4.039
  666    HA   ILE  89           HA       ILE  89   5.948   0.727  -4.895
  667    HB   ILE  89           HB       ILE  89   8.199  -0.474  -6.351
  668   HG12  ILE  89          HG12      ILE  89   8.821  -1.417  -4.164
  669   HG13  ILE  89          HG13      ILE  89   9.956  -0.260  -4.824
  670   HG21  ILE  89          HG21      ILE  89   7.479   1.842  -6.646
  671   HG22  ILE  89          HG22      ILE  89   7.808   2.200  -4.938
  672   HG23  ILE  89          HG23      ILE  89   9.138   1.779  -6.031
  673   HD11  ILE  89          HD11      ILE  89   9.300   1.448  -3.247
  674   HD12  ILE  89          HD12      ILE  89   7.941   0.464  -2.663
  675   HD13  ILE  89          HD13      ILE  89   9.611  -0.053  -2.362
  676    H    ASN  90           H        ASN  90   5.097   1.133  -6.906
  677    HA   ASN  90           HA       ASN  90   4.147  -1.124  -8.548
  678    HB2  ASN  90           HB2      ASN  90   2.779   0.874  -7.962
  679    HB3  ASN  90           HB3      ASN  90   3.903   1.907  -8.827
  680   HD21  ASN  90          HD22      ASN  90   0.961   1.247  -9.186
  681   HD22  ASN  90          HD21      ASN  90   0.871   0.852 -10.901
  682    H    GLN  91           H        GLN  91   5.004  -1.804 -10.532
  683    HA   GLN  91           HA       GLN  91   6.605   0.108 -12.031
  684    HB2  GLN  91           HB2      GLN  91   8.227  -1.308 -10.552
  685    HB3  GLN  91           HB3      GLN  91   7.868  -2.619 -11.669
  686    HG2  GLN  91           HG2      GLN  91   9.717  -1.615 -12.715
  687    HG3  GLN  91           HG3      GLN  91   8.374  -0.793 -13.532
  688   HE21  GLN  91          HE22      GLN  91   8.043   1.471 -13.131
  689   HE22  GLN  91          HE21      GLN  91   9.184   2.417 -12.183
  690    H    ASN  92           H        ASN  92   4.286  -0.281 -12.903
  691    HA   ASN  92           HA       ASN  92   4.829  -1.266 -15.521
  692    HB2  ASN  92           HB2      ASN  92   4.237  -3.482 -14.628
  693    HB3  ASN  92           HB3      ASN  92   2.688  -2.861 -14.063
  694   HD21  ASN  92          HD22      ASN  92   0.950  -3.059 -15.546
  695   HD22  ASN  92          HD21      ASN  92   1.233  -3.253 -17.268
  696    H    GLY  93           H        GLY  93   1.946  -0.671 -13.512
  697    HA2  GLY  93           HA2      GLY  93   0.914   1.475 -15.258
  698    HA3  GLY  93           HA3      GLY  93   0.086  -0.062 -15.437
  699    H    SER  94           H        SER  94  -1.457   2.029 -14.648
  700    HA   SER  94           HA       SER  94  -1.422   2.280 -11.732
  701    HB2  SER  94           HB2      SER  94  -3.140   3.993 -12.040
  702    HB3  SER  94           HB3      SER  94  -1.713   4.274 -13.048
  703    HG   SER  94           HG       SER  94  -3.258   4.523 -14.493
  704    H    LEU  95           H        LEU  95  -2.983   1.737 -10.268
  705    HA   LEU  95           HA       LEU  95  -5.253  -0.056 -11.081
  706    HB2  LEU  95           HB2      LEU  95  -3.152  -0.312  -8.919
  707    HB3  LEU  95           HB3      LEU  95  -4.612  -1.261  -8.880
  708    HG   LEU  95           HG       LEU  95  -2.461  -1.356 -11.033
  709   HD11  LEU  95          HD11      LEU  95  -1.941  -3.578  -9.922
  710   HD12  LEU  95          HD12      LEU  95  -1.556  -2.153  -8.934
  711   HD13  LEU  95          HD13      LEU  95  -3.014  -3.105  -8.600
  712   HD21  LEU  95          HD21      LEU  95  -4.882  -3.124 -10.500
  713   HD22  LEU  95          HD22      LEU  95  -4.574  -2.110 -11.919
  714   HD23  LEU  95          HD23      LEU  95  -3.561  -3.534 -11.603
  715    H    LEU  96           H        LEU  96  -6.901  -0.293  -9.493
  716    HA   LEU  96           HA       LEU  96  -7.325   2.086  -7.714
  717    HB2  LEU  96           HB2      LEU  96  -9.226   0.229  -9.167
  718    HB3  LEU  96           HB3      LEU  96  -9.740   1.240  -7.836
  719    HG   LEU  96           HG       LEU  96  -9.116   3.273  -9.063
  720   HD11  LEU  96          HD11      LEU  96  -8.415   1.351 -11.318
  721   HD12  LEU  96          HD12      LEU  96  -8.817   3.048 -11.598
  722   HD13  LEU  96          HD13      LEU  96  -7.406   2.629 -10.619
  723   HD21  LEU  96          HD21      LEU  96 -10.967   1.450 -10.634
  724   HD22  LEU  96          HD22      LEU  96 -11.407   2.381  -9.184
  725   HD23  LEU  96          HD23      LEU  96 -10.934   3.223 -10.662
  726    H    ILE  97           H        ILE  97  -6.952   1.699  -5.637
  727    HA   ILE  97           HA       ILE  97  -7.285  -1.033  -4.495
  728    HB   ILE  97           HB       ILE  97  -5.892   1.431  -3.404
  729   HG12  ILE  97          HG12      ILE  97  -4.379  -1.001  -4.375
  730   HG13  ILE  97          HG13      ILE  97  -4.854   0.226  -5.543
  731   HG21  ILE  97          HG21      ILE  97  -5.825  -1.472  -2.455
  732   HG22  ILE  97          HG22      ILE  97  -4.839  -0.156  -1.789
  733   HG23  ILE  97          HG23      ILE  97  -6.590  -0.113  -1.608
  734   HD11  ILE  97          HD11      ILE  97  -3.149   0.739  -3.086
  735   HD12  ILE  97          HD12      ILE  97  -2.638   0.711  -4.787
  736   HD13  ILE  97          HD13      ILE  97  -3.731   1.980  -4.224
  737    H    CYS  98           H        CYS  98  -9.138  -1.427  -3.282
  738    HA   CYS  98           HA       CYS  98 -10.682   0.851  -2.175
  739    HB2  CYS  98           HB2      CYS  98 -12.262  -0.882  -1.413
  740    HB3  CYS  98           HB3      CYS  98 -12.007  -0.889  -3.162
  741    HG   CYS  98           HG       CYS  98 -10.288  -2.716  -1.037
  742    H    ALA  99           H        ALA  99 -10.088   1.772  -0.289
  743    HA   ALA  99           HA       ALA  99  -8.102   0.467   1.345
  744    HB1  ALA  99           HB1      ALA  99  -9.464   3.175   1.571
  745    HB2  ALA  99           HB2      ALA  99  -8.050   2.636   2.506
  746    HB3  ALA  99           HB3      ALA  99  -7.927   2.813   0.746
  747    H    THR 100           H        THR 100  -8.454  -0.843   2.945
  748    HA   THR 100           HA       THR 100 -10.946  -0.719   4.603
  749    HB   THR 100           HB       THR 100 -10.295  -3.117   5.102
  750    HG1  THR 100           HG1      THR 100  -8.706  -3.990   3.703
  751   HG21  THR 100          HG21      THR 100 -11.894  -2.680   3.262
  752   HG22  THR 100          HG22      THR 100 -10.543  -2.496   2.119
  753   HG23  THR 100          HG23      THR 100 -10.838  -4.058   2.901
  754    H    HIS 101           H        HIS 101  -7.608  -0.004   4.845
  755    HA   HIS 101           HA       HIS 101  -7.705  -0.084   7.816
  756    HB2  HIS 101           HB2      HIS 101  -5.511  -1.044   5.922
  757    HB3  HIS 101           HB3      HIS 101  -5.269  -0.762   7.641
  758    HD1  HIS 101           HD1      HIS 101  -7.242  -3.191   5.347
  759    HD2  HIS 101           HD2      HIS 101  -5.957  -2.627   9.308
  760    HE1  HIS 101           HE1      HIS 101  -7.797  -5.347   6.595
  761    H    VAL 102           H        VAL 102  -6.703   1.562   8.839
  762    HA   VAL 102           HA       VAL 102  -5.286   3.686   7.274
  763    HB   VAL 102           HB       VAL 102  -5.517   5.044   9.375
  764   HG11  VAL 102          HG11      VAL 102  -8.112   4.166   8.034
  765   HG12  VAL 102          HG12      VAL 102  -7.779   5.723   8.830
  766   HG13  VAL 102          HG13      VAL 102  -6.932   5.299   7.338
  767   HG21  VAL 102          HG21      VAL 102  -6.052   3.178  10.961
  768   HG22  VAL 102          HG22      VAL 102  -7.260   4.471  10.963
  769   HG23  VAL 102          HG23      VAL 102  -7.614   2.956  10.133
  770    H    GLY 103           H        GLY 103  -3.275   4.707   8.538
  771    HA2  GLY 103           HA2      GLY 103  -1.352   2.746   8.070
  772    HA3  GLY 103           HA3      GLY 103  -1.097   4.271   8.857
  773    H    ALA 104           H        ALA 104  -2.581   3.874  11.267
  774    HA   ALA 104           HA       ALA 104  -0.718   2.282  12.797
  775    HB1  ALA 104           HB1      ALA 104  -3.388   3.547  13.531
  776    HB2  ALA 104           HB2      ALA 104  -2.195   2.922  14.683
  777    HB3  ALA 104           HB3      ALA 104  -1.784   4.301  13.663
  778    H    ASP 105           H        ASP 105  -3.987   1.573  11.554
  779    HA   ASP 105           HA       ASP 105  -4.166  -0.994  12.923
  780    HB2  ASP 105           HB2      ASP 105  -6.146   0.454  12.392
  781    HB3  ASP 105           HB3      ASP 105  -5.899   0.069  10.683
  782    H    THR 106           H        THR 106  -2.386  -0.010  10.206
  783    HA   THR 106           HA       THR 106  -2.828  -2.128   8.386
  784    HB   THR 106           HB       THR 106  -0.536  -1.752   7.516
  785    HG1  THR 106           HG1      THR 106  -0.228   0.281   9.398
  786   HG21  THR 106          HG21      THR 106  -2.228  -0.376   6.597
  787   HG22  THR 106          HG22      THR 106  -2.153   0.736   7.962
  788   HG23  THR 106          HG23      THR 106  -0.767   0.604   6.852
  789    H    THR 107           H        THR 107  -1.746  -3.955   7.852
  790    HA   THR 107           HA       THR 107  -0.870  -5.794   9.870
  791    HB   THR 107           HB       THR 107  -1.759  -6.186   7.500
  792    HG1  THR 107           HG1      THR 107  -1.289  -7.955   8.354
  793   HG21  THR 107          HG21      THR 107  -0.038  -4.824   6.279
  794   HG22  THR 107          HG22      THR 107   1.145  -6.108   6.657
  795   HG23  THR 107          HG23      THR 107  -0.302  -6.465   5.691
  796    H    LEU 108           H        LEU 108   0.908  -3.549   7.776
  797    HA   LEU 108           HA       LEU 108   3.563  -4.288   8.383
  798    HB2  LEU 108           HB2      LEU 108   2.518  -2.737   6.538
  799    HB3  LEU 108           HB3      LEU 108   2.567  -1.478   7.760
  800    HG   LEU 108           HG       LEU 108   5.125  -2.096   7.963
  801   HD11  LEU 108          HD11      LEU 108   4.410  -3.259   5.224
  802   HD12  LEU 108          HD12      LEU 108   6.055  -2.921   5.812
  803   HD13  LEU 108          HD13      LEU 108   5.067  -4.163   6.610
  804   HD21  LEU 108          HD21      LEU 108   5.649  -0.600   6.069
  805   HD22  LEU 108          HD22      LEU 108   4.004  -0.773   5.461
  806   HD23  LEU 108          HD23      LEU 108   4.296   0.005   7.041
  807    H    SER 109           H        SER 109   1.427  -1.871   9.960
  808    HA   SER 109           HA       SER 109   3.373  -0.985  11.896
  809    HB2  SER 109           HB2      SER 109   1.425   0.357  11.272
  810    HB3  SER 109           HB3      SER 109   0.332  -0.861  11.955
  811    HG   SER 109           HG       SER 109   2.389   0.432  13.443
  812    H    GLN 110           H        GLN 110   1.066  -3.704  11.850
  813    HA   GLN 110           HA       GLN 110   1.324  -4.246  14.695
  814    HB2  GLN 110           HB2      GLN 110  -0.654  -4.869  13.221
  815    HB3  GLN 110           HB3      GLN 110   0.337  -6.081  12.474
  816    HG2  GLN 110           HG2      GLN 110  -0.958  -7.187  14.105
  817    HG3  GLN 110           HG3      GLN 110   0.691  -7.154  14.735
  818   HE21  GLN 110          HE22      GLN 110  -2.338  -5.151  14.766
  819   HE22  GLN 110          HE21      GLN 110  -2.084  -4.606  16.406
  820    H    ILE 111           H        ILE 111   2.824  -5.611  11.720
  821    HA   ILE 111           HA       ILE 111   4.272  -7.710  12.879
  822    HB   ILE 111           HB       ILE 111   4.872  -5.939  10.494
  823   HG12  ILE 111          HG12      ILE 111   4.060  -8.881  10.584
  824   HG13  ILE 111          HG13      ILE 111   2.863  -7.602  10.624
  825   HG21  ILE 111          HG21      ILE 111   6.392  -8.447  11.360
  826   HG22  ILE 111          HG22      ILE 111   6.532  -7.684   9.766
  827   HG23  ILE 111          HG23      ILE 111   7.063  -6.811  11.192
  828   HD11  ILE 111          HD11      ILE 111   3.075  -8.371   8.355
  829   HD12  ILE 111          HD12      ILE 111   3.717  -6.719   8.449
  830   HD13  ILE 111          HD13      ILE 111   4.826  -8.110   8.355
  831    H    VAL 112           H        VAL 112   5.615  -4.338  12.441
  832    HA   VAL 112           HA       VAL 112   7.972  -4.965  13.906
  833    HB   VAL 112           HB       VAL 112   8.367  -2.571  14.088
  834   HG11  VAL 112          HG11      VAL 112   7.292  -3.315  11.338
  835   HG12  VAL 112          HG12      VAL 112   8.505  -2.078  11.727
  836   HG13  VAL 112          HG13      VAL 112   8.881  -3.784  11.991
  837   HG21  VAL 112          HG21      VAL 112   6.104  -1.704  14.503
  838   HG22  VAL 112          HG22      VAL 112   6.830  -0.927  13.099
  839   HG23  VAL 112          HG23      VAL 112   5.599  -2.184  12.860
  840    H    LYS 113           H        LYS 113   4.816  -4.179  15.126
  841    HA   LYS 113           HA       LYS 113   5.737  -3.453  17.851
  842    HB2  LYS 113           HB2      LYS 113   2.972  -3.828  16.640
  843    HB3  LYS 113           HB3      LYS 113   3.258  -3.434  18.342
  844    HG2  LYS 113           HG2      LYS 113   4.290  -1.311  17.785
  845    HG3  LYS 113           HG3      LYS 113   4.343  -1.714  16.081
  846    HD2  LYS 113           HD2      LYS 113   2.554  -0.301  16.114
  847    HD3  LYS 113           HD3      LYS 113   1.765  -1.878  16.171
  848    HE2  LYS 113           HE2      LYS 113   1.646  -1.651  18.673
  849    HE3  LYS 113           HE3      LYS 113   2.374  -0.042  18.519
  850    HZ1  LYS 113           HZ1      LYS 113  -0.064   0.160  18.556
  851    HZ2  LYS 113           HZ2      LYS 113   0.491   0.563  17.074
  852    HZ3  LYS 113           HZ3      LYS 113  -0.190  -0.894  17.273
  853    H    LEU 114           H        LEU 114   4.601  -6.323  16.115
  854    HA   LEU 114           HA       LEU 114   4.477  -8.030  18.430
  855    HB2  LEU 114           HB2      LEU 114   4.696  -8.430  15.441
  856    HB3  LEU 114           HB3      LEU 114   4.772  -9.784  16.553
  857    HG   LEU 114           HG       LEU 114   2.481  -7.824  16.302
  858   HD11  LEU 114          HD11      LEU 114   2.752 -10.668  15.245
  859   HD12  LEU 114          HD12      LEU 114   1.288  -9.663  15.161
  860   HD13  LEU 114          HD13      LEU 114   2.737  -9.182  14.270
  861   HD21  LEU 114          HD21      LEU 114   2.498  -8.884  18.530
  862   HD22  LEU 114          HD22      LEU 114   1.183  -9.537  17.558
  863   HD23  LEU 114          HD23      LEU 114   2.669 -10.487  17.776
  864    H    VAL 115           H        VAL 115   6.992  -7.489  15.953
  865    HA   VAL 115           HA       VAL 115   8.909  -9.283  17.115
  866    HB   VAL 115           HB       VAL 115   9.363  -6.933  15.245
  867   HG11  VAL 115          HG11      VAL 115  11.262  -9.188  16.056
  868   HG12  VAL 115          HG12      VAL 115  11.520  -8.080  14.691
  869   HG13  VAL 115          HG13      VAL 115  11.506  -7.446  16.335
  870   HG21  VAL 115          HG21      VAL 115   9.231  -9.948  14.746
  871   HG22  VAL 115          HG22      VAL 115   7.957  -8.790  14.326
  872   HG23  VAL 115          HG23      VAL 115   9.523  -8.693  13.525
  873    H    GLU 116           H        GLU 116   8.986  -5.675  17.325
  874    HA   GLU 116           HA       GLU 116  10.998  -5.311  19.048
  875    HB2  GLU 116           HB2      GLU 116   9.474  -3.600  17.976
  876    HB3  GLU 116           HB3      GLU 116   8.328  -3.864  19.292
  877    HG2  GLU 116           HG2      GLU 116  10.235  -3.162  20.877
  878    HG3  GLU 116           HG3      GLU 116  11.131  -2.683  19.428
  879    H    GLU 117           H        GLU 117   7.841  -6.504  20.152
  880    HA   GLU 117           HA       GLU 117   8.528  -6.268  23.035
  881    HB2  GLU 117           HB2      GLU 117   6.050  -7.182  21.557
  882    HB3  GLU 117           HB3      GLU 117   6.234  -7.309  23.299
  883    HG2  GLU 117           HG2      GLU 117   6.822  -4.569  22.348
  884    HG3  GLU 117           HG3      GLU 117   5.231  -5.113  21.844
  885    H    ALA 118           H        ALA 118   8.512  -8.661  20.414
  886    HA   ALA 118           HA       ALA 118   8.139 -10.973  22.081
  887    HB1  ALA 118           HB1      ALA 118   7.462 -10.946  19.742
  888    HB2  ALA 118           HB2      ALA 118   9.137 -10.614  19.224
  889    HB3  ALA 118           HB3      ALA 118   8.713 -12.174  19.958
  890    H    GLN 119           H        GLN 119  11.066  -9.194  21.236
  891    HA   GLN 119           HA       GLN 119  12.977 -11.312  21.787
  892    HB2  GLN 119           HB2      GLN 119  13.150  -8.286  21.564
  893    HB3  GLN 119           HB3      GLN 119  14.537  -9.367  21.750
  894    HG2  GLN 119           HG2      GLN 119  13.258  -8.410  19.377
  895    HG3  GLN 119           HG3      GLN 119  14.786  -9.278  19.548
  896   HE21  GLN 119          HE22      GLN 119  11.421  -9.448  18.773
  897   HE22  GLN 119          HE21      GLN 119  11.305 -11.166  18.878
  Start of MODEL   11
    1    H    SER   1           H        SER   1  18.132  -5.538  13.541
    2    HA   SER   1           HA       SER   1  16.277  -3.505  14.652
    3    HB2  SER   1           HB2      SER   1  19.307  -3.697  14.750
    4    HB3  SER   1           HB3      SER   1  18.340  -2.387  15.453
    5    HG   SER   1           HG       SER   1  18.688  -4.985  16.285
    6    H    GLU   2           H        GLU   2  18.174  -3.950  11.737
    7    HA   GLU   2           HA       GLU   2  17.970  -1.102  10.941
    8    HB2  GLU   2           HB2      GLU   2  19.874  -2.528  10.239
    9    HB3  GLU   2           HB3      GLU   2  18.763  -3.576   9.355
   10    HG2  GLU   2           HG2      GLU   2  18.120  -1.691   7.889
   11    HG3  GLU   2           HG3      GLU   2  19.201  -0.618   8.787
   12    H    ALA   3           H        ALA   3  16.397  -4.244  10.159
   13    HA   ALA   3           HA       ALA   3  14.351  -3.247   8.465
   14    HB1  ALA   3           HB1      ALA   3  14.279  -5.570  10.445
   15    HB2  ALA   3           HB2      ALA   3  13.151  -5.312   9.095
   16    HB3  ALA   3           HB3      ALA   3  14.864  -5.637   8.768
   17    H    LEU   4           H        LEU   4  14.264  -3.658  12.020
   18    HA   LEU   4           HA       LEU   4  11.829  -2.539  12.580
   19    HB2  LEU   4           HB2      LEU   4  13.395  -3.587  14.168
   20    HB3  LEU   4           HB3      LEU   4  14.325  -2.096  14.265
   21    HG   LEU   4           HG       LEU   4  11.361  -1.950  14.817
   22   HD11  LEU   4          HD11      LEU   4  13.347  -3.108  16.806
   23   HD12  LEU   4          HD12      LEU   4  11.650  -2.681  17.133
   24   HD13  LEU   4          HD13      LEU   4  12.031  -3.981  15.993
   25   HD21  LEU   4          HD21      LEU   4  12.036  -0.354  16.548
   26   HD22  LEU   4          HD22      LEU   4  13.749  -0.728  16.273
   27   HD23  LEU   4          HD23      LEU   4  12.804   0.097  15.021
   28    H    ALA   5           H        ALA   5  14.631  -0.634  11.555
   29    HA   ALA   5           HA       ALA   5  13.240   1.919  12.080
   30    HB1  ALA   5           HB1      ALA   5  15.894   1.319  10.685
   31    HB2  ALA   5           HB2      ALA   5  15.236   2.932  11.025
   32    HB3  ALA   5           HB3      ALA   5  15.691   1.866  12.363
   33    H    LYS   6           H        LYS   6  14.161  -0.180   9.295
   34    HA   LYS   6           HA       LYS   6  13.200   1.585   7.294
   35    HB2  LYS   6           HB2      LYS   6  14.815  -0.301   6.975
   36    HB3  LYS   6           HB3      LYS   6  13.464  -1.444   7.058
   37    HG2  LYS   6           HG2      LYS   6  12.446  -0.481   5.068
   38    HG3  LYS   6           HG3      LYS   6  13.570   0.892   5.105
   39    HD2  LYS   6           HD2      LYS   6  15.435  -0.876   4.710
   40    HD3  LYS   6           HD3      LYS   6  14.108  -1.982   4.292
   41    HE2  LYS   6           HE2      LYS   6  13.282  -0.230   2.640
   42    HE3  LYS   6           HE3      LYS   6  14.705   0.742   3.039
   43    HZ1  LYS   6           HZ1      LYS   6  15.237  -0.448   1.098
   44    HZ2  LYS   6           HZ2      LYS   6  16.026  -1.296   2.286
   45    HZ3  LYS   6           HZ3      LYS   6  14.629  -1.852   1.629
   46    H    LEU   7           H        LEU   7  11.375  -0.936   9.056
   47    HA   LEU   7           HA       LEU   7   9.016  -0.836   7.470
   48    HB2  LEU   7           HB2      LEU   7   9.663  -1.588  10.298
   49    HB3  LEU   7           HB3      LEU   7   7.981  -1.256   9.925
   50    HG   LEU   7           HG       LEU   7   8.264  -3.575   9.809
   51   HD11  LEU   7          HD11      LEU   7   7.393  -4.115   7.690
   52   HD12  LEU   7          HD12      LEU   7   6.923  -2.423   7.974
   53   HD13  LEU   7          HD13      LEU   7   8.264  -2.805   6.880
   54   HD21  LEU   7          HD21      LEU   7  10.636  -3.830   9.468
   55   HD22  LEU   7          HD22      LEU   7   9.759  -4.724   8.215
   56   HD23  LEU   7          HD23      LEU   7  10.518  -3.163   7.821
   57    H    ILE   8           H        ILE   8   9.994   1.439  10.045
   58    HA   ILE   8           HA       ILE   8   7.557   2.981   9.925
   59    HB   ILE   8           HB       ILE   8  10.357   3.805  10.751
   60   HG12  ILE   8          HG12      ILE   8   9.426   1.993  12.141
   61   HG13  ILE   8          HG13      ILE   8   9.656   3.493  13.025
   62   HG21  ILE   8          HG21      ILE   8   7.717   5.279  11.030
   63   HG22  ILE   8          HG22      ILE   8   9.143   5.638  12.013
   64   HG23  ILE   8          HG23      ILE   8   9.215   5.845  10.262
   65   HD11  ILE   8          HD11      ILE   8   7.583   2.469  13.721
   66   HD12  ILE   8          HD12      ILE   8   7.189   3.947  12.851
   67   HD13  ILE   8          HD13      ILE   8   6.995   2.370  12.049
   68    H    SER   9           H        SER   9  10.537   3.074   7.960
   69    HA   SER   9           HA       SER   9   9.820   5.527   6.535
   70    HB2  SER   9           HB2      SER   9  11.875   3.354   5.965
   71    HB3  SER   9           HB3      SER   9  11.729   4.869   5.074
   72    HG   SER   9           HG       SER   9  12.313   6.019   6.849
   73    H    LEU  10           H        LEU  10   8.978   2.138   6.217
   74    HA   LEU  10           HA       LEU  10   8.211   2.241   3.399
   75    HB2  LEU  10           HB2      LEU  10   7.951   0.254   5.668
   76    HB3  LEU  10           HB3      LEU  10   7.062   0.012   4.177
   77    HG   LEU  10           HG       LEU  10  10.061   0.490   4.068
   78   HD11  LEU  10          HD11      LEU  10   8.658  -2.174   4.524
   79   HD12  LEU  10          HD12      LEU  10  10.350  -1.975   4.013
   80   HD13  LEU  10          HD13      LEU  10   9.850  -1.386   5.594
   81   HD21  LEU  10          HD21      LEU  10   8.105  -1.088   2.325
   82   HD22  LEU  10          HD22      LEU  10   8.765   0.519   1.966
   83   HD23  LEU  10          HD23      LEU  10   9.845  -0.867   2.016
   84    H    GLN  11           H        GLN  11   6.614   3.126   6.447
   85    HA   GLN  11           HA       GLN  11   3.908   2.974   5.393
   86    HB2  GLN  11           HB2      GLN  11   5.093   4.453   7.790
   87    HB3  GLN  11           HB3      GLN  11   3.397   4.477   7.343
   88    HG2  GLN  11           HG2      GLN  11   3.253   2.044   7.621
   89    HG3  GLN  11           HG3      GLN  11   4.965   1.936   8.024
   90   HE21  GLN  11          HE22      GLN  11   1.782   3.016   9.103
   91   HE22  GLN  11          HE21      GLN  11   2.250   3.202  10.793
   92    H    ALA  12           H        ALA  12   3.403   4.061   3.630
   93    HA   ALA  12           HA       ALA  12   4.728   6.312   2.587
   94    HB1  ALA  12           HB1      ALA  12   1.932   5.323   1.972
   95    HB2  ALA  12           HB2      ALA  12   2.972   6.285   0.900
   96    HB3  ALA  12           HB3      ALA  12   3.431   4.617   1.305
   97    H    THR  13           H        THR  13   3.973   8.433   2.119
   98    HA   THR  13           HA       THR  13   2.864   9.726   4.522
   99    HB   THR  13           HB       THR  13   4.312  10.808   2.084
  100    HG1  THR  13           HG1      THR  13   5.391  10.475   4.670
  101   HG21  THR  13          HG21      THR  13   3.874  12.171   4.762
  102   HG22  THR  13          HG22      THR  13   4.910  12.741   3.429
  103   HG23  THR  13          HG23      THR  13   3.166  12.661   3.207
  104    H    GLU  14           H        GLU  14   1.933   9.412   1.097
  105    HA   GLU  14           HA       GLU  14  -0.413  11.184   1.572
  106    HB2  GLU  14           HB2      GLU  14   0.087  12.420  -0.459
  107    HB3  GLU  14           HB3      GLU  14   1.407  12.538   0.692
  108    HG2  GLU  14           HG2      GLU  14   2.092  10.315  -0.935
  109    HG3  GLU  14           HG3      GLU  14   1.371  11.462  -2.046
  110    H    ALA  15           H        ALA  15  -2.073  11.085  -0.103
  111    HA   ALA  15           HA       ALA  15  -2.117   8.694  -1.828
  112    HB1  ALA  15           HB1      ALA  15  -4.202   9.222   0.337
  113    HB2  ALA  15           HB2      ALA  15  -4.282   7.948  -0.896
  114    HB3  ALA  15           HB3      ALA  15  -3.008   7.904   0.334
  115    H    THR  16           H        THR  16  -3.788   8.737  -3.373
  116    HA   THR  16           HA       THR  16  -5.146  11.377  -3.885
  117    HB   THR  16           HB       THR  16  -4.294   9.292  -5.913
  118    HG1  THR  16           HG1      THR  16  -2.787  10.828  -6.483
  119   HG21  THR  16          HG21      THR  16  -6.213  10.529  -6.746
  120   HG22  THR  16          HG22      THR  16  -5.503  12.077  -6.224
  121   HG23  THR  16          HG23      THR  16  -4.767  11.144  -7.546
  122    H    ILE  17           H        ILE  17  -7.230  11.199  -3.068
  123    HA   ILE  17           HA       ILE  17  -8.579   8.551  -3.068
  124    HB   ILE  17           HB       ILE  17  -9.481  11.183  -1.830
  125   HG12  ILE  17          HG12      ILE  17  -8.059   8.817  -0.555
  126   HG13  ILE  17          HG13      ILE  17  -7.401  10.429  -0.777
  127   HG21  ILE  17          HG21      ILE  17 -10.511   8.327  -1.479
  128   HG22  ILE  17          HG22      ILE  17 -11.099   9.750  -0.590
  129   HG23  ILE  17          HG23      ILE  17 -11.363   9.648  -2.306
  130   HD11  ILE  17          HD11      ILE  17  -9.696   9.677   1.075
  131   HD12  ILE  17          HD12      ILE  17  -8.062  10.101   1.534
  132   HD13  ILE  17          HD13      ILE  17  -9.100  11.334   0.789
  133    H    VAL  18           H        VAL  18 -10.390   8.028  -4.354
  134    HA   VAL  18           HA       VAL  18 -11.100  10.038  -6.439
  135    HB   VAL  18           HB       VAL  18 -11.398   7.029  -6.530
  136   HG11  VAL  18          HG11      VAL  18 -11.489   9.159  -8.712
  137   HG12  VAL  18          HG12      VAL  18 -11.601   7.404  -8.964
  138   HG13  VAL  18          HG13      VAL  18 -12.876   8.243  -8.085
  139   HG21  VAL  18          HG21      VAL  18  -9.029   7.427  -6.395
  140   HG22  VAL  18          HG22      VAL  18  -9.458   6.997  -8.051
  141   HG23  VAL  18          HG23      VAL  18  -9.124   8.695  -7.629
  142    H    THR  19           H        THR  19 -13.082  10.820  -6.456
  143    HA   THR  19           HA       THR  19 -15.325   9.400  -5.054
  144    HB   THR  19           HB       THR  19 -14.810  12.379  -5.249
  145    HG1  THR  19           HG1      THR  19 -14.727  12.087  -2.948
  146   HG21  THR  19          HG21      THR  19 -16.741  12.557  -3.675
  147   HG22  THR  19          HG22      THR  19 -17.225  12.010  -5.268
  148   HG23  THR  19          HG23      THR  19 -17.085  10.827  -3.941
  149    H    LEU  20           H        LEU  20 -17.353   9.343  -6.010
  150    HA   LEU  20           HA       LEU  20 -17.513   9.817  -8.886
  151    HB2  LEU  20           HB2      LEU  20 -19.695   8.938  -6.943
  152    HB3  LEU  20           HB3      LEU  20 -19.778   8.942  -8.687
  153    HG   LEU  20           HG       LEU  20 -17.931   7.205  -6.994
  154   HD11  LEU  20          HD11      LEU  20 -20.392   6.549  -8.654
  155   HD12  LEU  20          HD12      LEU  20 -19.345   5.365  -7.843
  156   HD13  LEU  20          HD13      LEU  20 -20.277   6.533  -6.886
  157   HD21  LEU  20          HD21      LEU  20 -16.779   7.637  -9.055
  158   HD22  LEU  20          HD22      LEU  20 -17.491   6.028  -9.185
  159   HD23  LEU  20          HD23      LEU  20 -18.257   7.412 -10.010
  160    H    ASP  21           H        ASP  21 -17.823  11.774  -9.682
  161    HA   ASP  21           HA       ASP  21 -18.963  13.886  -7.929
  162    HB2  ASP  21           HB2      ASP  21 -16.644  13.974  -9.118
  163    HB3  ASP  21           HB3      ASP  21 -17.559  14.435 -10.534
  164    H    SER  22           H        SER  22 -20.232  12.017 -10.273
  165    HA   SER  22           HA       SER  22 -22.566  13.827 -10.586
  166    HB2  SER  22           HB2      SER  22 -21.317  12.386 -12.940
  167    HB3  SER  22           HB3      SER  22 -23.012  12.834 -12.899
  168    HG   SER  22           HG       SER  22 -21.736  14.392 -13.924
  169    H    ASP  23           H        ASP  23 -21.405  10.596 -11.444
  170    HA   ASP  23           HA       ASP  23 -22.883   9.124  -9.552
  171    HB2  ASP  23           HB2      ASP  23 -24.707   9.631 -11.349
  172    HB3  ASP  23           HB3      ASP  23 -23.773   8.613 -12.432
  173    H    ASN  24           H        ASN  24 -22.613   6.648 -11.124
  174    HA   ASN  24           HA       ASN  24 -19.821   6.062 -10.883
  175    HB2  ASN  24           HB2      ASN  24 -22.195   4.640 -12.202
  176    HB3  ASN  24           HB3      ASN  24 -20.624   3.891 -11.948
  177   HD21  ASN  24          HD22      ASN  24 -23.376   5.146 -10.167
  178   HD22  ASN  24          HD21      ASN  24 -22.930   4.104  -8.799
  179    H    ILE  25           H        ILE  25 -21.245   7.871 -13.282
  180    HA   ILE  25           HA       ILE  25 -19.642   7.044 -15.562
  181    HB   ILE  25           HB       ILE  25 -20.981   8.682 -16.727
  182   HG12  ILE  25          HG12      ILE  25 -21.967   9.597 -13.978
  183   HG13  ILE  25          HG13      ILE  25 -20.987  10.522 -15.115
  184   HG21  ILE  25          HG21      ILE  25 -22.847   7.259 -14.766
  185   HG22  ILE  25          HG22      ILE  25 -23.167   7.703 -16.448
  186   HG23  ILE  25          HG23      ILE  25 -21.988   6.438 -16.089
  187   HD11  ILE  25          HD11      ILE  25 -22.890  10.466 -16.741
  188   HD12  ILE  25          HD12      ILE  25 -23.893   9.732 -15.463
  189   HD13  ILE  25          HD13      ILE  25 -23.209  11.349 -15.237
  190    H    LEU  26           H        LEU  26 -19.187   9.244 -12.922
  191    HA   LEU  26           HA       LEU  26 -17.054  10.703 -14.412
  192    HB2  LEU  26           HB2      LEU  26 -19.021  12.144 -14.428
  193    HB3  LEU  26           HB3      LEU  26 -19.231  11.907 -12.688
  194    HG   LEU  26           HG       LEU  26 -17.151  13.105 -12.217
  195   HD11  LEU  26          HD11      LEU  26 -15.850  12.658 -14.266
  196   HD12  LEU  26          HD12      LEU  26 -16.992  13.673 -15.186
  197   HD13  LEU  26          HD13      LEU  26 -15.976  14.379 -13.907
  198   HD21  LEU  26          HD21      LEU  26 -17.870  15.368 -12.928
  199   HD22  LEU  26          HD22      LEU  26 -19.001  14.642 -14.088
  200   HD23  LEU  26          HD23      LEU  26 -19.226  14.406 -12.344
  201    H    LEU  27           H        LEU  27 -15.335  10.805 -13.458
  202    HA   LEU  27           HA       LEU  27 -14.973  10.172 -10.534
  203    HB2  LEU  27           HB2      LEU  27 -13.465   9.029 -12.877
  204    HB3  LEU  27           HB3      LEU  27 -12.625   9.296 -11.356
  205    HG   LEU  27           HG       LEU  27 -14.221   7.872 -10.151
  206   HD11  LEU  27          HD11      LEU  27 -15.452   7.380 -12.887
  207   HD12  LEU  27          HD12      LEU  27 -15.716   6.338 -11.468
  208   HD13  LEU  27          HD13      LEU  27 -16.262   8.008 -11.437
  209   HD21  LEU  27          HD21      LEU  27 -12.140   6.937 -11.204
  210   HD22  LEU  27          HD22      LEU  27 -13.444   5.750 -11.019
  211   HD23  LEU  27          HD23      LEU  27 -13.113   6.464 -12.609
  212    H    SER  28           H        SER  28 -13.923  11.562  -9.350
  213    HA   SER  28           HA       SER  28 -11.916  13.399 -10.517
  214    HB2  SER  28           HB2      SER  28 -14.091  14.602 -10.539
  215    HB3  SER  28           HB3      SER  28 -14.211  14.372  -8.779
  216    HG   SER  28           HG       SER  28 -13.274  16.384  -9.562
  217    H    GLU  29           H        GLU  29 -10.335  14.081  -8.988
  218    HA   GLU  29           HA       GLU  29 -10.327  12.341  -6.570
  219    HB2  GLU  29           HB2      GLU  29  -7.792  12.964  -8.043
  220    HB3  GLU  29           HB3      GLU  29  -8.175  11.718  -6.855
  221    HG2  GLU  29           HG2      GLU  29  -8.071  10.481  -8.769
  222    HG3  GLU  29           HG3      GLU  29  -9.802  10.734  -8.559
  223    H    GLU  30           H        GLU  30  -9.287  12.868  -4.715
  224    HA   GLU  30           HA       GLU  30  -8.521  15.736  -4.215
  225    HB2  GLU  30           HB2      GLU  30  -9.199  13.535  -2.223
  226    HB3  GLU  30           HB3      GLU  30  -8.713  15.159  -1.801
  227    HG2  GLU  30           HG2      GLU  30 -11.084  15.129  -3.547
  228    HG3  GLU  30           HG3      GLU  30 -11.298  14.141  -2.121
  229    H    GLN  31           H        GLN  31  -6.396  16.179  -3.486
  230    HA   GLN  31           HA       GLN  31  -4.496  13.885  -3.334
  231    HB2  GLN  31           HB2      GLN  31  -4.025  16.868  -3.745
  232    HB3  GLN  31           HB3      GLN  31  -2.793  15.619  -3.615
  233    HG2  GLN  31           HG2      GLN  31  -4.330  14.515  -5.592
  234    HG3  GLN  31           HG3      GLN  31  -4.675  16.221  -5.880
  235   HE21  GLN  31          HE21      GLN  31  -1.893  14.020  -5.206
  236   HE22  GLN  31          HE22      GLN  31  -0.880  14.714  -6.470
  237    H    VAL  32           H        VAL  32  -3.916  13.252  -1.298
  238    HA   VAL  32           HA       VAL  32  -4.291  15.171   0.975
  239    HB   VAL  32           HB       VAL  32  -5.565  13.608   2.207
  240   HG11  VAL  32          HG11      VAL  32  -6.834  13.598  -0.547
  241   HG12  VAL  32          HG12      VAL  32  -7.642  13.454   1.018
  242   HG13  VAL  32          HG13      VAL  32  -6.857  14.983   0.577
  243   HG21  VAL  32          HG21      VAL  32  -4.570  11.462   1.480
  244   HG22  VAL  32          HG22      VAL  32  -6.319  11.446   1.433
  245   HG23  VAL  32          HG23      VAL  32  -5.407  11.621  -0.083
  246    H    ASP  33           H        ASP  33  -3.475  14.573   2.978
  247    HA   ASP  33           HA       ASP  33  -0.986  12.969   3.013
  248    HB2  ASP  33           HB2      ASP  33  -1.244  15.170   4.222
  249    HB3  ASP  33           HB3      ASP  33  -2.392  14.389   5.308
  250    H    VAL  34           H        VAL  34  -0.747  11.095   4.265
  251    HA   VAL  34           HA       VAL  34  -2.886   9.217   4.360
  252    HB   VAL  34           HB       VAL  34  -0.450   8.696   4.293
  253   HG11  VAL  34          HG11      VAL  34  -0.532   9.124   7.311
  254   HG12  VAL  34          HG12      VAL  34   0.805   8.461   6.363
  255   HG13  VAL  34          HG13      VAL  34   0.330  10.149   6.141
  256   HG21  VAL  34          HG21      VAL  34  -2.131   6.943   4.699
  257   HG22  VAL  34          HG22      VAL  34  -0.594   6.613   5.518
  258   HG23  VAL  34          HG23      VAL  34  -1.977   7.200   6.453
  259    H    GLU  35           H        GLU  35  -2.123  11.679   6.731
  260    HA   GLU  35           HA       GLU  35  -3.612  10.644   8.980
  261    HB2  GLU  35           HB2      GLU  35  -1.993  12.635   8.838
  262    HB3  GLU  35           HB3      GLU  35  -3.335  13.534   8.130
  263    HG2  GLU  35           HG2      GLU  35  -3.369  14.088  10.416
  264    HG3  GLU  35           HG3      GLU  35  -4.665  12.911  10.249
  265    H    LEU  36           H        LEU  36  -4.729  11.827   5.877
  266    HA   LEU  36           HA       LEU  36  -7.444  12.422   6.912
  267    HB2  LEU  36           HB2      LEU  36  -6.192  13.013   4.222
  268    HB3  LEU  36           HB3      LEU  36  -7.651  13.726   4.885
  269    HG   LEU  36           HG       LEU  36  -4.806  14.217   5.868
  270   HD11  LEU  36          HD11      LEU  36  -6.791  16.043   4.459
  271   HD12  LEU  36          HD12      LEU  36  -5.175  16.493   5.039
  272   HD13  LEU  36          HD13      LEU  36  -5.341  15.319   3.730
  273   HD21  LEU  36          HD21      LEU  36  -6.352  14.354   7.766
  274   HD22  LEU  36          HD22      LEU  36  -5.822  15.967   7.301
  275   HD23  LEU  36          HD23      LEU  36  -7.441  15.408   6.831
  276    H    VAL  37           H        VAL  37  -6.057   9.743   5.433
  277    HA   VAL  37           HA       VAL  37  -8.495   9.057   3.864
  278    HB   VAL  37           HB       VAL  37  -6.274   8.755   2.826
  279   HG11  VAL  37          HG11      VAL  37  -5.866   6.487   4.820
  280   HG12  VAL  37          HG12      VAL  37  -4.838   6.878   3.428
  281   HG13  VAL  37          HG13      VAL  37  -4.958   8.011   4.775
  282   HG21  VAL  37          HG21      VAL  37  -8.199   7.449   2.048
  283   HG22  VAL  37          HG22      VAL  37  -6.673   6.567   1.876
  284   HG23  VAL  37          HG23      VAL  37  -7.789   6.143   3.183
  285    H    GLN  38           H        GLN  38  -9.783   7.293   4.340
  286    HA   GLN  38           HA       GLN  38  -9.298   5.875   6.941
  287    HB2  GLN  38           HB2      GLN  38 -11.676   5.794   7.344
  288    HB3  GLN  38           HB3      GLN  38 -11.153   7.451   7.149
  289    HG2  GLN  38           HG2      GLN  38 -12.222   7.616   4.990
  290    HG3  GLN  38           HG3      GLN  38 -12.443   5.863   4.887
  291   HE21  GLN  38          HE22      GLN  38 -13.355   8.524   7.144
  292   HE22  GLN  38          HE21      GLN  38 -14.907   7.731   7.458
  293    H    ARG  39           H        ARG  39 -10.370   3.813   7.190
  294    HA   ARG  39           HA       ARG  39  -9.633   1.965   5.123
  295    HB2  ARG  39           HB2      ARG  39 -10.116   0.277   6.716
  296    HB3  ARG  39           HB3      ARG  39  -9.427   1.641   7.585
  297    HG2  ARG  39           HG2      ARG  39 -11.905   2.287   8.078
  298    HG3  ARG  39           HG3      ARG  39 -12.312   0.653   7.550
  299    HD2  ARG  39           HD2      ARG  39 -10.690  -0.281   9.191
  300    HD3  ARG  39           HD3      ARG  39 -10.338   1.359   9.746
  301    HE   ARG  39           HE       ARG  39 -12.485   1.519  10.755
  302   HH11  ARG  39          HH11      ARG  39 -12.333  -1.676   9.221
  303   HH12  ARG  39          HH12      ARG  39 -13.302  -2.358  10.513
  304   HH21  ARG  39          HH21      ARG  39 -13.686   0.483  12.305
  305   HH22  ARG  39          HH22      ARG  39 -13.996  -1.244  12.106
  306    H    GLY  40           H        GLY  40 -11.794   3.701   4.240
  307    HA2  GLY  40           HA2      GLY  40 -13.500   1.630   3.006
  308    HA3  GLY  40           HA3      GLY  40 -14.319   2.961   3.839
  309    H    ASP  41           H        ASP  41 -11.353   3.995   2.429
  310    HA   ASP  41           HA       ASP  41 -12.770   5.423   0.258
  311    HB2  ASP  41           HB2      ASP  41  -9.990   5.638   1.474
  312    HB3  ASP  41           HB3      ASP  41 -10.526   6.589   0.094
  313    H    ILE  42           H        ILE  42 -11.759   5.618  -1.884
  314    HA   ILE  42           HA       ILE  42 -10.166   3.242  -2.736
  315    HB   ILE  42           HB       ILE  42 -12.311   4.664  -4.344
  316   HG12  ILE  42          HG12      ILE  42 -12.231   1.940  -2.968
  317   HG13  ILE  42          HG13      ILE  42 -13.296   3.283  -2.583
  318   HG21  ILE  42          HG21      ILE  42 -10.575   2.244  -5.039
  319   HG22  ILE  42          HG22      ILE  42 -11.854   2.940  -6.058
  320   HG23  ILE  42          HG23      ILE  42 -10.404   3.868  -5.738
  321   HD11  ILE  42          HD11      ILE  42 -14.418   3.051  -4.767
  322   HD12  ILE  42          HD12      ILE  42 -13.421   1.614  -5.117
  323   HD13  ILE  42          HD13      ILE  42 -14.539   1.599  -3.752
  324    H    ILE  43           H        ILE  43  -8.237   3.669  -3.547
  325    HA   ILE  43           HA       ILE  43  -7.475   6.468  -4.061
  326    HB   ILE  43           HB       ILE  43  -5.717   4.113  -3.310
  327   HG12  ILE  43          HG12      ILE  43  -7.347   4.158  -1.542
  328   HG13  ILE  43          HG13      ILE  43  -5.802   4.740  -0.966
  329   HG21  ILE  43          HG21      ILE  43  -5.341   7.109  -2.966
  330   HG22  ILE  43          HG22      ILE  43  -4.216   5.854  -2.401
  331   HG23  ILE  43          HG23      ILE  43  -4.502   6.064  -4.128
  332   HD11  ILE  43          HD11      ILE  43  -8.104   6.592  -1.733
  333   HD12  ILE  43          HD12      ILE  43  -7.775   6.008  -0.102
  334   HD13  ILE  43          HD13      ILE  43  -6.584   7.035  -0.925
  335    H    LYS  44           H        LYS  44  -6.726   7.102  -6.054
  336    HA   LYS  44           HA       LYS  44  -5.972   5.202  -8.140
  337    HB2  LYS  44           HB2      LYS  44  -7.191   7.290  -8.526
  338    HB3  LYS  44           HB3      LYS  44  -5.726   8.205  -8.138
  339    HG2  LYS  44           HG2      LYS  44  -4.543   7.190 -10.003
  340    HG3  LYS  44           HG3      LYS  44  -5.857   6.043 -10.309
  341    HD2  LYS  44           HD2      LYS  44  -6.262   9.036 -10.438
  342    HD3  LYS  44           HD3      LYS  44  -5.664   8.100 -11.825
  343    HE2  LYS  44           HE2      LYS  44  -7.696   6.689 -11.756
  344    HE3  LYS  44           HE3      LYS  44  -8.330   7.651 -10.410
  345    HZ1  LYS  44           HZ1      LYS  44  -7.720   8.759 -13.105
  346    HZ2  LYS  44           HZ2      LYS  44  -9.183   8.263 -12.638
  347    HZ3  LYS  44           HZ3      LYS  44  -8.494   9.557 -11.879
  348    H    VAL  45           H        VAL  45  -4.030   4.294  -8.499
  349    HA   VAL  45           HA       VAL  45  -1.573   5.672  -7.507
  350    HB   VAL  45           HB       VAL  45  -2.153   3.666  -6.274
  351   HG11  VAL  45          HG11      VAL  45  -3.217   2.303  -7.982
  352   HG12  VAL  45          HG12      VAL  45  -1.665   2.108  -8.834
  353   HG13  VAL  45          HG13      VAL  45  -1.877   1.445  -7.204
  354   HG21  VAL  45          HG21      VAL  45   0.215   4.373  -6.507
  355   HG22  VAL  45          HG22      VAL  45   0.050   2.617  -6.350
  356   HG23  VAL  45          HG23      VAL  45   0.385   3.333  -7.941
  357    H    VAL  46           H        VAL  46  -0.120   6.310  -8.867
  358    HA   VAL  46           HA       VAL  46  -0.482   5.834 -11.740
  359    HB   VAL  46           HB       VAL  46   1.113   7.674 -12.051
  360   HG11  VAL  46          HG11      VAL  46  -1.093   8.355 -10.078
  361   HG12  VAL  46          HG12      VAL  46  -0.268   9.475 -11.172
  362   HG13  VAL  46          HG13      VAL  46  -1.268   8.174 -11.835
  363   HG21  VAL  46          HG21      VAL  46   2.594   7.383 -10.117
  364   HG22  VAL  46          HG22      VAL  46   1.922   9.017 -10.173
  365   HG23  VAL  46          HG23      VAL  46   1.271   7.840  -9.019
  366    HA   PRO  47           HA       PRO  47   3.064   3.251 -12.667
  367    HB2  PRO  47           HB2      PRO  47   3.793   5.536 -14.529
  368    HB3  PRO  47           HB3      PRO  47   3.917   3.787 -14.824
  369    HG2  PRO  47           HG2      PRO  47   1.790   5.144 -15.771
  370    HG3  PRO  47           HG3      PRO  47   1.494   3.589 -14.927
  371    HD2  PRO  47           HD2      PRO  47   1.238   6.404 -13.860
  372    HD3  PRO  47           HD3      PRO  47   0.139   5.009 -13.638
  373    H    GLY  48           H        GLY  48   4.722   3.013 -11.296
  374    HA2  GLY  48           HA2      GLY  48   6.892   3.409 -10.454
  375    HA3  GLY  48           HA3      GLY  48   6.798   5.103 -10.956
  376    H    GLY  49           H        GLY  49   3.900   4.588  -9.413
  377    HA2  GLY  49           HA2      GLY  49   4.703   5.895  -6.946
  378    HA3  GLY  49           HA3      GLY  49   3.097   5.336  -7.397
  379    H    LYS  50           H        LYS  50   3.221   4.918  -5.027
  380    HA   LYS  50           HA       LYS  50   3.971   2.066  -4.491
  381    HB2  LYS  50           HB2      LYS  50   4.062   4.286  -2.416
  382    HB3  LYS  50           HB3      LYS  50   4.602   2.610  -2.247
  383    HG2  LYS  50           HG2      LYS  50   6.320   3.129  -4.089
  384    HG3  LYS  50           HG3      LYS  50   5.859   4.830  -3.884
  385    HD2  LYS  50           HD2      LYS  50   6.378   4.486  -1.374
  386    HD3  LYS  50           HD3      LYS  50   7.091   2.955  -1.859
  387    HE2  LYS  50           HE2      LYS  50   8.923   4.428  -1.778
  388    HE3  LYS  50           HE3      LYS  50   8.545   4.289  -3.509
  389    HZ1  LYS  50           HZ1      LYS  50   8.870   6.642  -2.775
  390    HZ2  LYS  50           HZ2      LYS  50   7.367   6.416  -3.334
  391    HZ3  LYS  50           HZ3      LYS  50   7.644   6.472  -1.702
  392    H    PHE  51           H        PHE  51   2.706   1.012  -2.880
  393    HA   PHE  51           HA       PHE  51  -0.138   1.829  -2.912
  394    HB2  PHE  51           HB2      PHE  51   1.209  -0.672  -1.879
  395    HB3  PHE  51           HB3      PHE  51  -0.528  -0.389  -1.923
  396    HD1  PHE  51           HD1      PHE  51  -1.759  -0.377  -4.086
  397    HD2  PHE  51           HD2      PHE  51   2.481  -1.087  -3.955
  398    HE1  PHE  51           HE1      PHE  51  -1.806  -1.228  -6.423
  399    HE2  PHE  51           HE2      PHE  51   2.444  -1.862  -6.288
  400    HZ   PHE  51           HZ       PHE  51   0.283  -1.954  -7.539
  401    HA   PRO  52           HA       PRO  52   0.929   3.690   0.994
  402    HB2  PRO  52           HB2      PRO  52  -1.094   5.472   1.319
  403    HB3  PRO  52           HB3      PRO  52   0.085   5.593  -0.020
  404    HG2  PRO  52           HG2      PRO  52  -2.703   4.404  -0.103
  405    HG3  PRO  52           HG3      PRO  52  -1.949   5.555  -1.248
  406    HD2  PRO  52           HD2      PRO  52  -2.028   2.815  -1.653
  407    HD3  PRO  52           HD3      PRO  52  -0.735   3.872  -2.286
  408    H    VAL  53           H        VAL  53  -1.704   1.568   0.805
  409    HA   VAL  53           HA       VAL  53  -1.890   0.992   3.613
  410    HB   VAL  53           HB       VAL  53  -4.498   1.152   3.476
  411   HG11  VAL  53          HG11      VAL  53  -2.897   3.669   4.053
  412   HG12  VAL  53          HG12      VAL  53  -4.499   3.237   4.681
  413   HG13  VAL  53          HG13      VAL  53  -3.087   2.288   5.158
  414   HG21  VAL  53          HG21      VAL  53  -4.601   2.068   1.158
  415   HG22  VAL  53          HG22      VAL  53  -5.375   3.123   2.367
  416   HG23  VAL  53          HG23      VAL  53  -3.785   3.543   1.737
  417    H    ASP  54           H        ASP  54  -3.296  -1.049   3.854
  418    HA   ASP  54           HA       ASP  54  -2.924  -2.648   1.403
  419    HB2  ASP  54           HB2      ASP  54  -2.873  -4.563   2.647
  420    HB3  ASP  54           HB3      ASP  54  -1.947  -3.393   3.562
  421    H    GLY  55           H        GLY  55  -4.439  -4.029   0.464
  422    HA2  GLY  55           HA2      GLY  55  -7.159  -4.274   0.932
  423    HA3  GLY  55           HA3      GLY  55  -6.995  -2.695   0.172
  424    H    ARG  56           H        ARG  56  -8.334  -3.544  -1.448
  425    HA   ARG  56           HA       ARG  56  -7.241  -5.642  -3.257
  426    HB2  ARG  56           HB2      ARG  56  -9.442  -5.897  -2.010
  427    HB3  ARG  56           HB3      ARG  56 -10.108  -4.662  -3.082
  428    HG2  ARG  56           HG2      ARG  56  -9.658  -6.129  -5.038
  429    HG3  ARG  56           HG3      ARG  56  -8.837  -7.288  -3.989
  430    HD2  ARG  56           HD2      ARG  56 -10.966  -8.175  -4.377
  431    HD3  ARG  56           HD3      ARG  56 -10.969  -7.599  -2.705
  432    HE   ARG  56           HE       ARG  56 -12.097  -5.474  -3.729
  433   HH11  ARG  56          HH11      ARG  56 -12.955  -8.787  -4.608
  434   HH12  ARG  56          HH12      ARG  56 -14.288  -8.213  -5.600
  435   HH21  ARG  56          HH21      ARG  56 -13.917  -4.945  -4.598
  436   HH22  ARG  56          HH22      ARG  56 -15.006  -6.142  -5.301
  437    H    VAL  57           H        VAL  57  -7.168  -5.511  -5.424
  438    HA   VAL  57           HA       VAL  57  -7.280  -2.819  -6.729
  439    HB   VAL  57           HB       VAL  57  -5.863  -5.322  -7.751
  440   HG11  VAL  57          HG11      VAL  57  -5.472  -2.360  -8.366
  441   HG12  VAL  57          HG12      VAL  57  -4.530  -3.698  -9.054
  442   HG13  VAL  57          HG13      VAL  57  -6.247  -3.553  -9.431
  443   HG21  VAL  57          HG21      VAL  57  -3.735  -4.263  -6.911
  444   HG22  VAL  57          HG22      VAL  57  -4.747  -3.188  -5.918
  445   HG23  VAL  57          HG23      VAL  57  -4.781  -4.938  -5.660
  446    H    ILE  58           H        ILE  58  -9.081  -2.542  -8.027
  447    HA   ILE  58           HA       ILE  58 -10.053  -4.868  -9.632
  448    HB   ILE  58           HB       ILE  58 -12.447  -4.103  -9.164
  449   HG12  ILE  58          HG12      ILE  58 -11.289  -3.123  -6.546
  450   HG13  ILE  58          HG13      ILE  58 -11.556  -1.997  -7.892
  451   HG21  ILE  58          HG21      ILE  58 -10.940  -5.510  -6.943
  452   HG22  ILE  58          HG22      ILE  58 -12.677  -5.599  -7.292
  453   HG23  ILE  58          HG23      ILE  58 -11.531  -6.250  -8.452
  454   HD11  ILE  58          HD11      ILE  58 -13.948  -2.609  -7.989
  455   HD12  ILE  58          HD12      ILE  58 -13.734  -3.668  -6.576
  456   HD13  ILE  58          HD13      ILE  58 -13.490  -1.918  -6.427
  457    H    GLU  59           H        GLU  59  -8.444  -2.631 -10.358
  458    HA   GLU  59           HA       GLU  59  -9.630  -2.359 -12.934
  459    HB2  GLU  59           HB2      GLU  59 -10.517  -0.308 -11.381
  460    HB3  GLU  59           HB3      GLU  59  -8.973   0.375 -11.835
  461    HG2  GLU  59           HG2      GLU  59 -11.174  -0.628 -13.704
  462    HG3  GLU  59           HG3      GLU  59 -10.819   1.056 -13.336
  463    H    GLY  60           H        GLY  60  -7.913  -2.568 -14.275
  464    HA2  GLY  60           HA2      GLY  60  -5.859  -1.956 -15.207
  465    HA3  GLY  60           HA3      GLY  60  -5.340  -1.260 -13.688
  466    H    HIS  61           H        HIS  61  -3.531  -2.455 -14.771
  467    HA   HIS  61           HA       HIS  61  -3.073  -5.163 -13.616
  468    HB2  HIS  61           HB2      HIS  61  -2.447  -5.932 -16.040
  469    HB3  HIS  61           HB3      HIS  61  -4.114  -5.947 -15.493
  470    HD1  HIS  61           HD1      HIS  61  -5.848  -4.647 -16.978
  471    HD2  HIS  61           HD2      HIS  61  -1.812  -3.661 -17.694
  472    HE1  HIS  61           HE1      HIS  61  -5.844  -2.981 -18.890
  473    H    SER  62           H        SER  62  -1.197  -4.892 -12.588
  474    HA   SER  62           HA       SER  62   1.130  -3.548 -13.837
  475    HB2  SER  62           HB2      SER  62   1.376  -2.720 -11.531
  476    HB3  SER  62           HB3      SER  62  -0.177  -2.263 -12.141
  477    HG   SER  62           HG       SER  62   0.402  -4.468 -10.443
  478    H    MET  63           H        MET  63   3.126  -3.942 -12.515
  479    HA   MET  63           HA       MET  63   3.221  -6.604 -11.160
  480    HB2  MET  63           HB2      MET  63   4.523  -6.609 -13.226
  481    HB3  MET  63           HB3      MET  63   5.477  -5.229 -12.668
  482    HG2  MET  63           HG2      MET  63   6.457  -6.459 -10.907
  483    HG3  MET  63           HG3      MET  63   5.269  -7.761 -11.010
  484    HE1  MET  63           HE1      MET  63   6.317  -9.895 -13.995
  485    HE2  MET  63           HE2      MET  63   5.395  -9.830 -12.474
  486    HE3  MET  63           HE3      MET  63   4.986  -8.743 -13.823
  487    H    VAL  64           H        VAL  64   4.082  -6.669  -9.157
  488    HA   VAL  64           HA       VAL  64   4.683  -4.072  -7.803
  489    HB   VAL  64           HB       VAL  64   3.115  -6.450  -6.742
  490   HG11  VAL  64          HG11      VAL  64   3.736  -3.746  -5.461
  491   HG12  VAL  64          HG12      VAL  64   2.537  -4.908  -4.855
  492   HG13  VAL  64          HG13      VAL  64   4.237  -5.349  -4.871
  493   HG21  VAL  64          HG21      VAL  64   1.807  -5.228  -8.380
  494   HG22  VAL  64          HG22      VAL  64   1.225  -4.772  -6.770
  495   HG23  VAL  64          HG23      VAL  64   2.284  -3.675  -7.683
  496    H    ASP  65           H        ASP  65   6.192  -3.933  -6.221
  497    HA   ASP  65           HA       ASP  65   8.051  -6.243  -5.823
  498    HB2  ASP  65           HB2      ASP  65   9.037  -4.455  -7.122
  499    HB3  ASP  65           HB3      ASP  65   8.499  -3.245  -5.956
  500    H    GLU  66           H        GLU  66   7.660  -7.140  -3.940
  501    HA   GLU  66           HA       GLU  66   7.105  -5.521  -1.483
  502    HB2  GLU  66           HB2      GLU  66   5.488  -7.282  -0.867
  503    HB3  GLU  66           HB3      GLU  66   5.041  -6.427  -2.347
  504    HG2  GLU  66           HG2      GLU  66   5.643  -8.264  -3.735
  505    HG3  GLU  66           HG3      GLU  66   6.526  -9.074  -2.433
  506    H    SER  67           H        SER  67   9.513  -7.069  -2.584
  507    HA   SER  67           HA       SER  67   9.978  -9.432  -1.223
  508    HB2  SER  67           HB2      SER  67  12.334  -9.178  -1.853
  509    HB3  SER  67           HB3      SER  67  11.265  -8.660  -3.162
  510    HG   SER  67           HG       SER  67  12.852  -7.116  -2.924
  511    H    LEU  68           H        LEU  68  10.160  -6.384   0.399
  512    HA   LEU  68           HA       LEU  68  11.771  -7.523   2.608
  513    HB2  LEU  68           HB2      LEU  68  12.092  -5.210   1.647
  514    HB3  LEU  68           HB3      LEU  68  10.467  -4.792   2.131
  515    HG   LEU  68           HG       LEU  68  12.146  -3.746   3.478
  516   HD11  LEU  68          HD11      LEU  68   9.904  -4.428   4.508
  517   HD12  LEU  68          HD12      LEU  68  10.826  -5.673   5.383
  518   HD13  LEU  68          HD13      LEU  68  11.230  -3.972   5.595
  519   HD21  LEU  68          HD21      LEU  68  12.947  -6.477   4.518
  520   HD22  LEU  68          HD22      LEU  68  13.899  -5.464   3.408
  521   HD23  LEU  68          HD23      LEU  68  13.561  -4.890   5.048
  522    H    ILE  69           H        ILE  69   8.408  -6.819   1.798
  523    HA   ILE  69           HA       ILE  69   7.468  -6.891   4.580
  524    HB   ILE  69           HB       ILE  69   5.793  -7.140   2.054
  525   HG12  ILE  69          HG12      ILE  69   7.128  -4.986   2.068
  526   HG13  ILE  69          HG13      ILE  69   5.391  -4.875   1.929
  527   HG21  ILE  69          HG21      ILE  69   4.008  -6.228   3.671
  528   HG22  ILE  69          HG22      ILE  69   4.543  -7.885   3.961
  529   HG23  ILE  69          HG23      ILE  69   5.147  -6.561   4.976
  530   HD11  ILE  69          HD11      ILE  69   5.148  -4.160   4.231
  531   HD12  ILE  69          HD12      ILE  69   6.899  -4.382   4.522
  532   HD13  ILE  69          HD13      ILE  69   6.314  -3.132   3.391
  533    H    THR  70           H        THR  70   6.857  -9.029   1.757
  534    HA   THR  70           HA       THR  70   5.913 -11.193   3.526
  535    HB   THR  70           HB       THR  70   5.196 -12.209   1.388
  536    HG1  THR  70           HG1      THR  70   5.513 -10.679  -0.471
  537   HG21  THR  70          HG21      THR  70   4.449  -9.262   1.335
  538   HG22  THR  70          HG22      THR  70   3.496 -10.670   0.828
  539   HG23  THR  70          HG23      THR  70   3.807 -10.404   2.544
  540    H    GLY  71           H        GLY  71   8.781 -10.371   1.959
  541    HA2  GLY  71           HA2      GLY  71  10.834 -11.393   1.810
  542    HA3  GLY  71           HA3      GLY  71  10.181 -12.876   2.537
  543    H    GLU  72           H        GLU  72   8.229 -11.835  -0.113
  544    HA   GLU  72           HA       GLU  72   9.106 -13.956  -1.925
  545    HB2  GLU  72           HB2      GLU  72   7.358 -11.502  -2.343
  546    HB3  GLU  72           HB3      GLU  72   7.664 -12.700  -3.593
  547    HG2  GLU  72           HG2      GLU  72   6.376 -13.445  -0.939
  548    HG3  GLU  72           HG3      GLU  72   5.485 -12.813  -2.320
  549    H    ALA  73           H        ALA  73  11.299 -13.768  -2.505
  550    HA   ALA  73           HA       ALA  73  12.519 -11.216  -2.957
  551    HB1  ALA  73           HB1      ALA  73  13.567 -14.056  -3.287
  552    HB2  ALA  73           HB2      ALA  73  14.554 -12.580  -3.202
  553    HB3  ALA  73           HB3      ALA  73  13.611 -13.093  -1.794
  554    H    MET  74           H        MET  74  10.382 -11.760  -4.805
  555    HA   MET  74           HA       MET  74  11.632 -11.263  -7.364
  556    HB2  MET  74           HB2      MET  74  10.569 -13.143  -8.493
  557    HB3  MET  74           HB3      MET  74  11.715 -13.706  -7.296
  558    HG2  MET  74           HG2      MET  74   9.823 -14.150  -5.739
  559    HG3  MET  74           HG3      MET  74   8.693 -13.696  -7.012
  560    HE1  MET  74           HE1      MET  74  10.046 -15.087  -9.696
  561    HE2  MET  74           HE2      MET  74   9.029 -16.543  -9.636
  562    HE3  MET  74           HE3      MET  74   8.338 -14.964  -9.221
  563    HA   PRO  75           HA       PRO  75   7.954  -8.846  -7.266
  564    HB2  PRO  75           HB2      PRO  75   7.812  -7.793  -9.744
  565    HB3  PRO  75           HB3      PRO  75   9.191  -7.465  -8.653
  566    HG2  PRO  75           HG2      PRO  75   9.026  -9.558 -10.852
  567    HG3  PRO  75           HG3      PRO  75  10.315  -8.346 -10.584
  568    HD2  PRO  75           HD2      PRO  75  10.541 -10.900  -9.670
  569    HD3  PRO  75           HD3      PRO  75  11.174  -9.508  -8.737
  570    H    VAL  76           H        VAL  76   5.757  -8.735  -7.736
  571    HA   VAL  76           HA       VAL  76   4.633 -11.246  -8.931
  572    HB   VAL  76           HB       VAL  76   3.462  -9.723  -6.587
  573   HG11  VAL  76          HG11      VAL  76   1.887 -11.231  -7.754
  574   HG12  VAL  76          HG12      VAL  76   3.061 -12.567  -7.634
  575   HG13  VAL  76          HG13      VAL  76   2.313 -11.892  -6.177
  576   HG21  VAL  76          HG21      VAL  76   5.653 -10.515  -5.829
  577   HG22  VAL  76          HG22      VAL  76   4.396 -11.537  -5.143
  578   HG23  VAL  76          HG23      VAL  76   5.349 -12.123  -6.523
  579    H    ALA  77           H        ALA  77   2.911 -11.216 -10.250
  580    HA   ALA  77           HA       ALA  77   2.131  -8.644 -11.401
  581    HB1  ALA  77           HB1      ALA  77   2.683 -10.591 -12.795
  582    HB2  ALA  77           HB2      ALA  77   1.307 -11.484 -12.099
  583    HB3  ALA  77           HB3      ALA  77   1.026 -10.033 -13.079
  584    H    LYS  78           H        LYS  78   0.131  -7.769 -11.540
  585    HA   LYS  78           HA       LYS  78  -2.111  -8.829  -9.841
  586    HB2  LYS  78           HB2      LYS  78  -1.369  -5.909 -10.191
  587    HB3  LYS  78           HB3      LYS  78  -2.646  -6.530  -9.165
  588    HG2  LYS  78           HG2      LYS  78   0.322  -7.067  -8.712
  589    HG3  LYS  78           HG3      LYS  78  -0.582  -5.735  -7.994
  590    HD2  LYS  78           HD2      LYS  78  -1.908  -7.198  -6.649
  591    HD3  LYS  78           HD3      LYS  78  -1.511  -8.601  -7.646
  592    HE2  LYS  78           HE2      LYS  78   0.877  -8.433  -6.876
  593    HE3  LYS  78           HE3      LYS  78   0.395  -7.144  -5.759
  594    HZ1  LYS  78           HZ1      LYS  78   0.442  -9.340  -4.702
  595    HZ2  LYS  78           HZ2      LYS  78  -1.066  -8.705  -4.650
  596    HZ3  LYS  78           HZ3      LYS  78  -0.693  -9.910  -5.731
  597    H    LYS  79           H        LYS  79  -4.178  -8.310 -10.427
  598    HA   LYS  79           HA       LYS  79  -4.895  -7.088 -13.021
  599    HB2  LYS  79           HB2      LYS  79  -5.014 -10.021 -12.273
  600    HB3  LYS  79           HB3      LYS  79  -6.456  -9.365 -13.018
  601    HG2  LYS  79           HG2      LYS  79  -5.142  -8.581 -14.963
  602    HG3  LYS  79           HG3      LYS  79  -3.661  -9.178 -14.205
  603    HD2  LYS  79           HD2      LYS  79  -4.410 -10.769 -15.874
  604    HD3  LYS  79           HD3      LYS  79  -4.548 -11.493 -14.268
  605    HE2  LYS  79           HE2      LYS  79  -6.972 -11.086 -14.252
  606    HE3  LYS  79           HE3      LYS  79  -6.866 -10.204 -15.784
  607    HZ1  LYS  79           HZ1      LYS  79  -6.136 -12.256 -16.846
  608    HZ2  LYS  79           HZ2      LYS  79  -6.198 -13.072 -15.442
  609    HZ3  LYS  79           HZ3      LYS  79  -7.593 -12.497 -16.119
  610    HA   PRO  80           HA       PRO  80  -8.493  -6.006 -10.524
  611    HB2  PRO  80           HB2      PRO  80 -10.743  -6.786 -11.942
  612    HB3  PRO  80           HB3      PRO  80  -9.783  -5.318 -12.294
  613    HG2  PRO  80           HG2      PRO  80  -9.544  -8.045 -13.601
  614    HG3  PRO  80           HG3      PRO  80  -9.664  -6.441 -14.397
  615    HD2  PRO  80           HD2      PRO  80  -7.268  -7.612 -14.058
  616    HD3  PRO  80           HD3      PRO  80  -7.453  -5.866 -13.753
  617    H    GLY  81           H        GLY  81  -9.486  -6.961  -8.825
  618    HA2  GLY  81           HA2      GLY  81 -10.351  -8.637  -7.433
  619    HA3  GLY  81           HA3      GLY  81 -10.062  -9.858  -8.671
  620    H    SER  82           H        SER  82  -7.342  -7.719  -7.867
  621    HA   SER  82           HA       SER  82  -5.952 -10.019  -6.532
  622    HB2  SER  82           HB2      SER  82  -4.905  -7.595  -8.038
  623    HB3  SER  82           HB3      SER  82  -3.893  -8.623  -7.029
  624    HG   SER  82           HG       SER  82  -5.461  -9.712  -9.128
  625    H    THR  83           H        THR  83  -4.438  -9.328  -4.728
  626    HA   THR  83           HA       THR  83  -5.322  -6.790  -3.398
  627    HB   THR  83           HB       THR  83  -5.163  -7.735  -1.198
  628    HG1  THR  83           HG1      THR  83  -5.185  -9.965  -0.963
  629   HG21  THR  83          HG21      THR  83  -7.233  -9.047  -1.215
  630   HG22  THR  83          HG22      THR  83  -7.350  -7.688  -2.314
  631   HG23  THR  83          HG23      THR  83  -7.079  -9.325  -2.958
  632    H    VAL  84           H        VAL  84  -3.914  -5.881  -1.842
  633    HA   VAL  84           HA       VAL  84  -1.013  -6.236  -2.391
  634    HB   VAL  84           HB       VAL  84  -0.818  -3.758  -2.654
  635   HG11  VAL  84          HG11      VAL  84  -1.353  -3.766  -5.024
  636   HG12  VAL  84          HG12      VAL  84  -0.640  -5.312  -4.546
  637   HG13  VAL  84          HG13      VAL  84  -2.391  -5.193  -4.823
  638   HG21  VAL  84          HG21      VAL  84  -3.057  -3.089  -1.785
  639   HG22  VAL  84          HG22      VAL  84  -2.734  -2.462  -3.408
  640   HG23  VAL  84          HG23      VAL  84  -3.817  -3.844  -3.204
  641    H    ILE  85           H        ILE  85   0.365  -5.042  -0.969
  642    HA   ILE  85           HA       ILE  85  -0.757  -4.344   1.697
  643    HB   ILE  85           HB       ILE  85   1.241  -4.998   2.794
  644   HG12  ILE  85          HG12      ILE  85   3.026  -4.620   1.320
  645   HG13  ILE  85          HG13      ILE  85   3.031  -6.327   1.726
  646   HG21  ILE  85          HG21      ILE  85   0.297  -7.322   1.092
  647   HG22  ILE  85          HG22      ILE  85   1.111  -7.397   2.667
  648   HG23  ILE  85          HG23      ILE  85  -0.508  -6.689   2.544
  649   HD11  ILE  85          HD11      ILE  85   3.618  -6.063  -0.556
  650   HD12  ILE  85          HD12      ILE  85   2.036  -6.859  -0.494
  651   HD13  ILE  85          HD13      ILE  85   2.176  -5.129  -0.919
  652    H    ALA  86           H        ALA  86   0.325  -2.681   2.881
  653    HA   ALA  86           HA       ALA  86   0.949  -0.443   1.227
  654    HB1  ALA  86           HB1      ALA  86   1.311  -0.722   4.239
  655    HB2  ALA  86           HB2      ALA  86   1.097   0.784   3.319
  656    HB3  ALA  86           HB3      ALA  86  -0.236  -0.381   3.448
  657    H    GLY  87           H        GLY  87   2.832   0.774   1.020
  658    HA2  GLY  87           HA2      GLY  87   5.095   1.342   1.177
  659    HA3  GLY  87           HA3      GLY  87   5.385  -0.049   2.227
  660    H    SER  88           H        SER  88   3.805  -1.320  -0.378
  661    HA   SER  88           HA       SER  88   6.257  -2.291  -1.697
  662    HB2  SER  88           HB2      SER  88   4.751  -3.750  -2.946
  663    HB3  SER  88           HB3      SER  88   4.480  -3.904  -1.210
  664    HG   SER  88           HG       SER  88   2.532  -2.905  -1.412
  665    H    ILE  89           H        ILE  89   6.481  -2.175  -4.040
  666    HA   ILE  89           HA       ILE  89   5.756   0.577  -4.962
  667    HB   ILE  89           HB       ILE  89   8.022  -0.976  -6.160
  668   HG12  ILE  89          HG12      ILE  89   8.542  -1.197  -3.790
  669   HG13  ILE  89          HG13      ILE  89   9.650  -0.120  -4.604
  670   HG21  ILE  89          HG21      ILE  89   7.466   1.988  -5.689
  671   HG22  ILE  89          HG22      ILE  89   8.938   1.335  -6.424
  672   HG23  ILE  89          HG23      ILE  89   7.378   1.118  -7.225
  673   HD11  ILE  89          HD11      ILE  89   7.316   0.847  -2.897
  674   HD12  ILE  89          HD12      ILE  89   8.983   0.673  -2.336
  675   HD13  ILE  89          HD13      ILE  89   8.609   1.843  -3.610
  676    H    ASN  90           H        ASN  90   4.869   0.988  -6.943
  677    HA   ASN  90           HA       ASN  90   3.682  -1.268  -8.422
  678    HB2  ASN  90           HB2      ASN  90   2.010   0.280  -8.129
  679    HB3  ASN  90           HB3      ASN  90   3.103   1.635  -7.986
  680   HD21  ASN  90          HD22      ASN  90   0.540   0.828  -9.888
  681   HD22  ASN  90          HD21      ASN  90   1.220   1.387 -11.413
  682    H    GLN  91           H        GLN  91   3.839  -1.621 -10.612
  683    HA   GLN  91           HA       GLN  91   5.743   0.014 -12.193
  684    HB2  GLN  91           HB2      GLN  91   6.436  -2.471 -11.566
  685    HB3  GLN  91           HB3      GLN  91   5.218  -2.900 -12.775
  686    HG2  GLN  91           HG2      GLN  91   7.309  -2.887 -13.890
  687    HG3  GLN  91           HG3      GLN  91   6.479  -1.427 -14.433
  688   HE21  GLN  91          HE22      GLN  91   7.377   0.697 -13.675
  689   HE22  GLN  91          HE21      GLN  91   8.898   0.727 -12.812
  690    H    ASN  92           H        ASN  92   4.807   0.950 -13.795
  691    HA   ASN  92           HA       ASN  92   3.171   1.831 -15.158
  692    HB2  ASN  92           HB2      ASN  92   4.334   0.027 -16.446
  693    HB3  ASN  92           HB3      ASN  92   3.010  -1.071 -16.045
  694   HD21  ASN  92          HD22      ASN  92   1.405  -1.148 -17.584
  695   HD22  ASN  92          HD21      ASN  92   0.928   0.231 -18.573
  696    H    GLY  93           H        GLY  93   0.577   0.227 -16.018
  697    HA2  GLY  93           HA2      GLY  93  -1.046  -1.149 -14.924
  698    HA3  GLY  93           HA3      GLY  93  -0.463  -0.506 -13.385
  699    H    SER  94           H        SER  94  -0.622   2.119 -13.485
  700    HA   SER  94           HA       SER  94  -2.144   3.670 -12.839
  701    HB2  SER  94           HB2      SER  94  -3.290   3.172 -15.626
  702    HB3  SER  94           HB3      SER  94  -3.662   4.566 -14.599
  703    HG   SER  94           HG       SER  94  -2.005   5.445 -15.422
  704    H    LEU  95           H        LEU  95  -3.017   2.480 -11.148
  705    HA   LEU  95           HA       LEU  95  -5.446   0.815 -11.702
  706    HB2  LEU  95           HB2      LEU  95  -3.787   0.513  -9.261
  707    HB3  LEU  95           HB3      LEU  95  -4.773  -0.678 -10.034
  708    HG   LEU  95           HG       LEU  95  -2.081   0.311 -11.111
  709   HD11  LEU  95          HD11      LEU  95  -1.929  -0.651  -8.803
  710   HD12  LEU  95          HD12      LEU  95  -2.611  -2.165  -9.446
  711   HD13  LEU  95          HD13      LEU  95  -1.058  -1.534 -10.040
  712   HD21  LEU  95          HD21      LEU  95  -3.492  -0.774 -12.768
  713   HD22  LEU  95          HD22      LEU  95  -2.186  -1.880 -12.315
  714   HD23  LEU  95          HD23      LEU  95  -3.812  -2.132 -11.658
  715    H    LEU  96           H        LEU  96  -6.994   0.564  -9.936
  716    HA   LEU  96           HA       LEU  96  -7.072   2.822  -7.982
  717    HB2  LEU  96           HB2      LEU  96  -9.427   1.612  -9.471
  718    HB3  LEU  96           HB3      LEU  96  -9.562   2.519  -7.974
  719    HG   LEU  96           HG       LEU  96  -8.260   4.423  -9.210
  720   HD11  LEU  96          HD11      LEU  96  -7.694   3.229 -11.305
  721   HD12  LEU  96          HD12      LEU  96  -9.411   2.887 -11.589
  722   HD13  LEU  96          HD13      LEU  96  -8.804   4.552 -11.639
  723   HD21  LEU  96          HD21      LEU  96 -10.387   5.332 -10.056
  724   HD22  LEU  96          HD22      LEU  96 -11.133   3.726  -9.934
  725   HD23  LEU  96          HD23      LEU  96 -10.596   4.578  -8.469
  726    H    ILE  97           H        ILE  97  -7.013   2.279  -5.971
  727    HA   ILE  97           HA       ILE  97  -7.209  -0.585  -5.190
  728    HB   ILE  97           HB       ILE  97  -5.723   1.592  -3.705
  729   HG12  ILE  97          HG12      ILE  97  -4.779   1.739  -5.926
  730   HG13  ILE  97          HG13      ILE  97  -3.643   1.059  -4.785
  731   HG21  ILE  97          HG21      ILE  97  -6.072  -0.484  -2.477
  732   HG22  ILE  97          HG22      ILE  97  -5.417  -1.438  -3.820
  733   HG23  ILE  97          HG23      ILE  97  -4.364  -0.338  -2.908
  734   HD11  ILE  97          HD11      ILE  97  -5.294  -0.633  -6.707
  735   HD12  ILE  97          HD12      ILE  97  -3.647  -0.063  -7.013
  736   HD13  ILE  97          HD13      ILE  97  -3.954  -1.160  -5.660
  737    H    CYS  98           H        CYS  98  -8.772  -1.186  -3.789
  738    HA   CYS  98           HA       CYS  98 -10.357   0.851  -2.309
  739    HB2  CYS  98           HB2      CYS  98 -10.783  -2.138  -2.661
  740    HB3  CYS  98           HB3      CYS  98 -11.916  -0.999  -1.914
  741    HG   CYS  98           HG       CYS  98 -12.311   0.472  -4.035
  742    H    ALA  99           H        ALA  99  -9.436   1.463  -0.479
  743    HA   ALA  99           HA       ALA  99  -7.549  -0.232   0.988
  744    HB1  ALA  99           HB1      ALA  99  -8.616   2.578   1.506
  745    HB2  ALA  99           HB2      ALA  99  -7.279   1.797   2.372
  746    HB3  ALA  99           HB3      ALA  99  -7.121   2.161   0.636
  747    H    THR 100           H        THR 100  -7.973  -1.469   2.673
  748    HA   THR 100           HA       THR 100 -10.514  -1.081   4.243
  749    HB   THR 100           HB       THR 100 -10.257  -3.730   4.491
  750    HG1  THR 100           HG1      THR 100  -8.549  -4.254   3.259
  751   HG21  THR 100          HG21      THR 100 -11.310  -2.337   1.995
  752   HG22  THR 100          HG22      THR 100 -11.747  -3.973   2.547
  753   HG23  THR 100          HG23      THR 100 -12.183  -2.566   3.525
  754    H    HIS 101           H        HIS 101  -7.317  -0.687   4.789
  755    HA   HIS 101           HA       HIS 101  -7.919  -0.881   7.684
  756    HB2  HIS 101           HB2      HIS 101  -5.418  -1.926   6.301
  757    HB3  HIS 101           HB3      HIS 101  -5.560  -1.685   8.036
  758    HD1  HIS 101           HD1      HIS 101  -5.961  -4.371   5.611
  759    HD2  HIS 101           HD2      HIS 101  -7.885  -3.094   9.128
  760    HE1  HIS 101           HE1      HIS 101  -7.337  -6.351   6.426
  761    H    VAL 102           H        VAL 102  -6.983   0.699   8.940
  762    HA   VAL 102           HA       VAL 102  -5.706   2.991   7.562
  763    HB   VAL 102           HB       VAL 102  -7.622   3.121   9.300
  764   HG11  VAL 102          HG11      VAL 102  -6.503   1.766  11.072
  765   HG12  VAL 102          HG12      VAL 102  -5.293   3.058  11.260
  766   HG13  VAL 102          HG13      VAL 102  -6.998   3.379  11.606
  767   HG21  VAL 102          HG21      VAL 102  -6.900   5.308  10.039
  768   HG22  VAL 102          HG22      VAL 102  -5.226   4.966   9.578
  769   HG23  VAL 102          HG23      VAL 102  -6.496   5.066   8.336
  770    H    GLY 103           H        GLY 103  -3.653   4.001   8.907
  771    HA2  GLY 103           HA2      GLY 103  -1.610   2.105   8.274
  772    HA3  GLY 103           HA3      GLY 103  -1.414   3.674   9.026
  773    H    ALA 104           H        ALA 104  -2.871   3.300  11.421
  774    HA   ALA 104           HA       ALA 104  -1.087   1.974  13.157
  775    HB1  ALA 104           HB1      ALA 104  -2.910   2.282  14.808
  776    HB2  ALA 104           HB2      ALA 104  -2.696   3.733  13.811
  777    HB3  ALA 104           HB3      ALA 104  -4.054   2.631  13.498
  778    H    ASP 105           H        ASP 105  -3.800   0.657  11.346
  779    HA   ASP 105           HA       ASP 105  -3.946  -1.865  12.842
  780    HB2  ASP 105           HB2      ASP 105  -5.856  -0.598  11.607
  781    HB3  ASP 105           HB3      ASP 105  -5.196  -1.320  10.146
  782    H    THR 106           H        THR 106  -1.772  -0.661  10.422
  783    HA   THR 106           HA       THR 106  -1.846  -2.994   8.705
  784    HB   THR 106           HB       THR 106   0.124  -2.124   7.588
  785    HG1  THR 106           HG1      THR 106   0.062  -0.010   9.448
  786   HG21  THR 106          HG21      THR 106  -2.015  -0.050   8.074
  787   HG22  THR 106          HG22      THR 106  -0.785   0.026   6.791
  788   HG23  THR 106          HG23      THR 106  -1.977  -1.291   6.816
  789    H    THR 107           H        THR 107  -0.142  -4.417   8.199
  790    HA   THR 107           HA       THR 107   1.035  -5.689  10.485
  791    HB   THR 107           HB       THR 107   0.317  -6.725   8.287
  792    HG1  THR 107           HG1      THR 107   1.374  -7.841   9.857
  793   HG21  THR 107          HG21      THR 107   3.130  -5.999   7.378
  794   HG22  THR 107          HG22      THR 107   1.959  -7.039   6.543
  795   HG23  THR 107          HG23      THR 107   1.618  -5.314   6.716
  796    H    LEU 108           H        LEU 108   2.295  -3.199   8.292
  797    HA   LEU 108           HA       LEU 108   5.067  -3.389   8.860
  798    HB2  LEU 108           HB2      LEU 108   3.320  -0.932   8.331
  799    HB3  LEU 108           HB3      LEU 108   5.068  -0.891   8.456
  800    HG   LEU 108           HG       LEU 108   5.234  -2.389   6.438
  801   HD11  LEU 108          HD11      LEU 108   2.247  -1.823   6.331
  802   HD12  LEU 108          HD12      LEU 108   3.219  -2.406   4.951
  803   HD13  LEU 108          HD13      LEU 108   3.046  -3.433   6.361
  804   HD21  LEU 108          HD21      LEU 108   5.429   0.081   6.393
  805   HD22  LEU 108          HD22      LEU 108   4.675  -0.536   4.906
  806   HD23  LEU 108          HD23      LEU 108   3.668   0.207   6.175
  807    H    SER 109           H        SER 109   2.602  -1.348  10.460
  808    HA   SER 109           HA       SER 109   4.363  -0.391  12.506
  809    HB2  SER 109           HB2      SER 109   2.237   0.509  13.495
  810    HB3  SER 109           HB3      SER 109   2.534   0.958  11.810
  811    HG   SER 109           HG       SER 109   0.496   0.308  11.753
  812    H    GLN 110           H        GLN 110   2.388  -3.247  12.234
  813    HA   GLN 110           HA       GLN 110   2.563  -3.977  15.061
  814    HB2  GLN 110           HB2      GLN 110   0.781  -4.843  13.513
  815    HB3  GLN 110           HB3      GLN 110   1.990  -5.818  12.717
  816    HG2  GLN 110           HG2      GLN 110   0.987  -7.278  14.248
  817    HG3  GLN 110           HG3      GLN 110   2.517  -6.872  15.007
  818   HE21  GLN 110          HE22      GLN 110  -0.944  -6.157  14.932
  819   HE22  GLN 110          HE21      GLN 110  -0.974  -5.335  16.495
  820    H    ILE 111           H        ILE 111   4.504  -4.897  12.157
  821    HA   ILE 111           HA       ILE 111   6.102  -6.870  13.384
  822    HB   ILE 111           HB       ILE 111   6.691  -4.912  11.144
  823   HG12  ILE 111          HG12      ILE 111   6.270  -7.928  10.972
  824   HG13  ILE 111          HG13      ILE 111   4.908  -6.826  10.998
  825   HG21  ILE 111          HG21      ILE 111   8.414  -7.271  12.038
  826   HG22  ILE 111          HG22      ILE 111   8.615  -6.394  10.510
  827   HG23  ILE 111          HG23      ILE 111   8.893  -5.557  12.030
  828   HD11  ILE 111          HD11      ILE 111   7.095  -6.880   8.885
  829   HD12  ILE 111          HD12      ILE 111   5.391  -7.334   8.708
  830   HD13  ILE 111          HD13      ILE 111   5.818  -5.641   8.992
  831    H    VAL 112           H        VAL 112   6.904  -3.365  13.124
  832    HA   VAL 112           HA       VAL 112   9.173  -3.527  14.808
  833    HB   VAL 112           HB       VAL 112   9.133  -1.139  14.978
  834   HG11  VAL 112          HG11      VAL 112   8.078  -1.905  12.226
  835   HG12  VAL 112          HG12      VAL 112   9.163  -0.563  12.633
  836   HG13  VAL 112          HG13      VAL 112   9.726  -2.237  12.789
  837   HG21  VAL 112          HG21      VAL 112   6.757  -0.679  15.432
  838   HG22  VAL 112          HG22      VAL 112   7.361   0.252  14.056
  839   HG23  VAL 112          HG23      VAL 112   6.341  -1.172  13.770
  840    H    LYS 113           H        LYS 113   5.816  -3.447  15.776
  841    HA   LYS 113           HA       LYS 113   6.374  -2.875  18.601
  842    HB2  LYS 113           HB2      LYS 113   3.924  -3.959  17.155
  843    HB3  LYS 113           HB3      LYS 113   4.031  -3.827  18.905
  844    HG2  LYS 113           HG2      LYS 113   4.204  -1.446  18.840
  845    HG3  LYS 113           HG3      LYS 113   4.505  -1.435  17.109
  846    HD2  LYS 113           HD2      LYS 113   2.243  -0.684  17.597
  847    HD3  LYS 113           HD3      LYS 113   2.234  -2.159  16.611
  848    HE2  LYS 113           HE2      LYS 113   1.765  -3.542  18.507
  849    HE3  LYS 113           HE3      LYS 113   2.032  -2.187  19.624
  850    HZ1  LYS 113           HZ1      LYS 113  -0.338  -2.604  19.265
  851    HZ2  LYS 113           HZ2      LYS 113   0.073  -1.105  18.683
  852    HZ3  LYS 113           HZ3      LYS 113  -0.204  -2.342  17.656
  853    H    LEU 114           H        LEU 114   5.904  -5.856  16.632
  854    HA   LEU 114           HA       LEU 114   5.867  -7.638  18.893
  855    HB2  LEU 114           HB2      LEU 114   5.991  -7.825  15.877
  856    HB3  LEU 114           HB3      LEU 114   6.352  -9.270  16.813
  857    HG   LEU 114           HG       LEU 114   3.796  -7.664  16.963
  858   HD11  LEU 114          HD11      LEU 114   4.104  -8.777  14.773
  859   HD12  LEU 114          HD12      LEU 114   4.376 -10.328  15.597
  860   HD13  LEU 114          HD13      LEU 114   2.793  -9.530  15.697
  861   HD21  LEU 114          HD21      LEU 114   4.188  -8.951  19.051
  862   HD22  LEU 114          HD22      LEU 114   2.901  -9.714  18.116
  863   HD23  LEU 114          HD23      LEU 114   4.536 -10.411  18.101
  864    H    VAL 115           H        VAL 115   8.438  -6.625  16.661
  865    HA   VAL 115           HA       VAL 115  10.435  -8.453  17.702
  866    HB   VAL 115           HB       VAL 115  10.727  -5.804  16.251
  867   HG11  VAL 115          HG11      VAL 115  12.871  -7.889  16.891
  868   HG12  VAL 115          HG12      VAL 115  13.071  -6.515  15.784
  869   HG13  VAL 115          HG13      VAL 115  12.816  -6.219  17.503
  870   HG21  VAL 115          HG21      VAL 115   9.691  -7.631  14.917
  871   HG22  VAL 115          HG22      VAL 115  11.302  -7.227  14.319
  872   HG23  VAL 115          HG23      VAL 115  11.062  -8.688  15.302
  873    H    GLU 116           H        GLU 116  10.063  -4.927  18.382
  874    HA   GLU 116           HA       GLU 116  11.751  -4.903  20.553
  875    HB2  GLU 116           HB2      GLU 116  10.252  -3.069  19.140
  876    HB3  GLU 116           HB3      GLU 116   9.489  -2.967  20.697
  877    HG2  GLU 116           HG2      GLU 116  12.492  -2.680  20.179
  878    HG3  GLU 116           HG3      GLU 116  11.362  -1.337  20.327
  879    H    GLU 117           H        GLU 117   8.442  -6.088  20.689
  880    HA   GLU 117           HA       GLU 117   8.345  -5.971  23.642
  881    HB2  GLU 117           HB2      GLU 117   6.541  -7.319  21.602
  882    HB3  GLU 117           HB3      GLU 117   6.368  -7.510  23.346
  883    HG2  GLU 117           HG2      GLU 117   6.572  -4.694  22.890
  884    HG3  GLU 117           HG3      GLU 117   5.480  -5.324  21.663
  885    H    ALA 118           H        ALA 118   9.616  -8.181  21.207
  886    HA   ALA 118           HA       ALA 118   9.686 -10.463  23.002
  887    HB1  ALA 118           HB1      ALA 118  11.143  -9.975  20.378
  888    HB2  ALA 118           HB2      ALA 118  10.997 -11.524  21.239
  889    HB3  ALA 118           HB3      ALA 118   9.554 -10.725  20.586
  890    H    GLN 119           H        GLN 119  12.427  -8.367  21.781
  891    HA   GLN 119           HA       GLN 119  14.212  -9.107  23.832
  892    HB2  GLN 119           HB2      GLN 119  14.041  -6.683  21.990
  893    HB3  GLN 119           HB3      GLN 119  15.382  -6.990  23.055
  894    HG2  GLN 119           HG2      GLN 119  16.349  -8.100  21.384
  895    HG3  GLN 119           HG3      GLN 119  15.227  -9.422  21.778
  896   HE21  GLN 119          HE22      GLN 119  13.413  -9.768  20.440
  897   HE22  GLN 119          HE21      GLN 119  12.914  -8.510  19.338
  Start of MODEL   12
    1    H    SER   1           H        SER   1  17.937  -5.514  14.986
    2    HA   SER   1           HA       SER   1  16.516  -3.190  16.193
    3    HB2  SER   1           HB2      SER   1  19.432  -4.026  16.303
    4    HB3  SER   1           HB3      SER   1  18.711  -2.645  17.155
    5    HG   SER   1           HG       SER   1  17.350  -4.072  18.254
    6    H    GLU   2           H        GLU   2  18.543  -4.021  13.408
    7    HA   GLU   2           HA       GLU   2  18.748  -1.234  12.492
    8    HB2  GLU   2           HB2      GLU   2  20.396  -2.932  11.792
    9    HB3  GLU   2           HB3      GLU   2  19.116  -3.866  10.996
   10    HG2  GLU   2           HG2      GLU   2  18.678  -1.986   9.454
   11    HG3  GLU   2           HG3      GLU   2  19.845  -0.989  10.316
   12    H    ALA   3           H        ALA   3  16.726  -4.054  11.667
   13    HA   ALA   3           HA       ALA   3  15.305  -2.778   9.569
   14    HB1  ALA   3           HB1      ALA   3  14.584  -5.257  11.195
   15    HB2  ALA   3           HB2      ALA   3  13.946  -4.831   9.593
   16    HB3  ALA   3           HB3      ALA   3  15.666  -5.214   9.784
   17    H    LEU   4           H        LEU   4  14.739  -2.284  12.935
   18    HA   LEU   4           HA       LEU   4  11.870  -2.451  12.940
   19    HB2  LEU   4           HB2      LEU   4  13.467  -2.706  14.909
   20    HB3  LEU   4           HB3      LEU   4  13.725  -0.977  14.851
   21    HG   LEU   4           HG       LEU   4  11.217  -0.688  15.261
   22   HD11  LEU   4          HD11      LEU   4  11.502  -3.635  15.973
   23   HD12  LEU   4          HD12      LEU   4  10.080  -2.614  16.298
   24   HD13  LEU   4          HD13      LEU   4  10.536  -2.996  14.627
   25   HD21  LEU   4          HD21      LEU   4  12.938  -0.391  17.004
   26   HD22  LEU   4          HD22      LEU   4  11.462  -1.109  17.660
   27   HD23  LEU   4          HD23      LEU   4  12.885  -2.131  17.364
   28    H    ALA   5           H        ALA   5  14.028   0.305  12.075
   29    HA   ALA   5           HA       ALA   5  11.801   2.209  12.126
   30    HB1  ALA   5           HB1      ALA   5  14.683   2.408  11.169
   31    HB2  ALA   5           HB2      ALA   5  13.511   3.742  11.253
   32    HB3  ALA   5           HB3      ALA   5  14.051   2.951  12.744
   33    H    LYS   6           H        LYS   6  13.019  -0.278   9.966
   34    HA   LYS   6           HA       LYS   6  12.783   1.225   7.496
   35    HB2  LYS   6           HB2      LYS   6  14.329  -0.700   7.931
   36    HB3  LYS   6           HB3      LYS   6  12.936  -1.791   7.911
   37    HG2  LYS   6           HG2      LYS   6  12.467  -1.269   5.590
   38    HG3  LYS   6           HG3      LYS   6  13.650   0.053   5.598
   39    HD2  LYS   6           HD2      LYS   6  15.467  -1.569   6.047
   40    HD3  LYS   6           HD3      LYS   6  14.298  -2.906   5.969
   41    HE2  LYS   6           HE2      LYS   6  13.775  -2.312   3.631
   42    HE3  LYS   6           HE3      LYS   6  14.857  -0.916   3.723
   43    HZ1  LYS   6           HZ1      LYS   6  15.867  -2.902   2.681
   44    HZ2  LYS   6           HZ2      LYS   6  16.727  -2.389   3.978
   45    HZ3  LYS   6           HZ3      LYS   6  15.782  -3.716   4.110
   46    H    LEU   7           H        LEU   7  10.732  -1.138   9.186
   47    HA   LEU   7           HA       LEU   7   8.636  -1.360   7.304
   48    HB2  LEU   7           HB2      LEU   7   8.767  -1.531  10.322
   49    HB3  LEU   7           HB3      LEU   7   7.239  -1.723   9.488
   50    HG   LEU   7           HG       LEU   7   8.207  -3.854  10.103
   51   HD11  LEU   7          HD11      LEU   7   6.786  -3.700   8.054
   52   HD12  LEU   7          HD12      LEU   7   8.250  -3.516   7.065
   53   HD13  LEU   7          HD13      LEU   7   7.969  -5.013   7.965
   54   HD21  LEU   7          HD21      LEU   7  10.595  -3.352   9.945
   55   HD22  LEU   7          HD22      LEU   7  10.156  -4.802   9.031
   56   HD23  LEU   7          HD23      LEU   7  10.471  -3.291   8.166
   57    H    ILE   8           H        ILE   8   8.978   1.143   9.885
   58    HA   ILE   8           HA       ILE   8   6.539   2.489   9.041
   59    HB   ILE   8           HB       ILE   8   8.815   3.479  10.775
   60   HG12  ILE   8          HG12      ILE   8   7.661   1.530  11.729
   61   HG13  ILE   8          HG13      ILE   8   7.374   2.986  12.664
   62   HG21  ILE   8          HG21      ILE   8   6.085   4.696  10.163
   63   HG22  ILE   8          HG22      ILE   8   7.078   5.157  11.568
   64   HG23  ILE   8          HG23      ILE   8   7.687   5.424   9.935
   65   HD11  ILE   8          HD11      ILE   8   5.093   3.171  11.656
   66   HD12  ILE   8          HD12      ILE   8   5.390   1.664  10.751
   67   HD13  ILE   8          HD13      ILE   8   5.336   1.652  12.519
   68    H    SER   9           H        SER   9   9.884   2.677   7.989
   69    HA   SER   9           HA       SER   9   9.609   5.279   6.657
   70    HB2  SER   9           HB2      SER   9  11.828   3.207   6.453
   71    HB3  SER   9           HB3      SER   9  11.887   4.905   5.949
   72    HG   SER   9           HG       SER   9  11.757   3.810   8.558
   73    H    LEU  10           H        LEU  10   9.151   1.933   5.850
   74    HA   LEU  10           HA       LEU  10   9.126   2.062   3.008
   75    HB2  LEU  10           HB2      LEU  10   8.214   0.220   5.178
   76    HB3  LEU  10           HB3      LEU  10   7.408   0.015   3.643
   77    HG   LEU  10           HG       LEU  10  10.437   0.183   3.724
   78   HD11  LEU  10          HD11      LEU  10   8.748  -2.303   4.201
   79   HD12  LEU  10          HD12      LEU  10  10.493  -2.272   3.858
   80   HD13  LEU  10          HD13      LEU  10   9.879  -1.550   5.350
   81   HD21  LEU  10          HD21      LEU  10   9.204   0.227   1.526
   82   HD22  LEU  10          HD22      LEU  10  10.228  -1.204   1.707
   83   HD23  LEU  10          HD23      LEU  10   8.476  -1.342   1.943
   84    H    GLN  11           H        GLN  11   6.553   2.931   5.346
   85    HA   GLN  11           HA       GLN  11   4.407   2.968   3.472
   86    HB2  GLN  11           HB2      GLN  11   4.878   4.768   5.896
   87    HB3  GLN  11           HB3      GLN  11   3.425   4.780   4.903
   88    HG2  GLN  11           HG2      GLN  11   3.087   2.355   5.411
   89    HG3  GLN  11           HG3      GLN  11   4.433   2.427   6.563
   90   HE21  GLN  11          HE22      GLN  11   1.137   3.524   5.835
   91   HE22  GLN  11          HE21      GLN  11   0.889   4.242   7.423
   92    H    ALA  12           H        ALA  12   3.839   4.174   1.827
   93    HA   ALA  12           HA       ALA  12   5.408   6.434   0.896
   94    HB1  ALA  12           HB1      ALA  12   3.771   6.527  -0.873
   95    HB2  ALA  12           HB2      ALA  12   4.110   4.810  -0.531
   96    HB3  ALA  12           HB3      ALA  12   2.619   5.548   0.057
   97    H    THR  13           H        THR  13   4.842   8.639   0.996
   98    HA   THR  13           HA       THR  13   3.540   9.407   3.488
   99    HB   THR  13           HB       THR  13   4.129  11.739   2.650
  100    HG1  THR  13           HG1      THR  13   5.231  11.951   0.881
  101   HG21  THR  13          HG21      THR  13   6.561  11.458   2.978
  102   HG22  THR  13          HG22      THR  13   5.652  10.518   4.168
  103   HG23  THR  13          HG23      THR  13   6.401   9.699   2.779
  104    H    GLU  14           H        GLU  14   2.467   9.267   0.209
  105    HA   GLU  14           HA       GLU  14   0.013  10.815   0.866
  106    HB2  GLU  14           HB2      GLU  14   0.199  11.931  -1.303
  107    HB3  GLU  14           HB3      GLU  14   1.525  12.334  -0.224
  108    HG2  GLU  14           HG2      GLU  14   3.073  10.949  -1.467
  109    HG3  GLU  14           HG3      GLU  14   1.747  10.199  -2.369
  110    H    ALA  15           H        ALA  15  -1.775  10.637  -0.594
  111    HA   ALA  15           HA       ALA  15  -1.995   8.204  -2.241
  112    HB1  ALA  15           HB1      ALA  15  -3.911   8.844   0.049
  113    HB2  ALA  15           HB2      ALA  15  -3.976   7.440  -1.033
  114    HB3  ALA  15           HB3      ALA  15  -2.648   7.612   0.130
  115    H    THR  16           H        THR  16  -4.101   8.164  -3.322
  116    HA   THR  16           HA       THR  16  -5.351  10.836  -3.920
  117    HB   THR  16           HB       THR  16  -4.912   8.665  -5.988
  118    HG1  THR  16           HG1      THR  16  -2.976   9.441  -5.395
  119   HG21  THR  16          HG21      THR  16  -6.760  10.191  -6.539
  120   HG22  THR  16          HG22      THR  16  -5.732  11.598  -6.203
  121   HG23  THR  16          HG23      THR  16  -5.365  10.523  -7.574
  122    H    ILE  17           H        ILE  17  -7.339  10.750  -3.001
  123    HA   ILE  17           HA       ILE  17  -8.925   8.252  -2.889
  124    HB   ILE  17           HB       ILE  17  -9.519  11.055  -1.847
  125   HG12  ILE  17          HG12      ILE  17  -8.580   8.575  -0.391
  126   HG13  ILE  17          HG13      ILE  17  -7.610  10.014  -0.692
  127   HG21  ILE  17          HG21      ILE  17 -10.981   8.413  -1.344
  128   HG22  ILE  17          HG22      ILE  17 -11.381   9.983  -0.612
  129   HG23  ILE  17          HG23      ILE  17 -11.601   9.757  -2.331
  130   HD11  ILE  17          HD11      ILE  17 -10.004   9.770   1.154
  131   HD12  ILE  17          HD12      ILE  17  -8.325  10.068   1.586
  132   HD13  ILE  17          HD13      ILE  17  -9.240  11.322   0.719
  133    H    VAL  18           H        VAL  18 -10.561   7.741  -4.338
  134    HA   VAL  18           HA       VAL  18 -11.347   9.856  -6.293
  135    HB   VAL  18           HB       VAL  18 -11.344   8.272  -8.077
  136   HG11  VAL  18          HG11      VAL  18  -8.632   8.155  -6.701
  137   HG12  VAL  18          HG12      VAL  18  -8.983   8.154  -8.444
  138   HG13  VAL  18          HG13      VAL  18  -9.271   9.609  -7.479
  139   HG21  VAL  18          HG21      VAL  18 -11.707   6.127  -6.923
  140   HG22  VAL  18          HG22      VAL  18 -10.241   6.074  -7.902
  141   HG23  VAL  18          HG23      VAL  18 -10.114   6.259  -6.143
  142    H    THR  19           H        THR  19 -13.349  10.167  -6.678
  143    HA   THR  19           HA       THR  19 -15.450   8.308  -5.592
  144    HB   THR  19           HB       THR  19 -15.374  11.331  -5.251
  145    HG1  THR  19           HG1      THR  19 -13.789  10.677  -4.013
  146   HG21  THR  19          HG21      THR  19 -17.618  10.544  -4.989
  147   HG22  THR  19          HG22      THR  19 -17.094   9.135  -4.024
  148   HG23  THR  19          HG23      THR  19 -16.968  10.782  -3.381
  149    H    LEU  20           H        LEU  20 -17.561   8.428  -6.479
  150    HA   LEU  20           HA       LEU  20 -17.895  10.141  -8.910
  151    HB2  LEU  20           HB2      LEU  20 -19.863   7.986  -8.244
  152    HB3  LEU  20           HB3      LEU  20 -19.482   8.741  -9.776
  153    HG   LEU  20           HG       LEU  20 -17.731   6.697  -8.375
  154   HD11  LEU  20          HD11      LEU  20 -19.426   6.453 -10.895
  155   HD12  LEU  20          HD12      LEU  20 -18.414   5.190 -10.164
  156   HD13  LEU  20          HD13      LEU  20 -19.843   5.775  -9.300
  157   HD21  LEU  20          HD21      LEU  20 -16.384   8.245  -9.774
  158   HD22  LEU  20          HD22      LEU  20 -16.475   6.643 -10.508
  159   HD23  LEU  20          HD23      LEU  20 -17.486   7.958 -11.142
  160    H    ASP  21           H        ASP  21 -19.286  11.772  -8.792
  161    HA   ASP  21           HA       ASP  21 -20.939  12.155  -6.337
  162    HB2  ASP  21           HB2      ASP  21 -18.520  13.476  -7.207
  163    HB3  ASP  21           HB3      ASP  21 -19.827  14.597  -7.452
  164    H    SER  22           H        SER  22 -22.269  13.959  -6.514
  165    HA   SER  22           HA       SER  22 -23.987  15.329  -7.298
  166    HB2  SER  22           HB2      SER  22 -22.460  15.936  -9.176
  167    HB3  SER  22           HB3      SER  22 -23.220  14.679 -10.136
  168    HG   SER  22           HG       SER  22 -24.063  16.879 -10.295
  169    H    ASP  23           H        ASP  23 -23.745  12.626  -9.545
  170    HA   ASP  23           HA       ASP  23 -25.912  11.020  -8.610
  171    HB2  ASP  23           HB2      ASP  23 -27.275  12.764  -9.820
  172    HB3  ASP  23           HB3      ASP  23 -26.372  12.434 -11.293
  173    H    ASN  24           H        ASN  24 -23.321  10.623  -8.830
  174    HA   ASN  24           HA       ASN  24 -21.523   9.616  -9.624
  175    HB2  ASN  24           HB2      ASN  24 -21.574   7.514 -10.667
  176    HB3  ASN  24           HB3      ASN  24 -22.994   7.580  -9.641
  177   HD21  ASN  24          HD22      ASN  24 -22.103   7.889 -13.115
  178   HD22  ASN  24          HD21      ASN  24 -23.682   7.188 -13.481
  179    H    ILE  25           H        ILE  25 -23.321  11.420 -11.909
  180    HA   ILE  25           HA       ILE  25 -21.659  11.306 -14.158
  181    HB   ILE  25           HB       ILE  25 -22.671  13.558 -14.648
  182   HG12  ILE  25          HG12      ILE  25 -24.064  13.244 -11.960
  183   HG13  ILE  25          HG13      ILE  25 -22.830  14.441 -12.370
  184   HG21  ILE  25          HG21      ILE  25 -24.679  11.464 -13.732
  185   HG22  ILE  25          HG22      ILE  25 -24.886  12.651 -15.036
  186   HG23  ILE  25          HG23      ILE  25 -23.720  11.342 -15.221
  187   HD11  ILE  25          HD11      ILE  25 -24.367  15.364 -14.126
  188   HD12  ILE  25          HD12      ILE  25 -25.631  14.253 -13.538
  189   HD13  ILE  25          HD13      ILE  25 -24.980  15.502 -12.466
  190    H    LEU  26           H        LEU  26 -20.865  12.784 -11.126
  191    HA   LEU  26           HA       LEU  26 -18.854  14.604 -12.391
  192    HB2  LEU  26           HB2      LEU  26 -20.530  15.762 -11.138
  193    HB3  LEU  26           HB3      LEU  26 -20.409  14.644  -9.796
  194    HG   LEU  26           HG       LEU  26 -18.228  15.501  -9.150
  195   HD11  LEU  26          HD11      LEU  26 -18.612  17.392 -11.487
  196   HD12  LEU  26          HD12      LEU  26 -17.349  17.528 -10.237
  197   HD13  LEU  26          HD13      LEU  26 -17.343  16.140 -11.338
  198   HD21  LEU  26          HD21      LEU  26 -20.313  16.623  -8.323
  199   HD22  LEU  26          HD22      LEU  26 -18.940  17.729  -8.435
  200   HD23  LEU  26          HD23      LEU  26 -20.214  17.762  -9.677
  201    H    LEU  27           H        LEU  27 -17.048  13.287 -12.679
  202    HA   LEU  27           HA       LEU  27 -16.206  11.473 -10.501
  203    HB2  LEU  27           HB2      LEU  27 -15.201  12.082 -13.284
  204    HB3  LEU  27           HB3      LEU  27 -14.151  11.304 -12.105
  205    HG   LEU  27           HG       LEU  27 -15.720   9.465 -11.817
  206   HD11  LEU  27          HD11      LEU  27 -17.585   9.138 -13.441
  207   HD12  LEU  27          HD12      LEU  27 -17.887  10.476 -12.340
  208   HD13  LEU  27          HD13      LEU  27 -17.363  10.808 -14.011
  209   HD21  LEU  27          HD21      LEU  27 -13.934   9.346 -13.518
  210   HD22  LEU  27          HD22      LEU  27 -15.358   8.410 -13.990
  211   HD23  LEU  27          HD23      LEU  27 -15.057   9.993 -14.738
  212    H    SER  28           H        SER  28 -14.964  12.057  -8.834
  213    HA   SER  28           HA       SER  28 -13.433  14.610  -8.950
  214    HB2  SER  28           HB2      SER  28 -15.653  14.783  -7.776
  215    HB3  SER  28           HB3      SER  28 -15.050  13.616  -6.584
  216    HG   SER  28           HG       SER  28 -13.864  15.114  -5.735
  217    H    GLU  29           H        GLU  29 -11.494  14.686  -7.774
  218    HA   GLU  29           HA       GLU  29 -10.413  12.124  -6.702
  219    HB2  GLU  29           HB2      GLU  29  -9.139  13.752  -8.931
  220    HB3  GLU  29           HB3      GLU  29  -8.433  12.341  -8.146
  221    HG2  GLU  29           HG2      GLU  29 -10.177  10.887  -9.089
  222    HG3  GLU  29           HG3      GLU  29 -11.022  12.272  -9.768
  223    H    GLU  30           H        GLU  30  -9.212  12.538  -4.851
  224    HA   GLU  30           HA       GLU  30  -8.195  15.332  -4.404
  225    HB2  GLU  30           HB2      GLU  30  -9.129  13.609  -2.111
  226    HB3  GLU  30           HB3      GLU  30  -8.861  15.351  -2.192
  227    HG2  GLU  30           HG2      GLU  30 -10.860  15.367  -3.861
  228    HG3  GLU  30           HG3      GLU  30 -11.150  13.712  -3.291
  229    H    GLN  31           H        GLN  31  -6.085  15.548  -3.632
  230    HA   GLN  31           HA       GLN  31  -4.586  12.997  -3.205
  231    HB2  GLN  31           HB2      GLN  31  -3.776  15.618  -4.419
  232    HB3  GLN  31           HB3      GLN  31  -2.591  14.706  -3.492
  233    HG2  GLN  31           HG2      GLN  31  -3.964  12.883  -5.307
  234    HG3  GLN  31           HG3      GLN  31  -3.368  14.278  -6.197
  235   HE21  GLN  31          HE21      GLN  31  -2.184  12.013  -3.593
  236   HE22  GLN  31          HE22      GLN  31  -0.514  12.059  -4.198
  237    H    VAL  32           H        VAL  32  -3.903  12.491  -1.290
  238    HA   VAL  32           HA       VAL  32  -4.065  14.494   0.928
  239    HB   VAL  32           HB       VAL  32  -5.191  12.884   2.295
  240   HG11  VAL  32          HG11      VAL  32  -7.368  12.930   1.308
  241   HG12  VAL  32          HG12      VAL  32  -6.515  14.401   0.821
  242   HG13  VAL  32          HG13      VAL  32  -6.706  13.065  -0.334
  243   HG21  VAL  32          HG21      VAL  32  -4.338  10.761   1.392
  244   HG22  VAL  32          HG22      VAL  32  -6.099  10.773   1.438
  245   HG23  VAL  32          HG23      VAL  32  -5.266  11.014  -0.110
  246    H    ASP  33           H        ASP  33  -3.130  13.789   2.872
  247    HA   ASP  33           HA       ASP  33  -0.515  12.417   2.645
  248    HB2  ASP  33           HB2      ASP  33  -0.975  14.525   4.006
  249    HB3  ASP  33           HB3      ASP  33  -1.854  13.515   5.142
  250    H    VAL  34           H        VAL  34   0.031  10.469   3.823
  251    HA   VAL  34           HA       VAL  34  -1.934   8.399   3.947
  252    HB   VAL  34           HB       VAL  34   0.402   7.953   3.600
  253   HG11  VAL  34          HG11      VAL  34   0.873   8.708   6.515
  254   HG12  VAL  34          HG12      VAL  34   2.055   7.974   5.410
  255   HG13  VAL  34          HG13      VAL  34   1.451   9.603   5.099
  256   HG21  VAL  34          HG21      VAL  34  -0.391   6.600   6.203
  257   HG22  VAL  34          HG22      VAL  34  -1.096   6.191   4.628
  258   HG23  VAL  34          HG23      VAL  34   0.644   5.977   4.906
  259    H    GLU  35           H        GLU  35  -1.057  10.793   6.341
  260    HA   GLU  35           HA       GLU  35  -2.347   9.547   8.607
  261    HB2  GLU  35           HB2      GLU  35  -0.595  11.321   8.586
  262    HB3  GLU  35           HB3      GLU  35  -1.803  12.488   8.042
  263    HG2  GLU  35           HG2      GLU  35  -2.941  12.425  10.124
  264    HG3  GLU  35           HG3      GLU  35  -2.243  10.863  10.562
  265    H    LEU  36           H        LEU  36  -3.716  11.052   5.800
  266    HA   LEU  36           HA       LEU  36  -6.269  11.737   7.187
  267    HB2  LEU  36           HB2      LEU  36  -5.181  12.641   4.509
  268    HB3  LEU  36           HB3      LEU  36  -6.579  13.310   5.342
  269    HG   LEU  36           HG       LEU  36  -3.692  13.493   6.316
  270   HD11  LEU  36          HD11      LEU  36  -5.478  15.611   5.075
  271   HD12  LEU  36          HD12      LEU  36  -3.823  15.844   5.682
  272   HD13  LEU  36          HD13      LEU  36  -4.114  14.817   4.272
  273   HD21  LEU  36          HD21      LEU  36  -6.198  14.832   7.384
  274   HD22  LEU  36          HD22      LEU  36  -5.252  13.560   8.200
  275   HD23  LEU  36          HD23      LEU  36  -4.527  15.141   7.911
  276    H    VAL  37           H        VAL  37  -5.202   9.200   5.367
  277    HA   VAL  37           HA       VAL  37  -7.824   8.693   4.043
  278    HB   VAL  37           HB       VAL  37  -6.063   8.400   2.532
  279   HG11  VAL  37          HG11      VAL  37  -4.670   6.581   4.550
  280   HG12  VAL  37          HG12      VAL  37  -4.162   6.840   2.867
  281   HG13  VAL  37          HG13      VAL  37  -4.129   8.187   4.001
  282   HG21  VAL  37          HG21      VAL  37  -7.775   6.644   2.426
  283   HG22  VAL  37          HG22      VAL  37  -6.195   6.077   1.865
  284   HG23  VAL  37          HG23      VAL  37  -6.783   5.590   3.462
  285    H    GLN  38           H        GLN  38  -9.043   6.919   4.477
  286    HA   GLN  38           HA       GLN  38  -8.667   5.542   7.103
  287    HB2  GLN  38           HB2      GLN  38 -11.089   6.868   5.877
  288    HB3  GLN  38           HB3      GLN  38 -11.245   5.669   7.147
  289    HG2  GLN  38           HG2      GLN  38  -9.856   6.994   8.672
  290    HG3  GLN  38           HG3      GLN  38  -9.616   8.231   7.429
  291   HE21  GLN  38          HE22      GLN  38 -11.779   8.998   6.501
  292   HE22  GLN  38          HE21      GLN  38 -13.089   9.114   7.663
  293    H    ARG  39           H        ARG  39 -10.067   3.683   7.414
  294    HA   ARG  39           HA       ARG  39  -9.297   1.717   5.473
  295    HB2  ARG  39           HB2      ARG  39  -9.828   0.133   7.150
  296    HB3  ARG  39           HB3      ARG  39  -9.207   1.555   7.981
  297    HG2  ARG  39           HG2      ARG  39 -11.803   2.161   8.134
  298    HG3  ARG  39           HG3      ARG  39 -12.006   0.432   7.829
  299    HD2  ARG  39           HD2      ARG  39 -10.761  -0.156   9.809
  300    HD3  ARG  39           HD3      ARG  39 -10.244   1.522  10.049
  301    HE   ARG  39           HE       ARG  39 -12.950   1.775  10.076
  302   HH11  ARG  39          HH11      ARG  39 -10.788  -0.124  12.085
  303   HH12  ARG  39          HH12      ARG  39 -12.019  -0.354  13.322
  304   HH21  ARG  39          HH21      ARG  39 -14.400   1.503  11.639
  305   HH22  ARG  39          HH22      ARG  39 -14.000   0.630  13.099
  306    H    GLY  40           H        GLY  40 -11.640   3.517   4.731
  307    HA2  GLY  40           HA2      GLY  40 -13.100   1.415   3.247
  308    HA3  GLY  40           HA3      GLY  40 -14.024   2.650   4.098
  309    H    ASP  41           H        ASP  41 -11.025   3.912   2.856
  310    HA   ASP  41           HA       ASP  41 -12.455   5.385   0.762
  311    HB2  ASP  41           HB2      ASP  41  -9.578   5.417   1.724
  312    HB3  ASP  41           HB3      ASP  41 -10.182   6.424   0.404
  313    H    ILE  42           H        ILE  42 -11.941   5.436  -1.452
  314    HA   ILE  42           HA       ILE  42 -10.701   2.974  -2.598
  315    HB   ILE  42           HB       ILE  42 -12.505   4.990  -3.945
  316   HG12  ILE  42          HG12      ILE  42 -13.871   3.845  -2.336
  317   HG13  ILE  42          HG13      ILE  42 -14.208   3.231  -3.941
  318   HG21  ILE  42          HG21      ILE  42 -11.378   2.305  -4.861
  319   HG22  ILE  42          HG22      ILE  42 -12.608   3.251  -5.729
  320   HG23  ILE  42          HG23      ILE  42 -10.982   3.907  -5.513
  321   HD11  ILE  42          HD11      ILE  42 -12.548   1.795  -1.836
  322   HD12  ILE  42          HD12      ILE  42 -14.211   1.425  -2.300
  323   HD13  ILE  42          HD13      ILE  42 -12.906   1.185  -3.474
  324    H    ILE  43           H        ILE  43  -8.590   3.262  -3.187
  325    HA   ILE  43           HA       ILE  43  -7.654   5.972  -3.816
  326    HB   ILE  43           HB       ILE  43  -6.166   3.522  -2.812
  327   HG12  ILE  43          HG12      ILE  43  -7.734   4.145  -1.079
  328   HG13  ILE  43          HG13      ILE  43  -6.101   4.546  -0.597
  329   HG21  ILE  43          HG21      ILE  43  -5.302   6.429  -3.043
  330   HG22  ILE  43          HG22      ILE  43  -4.402   5.178  -2.153
  331   HG23  ILE  43          HG23      ILE  43  -4.621   5.033  -3.896
  332   HD11  ILE  43          HD11      ILE  43  -8.154   6.542  -1.642
  333   HD12  ILE  43          HD12      ILE  43  -7.707   6.294   0.043
  334   HD13  ILE  43          HD13      ILE  43  -6.511   6.942  -1.089
  335    H    LYS  44           H        LYS  44  -6.985   6.470  -5.841
  336    HA   LYS  44           HA       LYS  44  -6.120   4.418  -7.770
  337    HB2  LYS  44           HB2      LYS  44  -7.276   6.246  -8.661
  338    HB3  LYS  44           HB3      LYS  44  -6.180   7.426  -7.909
  339    HG2  LYS  44           HG2      LYS  44  -4.364   6.832  -9.303
  340    HG3  LYS  44           HG3      LYS  44  -5.091   5.300  -9.798
  341    HD2  LYS  44           HD2      LYS  44  -6.519   7.848 -10.491
  342    HD3  LYS  44           HD3      LYS  44  -5.039   7.408 -11.388
  343    HE2  LYS  44           HE2      LYS  44  -6.065   5.133 -11.800
  344    HE3  LYS  44           HE3      LYS  44  -7.572   5.762 -11.108
  345    HZ1  LYS  44           HZ1      LYS  44  -6.201   6.716 -13.561
  346    HZ2  LYS  44           HZ2      LYS  44  -7.641   5.949 -13.465
  347    HZ3  LYS  44           HZ3      LYS  44  -7.502   7.494 -12.885
  348    H    VAL  45           H        VAL  45  -4.118   3.558  -7.912
  349    HA   VAL  45           HA       VAL  45  -1.807   5.080  -6.786
  350    HB   VAL  45           HB       VAL  45  -2.320   2.688  -6.065
  351   HG11  VAL  45          HG11      VAL  45  -0.917   1.982  -8.680
  352   HG12  VAL  45          HG12      VAL  45  -1.445   0.877  -7.405
  353   HG13  VAL  45          HG13      VAL  45  -2.648   1.764  -8.363
  354   HG21  VAL  45          HG21      VAL  45   0.472   3.350  -7.123
  355   HG22  VAL  45          HG22      VAL  45  -0.204   3.881  -5.565
  356   HG23  VAL  45          HG23      VAL  45   0.077   2.161  -5.869
  357    H    VAL  46           H        VAL  46  -0.239   5.913  -8.045
  358    HA   VAL  46           HA       VAL  46  -0.648   5.905 -10.913
  359    HB   VAL  46           HB       VAL  46   1.048   7.644 -10.974
  360   HG11  VAL  46          HG11      VAL  46  -0.881   8.098  -8.661
  361   HG12  VAL  46          HG12      VAL  46  -0.155   9.314  -9.721
  362   HG13  VAL  46          HG13      VAL  46  -1.317   8.166 -10.388
  363   HG21  VAL  46          HG21      VAL  46   2.622   6.874  -9.257
  364   HG22  VAL  46          HG22      VAL  46   2.075   8.518  -8.917
  365   HG23  VAL  46          HG23      VAL  46   1.415   7.165  -7.987
  366    HA   PRO  47           HA       PRO  47   2.691   3.223 -12.263
  367    HB2  PRO  47           HB2      PRO  47   3.503   5.413 -14.149
  368    HB3  PRO  47           HB3      PRO  47   3.187   3.697 -14.493
  369    HG2  PRO  47           HG2      PRO  47   1.353   5.588 -15.165
  370    HG3  PRO  47           HG3      PRO  47   0.792   4.066 -14.397
  371    HD2  PRO  47           HD2      PRO  47   1.341   6.727 -13.060
  372    HD3  PRO  47           HD3      PRO  47  -0.113   5.690 -12.944
  373    H    GLY  48           H        GLY  48   4.808   2.934 -11.593
  374    HA2  GLY  48           HA2      GLY  48   6.809   3.300 -10.587
  375    HA3  GLY  48           HA3      GLY  48   6.717   4.995 -11.036
  376    H    GLY  49           H        GLY  49   3.980   4.510  -9.253
  377    HA2  GLY  49           HA2      GLY  49   5.031   5.886  -6.919
  378    HA3  GLY  49           HA3      GLY  49   3.359   5.448  -7.238
  379    H    LYS  50           H        LYS  50   3.938   5.264  -4.781
  380    HA   LYS  50           HA       LYS  50   4.523   2.400  -4.102
  381    HB2  LYS  50           HB2      LYS  50   5.216   4.862  -2.464
  382    HB3  LYS  50           HB3      LYS  50   5.566   3.172  -2.044
  383    HG2  LYS  50           HG2      LYS  50   7.008   3.065  -4.117
  384    HG3  LYS  50           HG3      LYS  50   6.734   4.803  -4.324
  385    HD2  LYS  50           HD2      LYS  50   7.646   5.134  -1.953
  386    HD3  LYS  50           HD3      LYS  50   8.059   3.415  -1.958
  387    HE2  LYS  50           HE2      LYS  50  10.053   4.443  -2.585
  388    HE3  LYS  50           HE3      LYS  50   9.385   3.891  -4.124
  389    HZ1  LYS  50           HZ1      LYS  50   8.621   6.154  -4.530
  390    HZ2  LYS  50           HZ2      LYS  50   9.204   6.642  -3.027
  391    HZ3  LYS  50           HZ3      LYS  50  10.219   6.163  -4.216
  392    H    PHE  51           H        PHE  51   3.419   1.443  -2.465
  393    HA   PHE  51           HA       PHE  51   0.720   2.458  -2.038
  394    HB2  PHE  51           HB2      PHE  51   2.069  -0.110  -1.234
  395    HB3  PHE  51           HB3      PHE  51   0.394   0.270  -0.847
  396    HD1  PHE  51           HD2      PHE  51  -1.294   0.633  -2.691
  397    HD2  PHE  51           HD1      PHE  51   2.662  -0.866  -3.458
  398    HE1  PHE  51           HE2      PHE  51  -2.008  -0.147  -4.934
  399    HE2  PHE  51           HE1      PHE  51   1.951  -1.630  -5.705
  400    HZ   PHE  51           HZ       PHE  51  -0.388  -1.273  -6.452
  401    HA   PRO  52           HA       PRO  52   1.776   4.085   2.079
  402    HB2  PRO  52           HB2      PRO  52  -0.409   5.633   2.497
  403    HB3  PRO  52           HB3      PRO  52   0.797   6.036   1.253
  404    HG2  PRO  52           HG2      PRO  52  -1.879   4.692   0.896
  405    HG3  PRO  52           HG3      PRO  52  -1.125   5.978  -0.094
  406    HD2  PRO  52           HD2      PRO  52  -1.062   3.284  -0.742
  407    HD3  PRO  52           HD3      PRO  52   0.158   4.482  -1.265
  408    H    VAL  53           H        VAL  53  -0.872   1.974   1.446
  409    HA   VAL  53           HA       VAL  53  -1.270   1.091   4.154
  410    HB   VAL  53           HB       VAL  53  -3.704   1.323   4.190
  411   HG11  VAL  53          HG11      VAL  53  -2.364   4.048   4.080
  412   HG12  VAL  53          HG12      VAL  53  -3.830   3.596   4.972
  413   HG13  VAL  53          HG13      VAL  53  -2.269   2.913   5.446
  414   HG21  VAL  53          HG21      VAL  53  -4.843   3.001   2.806
  415   HG22  VAL  53          HG22      VAL  53  -3.358   3.262   1.875
  416   HG23  VAL  53          HG23      VAL  53  -4.180   1.687   1.815
  417    H    ASP  54           H        ASP  54  -2.979  -0.815   4.026
  418    HA   ASP  54           HA       ASP  54  -2.429  -2.296   1.504
  419    HB2  ASP  54           HB2      ASP  54  -2.660  -4.317   2.711
  420    HB3  ASP  54           HB3      ASP  54  -1.527  -3.267   3.556
  421    H    GLY  55           H        GLY  55  -3.986  -3.732   0.596
  422    HA2  GLY  55           HA2      GLY  55  -6.765  -3.719   1.208
  423    HA3  GLY  55           HA3      GLY  55  -6.463  -2.395   0.091
  424    H    ARG  56           H        ARG  56  -8.069  -3.693  -1.012
  425    HA   ARG  56           HA       ARG  56  -6.956  -5.874  -2.754
  426    HB2  ARG  56           HB2      ARG  56  -8.731  -6.646  -1.381
  427    HB3  ARG  56           HB3      ARG  56  -9.749  -5.276  -1.782
  428    HG2  ARG  56           HG2      ARG  56 -10.043  -6.111  -4.080
  429    HG3  ARG  56           HG3      ARG  56  -8.899  -7.429  -3.766
  430    HD2  ARG  56           HD2      ARG  56 -11.205  -8.253  -3.603
  431    HD3  ARG  56           HD3      ARG  56 -10.373  -8.366  -2.058
  432    HE   ARG  56           HE       ARG  56 -11.744  -6.716  -1.135
  433   HH11  ARG  56          HH11      ARG  56 -12.788  -7.142  -4.528
  434   HH12  ARG  56          HH12      ARG  56 -14.069  -5.962  -4.262
  435   HH21  ARG  56          HH21      ARG  56 -13.339  -5.192  -1.086
  436   HH22  ARG  56          HH22      ARG  56 -14.376  -4.991  -2.512
  437    H    VAL  57           H        VAL  57  -7.145  -5.833  -4.932
  438    HA   VAL  57           HA       VAL  57  -7.315  -3.132  -6.176
  439    HB   VAL  57           HB       VAL  57  -6.096  -5.713  -7.255
  440   HG11  VAL  57          HG11      VAL  57  -5.854  -2.817  -8.176
  441   HG12  VAL  57          HG12      VAL  57  -4.961  -4.202  -8.854
  442   HG13  VAL  57          HG13      VAL  57  -6.704  -4.124  -9.031
  443   HG21  VAL  57          HG21      VAL  57  -4.790  -5.046  -5.307
  444   HG22  VAL  57          HG22      VAL  57  -3.890  -4.701  -6.786
  445   HG23  VAL  57          HG23      VAL  57  -4.685  -3.380  -5.909
  446    H    ILE  58           H        ILE  58  -8.996  -2.687  -7.511
  447    HA   ILE  58           HA       ILE  58 -10.447  -4.923  -8.882
  448    HB   ILE  58           HB       ILE  58 -12.619  -3.659  -8.188
  449   HG12  ILE  58          HG12      ILE  58 -10.861  -2.822  -5.845
  450   HG13  ILE  58          HG13      ILE  58 -11.295  -1.714  -7.161
  451   HG21  ILE  58          HG21      ILE  58 -11.167  -5.239  -6.046
  452   HG22  ILE  58          HG22      ILE  58 -12.916  -5.083  -6.304
  453   HG23  ILE  58          HG23      ILE  58 -11.935  -5.948  -7.482
  454   HD11  ILE  58          HD11      ILE  58 -13.238  -3.048  -5.235
  455   HD12  ILE  58          HD12      ILE  58 -12.775  -1.339  -5.286
  456   HD13  ILE  58          HD13      ILE  58 -13.704  -2.037  -6.628
  457    H    GLU  59           H        GLU  59  -8.582  -2.827  -9.829
  458    HA   GLU  59           HA       GLU  59  -9.958  -2.489 -12.330
  459    HB2  GLU  59           HB2      GLU  59 -10.722  -0.448 -10.896
  460    HB3  GLU  59           HB3      GLU  59  -9.033   0.040 -10.910
  461    HG2  GLU  59           HG2      GLU  59 -10.331   1.248 -12.566
  462    HG3  GLU  59           HG3      GLU  59  -9.072   0.280 -13.333
  463    H    GLY  60           H        GLY  60  -8.388  -2.758 -13.878
  464    HA2  GLY  60           HA2      GLY  60  -6.493  -2.093 -15.071
  465    HA3  GLY  60           HA3      GLY  60  -5.848  -1.304 -13.643
  466    H    HIS  61           H        HIS  61  -3.974  -2.283 -14.737
  467    HA   HIS  61           HA       HIS  61  -3.264  -4.942 -13.666
  468    HB2  HIS  61           HB2      HIS  61  -2.738  -5.960 -15.764
  469    HB3  HIS  61           HB3      HIS  61  -4.427  -5.487 -15.741
  470    HD1  HIS  61           HD1      HIS  61  -1.364  -5.161 -17.790
  471    HD2  HIS  61           HD2      HIS  61  -5.036  -3.185 -17.299
  472    HE1  HIS  61           HE1      HIS  61  -1.693  -3.747 -19.886
  473    H    SER  62           H        SER  62  -1.408  -4.698 -12.727
  474    HA   SER  62           HA       SER  62   0.862  -3.372 -14.098
  475    HB2  SER  62           HB2      SER  62  -0.496  -1.802 -12.391
  476    HB3  SER  62           HB3      SER  62   0.536  -2.591 -11.206
  477    HG   SER  62           HG       SER  62   1.295  -0.634 -12.343
  478    H    MET  63           H        MET  63   2.936  -3.709 -12.900
  479    HA   MET  63           HA       MET  63   2.931  -6.270 -11.359
  480    HB2  MET  63           HB2      MET  63   4.109  -6.390 -13.496
  481    HB3  MET  63           HB3      MET  63   5.174  -5.061 -13.007
  482    HG2  MET  63           HG2      MET  63   6.154  -6.314 -11.301
  483    HG3  MET  63           HG3      MET  63   4.880  -7.531 -11.274
  484    HE1  MET  63           HE1      MET  63   4.851  -9.714 -12.552
  485    HE2  MET  63           HE2      MET  63   4.367  -8.723 -13.950
  486    HE3  MET  63           HE3      MET  63   5.645  -9.947 -14.122
  487    H    VAL  64           H        VAL  64   3.896  -6.346  -9.424
  488    HA   VAL  64           HA       VAL  64   4.735  -3.776  -8.166
  489    HB   VAL  64           HB       VAL  64   2.784  -5.845  -7.093
  490   HG11  VAL  64          HG11      VAL  64   3.815  -3.260  -5.869
  491   HG12  VAL  64          HG12      VAL  64   2.435  -4.196  -5.248
  492   HG13  VAL  64          HG13      VAL  64   4.048  -4.906  -5.230
  493   HG21  VAL  64          HG21      VAL  64   1.719  -4.397  -8.773
  494   HG22  VAL  64          HG22      VAL  64   1.169  -3.917  -7.164
  495   HG23  VAL  64          HG23      VAL  64   2.397  -2.957  -8.002
  496    H    ASP  65           H        ASP  65   6.356  -3.774  -6.751
  497    HA   ASP  65           HA       ASP  65   7.839  -6.317  -6.281
  498    HB2  ASP  65           HB2      ASP  65   8.911  -4.400  -7.472
  499    HB3  ASP  65           HB3      ASP  65   8.745  -3.435  -6.003
  500    H    GLU  66           H        GLU  66   7.959  -7.199  -4.314
  501    HA   GLU  66           HA       GLU  66   7.013  -5.700  -1.896
  502    HB2  GLU  66           HB2      GLU  66   6.574  -8.629  -2.263
  503    HB3  GLU  66           HB3      GLU  66   5.635  -7.440  -1.332
  504    HG2  GLU  66           HG2      GLU  66   4.792  -6.610  -3.618
  505    HG3  GLU  66           HG3      GLU  66   5.540  -8.052  -4.303
  506    H    SER  67           H        SER  67   9.829  -6.558  -2.760
  507    HA   SER  67           HA       SER  67  10.917  -8.726  -1.662
  508    HB2  SER  67           HB2      SER  67  13.068  -7.590  -1.685
  509    HB3  SER  67           HB3      SER  67  12.082  -7.138  -3.087
  510    HG   SER  67           HG       SER  67  13.172  -5.392  -1.966
  511    H    LEU  68           H        LEU  68  10.327  -5.945   0.482
  512    HA   LEU  68           HA       LEU  68  11.677  -7.358   2.722
  513    HB2  LEU  68           HB2      LEU  68  12.069  -4.966   2.204
  514    HB3  LEU  68           HB3      LEU  68  10.389  -4.605   2.536
  515    HG   LEU  68           HG       LEU  68  11.970  -3.929   4.290
  516   HD11  LEU  68          HD11      LEU  68  10.725  -4.516   6.184
  517   HD12  LEU  68          HD12      LEU  68   9.559  -4.537   4.849
  518   HD13  LEU  68          HD13      LEU  68  10.198  -6.055   5.516
  519   HD21  LEU  68          HD21      LEU  68  13.571  -5.806   4.104
  520   HD22  LEU  68          HD22      LEU  68  13.070  -5.448   5.769
  521   HD23  LEU  68          HD23      LEU  68  12.393  -6.856   4.923
  522    H    ILE  69           H        ILE  69   8.416  -6.339   1.706
  523    HA   ILE  69           HA       ILE  69   7.168  -6.767   4.247
  524    HB   ILE  69           HB       ILE  69   5.844  -6.608   1.513
  525   HG12  ILE  69          HG12      ILE  69   7.299  -4.611   1.895
  526   HG13  ILE  69          HG13      ILE  69   5.598  -4.274   1.726
  527   HG21  ILE  69          HG21      ILE  69   4.819  -6.288   4.366
  528   HG22  ILE  69          HG22      ILE  69   3.933  -5.694   2.956
  529   HG23  ILE  69          HG23      ILE  69   4.264  -7.423   3.122
  530   HD11  ILE  69          HD11      ILE  69   7.102  -4.315   4.368
  531   HD12  ILE  69          HD12      ILE  69   6.540  -2.885   3.461
  532   HD13  ILE  69          HD13      ILE  69   5.362  -3.994   4.164
  533    H    THR  70           H        THR  70   6.551  -8.602   1.190
  534    HA   THR  70           HA       THR  70   5.717 -10.980   2.736
  535    HB   THR  70           HB       THR  70   5.041 -11.839   0.504
  536    HG1  THR  70           HG1      THR  70   5.087 -10.055  -1.141
  537   HG21  THR  70          HG21      THR  70   4.012  -9.003   0.979
  538   HG22  THR  70          HG22      THR  70   3.186 -10.324   0.133
  539   HG23  THR  70          HG23      THR  70   3.462 -10.440   1.876
  540    H    GLY  71           H        GLY  71   8.556  -9.814   1.268
  541    HA2  GLY  71           HA2      GLY  71  10.690 -10.772   1.541
  542    HA3  GLY  71           HA3      GLY  71   9.956 -12.326   1.911
  543    H    GLU  72           H        GLU  72   8.477 -11.320  -0.841
  544    HA   GLU  72           HA       GLU  72   9.355 -13.427  -2.374
  545    HB2  GLU  72           HB2      GLU  72   8.207 -10.746  -3.270
  546    HB3  GLU  72           HB3      GLU  72   8.464 -12.078  -4.392
  547    HG2  GLU  72           HG2      GLU  72   6.712 -12.205  -1.904
  548    HG3  GLU  72           HG3      GLU  72   6.131 -11.987  -3.559
  549    H    ALA  73           H        ALA  73  10.536 -10.104  -2.958
  550    HA   ALA  73           HA       ALA  73  12.436  -9.261  -3.747
  551    HB1  ALA  73           HB1      ALA  73  14.570 -10.295  -3.291
  552    HB2  ALA  73           HB2      ALA  73  13.493 -10.479  -1.899
  553    HB3  ALA  73           HB3      ALA  73  13.780 -11.859  -2.971
  554    H    MET  74           H        MET  74  10.568 -10.559  -5.339
  555    HA   MET  74           HA       MET  74  11.775 -10.488  -7.958
  556    HB2  MET  74           HB2      MET  74  11.982 -12.888  -7.455
  557    HB3  MET  74           HB3      MET  74  10.314 -12.942  -6.866
  558    HG2  MET  74           HG2      MET  74   9.478 -12.429  -9.115
  559    HG3  MET  74           HG3      MET  74  11.141 -12.353  -9.727
  560    HE1  MET  74           HE1      MET  74  10.192 -14.012 -11.635
  561    HE2  MET  74           HE2      MET  74   9.519 -15.621 -11.292
  562    HE3  MET  74           HE3      MET  74   8.618 -14.164 -10.819
  563    HA   PRO  75           HA       PRO  75   7.931  -8.251  -7.787
  564    HB2  PRO  75           HB2      PRO  75   7.618  -7.393 -10.323
  565    HB3  PRO  75           HB3      PRO  75   8.983  -6.867  -9.303
  566    HG2  PRO  75           HG2      PRO  75   8.963  -9.104 -11.370
  567    HG3  PRO  75           HG3      PRO  75  10.130  -7.747 -11.230
  568    HD2  PRO  75           HD2      PRO  75  10.645 -10.192 -10.145
  569    HD3  PRO  75           HD3      PRO  75  11.136  -8.685  -9.315
  570    H    VAL  76           H        VAL  76   5.705  -8.306  -8.215
  571    HA   VAL  76           HA       VAL  76   4.640 -10.882  -9.319
  572    HB   VAL  76           HB       VAL  76   3.701  -9.426  -6.819
  573   HG11  VAL  76          HG11      VAL  76   1.897 -10.741  -7.847
  574   HG12  VAL  76          HG12      VAL  76   2.982 -12.144  -8.014
  575   HG13  VAL  76          HG13      VAL  76   2.482 -11.578  -6.412
  576   HG21  VAL  76          HG21      VAL  76   5.915 -10.414  -6.386
  577   HG22  VAL  76          HG22      VAL  76   4.661 -11.353  -5.579
  578   HG23  VAL  76          HG23      VAL  76   5.372 -11.957  -7.092
  579    H    ALA  77           H        ALA  77   2.882 -10.836 -10.578
  580    HA   ALA  77           HA       ALA  77   1.880  -8.290 -11.544
  581    HB1  ALA  77           HB1      ALA  77   1.090 -11.143 -12.230
  582    HB2  ALA  77           HB2      ALA  77   0.684  -9.681 -13.149
  583    HB3  ALA  77           HB3      ALA  77   2.372 -10.199 -13.021
  584    H    LYS  78           H        LYS  78   0.055  -7.259 -11.152
  585    HA   LYS  78           HA       LYS  78  -2.110  -8.465  -9.458
  586    HB2  LYS  78           HB2      LYS  78  -1.382  -5.523  -9.719
  587    HB3  LYS  78           HB3      LYS  78  -2.537  -6.221  -8.601
  588    HG2  LYS  78           HG2      LYS  78   0.491  -6.535  -8.559
  589    HG3  LYS  78           HG3      LYS  78  -0.486  -5.528  -7.498
  590    HD2  LYS  78           HD2      LYS  78  -1.492  -7.486  -6.440
  591    HD3  LYS  78           HD3      LYS  78  -0.586  -8.576  -7.515
  592    HE2  LYS  78           HE2      LYS  78   1.538  -7.848  -6.623
  593    HE3  LYS  78           HE3      LYS  78   0.789  -6.502  -5.763
  594    HZ1  LYS  78           HZ1      LYS  78   0.477  -9.377  -5.063
  595    HZ2  LYS  78           HZ2      LYS  78   1.272  -8.245  -4.225
  596    HZ3  LYS  78           HZ3      LYS  78  -0.368  -8.159  -4.352
  597    H    LYS  79           H        LYS  79  -4.235  -8.125 -10.068
  598    HA   LYS  79           HA       LYS  79  -4.975  -6.655 -12.519
  599    HB2  LYS  79           HB2      LYS  79  -4.977  -9.674 -12.158
  600    HB3  LYS  79           HB3      LYS  79  -6.278  -8.948 -13.071
  601    HG2  LYS  79           HG2      LYS  79  -4.447  -7.733 -14.441
  602    HG3  LYS  79           HG3      LYS  79  -3.302  -8.842 -13.683
  603    HD2  LYS  79           HD2      LYS  79  -5.695  -9.601 -15.413
  604    HD3  LYS  79           HD3      LYS  79  -4.002  -9.593 -15.922
  605    HE2  LYS  79           HE2      LYS  79  -3.477 -11.353 -14.266
  606    HE3  LYS  79           HE3      LYS  79  -5.168 -11.361 -13.734
  607    HZ1  LYS  79           HZ1      LYS  79  -4.273 -12.048 -16.488
  608    HZ2  LYS  79           HZ2      LYS  79  -4.692 -13.136 -15.348
  609    HZ3  LYS  79           HZ3      LYS  79  -5.812 -12.098 -15.963
  610    HA   PRO  80           HA       PRO  80  -8.750  -6.013 -10.128
  611    HB2  PRO  80           HB2      PRO  80 -10.892  -6.879 -11.646
  612    HB3  PRO  80           HB3      PRO  80 -10.026  -5.338 -11.923
  613    HG2  PRO  80           HG2      PRO  80  -9.556  -8.011 -13.304
  614    HG3  PRO  80           HG3      PRO  80  -9.798  -6.401 -14.062
  615    HD2  PRO  80           HD2      PRO  80  -7.314  -7.299 -13.731
  616    HD3  PRO  80           HD3      PRO  80  -7.702  -5.623 -13.287
  617    H    GLY  81           H        GLY  81  -9.458  -7.149  -8.407
  618    HA2  GLY  81           HA2      GLY  81 -10.169  -8.968  -7.121
  619    HA3  GLY  81           HA3      GLY  81  -9.978 -10.060  -8.492
  620    H    SER  82           H        SER  82  -7.478  -7.840  -7.176
  621    HA   SER  82           HA       SER  82  -5.853 -10.197  -6.246
  622    HB2  SER  82           HB2      SER  82  -4.905  -7.731  -7.760
  623    HB3  SER  82           HB3      SER  82  -3.834  -8.848  -6.911
  624    HG   SER  82           HG       SER  82  -5.600  -9.613  -9.030
  625    H    THR  83           H        THR  83  -4.101  -9.436  -4.581
  626    HA   THR  83           HA       THR  83  -5.086  -7.078  -3.009
  627    HB   THR  83           HB       THR  83  -4.357  -8.211  -0.973
  628    HG1  THR  83           HG1      THR  83  -4.070 -10.491  -1.132
  629   HG21  THR  83          HG21      THR  83  -6.226  -9.748  -0.764
  630   HG22  THR  83          HG22      THR  83  -6.740  -8.339  -1.703
  631   HG23  THR  83          HG23      THR  83  -6.386  -9.869  -2.530
  632    H    VAL  84           H        VAL  84  -3.671  -5.811  -1.867
  633    HA   VAL  84           HA       VAL  84  -0.756  -6.042  -2.420
  634    HB   VAL  84           HB       VAL  84  -0.687  -3.585  -2.883
  635   HG11  VAL  84          HG11      VAL  84  -2.241  -5.221  -4.918
  636   HG12  VAL  84          HG12      VAL  84  -1.322  -3.731  -5.233
  637   HG13  VAL  84          HG13      VAL  84  -0.477  -5.189  -4.694
  638   HG21  VAL  84          HG21      VAL  84  -3.696  -3.815  -3.327
  639   HG22  VAL  84          HG22      VAL  84  -2.917  -2.944  -1.988
  640   HG23  VAL  84          HG23      VAL  84  -2.660  -2.410  -3.652
  641    H    ILE  85           H        ILE  85   0.572  -4.758  -1.109
  642    HA   ILE  85           HA       ILE  85  -0.564  -3.906   1.504
  643    HB   ILE  85           HB       ILE  85   1.793  -4.736   2.385
  644   HG12  ILE  85          HG12      ILE  85   2.396  -6.967   1.517
  645   HG13  ILE  85          HG13      ILE  85   1.283  -6.782   0.173
  646   HG21  ILE  85          HG21      ILE  85  -0.580  -6.579   1.982
  647   HG22  ILE  85          HG22      ILE  85   0.729  -6.775   3.177
  648   HG23  ILE  85          HG23      ILE  85  -0.358  -5.392   3.292
  649   HD11  ILE  85          HD11      ILE  85   3.630  -6.302  -0.463
  650   HD12  ILE  85          HD12      ILE  85   2.607  -4.867  -0.663
  651   HD13  ILE  85          HD13      ILE  85   3.684  -4.979   0.727
  652    H    ALA  86           H        ALA  86   0.744  -2.429   2.754
  653    HA   ALA  86           HA       ALA  86   1.674  -0.225   1.174
  654    HB1  ALA  86           HB1      ALA  86   1.938  -0.776   4.149
  655    HB2  ALA  86           HB2      ALA  86   2.163   0.799   3.354
  656    HB3  ALA  86           HB3      ALA  86   0.572   0.014   3.366
  657    H    GLY  87           H        GLY  87   3.724   0.620   0.912
  658    HA2  GLY  87           HA2      GLY  87   6.089   0.745   1.011
  659    HA3  GLY  87           HA3      GLY  87   6.143  -0.753   1.949
  660    H    SER  88           H        SER  88   4.182  -1.446  -0.620
  661    HA   SER  88           HA       SER  88   6.325  -2.613  -2.255
  662    HB2  SER  88           HB2      SER  88   3.359  -2.856  -2.056
  663    HB3  SER  88           HB3      SER  88   4.022  -2.942  -3.687
  664    HG   SER  88           HG       SER  88   5.495  -4.496  -2.933
  665    H    ILE  89           H        ILE  89   6.733  -2.103  -4.402
  666    HA   ILE  89           HA       ILE  89   6.021   0.676  -5.258
  667    HB   ILE  89           HB       ILE  89   8.199  -0.920  -6.574
  668   HG12  ILE  89          HG12      ILE  89   8.815  -1.215  -4.272
  669   HG13  ILE  89          HG13      ILE  89   9.920  -0.155  -5.102
  670   HG21  ILE  89          HG21      ILE  89   9.160   1.340  -6.905
  671   HG22  ILE  89          HG22      ILE  89   7.523   1.211  -7.562
  672   HG23  ILE  89          HG23      ILE  89   7.787   2.052  -6.031
  673   HD11  ILE  89          HD11      ILE  89   9.454   0.580  -2.788
  674   HD12  ILE  89          HD12      ILE  89   9.024   1.804  -3.988
  675   HD13  ILE  89          HD13      ILE  89   7.750   0.834  -3.205
  676    H    ASN  90           H        ASN  90   4.847   1.031  -7.072
  677    HA   ASN  90           HA       ASN  90   3.819  -1.286  -8.623
  678    HB2  ASN  90           HB2      ASN  90   2.286   0.353  -7.450
  679    HB3  ASN  90           HB3      ASN  90   2.915   1.628  -8.484
  680   HD21  ASN  90          HD22      ASN  90   1.670   1.995 -10.268
  681   HD22  ASN  90          HD21      ASN  90   0.521   0.836 -10.911
  682    H    GLN  91           H        GLN  91   4.058  -1.499 -10.875
  683    HA   GLN  91           HA       GLN  91   6.253   0.082 -12.023
  684    HB2  GLN  91           HB2      GLN  91   5.092  -2.600 -12.688
  685    HB3  GLN  91           HB3      GLN  91   6.028  -1.703 -13.870
  686    HG2  GLN  91           HG2      GLN  91   7.548  -3.131 -12.852
  687    HG3  GLN  91           HG3      GLN  91   7.928  -1.506 -12.302
  688   HE21  GLN  91          HE22      GLN  91   7.449  -0.980  -9.989
  689   HE22  GLN  91          HE21      GLN  91   7.105  -2.304  -8.864
  690    H    ASN  92           H        ASN  92   3.888  -1.167 -14.341
  691    HA   ASN  92           HA       ASN  92   4.036   1.551 -15.539
  692    HB2  ASN  92           HB2      ASN  92   4.930  -0.185 -16.876
  693    HB3  ASN  92           HB3      ASN  92   3.507  -1.202 -16.659
  694   HD21  ASN  92          HD22      ASN  92   1.779  -0.981 -18.009
  695   HD22  ASN  92          HD21      ASN  92   1.695   0.230 -19.286
  696    H    GLY  93           H        GLY  93   1.401  -0.805 -14.739
  697    HA2  GLY  93           HA2      GLY  93  -0.602   1.000 -15.857
  698    HA3  GLY  93           HA3      GLY  93  -0.891  -0.525 -15.040
  699    H    SER  94           H        SER  94  -2.017   2.337 -14.855
  700    HA   SER  94           HA       SER  94  -1.801   2.810 -11.947
  701    HB2  SER  94           HB2      SER  94  -2.021   4.740 -13.485
  702    HB3  SER  94           HB3      SER  94  -3.607   4.138 -13.999
  703    HG   SER  94           HG       SER  94  -2.954   4.634 -11.268
  704    H    LEU  95           H        LEU  95  -3.167   2.050 -10.473
  705    HA   LEU  95           HA       LEU  95  -5.463   0.327 -11.330
  706    HB2  LEU  95           HB2      LEU  95  -3.746  -0.076  -8.889
  707    HB3  LEU  95           HB3      LEU  95  -4.896  -1.193  -9.563
  708    HG   LEU  95           HG       LEU  95  -2.199  -0.434 -10.791
  709   HD11  LEU  95          HD11      LEU  95  -3.047  -2.887  -9.192
  710   HD12  LEU  95          HD12      LEU  95  -1.491  -2.671 -10.021
  711   HD13  LEU  95          HD13      LEU  95  -1.911  -1.623  -8.665
  712   HD21  LEU  95          HD21      LEU  95  -4.235  -2.610 -11.412
  713   HD22  LEU  95          HD22      LEU  95  -3.850  -1.196 -12.427
  714   HD23  LEU  95          HD23      LEU  95  -2.631  -2.444 -12.154
  715    H    LEU  96           H        LEU  96  -7.188   0.091  -9.717
  716    HA   LEU  96           HA       LEU  96  -7.263   2.264  -7.652
  717    HB2  LEU  96           HB2      LEU  96  -9.644   1.163  -9.166
  718    HB3  LEU  96           HB3      LEU  96  -9.740   2.039  -7.663
  719    HG   LEU  96           HG       LEU  96  -8.716   4.036  -8.669
  720   HD11  LEU  96          HD11      LEU  96  -8.753   2.390 -11.222
  721   HD12  LEU  96          HD12      LEU  96  -8.807   4.152 -11.239
  722   HD13  LEU  96          HD13      LEU  96  -7.412   3.325 -10.532
  723   HD21  LEU  96          HD21      LEU  96 -11.177   3.720  -8.589
  724   HD22  LEU  96          HD22      LEU  96 -10.677   4.686  -9.981
  725   HD23  LEU  96          HD23      LEU  96 -11.128   2.980 -10.204
  726    H    ILE  97           H        ILE  97  -7.279   1.659  -5.680
  727    HA   ILE  97           HA       ILE  97  -7.797  -1.187  -4.954
  728    HB   ILE  97           HB       ILE  97  -5.835   0.785  -3.712
  729   HG12  ILE  97          HG12      ILE  97  -4.216  -1.116  -4.745
  730   HG13  ILE  97          HG13      ILE  97  -5.503  -1.226  -5.936
  731   HG21  ILE  97          HG21      ILE  97  -6.059  -2.222  -3.300
  732   HG22  ILE  97          HG22      ILE  97  -4.924  -1.114  -2.509
  733   HG23  ILE  97          HG23      ILE  97  -6.645  -0.997  -2.151
  734   HD11  ILE  97          HD11      ILE  97  -3.658   0.296  -6.581
  735   HD12  ILE  97          HD12      ILE  97  -5.176   1.184  -6.484
  736   HD13  ILE  97          HD13      ILE  97  -3.997   1.317  -5.168
  737    H    CYS  98           H        CYS  98  -9.257  -1.590  -3.359
  738    HA   CYS  98           HA       CYS  98 -10.437   0.696  -1.860
  739    HB2  CYS  98           HB2      CYS  98 -12.029  -0.988  -1.000
  740    HB3  CYS  98           HB3      CYS  98 -12.068  -0.823  -2.759
  741    HG   CYS  98           HG       CYS  98 -10.342  -3.045  -1.063
  742    H    ALA  99           H        ALA  99  -9.320   1.368  -0.171
  743    HA   ALA  99           HA       ALA  99  -7.240  -0.270   1.063
  744    HB1  ALA  99           HB1      ALA  99  -8.285   2.534   1.664
  745    HB2  ALA  99           HB2      ALA  99  -6.840   1.793   2.378
  746    HB3  ALA  99           HB3      ALA  99  -6.893   2.123   0.632
  747    H    THR 100           H        THR 100  -7.215  -1.131   3.087
  748    HA   THR 100           HA       THR 100  -9.819  -1.152   4.594
  749    HB   THR 100           HB       THR 100  -9.356  -3.053   2.939
  750    HG1  THR 100           HG1      THR 100 -10.322  -4.499   4.419
  751   HG21  THR 100          HG21      THR 100  -7.767  -4.183   5.271
  752   HG22  THR 100          HG22      THR 100  -8.122  -4.956   3.719
  753   HG23  THR 100          HG23      THR 100  -7.024  -3.571   3.776
  754    H    HIS 101           H        HIS 101  -6.673  -0.330   5.130
  755    HA   HIS 101           HA       HIS 101  -7.232  -0.407   8.030
  756    HB2  HIS 101           HB2      HIS 101  -4.644  -1.349   6.723
  757    HB3  HIS 101           HB3      HIS 101  -4.796  -0.945   8.429
  758    HD1  HIS 101           HD1      HIS 101  -5.168  -3.855   6.169
  759    HD2  HIS 101           HD2      HIS 101  -6.814  -2.475   9.788
  760    HE1  HIS 101           HE1      HIS 101  -6.279  -5.863   7.282
  761    H    VAL 102           H        VAL 102  -6.323   1.293   9.171
  762    HA   VAL 102           HA       VAL 102  -5.234   3.598   7.671
  763    HB   VAL 102           HB       VAL 102  -5.224   4.726   9.871
  764   HG11  VAL 102          HG11      VAL 102  -7.886   3.515   9.066
  765   HG12  VAL 102          HG12      VAL 102  -7.645   4.980  10.042
  766   HG13  VAL 102          HG13      VAL 102  -7.089   4.945   8.364
  767   HG21  VAL 102          HG21      VAL 102  -5.008   2.756  11.374
  768   HG22  VAL 102          HG22      VAL 102  -6.379   3.788  11.789
  769   HG23  VAL 102          HG23      VAL 102  -6.669   2.264  10.940
  770    H    GLY 103           H        GLY 103  -3.227   4.741   9.021
  771    HA2  GLY 103           HA2      GLY 103  -1.029   3.057   8.205
  772    HA3  GLY 103           HA3      GLY 103  -0.957   4.654   8.970
  773    H    ALA 104           H        ALA 104  -2.449   3.851  11.402
  774    HA   ALA 104           HA       ALA 104  -0.411   2.446  12.915
  775    HB1  ALA 104           HB1      ALA 104  -1.840   4.203  13.871
  776    HB2  ALA 104           HB2      ALA 104  -3.281   3.195  13.618
  777    HB3  ALA 104           HB3      ALA 104  -2.022   2.678  14.761
  778    H    ASP 105           H        ASP 105  -3.532   1.473  11.566
  779    HA   ASP 105           HA       ASP 105  -3.536  -1.091  12.911
  780    HB2  ASP 105           HB2      ASP 105  -5.529   0.500  12.321
  781    HB3  ASP 105           HB3      ASP 105  -5.542  -0.362  10.781
  782    H    THR 106           H        THR 106  -1.983  -0.235  10.103
  783    HA   THR 106           HA       THR 106  -2.477  -2.679   8.555
  784    HB   THR 106           HB       THR 106  -2.212  -0.505   7.452
  785    HG1  THR 106           HG1      THR 106  -1.719  -2.298   6.240
  786   HG21  THR 106          HG21      THR 106  -0.062   0.553   7.149
  787   HG22  THR 106          HG22      THR 106  -0.444   0.486   8.873
  788   HG23  THR 106          HG23      THR 106   0.735  -0.648   8.187
  789    H    THR 107           H        THR 107  -0.883  -4.113   7.840
  790    HA   THR 107           HA       THR 107   0.606  -5.565   9.555
  791    HB   THR 107           HB       THR 107   1.143  -5.020   6.622
  792    HG1  THR 107           HG1      THR 107  -0.787  -6.062   7.086
  793   HG21  THR 107          HG21      THR 107   2.307  -7.247   6.620
  794   HG22  THR 107          HG22      THR 107   3.232  -5.970   7.414
  795   HG23  THR 107          HG23      THR 107   2.365  -7.179   8.394
  796    H    LEU 108           H        LEU 108   2.052  -2.716   7.852
  797    HA   LEU 108           HA       LEU 108   4.721  -3.229   8.699
  798    HB2  LEU 108           HB2      LEU 108   3.268  -0.661   7.918
  799    HB3  LEU 108           HB3      LEU 108   4.984  -0.699   8.283
  800    HG   LEU 108           HG       LEU 108   5.478  -2.095   6.369
  801   HD11  LEU 108          HD11      LEU 108   2.465  -2.133   5.938
  802   HD12  LEU 108          HD12      LEU 108   3.657  -2.585   4.702
  803   HD13  LEU 108          HD13      LEU 108   3.555  -3.549   6.168
  804   HD21  LEU 108          HD21      LEU 108   5.208   0.346   6.010
  805   HD22  LEU 108          HD22      LEU 108   4.732  -0.560   4.574
  806   HD23  LEU 108          HD23      LEU 108   3.487   0.100   5.674
  807    H    SER 109           H        SER 109   2.221  -1.159  10.181
  808    HA   SER 109           HA       SER 109   3.807  -0.412  12.513
  809    HB2  SER 109           HB2      SER 109   2.051   1.035  11.756
  810    HB3  SER 109           HB3      SER 109   0.867  -0.278  11.821
  811    HG   SER 109           HG       SER 109   0.505   0.324  13.733
  812    H    GLN 110           H        GLN 110   1.581  -3.027  11.630
  813    HA   GLN 110           HA       GLN 110   1.077  -3.983  14.307
  814    HB2  GLN 110           HB2      GLN 110  -0.279  -4.398  12.168
  815    HB3  GLN 110           HB3      GLN 110   0.965  -5.530  11.689
  816    HG2  GLN 110           HG2      GLN 110  -0.671  -6.881  12.572
  817    HG3  GLN 110           HG3      GLN 110   0.506  -6.790  13.880
  818   HE21  GLN 110          HE22      GLN 110  -2.618  -5.450  12.707
  819   HE22  GLN 110          HE21      GLN 110  -3.030  -4.732  14.245
  820    H    ILE 111           H        ILE 111   3.541  -4.804  11.867
  821    HA   ILE 111           HA       ILE 111   4.900  -6.874  13.310
  822    HB   ILE 111           HB       ILE 111   5.833  -4.916  11.184
  823   HG12  ILE 111          HG12      ILE 111   5.398  -7.919  10.903
  824   HG13  ILE 111          HG13      ILE 111   4.066  -6.795  10.705
  825   HG21  ILE 111          HG21      ILE 111   7.331  -7.325  12.320
  826   HG22  ILE 111          HG22      ILE 111   7.810  -6.428  10.870
  827   HG23  ILE 111          HG23      ILE 111   7.842  -5.625  12.429
  828   HD11  ILE 111          HD11      ILE 111   6.609  -6.801   9.029
  829   HD12  ILE 111          HD12      ILE 111   4.999  -7.322   8.531
  830   HD13  ILE 111          HD13      ILE 111   5.293  -5.606   8.899
  831    H    VAL 112           H        VAL 112   5.816  -3.350  13.066
  832    HA   VAL 112           HA       VAL 112   7.976  -3.696  14.883
  833    HB   VAL 112           HB       VAL 112   8.204  -1.302  14.991
  834   HG11  VAL 112          HG11      VAL 112   8.965  -2.485  12.952
  835   HG12  VAL 112          HG12      VAL 112   7.391  -2.169  12.190
  836   HG13  VAL 112          HG13      VAL 112   8.457  -0.820  12.622
  837   HG21  VAL 112          HG21      VAL 112   5.826  -0.606  15.198
  838   HG22  VAL 112          HG22      VAL 112   6.671   0.245  13.900
  839   HG23  VAL 112          HG23      VAL 112   5.567  -1.088  13.508
  840    H    LYS 113           H        LYS 113   4.640  -3.253  15.625
  841    HA   LYS 113           HA       LYS 113   4.969  -2.512  18.441
  842    HB2  LYS 113           HB2      LYS 113   2.748  -3.748  16.792
  843    HB3  LYS 113           HB3      LYS 113   2.616  -3.517  18.545
  844    HG2  LYS 113           HG2      LYS 113   2.660  -1.141  18.348
  845    HG3  LYS 113           HG3      LYS 113   3.177  -1.227  16.663
  846    HD2  LYS 113           HD2      LYS 113   0.795  -0.611  16.880
  847    HD3  LYS 113           HD3      LYS 113   1.113  -2.047  15.892
  848    HE2  LYS 113           HE2      LYS 113   0.629  -3.475  17.863
  849    HE3  LYS 113           HE3      LYS 113   0.170  -2.031  18.779
  850    HZ1  LYS 113           HZ1      LYS 113  -1.762  -3.219  17.696
  851    HZ2  LYS 113           HZ2      LYS 113  -1.626  -1.663  17.193
  852    HZ3  LYS 113           HZ3      LYS 113  -1.113  -2.857  16.222
  853    H    LEU 114           H        LEU 114   4.355  -5.638  16.750
  854    HA   LEU 114           HA       LEU 114   4.421  -7.086  19.268
  855    HB2  LEU 114           HB2      LEU 114   3.205  -7.448  16.770
  856    HB3  LEU 114           HB3      LEU 114   4.346  -8.789  16.888
  857    HG   LEU 114           HG       LEU 114   2.290  -7.981  18.976
  858   HD11  LEU 114          HD11      LEU 114   2.159 -10.174  16.883
  859   HD12  LEU 114          HD12      LEU 114   0.977  -9.910  18.191
  860   HD13  LEU 114          HD13      LEU 114   1.195  -8.670  16.950
  861   HD21  LEU 114          HD21      LEU 114   4.105  -9.289  19.995
  862   HD22  LEU 114          HD22      LEU 114   2.655 -10.287  19.879
  863   HD23  LEU 114          HD23      LEU 114   3.979 -10.505  18.707
  864    H    VAL 115           H        VAL 115   6.742  -6.649  16.641
  865    HA   VAL 115           HA       VAL 115   8.656  -8.644  17.488
  866    HB   VAL 115           HB       VAL 115   9.019  -5.952  16.113
  867   HG11  VAL 115          HG11      VAL 115  11.107  -8.116  16.625
  868   HG12  VAL 115          HG12      VAL 115  11.302  -6.755  15.498
  869   HG13  VAL 115          HG13      VAL 115  11.152  -6.441  17.224
  870   HG21  VAL 115          HG21      VAL 115   7.845  -7.760  14.826
  871   HG22  VAL 115          HG22      VAL 115   9.413  -7.342  14.123
  872   HG23  VAL 115          HG23      VAL 115   9.234  -8.825  15.089
  873    H    GLU 116           H        GLU 116   8.669  -5.145  18.305
  874    HA   GLU 116           HA       GLU 116  10.396  -5.224  20.384
  875    HB2  GLU 116           HB2      GLU 116   8.120  -3.453  19.586
  876    HB3  GLU 116           HB3      GLU 116   8.758  -3.181  21.186
  877    HG2  GLU 116           HG2      GLU 116  10.524  -3.298  18.706
  878    HG3  GLU 116           HG3      GLU 116   9.803  -1.809  19.325
  879    H    GLU 117           H        GLU 117   7.280  -6.721  20.730
  880    HA   GLU 117           HA       GLU 117   7.267  -6.540  23.671
  881    HB2  GLU 117           HB2      GLU 117   5.762  -8.480  21.864
  882    HB3  GLU 117           HB3      GLU 117   5.600  -8.315  23.614
  883    HG2  GLU 117           HG2      GLU 117   5.077  -5.792  23.048
  884    HG3  GLU 117           HG3      GLU 117   4.685  -6.426  21.453
  885    H    ALA 118           H        ALA 118   8.674  -8.746  21.243
  886    HA   ALA 118           HA       ALA 118   9.699 -10.560  23.354
  887    HB1  ALA 118           HB1      ALA 118  10.609 -11.773  21.359
  888    HB2  ALA 118           HB2      ALA 118   8.841 -11.652  21.394
  889    HB3  ALA 118           HB3      ALA 118   9.764 -10.600  20.310
  890    H    GLN 119           H        GLN 119  11.064  -8.925  20.572
  891    HA   GLN 119           HA       GLN 119  13.666  -8.405  21.672
  892    HB2  GLN 119           HB2      GLN 119  12.170  -7.747  19.115
  893    HB3  GLN 119           HB3      GLN 119  13.691  -7.016  19.408
  894    HG2  GLN 119           HG2      GLN 119  14.721  -8.761  18.530
  895    HG3  GLN 119           HG3      GLN 119  14.247  -9.690  19.965
  896   HE21  GLN 119          HE22      GLN 119  12.287 -10.874  19.936
  897   HE22  GLN 119          HE21      GLN 119  11.381 -11.041  18.423
  Start of MODEL   13
    1    H    SER   1           H        SER   1  18.999  -4.676  14.104
    2    HA   SER   1           HA       SER   1  16.115  -4.100  14.520
    3    HB2  SER   1           HB2      SER   1  18.597  -2.985  15.888
    4    HB3  SER   1           HB3      SER   1  16.916  -2.598  16.287
    5    HG   SER   1           HG       SER   1  18.258  -5.087  16.543
    6    H    GLU   2           H        GLU   2  18.971  -2.819  12.912
    7    HA   GLU   2           HA       GLU   2  18.218  -0.191  12.319
    8    HB2  GLU   2           HB2      GLU   2  20.381  -1.279  11.796
    9    HB3  GLU   2           HB3      GLU   2  19.603  -2.290  10.593
   10    HG2  GLU   2           HG2      GLU   2  20.861  -0.438   9.569
   11    HG3  GLU   2           HG3      GLU   2  19.160  -0.414   9.151
   12    H    ALA   3           H        ALA   3  16.984  -3.177  10.830
   13    HA   ALA   3           HA       ALA   3  15.419  -1.807   8.793
   14    HB1  ALA   3           HB1      ALA   3  15.441  -4.678   9.779
   15    HB2  ALA   3           HB2      ALA   3  14.549  -4.082   8.365
   16    HB3  ALA   3           HB3      ALA   3  16.322  -4.026   8.382
   17    H    LEU   4           H        LEU   4  14.882  -2.269  12.201
   18    HA   LEU   4           HA       LEU   4  12.153  -3.079  12.110
   19    HB2  LEU   4           HB2      LEU   4  13.688  -3.341  14.069
   20    HB3  LEU   4           HB3      LEU   4  13.631  -1.600  14.320
   21    HG   LEU   4           HG       LEU   4  11.151  -1.755  14.716
   22   HD11  LEU   4          HD11      LEU   4  11.793  -4.723  14.697
   23   HD12  LEU   4          HD12      LEU   4  10.266  -4.013  15.286
   24   HD13  LEU   4          HD13      LEU   4  10.715  -3.890  13.575
   25   HD21  LEU   4          HD21      LEU   4  12.914  -3.449  16.527
   26   HD22  LEU   4          HD22      LEU   4  12.756  -1.676  16.582
   27   HD23  LEU   4          HD23      LEU   4  11.360  -2.699  16.962
   28    H    ALA   5           H        ALA   5  13.516   0.325  12.221
   29    HA   ALA   5           HA       ALA   5  10.811   1.428  12.231
   30    HB1  ALA   5           HB1      ALA   5  13.533   2.730  11.839
   31    HB2  ALA   5           HB2      ALA   5  11.987   3.558  12.086
   32    HB3  ALA   5           HB3      ALA   5  12.677   2.576  13.390
   33    H    LYS   6           H        LYS   6  12.921   0.010   9.811
   34    HA   LYS   6           HA       LYS   6  12.532   2.013   7.723
   35    HB2  LYS   6           HB2      LYS   6  14.559   0.709   7.825
   36    HB3  LYS   6           HB3      LYS   6  13.656  -0.804   7.626
   37    HG2  LYS   6           HG2      LYS   6  13.012  -0.305   5.420
   38    HG3  LYS   6           HG3      LYS   6  13.458   1.412   5.573
   39    HD2  LYS   6           HD2      LYS   6  15.797   0.867   5.676
   40    HD3  LYS   6           HD3      LYS   6  15.456  -0.886   5.686
   41    HE2  LYS   6           HE2      LYS   6  14.604  -0.827   3.445
   42    HE3  LYS   6           HE3      LYS   6  14.458   0.937   3.493
   43    HZ1  LYS   6           HZ1      LYS   6  16.858   1.101   3.527
   44    HZ2  LYS   6           HZ2      LYS   6  17.054  -0.532   3.437
   45    HZ3  LYS   6           HZ3      LYS   6  16.374   0.317   2.192
   46    H    LEU   7           H        LEU   7  11.050  -1.142   8.509
   47    HA   LEU   7           HA       LEU   7   9.215  -1.353   6.381
   48    HB2  LEU   7           HB2      LEU   7   9.091  -2.036   9.334
   49    HB3  LEU   7           HB3      LEU   7   7.674  -2.273   8.336
   50    HG   LEU   7           HG       LEU   7   8.974  -4.329   8.716
   51   HD11  LEU   7          HD11      LEU   7   7.538  -4.291   6.803
   52   HD12  LEU   7          HD12      LEU   7   8.749  -3.425   5.823
   53   HD13  LEU   7          HD13      LEU   7   9.031  -5.095   6.339
   54   HD21  LEU   7          HD21      LEU   7  11.258  -3.453   8.677
   55   HD22  LEU   7          HD22      LEU   7  11.051  -4.781   7.544
   56   HD23  LEU   7          HD23      LEU   7  11.120  -3.123   6.926
   57    H    ILE   8           H        ILE   8   8.869   0.655   9.334
   58    HA   ILE   8           HA       ILE   8   6.357   1.843   8.485
   59    HB   ILE   8           HB       ILE   8   8.325   2.496  10.695
   60   HG12  ILE   8          HG12      ILE   8   7.204   0.374  11.021
   61   HG13  ILE   8          HG13      ILE   8   6.650   1.552  12.194
   62   HG21  ILE   8          HG21      ILE   8   5.630   3.812  10.227
   63   HG22  ILE   8          HG22      ILE   8   6.576   3.915  11.720
   64   HG23  ILE   8          HG23      ILE   8   7.224   4.590  10.224
   65   HD11  ILE   8          HD11      ILE   8   4.546   1.864  10.856
   66   HD12  ILE   8          HD12      ILE   8   5.102   0.598   9.737
   67   HD13  ILE   8          HD13      ILE   8   4.780   0.208  11.431
   68    H    SER   9           H        SER   9   9.723   2.650   7.832
   69    HA   SER   9           HA       SER   9   9.277   5.425   7.139
   70    HB2  SER   9           HB2      SER   9  11.522   3.557   6.284
   71    HB3  SER   9           HB3      SER   9  11.490   5.312   6.140
   72    HG   SER   9           HG       SER   9  12.656   4.441   7.963
   73    H    LEU  10           H        LEU  10   9.301   2.358   5.309
   74    HA   LEU  10           HA       LEU  10   9.419   3.399   2.689
   75    HB2  LEU  10           HB2      LEU  10   8.511   0.821   3.967
   76    HB3  LEU  10           HB3      LEU  10   8.005   1.130   2.322
   77    HG   LEU  10           HG       LEU  10  10.396   1.474   1.638
   78   HD11  LEU  10          HD11      LEU  10  11.357   1.865   3.920
   79   HD12  LEU  10          HD12      LEU  10  10.984   0.160   4.298
   80   HD13  LEU  10          HD13      LEU  10  12.153   0.568   3.018
   81   HD21  LEU  10          HD21      LEU  10  10.875  -0.985   1.696
   82   HD22  LEU  10          HD22      LEU  10   9.548  -1.176   2.868
   83   HD23  LEU  10          HD23      LEU  10   9.214  -0.627   1.214
   84    H    GLN  11           H        GLN  11   6.787   3.657   4.840
   85    HA   GLN  11           HA       GLN  11   4.523   3.408   3.111
   86    HB2  GLN  11           HB2      GLN  11   4.881   4.846   5.734
   87    HB3  GLN  11           HB3      GLN  11   3.336   4.591   4.902
   88    HG2  GLN  11           HG2      GLN  11   3.643   2.143   5.010
   89    HG3  GLN  11           HG3      GLN  11   5.199   2.365   5.837
   90   HE21  GLN  11          HE22      GLN  11   5.133   3.710   7.874
   91   HE22  GLN  11          HE21      GLN  11   3.650   3.718   8.808
   92    H    ALA  12           H        ALA  12   3.473   4.780   1.807
   93    HA   ALA  12           HA       ALA  12   4.627   7.261   0.949
   94    HB1  ALA  12           HB1      ALA  12   2.628   7.400  -0.452
   95    HB2  ALA  12           HB2      ALA  12   3.274   5.745  -0.461
   96    HB3  ALA  12           HB3      ALA  12   1.845   6.127   0.504
   97    H    THR  13           H        THR  13   3.838   9.393   1.147
   98    HA   THR  13           HA       THR  13   2.708   9.979   3.840
   99    HB   THR  13           HB       THR  13   3.995  12.002   2.011
  100    HG1  THR  13           HG1      THR  13   5.972  11.476   2.997
  101   HG21  THR  13          HG21      THR  13   4.021  11.624   5.041
  102   HG22  THR  13          HG22      THR  13   4.715  12.990   4.142
  103   HG23  THR  13          HG23      THR  13   2.967  12.751   4.157
  104    H    GLU  14           H        GLU  14   2.032  10.458   0.431
  105    HA   GLU  14           HA       GLU  14  -0.648  11.449   1.121
  106    HB2  GLU  14           HB2      GLU  14  -0.574  13.215  -0.607
  107    HB3  GLU  14           HB3      GLU  14   0.417  13.531   0.811
  108    HG2  GLU  14           HG2      GLU  14   1.573  12.411  -1.763
  109    HG3  GLU  14           HG3      GLU  14   1.330  14.136  -1.512
  110    H    ALA  15           H        ALA  15  -2.239  11.223  -0.572
  111    HA   ALA  15           HA       ALA  15  -1.645   9.102  -2.569
  112    HB1  ALA  15           HB1      ALA  15  -2.117   8.031  -0.382
  113    HB2  ALA  15           HB2      ALA  15  -3.687   8.865  -0.320
  114    HB3  ALA  15           HB3      ALA  15  -3.361   7.668  -1.596
  115    H    THR  16           H        THR  16  -3.343   8.765  -4.133
  116    HA   THR  16           HA       THR  16  -5.062  11.126  -4.568
  117    HB   THR  16           HB       THR  16  -4.606   8.806  -6.452
  118    HG1  THR  16           HG1      THR  16  -3.403  10.554  -7.526
  119   HG21  THR  16          HG21      THR  16  -5.459  10.391  -8.150
  120   HG22  THR  16          HG22      THR  16  -6.690  10.099  -6.925
  121   HG23  THR  16          HG23      THR  16  -5.749  11.606  -6.883
  122    H    ILE  17           H        ILE  17  -7.061  11.141  -3.663
  123    HA   ILE  17           HA       ILE  17  -8.699   8.650  -3.484
  124    HB   ILE  17           HB       ILE  17  -9.389  11.476  -2.581
  125   HG12  ILE  17          HG12      ILE  17  -8.547   9.014  -1.003
  126   HG13  ILE  17          HG13      ILE  17  -7.626  10.503  -1.181
  127   HG21  ILE  17          HG21      ILE  17 -10.883   8.833  -2.173
  128   HG22  ILE  17          HG22      ILE  17 -11.364  10.417  -1.524
  129   HG23  ILE  17          HG23      ILE  17 -11.404  10.155  -3.245
  130   HD11  ILE  17          HD11      ILE  17 -10.237  10.137   0.352
  131   HD12  ILE  17          HD12      ILE  17  -8.640  10.428   1.015
  132   HD13  ILE  17          HD13      ILE  17  -9.443  11.710   0.076
  133    H    VAL  18           H        VAL  18 -10.117   8.084  -5.044
  134    HA   VAL  18           HA       VAL  18 -10.719  10.076  -7.204
  135    HB   VAL  18           HB       VAL  18 -10.555   7.064  -7.390
  136   HG11  VAL  18          HG11      VAL  18 -10.693   7.479  -9.851
  137   HG12  VAL  18          HG12      VAL  18 -12.180   7.858  -8.984
  138   HG13  VAL  18          HG13      VAL  18 -11.110   9.174  -9.502
  139   HG21  VAL  18          HG21      VAL  18  -8.327   7.902  -7.136
  140   HG22  VAL  18          HG22      VAL  18  -8.579   7.500  -8.835
  141   HG23  VAL  18          HG23      VAL  18  -8.610   9.194  -8.310
  142    H    THR  19           H        THR  19 -12.754  10.628  -7.563
  143    HA   THR  19           HA       THR  19 -15.004   8.945  -6.543
  144    HB   THR  19           HB       THR  19 -14.922  11.947  -6.101
  145    HG1  THR  19           HG1      THR  19 -13.453  11.381  -4.749
  146   HG21  THR  19          HG21      THR  19 -16.619   9.720  -4.887
  147   HG22  THR  19          HG22      THR  19 -16.677  11.434  -4.426
  148   HG23  THR  19          HG23      THR  19 -17.175  10.946  -6.050
  149    H    LEU  20           H        LEU  20 -16.700   8.858  -7.858
  150    HA   LEU  20           HA       LEU  20 -16.773  10.485 -10.334
  151    HB2  LEU  20           HB2      LEU  20 -18.755   8.390  -9.380
  152    HB3  LEU  20           HB3      LEU  20 -18.726   9.163 -10.948
  153    HG   LEU  20           HG       LEU  20 -16.451   7.415  -9.896
  154   HD11  LEU  20          HD11      LEU  20 -18.703   6.704 -11.815
  155   HD12  LEU  20          HD12      LEU  20 -17.276   5.705 -11.462
  156   HD13  LEU  20          HD13      LEU  20 -18.444   6.058 -10.186
  157   HD21  LEU  20          HD21      LEU  20 -15.711   9.002 -11.623
  158   HD22  LEU  20          HD22      LEU  20 -15.752   7.362 -12.274
  159   HD23  LEU  20          HD23      LEU  20 -17.048   8.506 -12.682
  160    H    ASP  21           H        ASP  21 -17.021  12.542  -9.600
  161    HA   ASP  21           HA       ASP  21 -18.899  13.277  -7.560
  162    HB2  ASP  21           HB2      ASP  21 -16.664  14.424  -8.353
  163    HB3  ASP  21           HB3      ASP  21 -17.704  15.293  -9.459
  164    H    SER  22           H        SER  22 -19.561  12.419 -10.535
  165    HA   SER  22           HA       SER  22 -22.297  13.039 -10.339
  166    HB2  SER  22           HB2      SER  22 -21.096  14.432 -12.745
  167    HB3  SER  22           HB3      SER  22 -22.811  14.123 -12.478
  168    HG   SER  22           HG       SER  22 -21.699  15.215 -10.294
  169    H    ASP  23           H        ASP  23 -23.512  11.750 -11.430
  170    HA   ASP  23           HA       ASP  23 -23.689   9.340 -11.844
  171    HB2  ASP  23           HB2      ASP  23 -24.606  11.373 -13.892
  172    HB3  ASP  23           HB3      ASP  23 -25.103   9.693 -13.987
  173    H    ASN  24           H        ASN  24 -21.085   9.297 -12.255
  174    HA   ASN  24           HA       ASN  24 -19.362   8.202 -13.251
  175    HB2  ASN  24           HB2      ASN  24 -21.133   6.411 -13.773
  176    HB3  ASN  24           HB3      ASN  24 -21.162   7.075 -15.412
  177   HD21  ASN  24          HD22      ASN  24 -18.187   7.512 -15.455
  178   HD22  ASN  24          HD21      ASN  24 -17.618   5.843 -15.556
  179    H    ILE  25           H        ILE  25 -21.468  10.264 -15.206
  180    HA   ILE  25           HA       ILE  25 -19.865  11.031 -17.285
  181    HB   ILE  25           HB       ILE  25 -21.328  13.083 -17.153
  182   HG12  ILE  25          HG12      ILE  25 -22.521  11.866 -14.687
  183   HG13  ILE  25          HG13      ILE  25 -21.465  13.280 -14.718
  184   HG21  ILE  25          HG21      ILE  25 -22.832  10.460 -16.792
  185   HG22  ILE  25          HG22      ILE  25 -23.321  11.860 -17.767
  186   HG23  ILE  25          HG23      ILE  25 -21.933  10.883 -18.253
  187   HD11  ILE  25          HD11      ILE  25 -23.117  14.468 -16.158
  188   HD12  ILE  25          HD12      ILE  25 -24.213  13.070 -16.015
  189   HD13  ILE  25          HD13      ILE  25 -23.777  14.005 -14.579
  190    H    LEU  26           H        LEU  26 -19.100  11.701 -14.012
  191    HA   LEU  26           HA       LEU  26 -17.153  13.814 -14.852
  192    HB2  LEU  26           HB2      LEU  26 -19.098  14.896 -13.917
  193    HB3  LEU  26           HB3      LEU  26 -19.085  13.786 -12.545
  194    HG   LEU  26           HG       LEU  26 -17.147  14.791 -11.584
  195   HD11  LEU  26          HD11      LEU  26 -17.067  16.545 -14.049
  196   HD12  LEU  26          HD12      LEU  26 -16.094  16.773 -12.567
  197   HD13  LEU  26          HD13      LEU  26 -15.845  15.334 -13.562
  198   HD21  LEU  26          HD21      LEU  26 -19.335  15.915 -11.203
  199   HD22  LEU  26          HD22      LEU  26 -18.001  17.074 -11.180
  200   HD23  LEU  26          HD23      LEU  26 -19.047  16.954 -12.609
  201    H    LEU  27           H        LEU  27 -15.382  12.775 -14.726
  202    HA   LEU  27           HA       LEU  27 -14.601  11.068 -12.396
  203    HB2  LEU  27           HB2      LEU  27 -13.266  11.756 -15.030
  204    HB3  LEU  27           HB3      LEU  27 -12.333  11.110 -13.690
  205    HG   LEU  27           HG       LEU  27 -13.686   9.082 -13.610
  206   HD11  LEU  27          HD11      LEU  27 -15.257   8.542 -15.475
  207   HD12  LEU  27          HD12      LEU  27 -15.869   9.818 -14.424
  208   HD13  LEU  27          HD13      LEU  27 -15.171  10.235 -16.006
  209   HD21  LEU  27          HD21      LEU  27 -11.688   9.199 -15.078
  210   HD22  LEU  27          HD22      LEU  27 -12.916   8.101 -15.725
  211   HD23  LEU  27          HD23      LEU  27 -12.716   9.718 -16.427
  212    H    SER  28           H        SER  28 -13.594  11.859 -10.593
  213    HA   SER  28           HA       SER  28 -12.092  14.400 -10.781
  214    HB2  SER  28           HB2      SER  28 -14.548  14.745 -10.062
  215    HB3  SER  28           HB3      SER  28 -14.085  13.925  -8.557
  216    HG   SER  28           HG       SER  28 -13.269  16.387  -9.653
  217    H    GLU  29           H        GLU  29 -10.300  14.475  -9.523
  218    HA   GLU  29           HA       GLU  29  -9.794  12.259  -7.582
  219    HB2  GLU  29           HB2      GLU  29  -7.806  13.195  -9.672
  220    HB3  GLU  29           HB3      GLU  29  -7.668  11.834  -8.541
  221    HG2  GLU  29           HG2      GLU  29  -9.481  10.653  -9.695
  222    HG3  GLU  29           HG3      GLU  29  -9.680  11.990 -10.824
  223    H    GLU  30           H        GLU  30  -8.759  12.864  -5.714
  224    HA   GLU  30           HA       GLU  30  -7.700  15.672  -5.462
  225    HB2  GLU  30           HB2      GLU  30  -8.667  13.909  -3.194
  226    HB3  GLU  30           HB3      GLU  30  -8.274  15.616  -3.123
  227    HG2  GLU  30           HG2      GLU  30 -10.647  14.482  -4.635
  228    HG3  GLU  30           HG3      GLU  30 -10.687  14.901  -2.935
  229    H    GLN  31           H        GLN  31  -5.583  15.856  -4.587
  230    HA   GLN  31           HA       GLN  31  -4.260  13.306  -3.733
  231    HB2  GLN  31           HB2      GLN  31  -3.014  15.920  -4.650
  232    HB3  GLN  31           HB3      GLN  31  -2.119  14.523  -4.010
  233    HG2  GLN  31           HG2      GLN  31  -3.145  13.099  -5.794
  234    HG3  GLN  31           HG3      GLN  31  -3.737  14.592  -6.584
  235   HE21  GLN  31          HE22      GLN  31  -1.166  12.512  -5.808
  236   HE22  GLN  31          HE21      GLN  31  -0.036  13.743  -5.675
  237    H    VAL  32           H        VAL  32  -4.167  12.961  -1.618
  238    HA   VAL  32           HA       VAL  32  -4.451  15.266   0.272
  239    HB   VAL  32           HB       VAL  32  -6.095  14.179   1.507
  240   HG11  VAL  32          HG11      VAL  32  -6.919  13.495  -1.342
  241   HG12  VAL  32          HG12      VAL  32  -7.960  13.930   0.026
  242   HG13  VAL  32          HG13      VAL  32  -6.889  15.148  -0.693
  243   HG21  VAL  32          HG21      VAL  32  -5.282  11.859   1.549
  244   HG22  VAL  32          HG22      VAL  32  -6.972  11.927   1.086
  245   HG23  VAL  32          HG23      VAL  32  -5.729  11.657  -0.159
  246    H    ASP  33           H        ASP  33  -3.757  14.840   2.491
  247    HA   ASP  33           HA       ASP  33  -1.301  13.222   2.558
  248    HB2  ASP  33           HB2      ASP  33  -2.649  14.678   4.845
  249    HB3  ASP  33           HB3      ASP  33  -1.015  14.023   4.823
  250    H    VAL  34           H        VAL  34  -0.903  11.469   3.868
  251    HA   VAL  34           HA       VAL  34  -2.807   9.461   3.836
  252    HB   VAL  34           HB       VAL  34  -0.387   9.156   3.849
  253   HG11  VAL  34          HG11      VAL  34  -0.508   9.491   6.876
  254   HG12  VAL  34          HG12      VAL  34   0.900   9.043   5.897
  255   HG13  VAL  34          HG13      VAL  34   0.212  10.657   5.738
  256   HG21  VAL  34          HG21      VAL  34  -1.636   7.432   6.008
  257   HG22  VAL  34          HG22      VAL  34  -1.945   7.239   4.270
  258   HG23  VAL  34          HG23      VAL  34  -0.304   7.029   4.911
  259    H    GLU  35           H        GLU  35  -2.584  11.765   6.442
  260    HA   GLU  35           HA       GLU  35  -4.170  10.143   8.308
  261    HB2  GLU  35           HB2      GLU  35  -2.449  12.059   8.809
  262    HB3  GLU  35           HB3      GLU  35  -3.802  13.134   8.471
  263    HG2  GLU  35           HG2      GLU  35  -3.732  12.813  10.834
  264    HG3  GLU  35           HG3      GLU  35  -5.113  11.876  10.266
  265    H    LEU  36           H        LEU  36  -4.957  12.152   5.565
  266    HA   LEU  36           HA       LEU  36  -7.654  12.849   6.489
  267    HB2  LEU  36           HB2      LEU  36  -6.302  13.405   3.832
  268    HB3  LEU  36           HB3      LEU  36  -7.707  14.220   4.507
  269    HG   LEU  36           HG       LEU  36  -4.851  14.406   5.561
  270   HD11  LEU  36          HD11      LEU  36  -6.591  16.487   4.187
  271   HD12  LEU  36          HD12      LEU  36  -4.922  16.699   4.755
  272   HD13  LEU  36          HD13      LEU  36  -5.272  15.592   3.415
  273   HD21  LEU  36          HD21      LEU  36  -5.698  16.206   7.021
  274   HD22  LEU  36          HD22      LEU  36  -7.358  15.866   6.488
  275   HD23  LEU  36          HD23      LEU  36  -6.448  14.659   7.424
  276    H    VAL  37           H        VAL  37  -6.319  10.188   4.967
  277    HA   VAL  37           HA       VAL  37  -8.835   9.369   3.593
  278    HB   VAL  37           HB       VAL  37  -6.923   8.998   2.251
  279   HG11  VAL  37          HG11      VAL  37  -5.053   7.505   2.875
  280   HG12  VAL  37          HG12      VAL  37  -5.104   8.977   3.839
  281   HG13  VAL  37          HG13      VAL  37  -5.668   7.439   4.540
  282   HG21  VAL  37          HG21      VAL  37  -8.624   7.228   2.195
  283   HG22  VAL  37          HG22      VAL  37  -7.002   6.604   1.841
  284   HG23  VAL  37          HG23      VAL  37  -7.729   6.305   3.424
  285    H    GLN  38           H        GLN  38 -10.091   7.666   4.299
  286    HA   GLN  38           HA       GLN  38  -9.330   6.365   6.876
  287    HB2  GLN  38           HB2      GLN  38 -11.501   6.667   7.790
  288    HB3  GLN  38           HB3      GLN  38 -10.797   8.207   7.378
  289    HG2  GLN  38           HG2      GLN  38 -13.055   8.410   6.828
  290    HG3  GLN  38           HG3      GLN  38 -12.269   8.189   5.269
  291   HE21  GLN  38          HE22      GLN  38 -13.787   6.054   7.797
  292   HE22  GLN  38          HE21      GLN  38 -14.652   5.180   6.536
  293    H    ARG  39           H        ARG  39 -10.848   4.470   7.362
  294    HA   ARG  39           HA       ARG  39 -10.255   2.511   5.430
  295    HB2  ARG  39           HB2      ARG  39 -11.161   0.963   7.039
  296    HB3  ARG  39           HB3      ARG  39 -10.324   2.255   7.909
  297    HG2  ARG  39           HG2      ARG  39 -12.642   3.357   8.185
  298    HG3  ARG  39           HG3      ARG  39 -13.314   1.867   7.506
  299    HD2  ARG  39           HD2      ARG  39 -12.320   0.558   9.353
  300    HD3  ARG  39           HD3      ARG  39 -11.571   2.041   9.976
  301    HE   ARG  39           HE       ARG  39 -13.616   2.723  10.871
  302   HH11  ARG  39          HH11      ARG  39 -14.374   0.112   8.592
  303   HH12  ARG  39          HH12      ARG  39 -15.999  -0.001   9.223
  304   HH21  ARG  39          HH21      ARG  39 -15.782   2.559  11.443
  305   HH22  ARG  39          HH22      ARG  39 -16.819   1.579  10.434
  306    H    GLY  40           H        GLY  40 -12.307   4.431   4.346
  307    HA2  GLY  40           HA2      GLY  40 -13.977   2.437   2.968
  308    HA3  GLY  40           HA3      GLY  40 -14.832   3.704   3.871
  309    H    ASP  41           H        ASP  41 -11.831   3.766   1.928
  310    HA   ASP  41           HA       ASP  41 -13.010   5.709   0.004
  311    HB2  ASP  41           HB2      ASP  41 -10.349   5.928   1.458
  312    HB3  ASP  41           HB3      ASP  41 -10.690   6.784  -0.044
  313    H    ILE  42           H        ILE  42 -11.903   5.694  -2.108
  314    HA   ILE  42           HA       ILE  42 -10.375   3.184  -2.649
  315    HB   ILE  42           HB       ILE  42 -12.422   4.476  -4.468
  316   HG12  ILE  42          HG12      ILE  42 -12.238   1.756  -3.080
  317   HG13  ILE  42          HG13      ILE  42 -13.380   3.046  -2.706
  318   HG21  ILE  42          HG21      ILE  42 -10.525   2.140  -5.023
  319   HG22  ILE  42          HG22      ILE  42 -11.799   2.735  -6.114
  320   HG23  ILE  42          HG23      ILE  42 -10.424   3.754  -5.769
  321   HD11  ILE  42          HD11      ILE  42 -14.371   2.771  -5.003
  322   HD12  ILE  42          HD12      ILE  42 -13.329   1.342  -5.226
  323   HD13  ILE  42          HD13      ILE  42 -14.534   1.355  -3.939
  324    H    ILE  43           H        ILE  43  -8.381   3.469  -3.252
  325    HA   ILE  43           HA       ILE  43  -7.469   6.175  -3.988
  326    HB   ILE  43           HB       ILE  43  -6.025   3.830  -2.700
  327   HG12  ILE  43          HG12      ILE  43  -7.746   4.493  -1.151
  328   HG13  ILE  43          HG13      ILE  43  -6.185   5.011  -0.555
  329   HG21  ILE  43          HG21      ILE  43  -5.198   6.745  -2.985
  330   HG22  ILE  43          HG22      ILE  43  -4.350   5.525  -2.008
  331   HG23  ILE  43          HG23      ILE  43  -4.442   5.343  -3.758
  332   HD11  ILE  43          HD11      ILE  43  -8.181   6.845  -1.957
  333   HD12  ILE  43          HD12      ILE  43  -7.978   6.698  -0.218
  334   HD13  ILE  43          HD13      ILE  43  -6.647   7.335  -1.203
  335    H    LYS  44           H        LYS  44  -6.587   6.542  -5.940
  336    HA   LYS  44           HA       LYS  44  -5.633   4.352  -7.678
  337    HB2  LYS  44           HB2      LYS  44  -6.647   6.120  -8.853
  338    HB3  LYS  44           HB3      LYS  44  -5.838   7.358  -7.902
  339    HG2  LYS  44           HG2      LYS  44  -4.961   7.349 -10.136
  340    HG3  LYS  44           HG3      LYS  44  -3.712   6.924  -8.994
  341    HD2  LYS  44           HD2      LYS  44  -3.381   5.522 -10.879
  342    HD3  LYS  44           HD3      LYS  44  -4.023   4.489  -9.625
  343    HE2  LYS  44           HE2      LYS  44  -5.046   3.899 -11.700
  344    HE3  LYS  44           HE3      LYS  44  -6.283   4.612 -10.664
  345    HZ1  LYS  44           HZ1      LYS  44  -4.834   6.258 -12.659
  346    HZ2  LYS  44           HZ2      LYS  44  -6.208   5.375 -13.051
  347    HZ3  LYS  44           HZ3      LYS  44  -6.279   6.558 -11.936
  348    H    VAL  45           H        VAL  45  -3.722   3.413  -7.467
  349    HA   VAL  45           HA       VAL  45  -1.433   4.921  -6.293
  350    HB   VAL  45           HB       VAL  45  -1.958   2.826  -5.212
  351   HG11  VAL  45          HG11      VAL  45  -1.358   1.444  -7.844
  352   HG12  VAL  45          HG12      VAL  45  -1.620   0.668  -6.279
  353   HG13  VAL  45          HG13      VAL  45  -2.943   1.561  -7.034
  354   HG21  VAL  45          HG21      VAL  45   0.412   3.548  -5.300
  355   HG22  VAL  45          HG22      VAL  45   0.260   1.786  -5.295
  356   HG23  VAL  45          HG23      VAL  45   0.642   2.635  -6.807
  357    H    VAL  46           H        VAL  46   0.088   5.719  -7.571
  358    HA   VAL  46           HA       VAL  46  -0.379   5.513 -10.445
  359    HB   VAL  46           HB       VAL  46   1.145   7.387 -10.677
  360   HG11  VAL  46          HG11      VAL  46  -0.209   9.053  -9.548
  361   HG12  VAL  46          HG12      VAL  46  -1.254   7.754 -10.138
  362   HG13  VAL  46          HG13      VAL  46  -0.843   7.849  -8.411
  363   HG21  VAL  46          HG21      VAL  46   1.529   7.248  -7.652
  364   HG22  VAL  46          HG22      VAL  46   2.773   6.954  -8.894
  365   HG23  VAL  46          HG23      VAL  46   2.064   8.560  -8.715
  366    HA   PRO  47           HA       PRO  47   3.121   2.965 -11.569
  367    HB2  PRO  47           HB2      PRO  47   3.633   4.978 -13.755
  368    HB3  PRO  47           HB3      PRO  47   3.560   3.194 -13.862
  369    HG2  PRO  47           HG2      PRO  47   1.463   4.685 -14.690
  370    HG3  PRO  47           HG3      PRO  47   1.151   3.239 -13.670
  371    HD2  PRO  47           HD2      PRO  47   1.331   6.139 -12.790
  372    HD3  PRO  47           HD3      PRO  47   0.073   4.917 -12.417
  373    H    GLY  48           H        GLY  48   5.154   2.868 -10.757
  374    HA2  GLY  48           HA2      GLY  48   7.206   3.502  -9.868
  375    HA3  GLY  48           HA3      GLY  48   6.972   5.142 -10.476
  376    H    GLY  49           H        GLY  49   4.181   4.714  -8.835
  377    HA2  GLY  49           HA2      GLY  49   5.026   6.173  -6.471
  378    HA3  GLY  49           HA3      GLY  49   3.395   5.675  -6.912
  379    H    LYS  50           H        LYS  50   3.645   5.512  -4.452
  380    HA   LYS  50           HA       LYS  50   4.371   2.704  -3.651
  381    HB2  LYS  50           HB2      LYS  50   4.766   5.322  -2.168
  382    HB3  LYS  50           HB3      LYS  50   4.938   3.724  -1.412
  383    HG2  LYS  50           HG2      LYS  50   6.809   3.159  -2.778
  384    HG3  LYS  50           HG3      LYS  50   6.591   4.587  -3.805
  385    HD2  LYS  50           HD2      LYS  50   7.071   6.083  -1.921
  386    HD3  LYS  50           HD3      LYS  50   7.239   4.693  -0.824
  387    HE2  LYS  50           HE2      LYS  50   9.123   3.843  -2.162
  388    HE3  LYS  50           HE3      LYS  50   8.930   5.172  -3.314
  389    HZ1  LYS  50           HZ1      LYS  50   9.717   5.455  -0.455
  390    HZ2  LYS  50           HZ2      LYS  50  10.683   5.612  -1.767
  391    HZ3  LYS  50           HZ3      LYS  50   9.476   6.711  -1.489
  392    H    PHE  51           H        PHE  51   3.230   1.800  -1.906
  393    HA   PHE  51           HA       PHE  51   0.394   2.560  -1.842
  394    HB2  PHE  51           HB2      PHE  51   1.893   0.177  -0.754
  395    HB3  PHE  51           HB3      PHE  51   0.167   0.429  -0.530
  396    HD1  PHE  51           HD2      PHE  51   2.801  -0.089  -3.127
  397    HD2  PHE  51           HD1      PHE  51  -1.411  -0.110  -2.271
  398    HE1  PHE  51           HE2      PHE  51   2.389  -1.124  -5.324
  399    HE2  PHE  51           HE1      PHE  51  -1.819  -1.174  -4.477
  400    HZ   PHE  51           HZ       PHE  51   0.063  -1.667  -6.013
  401    HA   PRO  52           HA       PRO  52   1.043   4.659   2.108
  402    HB2  PRO  52           HB2      PRO  52  -1.417   5.770   2.461
  403    HB3  PRO  52           HB3      PRO  52  -0.310   6.302   1.167
  404    HG2  PRO  52           HG2      PRO  52  -2.641   4.380   0.954
  405    HG3  PRO  52           HG3      PRO  52  -2.229   5.738  -0.124
  406    HD2  PRO  52           HD2      PRO  52  -1.543   3.141  -0.677
  407    HD3  PRO  52           HD3      PRO  52  -0.539   4.534  -1.178
  408    H    VAL  53           H        VAL  53  -1.299   2.090   1.795
  409    HA   VAL  53           HA       VAL  53  -1.256   1.379   4.592
  410    HB   VAL  53           HB       VAL  53  -3.710   1.176   4.824
  411   HG11  VAL  53          HG11      VAL  53  -4.095   3.446   5.559
  412   HG12  VAL  53          HG12      VAL  53  -2.424   2.986   5.934
  413   HG13  VAL  53          HG13      VAL  53  -2.765   4.055   4.559
  414   HG21  VAL  53          HG21      VAL  53  -4.348   1.441   2.429
  415   HG22  VAL  53          HG22      VAL  53  -5.209   2.551   3.514
  416   HG23  VAL  53          HG23      VAL  53  -3.870   3.157   2.522
  417    H    ASP  54           H        ASP  54  -2.603  -0.809   4.783
  418    HA   ASP  54           HA       ASP  54  -1.973  -2.392   2.348
  419    HB2  ASP  54           HB2      ASP  54  -1.796  -4.294   3.568
  420    HB3  ASP  54           HB3      ASP  54  -1.054  -3.101   4.617
  421    H    GLY  55           H        GLY  55  -3.520  -3.810   1.377
  422    HA2  GLY  55           HA2      GLY  55  -6.248  -3.967   2.089
  423    HA3  GLY  55           HA3      GLY  55  -6.075  -2.544   1.069
  424    H    ARG  56           H        ARG  56  -7.622  -3.834  -0.154
  425    HA   ARG  56           HA       ARG  56  -6.365  -5.813  -1.997
  426    HB2  ARG  56           HB2      ARG  56  -8.289  -6.432  -0.504
  427    HB3  ARG  56           HB3      ARG  56  -9.309  -5.347  -1.443
  428    HG2  ARG  56           HG2      ARG  56  -8.963  -6.747  -3.453
  429    HG3  ARG  56           HG3      ARG  56  -7.783  -7.736  -2.569
  430    HD2  ARG  56           HD2      ARG  56  -9.862  -8.935  -2.612
  431    HD3  ARG  56           HD3      ARG  56  -9.519  -8.432  -0.967
  432    HE   ARG  56           HE       ARG  56 -11.266  -6.775  -1.086
  433   HH11  ARG  56          HH11      ARG  56 -11.461  -9.007  -3.798
  434   HH12  ARG  56          HH12      ARG  56 -12.864  -8.210  -4.448
  435   HH21  ARG  56          HH21      ARG  56 -13.114  -5.994  -1.784
  436   HH22  ARG  56          HH22      ARG  56 -13.936  -6.677  -3.160
  437    H    VAL  57           H        VAL  57  -6.600  -5.744  -4.150
  438    HA   VAL  57           HA       VAL  57  -6.905  -3.121  -5.504
  439    HB   VAL  57           HB       VAL  57  -5.997  -5.848  -6.525
  440   HG11  VAL  57          HG11      VAL  57  -6.771  -4.447  -8.364
  441   HG12  VAL  57          HG12      VAL  57  -5.783  -3.086  -7.788
  442   HG13  VAL  57          HG13      VAL  57  -5.022  -4.569  -8.415
  443   HG21  VAL  57          HG21      VAL  57  -4.184  -3.514  -5.852
  444   HG22  VAL  57          HG22      VAL  57  -4.373  -4.965  -4.844
  445   HG23  VAL  57          HG23      VAL  57  -3.711  -5.101  -6.472
  446    H    ILE  58           H        ILE  58  -8.734  -2.732  -6.747
  447    HA   ILE  58           HA       ILE  58 -10.284  -5.067  -7.799
  448    HB   ILE  58           HB       ILE  58 -12.417  -3.705  -7.216
  449   HG12  ILE  58          HG12      ILE  58 -10.615  -2.686  -4.991
  450   HG13  ILE  58          HG13      ILE  58 -11.011  -1.702  -6.417
  451   HG21  ILE  58          HG21      ILE  58 -10.945  -5.096  -4.950
  452   HG22  ILE  58          HG22      ILE  58 -12.696  -4.902  -5.147
  453   HG23  ILE  58          HG23      ILE  58 -11.800  -5.922  -6.271
  454   HD11  ILE  58          HD11      ILE  58 -12.999  -2.728  -4.353
  455   HD12  ILE  58          HD12      ILE  58 -12.492  -1.051  -4.648
  456   HD13  ILE  58          HD13      ILE  58 -13.438  -1.904  -5.871
  457    H    GLU  59           H        GLU  59  -8.385  -3.092  -8.933
  458    HA   GLU  59           HA       GLU  59  -9.648  -3.124 -11.478
  459    HB2  GLU  59           HB2      GLU  59 -10.356  -0.813 -10.251
  460    HB3  GLU  59           HB3      GLU  59  -8.715  -0.361 -10.690
  461    HG2  GLU  59           HG2      GLU  59  -9.979   0.380 -12.489
  462    HG3  GLU  59           HG3      GLU  59  -9.341  -1.137 -13.103
  463    H    GLY  60           H        GLY  60  -7.971  -3.302 -13.035
  464    HA2  GLY  60           HA2      GLY  60  -6.036  -2.435 -14.085
  465    HA3  GLY  60           HA3      GLY  60  -5.401  -1.898 -12.552
  466    H    HIS  61           H        HIS  61  -3.652  -2.860 -14.000
  467    HA   HIS  61           HA       HIS  61  -3.012  -5.662 -13.230
  468    HB2  HIS  61           HB2      HIS  61  -2.470  -6.186 -15.610
  469    HB3  HIS  61           HB3      HIS  61  -4.164  -5.875 -15.293
  470    HD1  HIS  61           HD1      HIS  61  -5.291  -3.930 -16.601
  471    HD2  HIS  61           HD2      HIS  61  -1.114  -4.151 -17.029
  472    HE1  HIS  61           HE1      HIS  61  -4.673  -2.260 -18.417
  473    H    SER  62           H        SER  62  -1.685  -3.387 -12.111
  474    HA   SER  62           HA       SER  62   0.874  -3.080 -13.520
  475    HB2  SER  62           HB2      SER  62  -0.015  -2.154 -10.791
  476    HB3  SER  62           HB3      SER  62   1.623  -1.986 -11.332
  477    HG   SER  62           HG       SER  62   1.038  -0.268 -12.242
  478    H    MET  63           H        MET  63   2.951  -3.583 -12.673
  479    HA   MET  63           HA       MET  63   2.986  -6.073 -11.030
  480    HB2  MET  63           HB2      MET  63   4.166  -6.226 -13.107
  481    HB3  MET  63           HB3      MET  63   5.121  -4.778 -12.746
  482    HG2  MET  63           HG2      MET  63   6.317  -5.835 -11.031
  483    HG3  MET  63           HG3      MET  63   5.149  -7.151 -10.864
  484    HE1  MET  63           HE1      MET  63   5.335  -9.397 -11.874
  485    HE2  MET  63           HE2      MET  63   4.616  -8.652 -13.325
  486    HE3  MET  63           HE3      MET  63   6.029  -9.723 -13.475
  487    H    VAL  64           H        VAL  64   3.832  -6.113  -9.025
  488    HA   VAL  64           HA       VAL  64   4.670  -3.528  -7.762
  489    HB   VAL  64           HB       VAL  64   2.831  -5.705  -6.726
  490   HG11  VAL  64          HG11      VAL  64   3.843  -3.235  -5.260
  491   HG12  VAL  64          HG12      VAL  64   2.487  -4.244  -4.732
  492   HG13  VAL  64          HG13      VAL  64   4.113  -4.934  -4.799
  493   HG21  VAL  64          HG21      VAL  64   1.749  -4.117  -8.275
  494   HG22  VAL  64          HG22      VAL  64   1.187  -3.831  -6.623
  495   HG23  VAL  64          HG23      VAL  64   2.393  -2.752  -7.349
  496    H    ASP  65           H        ASP  65   6.198  -3.480  -6.235
  497    HA   ASP  65           HA       ASP  65   7.995  -5.849  -5.997
  498    HB2  ASP  65           HB2      ASP  65   8.770  -3.754  -7.114
  499    HB3  ASP  65           HB3      ASP  65   8.548  -2.883  -5.598
  500    H    GLU  66           H        GLU  66   7.668  -6.981  -4.193
  501    HA   GLU  66           HA       GLU  66   7.295  -5.602  -1.585
  502    HB2  GLU  66           HB2      GLU  66   5.626  -7.399  -1.019
  503    HB3  GLU  66           HB3      GLU  66   5.138  -6.201  -2.208
  504    HG2  GLU  66           HG2      GLU  66   5.535  -7.806  -4.037
  505    HG3  GLU  66           HG3      GLU  66   6.017  -9.037  -2.851
  506    H    SER  67           H        SER  67   9.611  -7.050  -2.936
  507    HA   SER  67           HA       SER  67  10.295  -9.353  -1.394
  508    HB2  SER  67           HB2      SER  67  12.568  -9.108  -2.205
  509    HB3  SER  67           HB3      SER  67  11.405  -8.936  -3.513
  510    HG   SER  67           HG       SER  67  13.200  -7.384  -3.380
  511    H    LEU  68           H        LEU  68  10.822  -5.957  -0.535
  512    HA   LEU  68           HA       LEU  68  12.452  -6.679   1.817
  513    HB2  LEU  68           HB2      LEU  68  12.792  -4.562   0.729
  514    HB3  LEU  68           HB3      LEU  68  11.111  -4.107   0.891
  515    HG   LEU  68           HG       LEU  68  12.625  -2.857   2.338
  516   HD11  LEU  68          HD11      LEU  68  10.202  -3.356   3.005
  517   HD12  LEU  68          HD12      LEU  68  10.890  -4.443   4.233
  518   HD13  LEU  68          HD13      LEU  68  11.308  -2.730   4.241
  519   HD21  LEU  68          HD21      LEU  68  14.296  -4.559   2.909
  520   HD22  LEU  68          HD22      LEU  68  13.621  -3.790   4.359
  521   HD23  LEU  68          HD23      LEU  68  13.097  -5.420   3.902
  522    H    ILE  69           H        ILE  69   9.097  -5.708   1.238
  523    HA   ILE  69           HA       ILE  69   8.342  -5.597   3.997
  524    HB   ILE  69           HB       ILE  69   6.510  -6.065   1.613
  525   HG12  ILE  69          HG12      ILE  69   7.964  -3.986   1.361
  526   HG13  ILE  69          HG13      ILE  69   6.238  -3.776   1.274
  527   HG21  ILE  69          HG21      ILE  69   6.013  -5.143   4.472
  528   HG22  ILE  69          HG22      ILE  69   4.843  -4.892   3.171
  529   HG23  ILE  69          HG23      ILE  69   5.306  -6.535   3.632
  530   HD11  ILE  69          HD11      ILE  69   7.297  -1.978   2.546
  531   HD12  ILE  69          HD12      ILE  69   6.144  -2.875   3.533
  532   HD13  ILE  69          HD13      ILE  69   7.891  -3.154   3.740
  533    H    THR  70           H        THR  70   7.493  -8.076   1.569
  534    HA   THR  70           HA       THR  70   6.671  -9.955   3.669
  535    HB   THR  70           HB       THR  70   5.773 -11.309   1.902
  536    HG1  THR  70           HG1      THR  70   6.949  -9.436   0.100
  537   HG21  THR  70          HG21      THR  70   4.135  -9.796   0.949
  538   HG22  THR  70          HG22      THR  70   4.451  -9.325   2.624
  539   HG23  THR  70          HG23      THR  70   5.152  -8.385   1.285
  540    H    GLY  71           H        GLY  71   9.574  -9.428   2.014
  541    HA2  GLY  71           HA2      GLY  71  11.594 -10.594   2.197
  542    HA3  GLY  71           HA3      GLY  71  10.770 -11.931   3.002
  543    H    GLU  72           H        GLU  72   9.238 -10.933   0.178
  544    HA   GLU  72           HA       GLU  72   9.555 -13.248  -1.454
  545    HB2  GLU  72           HB2      GLU  72   8.420 -10.518  -1.717
  546    HB3  GLU  72           HB3      GLU  72   9.056 -11.105  -3.230
  547    HG2  GLU  72           HG2      GLU  72   7.011 -12.529  -1.492
  548    HG3  GLU  72           HG3      GLU  72   6.684 -11.625  -2.967
  549    H    ALA  73           H        ALA  73  10.345 -12.870  -3.909
  550    HA   ALA  73           HA       ALA  73  13.004 -11.639  -3.972
  551    HB1  ALA  73           HB1      ALA  73  12.777 -14.645  -4.319
  552    HB2  ALA  73           HB2      ALA  73  14.236 -13.655  -4.548
  553    HB3  ALA  73           HB3      ALA  73  13.510 -13.782  -2.941
  554    H    MET  74           H        MET  74  10.174 -12.037  -5.582
  555    HA   MET  74           HA       MET  74  11.444 -10.949  -7.933
  556    HB2  MET  74           HB2      MET  74  10.338 -12.388  -9.576
  557    HB3  MET  74           HB3      MET  74  11.455 -13.311  -8.576
  558    HG2  MET  74           HG2      MET  74   9.507 -14.074  -7.193
  559    HG3  MET  74           HG3      MET  74   8.435 -13.235  -8.324
  560    HE1  MET  74           HE1      MET  74   8.009 -17.177  -8.818
  561    HE2  MET  74           HE2      MET  74   8.508 -16.359  -7.323
  562    HE3  MET  74           HE3      MET  74   7.183 -15.688  -8.301
  563    HA   PRO  75           HA       PRO  75   7.889  -8.437  -7.392
  564    HB2  PRO  75           HB2      PRO  75   7.551  -7.186  -9.762
  565    HB3  PRO  75           HB3      PRO  75   8.964  -6.901  -8.708
  566    HG2  PRO  75           HG2      PRO  75   8.780  -8.771 -11.090
  567    HG3  PRO  75           HG3      PRO  75  10.044  -7.543 -10.742
  568    HD2  PRO  75           HD2      PRO  75  10.355 -10.181 -10.132
  569    HD3  PRO  75           HD3      PRO  75  11.011  -8.902  -9.071
  570    H    VAL  76           H        VAL  76   5.665  -8.130  -7.911
  571    HA   VAL  76           HA       VAL  76   4.428 -10.694  -8.842
  572    HB   VAL  76           HB       VAL  76   3.448  -8.802  -6.676
  573   HG11  VAL  76          HG11      VAL  76   2.720 -11.661  -7.447
  574   HG12  VAL  76          HG12      VAL  76   2.117 -10.799  -6.024
  575   HG13  VAL  76          HG13      VAL  76   1.679 -10.230  -7.637
  576   HG21  VAL  76          HG21      VAL  76   5.585  -9.778  -5.920
  577   HG22  VAL  76          HG22      VAL  76   4.235 -10.517  -5.065
  578   HG23  VAL  76          HG23      VAL  76   5.012 -11.398  -6.391
  579    H    ALA  77           H        ALA  77   2.908 -10.669 -10.400
  580    HA   ALA  77           HA       ALA  77   1.905  -8.118 -11.461
  581    HB1  ALA  77           HB1      ALA  77   0.806  -9.558 -13.122
  582    HB2  ALA  77           HB2      ALA  77   2.531  -9.948 -12.977
  583    HB3  ALA  77           HB3      ALA  77   1.315 -11.004 -12.224
  584    H    LYS  78           H        LYS  78   0.030  -7.163 -10.967
  585    HA   LYS  78           HA       LYS  78  -1.857  -8.526  -9.098
  586    HB2  LYS  78           HB2      LYS  78  -1.473  -5.572  -9.704
  587    HB3  LYS  78           HB3      LYS  78  -2.535  -6.240  -8.469
  588    HG2  LYS  78           HG2      LYS  78   0.510  -6.524  -8.490
  589    HG3  LYS  78           HG3      LYS  78  -0.392  -5.322  -7.579
  590    HD2  LYS  78           HD2      LYS  78  -1.473  -7.052  -6.248
  591    HD3  LYS  78           HD3      LYS  78  -0.756  -8.330  -7.252
  592    HE2  LYS  78           HE2      LYS  78   1.507  -7.661  -6.536
  593    HE3  LYS  78           HE3      LYS  78   0.819  -6.415  -5.490
  594    HZ1  LYS  78           HZ1      LYS  78   0.284  -9.335  -5.197
  595    HZ2  LYS  78           HZ2      LYS  78   1.366  -8.464  -4.292
  596    HZ3  LYS  78           HZ3      LYS  78  -0.258  -8.168  -4.193
  597    H    LYS  79           H        LYS  79  -4.107  -7.913  -9.239
  598    HA   LYS  79           HA       LYS  79  -5.314  -7.385 -11.862
  599    HB2  LYS  79           HB2      LYS  79  -6.602  -9.500 -11.857
  600    HB3  LYS  79           HB3      LYS  79  -4.890  -9.806 -12.025
  601    HG2  LYS  79           HG2      LYS  79  -4.698 -10.665  -9.799
  602    HG3  LYS  79           HG3      LYS  79  -6.251  -9.977  -9.325
  603    HD2  LYS  79           HD2      LYS  79  -6.512 -12.343  -9.541
  604    HD3  LYS  79           HD3      LYS  79  -7.493 -11.475 -10.709
  605    HE2  LYS  79           HE2      LYS  79  -6.595 -13.338 -11.841
  606    HE3  LYS  79           HE3      LYS  79  -5.752 -11.905 -12.455
  607    HZ1  LYS  79           HZ1      LYS  79  -4.384 -13.934 -11.900
  608    HZ2  LYS  79           HZ2      LYS  79  -3.818 -12.513 -11.301
  609    HZ3  LYS  79           HZ3      LYS  79  -4.601 -13.598 -10.308
  610    HA   PRO  80           HA       PRO  80  -8.652  -6.093  -9.021
  611    HB2  PRO  80           HB2      PRO  80 -10.958  -6.958 -10.295
  612    HB3  PRO  80           HB3      PRO  80 -10.063  -5.479 -10.752
  613    HG2  PRO  80           HG2      PRO  80  -9.846  -8.236 -11.999
  614    HG3  PRO  80           HG3      PRO  80 -10.045  -6.654 -12.822
  615    HD2  PRO  80           HD2      PRO  80  -7.608  -7.768 -12.608
  616    HD3  PRO  80           HD3      PRO  80  -7.807  -6.019 -12.332
  617    H    GLY  81           H        GLY  81  -9.283  -7.159  -7.186
  618    HA2  GLY  81           HA2      GLY  81  -9.792  -8.915  -5.741
  619    HA3  GLY  81           HA3      GLY  81  -9.816 -10.063  -7.082
  620    H    SER  82           H        SER  82  -7.233  -7.813  -5.963
  621    HA   SER  82           HA       SER  82  -5.427 -10.137  -5.324
  622    HB2  SER  82           HB2      SER  82  -5.003  -9.121  -7.576
  623    HB3  SER  82           HB3      SER  82  -4.679  -7.577  -6.783
  624    HG   SER  82           HG       SER  82  -3.214  -9.999  -6.583
  625    H    THR  83           H        THR  83  -3.780  -9.690  -3.587
  626    HA   THR  83           HA       THR  83  -4.614  -7.408  -1.873
  627    HB   THR  83           HB       THR  83  -3.519  -8.590  -0.058
  628    HG1  THR  83           HG1      THR  83  -2.813 -10.726  -0.437
  629   HG21  THR  83          HG21      THR  83  -5.107 -10.413   0.182
  630   HG22  THR  83          HG22      THR  83  -5.934  -9.051  -0.597
  631   HG23  THR  83          HG23      THR  83  -5.415 -10.447  -1.564
  632    H    VAL  84           H        VAL  84  -3.251  -5.957  -0.994
  633    HA   VAL  84           HA       VAL  84  -0.381  -5.981  -1.750
  634    HB   VAL  84           HB       VAL  84  -0.544  -3.504  -2.170
  635   HG11  VAL  84          HG11      VAL  84  -0.298  -5.112  -4.001
  636   HG12  VAL  84          HG12      VAL  84  -2.062  -5.282  -4.116
  637   HG13  VAL  84          HG13      VAL  84  -1.290  -3.730  -4.489
  638   HG21  VAL  84          HG21      VAL  84  -2.795  -3.119  -1.140
  639   HG22  VAL  84          HG22      VAL  84  -2.673  -2.511  -2.790
  640   HG23  VAL  84          HG23      VAL  84  -3.534  -4.022  -2.480
  641    H    ILE  85           H        ILE  85   1.020  -4.793  -0.473
  642    HA   ILE  85           HA       ILE  85  -0.027  -3.927   2.183
  643    HB   ILE  85           HB       ILE  85   2.538  -4.286   2.839
  644   HG12  ILE  85          HG12      ILE  85   3.337  -6.493   2.097
  645   HG13  ILE  85          HG13      ILE  85   2.067  -6.587   0.886
  646   HG21  ILE  85          HG21      ILE  85   0.412  -6.435   2.920
  647   HG22  ILE  85          HG22      ILE  85   1.869  -6.332   3.940
  648   HG23  ILE  85          HG23      ILE  85   0.626  -5.080   4.056
  649   HD11  ILE  85          HD11      ILE  85   4.337  -5.820   0.052
  650   HD12  ILE  85          HD12      ILE  85   3.008  -4.713  -0.330
  651   HD13  ILE  85          HD13      ILE  85   4.111  -4.330   0.992
  652    H    ALA  86           H        ALA  86   0.683  -2.159   3.163
  653    HA   ALA  86           HA       ALA  86   1.391   0.149   1.733
  654    HB1  ALA  86           HB1      ALA  86   0.398   0.059   4.020
  655    HB2  ALA  86           HB2      ALA  86   1.906  -0.554   4.656
  656    HB3  ALA  86           HB3      ALA  86   1.835   1.087   3.964
  657    H    GLY  87           H        GLY  87   3.297   1.195   1.317
  658    HA2  GLY  87           HA2      GLY  87   5.554   1.666   1.291
  659    HA3  GLY  87           HA3      GLY  87   5.871   0.306   2.376
  660    H    SER  88           H        SER  88   4.192  -1.099  -0.127
  661    HA   SER  88           HA       SER  88   6.611  -1.998  -1.542
  662    HB2  SER  88           HB2      SER  88   5.023  -3.226  -3.004
  663    HB3  SER  88           HB3      SER  88   4.946  -3.668  -1.310
  664    HG   SER  88           HG       SER  88   2.983  -2.525  -1.137
  665    H    ILE  89           H        ILE  89   6.846  -1.734  -3.868
  666    HA   ILE  89           HA       ILE  89   6.027   1.007  -4.742
  667    HB   ILE  89           HB       ILE  89   8.234  -0.335  -6.200
  668   HG12  ILE  89          HG12      ILE  89   8.941  -0.966  -3.940
  669   HG13  ILE  89          HG13      ILE  89  10.009   0.185  -4.708
  670   HG21  ILE  89          HG21      ILE  89   9.128   2.001  -6.133
  671   HG22  ILE  89          HG22      ILE  89   7.500   1.904  -6.806
  672   HG23  ILE  89          HG23      ILE  89   7.726   2.488  -5.148
  673   HD11  ILE  89          HD11      ILE  89   7.945   0.975  -2.616
  674   HD12  ILE  89          HD12      ILE  89   9.655   0.638  -2.300
  675   HD13  ILE  89          HD13      ILE  89   9.205   2.007  -3.328
  676    H    ASN  90           H        ASN  90   5.250   1.398  -6.828
  677    HA   ASN  90           HA       ASN  90   4.039  -0.979  -8.145
  678    HB2  ASN  90           HB2      ASN  90   2.654   0.838  -7.027
  679    HB3  ASN  90           HB3      ASN  90   3.244   1.955  -8.249
  680   HD21  ASN  90          HD22      ASN  90   1.397   2.317  -9.514
  681   HD22  ASN  90          HD21      ASN  90   0.476   0.989 -10.212
  682    H    GLN  91           H        GLN  91   3.924  -1.206 -10.370
  683    HA   GLN  91           HA       GLN  91   5.596   0.557 -12.115
  684    HB2  GLN  91           HB2      GLN  91   6.145  -2.017 -11.664
  685    HB3  GLN  91           HB3      GLN  91   4.842  -2.277 -12.813
  686    HG2  GLN  91           HG2      GLN  91   6.826  -2.385 -14.062
  687    HG3  GLN  91           HG3      GLN  91   6.199  -0.799 -14.446
  688   HE21  GLN  91          HE22      GLN  91   7.316   1.090 -13.427
  689   HE22  GLN  91          HE21      GLN  91   8.911   0.917 -12.712
  690    H    ASN  92           H        ASN  92   4.469  -0.241 -14.649
  691    HA   ASN  92           HA       ASN  92   2.166   1.440 -14.661
  692    HB2  ASN  92           HB2      ASN  92   4.092   1.325 -16.297
  693    HB3  ASN  92           HB3      ASN  92   3.454  -0.205 -16.878
  694   HD21  ASN  92          HD22      ASN  92   1.322  -0.209 -17.949
  695   HD22  ASN  92          HD21      ASN  92   0.637   1.311 -18.526
  696    H    GLY  93           H        GLY  93  -0.006   0.889 -15.352
  697    HA2  GLY  93           HA2      GLY  93  -1.355  -1.069 -16.104
  698    HA3  GLY  93           HA3      GLY  93  -0.736  -1.872 -14.660
  699    H    SER  94           H        SER  94  -1.286   1.502 -14.264
  700    HA   SER  94           HA       SER  94  -2.453   2.443 -12.455
  701    HB2  SER  94           HB2      SER  94  -3.961   2.259 -15.041
  702    HB3  SER  94           HB3      SER  94  -4.708   3.082 -13.656
  703    HG   SER  94           HG       SER  94  -3.394   4.417 -15.051
  704    H    LEU  95           H        LEU  95  -2.727   1.111 -10.728
  705    HA   LEU  95           HA       LEU  95  -5.112  -0.624 -10.588
  706    HB2  LEU  95           HB2      LEU  95  -3.019  -0.105  -8.490
  707    HB3  LEU  95           HB3      LEU  95  -4.269  -1.325  -8.398
  708    HG   LEU  95           HG       LEU  95  -1.860  -1.261 -10.234
  709   HD11  LEU  95          HD11      LEU  95  -2.590  -3.099  -7.914
  710   HD12  LEU  95          HD12      LEU  95  -1.117  -3.189  -8.912
  711   HD13  LEU  95          HD13      LEU  95  -1.382  -1.789  -7.869
  712   HD21  LEU  95          HD21      LEU  95  -4.217  -3.155 -10.072
  713   HD22  LEU  95          HD22      LEU  95  -3.497  -2.334 -11.469
  714   HD23  LEU  95          HD23      LEU  95  -2.648  -3.692 -10.683
  715    H    LEU  96           H        LEU  96  -6.768  -0.405  -9.071
  716    HA   LEU  96           HA       LEU  96  -6.736   2.032  -7.352
  717    HB2  LEU  96           HB2      LEU  96  -9.182   1.002  -8.826
  718    HB3  LEU  96           HB3      LEU  96  -9.212   2.075  -7.441
  719    HG   LEU  96           HG       LEU  96  -7.548   3.571  -8.870
  720   HD11  LEU  96          HD11      LEU  96  -9.114   2.096 -11.029
  721   HD12  LEU  96          HD12      LEU  96  -8.144   3.552 -11.270
  722   HD13  LEU  96          HD13      LEU  96  -7.355   2.035 -10.821
  723   HD21  LEU  96          HD21      LEU  96 -10.535   3.409  -9.410
  724   HD22  LEU  96          HD22      LEU  96  -9.747   4.296  -8.087
  725   HD23  LEU  96          HD23      LEU  96  -9.489   4.803  -9.761
  726    H    ILE  97           H        ILE  97  -6.901   1.722  -5.333
  727    HA   ILE  97           HA       ILE  97  -7.268  -1.041  -4.297
  728    HB   ILE  97           HB       ILE  97  -5.877   1.273  -2.927
  729   HG12  ILE  97          HG12      ILE  97  -4.709   1.225  -5.001
  730   HG13  ILE  97          HG13      ILE  97  -3.706   0.548  -3.740
  731   HG21  ILE  97          HG21      ILE  97  -5.528  -1.740  -2.672
  732   HG22  ILE  97          HG22      ILE  97  -4.637  -0.506  -1.759
  733   HG23  ILE  97          HG23      ILE  97  -6.382  -0.687  -1.534
  734   HD11  ILE  97          HD11      ILE  97  -3.535  -0.701  -5.865
  735   HD12  ILE  97          HD12      ILE  97  -4.138  -1.716  -4.537
  736   HD13  ILE  97          HD13      ILE  97  -5.253  -1.111  -5.780
  737    H    CYS  98           H        CYS  98  -8.973  -1.485  -2.909
  738    HA   CYS  98           HA       CYS  98 -10.529   0.758  -1.765
  739    HB2  CYS  98           HB2      CYS  98 -11.888  -1.080  -0.731
  740    HB3  CYS  98           HB3      CYS  98 -11.915  -0.993  -2.492
  741    HG   CYS  98           HG       CYS  98 -11.923  -3.528  -1.376
  742    H    ALA  99           H        ALA  99  -9.464   1.862  -0.213
  743    HA   ALA  99           HA       ALA  99  -7.691   0.546   1.666
  744    HB1  ALA  99           HB1      ALA  99  -7.284   2.829   0.884
  745    HB2  ALA  99           HB2      ALA  99  -8.843   3.367   1.558
  746    HB3  ALA  99           HB3      ALA  99  -7.549   2.818   2.642
  747    H    THR 100           H        THR 100  -8.532  -0.787   3.109
  748    HA   THR 100           HA       THR 100 -10.943  -0.003   4.690
  749    HB   THR 100           HB       THR 100 -11.342  -2.377   5.060
  750    HG1  THR 100           HG1      THR 100  -9.894  -3.715   4.647
  751   HG21  THR 100          HG21      THR 100 -12.439  -1.311   3.145
  752   HG22  THR 100          HG22      THR 100 -11.039  -1.657   2.109
  753   HG23  THR 100          HG23      THR 100 -11.996  -2.987   2.768
  754    H    HIS 101           H        HIS 101  -7.905   0.491   5.193
  755    HA   HIS 101           HA       HIS 101  -7.968  -0.067   8.089
  756    HB2  HIS 101           HB2      HIS 101  -5.559  -0.589   6.297
  757    HB3  HIS 101           HB3      HIS 101  -5.710  -0.942   8.009
  758    HD1  HIS 101           HD1      HIS 101  -6.133  -2.494   4.652
  759    HD2  HIS 101           HD2      HIS 101  -7.278  -3.149   8.641
  760    HE1  HIS 101           HE1      HIS 101  -6.924  -4.911   4.765
  761    H    VAL 102           H        VAL 102  -6.887   1.506   9.265
  762    HA   VAL 102           HA       VAL 102  -5.404   3.646   7.779
  763    HB   VAL 102           HB       VAL 102  -5.531   5.000   9.788
  764   HG11  VAL 102          HG11      VAL 102  -8.261   4.079   8.819
  765   HG12  VAL 102          HG12      VAL 102  -7.817   5.658   9.510
  766   HG13  VAL 102          HG13      VAL 102  -7.147   5.175   7.947
  767   HG21  VAL 102          HG21      VAL 102  -5.828   3.230  11.517
  768   HG22  VAL 102          HG22      VAL 102  -7.081   4.483  11.597
  769   HG23  VAL 102          HG23      VAL 102  -7.457   2.912  10.872
  770    H    GLY 103           H        GLY 103  -3.411   4.495   9.120
  771    HA2  GLY 103           HA2      GLY 103  -1.489   2.510   8.590
  772    HA3  GLY 103           HA3      GLY 103  -1.211   3.975   9.506
  773    H    ALA 104           H        ALA 104  -2.746   3.559  11.798
  774    HA   ALA 104           HA       ALA 104  -1.014   1.932  13.361
  775    HB1  ALA 104           HB1      ALA 104  -3.797   2.992  13.998
  776    HB2  ALA 104           HB2      ALA 104  -2.566   2.499  15.183
  777    HB3  ALA 104           HB3      ALA 104  -2.286   3.916  14.149
  778    H    ASP 105           H        ASP 105  -3.959   0.990  11.659
  779    HA   ASP 105           HA       ASP 105  -4.269  -1.568  13.065
  780    HB2  ASP 105           HB2      ASP 105  -6.076  -0.093  11.839
  781    HB3  ASP 105           HB3      ASP 105  -5.501  -0.916  10.394
  782    H    THR 106           H        THR 106  -2.276  -0.413  10.445
  783    HA   THR 106           HA       THR 106  -2.625  -2.459   8.569
  784    HB   THR 106           HB       THR 106  -0.406  -1.854   7.618
  785    HG1  THR 106           HG1      THR 106  -0.343  -0.003   9.749
  786   HG21  THR 106          HG21      THR 106  -2.349  -0.659   6.879
  787   HG22  THR 106          HG22      THR 106  -2.267   0.435   8.263
  788   HG23  THR 106          HG23      THR 106  -0.979   0.465   7.036
  789    H    THR 107           H        THR 107  -1.679  -4.298   7.933
  790    HA   THR 107           HA       THR 107  -0.524  -6.080   9.872
  791    HB   THR 107           HB       THR 107  -1.802  -6.748   7.849
  792    HG1  THR 107           HG1      THR 107  -0.684  -8.575   7.548
  793   HG21  THR 107          HG21      THR 107   0.809  -6.404   6.324
  794   HG22  THR 107          HG22      THR 107  -0.738  -7.017   5.710
  795   HG23  THR 107          HG23      THR 107  -0.588  -5.314   6.164
  796    H    LEU 108           H        LEU 108   0.985  -3.897   7.520
  797    HA   LEU 108           HA       LEU 108   3.690  -4.489   7.809
  798    HB2  LEU 108           HB2      LEU 108   2.602  -2.806   6.279
  799    HB3  LEU 108           HB3      LEU 108   2.262  -1.785   7.676
  800    HG   LEU 108           HG       LEU 108   4.746  -1.574   8.075
  801   HD11  LEU 108          HD11      LEU 108   4.838  -3.034   5.394
  802   HD12  LEU 108          HD12      LEU 108   6.217  -2.194   6.149
  803   HD13  LEU 108          HD13      LEU 108   5.498  -3.611   6.943
  804   HD21  LEU 108          HD21      LEU 108   5.106   0.025   6.351
  805   HD22  LEU 108          HD22      LEU 108   4.004  -0.774   5.246
  806   HD23  LEU 108          HD23      LEU 108   3.372   0.064   6.698
  807    H    SER 109           H        SER 109   1.616  -2.518   9.980
  808    HA   SER 109           HA       SER 109   3.746  -1.961  11.857
  809    HB2  SER 109           HB2      SER 109   2.222  -0.811  13.138
  810    HB3  SER 109           HB3      SER 109   1.696  -0.528  11.478
  811    HG   SER 109           HG       SER 109   0.165  -2.319  11.851
  812    H    GLN 110           H        GLN 110   1.641  -4.731  11.402
  813    HA   GLN 110           HA       GLN 110   1.840  -5.683  14.156
  814    HB2  GLN 110           HB2      GLN 110  -0.088  -6.237  12.692
  815    HB3  GLN 110           HB3      GLN 110   0.974  -7.140  11.637
  816    HG2  GLN 110           HG2      GLN 110  -0.139  -8.679  13.068
  817    HG3  GLN 110           HG3      GLN 110   1.572  -8.689  13.486
  818   HE21  GLN 110          HE22      GLN 110  -1.520  -7.060  14.387
  819   HE22  GLN 110          HE21      GLN 110  -0.969  -6.727  16.043
  820    H    ILE 111           H        ILE 111   3.500  -6.317  11.087
  821    HA   ILE 111           HA       ILE 111   5.295  -8.345  11.925
  822    HB   ILE 111           HB       ILE 111   5.756  -6.040   9.989
  823   HG12  ILE 111          HG12      ILE 111   5.140  -8.975   9.410
  824   HG13  ILE 111          HG13      ILE 111   3.901  -7.731   9.486
  825   HG21  ILE 111          HG21      ILE 111   7.953  -6.893  10.738
  826   HG22  ILE 111          HG22      ILE 111   7.435  -8.561  10.386
  827   HG23  ILE 111          HG23      ILE 111   7.645  -7.375   9.083
  828   HD11  ILE 111          HD11      ILE 111   5.047  -6.481   7.643
  829   HD12  ILE 111          HD12      ILE 111   6.172  -7.850   7.469
  830   HD13  ILE 111          HD13      ILE 111   4.444  -8.084   7.181
  831    H    VAL 112           H        VAL 112   6.012  -4.798  11.974
  832    HA   VAL 112           HA       VAL 112   8.264  -5.089  13.665
  833    HB   VAL 112           HB       VAL 112   8.211  -2.665  13.946
  834   HG11  VAL 112          HG11      VAL 112   7.609  -3.560  11.086
  835   HG12  VAL 112          HG12      VAL 112   8.441  -2.076  11.582
  836   HG13  VAL 112          HG13      VAL 112   9.188  -3.645  11.904
  837   HG21  VAL 112          HG21      VAL 112   5.639  -2.707  12.347
  838   HG22  VAL 112          HG22      VAL 112   5.748  -2.294  14.077
  839   HG23  VAL 112          HG23      VAL 112   6.536  -1.270  12.872
  840    H    LYS 113           H        LYS 113   4.914  -5.057  14.632
  841    HA   LYS 113           HA       LYS 113   5.501  -4.456  17.455
  842    HB2  LYS 113           HB2      LYS 113   3.084  -5.572  16.047
  843    HB3  LYS 113           HB3      LYS 113   3.238  -5.652  17.804
  844    HG2  LYS 113           HG2      LYS 113   3.583  -3.225  17.954
  845    HG3  LYS 113           HG3      LYS 113   3.437  -3.070  16.203
  846    HD2  LYS 113           HD2      LYS 113   1.255  -4.045  18.105
  847    HD3  LYS 113           HD3      LYS 113   1.361  -2.439  17.363
  848    HE2  LYS 113           HE2      LYS 113   1.401  -3.666  15.100
  849    HE3  LYS 113           HE3      LYS 113   0.900  -5.112  15.998
  850    HZ1  LYS 113           HZ1      LYS 113  -1.028  -3.893  15.095
  851    HZ2  LYS 113           HZ2      LYS 113  -1.075  -3.865  16.736
  852    HZ3  LYS 113           HZ3      LYS 113  -0.569  -2.540  15.894
  853    H    LEU 114           H        LEU 114   5.282  -7.432  15.453
  854    HA   LEU 114           HA       LEU 114   5.726  -9.217  17.682
  855    HB2  LEU 114           HB2      LEU 114   5.508  -9.358  14.694
  856    HB3  LEU 114           HB3      LEU 114   6.333 -10.699  15.490
  857    HG   LEU 114           HG       LEU 114   3.535  -9.724  16.095
  858   HD11  LEU 114          HD11      LEU 114   4.494 -12.124  14.483
  859   HD12  LEU 114          HD12      LEU 114   2.798 -11.767  14.903
  860   HD13  LEU 114          HD13      LEU 114   3.700 -10.675  13.843
  861   HD21  LEU 114          HD21      LEU 114   3.344 -11.995  17.223
  862   HD22  LEU 114          HD22      LEU 114   5.094 -12.203  17.003
  863   HD23  LEU 114          HD23      LEU 114   4.462 -10.911  18.045
  864    H    VAL 115           H        VAL 115   7.974  -7.822  15.206
  865    HA   VAL 115           HA       VAL 115  10.271  -9.260  16.220
  866    HB   VAL 115           HB       VAL 115  10.158  -6.612  14.728
  867   HG11  VAL 115          HG11      VAL 115  12.492  -8.531  15.189
  868   HG12  VAL 115          HG12      VAL 115  12.511  -7.158  14.061
  869   HG13  VAL 115          HG13      VAL 115  12.375  -6.862  15.792
  870   HG21  VAL 115          HG21      VAL 115  10.640  -9.456  13.732
  871   HG22  VAL 115          HG22      VAL 115   9.200  -8.469  13.414
  872   HG23  VAL 115          HG23      VAL 115  10.753  -7.981  12.752
  873    H    GLU 116           H        GLU 116   8.567  -6.519  17.417
  874    HA   GLU 116           HA       GLU 116  10.685  -5.563  19.238
  875    HB2  GLU 116           HB2      GLU 116   9.147  -4.005  18.154
  876    HB3  GLU 116           HB3      GLU 116   7.775  -4.811  18.897
  877    HG2  GLU 116           HG2      GLU 116   8.576  -4.068  21.135
  878    HG3  GLU 116           HG3      GLU 116   9.967  -3.285  20.360
  879    H    GLU 117           H        GLU 117   7.951  -7.849  19.313
  880    HA   GLU 117           HA       GLU 117   7.870  -8.112  22.227
  881    HB2  GLU 117           HB2      GLU 117   6.776  -9.807  19.949
  882    HB3  GLU 117           HB3      GLU 117   6.506 -10.171  21.642
  883    HG2  GLU 117           HG2      GLU 117   5.722  -7.440  20.679
  884    HG3  GLU 117           HG3      GLU 117   4.776  -8.828  20.153
  885    H    ALA 118           H        ALA 118   9.741  -9.617  19.601
  886    HA   ALA 118           HA       ALA 118  10.238 -12.082  20.971
  887    HB1  ALA 118           HB1      ALA 118  11.754 -10.723  18.703
  888    HB2  ALA 118           HB2      ALA 118  11.894 -12.430  19.188
  889    HB3  ALA 118           HB3      ALA 118  10.363 -11.815  18.538
  890    H    GLN 119           H        GLN 119  12.542  -9.350  20.429
  891    HA   GLN 119           HA       GLN 119  14.357  -9.847  22.447
  892    HB2  GLN 119           HB2      GLN 119  13.303  -7.279  21.201
  893    HB3  GLN 119           HB3      GLN 119  14.622  -7.259  22.320
  894    HG2  GLN 119           HG2      GLN 119  16.064  -7.613  20.680
  895    HG3  GLN 119           HG3      GLN 119  15.405  -9.240  20.481
  896   HE21  GLN 119          HE22      GLN 119  14.051  -9.684  18.729
  897   HE22  GLN 119          HE21      GLN 119  13.164  -8.354  17.980
  Start of MODEL   14
    1    H    SER   1           H        SER   1  18.844  -3.522  13.277
    2    HA   SER   1           HA       SER   1  16.464  -2.412  14.601
    3    HB2  SER   1           HB2      SER   1  18.247  -0.742  15.516
    4    HB3  SER   1           HB3      SER   1  18.138  -2.393  16.126
    5    HG   SER   1           HG       SER   1  19.866  -2.980  15.113
    6    H    GLU   2           H        GLU   2  18.711  -1.179  12.030
    7    HA   GLU   2           HA       GLU   2  17.055   1.270  11.737
    8    HB2  GLU   2           HB2      GLU   2  19.174   0.004   9.954
    9    HB3  GLU   2           HB3      GLU   2  18.164   1.348   9.448
   10    HG2  GLU   2           HG2      GLU   2  20.156   2.340  10.189
   11    HG3  GLU   2           HG3      GLU   2  18.948   2.682  11.423
   12    H    ALA   3           H        ALA   3  17.268  -1.950  10.175
   13    HA   ALA   3           HA       ALA   3  15.154  -1.735   8.404
   14    HB1  ALA   3           HB1      ALA   3  15.825  -4.202  10.032
   15    HB2  ALA   3           HB2      ALA   3  15.091  -4.132   8.428
   16    HB3  ALA   3           HB3      ALA   3  16.775  -3.632   8.635
   17    H    LEU   4           H        LEU   4  14.843  -2.063  11.958
   18    HA   LEU   4           HA       LEU   4  12.056  -2.693  11.964
   19    HB2  LEU   4           HB2      LEU   4  13.611  -2.959  13.922
   20    HB3  LEU   4           HB3      LEU   4  13.687  -1.212  14.059
   21    HG   LEU   4           HG       LEU   4  11.292  -1.091  14.587
   22   HD11  LEU   4          HD11      LEU   4  11.461  -4.118  14.446
   23   HD12  LEU   4          HD12      LEU   4  10.088  -3.206  15.138
   24   HD13  LEU   4          HD13      LEU   4  10.475  -3.061  13.417
   25   HD21  LEU   4          HD21      LEU   4  12.934  -1.317  16.412
   26   HD22  LEU   4          HD22      LEU   4  11.401  -2.114  16.804
   27   HD23  LEU   4          HD23      LEU   4  12.807  -3.089  16.311
   28    H    ALA   5           H        ALA   5  13.737   0.431  11.567
   29    HA   ALA   5           HA       ALA   5  11.247   1.991  11.784
   30    HB1  ALA   5           HB1      ALA   5  12.713   3.863  11.161
   31    HB2  ALA   5           HB2      ALA   5  13.383   2.980  12.542
   32    HB3  ALA   5           HB3      ALA   5  14.077   2.753  10.920
   33    H    LYS   6           H        LYS   6  13.489   0.671   9.332
   34    HA   LYS   6           HA       LYS   6  12.647   1.893   7.110
   35    HB2  LYS   6           HB2      LYS   6  14.556   0.291   7.501
   36    HB3  LYS   6           HB3      LYS   6  13.437  -1.025   7.082
   37    HG2  LYS   6           HG2      LYS   6  13.139  -0.113   4.852
   38    HG3  LYS   6           HG3      LYS   6  13.959   1.392   5.295
   39    HD2  LYS   6           HD2      LYS   6  15.503   0.130   3.999
   40    HD3  LYS   6           HD3      LYS   6  16.066   0.072   5.672
   41    HE2  LYS   6           HE2      LYS   6  14.899  -2.198   5.857
   42    HE3  LYS   6           HE3      LYS   6  14.586  -2.091   4.111
   43    HZ1  LYS   6           HZ1      LYS   6  17.249  -2.122   5.428
   44    HZ2  LYS   6           HZ2      LYS   6  16.655  -3.297   4.438
   45    HZ3  LYS   6           HZ3      LYS   6  17.055  -1.814   3.849
   46    H    LEU   7           H        LEU   7  10.904  -0.978   8.375
   47    HA   LEU   7           HA       LEU   7   9.072  -1.434   6.307
   48    HB2  LEU   7           HB2      LEU   7   8.713  -1.416   9.329
   49    HB3  LEU   7           HB3      LEU   7   7.365  -1.770   8.273
   50    HG   LEU   7           HG       LEU   7   8.325  -3.782   9.202
   51   HD11  LEU   7          HD11      LEU   7   8.683  -3.599   6.191
   52   HD12  LEU   7          HD12      LEU   7   8.620  -5.099   7.133
   53   HD13  LEU   7          HD13      LEU   7   7.219  -4.035   7.113
   54   HD21  LEU   7          HD21      LEU   7  10.640  -3.123   9.405
   55   HD22  LEU   7          HD22      LEU   7  10.478  -4.655   8.530
   56   HD23  LEU   7          HD23      LEU   7  10.841  -3.175   7.623
   57    H    ILE   8           H        ILE   8   8.798   1.049   8.827
   58    HA   ILE   8           HA       ILE   8   6.363   2.243   7.783
   59    HB   ILE   8           HB       ILE   8   8.382   3.220   9.823
   60   HG12  ILE   8          HG12      ILE   8   7.272   1.173  10.518
   61   HG13  ILE   8          HG13      ILE   8   6.757   2.535  11.501
   62   HG21  ILE   8          HG21      ILE   8   5.677   4.372   9.086
   63   HG22  ILE   8          HG22      ILE   8   6.569   4.778  10.572
   64   HG23  ILE   8          HG23      ILE   8   7.257   5.177   8.992
   65   HD11  ILE   8          HD11      ILE   8   4.868   1.084  11.048
   66   HD12  ILE   8          HD12      ILE   8   4.603   2.606  10.188
   67   HD13  ILE   8          HD13      ILE   8   5.147   1.158   9.304
   68    H    SER   9           H        SER   9   9.770   2.707   7.075
   69    HA   SER   9           HA       SER   9   9.466   5.368   5.894
   70    HB2  SER   9           HB2      SER   9  11.725   3.339   5.666
   71    HB3  SER   9           HB3      SER   9  11.765   4.999   5.090
   72    HG   SER   9           HG       SER   9  12.784   4.598   7.106
   73    H    LEU  10           H        LEU  10   9.296   1.978   4.751
   74    HA   LEU  10           HA       LEU  10   9.394   2.648   1.948
   75    HB2  LEU  10           HB2      LEU  10   8.470   0.220   3.510
   76    HB3  LEU  10           HB3      LEU  10   7.972   0.413   1.847
   77    HG   LEU  10           HG       LEU  10  10.491   0.772   1.282
   78   HD11  LEU  10          HD11      LEU  10  10.651  -0.727   3.924
   79   HD12  LEU  10          HD12      LEU  10  11.981  -0.550   2.746
   80   HD13  LEU  10          HD13      LEU  10  11.340   0.881   3.558
   81   HD21  LEU  10          HD21      LEU  10   9.220  -1.142   0.487
   82   HD22  LEU  10          HD22      LEU  10  10.790  -1.686   1.067
   83   HD23  LEU  10          HD23      LEU  10   9.337  -1.928   2.071
   84    H    GLN  11           H        GLN  11   6.696   2.788   4.279
   85    HA   GLN  11           HA       GLN  11   4.588   2.749   2.333
   86    HB2  GLN  11           HB2      GLN  11   4.635   3.991   5.098
   87    HB3  GLN  11           HB3      GLN  11   3.204   3.747   4.079
   88    HG2  GLN  11           HG2      GLN  11   3.570   1.298   4.172
   89    HG3  GLN  11           HG3      GLN  11   4.939   1.557   5.263
   90   HE21  GLN  11          HE22      GLN  11   1.342   2.376   5.010
   91   HE22  GLN  11          HE21      GLN  11   1.182   2.296   6.758
   92    H    ALA  12           H        ALA  12   3.392   4.377   1.436
   93    HA   ALA  12           HA       ALA  12   4.914   6.283   0.134
   94    HB1  ALA  12           HB1      ALA  12   1.892   6.196   0.411
   95    HB2  ALA  12           HB2      ALA  12   2.810   6.918  -0.921
   96    HB3  ALA  12           HB3      ALA  12   2.851   5.163  -0.685
   97    H    THR  13           H        THR  13   3.196   6.938   3.149
   98    HA   THR  13           HA       THR  13   3.101   8.757   4.492
   99    HB   THR  13           HB       THR  13   4.950  10.240   2.610
  100    HG1  THR  13           HG1      THR  13   6.559   9.383   3.616
  101   HG21  THR  13          HG21      THR  13   3.945  11.791   4.164
  102   HG22  THR  13          HG22      THR  13   4.246  10.689   5.533
  103   HG23  THR  13          HG23      THR  13   5.599  11.469   4.686
  104    H    GLU  14           H        GLU  14   2.485   9.293   1.083
  105    HA   GLU  14           HA       GLU  14   0.062  10.867   1.761
  106    HB2  GLU  14           HB2      GLU  14   0.467  12.440   0.003
  107    HB3  GLU  14           HB3      GLU  14   1.865  12.409   1.081
  108    HG2  GLU  14           HG2      GLU  14   3.132  11.066  -0.550
  109    HG3  GLU  14           HG3      GLU  14   1.722  10.999  -1.620
  110    H    ALA  15           H        ALA  15  -1.638  10.876   0.067
  111    HA   ALA  15           HA       ALA  15  -1.565   8.634  -1.841
  112    HB1  ALA  15           HB1      ALA  15  -2.345   7.683   0.301
  113    HB2  ALA  15           HB2      ALA  15  -3.632   8.908   0.377
  114    HB3  ALA  15           HB3      ALA  15  -3.632   7.689  -0.915
  115    H    THR  16           H        THR  16  -3.388   8.594  -3.244
  116    HA   THR  16           HA       THR  16  -4.871  11.198  -3.638
  117    HB   THR  16           HB       THR  16  -4.187   9.180  -5.796
  118    HG1  THR  16           HG1      THR  16  -2.420  10.547  -5.163
  119   HG21  THR  16          HG21      THR  16  -5.046  10.990  -7.321
  120   HG22  THR  16          HG22      THR  16  -6.318  10.308  -6.308
  121   HG23  THR  16          HG23      THR  16  -5.603  11.885  -5.895
  122    H    ILE  17           H        ILE  17  -6.910  11.009  -2.828
  123    HA   ILE  17           HA       ILE  17  -8.401   8.438  -2.959
  124    HB   ILE  17           HB       ILE  17  -9.265  11.113  -1.802
  125   HG12  ILE  17          HG12      ILE  17  -8.283   8.755  -0.169
  126   HG13  ILE  17          HG13      ILE  17  -7.275  10.144  -0.570
  127   HG21  ILE  17          HG21      ILE  17 -11.190   9.762  -2.352
  128   HG22  ILE  17          HG22      ILE  17 -10.439   8.311  -1.654
  129   HG23  ILE  17          HG23      ILE  17 -10.992   9.647  -0.627
  130   HD11  ILE  17          HD11      ILE  17  -9.829  10.227   1.083
  131   HD12  ILE  17          HD12      ILE  17  -8.181  10.432   1.654
  132   HD13  ILE  17          HD13      ILE  17  -8.893  11.649   0.575
  133    H    VAL  18           H        VAL  18 -10.173   8.130  -4.339
  134    HA   VAL  18           HA       VAL  18 -11.003  10.445  -6.070
  135    HB   VAL  18           HB       VAL  18 -11.850   8.642  -7.642
  136   HG11  VAL  18          HG11      VAL  18  -8.951   9.402  -7.394
  137   HG12  VAL  18          HG12      VAL  18  -9.646   8.559  -8.804
  138   HG13  VAL  18          HG13      VAL  18 -10.269  10.135  -8.355
  139   HG21  VAL  18          HG21      VAL  18 -11.300   6.669  -6.146
  140   HG22  VAL  18          HG22      VAL  18 -10.617   6.585  -7.781
  141   HG23  VAL  18          HG23      VAL  18  -9.577   7.042  -6.415
  142    H    THR  19           H        THR  19 -12.976  11.119  -6.098
  143    HA   THR  19           HA       THR  19 -15.173   9.576  -4.767
  144    HB   THR  19           HB       THR  19 -14.669  12.564  -4.485
  145    HG1  THR  19           HG1      THR  19 -13.126  11.550  -3.333
  146   HG21  THR  19          HG21      THR  19 -16.301  12.349  -2.606
  147   HG22  THR  19          HG22      THR  19 -17.035  11.992  -4.169
  148   HG23  THR  19          HG23      THR  19 -16.595  10.661  -3.070
  149    H    LEU  20           H        LEU  20 -17.136   9.643  -5.767
  150    HA   LEU  20           HA       LEU  20 -17.160  10.814  -8.461
  151    HB2  LEU  20           HB2      LEU  20 -19.160   8.909  -7.207
  152    HB3  LEU  20           HB3      LEU  20 -18.983   9.330  -8.903
  153    HG   LEU  20           HG       LEU  20 -16.912   7.833  -7.221
  154   HD11  LEU  20          HD11      LEU  20 -18.847   6.883  -9.345
  155   HD12  LEU  20          HD12      LEU  20 -17.551   5.901  -8.625
  156   HD13  LEU  20          HD13      LEU  20 -18.877   6.498  -7.619
  157   HD21  LEU  20          HD21      LEU  20 -15.780   9.086  -8.999
  158   HD22  LEU  20          HD22      LEU  20 -15.798   7.363  -9.382
  159   HD23  LEU  20          HD23      LEU  20 -16.924   8.460 -10.203
  160    H    ASP  21           H        ASP  21 -17.395  13.006  -8.032
  161    HA   ASP  21           HA       ASP  21 -19.580  14.016  -6.394
  162    HB2  ASP  21           HB2      ASP  21 -17.219  15.050  -6.843
  163    HB3  ASP  21           HB3      ASP  21 -17.951  15.718  -8.275
  164    H    SER  22           H        SER  22 -19.666  12.735  -9.431
  165    HA   SER  22           HA       SER  22 -22.431  13.316  -9.712
  166    HB2  SER  22           HB2      SER  22 -20.693  14.416 -11.935
  167    HB3  SER  22           HB3      SER  22 -22.416  14.064 -12.087
  168    HG   SER  22           HG       SER  22 -21.527  15.587  -9.916
  169    H    ASP  23           H        ASP  23 -23.395  11.703 -10.683
  170    HA   ASP  23           HA       ASP  23 -23.205   9.291 -10.611
  171    HB2  ASP  23           HB2      ASP  23 -25.026  10.488 -11.821
  172    HB3  ASP  23           HB3      ASP  23 -24.121  10.318 -13.321
  173    H    ASN  24           H        ASN  24 -20.813   9.007 -10.603
  174    HA   ASN  24           HA       ASN  24 -18.825   8.331 -11.272
  175    HB2  ASN  24           HB2      ASN  24 -18.579   6.208 -12.425
  176    HB3  ASN  24           HB3      ASN  24 -19.818   6.166 -11.191
  177   HD21  ASN  24          HD22      ASN  24 -21.850   5.677 -11.736
  178   HD22  ASN  24          HD21      ASN  24 -22.229   5.011 -13.326
  179    H    ILE  25           H        ILE  25 -20.455  10.126 -13.432
  180    HA   ILE  25           HA       ILE  25 -18.574  10.305 -15.576
  181    HB   ILE  25           HB       ILE  25 -20.034  12.425 -15.945
  182   HG12  ILE  25          HG12      ILE  25 -21.821  11.273 -13.840
  183   HG13  ILE  25          HG13      ILE  25 -20.792  12.700 -13.637
  184   HG21  ILE  25          HG21      ILE  25 -21.815  11.033 -16.906
  185   HG22  ILE  25          HG22      ILE  25 -20.260  10.219 -17.091
  186   HG23  ILE  25          HG23      ILE  25 -21.374   9.699 -15.815
  187   HD11  ILE  25          HD11      ILE  25 -21.994  13.806 -15.512
  188   HD12  ILE  25          HD12      ILE  25 -23.078  12.398 -15.630
  189   HD13  ILE  25          HD13      ILE  25 -23.067  13.382 -14.165
  190    H    LEU  26           H        LEU  26 -18.388  11.451 -12.413
  191    HA   LEU  26           HA       LEU  26 -16.409  13.567 -13.145
  192    HB2  LEU  26           HB2      LEU  26 -18.517  14.646 -12.772
  193    HB3  LEU  26           HB3      LEU  26 -18.760  13.737 -11.279
  194    HG   LEU  26           HG       LEU  26 -17.049  14.967 -10.125
  195   HD11  LEU  26          HD11      LEU  26 -16.573  16.404 -12.742
  196   HD12  LEU  26          HD12      LEU  26 -15.883  16.845 -11.152
  197   HD13  LEU  26          HD13      LEU  26 -15.427  15.315 -11.905
  198   HD21  LEU  26          HD21      LEU  26 -19.297  16.027 -10.297
  199   HD22  LEU  26          HD22      LEU  26 -18.009  17.225 -10.198
  200   HD23  LEU  26          HD23      LEU  26 -18.779  16.882 -11.762
  201    H    LEU  27           H        LEU  27 -14.799  12.469 -12.661
  202    HA   LEU  27           HA       LEU  27 -14.300  11.188  -9.992
  203    HB2  LEU  27           HB2      LEU  27 -12.782  11.089 -12.610
  204    HB3  LEU  27           HB3      LEU  27 -12.019  10.634 -11.092
  205    HG   LEU  27           HG       LEU  27 -13.743   8.935 -10.660
  206   HD11  LEU  27          HD11      LEU  27 -14.759   9.619 -13.450
  207   HD12  LEU  27          HD12      LEU  27 -15.183   8.152 -12.540
  208   HD13  LEU  27          HD13      LEU  27 -15.671   9.728 -11.930
  209   HD21  LEU  27          HD21      LEU  27 -12.964   7.335 -12.345
  210   HD22  LEU  27          HD22      LEU  27 -12.378   8.670 -13.365
  211   HD23  LEU  27          HD23      LEU  27 -11.630   8.356 -11.781
  212    H    SER  28           H        SER  28 -14.569  13.246  -8.923
  213    HA   SER  28           HA       SER  28 -12.393  15.179  -8.968
  214    HB2  SER  28           HB2      SER  28 -14.818  14.656  -7.235
  215    HB3  SER  28           HB3      SER  28 -13.581  15.793  -6.705
  216    HG   SER  28           HG       SER  28 -13.904  17.071  -8.402
  217    H    GLU  29           H        GLU  29 -10.454  15.054  -7.939
  218    HA   GLU  29           HA       GLU  29 -10.003  12.685  -6.201
  219    HB2  GLU  29           HB2      GLU  29  -7.811  14.306  -7.418
  220    HB3  GLU  29           HB3      GLU  29  -7.797  12.664  -6.730
  221    HG2  GLU  29           HG2      GLU  29  -9.042  11.786  -8.547
  222    HG3  GLU  29           HG3      GLU  29  -9.203  13.374  -9.313
  223    H    GLU  30           H        GLU  30  -8.560  12.851  -4.366
  224    HA   GLU  30           HA       GLU  30  -8.005  15.591  -3.274
  225    HB2  GLU  30           HB2      GLU  30  -8.747  13.216  -1.523
  226    HB3  GLU  30           HB3      GLU  30  -8.316  14.837  -1.001
  227    HG2  GLU  30           HG2      GLU  30 -10.355  15.717  -2.119
  228    HG3  GLU  30           HG3      GLU  30 -10.797  14.059  -2.554
  229    H    GLN  31           H        GLN  31  -5.826  15.877  -2.936
  230    HA   GLN  31           HA       GLN  31  -4.060  13.481  -2.731
  231    HB2  GLN  31           HB2      GLN  31  -3.385  16.398  -3.204
  232    HB3  GLN  31           HB3      GLN  31  -2.244  15.057  -3.008
  233    HG2  GLN  31           HG2      GLN  31  -3.808  13.954  -4.935
  234    HG3  GLN  31           HG3      GLN  31  -4.126  15.653  -5.295
  235   HE21  GLN  31          HE21      GLN  31  -1.360  13.373  -4.628
  236   HE22  GLN  31          HE22      GLN  31  -0.382  14.057  -5.902
  237    H    VAL  32           H        VAL  32  -3.505  12.846  -0.724
  238    HA   VAL  32           HA       VAL  32  -3.907  14.705   1.593
  239    HB   VAL  32           HB       VAL  32  -5.112  12.986   2.796
  240   HG11  VAL  32          HG11      VAL  32  -6.484  13.408   0.119
  241   HG12  VAL  32          HG12      VAL  32  -7.238  13.103   1.692
  242   HG13  VAL  32          HG13      VAL  32  -6.390  14.632   1.411
  243   HG21  VAL  32          HG21      VAL  32  -4.221  10.940   1.735
  244   HG22  VAL  32          HG22      VAL  32  -5.981  10.969   1.715
  245   HG23  VAL  32          HG23      VAL  32  -5.086  11.338   0.230
  246    H    ASP  33           H        ASP  33  -3.024  14.107   3.524
  247    HA   ASP  33           HA       ASP  33  -0.522  12.506   3.453
  248    HB2  ASP  33           HB2      ASP  33  -1.867  14.252   5.526
  249    HB3  ASP  33           HB3      ASP  33  -0.606  13.124   5.988
  250    H    VAL  34           H        VAL  34  -0.213  10.552   4.468
  251    HA   VAL  34           HA       VAL  34  -2.320   8.714   4.510
  252    HB   VAL  34           HB       VAL  34   0.097   8.204   4.307
  253   HG11  VAL  34          HG11      VAL  34   0.172   8.331   7.355
  254   HG12  VAL  34          HG12      VAL  34   1.485   7.871   6.275
  255   HG13  VAL  34          HG13      VAL  34   0.907   9.531   6.274
  256   HG21  VAL  34          HG21      VAL  34  -1.602   6.423   4.649
  257   HG22  VAL  34          HG22      VAL  34  -0.012   6.004   5.301
  258   HG23  VAL  34          HG23      VAL  34  -1.308   6.504   6.401
  259    H    GLU  35           H        GLU  35  -1.257  10.716   7.193
  260    HA   GLU  35           HA       GLU  35  -2.749   9.332   9.243
  261    HB2  GLU  35           HB2      GLU  35  -0.657  10.728   9.460
  262    HB3  GLU  35           HB3      GLU  35  -1.650  12.172   9.261
  263    HG2  GLU  35           HG2      GLU  35  -2.762  11.787  11.349
  264    HG3  GLU  35           HG3      GLU  35  -2.213  10.104  11.421
  265    H    LEU  36           H        LEU  36  -3.892  11.150   6.685
  266    HA   LEU  36           HA       LEU  36  -6.334  12.129   8.104
  267    HB2  LEU  36           HB2      LEU  36  -5.219  12.969   5.403
  268    HB3  LEU  36           HB3      LEU  36  -6.524  13.734   6.294
  269    HG   LEU  36           HG       LEU  36  -3.581  13.740   7.103
  270   HD11  LEU  36          HD11      LEU  36  -5.412  15.909   6.007
  271   HD12  LEU  36          HD12      LEU  36  -3.734  16.141   6.534
  272   HD13  LEU  36          HD13      LEU  36  -4.090  15.126   5.125
  273   HD21  LEU  36          HD21      LEU  36  -5.006  13.850   9.100
  274   HD22  LEU  36          HD22      LEU  36  -4.280  15.427   8.773
  275   HD23  LEU  36          HD23      LEU  36  -5.984  15.138   8.353
  276    H    VAL  37           H        VAL  37  -5.392   9.644   5.947
  277    HA   VAL  37           HA       VAL  37  -8.067   9.540   4.666
  278    HB   VAL  37           HB       VAL  37  -6.229   9.147   3.196
  279   HG11  VAL  37          HG11      VAL  37  -4.833   7.107   3.324
  280   HG12  VAL  37          HG12      VAL  37  -4.543   8.210   4.665
  281   HG13  VAL  37          HG13      VAL  37  -5.513   6.742   4.926
  282   HG21  VAL  37          HG21      VAL  37  -8.350   7.960   2.747
  283   HG22  VAL  37          HG22      VAL  37  -6.922   7.124   2.126
  284   HG23  VAL  37          HG23      VAL  37  -7.714   6.526   3.591
  285    H    GLN  38           H        GLN  38  -9.479   7.866   4.890
  286    HA   GLN  38           HA       GLN  38  -9.292   6.256   7.412
  287    HB2  GLN  38           HB2      GLN  38 -11.575   6.771   7.884
  288    HB3  GLN  38           HB3      GLN  38 -10.671   8.258   7.689
  289    HG2  GLN  38           HG2      GLN  38 -12.063   8.963   6.044
  290    HG3  GLN  38           HG3      GLN  38 -11.863   7.479   5.118
  291   HE21  GLN  38          HE22      GLN  38 -13.718   8.867   7.783
  292   HE22  GLN  38          HE21      GLN  38 -14.997   7.646   7.629
  293    H    ARG  39           H        ARG  39 -10.847   4.454   7.576
  294    HA   ARG  39           HA       ARG  39 -10.230   2.621   5.475
  295    HB2  ARG  39           HB2      ARG  39 -10.926   0.944   7.002
  296    HB3  ARG  39           HB3      ARG  39 -10.187   2.220   7.963
  297    HG2  ARG  39           HG2      ARG  39 -12.583   3.092   8.363
  298    HG3  ARG  39           HG3      ARG  39 -13.134   1.599   7.609
  299    HD2  ARG  39           HD2      ARG  39 -11.937   0.274   9.344
  300    HD3  ARG  39           HD3      ARG  39 -11.388   1.780  10.085
  301    HE   ARG  39           HE       ARG  39 -13.405   1.940  11.169
  302   HH11  ARG  39          HH11      ARG  39 -13.961  -0.272   8.488
  303   HH12  ARG  39          HH12      ARG  39 -15.690  -0.290   8.762
  304   HH21  ARG  39          HH21      ARG  39 -15.575   1.628  11.595
  305   HH22  ARG  39          HH22      ARG  39 -16.505   0.526  10.587
  306    H    GLY  40           H        GLY  40 -12.398   4.627   4.721
  307    HA2  GLY  40           HA2      GLY  40 -14.369   2.660   3.582
  308    HA3  GLY  40           HA3      GLY  40 -14.850   4.214   4.253
  309    H    ASP  41           H        ASP  41 -11.931   4.670   2.611
  310    HA   ASP  41           HA       ASP  41 -13.371   5.644   0.176
  311    HB2  ASP  41           HB2      ASP  41 -11.004   6.739   1.723
  312    HB3  ASP  41           HB3      ASP  41 -11.410   7.263   0.097
  313    H    ILE  42           H        ILE  42 -11.821   5.996  -1.719
  314    HA   ILE  42           HA       ILE  42 -10.372   3.426  -2.252
  315    HB   ILE  42           HB       ILE  42 -12.494   4.795  -3.934
  316   HG12  ILE  42          HG12      ILE  42 -12.288   2.109  -2.503
  317   HG13  ILE  42          HG13      ILE  42 -13.418   3.413  -2.167
  318   HG21  ILE  42          HG21      ILE  42 -10.709   2.440  -4.691
  319   HG22  ILE  42          HG22      ILE  42 -12.066   3.090  -5.648
  320   HG23  ILE  42          HG23      ILE  42 -10.650   4.082  -5.384
  321   HD11  ILE  42          HD11      ILE  42 -13.437   1.600  -4.608
  322   HD12  ILE  42          HD12      ILE  42 -14.569   1.607  -3.257
  323   HD13  ILE  42          HD13      ILE  42 -14.521   2.999  -4.363
  324    H    ILE  43           H        ILE  43  -8.404   3.581  -3.073
  325    HA   ILE  43           HA       ILE  43  -7.357   6.249  -3.730
  326    HB   ILE  43           HB       ILE  43  -5.968   3.736  -2.742
  327   HG12  ILE  43          HG12      ILE  43  -7.599   4.197  -1.040
  328   HG13  ILE  43          HG13      ILE  43  -6.005   4.615  -0.463
  329   HG21  ILE  43          HG21      ILE  43  -4.244   5.312  -1.898
  330   HG22  ILE  43          HG22      ILE  43  -4.401   5.346  -3.650
  331   HG23  ILE  43          HG23      ILE  43  -5.105   6.650  -2.678
  332   HD11  ILE  43          HD11      ILE  43  -7.756   6.241   0.202
  333   HD12  ILE  43          HD12      ILE  43  -6.460   7.007  -0.740
  334   HD13  ILE  43          HD13      ILE  43  -8.033   6.651  -1.489
  335    H    LYS  44           H        LYS  44  -6.385   6.684  -5.698
  336    HA   LYS  44           HA       LYS  44  -5.670   4.543  -7.563
  337    HB2  LYS  44           HB2      LYS  44  -4.893   7.480  -7.726
  338    HB3  LYS  44           HB3      LYS  44  -4.887   6.300  -9.028
  339    HG2  LYS  44           HG2      LYS  44  -7.268   7.523  -7.640
  340    HG3  LYS  44           HG3      LYS  44  -6.726   7.796  -9.296
  341    HD2  LYS  44           HD2      LYS  44  -7.948   5.299  -8.130
  342    HD3  LYS  44           HD3      LYS  44  -8.704   6.386  -9.287
  343    HE2  LYS  44           HE2      LYS  44  -6.330   4.549  -9.835
  344    HE3  LYS  44           HE3      LYS  44  -8.002   4.301 -10.358
  345    HZ1  LYS  44           HZ1      LYS  44  -6.210   6.518 -11.241
  346    HZ2  LYS  44           HZ2      LYS  44  -6.728   5.244 -12.136
  347    HZ3  LYS  44           HZ3      LYS  44  -7.788   6.405 -11.658
  348    H    VAL  45           H        VAL  45  -3.741   3.643  -8.029
  349    HA   VAL  45           HA       VAL  45  -1.253   5.058  -7.168
  350    HB   VAL  45           HB       VAL  45  -1.881   3.033  -5.804
  351   HG11  VAL  45          HG11      VAL  45  -0.957   1.482  -8.257
  352   HG12  VAL  45          HG12      VAL  45  -1.304   0.833  -6.651
  353   HG13  VAL  45          HG13      VAL  45  -2.614   1.555  -7.603
  354   HG21  VAL  45          HG21      VAL  45   0.448   2.254  -5.666
  355   HG22  VAL  45          HG22      VAL  45   0.822   2.996  -7.234
  356   HG23  VAL  45          HG23      VAL  45   0.398   4.014  -5.839
  357    H    VAL  46           H        VAL  46   0.316   5.346  -8.635
  358    HA   VAL  46           HA       VAL  46  -0.303   4.584 -11.449
  359    HB   VAL  46           HB       VAL  46   0.900   6.619 -12.070
  360   HG11  VAL  46          HG11      VAL  46  -1.171   7.213  -9.935
  361   HG12  VAL  46          HG12      VAL  46  -0.687   8.250 -11.289
  362   HG13  VAL  46          HG13      VAL  46  -1.521   6.719 -11.605
  363   HG21  VAL  46          HG21      VAL  46   1.670   8.244 -10.458
  364   HG22  VAL  46          HG22      VAL  46   1.230   7.189  -9.108
  365   HG23  VAL  46          HG23      VAL  46   2.546   6.730 -10.210
  366    HA   PRO  47           HA       PRO  47   3.661   2.603 -12.203
  367    HB2  PRO  47           HB2      PRO  47   4.252   4.750 -14.250
  368    HB3  PRO  47           HB3      PRO  47   4.473   2.975 -14.379
  369    HG2  PRO  47           HG2      PRO  47   2.322   4.142 -15.527
  370    HG3  PRO  47           HG3      PRO  47   2.116   2.627 -14.586
  371    HD2  PRO  47           HD2      PRO  47   1.595   5.470 -13.715
  372    HD3  PRO  47           HD3      PRO  47   0.576   4.015 -13.479
  373    H    GLY  48           H        GLY  48   5.444   2.689 -11.091
  374    HA2  GLY  48           HA2      GLY  48   7.396   3.418 -10.072
  375    HA3  GLY  48           HA3      GLY  48   7.091   5.077 -10.627
  376    H    GLY  49           H        GLY  49   4.209   4.430  -9.259
  377    HA2  GLY  49           HA2      GLY  49   4.761   5.770  -6.757
  378    HA3  GLY  49           HA3      GLY  49   3.216   5.135  -7.314
  379    H    LYS  50           H        LYS  50   3.907   4.983  -4.687
  380    HA   LYS  50           HA       LYS  50   4.309   2.050  -4.222
  381    HB2  LYS  50           HB2      LYS  50   5.073   4.330  -2.346
  382    HB3  LYS  50           HB3      LYS  50   5.178   2.604  -2.007
  383    HG2  LYS  50           HG2      LYS  50   7.319   2.966  -2.572
  384    HG3  LYS  50           HG3      LYS  50   6.686   2.499  -4.142
  385    HD2  LYS  50           HD2      LYS  50   6.711   4.835  -4.894
  386    HD3  LYS  50           HD3      LYS  50   7.000   5.387  -3.237
  387    HE2  LYS  50           HE2      LYS  50   9.159   4.010  -3.286
  388    HE3  LYS  50           HE3      LYS  50   8.903   3.811  -5.027
  389    HZ1  LYS  50           HZ1      LYS  50  10.359   5.683  -4.529
  390    HZ2  LYS  50           HZ2      LYS  50   8.968   6.255  -5.212
  391    HZ3  LYS  50           HZ3      LYS  50   9.210   6.393  -3.591
  392    H    PHE  51           H        PHE  51   3.101   1.049  -2.592
  393    HA   PHE  51           HA       PHE  51   0.377   2.050  -2.406
  394    HB2  PHE  51           HB2      PHE  51   1.708  -0.450  -1.343
  395    HB3  PHE  51           HB3      PHE  51   0.008  -0.081  -1.097
  396    HD1  PHE  51           HD1      PHE  51   2.557  -0.979  -3.638
  397    HD2  PHE  51           HD2      PHE  51  -1.619  -0.256  -2.898
  398    HE1  PHE  51           HE1      PHE  51   2.010  -1.970  -5.831
  399    HE2  PHE  51           HE2      PHE  51  -2.173  -1.277  -5.101
  400    HZ   PHE  51           HZ       PHE  51  -0.356  -2.125  -6.572
  401    HA   PRO  52           HA       PRO  52   1.039   3.940   1.623
  402    HB2  PRO  52           HB2      PRO  52  -1.397   5.061   2.071
  403    HB3  PRO  52           HB3      PRO  52  -0.299   5.624   0.779
  404    HG2  PRO  52           HG2      PRO  52  -2.665   3.753   0.517
  405    HG3  PRO  52           HG3      PRO  52  -2.235   5.159  -0.504
  406    HD2  PRO  52           HD2      PRO  52  -1.607   2.560  -1.170
  407    HD3  PRO  52           HD3      PRO  52  -0.593   3.959  -1.636
  408    H    VAL  53           H        VAL  53  -1.434   1.414   1.316
  409    HA   VAL  53           HA       VAL  53  -1.360   0.702   4.100
  410    HB   VAL  53           HB       VAL  53  -3.847   0.687   4.398
  411   HG11  VAL  53          HG11      VAL  53  -2.590   3.452   4.308
  412   HG12  VAL  53          HG12      VAL  53  -3.968   2.922   5.294
  413   HG13  VAL  53          HG13      VAL  53  -2.356   2.255   5.597
  414   HG21  VAL  53          HG21      VAL  53  -4.475   1.206   2.025
  415   HG22  VAL  53          HG22      VAL  53  -5.226   2.271   3.232
  416   HG23  VAL  53          HG23      VAL  53  -3.855   2.860   2.277
  417    H    ASP  54           H        ASP  54  -3.012  -1.314   4.334
  418    HA   ASP  54           HA       ASP  54  -2.455  -2.973   1.916
  419    HB2  ASP  54           HB2      ASP  54  -2.136  -4.818   3.118
  420    HB3  ASP  54           HB3      ASP  54  -1.526  -3.627   4.246
  421    H    GLY  55           H        GLY  55  -4.015  -4.297   0.925
  422    HA2  GLY  55           HA2      GLY  55  -6.743  -4.466   1.677
  423    HA3  GLY  55           HA3      GLY  55  -6.579  -2.981   0.757
  424    H    ARG  56           H        ARG  56  -8.200  -4.089  -0.540
  425    HA   ARG  56           HA       ARG  56  -7.163  -6.074  -2.501
  426    HB2  ARG  56           HB2      ARG  56  -9.093  -6.688  -1.099
  427    HB3  ARG  56           HB3      ARG  56 -10.007  -5.315  -1.732
  428    HG2  ARG  56           HG2      ARG  56 -10.026  -6.291  -3.970
  429    HG3  ARG  56           HG3      ARG  56  -8.927  -7.591  -3.456
  430    HD2  ARG  56           HD2      ARG  56 -10.594  -8.463  -1.911
  431    HD3  ARG  56           HD3      ARG  56 -11.700  -7.136  -2.278
  432    HE   ARG  56           HE       ARG  56 -10.979  -9.448  -4.012
  433   HH11  ARG  56          HH11      ARG  56 -12.994  -6.538  -3.726
  434   HH12  ARG  56          HH12      ARG  56 -14.051  -7.068  -5.000
  435   HH21  ARG  56          HH21      ARG  56 -12.315 -10.007  -5.628
  436   HH22  ARG  56          HH22      ARG  56 -13.502  -8.869  -6.215
  437    H    VAL  57           H        VAL  57  -7.369  -5.843  -4.637
  438    HA   VAL  57           HA       VAL  57  -7.692  -3.094  -5.756
  439    HB   VAL  57           HB       VAL  57  -5.992  -5.425  -6.746
  440   HG11  VAL  57          HG11      VAL  57  -6.091  -2.523  -7.674
  441   HG12  VAL  57          HG12      VAL  57  -4.931  -3.753  -8.218
  442   HG13  VAL  57          HG13      VAL  57  -6.631  -3.945  -8.603
  443   HG21  VAL  57          HG21      VAL  57  -5.024  -4.589  -4.689
  444   HG22  VAL  57          HG22      VAL  57  -4.056  -4.000  -6.042
  445   HG23  VAL  57          HG23      VAL  57  -5.206  -2.908  -5.234
  446    H    ILE  58           H        ILE  58  -9.122  -2.773  -7.405
  447    HA   ILE  58           HA       ILE  58 -10.202  -5.112  -8.917
  448    HB   ILE  58           HB       ILE  58 -12.537  -4.176  -8.640
  449   HG12  ILE  58          HG12      ILE  58 -11.382  -2.914  -6.134
  450   HG13  ILE  58          HG13      ILE  58 -11.638  -1.974  -7.617
  451   HG21  ILE  58          HG21      ILE  58 -12.970  -5.436  -6.650
  452   HG22  ILE  58          HG22      ILE  58 -11.732  -6.268  -7.589
  453   HG23  ILE  58          HG23      ILE  58 -11.273  -5.345  -6.140
  454   HD11  ILE  58          HD11      ILE  58 -14.058  -2.592  -7.591
  455   HD12  ILE  58          HD12      ILE  58 -13.812  -3.369  -6.006
  456   HD13  ILE  58          HD13      ILE  58 -13.551  -1.625  -6.199
  457    H    GLU  59           H        GLU  59  -8.350  -3.091  -9.819
  458    HA   GLU  59           HA       GLU  59  -9.590  -2.830 -12.405
  459    HB2  GLU  59           HB2      GLU  59 -10.382  -0.682 -11.176
  460    HB3  GLU  59           HB3      GLU  59  -8.677  -0.250 -11.096
  461    HG2  GLU  59           HG2      GLU  59  -9.539   0.939 -12.881
  462    HG3  GLU  59           HG3      GLU  59  -8.567  -0.326 -13.609
  463    H    GLY  60           H        GLY  60  -7.993  -3.120 -13.879
  464    HA2  GLY  60           HA2      GLY  60  -6.087  -2.529 -15.041
  465    HA3  GLY  60           HA3      GLY  60  -5.466  -1.687 -13.629
  466    H    HIS  61           H        HIS  61  -3.557  -2.677 -14.589
  467    HA   HIS  61           HA       HIS  61  -2.873  -5.293 -13.394
  468    HB2  HIS  61           HB2      HIS  61  -2.021  -6.127 -15.665
  469    HB3  HIS  61           HB3      HIS  61  -3.725  -6.235 -15.281
  470    HD1  HIS  61           HD1      HIS  61  -5.432  -4.861 -16.782
  471    HD2  HIS  61           HD2      HIS  61  -1.344  -4.411 -17.700
  472    HE1  HIS  61           HE1      HIS  61  -5.326  -3.638 -19.022
  473    H    SER  62           H        SER  62  -1.092  -5.007 -12.368
  474    HA   SER  62           HA       SER  62   1.221  -3.808 -13.695
  475    HB2  SER  62           HB2      SER  62  -0.235  -2.276 -11.787
  476    HB3  SER  62           HB3      SER  62   1.211  -2.848 -10.955
  477    HG   SER  62           HG       SER  62   1.101  -0.828 -12.387
  478    H    MET  63           H        MET  63   3.267  -4.245 -12.719
  479    HA   MET  63           HA       MET  63   3.264  -6.710 -11.061
  480    HB2  MET  63           HB2      MET  63   4.116  -7.064 -13.272
  481    HB3  MET  63           HB3      MET  63   5.213  -5.686 -13.144
  482    HG2  MET  63           HG2      MET  63   6.609  -6.745 -11.647
  483    HG3  MET  63           HG3      MET  63   5.402  -7.946 -11.149
  484    HE1  MET  63           HE1      MET  63   4.294  -9.423 -13.528
  485    HE2  MET  63           HE2      MET  63   5.522 -10.664 -13.848
  486    HE3  MET  63           HE3      MET  63   5.094 -10.256 -12.173
  487    H    VAL  64           H        VAL  64   4.050  -6.603  -9.118
  488    HA   VAL  64           HA       VAL  64   5.030  -3.998  -8.119
  489    HB   VAL  64           HB       VAL  64   3.342  -6.147  -6.804
  490   HG11  VAL  64          HG11      VAL  64   4.210  -3.436  -5.716
  491   HG12  VAL  64          HG12      VAL  64   2.980  -4.491  -4.992
  492   HG13  VAL  64          HG13      VAL  64   4.650  -5.041  -5.077
  493   HG21  VAL  64          HG21      VAL  64   2.071  -4.892  -8.484
  494   HG22  VAL  64          HG22      VAL  64   1.573  -4.381  -6.870
  495   HG23  VAL  64          HG23      VAL  64   2.659  -3.351  -7.823
  496    H    ASP  65           H        ASP  65   6.809  -3.792  -6.774
  497    HA   ASP  65           HA       ASP  65   8.424  -6.238  -6.306
  498    HB2  ASP  65           HB2      ASP  65   9.530  -4.312  -7.350
  499    HB3  ASP  65           HB3      ASP  65   9.183  -3.331  -5.921
  500    H    GLU  66           H        GLU  66   7.573  -7.317  -4.632
  501    HA   GLU  66           HA       GLU  66   6.905  -5.990  -2.083
  502    HB2  GLU  66           HB2      GLU  66   6.774  -8.931  -2.785
  503    HB3  GLU  66           HB3      GLU  66   5.992  -8.081  -1.432
  504    HG2  GLU  66           HG2      GLU  66   4.571  -6.862  -3.077
  505    HG3  GLU  66           HG3      GLU  66   5.252  -7.871  -4.364
  506    H    SER  67           H        SER  67   9.794  -6.871  -3.292
  507    HA   SER  67           HA       SER  67  11.104  -8.785  -2.086
  508    HB2  SER  67           HB2      SER  67  12.020  -7.171  -3.685
  509    HB3  SER  67           HB3      SER  67  12.169  -5.952  -2.410
  510    HG   SER  67           HG       SER  67  14.032  -7.358  -3.064
  511    H    LEU  68           H        LEU  68  10.712  -5.668  -0.304
  512    HA   LEU  68           HA       LEU  68  12.211  -6.786   1.972
  513    HB2  LEU  68           HB2      LEU  68  12.438  -4.449   1.179
  514    HB3  LEU  68           HB3      LEU  68  10.741  -4.146   1.455
  515    HG   LEU  68           HG       LEU  68  12.323  -3.058   3.008
  516   HD11  LEU  68          HD11      LEU  68   9.951  -3.405   3.649
  517   HD12  LEU  68          HD12      LEU  68  10.435  -4.856   4.542
  518   HD13  LEU  68          HD13      LEU  68  11.074  -3.283   5.010
  519   HD21  LEU  68          HD21      LEU  68  12.768  -5.801   4.220
  520   HD22  LEU  68          HD22      LEU  68  13.964  -4.843   3.314
  521   HD23  LEU  68          HD23      LEU  68  13.333  -4.249   4.862
  522    H    ILE  69           H        ILE  69   8.861  -6.422   1.076
  523    HA   ILE  69           HA       ILE  69   7.787  -6.564   3.781
  524    HB   ILE  69           HB       ILE  69   6.247  -6.887   1.178
  525   HG12  ILE  69          HG12      ILE  69   7.591  -4.815   0.929
  526   HG13  ILE  69          HG13      ILE  69   5.862  -4.573   0.950
  527   HG21  ILE  69          HG21      ILE  69   4.456  -5.784   2.600
  528   HG22  ILE  69          HG22      ILE  69   4.937  -7.409   3.122
  529   HG23  ILE  69          HG23      ILE  69   5.526  -5.983   3.993
  530   HD11  ILE  69          HD11      ILE  69   7.620  -4.096   3.384
  531   HD12  ILE  69          HD12      ILE  69   7.101  -2.845   2.226
  532   HD13  ILE  69          HD13      ILE  69   5.891  -3.705   3.181
  533    H    THR  70           H        THR  70   7.415  -8.701   0.903
  534    HA   THR  70           HA       THR  70   6.668 -10.963   2.671
  535    HB   THR  70           HB       THR  70   5.842 -11.995   0.588
  536    HG1  THR  70           HG1      THR  70   5.734 -10.446  -1.210
  537   HG21  THR  70          HG21      THR  70   4.821  -9.134   0.865
  538   HG22  THR  70          HG22      THR  70   3.950 -10.539   0.219
  539   HG23  THR  70          HG23      THR  70   4.359 -10.476   1.939
  540    H    GLY  71           H        GLY  71   9.435  -9.879   1.156
  541    HA2  GLY  71           HA2      GLY  71  11.565 -10.752   1.240
  542    HA3  GLY  71           HA3      GLY  71  10.929 -12.249   1.941
  543    H    GLU  72           H        GLU  72   9.468 -11.283  -0.956
  544    HA   GLU  72           HA       GLU  72  10.200 -13.678  -2.382
  545    HB2  GLU  72           HB2      GLU  72   8.912 -11.120  -3.399
  546    HB3  GLU  72           HB3      GLU  72   9.152 -12.549  -4.405
  547    HG2  GLU  72           HG2      GLU  72   7.559 -12.550  -1.812
  548    HG3  GLU  72           HG3      GLU  72   6.860 -12.353  -3.424
  549    H    ALA  73           H        ALA  73  11.162 -10.343  -3.281
  550    HA   ALA  73           HA       ALA  73  12.991  -9.436  -4.153
  551    HB1  ALA  73           HB1      ALA  73  15.200 -10.388  -3.941
  552    HB2  ALA  73           HB2      ALA  73  14.301 -10.565  -2.426
  553    HB3  ALA  73           HB3      ALA  73  14.520 -11.969  -3.492
  554    H    MET  74           H        MET  74  11.028 -10.668  -5.549
  555    HA   MET  74           HA       MET  74  11.942 -10.582  -8.242
  556    HB2  MET  74           HB2      MET  74  10.798 -12.762  -8.832
  557    HB3  MET  74           HB3      MET  74  12.412 -12.884  -8.134
  558    HG2  MET  74           HG2      MET  74  11.345 -13.451  -5.937
  559    HG3  MET  74           HG3      MET  74   9.774 -13.414  -6.715
  560    HE1  MET  74           HE1      MET  74  13.082 -15.234  -6.060
  561    HE2  MET  74           HE2      MET  74  13.074 -16.613  -7.182
  562    HE3  MET  74           HE3      MET  74  13.338 -14.972  -7.800
  563    HA   PRO  75           HA       PRO  75   8.123  -8.574  -7.537
  564    HB2  PRO  75           HB2      PRO  75   7.500  -7.468  -9.904
  565    HB3  PRO  75           HB3      PRO  75   8.944  -6.999  -8.976
  566    HG2  PRO  75           HG2      PRO  75   8.812  -9.009 -11.254
  567    HG3  PRO  75           HG3      PRO  75   9.932  -7.616 -11.083
  568    HD2  PRO  75           HD2      PRO  75  10.655 -10.131 -10.320
  569    HD3  PRO  75           HD3      PRO  75  11.157  -8.697  -9.372
  570    H    VAL  76           H        VAL  76   5.888  -8.484  -7.870
  571    HA   VAL  76           HA       VAL  76   4.686 -11.101  -8.684
  572    HB   VAL  76           HB       VAL  76   3.864  -9.263  -6.398
  573   HG11  VAL  76          HG11      VAL  76   3.077 -12.132  -7.077
  574   HG12  VAL  76          HG12      VAL  76   2.590 -11.243  -5.621
  575   HG13  VAL  76          HG13      VAL  76   2.026 -10.706  -7.205
  576   HG21  VAL  76          HG21      VAL  76   4.825 -11.029  -4.905
  577   HG22  VAL  76          HG22      VAL  76   5.546 -11.792  -6.329
  578   HG23  VAL  76          HG23      VAL  76   6.054 -10.164  -5.828
  579    H    ALA  77           H        ALA  77   2.988 -11.063 -10.063
  580    HA   ALA  77           HA       ALA  77   2.018  -8.531 -11.118
  581    HB1  ALA  77           HB1      ALA  77   0.883  -9.899 -12.725
  582    HB2  ALA  77           HB2      ALA  77   2.494 -10.580 -12.475
  583    HB3  ALA  77           HB3      ALA  77   1.082 -11.354 -11.722
  584    H    LYS  78           H        LYS  78   0.189  -7.456 -10.724
  585    HA   LYS  78           HA       LYS  78  -1.991  -8.675  -9.061
  586    HB2  LYS  78           HB2      LYS  78  -1.169  -5.751  -9.142
  587    HB3  LYS  78           HB3      LYS  78  -2.403  -6.469  -8.108
  588    HG2  LYS  78           HG2      LYS  78   0.592  -7.034  -7.963
  589    HG3  LYS  78           HG3      LYS  78  -0.298  -5.935  -6.920
  590    HD2  LYS  78           HD2      LYS  78  -1.562  -7.743  -5.924
  591    HD3  LYS  78           HD3      LYS  78  -0.860  -8.931  -7.043
  592    HE2  LYS  78           HE2      LYS  78   1.360  -8.600  -6.133
  593    HE3  LYS  78           HE3      LYS  78   0.820  -7.236  -5.150
  594    HZ1  LYS  78           HZ1      LYS  78  -0.156 -10.019  -4.751
  595    HZ2  LYS  78           HZ2      LYS  78   1.035  -9.279  -3.875
  596    HZ3  LYS  78           HZ3      LYS  78  -0.513  -8.727  -3.828
  597    H    LYS  79           H        LYS  79  -4.114  -7.982  -9.493
  598    HA   LYS  79           HA       LYS  79  -4.832  -6.996 -12.198
  599    HB2  LYS  79           HB2      LYS  79  -5.916  -9.142 -12.737
  600    HB3  LYS  79           HB3      LYS  79  -4.211  -9.391 -12.423
  601    HG2  LYS  79           HG2      LYS  79  -4.778 -10.176 -10.117
  602    HG3  LYS  79           HG3      LYS  79  -6.496  -9.975 -10.473
  603    HD2  LYS  79           HD2      LYS  79  -4.585 -11.803 -11.981
  604    HD3  LYS  79           HD3      LYS  79  -5.641 -12.295 -10.651
  605    HE2  LYS  79           HE2      LYS  79  -7.634 -11.742 -11.953
  606    HE3  LYS  79           HE3      LYS  79  -6.616 -11.165 -13.289
  607    HZ1  LYS  79           HZ1      LYS  79  -6.756 -13.965 -12.298
  608    HZ2  LYS  79           HZ2      LYS  79  -7.245 -13.380 -13.771
  609    HZ3  LYS  79           HZ3      LYS  79  -5.650 -13.436 -13.381
  610    HA   PRO  80           HA       PRO  80  -8.685  -6.098  -9.955
  611    HB2  PRO  80           HB2      PRO  80 -10.778  -6.951 -11.537
  612    HB3  PRO  80           HB3      PRO  80  -9.836  -5.462 -11.851
  613    HG2  PRO  80           HG2      PRO  80  -9.404  -8.212 -13.073
  614    HG3  PRO  80           HG3      PRO  80  -9.543  -6.633 -13.918
  615    HD2  PRO  80           HD2      PRO  80  -7.123  -7.632 -13.393
  616    HD3  PRO  80           HD3      PRO  80  -7.447  -5.909 -13.102
  617    H    GLY  81           H        GLY  81  -9.522  -7.148  -8.247
  618    HA2  GLY  81           HA2      GLY  81 -10.166  -8.858  -6.821
  619    HA3  GLY  81           HA3      GLY  81 -10.171 -10.025  -8.141
  620    H    SER  82           H        SER  82  -7.646  -7.818  -6.864
  621    HA   SER  82           HA       SER  82  -5.902 -10.140  -6.100
  622    HB2  SER  82           HB2      SER  82  -5.235  -9.016  -8.241
  623    HB3  SER  82           HB3      SER  82  -4.956  -7.534  -7.306
  624    HG   SER  82           HG       SER  82  -3.575 -10.005  -7.279
  625    H    THR  83           H        THR  83  -4.263  -9.567  -4.355
  626    HA   THR  83           HA       THR  83  -5.242  -7.361  -2.599
  627    HB   THR  83           HB       THR  83  -4.620  -8.770  -0.658
  628    HG1  THR  83           HG1      THR  83  -4.536 -10.979  -0.973
  629   HG21  THR  83          HG21      THR  83  -6.651 -10.161  -0.707
  630   HG22  THR  83          HG22      THR  83  -6.974  -8.550  -1.366
  631   HG23  THR  83          HG23      THR  83  -6.790  -9.938  -2.460
  632    H    VAL  84           H        VAL  84  -3.796  -6.228  -1.404
  633    HA   VAL  84           HA       VAL  84  -0.918  -6.483  -2.139
  634    HB   VAL  84           HB       VAL  84  -0.826  -4.036  -2.476
  635   HG11  VAL  84          HG11      VAL  84  -2.653  -5.511  -4.408
  636   HG12  VAL  84          HG12      VAL  84  -1.675  -4.071  -4.757
  637   HG13  VAL  84          HG13      VAL  84  -0.880  -5.601  -4.363
  638   HG21  VAL  84          HG21      VAL  84  -2.919  -3.354  -1.332
  639   HG22  VAL  84          HG22      VAL  84  -2.845  -2.768  -2.999
  640   HG23  VAL  84          HG23      VAL  84  -3.868  -4.156  -2.600
  641    H    ILE  85           H        ILE  85   0.567  -5.474  -0.849
  642    HA   ILE  85           HA       ILE  85  -0.304  -4.498   1.820
  643    HB   ILE  85           HB       ILE  85   2.260  -5.064   2.341
  644   HG12  ILE  85          HG12      ILE  85   2.897  -7.287   1.614
  645   HG13  ILE  85          HG13      ILE  85   1.491  -7.419   0.587
  646   HG21  ILE  85          HG21      ILE  85   0.339  -5.681   3.685
  647   HG22  ILE  85          HG22      ILE  85  -0.024  -7.036   2.586
  648   HG23  ILE  85          HG23      ILE  85   1.481  -7.019   3.540
  649   HD11  ILE  85          HD11      ILE  85   3.692  -5.333   0.221
  650   HD12  ILE  85          HD12      ILE  85   3.632  -6.893  -0.629
  651   HD13  ILE  85          HD13      ILE  85   2.373  -5.683  -0.916
  652    H    ALA  86           H        ALA  86   0.670  -2.804   2.752
  653    HA   ALA  86           HA       ALA  86   1.293  -0.598   1.107
  654    HB1  ALA  86           HB1      ALA  86   1.589   0.566   3.205
  655    HB2  ALA  86           HB2      ALA  86   0.272  -0.603   3.414
  656    HB3  ALA  86           HB3      ALA  86   1.861  -0.962   4.077
  657    H    GLY  87           H        GLY  87   3.169   0.608   0.833
  658    HA2  GLY  87           HA2      GLY  87   5.400   1.179   0.851
  659    HA3  GLY  87           HA3      GLY  87   5.758  -0.202   1.899
  660    H    SER  88           H        SER  88   4.147  -1.529  -0.685
  661    HA   SER  88           HA       SER  88   6.627  -2.416  -2.005
  662    HB2  SER  88           HB2      SER  88   5.150  -3.916  -3.232
  663    HB3  SER  88           HB3      SER  88   4.949  -4.088  -1.488
  664    HG   SER  88           HG       SER  88   2.947  -3.237  -1.604
  665    H    ILE  89           H        ILE  89   6.796  -2.319  -4.399
  666    HA   ILE  89           HA       ILE  89   6.064   0.439  -5.279
  667    HB   ILE  89           HB       ILE  89   8.287  -1.088  -6.581
  668   HG12  ILE  89          HG12      ILE  89   8.868  -1.509  -4.270
  669   HG13  ILE  89          HG13      ILE  89   9.979  -0.401  -5.039
  670   HG21  ILE  89          HG21      ILE  89   7.607   1.096  -7.455
  671   HG22  ILE  89          HG22      ILE  89   7.861   1.846  -5.870
  672   HG23  ILE  89          HG23      ILE  89   9.237   1.180  -6.774
  673   HD11  ILE  89          HD11      ILE  89   9.086   1.491  -3.823
  674   HD12  ILE  89          HD12      ILE  89   7.751   0.509  -3.172
  675   HD13  ILE  89          HD13      ILE  89   9.414   0.177  -2.680
  676    H    ASN  90           H        ASN  90   4.852   0.789  -7.064
  677    HA   ASN  90           HA       ASN  90   3.873  -1.525  -8.643
  678    HB2  ASN  90           HB2      ASN  90   2.316   0.021  -7.421
  679    HB3  ASN  90           HB3      ASN  90   2.951   1.377  -8.340
  680   HD21  ASN  90          HD22      ASN  90   1.917   1.825 -10.230
  681   HD22  ASN  90          HD21      ASN  90   0.682   0.771 -10.915
  682    H    GLN  91           H        GLN  91   4.461  -1.835 -10.880
  683    HA   GLN  91           HA       GLN  91   5.603   0.467 -12.323
  684    HB2  GLN  91           HB2      GLN  91   7.399  -0.609 -10.830
  685    HB3  GLN  91           HB3      GLN  91   7.308  -1.999 -11.907
  686    HG2  GLN  91           HG2      GLN  91   9.122  -0.619 -12.649
  687    HG3  GLN  91           HG3      GLN  91   7.826  -0.432 -13.840
  688   HE21  GLN  91          HE22      GLN  91   6.971   1.690 -14.185
  689   HE22  GLN  91          HE21      GLN  91   7.448   3.052 -13.189
  690    H    ASN  92           H        ASN  92   3.723   0.018 -13.600
  691    HA   ASN  92           HA       ASN  92   4.515  -0.900 -16.153
  692    HB2  ASN  92           HB2      ASN  92   4.035  -3.201 -15.379
  693    HB3  ASN  92           HB3      ASN  92   2.444  -2.703 -14.836
  694   HD21  ASN  92          HD22      ASN  92   0.700  -2.846 -16.361
  695   HD22  ASN  92          HD21      ASN  92   1.042  -3.134 -18.070
  696    H    GLY  93           H        GLY  93   1.458  -0.812 -14.346
  697    HA2  GLY  93           HA2      GLY  93   0.412   1.532 -15.862
  698    HA3  GLY  93           HA3      GLY  93  -0.504   0.026 -15.851
  699    H    SER  94           H        SER  94  -1.822   2.089 -14.943
  700    HA   SER  94           HA       SER  94  -1.494   2.497 -12.060
  701    HB2  SER  94           HB2      SER  94  -3.578   3.600 -13.977
  702    HB3  SER  94           HB3      SER  94  -3.334   4.094 -12.291
  703    HG   SER  94           HG       SER  94  -1.889   4.752 -14.550
  704    H    LEU  95           H        LEU  95  -2.779   1.760 -10.432
  705    HA   LEU  95           HA       LEU  95  -5.077  -0.058 -11.042
  706    HB2  LEU  95           HB2      LEU  95  -2.994  -0.198  -8.863
  707    HB3  LEU  95           HB3      LEU  95  -4.333  -1.311  -9.019
  708    HG   LEU  95           HG       LEU  95  -1.941  -1.033 -10.884
  709   HD11  LEU  95          HD11      LEU  95  -1.339  -1.917  -8.671
  710   HD12  LEU  95          HD12      LEU  95  -2.651  -3.115  -8.762
  711   HD13  LEU  95          HD13      LEU  95  -1.272  -3.205  -9.876
  712   HD21  LEU  95          HD21      LEU  95  -2.758  -3.214 -11.745
  713   HD22  LEU  95          HD22      LEU  95  -4.224  -3.050 -10.763
  714   HD23  LEU  95          HD23      LEU  95  -3.884  -1.871 -12.050
  715    H    LEU  96           H        LEU  96  -6.548  -0.375  -9.253
  716    HA   LEU  96           HA       LEU  96  -7.100   2.091  -7.635
  717    HB2  LEU  96           HB2      LEU  96  -8.474   1.636  -9.701
  718    HB3  LEU  96           HB3      LEU  96  -8.960   0.100  -8.976
  719    HG   LEU  96           HG       LEU  96 -10.131   1.333  -7.158
  720   HD11  LEU  96          HD11      LEU  96  -9.414   3.730  -8.882
  721   HD12  LEU  96          HD12      LEU  96 -10.617   3.758  -7.604
  722   HD13  LEU  96          HD13      LEU  96  -8.917   3.463  -7.175
  723   HD21  LEU  96          HD21      LEU  96 -11.297   0.584  -9.224
  724   HD22  LEU  96          HD22      LEU  96 -11.968   2.117  -8.646
  725   HD23  LEU  96          HD23      LEU  96 -10.838   2.113 -10.022
  726    H    ILE  97           H        ILE  97  -6.772   1.667  -5.486
  727    HA   ILE  97           HA       ILE  97  -7.410  -1.053  -4.429
  728    HB   ILE  97           HB       ILE  97  -5.917   1.054  -2.863
  729   HG12  ILE  97          HG12      ILE  97  -3.844  -0.400  -3.570
  730   HG13  ILE  97          HG13      ILE  97  -4.765  -0.718  -5.035
  731   HG21  ILE  97          HG21      ILE  97  -5.894  -1.997  -2.808
  732   HG22  ILE  97          HG22      ILE  97  -5.023  -0.920  -1.699
  733   HG23  ILE  97          HG23      ILE  97  -6.781  -0.956  -1.676
  734   HD11  ILE  97          HD11      ILE  97  -3.096   1.181  -5.098
  735   HD12  ILE  97          HD12      ILE  97  -4.717   1.641  -5.625
  736   HD13  ILE  97          HD13      ILE  97  -4.139   2.088  -3.998
  737    H    CYS  98           H        CYS  98  -9.082  -1.426  -3.099
  738    HA   CYS  98           HA       CYS  98 -10.633   0.822  -1.931
  739    HB2  CYS  98           HB2      CYS  98 -11.064  -2.191  -1.856
  740    HB3  CYS  98           HB3      CYS  98 -12.171  -0.978  -1.197
  741    HG   CYS  98           HG       CYS  98 -12.690   0.228  -3.436
  742    H    ALA  99           H        ALA  99  -9.702   1.727  -0.128
  743    HA   ALA  99           HA       ALA  99  -7.967   0.142   1.600
  744    HB1  ALA  99           HB1      ALA  99  -8.940   3.022   1.780
  745    HB2  ALA  99           HB2      ALA  99  -7.680   2.286   2.789
  746    HB3  ALA  99           HB3      ALA  99  -7.422   2.462   1.040
  747    H    THR 100           H        THR 100  -8.802  -1.227   3.040
  748    HA   THR 100           HA       THR 100 -11.152  -0.375   4.690
  749    HB   THR 100           HB       THR 100 -11.324  -2.380   3.111
  750    HG1  THR 100           HG1      THR 100 -12.488  -3.512   4.892
  751   HG21  THR 100          HG21      THR 100  -9.257  -3.574   3.852
  752   HG22  THR 100          HG22      THR 100 -10.022  -3.846   5.437
  753   HG23  THR 100          HG23      THR 100 -10.729  -4.546   3.970
  754    H    HIS 101           H        HIS 101  -7.983  -0.170   5.036
  755    HA   HIS 101           HA       HIS 101  -8.100  -0.554   7.965
  756    HB2  HIS 101           HB2      HIS 101  -5.677  -1.174   6.238
  757    HB3  HIS 101           HB3      HIS 101  -5.876  -1.479   7.956
  758    HD1  HIS 101           HD1      HIS 101  -6.291  -3.106   4.615
  759    HD2  HIS 101           HD2      HIS 101  -7.551  -3.623   8.599
  760    HE1  HIS 101           HE1      HIS 101  -7.253  -5.459   4.765
  761    H    VAL 102           H        VAL 102  -7.195   1.180   9.077
  762    HA   VAL 102           HA       VAL 102  -5.688   3.261   7.540
  763    HB   VAL 102           HB       VAL 102  -5.518   4.459   9.712
  764   HG11  VAL 102          HG11      VAL 102  -8.362   3.811   8.871
  765   HG12  VAL 102          HG12      VAL 102  -7.808   5.264   9.737
  766   HG13  VAL 102          HG13      VAL 102  -7.262   4.965   8.076
  767   HG21  VAL 102          HG21      VAL 102  -5.775   2.524  11.267
  768   HG22  VAL 102          HG22      VAL 102  -6.863   3.871  11.624
  769   HG23  VAL 102          HG23      VAL 102  -7.491   2.430  10.816
  770    H    GLY 103           H        GLY 103  -3.496   3.993   8.609
  771    HA2  GLY 103           HA2      GLY 103  -1.782   1.856   7.951
  772    HA3  GLY 103           HA3      GLY 103  -1.296   3.327   8.760
  773    H    ALA 104           H        ALA 104  -2.619   3.065  11.245
  774    HA   ALA 104           HA       ALA 104  -0.941   1.295  12.713
  775    HB1  ALA 104           HB1      ALA 104  -2.054   3.341  13.612
  776    HB2  ALA 104           HB2      ALA 104  -3.627   2.526  13.498
  777    HB3  ALA 104           HB3      ALA 104  -2.382   1.913  14.606
  778    H    ASP 105           H        ASP 105  -4.118   0.704  11.260
  779    HA   ASP 105           HA       ASP 105  -4.634  -1.798  12.662
  780    HB2  ASP 105           HB2      ASP 105  -6.315  -0.031  11.890
  781    HB3  ASP 105           HB3      ASP 105  -6.021  -0.593  10.249
  782    H    THR 106           H        THR 106  -2.707  -0.919   9.945
  783    HA   THR 106           HA       THR 106  -3.234  -3.188   8.242
  784    HB   THR 106           HB       THR 106  -1.236  -2.615   7.003
  785    HG1  THR 106           HG1      THR 106  -0.735  -0.631   8.934
  786   HG21  THR 106          HG21      THR 106  -1.740  -0.361   6.281
  787   HG22  THR 106          HG22      THR 106  -3.208  -1.353   6.456
  788   HG23  THR 106          HG23      THR 106  -2.805  -0.141   7.680
  789    H    THR 107           H        THR 107  -2.005  -4.990   7.756
  790    HA   THR 107           HA       THR 107  -0.772  -6.442   9.863
  791    HB   THR 107           HB       THR 107  -1.678  -7.468   7.855
  792    HG1  THR 107           HG1      THR 107  -0.197  -8.626   9.033
  793   HG21  THR 107          HG21      THR 107   0.819  -6.561   6.360
  794   HG22  THR 107          HG22      THR 107  -0.498  -7.579   5.751
  795   HG23  THR 107          HG23      THR 107  -0.812  -5.881   6.113
  796    H    LEU 108           H        LEU 108   0.739  -4.235   7.521
  797    HA   LEU 108           HA       LEU 108   3.463  -4.798   8.099
  798    HB2  LEU 108           HB2      LEU 108   2.382  -3.425   6.171
  799    HB3  LEU 108           HB3      LEU 108   2.289  -2.098   7.319
  800    HG   LEU 108           HG       LEU 108   4.900  -2.563   7.639
  801   HD11  LEU 108          HD11      LEU 108   5.001  -4.607   6.254
  802   HD12  LEU 108          HD12      LEU 108   4.308  -3.719   4.875
  803   HD13  LEU 108          HD13      LEU 108   5.915  -3.290   5.477
  804   HD21  LEU 108          HD21      LEU 108   3.817  -1.300   5.094
  805   HD22  LEU 108          HD22      LEU 108   3.940  -0.514   6.695
  806   HD23  LEU 108          HD23      LEU 108   5.400  -1.007   5.828
  807    H    SER 109           H        SER 109   1.302  -2.281   9.496
  808    HA   SER 109           HA       SER 109   3.302  -1.315  11.347
  809    HB2  SER 109           HB2      SER 109   1.305  -0.077  10.330
  810    HB3  SER 109           HB3      SER 109   0.334  -0.828  11.616
  811    HG   SER 109           HG       SER 109   1.605   1.376  11.839
  812    H    GLN 110           H        GLN 110   0.880  -3.866  11.507
  813    HA   GLN 110           HA       GLN 110   0.957  -4.289  14.347
  814    HB2  GLN 110           HB2      GLN 110  -0.772  -5.073  12.579
  815    HB3  GLN 110           HB3      GLN 110   0.347  -6.370  12.218
  816    HG2  GLN 110           HG2      GLN 110  -1.200  -7.253  13.757
  817    HG3  GLN 110           HG3      GLN 110   0.269  -6.996  14.706
  818   HE21  GLN 110          HE22      GLN 110  -2.866  -5.419  13.809
  819   HE22  GLN 110          HE21      GLN 110  -2.832  -4.311  15.161
  820    H    ILE 111           H        ILE 111   2.799  -5.768  11.647
  821    HA   ILE 111           HA       ILE 111   4.326  -7.622  13.138
  822    HB   ILE 111           HB       ILE 111   4.984  -6.041  10.632
  823   HG12  ILE 111          HG12      ILE 111   4.371  -9.014  10.945
  824   HG13  ILE 111          HG13      ILE 111   3.098  -7.826  10.730
  825   HG21  ILE 111          HG21      ILE 111   6.596  -8.340  11.840
  826   HG22  ILE 111          HG22      ILE 111   6.838  -7.659  10.222
  827   HG23  ILE 111          HG23      ILE 111   7.154  -6.663  11.630
  828   HD11  ILE 111          HD11      ILE 111   4.120  -7.099   8.575
  829   HD12  ILE 111          HD12      ILE 111   5.318  -8.408   8.734
  830   HD13  ILE 111          HD13      ILE 111   3.596  -8.794   8.589
  831    H    VAL 112           H        VAL 112   5.285  -4.207  12.390
  832    HA   VAL 112           HA       VAL 112   7.531  -4.333  14.155
  833    HB   VAL 112           HB       VAL 112   7.712  -1.920  13.983
  834   HG11  VAL 112          HG11      VAL 112   7.108  -3.171  11.277
  835   HG12  VAL 112          HG12      VAL 112   8.228  -1.837  11.645
  836   HG13  VAL 112          HG13      VAL 112   8.586  -3.470  12.218
  837   HG21  VAL 112          HG21      VAL 112   5.331  -1.262  13.923
  838   HG22  VAL 112          HG22      VAL 112   6.227  -0.610  12.546
  839   HG23  VAL 112          HG23      VAL 112   5.170  -2.015  12.318
  840    H    LYS 113           H        LYS 113   4.187  -3.810  15.019
  841    HA   LYS 113           HA       LYS 113   4.770  -2.787  17.691
  842    HB2  LYS 113           HB2      LYS 113   2.349  -4.215  16.512
  843    HB3  LYS 113           HB3      LYS 113   2.471  -3.850  18.232
  844    HG2  LYS 113           HG2      LYS 113   2.543  -1.501  17.855
  845    HG3  LYS 113           HG3      LYS 113   2.873  -1.726  16.146
  846    HD2  LYS 113           HD2      LYS 113   0.624  -0.926  16.445
  847    HD3  LYS 113           HD3      LYS 113   0.620  -2.544  15.720
  848    HE2  LYS 113           HE2      LYS 113   0.003  -3.584  17.765
  849    HE3  LYS 113           HE3      LYS 113   0.412  -2.130  18.695
  850    HZ1  LYS 113           HZ1      LYS 113  -2.004  -2.372  18.421
  851    HZ2  LYS 113           HZ2      LYS 113  -1.457  -0.995  17.728
  852    HZ3  LYS 113           HZ3      LYS 113  -1.878  -2.281  16.785
  853    H    LEU 114           H        LEU 114   4.363  -6.087  16.375
  854    HA   LEU 114           HA       LEU 114   4.634  -7.474  18.832
  855    HB2  LEU 114           HB2      LEU 114   3.950  -8.116  16.281
  856    HB3  LEU 114           HB3      LEU 114   5.594  -8.755  16.291
  857    HG   LEU 114           HG       LEU 114   3.313  -9.500  18.158
  858   HD11  LEU 114          HD11      LEU 114   4.726 -11.111  15.989
  859   HD12  LEU 114          HD12      LEU 114   3.365 -11.651  16.996
  860   HD13  LEU 114          HD13      LEU 114   3.131 -10.346  15.826
  861   HD21  LEU 114          HD21      LEU 114   6.176 -10.516  18.008
  862   HD22  LEU 114          HD22      LEU 114   5.344  -9.773  19.401
  863   HD23  LEU 114          HD23      LEU 114   4.863 -11.380  18.852
  864    H    VAL 115           H        VAL 115   7.135  -6.546  16.465
  865    HA   VAL 115           HA       VAL 115   9.341  -7.811  17.898
  866    HB   VAL 115           HB       VAL 115   9.388  -5.666  15.742
  867   HG11  VAL 115          HG11      VAL 115  11.620  -7.450  16.835
  868   HG12  VAL 115          HG12      VAL 115  11.732  -6.490  15.348
  869   HG13  VAL 115          HG13      VAL 115  11.551  -5.674  16.897
  870   HG21  VAL 115          HG21      VAL 115   9.740  -8.695  15.578
  871   HG22  VAL 115          HG22      VAL 115   8.353  -7.775  14.957
  872   HG23  VAL 115          HG23      VAL 115   9.943  -7.554  14.232
  873    H    GLU 116           H        GLU 116   7.828  -4.665  18.114
  874    HA   GLU 116           HA       GLU 116   9.995  -3.391  19.637
  875    HB2  GLU 116           HB2      GLU 116   8.444  -2.175  18.166
  876    HB3  GLU 116           HB3      GLU 116   7.106  -2.517  19.251
  877    HG2  GLU 116           HG2      GLU 116   9.640  -0.990  19.994
  878    HG3  GLU 116           HG3      GLU 116   8.179  -0.217  19.393
  879    H    GLU 117           H        GLU 117   7.112  -5.266  20.421
  880    HA   GLU 117           HA       GLU 117   7.115  -4.823  23.270
  881    HB2  GLU 117           HB2      GLU 117   6.172  -7.111  21.518
  882    HB3  GLU 117           HB3      GLU 117   5.881  -7.082  23.242
  883    HG2  GLU 117           HG2      GLU 117   4.999  -4.724  21.564
  884    HG3  GLU 117           HG3      GLU 117   4.105  -6.236  21.448
  885    H    ALA 118           H        ALA 118   9.046  -6.986  21.214
  886    HA   ALA 118           HA       ALA 118  10.224  -8.452  23.466
  887    HB1  ALA 118           HB1      ALA 118  10.984  -8.352  20.517
  888    HB2  ALA 118           HB2      ALA 118  11.585  -9.503  21.731
  889    HB3  ALA 118           HB3      ALA 118   9.876  -9.519  21.272
  890    H    GLN 119           H        GLN 119  11.431  -6.061  21.159
  891    HA   GLN 119           HA       GLN 119  13.896  -5.464  22.241
  892    HB2  GLN 119           HB2      GLN 119  11.931  -3.685  20.786
  893    HB3  GLN 119           HB3      GLN 119  13.561  -3.162  21.226
  894    HG2  GLN 119           HG2      GLN 119  12.736  -4.398  18.846
  895    HG3  GLN 119           HG3      GLN 119  14.340  -3.816  19.301
  896   HE21  GLN 119          HE22      GLN 119  12.160  -6.561  19.235
  897   HE22  GLN 119          HE21      GLN 119  13.366  -7.678  19.874
  Start of MODEL   15
    1    H    SER   1           H        SER   1  18.601  -4.694  14.233
    2    HA   SER   1           HA       SER   1  15.952  -3.523  14.852
    3    HB2  SER   1           HB2      SER   1  18.774  -2.716  15.655
    4    HB3  SER   1           HB3      SER   1  17.291  -1.895  16.171
    5    HG   SER   1           HG       SER   1  16.639  -3.677  17.260
    6    H    GLU   2           H        GLU   2  18.474  -3.226  12.516
    7    HA   GLU   2           HA       GLU   2  17.828  -0.509  11.597
    8    HB2  GLU   2           HB2      GLU   2  20.074  -1.831  11.353
    9    HB3  GLU   2           HB3      GLU   2  19.265  -2.686  10.040
   10    HG2  GLU   2           HG2      GLU   2  18.779  -0.382   9.041
   11    HG3  GLU   2           HG3      GLU   2  19.902   0.270  10.232
   12    H    ALA   3           H        ALA   3  17.256  -3.893  10.394
   13    HA   ALA   3           HA       ALA   3  15.337  -3.331   8.468
   14    HB1  ALA   3           HB1      ALA   3  15.578  -5.755  10.305
   15    HB2  ALA   3           HB2      ALA   3  14.792  -5.709   8.711
   16    HB3  ALA   3           HB3      ALA   3  16.546  -5.470   8.845
   17    H    LEU   4           H        LEU   4  14.878  -3.543  11.984
   18    HA   LEU   4           HA       LEU   4  11.990  -3.690  11.939
   19    HB2  LEU   4           HB2      LEU   4  13.358  -4.379  13.880
   20    HB3  LEU   4           HB3      LEU   4  13.920  -2.722  14.074
   21    HG   LEU   4           HG       LEU   4  11.640  -1.968  14.603
   22   HD11  LEU   4          HD11      LEU   4  11.007  -4.924  14.397
   23   HD12  LEU   4          HD12      LEU   4   9.932  -3.719  15.167
   24   HD13  LEU   4          HD13      LEU   4  10.311  -3.606  13.438
   25   HD21  LEU   4          HD21      LEU   4  13.145  -2.545  16.363
   26   HD22  LEU   4          HD22      LEU   4  11.483  -2.998  16.798
   27   HD23  LEU   4          HD23      LEU   4  12.644  -4.257  16.292
   28    H    ALA   5           H        ALA   5  14.233  -1.027  11.447
   29    HA   ALA   5           HA       ALA   5  12.154   1.047  11.773
   30    HB1  ALA   5           HB1      ALA   5  14.992   1.224  10.664
   31    HB2  ALA   5           HB2      ALA   5  13.893   2.569  11.014
   32    HB3  ALA   5           HB3      ALA   5  14.523   1.569  12.335
   33    H    LYS   6           H        LYS   6  14.093  -0.538   9.200
   34    HA   LYS   6           HA       LYS   6  13.315   0.750   7.024
   35    HB2  LYS   6           HB2      LYS   6  14.960  -1.163   7.207
   36    HB3  LYS   6           HB3      LYS   6  13.614  -2.286   7.081
   37    HG2  LYS   6           HG2      LYS   6  14.816  -2.031   4.971
   38    HG3  LYS   6           HG3      LYS   6  13.137  -1.511   4.810
   39    HD2  LYS   6           HD2      LYS   6  13.779   0.823   4.866
   40    HD3  LYS   6           HD3      LYS   6  15.462   0.398   5.258
   41    HE2  LYS   6           HE2      LYS   6  15.782  -0.606   3.074
   42    HE3  LYS   6           HE3      LYS   6  14.056  -0.511   2.714
   43    HZ1  LYS   6           HZ1      LYS   6  14.202   1.886   2.733
   44    HZ2  LYS   6           HZ2      LYS   6  15.774   1.884   3.122
   45    HZ3  LYS   6           HZ3      LYS   6  15.282   1.313   1.653
   46    H    LEU   7           H        LEU   7  11.269  -1.893   8.301
   47    HA   LEU   7           HA       LEU   7   9.311  -1.956   6.257
   48    HB2  LEU   7           HB2      LEU   7   9.187  -2.389   9.258
   49    HB3  LEU   7           HB3      LEU   7   7.714  -2.420   8.313
   50    HG   LEU   7           HG       LEU   7   8.488  -4.646   8.780
   51   HD11  LEU   7          HD11      LEU   7   7.244  -4.296   6.711
   52   HD12  LEU   7          HD12      LEU   7   8.761  -4.043   5.813
   53   HD13  LEU   7          HD13      LEU   7   8.402  -5.616   6.547
   54   HD21  LEU   7          HD21      LEU   7  10.888  -4.328   8.901
   55   HD22  LEU   7          HD22      LEU   7  10.490  -5.617   7.761
   56   HD23  LEU   7          HD23      LEU   7  10.972  -4.027   7.148
   57    H    ILE   8           H        ILE   8   9.494   0.330   9.007
   58    HA   ILE   8           HA       ILE   8   7.105   1.814   8.188
   59    HB   ILE   8           HB       ILE   8   9.259   2.305  10.272
   60   HG12  ILE   8          HG12      ILE   8   7.814   0.436  10.813
   61   HG13  ILE   8          HG13      ILE   8   7.509   1.783  11.895
   62   HG21  ILE   8          HG21      ILE   8   6.815   4.001   9.688
   63   HG22  ILE   8          HG22      ILE   8   7.731   4.059  11.208
   64   HG23  ILE   8          HG23      ILE   8   8.519   4.502   9.695
   65   HD11  ILE   8          HD11      ILE   8   5.725   0.866   9.591
   66   HD12  ILE   8          HD12      ILE   8   5.394   0.752  11.321
   67   HD13  ILE   8          HD13      ILE   8   5.436   2.336  10.553
   68    H    SER   9           H        SER   9  10.548   2.006   7.484
   69    HA   SER   9           HA       SER   9  10.442   4.723   6.460
   70    HB2  SER   9           HB2      SER   9  12.545   2.605   5.939
   71    HB3  SER   9           HB3      SER   9  12.689   4.360   5.754
   72    HG   SER   9           HG       SER   9  12.086   4.401   8.102
   73    H    LEU  10           H        LEU  10   9.913   1.538   4.982
   74    HA   LEU  10           HA       LEU  10   9.933   2.379   2.265
   75    HB2  LEU  10           HB2      LEU  10   8.726   0.099   3.807
   76    HB3  LEU  10           HB3      LEU  10   7.978   0.476   2.267
   77    HG   LEU  10           HG       LEU  10  10.233   0.356   1.152
   78   HD11  LEU  10          HD11      LEU  10  11.009  -1.003   3.764
   79   HD12  LEU  10          HD12      LEU  10  11.997  -0.898   2.283
   80   HD13  LEU  10          HD13      LEU  10  11.638   0.564   3.221
   81   HD21  LEU  10          HD21      LEU  10   8.584  -1.485   1.076
   82   HD22  LEU  10          HD22      LEU  10  10.237  -2.091   1.094
   83   HD23  LEU  10          HD23      LEU  10   9.244  -2.140   2.581
   84    H    GLN  11           H        GLN  11   7.642   3.345   4.684
   85    HA   GLN  11           HA       GLN  11   5.272   3.349   3.100
   86    HB2  GLN  11           HB2      GLN  11   5.991   4.642   5.731
   87    HB3  GLN  11           HB3      GLN  11   4.395   4.717   5.001
   88    HG2  GLN  11           HG2      GLN  11   4.440   2.163   4.814
   89    HG3  GLN  11           HG3      GLN  11   5.862   2.199   5.872
   90   HE21  GLN  11          HE22      GLN  11   5.486   3.592   7.961
   91   HE22  GLN  11          HE21      GLN  11   3.875   3.412   8.666
   92    H    ALA  12           H        ALA  12   3.888   5.143   2.651
   93    HA   ALA  12           HA       ALA  12   5.332   7.307   1.206
   94    HB1  ALA  12           HB1      ALA  12   3.290   7.437  -0.140
   95    HB2  ALA  12           HB2      ALA  12   3.934   5.788  -0.130
   96    HB3  ALA  12           HB3      ALA  12   2.521   6.196   0.872
   97    H    THR  13           H        THR  13   4.603   9.434   1.240
   98    HA   THR  13           HA       THR  13   3.647  10.340   3.853
   99    HB   THR  13           HB       THR  13   4.395  12.067   1.479
  100    HG1  THR  13           HG1      THR  13   6.482  11.804   1.974
  101   HG21  THR  13          HG21      THR  13   5.314  13.560   3.236
  102   HG22  THR  13          HG22      THR  13   3.579  13.304   3.451
  103   HG23  THR  13          HG23      THR  13   4.735  12.437   4.488
  104    H    GLU  14           H        GLU  14   2.204   9.923   0.727
  105    HA   GLU  14           HA       GLU  14  -0.236  11.421   1.514
  106    HB2  GLU  14           HB2      GLU  14  -0.233  12.782  -0.416
  107    HB3  GLU  14           HB3      GLU  14   1.331  12.955   0.353
  108    HG2  GLU  14           HG2      GLU  14   0.711  11.285  -2.117
  109    HG3  GLU  14           HG3      GLU  14   1.430  12.894  -2.118
  110    H    ALA  15           H        ALA  15  -2.021  11.217  -0.080
  111    HA   ALA  15           HA       ALA  15  -2.026   8.720  -1.683
  112    HB1  ALA  15           HB1      ALA  15  -4.158   8.015  -0.642
  113    HB2  ALA  15           HB2      ALA  15  -2.856   8.094   0.558
  114    HB3  ALA  15           HB3      ALA  15  -4.073   9.390   0.482
  115    H    THR  16           H        THR  16  -3.707   8.602  -3.219
  116    HA   THR  16           HA       THR  16  -5.099  11.161  -3.926
  117    HB   THR  16           HB       THR  16  -4.130   8.984  -5.801
  118    HG1  THR  16           HG1      THR  16  -2.703  10.706  -6.442
  119   HG21  THR  16          HG21      THR  16  -5.330  11.746  -6.313
  120   HG22  THR  16          HG22      THR  16  -4.598  10.700  -7.552
  121   HG23  THR  16          HG23      THR  16  -6.072  10.187  -6.723
  122    H    ILE  17           H        ILE  17  -7.140  10.918  -3.091
  123    HA   ILE  17           HA       ILE  17  -8.555   8.320  -3.103
  124    HB   ILE  17           HB       ILE  17  -9.787  10.952  -2.267
  125   HG12  ILE  17          HG12      ILE  17  -7.916   9.305  -0.517
  126   HG13  ILE  17          HG13      ILE  17  -7.678  10.964  -1.059
  127   HG21  ILE  17          HG21      ILE  17 -10.186   8.101  -1.251
  128   HG22  ILE  17          HG22      ILE  17 -11.143   9.527  -0.795
  129   HG23  ILE  17          HG23      ILE  17 -11.233   8.919  -2.425
  130   HD11  ILE  17          HD11      ILE  17  -9.776  10.010   0.917
  131   HD12  ILE  17          HD12      ILE  17  -8.379  11.037   1.223
  132   HD13  ILE  17          HD13      ILE  17  -9.712  11.655   0.229
  133    H    VAL  18           H        VAL  18 -10.504   7.891  -4.343
  134    HA   VAL  18           HA       VAL  18 -11.185   9.939  -6.430
  135    HB   VAL  18           HB       VAL  18 -11.038   6.945  -6.884
  136   HG11  VAL  18          HG11      VAL  18 -11.660   9.261  -8.757
  137   HG12  VAL  18          HG12      VAL  18 -11.358   7.589  -9.270
  138   HG13  VAL  18          HG13      VAL  18 -12.761   7.959  -8.265
  139   HG21  VAL  18          HG21      VAL  18  -9.173   7.533  -8.459
  140   HG22  VAL  18          HG22      VAL  18  -9.140   9.154  -7.732
  141   HG23  VAL  18          HG23      VAL  18  -8.774   7.730  -6.748
  142    H    THR  19           H        THR  19 -13.189  10.627  -6.249
  143    HA   THR  19           HA       THR  19 -15.351   8.758  -5.338
  144    HB   THR  19           HB       THR  19 -15.258  11.757  -4.899
  145    HG1  THR  19           HG1      THR  19 -14.551  11.368  -2.954
  146   HG21  THR  19          HG21      THR  19 -17.128   9.567  -3.887
  147   HG22  THR  19          HG22      THR  19 -17.061  11.206  -3.216
  148   HG23  THR  19          HG23      THR  19 -17.552  10.966  -4.894
  149    H    LEU  20           H        LEU  20 -17.343   8.816  -6.426
  150    HA   LEU  20           HA       LEU  20 -17.211  10.022  -9.113
  151    HB2  LEU  20           HB2      LEU  20 -18.770   7.573  -8.195
  152    HB3  LEU  20           HB3      LEU  20 -18.501   8.157  -9.825
  153    HG   LEU  20           HG       LEU  20 -15.907   7.915  -9.134
  154   HD11  LEU  20          HD11      LEU  20 -15.501   5.914  -7.786
  155   HD12  LEU  20          HD12      LEU  20 -16.328   7.088  -6.782
  156   HD13  LEU  20          HD13      LEU  20 -17.230   5.727  -7.459
  157   HD21  LEU  20          HD21      LEU  20 -15.879   5.677 -10.083
  158   HD22  LEU  20          HD22      LEU  20 -17.627   5.519  -9.809
  159   HD23  LEU  20          HD23      LEU  20 -16.990   6.721 -10.978
  160    H    ASP  21           H        ASP  21 -17.992  11.994  -8.642
  161    HA   ASP  21           HA       ASP  21 -20.165  12.655  -7.035
  162    HB2  ASP  21           HB2      ASP  21 -18.197  14.056  -8.412
  163    HB3  ASP  21           HB3      ASP  21 -19.632  14.530  -9.267
  164    H    SER  22           H        SER  22 -20.608  11.132  -9.954
  165    HA   SER  22           HA       SER  22 -23.343  12.300 -10.383
  166    HB2  SER  22           HB2      SER  22 -21.571  11.147 -12.550
  167    HB3  SER  22           HB3      SER  22 -23.253  11.640 -12.740
  168    HG   SER  22           HG       SER  22 -21.874  13.215 -13.454
  169    H    ASP  23           H        ASP  23 -22.322   9.458 -12.087
  170    HA   ASP  23           HA       ASP  23 -23.613   7.539 -10.248
  171    HB2  ASP  23           HB2      ASP  23 -25.370   8.706 -11.661
  172    HB3  ASP  23           HB3      ASP  23 -24.586   8.056 -13.093
  173    H    ASN  24           H        ASN  24 -21.139   7.293 -10.413
  174    HA   ASN  24           HA       ASN  24 -19.208   6.459 -11.041
  175    HB2  ASN  24           HB2      ASN  24 -20.690   4.227 -12.402
  176    HB3  ASN  24           HB3      ASN  24 -19.132   4.138 -11.612
  177   HD21  ASN  24          HD22      ASN  24 -22.273   3.478 -11.211
  178   HD22  ASN  24          HD21      ASN  24 -22.229   3.356  -9.459
  179    H    ILE  25           H        ILE  25 -21.028   7.481 -13.695
  180    HA   ILE  25           HA       ILE  25 -19.058   7.048 -15.744
  181    HB   ILE  25           HB       ILE  25 -20.513   8.508 -17.071
  182   HG12  ILE  25          HG12      ILE  25 -22.063   8.973 -14.470
  183   HG13  ILE  25          HG13      ILE  25 -21.076  10.174 -15.306
  184   HG21  ILE  25          HG21      ILE  25 -22.176   6.573 -15.381
  185   HG22  ILE  25          HG22      ILE  25 -22.448   7.051 -17.065
  186   HG23  ILE  25          HG23      ILE  25 -21.043   6.074 -16.650
  187   HD11  ILE  25          HD11      ILE  25 -22.588  10.042 -17.270
  188   HD12  ILE  25          HD12      ILE  25 -23.622   8.899 -16.370
  189   HD13  ILE  25          HD13      ILE  25 -23.403  10.548 -15.773
  190    H    LEU  26           H        LEU  26 -18.979   9.157 -13.176
  191    HA   LEU  26           HA       LEU  26 -17.152  11.116 -14.482
  192    HB2  LEU  26           HB2      LEU  26 -19.297  12.118 -14.133
  193    HB3  LEU  26           HB3      LEU  26 -19.342  11.586 -12.457
  194    HG   LEU  26           HG       LEU  26 -16.930  13.224 -13.019
  195   HD11  LEU  26          HD11      LEU  26 -19.660  14.511 -13.296
  196   HD12  LEU  26          HD12      LEU  26 -18.085  15.348 -13.204
  197   HD13  LEU  26          HD13      LEU  26 -18.461  14.305 -14.597
  198   HD21  LEU  26          HD21      LEU  26 -19.211  13.449 -11.078
  199   HD22  LEU  26          HD22      LEU  26 -17.660  12.618 -10.784
  200   HD23  LEU  26          HD23      LEU  26 -17.690  14.377 -11.014
  201    H    LEU  27           H        LEU  27 -15.363  11.648 -13.385
  202    HA   LEU  27           HA       LEU  27 -14.732  10.296 -10.771
  203    HB2  LEU  27           HB2      LEU  27 -12.904  10.665 -13.182
  204    HB3  LEU  27           HB3      LEU  27 -12.403  10.094 -11.605
  205    HG   LEU  27           HG       LEU  27 -12.479   8.239 -13.002
  206   HD11  LEU  27          HD11      LEU  27 -15.001   8.096 -11.323
  207   HD12  LEU  27          HD12      LEU  27 -13.994   6.742 -11.844
  208   HD13  LEU  27          HD13      LEU  27 -13.348   7.922 -10.698
  209   HD21  LEU  27          HD21      LEU  27 -14.150   9.178 -14.702
  210   HD22  LEU  27          HD22      LEU  27 -14.213   7.444 -14.356
  211   HD23  LEU  27          HD23      LEU  27 -15.421   8.516 -13.652
  212    H    SER  28           H        SER  28 -14.156  11.583  -9.176
  213    HA   SER  28           HA       SER  28 -12.872  14.251  -9.674
  214    HB2  SER  28           HB2      SER  28 -15.235  14.549  -9.158
  215    HB3  SER  28           HB3      SER  28 -15.104  13.465  -7.763
  216    HG   SER  28           HG       SER  28 -15.019  15.489  -7.012
  217    H    GLU  29           H        GLU  29 -10.757  14.015  -8.915
  218    HA   GLU  29           HA       GLU  29 -10.329  12.159  -6.685
  219    HB2  GLU  29           HB2      GLU  29  -8.201  13.199  -8.545
  220    HB3  GLU  29           HB3      GLU  29  -8.188  11.793  -7.505
  221    HG2  GLU  29           HG2      GLU  29  -8.480  10.855  -9.604
  222    HG3  GLU  29           HG3      GLU  29 -10.109  10.861  -8.936
  223    H    GLU  30           H        GLU  30  -9.264  12.589  -4.871
  224    HA   GLU  30           HA       GLU  30  -8.532  15.431  -4.232
  225    HB2  GLU  30           HB2      GLU  30  -9.168  13.217  -2.269
  226    HB3  GLU  30           HB3      GLU  30  -9.006  14.930  -1.940
  227    HG2  GLU  30           HG2      GLU  30 -11.244  13.603  -3.540
  228    HG3  GLU  30           HG3      GLU  30 -11.333  14.108  -1.866
  229    H    GLN  31           H        GLN  31  -6.394  15.860  -3.553
  230    HA   GLN  31           HA       GLN  31  -4.507  13.541  -3.257
  231    HB2  GLN  31           HB2      GLN  31  -4.009  16.372  -4.177
  232    HB3  GLN  31           HB3      GLN  31  -2.777  15.199  -3.717
  233    HG2  GLN  31           HG2      GLN  31  -4.078  13.627  -5.455
  234    HG3  GLN  31           HG3      GLN  31  -4.622  15.173  -6.116
  235   HE21  GLN  31          HE21      GLN  31  -1.701  13.370  -5.073
  236   HE22  GLN  31          HE22      GLN  31  -0.637  14.101  -6.252
  237    H    VAL  32           H        VAL  32  -3.972  13.207  -1.156
  238    HA   VAL  32           HA       VAL  32  -4.136  15.454   0.823
  239    HB   VAL  32           HB       VAL  32  -5.376  14.097   2.364
  240   HG11  VAL  32          HG11      VAL  32  -7.550  14.016   1.331
  241   HG12  VAL  32          HG12      VAL  32  -6.680  15.432   0.713
  242   HG13  VAL  32          HG13      VAL  32  -6.849  13.968  -0.294
  243   HG21  VAL  32          HG21      VAL  32  -4.614  11.824   1.779
  244   HG22  VAL  32          HG22      VAL  32  -6.369  11.931   1.802
  245   HG23  VAL  32          HG23      VAL  32  -5.508  11.910   0.243
  246    H    ASP  33           H        ASP  33  -3.076  15.143   2.805
  247    HA   ASP  33           HA       ASP  33  -0.651  13.449   2.736
  248    HB2  ASP  33           HB2      ASP  33  -1.869  15.288   4.815
  249    HB3  ASP  33           HB3      ASP  33  -0.572  14.179   5.224
  250    H    VAL  34           H        VAL  34  -0.255  11.618   3.969
  251    HA   VAL  34           HA       VAL  34  -2.325   9.762   3.909
  252    HB   VAL  34           HB       VAL  34   0.073   9.278   3.724
  253   HG11  VAL  34          HG11      VAL  34   0.158   9.331   6.770
  254   HG12  VAL  34          HG12      VAL  34   1.471   8.894   5.657
  255   HG13  VAL  34          HG13      VAL  34   0.882  10.558   5.702
  256   HG21  VAL  34          HG21      VAL  34   0.037   7.063   4.678
  257   HG22  VAL  34          HG22      VAL  34  -1.282   7.495   5.778
  258   HG23  VAL  34          HG23      VAL  34  -1.563   7.444   4.024
  259    H    GLU  35           H        GLU  35  -1.508  11.716   6.757
  260    HA   GLU  35           HA       GLU  35  -3.064  10.097   8.595
  261    HB2  GLU  35           HB2      GLU  35  -1.150  11.599   9.119
  262    HB3  GLU  35           HB3      GLU  35  -2.206  12.997   8.880
  263    HG2  GLU  35           HG2      GLU  35  -3.546  12.323  10.802
  264    HG3  GLU  35           HG3      GLU  35  -2.697  10.773  10.908
  265    H    LEU  36           H        LEU  36  -4.122  12.093   6.067
  266    HA   LEU  36           HA       LEU  36  -6.688  12.851   7.366
  267    HB2  LEU  36           HB2      LEU  36  -5.603  13.627   4.636
  268    HB3  LEU  36           HB3      LEU  36  -6.918  14.393   5.515
  269    HG   LEU  36           HG       LEU  36  -3.959  14.501   6.251
  270   HD11  LEU  36          HD11      LEU  36  -5.880  16.647   5.258
  271   HD12  LEU  36          HD12      LEU  36  -4.173  16.876   5.687
  272   HD13  LEU  36          HD13      LEU  36  -4.606  15.870   4.297
  273   HD21  LEU  36          HD21      LEU  36  -5.333  14.545   8.299
  274   HD22  LEU  36          HD22      LEU  36  -4.647  16.133   7.961
  275   HD23  LEU  36          HD23      LEU  36  -6.356  15.819   7.596
  276    H    VAL  37           H        VAL  37  -5.687  10.221   5.703
  277    HA   VAL  37           HA       VAL  37  -8.432   9.721   4.637
  278    HB   VAL  37           HB       VAL  37  -6.745   9.705   2.891
  279   HG11  VAL  37          HG11      VAL  37  -5.498   7.343   4.351
  280   HG12  VAL  37          HG12      VAL  37  -5.116   7.862   2.696
  281   HG13  VAL  37          HG13      VAL  37  -4.758   8.934   4.051
  282   HG21  VAL  37          HG21      VAL  37  -8.783   8.285   2.733
  283   HG22  VAL  37          HG22      VAL  37  -7.398   7.688   1.811
  284   HG23  VAL  37          HG23      VAL  37  -7.830   6.907   3.340
  285    H    GLN  38           H        GLN  38  -9.410   7.774   5.067
  286    HA   GLN  38           HA       GLN  38  -8.452   6.205   7.423
  287    HB2  GLN  38           HB2      GLN  38 -11.288   7.201   6.861
  288    HB3  GLN  38           HB3      GLN  38 -10.830   6.111   8.154
  289    HG2  GLN  38           HG2      GLN  38  -9.582   7.829   9.299
  290    HG3  GLN  38           HG3      GLN  38  -9.688   8.918   7.901
  291   HE21  GLN  38          HE22      GLN  38 -11.792   7.301  10.307
  292   HE22  GLN  38          HE21      GLN  38 -13.099   8.439   9.958
  293    H    ARG  39           H        ARG  39 -10.012   4.171   7.569
  294    HA   ARG  39           HA       ARG  39  -9.838   2.688   5.008
  295    HB2  ARG  39           HB2      ARG  39 -10.613   0.790   6.226
  296    HB3  ARG  39           HB3      ARG  39  -9.423   1.616   7.234
  297    HG2  ARG  39           HG2      ARG  39 -11.560   2.764   8.302
  298    HG3  ARG  39           HG3      ARG  39 -12.438   1.436   7.557
  299    HD2  ARG  39           HD2      ARG  39 -10.998  -0.192   8.757
  300    HD3  ARG  39           HD3      ARG  39 -10.065   1.143   9.451
  301    HE   ARG  39           HE       ARG  39 -11.774   1.613  10.967
  302   HH11  ARG  39          HH11      ARG  39 -13.060  -0.759   8.689
  303   HH12  ARG  39          HH12      ARG  39 -14.449  -1.062   9.713
  304   HH21  ARG  39          HH21      ARG  39 -13.531   1.194  12.130
  305   HH22  ARG  39          HH22      ARG  39 -14.692  -0.028  11.615
  306    H    GLY  40           H        GLY  40 -11.734   1.871   3.766
  307    HA2  GLY  40           HA2      GLY  40 -14.073   1.699   3.423
  308    HA3  GLY  40           HA3      GLY  40 -14.359   3.107   4.445
  309    H    ASP  41           H        ASP  41 -11.732   3.057   2.040
  310    HA   ASP  41           HA       ASP  41 -13.240   4.799   0.202
  311    HB2  ASP  41           HB2      ASP  41 -10.776   5.556   1.800
  312    HB3  ASP  41           HB3      ASP  41 -10.996   6.210   0.181
  313    H    ILE  42           H        ILE  42 -11.963   5.246  -1.819
  314    HA   ILE  42           HA       ILE  42 -10.201   2.964  -2.568
  315    HB   ILE  42           HB       ILE  42 -12.405   4.183  -4.235
  316   HG12  ILE  42          HG12      ILE  42 -11.807   1.298  -3.429
  317   HG13  ILE  42          HG13      ILE  42 -12.965   2.326  -2.600
  318   HG21  ILE  42          HG21      ILE  42 -10.198   2.255  -5.104
  319   HG22  ILE  42          HG22      ILE  42 -11.606   2.717  -6.085
  320   HG23  ILE  42          HG23      ILE  42 -10.414   3.930  -5.672
  321   HD11  ILE  42          HD11      ILE  42 -14.199   0.890  -4.045
  322   HD12  ILE  42          HD12      ILE  42 -14.263   2.512  -4.759
  323   HD13  ILE  42          HD13      ILE  42 -13.184   1.274  -5.442
  324    H    ILE  43           H        ILE  43  -8.297   3.456  -3.262
  325    HA   ILE  43           HA       ILE  43  -7.562   6.281  -3.797
  326    HB   ILE  43           HB       ILE  43  -5.877   3.985  -2.736
  327   HG12  ILE  43          HG12      ILE  43  -7.623   4.228  -1.097
  328   HG13  ILE  43          HG13      ILE  43  -6.108   4.835  -0.470
  329   HG21  ILE  43          HG21      ILE  43  -5.448   6.993  -2.626
  330   HG22  ILE  43          HG22      ILE  43  -4.391   5.765  -1.900
  331   HG23  ILE  43          HG23      ILE  43  -4.581   5.840  -3.652
  332   HD11  ILE  43          HD11      ILE  43  -8.070   6.224   0.156
  333   HD12  ILE  43          HD12      ILE  43  -6.846   7.151  -0.738
  334   HD13  ILE  43          HD13      ILE  43  -8.338   6.615  -1.545
  335    H    LYS  44           H        LYS  44  -6.675   6.764  -5.791
  336    HA   LYS  44           HA       LYS  44  -5.875   4.663  -7.679
  337    HB2  LYS  44           HB2      LYS  44  -6.972   6.643  -8.478
  338    HB3  LYS  44           HB3      LYS  44  -5.622   7.653  -7.912
  339    HG2  LYS  44           HG2      LYS  44  -4.073   6.522  -9.405
  340    HG3  LYS  44           HG3      LYS  44  -5.273   5.304  -9.852
  341    HD2  LYS  44           HD2      LYS  44  -5.679   8.243 -10.389
  342    HD3  LYS  44           HD3      LYS  44  -4.756   7.181 -11.481
  343    HE2  LYS  44           HE2      LYS  44  -6.815   5.667 -11.542
  344    HE3  LYS  44           HE3      LYS  44  -7.697   6.987 -10.745
  345    HZ1  LYS  44           HZ1      LYS  44  -7.980   7.186 -13.100
  346    HZ2  LYS  44           HZ2      LYS  44  -6.998   8.412 -12.653
  347    HZ3  LYS  44           HZ3      LYS  44  -6.377   7.090 -13.411
  348    H    VAL  45           H        VAL  45  -3.933   3.769  -7.960
  349    HA   VAL  45           HA       VAL  45  -1.521   5.194  -6.949
  350    HB   VAL  45           HB       VAL  45  -2.054   3.179  -5.686
  351   HG11  VAL  45          HG11      VAL  45  -1.558   1.623  -8.247
  352   HG12  VAL  45          HG12      VAL  45  -1.775   0.963  -6.616
  353   HG13  VAL  45          HG13      VAL  45  -3.114   1.821  -7.397
  354   HG21  VAL  45          HG21      VAL  45   0.312   3.889  -5.932
  355   HG22  VAL  45          HG22      VAL  45   0.148   2.130  -5.775
  356   HG23  VAL  45          HG23      VAL  45   0.475   2.849  -7.366
  357    H    VAL  46           H        VAL  46  -0.014   5.751  -8.325
  358    HA   VAL  46           HA       VAL  46  -0.572   5.255 -11.195
  359    HB   VAL  46           HB       VAL  46   0.402   7.330 -11.678
  360   HG11  VAL  46          HG11      VAL  46  -1.842   7.435 -10.637
  361   HG12  VAL  46          HG12      VAL  46  -1.071   7.791  -9.071
  362   HG13  VAL  46          HG13      VAL  46  -0.881   8.908 -10.432
  363   HG21  VAL  46          HG21      VAL  46   1.515   7.448  -8.859
  364   HG22  VAL  46          HG22      VAL  46   2.435   7.304 -10.368
  365   HG23  VAL  46          HG23      VAL  46   1.529   8.778 -10.033
  366    HA   PRO  47           HA       PRO  47   3.224   3.228 -12.185
  367    HB2  PRO  47           HB2      PRO  47   3.965   5.473 -14.072
  368    HB3  PRO  47           HB3      PRO  47   3.987   3.708 -14.366
  369    HG2  PRO  47           HG2      PRO  47   1.946   5.182 -15.323
  370    HG3  PRO  47           HG3      PRO  47   1.581   3.637 -14.479
  371    HD2  PRO  47           HD2      PRO  47   1.524   6.444 -13.345
  372    HD3  PRO  47           HD3      PRO  47   0.264   5.171 -13.243
  373    H    GLY  48           H        GLY  48   5.070   3.049 -11.058
  374    HA2  GLY  48           HA2      GLY  48   7.028   3.583  -9.943
  375    HA3  GLY  48           HA3      GLY  48   6.877   5.259 -10.462
  376    H    GLY  49           H        GLY  49   3.951   4.674  -8.995
  377    HA2  GLY  49           HA2      GLY  49   4.689   5.886  -6.444
  378    HA3  GLY  49           HA3      GLY  49   3.082   5.409  -6.982
  379    H    LYS  50           H        LYS  50   3.332   4.935  -4.519
  380    HA   LYS  50           HA       LYS  50   3.926   2.017  -4.134
  381    HB2  LYS  50           HB2      LYS  50   4.017   4.199  -2.027
  382    HB3  LYS  50           HB3      LYS  50   4.460   2.496  -1.839
  383    HG2  LYS  50           HG2      LYS  50   6.379   2.843  -3.387
  384    HG3  LYS  50           HG3      LYS  50   5.970   4.576  -3.468
  385    HD2  LYS  50           HD2      LYS  50   6.139   4.702  -0.971
  386    HD3  LYS  50           HD3      LYS  50   6.638   2.996  -0.945
  387    HE2  LYS  50           HE2      LYS  50   8.613   3.557  -2.320
  388    HE3  LYS  50           HE3      LYS  50   8.114   5.253  -2.372
  389    HZ1  LYS  50           HZ1      LYS  50   9.780   4.663  -0.624
  390    HZ2  LYS  50           HZ2      LYS  50   8.454   5.440  -0.056
  391    HZ3  LYS  50           HZ3      LYS  50   8.593   3.818   0.177
  392    H    PHE  51           H        PHE  51   2.655   0.931  -2.577
  393    HA   PHE  51           HA       PHE  51  -0.170   1.777  -2.421
  394    HB2  PHE  51           HB2      PHE  51   1.196  -0.721  -1.371
  395    HB3  PHE  51           HB3      PHE  51  -0.537  -0.428  -1.427
  396    HD1  PHE  51           HD2      PHE  51   2.490  -1.138  -3.437
  397    HD2  PHE  51           HD1      PHE  51  -1.779  -0.615  -3.557
  398    HE1  PHE  51           HE2      PHE  51   2.470  -1.950  -5.766
  399    HE2  PHE  51           HE1      PHE  51  -1.802  -1.530  -5.873
  400    HZ   PHE  51           HZ       PHE  51   0.316  -2.148  -6.999
  401    HA   PRO  52           HA       PRO  52   1.140   3.687   1.415
  402    HB2  PRO  52           HB2      PRO  52  -1.012   5.241   2.027
  403    HB3  PRO  52           HB3      PRO  52   0.042   5.546   0.614
  404    HG2  PRO  52           HG2      PRO  52  -2.614   4.073   0.664
  405    HG3  PRO  52           HG3      PRO  52  -2.093   5.382  -0.445
  406    HD2  PRO  52           HD2      PRO  52  -1.916   2.734  -1.119
  407    HD3  PRO  52           HD3      PRO  52  -0.704   3.936  -1.657
  408    H    VAL  53           H        VAL  53  -1.403   1.369   1.421
  409    HA   VAL  53           HA       VAL  53  -1.215   0.728   4.203
  410    HB   VAL  53           HB       VAL  53  -3.783   0.735   4.465
  411   HG11  VAL  53          HG11      VAL  53  -2.285   3.360   4.787
  412   HG12  VAL  53          HG12      VAL  53  -3.732   2.831   5.661
  413   HG13  VAL  53          HG13      VAL  53  -2.199   1.980   5.904
  414   HG21  VAL  53          HG21      VAL  53  -4.289   1.648   2.174
  415   HG22  VAL  53          HG22      VAL  53  -4.991   2.583   3.514
  416   HG23  VAL  53          HG23      VAL  53  -3.549   3.193   2.687
  417    H    ASP  54           H        ASP  54  -2.489  -1.377   4.584
  418    HA   ASP  54           HA       ASP  54  -2.195  -2.958   2.121
  419    HB2  ASP  54           HB2      ASP  54  -1.868  -4.797   3.325
  420    HB3  ASP  54           HB3      ASP  54  -1.271  -3.607   4.454
  421    H    GLY  55           H        GLY  55  -3.735  -4.214   1.056
  422    HA2  GLY  55           HA2      GLY  55  -6.513  -4.357   1.685
  423    HA3  GLY  55           HA3      GLY  55  -6.231  -2.860   0.802
  424    H    ARG  56           H        ARG  56  -7.416  -3.464  -0.908
  425    HA   ARG  56           HA       ARG  56  -6.431  -5.700  -2.670
  426    HB2  ARG  56           HB2      ARG  56  -8.191  -6.688  -1.565
  427    HB3  ARG  56           HB3      ARG  56  -9.162  -5.229  -1.543
  428    HG2  ARG  56           HG2      ARG  56  -9.721  -5.464  -3.889
  429    HG3  ARG  56           HG3      ARG  56  -8.617  -6.834  -4.079
  430    HD2  ARG  56           HD2      ARG  56 -10.970  -7.564  -3.906
  431    HD3  ARG  56           HD3      ARG  56  -9.959  -8.211  -2.612
  432    HE   ARG  56           HE       ARG  56 -10.957  -6.704  -1.033
  433   HH11  ARG  56          HH11      ARG  56 -12.891  -6.780  -4.004
  434   HH12  ARG  56          HH12      ARG  56 -14.042  -5.676  -3.271
  435   HH21  ARG  56          HH21      ARG  56 -12.473  -5.520  -0.258
  436   HH22  ARG  56          HH22      ARG  56 -13.917  -5.136  -1.196
  437    H    VAL  57           H        VAL  57  -6.678  -5.634  -4.812
  438    HA   VAL  57           HA       VAL  57  -6.843  -2.955  -6.099
  439    HB   VAL  57           HB       VAL  57  -5.857  -5.561  -7.338
  440   HG11  VAL  57          HG11      VAL  57  -5.204  -2.649  -7.949
  441   HG12  VAL  57          HG12      VAL  57  -4.542  -4.058  -8.794
  442   HG13  VAL  57          HG13      VAL  57  -6.267  -3.697  -8.913
  443   HG21  VAL  57          HG21      VAL  57  -3.532  -4.859  -6.823
  444   HG22  VAL  57          HG22      VAL  57  -4.173  -3.607  -5.742
  445   HG23  VAL  57          HG23      VAL  57  -4.447  -5.322  -5.390
  446    H    ILE  58           H        ILE  58  -8.685  -2.479  -7.290
  447    HA   ILE  58           HA       ILE  58 -10.160  -4.720  -8.615
  448    HB   ILE  58           HB       ILE  58 -12.348  -3.574  -7.855
  449   HG12  ILE  58          HG12      ILE  58 -10.638  -2.683  -5.509
  450   HG13  ILE  58          HG13      ILE  58 -11.015  -1.587  -6.850
  451   HG21  ILE  58          HG21      ILE  58 -12.517  -4.982  -5.909
  452   HG22  ILE  58          HG22      ILE  58 -11.644  -5.825  -7.189
  453   HG23  ILE  58          HG23      ILE  58 -10.754  -5.135  -5.816
  454   HD11  ILE  58          HD11      ILE  58 -13.434  -1.879  -6.452
  455   HD12  ILE  58          HD12      ILE  58 -13.075  -2.912  -5.041
  456   HD13  ILE  58          HD13      ILE  58 -12.586  -1.207  -5.050
  457    H    GLU  59           H        GLU  59  -8.407  -2.646  -9.648
  458    HA   GLU  59           HA       GLU  59  -9.824  -2.427 -12.094
  459    HB2  GLU  59           HB2      GLU  59 -10.695  -0.317 -10.835
  460    HB3  GLU  59           HB3      GLU  59  -9.043   0.299 -10.976
  461    HG2  GLU  59           HG2      GLU  59  -9.149   0.087 -13.432
  462    HG3  GLU  59           HG3      GLU  59 -10.745  -0.668 -13.320
  463    H    GLY  60           H        GLY  60  -8.249  -2.574 -13.698
  464    HA2  GLY  60           HA2      GLY  60  -6.256  -2.141 -14.802
  465    HA3  GLY  60           HA3      GLY  60  -5.640  -1.270 -13.406
  466    H    HIS  61           H        HIS  61  -3.796  -2.562 -14.387
  467    HA   HIS  61           HA       HIS  61  -3.294  -5.052 -12.890
  468    HB2  HIS  61           HB2      HIS  61  -2.841  -6.383 -14.958
  469    HB3  HIS  61           HB3      HIS  61  -4.532  -6.003 -14.671
  470    HD1  HIS  61           HD1      HIS  61  -5.795  -4.632 -16.578
  471    HD2  HIS  61           HD2      HIS  61  -1.622  -5.032 -17.051
  472    HE1  HIS  61           HE1      HIS  61  -5.240  -3.698 -18.880
  473    H    SER  62           H        SER  62  -1.324  -4.944 -12.149
  474    HA   SER  62           HA       SER  62   0.889  -3.577 -13.576
  475    HB2  SER  62           HB2      SER  62   1.365  -2.838 -11.292
  476    HB3  SER  62           HB3      SER  62  -0.211  -2.303 -11.734
  477    HG   SER  62           HG       SER  62  -0.020  -3.359  -9.625
  478    H    MET  63           H        MET  63   2.969  -3.941 -12.286
  479    HA   MET  63           HA       MET  63   3.224  -6.597 -11.022
  480    HB2  MET  63           HB2      MET  63   4.166  -6.671 -13.305
  481    HB3  MET  63           HB3      MET  63   5.276  -5.356 -12.900
  482    HG2  MET  63           HG2      MET  63   6.511  -6.673 -11.430
  483    HG3  MET  63           HG3      MET  63   5.194  -7.811 -11.136
  484    HE1  MET  63           HE1      MET  63   5.257 -10.279 -14.048
  485    HE2  MET  63           HE2      MET  63   4.731  -9.951 -12.381
  486    HE3  MET  63           HE3      MET  63   4.133  -8.945 -13.725
  487    H    VAL  64           H        VAL  64   4.152  -6.536  -9.112
  488    HA   VAL  64           HA       VAL  64   5.039  -3.900  -7.991
  489    HB   VAL  64           HB       VAL  64   3.451  -6.151  -6.695
  490   HG11  VAL  64          HG11      VAL  64   4.290  -3.432  -5.606
  491   HG12  VAL  64          HG12      VAL  64   3.066  -4.479  -4.862
  492   HG13  VAL  64          HG13      VAL  64   4.736  -5.030  -4.971
  493   HG21  VAL  64          HG21      VAL  64   2.068  -4.959  -8.314
  494   HG22  VAL  64          HG22      VAL  64   1.599  -4.472  -6.683
  495   HG23  VAL  64          HG23      VAL  64   2.607  -3.395  -7.680
  496    H    ASP  65           H        ASP  65   6.761  -3.737  -6.640
  497    HA   ASP  65           HA       ASP  65   8.479  -6.139  -6.233
  498    HB2  ASP  65           HB2      ASP  65   9.496  -4.354  -7.507
  499    HB3  ASP  65           HB3      ASP  65   9.072  -3.166  -6.271
  500    H    GLU  66           H        GLU  66   8.105  -7.091  -4.377
  501    HA   GLU  66           HA       GLU  66   7.785  -5.502  -1.869
  502    HB2  GLU  66           HB2      GLU  66   6.354  -7.320  -1.029
  503    HB3  GLU  66           HB3      GLU  66   5.676  -6.445  -2.392
  504    HG2  GLU  66           HG2      GLU  66   6.082  -8.254  -3.908
  505    HG3  GLU  66           HG3      GLU  66   7.127  -9.086  -2.753
  506    H    SER  67           H        SER  67  10.312  -6.582  -3.132
  507    HA   SER  67           HA       SER  67  11.267  -8.907  -1.970
  508    HB2  SER  67           HB2      SER  67  13.481  -8.075  -2.492
  509    HB3  SER  67           HB3      SER  67  12.367  -7.577  -3.774
  510    HG   SER  67           HG       SER  67  13.897  -6.070  -2.146
  511    H    LEU  68           H        LEU  68  11.121  -5.729  -0.347
  512    HA   LEU  68           HA       LEU  68  12.642  -6.764   1.958
  513    HB2  LEU  68           HB2      LEU  68  12.829  -4.454   1.042
  514    HB3  LEU  68           HB3      LEU  68  11.156  -4.148   1.439
  515    HG   LEU  68           HG       LEU  68  12.796  -3.055   2.894
  516   HD11  LEU  68          HD11      LEU  68  11.717  -3.310   4.952
  517   HD12  LEU  68          HD12      LEU  68  10.479  -3.694   3.748
  518   HD13  LEU  68          HD13      LEU  68  11.286  -4.987   4.661
  519   HD21  LEU  68          HD21      LEU  68  14.071  -4.260   4.574
  520   HD22  LEU  68          HD22      LEU  68  13.496  -5.812   3.940
  521   HD23  LEU  68          HD23      LEU  68  14.540  -4.770   2.942
  522    H    ILE  69           H        ILE  69   9.266  -6.309   1.071
  523    HA   ILE  69           HA       ILE  69   8.225  -6.478   3.795
  524    HB   ILE  69           HB       ILE  69   6.733  -6.918   1.185
  525   HG12  ILE  69          HG12      ILE  69   7.812  -4.671   1.144
  526   HG13  ILE  69          HG13      ILE  69   6.065  -4.635   1.137
  527   HG21  ILE  69          HG21      ILE  69   5.846  -6.357   4.042
  528   HG22  ILE  69          HG22      ILE  69   4.787  -6.113   2.648
  529   HG23  ILE  69          HG23      ILE  69   5.413  -7.728   3.006
  530   HD11  ILE  69          HD11      ILE  69   6.951  -2.887   2.587
  531   HD12  ILE  69          HD12      ILE  69   6.014  -4.047   3.526
  532   HD13  ILE  69          HD13      ILE  69   7.795  -4.096   3.581
  533    H    THR  70           H        THR  70   8.281  -8.750   1.013
  534    HA   THR  70           HA       THR  70   7.712 -11.028   2.866
  535    HB   THR  70           HB       THR  70   6.772 -12.095   0.846
  536    HG1  THR  70           HG1      THR  70   6.480 -10.563  -0.943
  537   HG21  THR  70          HG21      THR  70   4.778 -10.814   0.699
  538   HG22  THR  70          HG22      THR  70   5.381 -10.535   2.340
  539   HG23  THR  70          HG23      THR  70   5.605  -9.294   1.085
  540    H    GLY  71           H        GLY  71  10.328  -9.823   1.128
  541    HA2  GLY  71           HA2      GLY  71  12.480 -10.719   1.102
  542    HA3  GLY  71           HA3      GLY  71  11.854 -12.267   1.656
  543    H    GLU  72           H        GLU  72  10.034 -11.429  -1.013
  544    HA   GLU  72           HA       GLU  72  10.756 -13.667  -2.468
  545    HB2  GLU  72           HB2      GLU  72   9.466 -11.077  -3.423
  546    HB3  GLU  72           HB3      GLU  72   9.598 -12.509  -4.440
  547    HG2  GLU  72           HG2      GLU  72   8.136 -12.390  -1.778
  548    HG3  GLU  72           HG3      GLU  72   7.384 -12.344  -3.375
  549    H    ALA  73           H        ALA  73  11.704 -10.385  -3.589
  550    HA   ALA  73           HA       ALA  73  13.376  -9.642  -4.889
  551    HB1  ALA  73           HB1      ALA  73  14.997 -10.714  -3.374
  552    HB2  ALA  73           HB2      ALA  73  14.910 -12.205  -4.344
  553    HB3  ALA  73           HB3      ALA  73  15.526 -10.719  -5.064
  554    H    MET  74           H        MET  74  11.073 -10.805  -5.778
  555    HA   MET  74           HA       MET  74  11.548 -11.341  -8.578
  556    HB2  MET  74           HB2      MET  74  10.762 -13.529  -6.696
  557    HB3  MET  74           HB3      MET  74   9.707 -13.330  -8.090
  558    HG2  MET  74           HG2      MET  74  12.706 -13.588  -8.363
  559    HG3  MET  74           HG3      MET  74  11.597 -14.960  -8.364
  560    HE1  MET  74           HE1      MET  74  12.008 -16.019 -10.578
  561    HE2  MET  74           HE2      MET  74  12.230 -15.150 -12.112
  562    HE3  MET  74           HE3      MET  74  13.417 -14.960 -10.807
  563    HA   PRO  75           HA       PRO  75   8.065  -8.594  -7.633
  564    HB2  PRO  75           HB2      PRO  75   8.036  -8.422 -10.642
  565    HB3  PRO  75           HB3      PRO  75   7.826  -7.104  -9.441
  566    HG2  PRO  75           HG2      PRO  75  10.224  -7.412 -10.608
  567    HG3  PRO  75           HG3      PRO  75  10.157  -7.219  -8.826
  568    HD2  PRO  75           HD2      PRO  75  10.386  -9.801 -10.420
  569    HD3  PRO  75           HD3      PRO  75  11.351  -9.245  -9.016
  570    H    VAL  76           H        VAL  76   5.795  -8.530  -7.829
  571    HA   VAL  76           HA       VAL  76   4.572 -11.135  -8.683
  572    HB   VAL  76           HB       VAL  76   3.585  -9.363  -6.428
  573   HG11  VAL  76          HG11      VAL  76   3.140 -12.299  -7.142
  574   HG12  VAL  76          HG12      VAL  76   2.498 -11.495  -5.711
  575   HG13  VAL  76          HG13      VAL  76   1.941 -10.991  -7.307
  576   HG21  VAL  76          HG21      VAL  76   5.847 -10.077  -5.773
  577   HG22  VAL  76          HG22      VAL  76   4.644 -10.986  -4.863
  578   HG23  VAL  76          HG23      VAL  76   5.471 -11.755  -6.229
  579    H    ALA  77           H        ALA  77   2.637 -11.189  -9.800
  580    HA   ALA  77           HA       ALA  77   1.921  -8.655 -11.142
  581    HB1  ALA  77           HB1      ALA  77   2.403 -10.650 -12.501
  582    HB2  ALA  77           HB2      ALA  77   1.071 -11.519 -11.703
  583    HB3  ALA  77           HB3      ALA  77   0.730 -10.102 -12.714
  584    H    LYS  78           H        LYS  78   0.020  -7.666 -11.041
  585    HA   LYS  78           HA       LYS  78  -2.182  -8.782  -9.323
  586    HB2  LYS  78           HB2      LYS  78  -1.594  -5.839  -9.715
  587    HB3  LYS  78           HB3      LYS  78  -2.704  -6.559  -8.563
  588    HG2  LYS  78           HG2      LYS  78   0.340  -6.815  -8.455
  589    HG3  LYS  78           HG3      LYS  78  -0.618  -5.661  -7.539
  590    HD2  LYS  78           HD2      LYS  78  -1.715  -7.416  -6.285
  591    HD3  LYS  78           HD3      LYS  78  -1.000  -8.677  -7.304
  592    HE2  LYS  78           HE2      LYS  78   1.251  -8.099  -6.548
  593    HE3  LYS  78           HE3      LYS  78   0.622  -6.763  -5.572
  594    HZ1  LYS  78           HZ1      LYS  78  -0.098  -9.616  -5.158
  595    HZ2  LYS  78           HZ2      LYS  78   1.001  -8.808  -4.266
  596    HZ3  LYS  78           HZ3      LYS  78  -0.586  -8.373  -4.226
  597    H    LYS  79           H        LYS  79  -4.302  -8.273  -9.846
  598    HA   LYS  79           HA       LYS  79  -5.113  -7.048 -12.388
  599    HB2  LYS  79           HB2      LYS  79  -5.762  -9.938 -11.584
  600    HB3  LYS  79           HB3      LYS  79  -6.507  -9.090 -12.923
  601    HG2  LYS  79           HG2      LYS  79  -4.209  -8.879 -13.992
  602    HG3  LYS  79           HG3      LYS  79  -3.601  -9.910 -12.697
  603    HD2  LYS  79           HD2      LYS  79  -4.002 -11.540 -14.232
  604    HD3  LYS  79           HD3      LYS  79  -5.597 -11.525 -13.474
  605    HE2  LYS  79           HE2      LYS  79  -6.383  -9.959 -15.293
  606    HE3  LYS  79           HE3      LYS  79  -4.761 -10.025 -16.003
  607    HZ1  LYS  79           HZ1      LYS  79  -5.110 -12.500 -16.147
  608    HZ2  LYS  79           HZ2      LYS  79  -6.709 -12.247 -15.824
  609    HZ3  LYS  79           HZ3      LYS  79  -5.992 -11.597 -17.171
  610    HA   PRO  80           HA       PRO  80  -8.618  -6.019  -9.673
  611    HB2  PRO  80           HB2      PRO  80 -10.902  -6.822 -11.058
  612    HB3  PRO  80           HB3      PRO  80 -10.012  -5.293 -11.334
  613    HG2  PRO  80           HG2      PRO  80  -9.701  -7.920 -12.834
  614    HG3  PRO  80           HG3      PRO  80  -9.902  -6.267 -13.510
  615    HD2  PRO  80           HD2      PRO  80  -7.461  -7.307 -13.349
  616    HD3  PRO  80           HD3      PRO  80  -7.729  -5.632 -12.823
  617    H    GLY  81           H        GLY  81  -9.423  -7.033  -7.944
  618    HA2  GLY  81           HA2      GLY  81 -10.264  -8.750  -6.582
  619    HA3  GLY  81           HA3      GLY  81 -10.075  -9.920  -7.884
  620    H    SER  82           H        SER  82  -7.397  -7.787  -6.817
  621    HA   SER  82           HA       SER  82  -5.911 -10.199  -5.811
  622    HB2  SER  82           HB2      SER  82  -5.207  -9.381  -8.070
  623    HB3  SER  82           HB3      SER  82  -4.798  -7.819  -7.330
  624    HG   SER  82           HG       SER  82  -3.657 -10.379  -6.893
  625    H    THR  83           H        THR  83  -4.138  -9.672  -4.165
  626    HA   THR  83           HA       THR  83  -5.025  -7.409  -2.429
  627    HB   THR  83           HB       THR  83  -4.258  -8.834  -0.533
  628    HG1  THR  83           HG1      THR  83  -4.038 -10.993  -0.870
  629   HG21  THR  83          HG21      THR  83  -6.276 -10.239  -0.484
  630   HG22  THR  83          HG22      THR  83  -6.641  -8.603  -1.053
  631   HG23  THR  83          HG23      THR  83  -6.537  -9.943  -2.214
  632    H    VAL  84           H        VAL  84  -3.573  -6.265  -1.239
  633    HA   VAL  84           HA       VAL  84  -0.675  -6.487  -1.927
  634    HB   VAL  84           HB       VAL  84  -0.661  -3.991  -2.227
  635   HG11  VAL  84          HG11      VAL  84  -2.228  -5.593  -4.282
  636   HG12  VAL  84          HG12      VAL  84  -1.346  -4.079  -4.567
  637   HG13  VAL  84          HG13      VAL  84  -0.458  -5.536  -4.104
  638   HG21  VAL  84          HG21      VAL  84  -2.896  -3.462  -1.255
  639   HG22  VAL  84          HG22      VAL  84  -2.693  -2.838  -2.897
  640   HG23  VAL  84          HG23      VAL  84  -3.672  -4.287  -2.626
  641    H    ILE  85           H        ILE  85   0.754  -5.376  -0.656
  642    HA   ILE  85           HA       ILE  85  -0.138  -4.598   2.063
  643    HB   ILE  85           HB       ILE  85   2.392  -5.184   2.618
  644   HG12  ILE  85          HG12      ILE  85   3.101  -7.310   1.643
  645   HG13  ILE  85          HG13      ILE  85   1.756  -7.312   0.514
  646   HG21  ILE  85          HG21      ILE  85   0.158  -7.241   2.490
  647   HG22  ILE  85          HG22      ILE  85   1.599  -7.295   3.531
  648   HG23  ILE  85          HG23      ILE  85   0.401  -6.021   3.768
  649   HD11  ILE  85          HD11      ILE  85   3.888  -5.141   0.560
  650   HD12  ILE  85          HD12      ILE  85   3.997  -6.612  -0.429
  651   HD13  ILE  85          HD13      ILE  85   2.691  -5.456  -0.717
  652    H    ALA  86           H        ALA  86   0.812  -2.959   3.113
  653    HA   ALA  86           HA       ALA  86   1.243  -0.636   1.581
  654    HB1  ALA  86           HB1      ALA  86   0.249  -0.786   3.863
  655    HB2  ALA  86           HB2      ALA  86   1.826  -1.182   4.519
  656    HB3  ALA  86           HB3      ALA  86   1.558   0.415   3.778
  657    H    GLY  87           H        GLY  87   3.034   0.663   1.226
  658    HA2  GLY  87           HA2      GLY  87   5.253   1.358   1.162
  659    HA3  GLY  87           HA3      GLY  87   5.698   0.028   2.233
  660    H    SER  88           H        SER  88   4.069  -1.422  -0.314
  661    HA   SER  88           HA       SER  88   6.599  -2.259  -1.593
  662    HB2  SER  88           HB2      SER  88   5.235  -3.802  -2.894
  663    HB3  SER  88           HB3      SER  88   5.035  -4.025  -1.157
  664    HG   SER  88           HG       SER  88   3.001  -3.125  -1.262
  665    H    ILE  89           H        ILE  89   6.893  -2.118  -3.949
  666    HA   ILE  89           HA       ILE  89   6.038   0.618  -4.769
  667    HB   ILE  89           HB       ILE  89   8.392  -0.714  -6.041
  668   HG12  ILE  89          HG12      ILE  89   8.905  -1.132  -3.683
  669   HG13  ILE  89          HG13      ILE  89   9.986   0.017  -4.435
  670   HG21  ILE  89          HG21      ILE  89   7.674   2.152  -5.261
  671   HG22  ILE  89          HG22      ILE  89   9.147   1.659  -6.129
  672   HG23  ILE  89          HG23      ILE  89   7.556   1.438  -6.871
  673   HD11  ILE  89          HD11      ILE  89   7.674   0.850  -2.635
  674   HD12  ILE  89          HD12      ILE  89   9.352   0.629  -2.104
  675   HD13  ILE  89          HD13      ILE  89   8.967   1.882  -3.294
  676    H    ASN  90           H        ASN  90   4.866   0.960  -6.541
  677    HA   ASN  90           HA       ASN  90   4.086  -1.336  -8.231
  678    HB2  ASN  90           HB2      ASN  90   2.388   0.285  -7.215
  679    HB3  ASN  90           HB3      ASN  90   3.063   1.543  -8.258
  680   HD21  ASN  90          HD22      ASN  90   1.422   1.807  -9.858
  681   HD22  ASN  90          HD21      ASN  90   0.961   0.403 -10.833
  682    H    GLN  91           H        GLN  91   4.594  -1.547 -10.449
  683    HA   GLN  91           HA       GLN  91   6.582   0.385 -11.477
  684    HB2  GLN  91           HB2      GLN  91   6.998  -2.056 -11.671
  685    HB3  GLN  91           HB3      GLN  91   5.637  -2.165 -12.788
  686    HG2  GLN  91           HG2      GLN  91   7.738  -1.984 -14.027
  687    HG3  GLN  91           HG3      GLN  91   6.753  -0.550 -14.324
  688   HE21  GLN  91          HE22      GLN  91   9.349  -1.732 -12.090
  689   HE22  GLN  91          HE21      GLN  91  10.256  -0.235 -12.095
  690    H    ASN  92           H        ASN  92   3.713  -1.124 -13.155
  691    HA   ASN  92           HA       ASN  92   2.863   1.584 -14.019
  692    HB2  ASN  92           HB2      ASN  92   4.244   0.373 -15.777
  693    HB3  ASN  92           HB3      ASN  92   3.031  -0.902 -15.784
  694   HD21  ASN  92          HD22      ASN  92   1.419  -0.659 -17.339
  695   HD22  ASN  92          HD21      ASN  92   1.029   0.892 -18.077
  696    H    GLY  93           H        GLY  93   0.487   0.614 -15.420
  697    HA2  GLY  93           HA2      GLY  93  -1.196  -0.996 -15.231
  698    HA3  GLY  93           HA3      GLY  93  -0.915  -1.142 -13.504
  699    H    SER  94           H        SER  94  -0.824   1.931 -13.353
  700    HA   SER  94           HA       SER  94  -2.301   3.466 -12.494
  701    HB2  SER  94           HB2      SER  94  -3.492   2.973 -15.247
  702    HB3  SER  94           HB3      SER  94  -3.863   4.358 -14.200
  703    HG   SER  94           HG       SER  94  -1.394   3.659 -15.427
  704    H    LEU  95           H        LEU  95  -2.989   2.099 -10.807
  705    HA   LEU  95           HA       LEU  95  -5.437   0.446 -11.245
  706    HB2  LEU  95           HB2      LEU  95  -3.716   0.266  -8.822
  707    HB3  LEU  95           HB3      LEU  95  -4.730  -0.965  -9.498
  708    HG   LEU  95           HG       LEU  95  -2.093  -0.031 -10.735
  709   HD11  LEU  95          HD11      LEU  95  -0.963  -1.690  -9.585
  710   HD12  LEU  95          HD12      LEU  95  -1.926  -0.941  -8.344
  711   HD13  LEU  95          HD13      LEU  95  -2.460  -2.498  -9.019
  712   HD21  LEU  95          HD21      LEU  95  -3.814  -2.526 -11.062
  713   HD22  LEU  95          HD22      LEU  95  -3.670  -1.190 -12.224
  714   HD23  LEU  95          HD23      LEU  95  -2.273  -2.220 -11.882
  715    H    LEU  96           H        LEU  96  -7.017   0.284  -9.527
  716    HA   LEU  96           HA       LEU  96  -6.974   2.515  -7.539
  717    HB2  LEU  96           HB2      LEU  96  -9.405   1.543  -9.063
  718    HB3  LEU  96           HB3      LEU  96  -9.479   2.365  -7.521
  719    HG   LEU  96           HG       LEU  96  -8.124   4.282  -8.557
  720   HD11  LEU  96          HD11      LEU  96  -8.603   4.514 -11.076
  721   HD12  LEU  96          HD12      LEU  96  -7.309   3.398 -10.641
  722   HD13  LEU  96          HD13      LEU  96  -8.911   2.776 -11.077
  723   HD21  LEU  96          HD21      LEU  96 -10.514   4.442  -8.044
  724   HD22  LEU  96          HD22      LEU  96 -10.124   5.297  -9.541
  725   HD23  LEU  96          HD23      LEU  96 -10.911   3.701  -9.615
  726    H    ILE  97           H        ILE  97  -6.976   1.989  -5.570
  727    HA   ILE  97           HA       ILE  97  -7.194  -0.861  -4.771
  728    HB   ILE  97           HB       ILE  97  -5.733   1.382  -3.340
  729   HG12  ILE  97          HG12      ILE  97  -4.743   1.426  -5.526
  730   HG13  ILE  97          HG13      ILE  97  -3.630   0.750  -4.361
  731   HG21  ILE  97          HG21      ILE  97  -5.369  -1.642  -3.278
  732   HG22  ILE  97          HG22      ILE  97  -4.392  -0.461  -2.384
  733   HG23  ILE  97          HG23      ILE  97  -6.111  -0.645  -2.016
  734   HD11  ILE  97          HD11      ILE  97  -5.311  -0.934  -6.270
  735   HD12  ILE  97          HD12      ILE  97  -3.633  -0.447  -6.542
  736   HD13  ILE  97          HD13      ILE  97  -4.029  -1.496  -5.171
  737    H    CYS  98           H        CYS  98  -8.810  -1.432  -3.349
  738    HA   CYS  98           HA       CYS  98 -10.275   0.689  -1.868
  739    HB2  CYS  98           HB2      CYS  98 -11.768  -1.162  -1.165
  740    HB3  CYS  98           HB3      CYS  98 -11.720  -0.909  -2.912
  741    HG   CYS  98           HG       CYS  98  -9.873  -3.044  -1.230
  742    H    ALA  99           H        ALA  99  -9.589   1.351   0.048
  743    HA   ALA  99           HA       ALA  99  -7.637  -0.271   1.546
  744    HB1  ALA  99           HB1      ALA  99  -7.220   1.870   2.697
  745    HB2  ALA  99           HB2      ALA  99  -7.050   2.023   0.935
  746    HB3  ALA  99           HB3      ALA  99  -8.507   2.640   1.748
  747    H    THR 100           H        THR 100  -8.430  -1.624   2.996
  748    HA   THR 100           HA       THR 100 -10.809  -0.953   4.664
  749    HB   THR 100           HB       THR 100 -10.766  -3.442   5.091
  750    HG1  THR 100           HG1      THR 100  -9.436  -4.672   3.827
  751   HG21  THR 100          HG21      THR 100 -11.670  -4.093   2.922
  752   HG22  THR 100          HG22      THR 100 -12.228  -2.458   3.320
  753   HG23  THR 100          HG23      THR 100 -10.923  -2.690   2.136
  754    H    HIS 101           H        HIS 101  -7.506  -0.632   4.938
  755    HA   HIS 101           HA       HIS 101  -7.693  -0.772   7.893
  756    HB2  HIS 101           HB2      HIS 101  -5.217  -1.463   6.273
  757    HB3  HIS 101           HB3      HIS 101  -5.487  -1.679   8.001
  758    HD1  HIS 101           HD1      HIS 101  -6.149  -3.319   4.646
  759    HD2  HIS 101           HD2      HIS 101  -7.091  -3.839   8.711
  760    HE1  HIS 101           HE1      HIS 101  -7.235  -5.619   4.839
  761    H    VAL 102           H        VAL 102  -6.960   1.018   8.888
  762    HA   VAL 102           HA       VAL 102  -5.623   3.174   7.337
  763    HB   VAL 102           HB       VAL 102  -7.653   3.542   8.794
  764   HG11  VAL 102          HG11      VAL 102  -7.352   3.882  11.187
  765   HG12  VAL 102          HG12      VAL 102  -6.988   2.201  10.769
  766   HG13  VAL 102          HG13      VAL 102  -5.669   3.356  11.100
  767   HG21  VAL 102          HG21      VAL 102  -6.195   5.368   7.987
  768   HG22  VAL 102          HG22      VAL 102  -7.036   5.709   9.507
  769   HG23  VAL 102          HG23      VAL 102  -5.312   5.313   9.535
  770    H    GLY 103           H        GLY 103  -3.743   4.363   9.079
  771    HA2  GLY 103           HA2      GLY 103  -1.592   2.536   8.797
  772    HA3  GLY 103           HA3      GLY 103  -1.606   4.068   9.674
  773    H    ALA 104           H        ALA 104  -3.628   3.363  11.666
  774    HA   ALA 104           HA       ALA 104  -2.174   1.710  13.486
  775    HB1  ALA 104           HB1      ALA 104  -5.082   2.620  13.534
  776    HB2  ALA 104           HB2      ALA 104  -4.186   1.926  14.901
  777    HB3  ALA 104           HB3      ALA 104  -3.683   3.482  14.222
  778    H    ASP 105           H        ASP 105  -4.986   0.882  11.379
  779    HA   ASP 105           HA       ASP 105  -5.127  -1.788  12.576
  780    HB2  ASP 105           HB2      ASP 105  -7.079  -0.247  11.585
  781    HB3  ASP 105           HB3      ASP 105  -6.731  -1.183  10.131
  782    H    THR 106           H        THR 106  -3.164  -0.554  10.088
  783    HA   THR 106           HA       THR 106  -3.416  -2.828   8.305
  784    HB   THR 106           HB       THR 106  -2.909  -0.494   7.587
  785    HG1  THR 106           HG1      THR 106  -2.425  -2.679   6.477
  786   HG21  THR 106          HG21      THR 106  -0.658   0.299   7.442
  787   HG22  THR 106          HG22      THR 106  -0.993  -0.043   9.147
  788   HG23  THR 106          HG23      THR 106  -0.018  -1.175   8.197
  789    H    THR 107           H        THR 107  -2.036  -4.470   7.840
  790    HA   THR 107           HA       THR 107  -0.835  -5.606  10.127
  791    HB   THR 107           HB       THR 107  -1.829  -6.793   8.196
  792    HG1  THR 107           HG1      THR 107  -0.801  -8.500   8.708
  793   HG21  THR 107          HG21      THR 107  -0.535  -5.746   6.331
  794   HG22  THR 107          HG22      THR 107   0.928  -6.576   6.922
  795   HG23  THR 107          HG23      THR 107  -0.458  -7.517   6.342
  796    H    LEU 108           H        LEU 108   0.744  -3.715   7.574
  797    HA   LEU 108           HA       LEU 108   3.439  -4.282   8.084
  798    HB2  LEU 108           HB2      LEU 108   2.374  -2.829   6.246
  799    HB3  LEU 108           HB3      LEU 108   2.250  -1.547   7.443
  800    HG   LEU 108           HG       LEU 108   4.851  -1.919   7.756
  801   HD11  LEU 108          HD11      LEU 108   4.362  -3.084   4.973
  802   HD12  LEU 108          HD12      LEU 108   5.940  -2.637   5.654
  803   HD13  LEU 108          HD13      LEU 108   4.997  -3.970   6.374
  804   HD21  LEU 108          HD21      LEU 108   3.772   0.093   6.753
  805   HD22  LEU 108          HD22      LEU 108   5.344  -0.311   6.046
  806   HD23  LEU 108          HD23      LEU 108   3.874  -0.690   5.155
  807    H    SER 109           H        SER 109   1.425  -1.743   9.699
  808    HA   SER 109           HA       SER 109   3.550  -1.028  11.543
  809    HB2  SER 109           HB2      SER 109   2.065   0.524  12.479
  810    HB3  SER 109           HB3      SER 109   1.696   0.515  10.746
  811    HG   SER 109           HG       SER 109  -0.250   0.314  11.622
  812    H    GLN 110           H        GLN 110   0.849  -3.346  11.619
  813    HA   GLN 110           HA       GLN 110   0.906  -3.801  14.470
  814    HB2  GLN 110           HB2      GLN 110  -0.950  -4.434  12.901
  815    HB3  GLN 110           HB3      GLN 110   0.077  -5.667  12.214
  816    HG2  GLN 110           HG2      GLN 110  -1.397  -6.734  13.753
  817    HG3  GLN 110           HG3      GLN 110   0.230  -6.809  14.439
  818   HE21  GLN 110          HE22      GLN 110  -2.626  -4.592  14.384
  819   HE22  GLN 110          HE21      GLN 110  -2.390  -4.038  16.015
  820    H    ILE 111           H        ILE 111   2.641  -5.336  11.730
  821    HA   ILE 111           HA       ILE 111   3.953  -7.389  13.150
  822    HB   ILE 111           HB       ILE 111   4.775  -5.821  10.683
  823   HG12  ILE 111          HG12      ILE 111   3.912  -8.736  10.844
  824   HG13  ILE 111          HG13      ILE 111   2.719  -7.453  10.763
  825   HG21  ILE 111          HG21      ILE 111   6.125  -8.301  11.856
  826   HG22  ILE 111          HG22      ILE 111   6.428  -7.662  10.231
  827   HG23  ILE 111          HG23      ILE 111   6.867  -6.699  11.633
  828   HD11  ILE 111          HD11      ILE 111   3.710  -6.643   8.626
  829   HD12  ILE 111          HD12      ILE 111   4.846  -8.011   8.658
  830   HD13  ILE 111          HD13      ILE 111   3.105  -8.307   8.535
  831    H    VAL 112           H        VAL 112   5.332  -4.126  12.377
  832    HA   VAL 112           HA       VAL 112   7.600  -4.559  14.069
  833    HB   VAL 112           HB       VAL 112   8.113  -2.198  13.810
  834   HG11  VAL 112          HG11      VAL 112   7.197  -3.347  11.152
  835   HG12  VAL 112          HG12      VAL 112   8.531  -2.210  11.481
  836   HG13  VAL 112          HG13      VAL 112   8.646  -3.886  12.031
  837   HG21  VAL 112          HG21      VAL 112   5.791  -1.261  13.875
  838   HG22  VAL 112          HG22      VAL 112   6.760  -0.692  12.524
  839   HG23  VAL 112          HG23      VAL 112   5.517  -1.930  12.248
  840    H    LYS 113           H        LYS 113   4.411  -3.435  14.955
  841    HA   LYS 113           HA       LYS 113   5.217  -2.344  17.551
  842    HB2  LYS 113           HB2      LYS 113   2.583  -3.119  16.289
  843    HB3  LYS 113           HB3      LYS 113   2.695  -2.749  18.027
  844    HG2  LYS 113           HG2      LYS 113   3.655  -0.554  17.524
  845    HG3  LYS 113           HG3      LYS 113   3.666  -0.962  15.795
  846    HD2  LYS 113           HD2      LYS 113   1.057  -1.415  16.236
  847    HD3  LYS 113           HD3      LYS 113   1.327  -0.306  17.611
  848    HE2  LYS 113           HE2      LYS 113   2.355   1.321  16.079
  849    HE3  LYS 113           HE3      LYS 113   2.215   0.138  14.758
  850    HZ1  LYS 113           HZ1      LYS 113   0.398   1.818  14.719
  851    HZ2  LYS 113           HZ2      LYS 113  -0.183   0.275  14.936
  852    HZ3  LYS 113           HZ3      LYS 113  -0.105   1.321  16.199
  853    H    LEU 114           H        LEU 114   3.979  -5.527  16.421
  854    HA   LEU 114           HA       LEU 114   4.092  -6.714  19.040
  855    HB2  LEU 114           HB2      LEU 114   2.980  -7.378  16.599
  856    HB3  LEU 114           HB3      LEU 114   4.324  -8.520  16.695
  857    HG   LEU 114           HG       LEU 114   2.127  -8.115  18.746
  858   HD11  LEU 114          HD11      LEU 114   1.315  -9.115  16.653
  859   HD12  LEU 114          HD12      LEU 114   2.574 -10.362  16.742
  860   HD13  LEU 114          HD13      LEU 114   1.291 -10.298  17.971
  861   HD21  LEU 114          HD21      LEU 114   4.140  -8.985  19.855
  862   HD22  LEU 114          HD22      LEU 114   2.951 -10.275  19.704
  863   HD23  LEU 114          HD23      LEU 114   4.326 -10.213  18.578
  864    H    VAL 115           H        VAL 115   6.459  -6.512  16.377
  865    HA   VAL 115           HA       VAL 115   8.482  -8.112  17.748
  866    HB   VAL 115           HB       VAL 115   8.736  -6.105  15.486
  867   HG11  VAL 115          HG11      VAL 115  10.933  -6.267  16.547
  868   HG12  VAL 115          HG12      VAL 115  10.795  -8.038  16.646
  869   HG13  VAL 115          HG13      VAL 115  10.955  -7.235  15.071
  870   HG21  VAL 115          HG21      VAL 115   7.455  -8.217  14.973
  871   HG22  VAL 115          HG22      VAL 115   8.979  -8.115  14.090
  872   HG23  VAL 115          HG23      VAL 115   8.847  -9.158  15.520
  873    H    GLU 116           H        GLU 116   7.388  -4.849  18.216
  874    HA   GLU 116           HA       GLU 116   9.808  -3.927  19.631
  875    HB2  GLU 116           HB2      GLU 116   7.448  -2.686  18.630
  876    HB3  GLU 116           HB3      GLU 116   7.362  -2.501  20.368
  877    HG2  GLU 116           HG2      GLU 116   9.729  -1.712  18.615
  878    HG3  GLU 116           HG3      GLU 116   8.465  -0.613  19.165
  879    H    GLU 117           H        GLU 117   6.879  -5.745  20.411
  880    HA   GLU 117           HA       GLU 117   7.177  -5.497  23.300
  881    HB2  GLU 117           HB2      GLU 117   5.531  -7.425  21.611
  882    HB3  GLU 117           HB3      GLU 117   5.536  -7.333  23.359
  883    HG2  GLU 117           HG2      GLU 117   4.955  -4.796  23.020
  884    HG3  GLU 117           HG3      GLU 117   4.549  -5.274  21.375
  885    H    ALA 118           H        ALA 118   8.932  -7.353  20.953
  886    HA   ALA 118           HA       ALA 118   9.478  -9.615  22.712
  887    HB1  ALA 118           HB1      ALA 118  11.149 -10.205  21.005
  888    HB2  ALA 118           HB2      ALA 118   9.550  -9.902  20.301
  889    HB3  ALA 118           HB3      ALA 118  10.826  -8.681  20.149
  890    H    GLN 119           H        GLN 119  11.697  -7.101  21.465
  891    HA   GLN 119           HA       GLN 119  13.666  -7.180  23.360
  892    HB2  GLN 119           HB2      GLN 119  12.637  -4.803  21.789
  893    HB3  GLN 119           HB3      GLN 119  14.126  -4.792  22.702
  894    HG2  GLN 119           HG2      GLN 119  14.792  -5.243  20.493
  895    HG3  GLN 119           HG3      GLN 119  14.916  -6.808  21.332
  896   HE21  GLN 119          HE22      GLN 119  12.678  -4.781  19.452
  897   HE22  GLN 119          HE21      GLN 119  11.722  -6.162  18.965
  Start of MODEL   16
    1    H    SER   1           H        SER   1  17.348  -5.500  13.968
    2    HA   SER   1           HA       SER   1  15.364  -3.612  15.101
    3    HB2  SER   1           HB2      SER   1  18.384  -3.772  15.328
    4    HB3  SER   1           HB3      SER   1  17.387  -2.504  16.069
    5    HG   SER   1           HG       SER   1  17.862  -4.347  17.462
    6    H    GLU   2           H        GLU   2  17.634  -3.771  12.397
    7    HA   GLU   2           HA       GLU   2  17.410  -0.970  11.649
    8    HB2  GLU   2           HB2      GLU   2  19.276  -2.601  11.110
    9    HB3  GLU   2           HB3      GLU   2  18.231  -3.355   9.926
   10    HG2  GLU   2           HG2      GLU   2  18.860  -0.371   9.860
   11    HG3  GLU   2           HG3      GLU   2  19.987  -1.558   9.215
   12    H    ALA   3           H        ALA   3  15.784  -3.986  10.712
   13    HA   ALA   3           HA       ALA   3  13.890  -2.901   8.866
   14    HB1  ALA   3           HB1      ALA   3  12.693  -5.004   9.256
   15    HB2  ALA   3           HB2      ALA   3  14.433  -5.306   9.089
   16    HB3  ALA   3           HB3      ALA   3  13.681  -5.332  10.695
   17    H    LEU   4           H        LEU   4  13.570  -3.555  12.395
   18    HA   LEU   4           HA       LEU   4  11.079  -2.555  12.885
   19    HB2  LEU   4           HB2      LEU   4  12.939  -3.455  14.533
   20    HB3  LEU   4           HB3      LEU   4  13.342  -1.761  14.735
   21    HG   LEU   4           HG       LEU   4  10.796  -1.454  15.315
   22   HD11  LEU   4          HD11      LEU   4  11.179  -4.446  15.791
   23   HD12  LEU   4          HD12      LEU   4   9.763  -3.479  16.252
   24   HD13  LEU   4          HD13      LEU   4  10.142  -3.741  14.539
   25   HD21  LEU   4          HD21      LEU   4  11.201  -2.073  17.660
   26   HD22  LEU   4          HD22      LEU   4  12.635  -3.011  17.187
   27   HD23  LEU   4          HD23      LEU   4  12.607  -1.246  16.977
   28    H    ALA   5           H        ALA   5  13.854  -0.548  12.118
   29    HA   ALA   5           HA       ALA   5  12.411   1.991  12.559
   30    HB1  ALA   5           HB1      ALA   5  15.200   1.279  11.522
   31    HB2  ALA   5           HB2      ALA   5  14.552   2.921  11.563
   32    HB3  ALA   5           HB3      ALA   5  14.776   2.023  13.077
   33    H    LYS   6           H        LYS   6  13.686   0.037   9.798
   34    HA   LYS   6           HA       LYS   6  12.977   1.818   7.749
   35    HB2  LYS   6           HB2      LYS   6  14.542  -0.118   7.651
   36    HB3  LYS   6           HB3      LYS   6  13.166  -1.218   7.588
   37    HG2  LYS   6           HG2      LYS   6  12.744  -0.780   5.379
   38    HG3  LYS   6           HG3      LYS   6  13.073   0.945   5.550
   39    HD2  LYS   6           HD2      LYS   6  14.730  -0.007   4.076
   40    HD3  LYS   6           HD3      LYS   6  15.492   0.532   5.575
   41    HE2  LYS   6           HE2      LYS   6  15.239  -1.974   6.329
   42    HE3  LYS   6           HE3      LYS   6  14.940  -2.288   4.606
   43    HZ1  LYS   6           HZ1      LYS   6  17.390  -1.469   5.946
   44    HZ2  LYS   6           HZ2      LYS   6  17.180  -2.427   4.594
   45    HZ3  LYS   6           HZ3      LYS   6  17.126  -0.801   4.463
   46    H    LEU   7           H        LEU   7  10.897  -0.636   9.243
   47    HA   LEU   7           HA       LEU   7   8.718  -0.493   7.397
   48    HB2  LEU   7           HB2      LEU   7   9.045  -1.217  10.295
   49    HB3  LEU   7           HB3      LEU   7   7.420  -0.934   9.701
   50    HG   LEU   7           HG       LEU   7   7.813  -3.266   9.689
   51   HD11  LEU   7          HD11      LEU   7   7.196  -3.862   7.482
   52   HD12  LEU   7          HD12      LEU   7   6.567  -2.230   7.778
   53   HD13  LEU   7          HD13      LEU   7   8.011  -2.457   6.769
   54   HD21  LEU   7          HD21      LEU   7  10.193  -3.476   9.568
   55   HD22  LEU   7          HD22      LEU   7   9.485  -4.369   8.221
   56   HD23  LEU   7          HD23      LEU   7  10.237  -2.784   7.926
   57    H    ILE   8           H        ILE   8   9.641   1.839   9.913
   58    HA   ILE   8           HA       ILE   8   7.250   3.463   9.583
   59    HB   ILE   8           HB       ILE   8   9.936   4.172  10.782
   60   HG12  ILE   8          HG12      ILE   8   8.850   2.344  11.975
   61   HG13  ILE   8          HG13      ILE   8   8.870   3.812  12.941
   62   HG21  ILE   8          HG21      ILE   8   7.297   5.675  10.772
   63   HG22  ILE   8          HG22      ILE   8   8.624   6.007  11.909
   64   HG23  ILE   8          HG23      ILE   8   8.873   6.228  10.176
   65   HD11  ILE   8          HD11      ILE   8   6.443   4.165  12.345
   66   HD12  ILE   8          HD12      ILE   8   6.468   2.602  11.495
   67   HD13  ILE   8          HD13      ILE   8   6.757   2.670  13.240
   68    H    SER   9           H        SER   9  10.498   3.442   8.110
   69    HA   SER   9           HA       SER   9  10.209   5.947   6.657
   70    HB2  SER   9           HB2      SER   9  12.091   3.595   6.245
   71    HB3  SER   9           HB3      SER   9  12.253   5.191   5.498
   72    HG   SER   9           HG       SER   9  13.441   4.635   7.558
   73    H    LEU  10           H        LEU  10   9.217   2.666   6.062
   74    HA   LEU  10           HA       LEU  10   8.640   2.893   3.235
   75    HB2  LEU  10           HB2      LEU  10   8.039   0.941   5.463
   76    HB3  LEU  10           HB3      LEU  10   7.271   0.747   3.899
   77    HG   LEU  10           HG       LEU  10  10.297   1.010   4.124
   78   HD11  LEU  10          HD11      LEU  10   8.623  -1.535   4.231
   79   HD12  LEU  10          HD12      LEU  10  10.382  -1.464   3.971
   80   HD13  LEU  10          HD13      LEU  10   9.705  -0.907   5.499
   81   HD21  LEU  10          HD21      LEU  10   9.217   1.277   1.866
   82   HD22  LEU  10          HD22      LEU  10  10.272  -0.137   1.971
   83   HD23  LEU  10          HD23      LEU  10   8.511  -0.345   2.057
   84    H    GLN  11           H        GLN  11   6.973   4.217   5.956
   85    HA   GLN  11           HA       GLN  11   4.384   4.243   4.530
   86    HB2  GLN  11           HB2      GLN  11   5.159   5.093   7.294
   87    HB3  GLN  11           HB3      GLN  11   3.639   5.593   6.531
   88    HG2  GLN  11           HG2      GLN  11   3.082   3.223   6.018
   89    HG3  GLN  11           HG3      GLN  11   4.549   2.714   6.871
   90   HE21  GLN  11          HE22      GLN  11   4.688   3.097   9.167
   91   HE22  GLN  11          HE21      GLN  11   3.225   3.336  10.094
   92    H    ALA  12           H        ALA  12   3.285   6.032   3.943
   93    HA   ALA  12           HA       ALA  12   4.903   7.896   2.442
   94    HB1  ALA  12           HB1      ALA  12   1.884   7.506   2.625
   95    HB2  ALA  12           HB2      ALA  12   2.741   8.392   1.354
   96    HB3  ALA  12           HB3      ALA  12   2.983   6.651   1.516
   97    H    THR  13           H        THR  13   4.195  10.139   2.096
   98    HA   THR  13           HA       THR  13   3.520  11.670   4.581
   99    HB   THR  13           HB       THR  13   4.531  12.624   1.876
  100    HG1  THR  13           HG1      THR  13   6.414  13.024   3.107
  101   HG21  THR  13          HG21      THR  13   4.194  14.111   4.520
  102   HG22  THR  13          HG22      THR  13   5.018  14.746   3.079
  103   HG23  THR  13          HG23      THR  13   3.288  14.418   3.024
  104    H    GLU  14           H        GLU  14   2.450  11.179   1.218
  105    HA   GLU  14           HA       GLU  14  -0.261  12.195   1.891
  106    HB2  GLU  14           HB2      GLU  14  -0.345  13.692   0.053
  107    HB3  GLU  14           HB3      GLU  14   1.105  14.045   0.987
  108    HG2  GLU  14           HG2      GLU  14   2.464  12.818  -0.732
  109    HG3  GLU  14           HG3      GLU  14   0.988  12.546  -1.665
  110    H    ALA  15           H        ALA  15  -1.859  11.780   0.190
  111    HA   ALA  15           HA       ALA  15  -1.362   9.403  -1.518
  112    HB1  ALA  15           HB1      ALA  15  -2.133   8.576   0.680
  113    HB2  ALA  15           HB2      ALA  15  -3.555   9.640   0.596
  114    HB3  ALA  15           HB3      ALA  15  -3.372   8.303  -0.557
  115    H    THR  16           H        THR  16  -3.369   8.901  -2.830
  116    HA   THR  16           HA       THR  16  -4.872  11.368  -3.675
  117    HB   THR  16           HB       THR  16  -3.661   9.309  -5.555
  118    HG1  THR  16           HG1      THR  16  -2.021  10.570  -4.883
  119   HG21  THR  16          HG21      THR  16  -5.721  10.333  -6.471
  120   HG22  THR  16          HG22      THR  16  -5.112  11.954  -6.065
  121   HG23  THR  16          HG23      THR  16  -4.294  10.967  -7.299
  122    H    ILE  17           H        ILE  17  -6.908  11.057  -3.223
  123    HA   ILE  17           HA       ILE  17  -8.203   8.372  -3.382
  124    HB   ILE  17           HB       ILE  17  -9.169  10.968  -2.108
  125   HG12  ILE  17          HG12      ILE  17  -7.894   8.521  -0.810
  126   HG13  ILE  17          HG13      ILE  17  -7.216  10.138  -0.895
  127   HG21  ILE  17          HG21      ILE  17 -10.307   8.143  -1.927
  128   HG22  ILE  17          HG22      ILE  17 -10.923   9.562  -1.053
  129   HG23  ILE  17          HG23      ILE  17 -11.046   9.516  -2.784
  130   HD11  ILE  17          HD11      ILE  17  -8.080   9.723   1.326
  131   HD12  ILE  17          HD12      ILE  17  -9.057  10.989   0.541
  132   HD13  ILE  17          HD13      ILE  17  -9.669   9.328   0.707
  133    H    VAL  18           H        VAL  18 -10.023   8.015  -4.688
  134    HA   VAL  18           HA       VAL  18 -10.784  10.248  -6.533
  135    HB   VAL  18           HB       VAL  18 -11.439   8.667  -8.203
  136   HG11  VAL  18          HG11      VAL  18  -8.578   8.089  -7.332
  137   HG12  VAL  18          HG12      VAL  18  -9.242   8.177  -8.981
  138   HG13  VAL  18          HG13      VAL  18  -9.083   9.641  -8.001
  139   HG21  VAL  18          HG21      VAL  18 -11.906   6.637  -6.844
  140   HG22  VAL  18          HG22      VAL  18 -10.729   6.318  -8.129
  141   HG23  VAL  18          HG23      VAL  18 -10.173   6.512  -6.456
  142    H    THR  19           H        THR  19 -12.712  10.942  -6.686
  143    HA   THR  19           HA       THR  19 -14.784   9.839  -4.839
  144    HB   THR  19           HB       THR  19 -14.313  12.697  -5.722
  145    HG1  THR  19           HG1      THR  19 -13.583  13.001  -3.762
  146   HG21  THR  19          HG21      THR  19 -16.005  13.205  -3.903
  147   HG22  THR  19          HG22      THR  19 -16.704  12.455  -5.335
  148   HG23  THR  19          HG23      THR  19 -16.419  11.480  -3.872
  149    H    LEU  20           H        LEU  20 -16.897   9.492  -5.429
  150    HA   LEU  20           HA       LEU  20 -17.819  10.382  -8.052
  151    HB2  LEU  20           HB2      LEU  20 -18.444   7.552  -7.143
  152    HB3  LEU  20           HB3      LEU  20 -18.915   8.340  -8.613
  153    HG   LEU  20           HG       LEU  20 -15.987   7.763  -7.974
  154   HD11  LEU  20          HD11      LEU  20 -16.368   5.816  -9.574
  155   HD12  LEU  20          HD12      LEU  20 -16.995   5.651  -7.927
  156   HD13  LEU  20          HD13      LEU  20 -18.103   6.007  -9.240
  157   HD21  LEU  20          HD21      LEU  20 -17.438   8.345 -10.597
  158   HD22  LEU  20          HD22      LEU  20 -16.344   9.444  -9.732
  159   HD23  LEU  20          HD23      LEU  20 -15.721   7.939 -10.407
  160    H    ASP  21           H        ASP  21 -18.942  11.924  -7.069
  161    HA   ASP  21           HA       ASP  21 -20.731  11.359  -4.750
  162    HB2  ASP  21           HB2      ASP  21 -19.108  13.559  -5.413
  163    HB3  ASP  21           HB3      ASP  21 -20.734  14.127  -5.728
  164    H    SER  22           H        SER  22 -20.937  10.752  -7.685
  165    HA   SER  22           HA       SER  22 -23.784  10.862  -8.096
  166    HB2  SER  22           HB2      SER  22 -22.086  12.113 -10.283
  167    HB3  SER  22           HB3      SER  22 -23.847  11.925 -10.249
  168    HG   SER  22           HG       SER  22 -23.174  14.038  -9.799
  169    H    ASP  23           H        ASP  23 -24.225   8.981  -8.863
  170    HA   ASP  23           HA       ASP  23 -22.992   6.746  -8.747
  171    HB2  ASP  23           HB2      ASP  23 -25.387   7.137  -9.049
  172    HB3  ASP  23           HB3      ASP  23 -25.156   7.310 -10.792
  173    H    ASN  24           H        ASN  24 -20.868   7.378  -9.630
  174    HA   ASN  24           HA       ASN  24 -19.075   6.951 -10.819
  175    HB2  ASN  24           HB2      ASN  24 -20.277   4.570 -10.853
  176    HB3  ASN  24           HB3      ASN  24 -20.366   4.860 -12.590
  177   HD21  ASN  24          HD22      ASN  24 -17.831   5.923 -13.084
  178   HD22  ASN  24          HD21      ASN  24 -16.670   4.697 -12.521
  179    H    ILE  25           H        ILE  25 -20.597   8.921 -11.478
  180    HA   ILE  25           HA       ILE  25 -20.181   9.412 -14.410
  181    HB   ILE  25           HB       ILE  25 -22.290  10.787 -14.478
  182   HG12  ILE  25          HG12      ILE  25 -23.014   9.274 -11.965
  183   HG13  ILE  25          HG13      ILE  25 -22.663  11.006 -12.080
  184   HG21  ILE  25          HG21      ILE  25 -23.645   8.831 -15.016
  185   HG22  ILE  25          HG22      ILE  25 -21.979   8.529 -15.500
  186   HG23  ILE  25          HG23      ILE  25 -22.612   7.793 -14.018
  187   HD11  ILE  25          HD11      ILE  25 -25.055  10.682 -11.988
  188   HD12  ILE  25          HD12      ILE  25 -24.633  11.246 -13.617
  189   HD13  ILE  25          HD13      ILE  25 -25.012   9.532 -13.328
  190    H    LEU  26           H        LEU  26 -20.135  10.855 -11.219
  191    HA   LEU  26           HA       LEU  26 -19.544  13.472 -12.003
  192    HB2  LEU  26           HB2      LEU  26 -20.073  12.885  -9.692
  193    HB3  LEU  26           HB3      LEU  26 -18.546  12.013  -9.531
  194    HG   LEU  26           HG       LEU  26 -17.289  14.136  -9.818
  195   HD11  LEU  26          HD11      LEU  26 -20.047  15.446  -9.896
  196   HD12  LEU  26          HD12      LEU  26 -18.494  16.301  -9.719
  197   HD13  LEU  26          HD13      LEU  26 -18.843  15.436 -11.214
  198   HD21  LEU  26          HD21      LEU  26 -19.444  14.295  -7.710
  199   HD22  LEU  26          HD22      LEU  26 -17.878  13.426  -7.578
  200   HD23  LEU  26          HD23      LEU  26 -17.910  15.182  -7.705
  201    H    LEU  27           H        LEU  27 -16.829  11.176 -10.989
  202    HA   LEU  27           HA       LEU  27 -14.758  11.022 -11.530
  203    HB2  LEU  27           HB2      LEU  27 -15.289  12.616 -14.045
  204    HB3  LEU  27           HB3      LEU  27 -13.773  11.885 -13.588
  205    HG   LEU  27           HG       LEU  27 -14.715  10.486 -15.192
  206   HD11  LEU  27          HD11      LEU  27 -13.718   9.282 -13.251
  207   HD12  LEU  27          HD12      LEU  27 -15.350   9.067 -12.574
  208   HD13  LEU  27          HD13      LEU  27 -14.931   8.333 -14.126
  209   HD21  LEU  27          HD21      LEU  27 -17.103  11.243 -14.956
  210   HD22  LEU  27          HD22      LEU  27 -16.875   9.499 -15.226
  211   HD23  LEU  27          HD23      LEU  27 -17.268  10.096 -13.614
  212    H    SER  28           H        SER  28 -14.236  11.929  -9.676
  213    HA   SER  28           HA       SER  28 -12.840  14.569  -9.865
  214    HB2  SER  28           HB2      SER  28 -15.013  14.907  -8.762
  215    HB3  SER  28           HB3      SER  28 -14.638  13.620  -7.615
  216    HG   SER  28           HG       SER  28 -14.147  15.480  -6.634
  217    H    GLU  29           H        GLU  29 -11.006  14.801  -8.410
  218    HA   GLU  29           HA       GLU  29 -10.123  12.375  -6.948
  219    HB2  GLU  29           HB2      GLU  29  -8.196  14.021  -8.617
  220    HB3  GLU  29           HB3      GLU  29  -7.880  12.573  -7.677
  221    HG2  GLU  29           HG2      GLU  29  -7.891  11.718  -9.802
  222    HG3  GLU  29           HG3      GLU  29  -9.530  11.365  -9.269
  223    H    GLU  30           H        GLU  30  -9.174  12.773  -5.034
  224    HA   GLU  30           HA       GLU  30  -8.697  15.607  -4.159
  225    HB2  GLU  30           HB2      GLU  30  -9.257  13.538  -2.104
  226    HB3  GLU  30           HB3      GLU  30  -9.668  15.227  -2.110
  227    HG2  GLU  30           HG2      GLU  30 -11.170  13.092  -3.717
  228    HG3  GLU  30           HG3      GLU  30 -11.503  13.465  -2.046
  229    H    GLN  31           H        GLN  31  -6.541  16.020  -3.425
  230    HA   GLN  31           HA       GLN  31  -4.872  13.645  -2.754
  231    HB2  GLN  31           HB2      GLN  31  -4.214  16.460  -3.628
  232    HB3  GLN  31           HB3      GLN  31  -3.115  15.568  -2.585
  233    HG2  GLN  31           HG2      GLN  31  -3.738  13.696  -4.607
  234    HG3  GLN  31           HG3      GLN  31  -3.577  15.237  -5.454
  235   HE21  GLN  31          HE21      GLN  31  -1.927  13.150  -3.003
  236   HE22  GLN  31          HE22      GLN  31  -0.310  13.788  -3.373
  237    H    VAL  32           H        VAL  32  -4.240  13.245  -0.790
  238    HA   VAL  32           HA       VAL  32  -5.005  15.110   1.428
  239    HB   VAL  32           HB       VAL  32  -5.969  13.311   2.680
  240   HG11  VAL  32          HG11      VAL  32  -7.247  13.273  -0.075
  241   HG12  VAL  32          HG12      VAL  32  -8.014  12.937   1.488
  242   HG13  VAL  32          HG13      VAL  32  -7.443  14.571   1.130
  243   HG21  VAL  32          HG21      VAL  32  -4.670  11.381   1.856
  244   HG22  VAL  32          HG22      VAL  32  -6.399  11.087   1.781
  245   HG23  VAL  32          HG23      VAL  32  -5.514  11.475   0.289
  246    H    ASP  33           H        ASP  33  -4.028  14.802   3.400
  247    HA   ASP  33           HA       ASP  33  -1.275  13.831   3.409
  248    HB2  ASP  33           HB2      ASP  33  -3.052  14.812   5.678
  249    HB3  ASP  33           HB3      ASP  33  -1.320  14.530   5.772
  250    H    VAL  34           H        VAL  34  -0.430  11.989   4.667
  251    HA   VAL  34           HA       VAL  34  -1.944   9.715   4.152
  252    HB   VAL  34           HB       VAL  34   0.521   9.838   4.292
  253   HG11  VAL  34          HG11      VAL  34   0.835  10.951   6.448
  254   HG12  VAL  34          HG12      VAL  34   0.101   9.574   7.306
  255   HG13  VAL  34          HG13      VAL  34   1.628   9.375   6.460
  256   HG21  VAL  34          HG21      VAL  34  -0.685   7.672   4.130
  257   HG22  VAL  34          HG22      VAL  34   0.869   7.555   4.980
  258   HG23  VAL  34          HG23      VAL  34  -0.644   7.536   5.898
  259    H    GLU  35           H        GLU  35  -1.948  11.445   7.264
  260    HA   GLU  35           HA       GLU  35  -3.318   9.258   8.629
  261    HB2  GLU  35           HB2      GLU  35  -1.833  10.937   9.694
  262    HB3  GLU  35           HB3      GLU  35  -3.079  12.161   9.459
  263    HG2  GLU  35           HG2      GLU  35  -4.529  11.119  11.041
  264    HG3  GLU  35           HG3      GLU  35  -3.695   9.564  10.908
  265    H    LEU  36           H        LEU  36  -4.422  11.388   6.282
  266    HA   LEU  36           HA       LEU  36  -7.224  11.474   7.257
  267    HB2  LEU  36           HB2      LEU  36  -5.989  12.834   4.854
  268    HB3  LEU  36           HB3      LEU  36  -7.553  13.173   5.577
  269    HG   LEU  36           HG       LEU  36  -4.825  13.742   6.828
  270   HD11  LEU  36          HD11      LEU  36  -6.975  15.638   5.812
  271   HD12  LEU  36          HD12      LEU  36  -5.400  16.082   6.500
  272   HD13  LEU  36          HD13      LEU  36  -5.479  15.237   4.945
  273   HD21  LEU  36          HD21      LEU  36  -6.442  13.252   8.603
  274   HD22  LEU  36          HD22      LEU  36  -6.101  14.984   8.552
  275   HD23  LEU  36          HD23      LEU  36  -7.619  14.362   7.862
  276    H    VAL  37           H        VAL  37  -5.402   9.365   5.383
  277    HA   VAL  37           HA       VAL  37  -7.755   8.503   3.751
  278    HB   VAL  37           HB       VAL  37  -5.908   8.698   2.317
  279   HG11  VAL  37          HG11      VAL  37  -4.008   8.733   3.793
  280   HG12  VAL  37          HG12      VAL  37  -4.252   7.025   4.239
  281   HG13  VAL  37          HG13      VAL  37  -3.778   7.470   2.586
  282   HG21  VAL  37          HG21      VAL  37  -7.299   6.693   2.001
  283   HG22  VAL  37          HG22      VAL  37  -5.619   6.429   1.495
  284   HG23  VAL  37          HG23      VAL  37  -6.188   5.749   3.024
  285    H    GLN  38           H        GLN  38  -8.838   6.640   4.299
  286    HA   GLN  38           HA       GLN  38  -7.860   5.054   6.580
  287    HB2  GLN  38           HB2      GLN  38 -10.531   6.521   6.779
  288    HB3  GLN  38           HB3      GLN  38  -9.719   5.533   7.996
  289    HG2  GLN  38           HG2      GLN  38  -7.879   7.281   8.040
  290    HG3  GLN  38           HG3      GLN  38  -8.858   8.261   6.934
  291   HE21  GLN  38          HE22      GLN  38 -11.233   8.614   7.839
  292   HE22  GLN  38          HE21      GLN  38 -11.095   9.098   9.510
  293    H    ARG  39           H        ARG  39 -10.066   3.657   7.199
  294    HA   ARG  39           HA       ARG  39  -9.797   1.609   5.251
  295    HB2  ARG  39           HB2      ARG  39 -10.922   0.206   6.847
  296    HB3  ARG  39           HB3      ARG  39  -9.881   1.316   7.747
  297    HG2  ARG  39           HG2      ARG  39 -11.955   2.748   8.062
  298    HG3  ARG  39           HG3      ARG  39 -12.896   1.422   7.374
  299    HD2  ARG  39           HD2      ARG  39 -12.078  -0.085   9.182
  300    HD3  ARG  39           HD3      ARG  39 -11.171   1.271   9.875
  301    HE   ARG  39           HE       ARG  39 -13.966   1.966   9.498
  302   HH11  ARG  39          HH11      ARG  39 -11.951   0.250  11.908
  303   HH12  ARG  39          HH12      ARG  39 -13.233   0.499  13.083
  304   HH21  ARG  39          HH21      ARG  39 -15.335   2.188  11.058
  305   HH22  ARG  39          HH22      ARG  39 -14.996   1.567  12.675
  306    H    GLY  40           H        GLY  40 -11.550   3.927   4.330
  307    HA2  GLY  40           HA2      GLY  40 -13.586   2.216   2.973
  308    HA3  GLY  40           HA3      GLY  40 -14.127   3.694   3.771
  309    H    ASP  41           H        ASP  41 -11.007   4.186   2.399
  310    HA   ASP  41           HA       ASP  41 -12.189   5.772   0.224
  311    HB2  ASP  41           HB2      ASP  41  -9.389   5.597   1.379
  312    HB3  ASP  41           HB3      ASP  41  -9.888   6.712   0.099
  313    H    ILE  42           H        ILE  42 -11.665   5.711  -1.970
  314    HA   ILE  42           HA       ILE  42 -10.248   3.274  -2.959
  315    HB   ILE  42           HB       ILE  42 -12.099   5.109  -4.482
  316   HG12  ILE  42          HG12      ILE  42 -13.438   3.865  -2.921
  317   HG13  ILE  42          HG13      ILE  42 -13.652   3.219  -4.535
  318   HG21  ILE  42          HG21      ILE  42 -10.696   2.510  -5.266
  319   HG22  ILE  42          HG22      ILE  42 -11.971   3.307  -6.216
  320   HG23  ILE  42          HG23      ILE  42 -10.426   4.116  -5.959
  321   HD11  ILE  42          HD11      ILE  42 -13.613   1.410  -2.943
  322   HD12  ILE  42          HD12      ILE  42 -12.158   1.301  -3.947
  323   HD13  ILE  42          HD13      ILE  42 -12.063   1.946  -2.287
  324    H    ILE  43           H        ILE  43  -8.211   3.569  -3.538
  325    HA   ILE  43           HA       ILE  43  -7.111   6.178  -4.218
  326    HB   ILE  43           HB       ILE  43  -5.883   3.435  -3.738
  327   HG12  ILE  43          HG12      ILE  43  -7.032   4.034  -1.723
  328   HG13  ILE  43          HG13      ILE  43  -5.319   4.242  -1.460
  329   HG21  ILE  43          HG21      ILE  43  -4.198   4.735  -4.841
  330   HG22  ILE  43          HG22      ILE  43  -4.524   6.150  -3.806
  331   HG23  ILE  43          HG23      ILE  43  -3.793   4.685  -3.139
  332   HD11  ILE  43          HD11      ILE  43  -5.547   6.701  -1.688
  333   HD12  ILE  43          HD12      ILE  43  -7.284   6.512  -2.028
  334   HD13  ILE  43          HD13      ILE  43  -6.650   6.055  -0.455
  335    H    LYS  44           H        LYS  44  -5.365   6.171  -5.878
  336    HA   LYS  44           HA       LYS  44  -5.798   4.515  -8.283
  337    HB2  LYS  44           HB2      LYS  44  -7.267   6.426  -8.685
  338    HB3  LYS  44           HB3      LYS  44  -5.863   7.513  -8.588
  339    HG2  LYS  44           HG2      LYS  44  -4.783   6.309 -10.449
  340    HG3  LYS  44           HG3      LYS  44  -6.096   5.127 -10.504
  341    HD2  LYS  44           HD2      LYS  44  -6.463   8.097 -10.970
  342    HD3  LYS  44           HD3      LYS  44  -6.123   6.914 -12.253
  343    HE2  LYS  44           HE2      LYS  44  -8.198   5.659 -11.492
  344    HE3  LYS  44           HE3      LYS  44  -8.591   7.053 -10.479
  345    HZ1  LYS  44           HZ1      LYS  44  -8.533   8.391 -12.608
  346    HZ2  LYS  44           HZ2      LYS  44  -8.372   6.972 -13.438
  347    HZ3  LYS  44           HZ3      LYS  44  -9.722   7.303 -12.540
  348    H    VAL  45           H        VAL  45  -3.830   3.798  -8.940
  349    HA   VAL  45           HA       VAL  45  -1.403   5.396  -8.245
  350    HB   VAL  45           HB       VAL  45  -2.030   3.420  -6.738
  351   HG11  VAL  45          HG11      VAL  45  -0.939   1.788  -9.073
  352   HG12  VAL  45          HG12      VAL  45  -1.301   1.199  -7.450
  353   HG13  VAL  45          HG13      VAL  45  -2.613   1.808  -8.479
  354   HG21  VAL  45          HG21      VAL  45   0.235   4.498  -6.783
  355   HG22  VAL  45          HG22      VAL  45   0.309   2.762  -6.441
  356   HG23  VAL  45          HG23      VAL  45   0.736   3.357  -8.055
  357    H    VAL  46           H        VAL  46   0.312   5.402  -9.596
  358    HA   VAL  46           HA       VAL  46  -0.224   4.621 -12.383
  359    HB   VAL  46           HB       VAL  46   1.392   6.267 -12.994
  360   HG11  VAL  46          HG11      VAL  46  -0.800   7.131 -12.132
  361   HG12  VAL  46          HG12      VAL  46   0.010   7.440 -10.573
  362   HG13  VAL  46          HG13      VAL  46   0.552   8.279 -12.032
  363   HG21  VAL  46          HG21      VAL  46   2.275   6.362 -10.087
  364   HG22  VAL  46          HG22      VAL  46   3.229   5.857 -11.492
  365   HG23  VAL  46          HG23      VAL  46   2.742   7.541 -11.327
  366    HA   PRO  47           HA       PRO  47   3.262   1.697 -12.656
  367    HB2  PRO  47           HB2      PRO  47   4.336   2.331 -15.126
  368    HB3  PRO  47           HB3      PRO  47   2.857   1.353 -14.900
  369    HG2  PRO  47           HG2      PRO  47   3.063   4.319 -15.487
  370    HG3  PRO  47           HG3      PRO  47   2.009   3.093 -16.272
  371    HD2  PRO  47           HD2      PRO  47   1.043   4.693 -14.356
  372    HD3  PRO  47           HD3      PRO  47   0.595   2.970 -14.395
  373    H    GLY  48           H        GLY  48   4.633   2.315 -11.151
  374    HA2  GLY  48           HA2      GLY  48   6.770   3.145 -10.391
  375    HA3  GLY  48           HA3      GLY  48   6.697   4.459 -11.582
  376    H    GLY  49           H        GLY  49   5.168   3.174  -8.660
  377    HA2  GLY  49           HA2      GLY  49   4.638   5.635  -7.403
  378    HA3  GLY  49           HA3      GLY  49   3.117   4.962  -8.019
  379    H    LYS  50           H        LYS  50   3.557   5.187  -5.235
  380    HA   LYS  50           HA       LYS  50   4.097   2.364  -4.349
  381    HB2  LYS  50           HB2      LYS  50   4.727   4.902  -2.812
  382    HB3  LYS  50           HB3      LYS  50   5.106   3.238  -2.349
  383    HG2  LYS  50           HG2      LYS  50   6.648   3.058  -4.295
  384    HG3  LYS  50           HG3      LYS  50   6.324   4.759  -4.692
  385    HD2  LYS  50           HD2      LYS  50   7.112   5.416  -2.414
  386    HD3  LYS  50           HD3      LYS  50   7.512   3.718  -2.086
  387    HE2  LYS  50           HE2      LYS  50   9.104   3.796  -4.055
  388    HE3  LYS  50           HE3      LYS  50   8.746   5.523  -4.216
  389    HZ1  LYS  50           HZ1      LYS  50  10.734   5.158  -2.853
  390    HZ2  LYS  50           HZ2      LYS  50   9.562   5.855  -1.976
  391    HZ3  LYS  50           HZ3      LYS  50   9.883   4.239  -1.790
  392    H    PHE  51           H        PHE  51   3.024   1.561  -2.581
  393    HA   PHE  51           HA       PHE  51   0.293   2.563  -2.230
  394    HB2  PHE  51           HB2      PHE  51   1.673   0.126  -1.147
  395    HB3  PHE  51           HB3      PHE  51  -0.056   0.451  -1.026
  396    HD1  PHE  51           HD2      PHE  51  -1.226   0.951  -3.436
  397    HD2  PHE  51           HD1      PHE  51   2.412  -1.286  -2.834
  398    HE1  PHE  51           HE2      PHE  51  -1.558  -0.203  -5.610
  399    HE2  PHE  51           HE1      PHE  51   2.091  -2.395  -5.030
  400    HZ   PHE  51           HZ       PHE  51   0.101  -1.861  -6.419
  401    HA   PRO  52           HA       PRO  52   1.362   4.332   1.814
  402    HB2  PRO  52           HB2      PRO  52  -0.807   5.860   2.246
  403    HB3  PRO  52           HB3      PRO  52   0.271   6.155   0.845
  404    HG2  PRO  52           HG2      PRO  52  -2.362   4.641   0.877
  405    HG3  PRO  52           HG3      PRO  52  -1.833   5.918  -0.255
  406    HD2  PRO  52           HD2      PRO  52  -1.588   3.203  -0.771
  407    HD3  PRO  52           HD3      PRO  52  -0.498   4.452  -1.441
  408    H    VAL  53           H        VAL  53  -1.157   1.992   1.496
  409    HA   VAL  53           HA       VAL  53  -1.231   1.263   4.262
  410    HB   VAL  53           HB       VAL  53  -3.888   1.218   4.133
  411   HG11  VAL  53          HG11      VAL  53  -2.360   3.671   5.066
  412   HG12  VAL  53          HG12      VAL  53  -3.971   3.148   5.600
  413   HG13  VAL  53          HG13      VAL  53  -2.560   2.152   5.971
  414   HG21  VAL  53          HG21      VAL  53  -4.023   2.485   1.956
  415   HG22  VAL  53          HG22      VAL  53  -4.905   3.223   3.309
  416   HG23  VAL  53          HG23      VAL  53  -3.350   3.902   2.816
  417    H    ASP  54           H        ASP  54  -2.671  -0.820   4.441
  418    HA   ASP  54           HA       ASP  54  -2.192  -2.349   1.935
  419    HB2  ASP  54           HB2      ASP  54  -1.872  -4.255   3.116
  420    HB3  ASP  54           HB3      ASP  54  -1.086  -3.041   4.109
  421    H    GLY  55           H        GLY  55  -3.697  -3.696   0.938
  422    HA2  GLY  55           HA2      GLY  55  -6.424  -3.997   1.643
  423    HA3  GLY  55           HA3      GLY  55  -6.275  -2.481   0.756
  424    H    ARG  56           H        ARG  56  -7.678  -3.465  -0.798
  425    HA   ARG  56           HA       ARG  56  -6.452  -5.599  -2.515
  426    HB2  ARG  56           HB2      ARG  56  -8.521  -6.088  -1.086
  427    HB3  ARG  56           HB3      ARG  56  -9.416  -5.096  -2.240
  428    HG2  ARG  56           HG2      ARG  56  -8.773  -6.648  -4.069
  429    HG3  ARG  56           HG3      ARG  56  -7.782  -7.565  -2.925
  430    HD2  ARG  56           HD2      ARG  56  -9.751  -8.812  -3.138
  431    HD3  ARG  56           HD3      ARG  56  -9.879  -8.029  -1.571
  432    HE   ARG  56           HE       ARG  56 -11.542  -7.610  -3.977
  433   HH11  ARG  56          HH11      ARG  56 -11.040  -6.449  -0.655
  434   HH12  ARG  56          HH12      ARG  56 -12.498  -5.493  -0.764
  435   HH21  ARG  56          HH21      ARG  56 -13.297  -6.556  -3.934
  436   HH22  ARG  56          HH22      ARG  56 -13.765  -5.516  -2.611
  437    H    VAL  57           H        VAL  57  -6.400  -5.477  -4.666
  438    HA   VAL  57           HA       VAL  57  -6.846  -2.893  -6.050
  439    HB   VAL  57           HB       VAL  57  -5.500  -5.517  -6.832
  440   HG11  VAL  57          HG11      VAL  57  -5.867  -3.009  -8.525
  441   HG12  VAL  57          HG12      VAL  57  -4.819  -4.396  -8.924
  442   HG13  VAL  57          HG13      VAL  57  -6.552  -4.618  -8.852
  443   HG21  VAL  57          HG21      VAL  57  -4.191  -4.041  -5.310
  444   HG22  VAL  57          HG22      VAL  57  -3.450  -4.196  -6.905
  445   HG23  VAL  57          HG23      VAL  57  -4.345  -2.717  -6.484
  446    H    ILE  58           H        ILE  58  -8.638  -2.626  -7.274
  447    HA   ILE  58           HA       ILE  58 -10.099  -5.014  -8.308
  448    HB   ILE  58           HB       ILE  58 -12.280  -3.880  -7.602
  449   HG12  ILE  58          HG12      ILE  58 -10.496  -2.548  -5.522
  450   HG13  ILE  58          HG13      ILE  58 -11.090  -1.693  -6.958
  451   HG21  ILE  58          HG21      ILE  58 -12.334  -4.999  -5.490
  452   HG22  ILE  58          HG22      ILE  58 -11.366  -5.965  -6.598
  453   HG23  ILE  58          HG23      ILE  58 -10.567  -4.980  -5.346
  454   HD11  ILE  58          HD11      ILE  58 -12.530  -1.156  -5.103
  455   HD12  ILE  58          HD12      ILE  58 -13.439  -2.157  -6.249
  456   HD13  ILE  58          HD13      ILE  58 -12.812  -2.867  -4.737
  457    H    GLU  59           H        GLU  59  -8.367  -3.053  -9.619
  458    HA   GLU  59           HA       GLU  59  -9.983  -2.938 -11.988
  459    HB2  GLU  59           HB2      GLU  59 -10.589  -0.744 -10.720
  460    HB3  GLU  59           HB3      GLU  59  -8.908  -0.293 -10.913
  461    HG2  GLU  59           HG2      GLU  59 -10.295   0.785 -12.577
  462    HG3  GLU  59           HG3      GLU  59  -9.147  -0.300 -13.358
  463    H    GLY  60           H        GLY  60  -8.570  -3.365 -13.681
  464    HA2  GLY  60           HA2      GLY  60  -6.737  -2.983 -15.052
  465    HA3  GLY  60           HA3      GLY  60  -5.994  -2.001 -13.804
  466    H    HIS  61           H        HIS  61  -4.124  -3.064 -14.678
  467    HA   HIS  61           HA       HIS  61  -3.399  -5.586 -13.339
  468    HB2  HIS  61           HB2      HIS  61  -2.618  -6.686 -15.333
  469    HB3  HIS  61           HB3      HIS  61  -4.341  -6.375 -15.420
  470    HD1  HIS  61           HD1      HIS  61  -3.472  -3.163 -16.578
  471    HD2  HIS  61           HD2      HIS  61  -2.778  -7.057 -18.033
  472    HE1  HIS  61           HE1      HIS  61  -3.137  -2.947 -19.095
  473    H    SER  62           H        SER  62  -1.464  -5.480 -12.514
  474    HA   SER  62           HA       SER  62   0.741  -4.028 -13.812
  475    HB2  SER  62           HB2      SER  62  -0.658  -2.487 -12.101
  476    HB3  SER  62           HB3      SER  62   0.487  -3.202 -10.952
  477    HG   SER  62           HG       SER  62   0.855  -1.210 -12.438
  478    H    MET  63           H        MET  63   2.775  -4.125 -12.309
  479    HA   MET  63           HA       MET  63   2.945  -6.815 -11.041
  480    HB2  MET  63           HB2      MET  63   3.925  -6.669 -13.322
  481    HB3  MET  63           HB3      MET  63   5.065  -5.452 -12.738
  482    HG2  MET  63           HG2      MET  63   6.120  -6.997 -11.281
  483    HG3  MET  63           HG3      MET  63   4.807  -8.168 -11.406
  484    HE1  MET  63           HE1      MET  63   5.243  -9.985 -14.700
  485    HE2  MET  63           HE2      MET  63   4.692 -10.104 -13.014
  486    HE3  MET  63           HE3      MET  63   4.021  -8.849 -14.076
  487    H    VAL  64           H        VAL  64   3.797  -6.857  -9.072
  488    HA   VAL  64           HA       VAL  64   4.657  -4.281  -7.843
  489    HB   VAL  64           HB       VAL  64   3.062  -6.563  -6.637
  490   HG11  VAL  64          HG11      VAL  64   3.848  -3.887  -5.401
  491   HG12  VAL  64          HG12      VAL  64   2.729  -5.073  -4.694
  492   HG13  VAL  64          HG13      VAL  64   4.433  -5.477  -4.887
  493   HG21  VAL  64          HG21      VAL  64   1.727  -5.189  -8.194
  494   HG22  VAL  64          HG22      VAL  64   1.247  -4.847  -6.529
  495   HG23  VAL  64          HG23      VAL  64   2.291  -3.707  -7.404
  496    H    ASP  65           H        ASP  65   6.286  -4.152  -6.446
  497    HA   ASP  65           HA       ASP  65   8.100  -6.515  -6.156
  498    HB2  ASP  65           HB2      ASP  65   8.956  -4.552  -7.402
  499    HB3  ASP  65           HB3      ASP  65   8.730  -3.547  -5.970
  500    H    GLU  66           H        GLU  66   7.041  -7.459  -4.383
  501    HA   GLU  66           HA       GLU  66   6.618  -5.945  -1.890
  502    HB2  GLU  66           HB2      GLU  66   6.034  -8.873  -2.410
  503    HB3  GLU  66           HB3      GLU  66   5.465  -7.830  -1.096
  504    HG2  GLU  66           HG2      GLU  66   4.109  -6.534  -2.712
  505    HG3  GLU  66           HG3      GLU  66   4.629  -7.637  -3.999
  506    H    SER  67           H        SER  67   9.403  -6.262  -2.634
  507    HA   SER  67           HA       SER  67  10.661  -8.531  -1.727
  508    HB2  SER  67           HB2      SER  67  12.718  -7.078  -1.749
  509    HB3  SER  67           HB3      SER  67  11.737  -7.058  -3.218
  510    HG   SER  67           HG       SER  67  12.470  -5.011  -2.513
  511    H    LEU  68           H        LEU  68   9.889  -5.733   0.362
  512    HA   LEU  68           HA       LEU  68  11.587  -6.875   2.514
  513    HB2  LEU  68           HB2      LEU  68  11.756  -4.507   1.695
  514    HB3  LEU  68           HB3      LEU  68  10.138  -4.203   2.282
  515    HG   LEU  68           HG       LEU  68  11.887  -3.274   3.693
  516   HD11  LEU  68          HD11      LEU  68  10.558  -5.467   5.306
  517   HD12  LEU  68          HD12      LEU  68  11.098  -3.872   5.838
  518   HD13  LEU  68          HD13      LEU  68   9.717  -4.005   4.734
  519   HD21  LEU  68          HD21      LEU  68  12.754  -6.102   4.370
  520   HD22  LEU  68          HD22      LEU  68  13.649  -4.957   3.339
  521   HD23  LEU  68          HD23      LEU  68  13.384  -4.587   5.051
  522    H    ILE  69           H        ILE  69   8.274  -5.762   2.024
  523    HA   ILE  69           HA       ILE  69   7.303  -6.427   4.648
  524    HB   ILE  69           HB       ILE  69   5.559  -6.437   2.152
  525   HG12  ILE  69          HG12      ILE  69   6.994  -4.340   2.169
  526   HG13  ILE  69          HG13      ILE  69   5.289  -4.079   2.218
  527   HG21  ILE  69          HG21      ILE  69   5.073  -6.027   5.128
  528   HG22  ILE  69          HG22      ILE  69   3.915  -5.446   3.931
  529   HG23  ILE  69          HG23      ILE  69   4.306  -7.169   4.001
  530   HD11  ILE  69          HD11      ILE  69   7.154  -3.838   4.575
  531   HD12  ILE  69          HD12      ILE  69   6.380  -2.524   3.637
  532   HD13  ILE  69          HD13      ILE  69   5.383  -3.618   4.611
  533    H    THR  70           H        THR  70   6.817  -8.108   1.584
  534    HA   THR  70           HA       THR  70   5.635 -10.449   2.854
  535    HB   THR  70           HB       THR  70   6.059  -9.634  -0.039
  536    HG1  THR  70           HG1      THR  70   3.910  -8.920   0.116
  537   HG21  THR  70          HG21      THR  70   4.268 -11.056  -0.615
  538   HG22  THR  70          HG22      THR  70   5.417 -12.043   0.310
  539   HG23  THR  70          HG23      THR  70   3.940 -11.420   1.088
  540    H    GLY  71           H        GLY  71   8.606  -9.622   1.097
  541    HA2  GLY  71           HA2      GLY  71  10.668 -10.647   1.494
  542    HA3  GLY  71           HA3      GLY  71   9.864 -12.076   2.134
  543    H    GLU  72           H        GLU  72   8.448 -11.356  -0.754
  544    HA   GLU  72           HA       GLU  72   9.364 -13.607  -2.215
  545    HB2  GLU  72           HB2      GLU  72   8.137 -11.020  -3.254
  546    HB3  GLU  72           HB3      GLU  72   8.337 -12.473  -4.231
  547    HG2  GLU  72           HG2      GLU  72   6.700 -12.419  -1.664
  548    HG3  GLU  72           HG3      GLU  72   6.033 -12.062  -3.249
  549    H    ALA  73           H        ALA  73  10.269 -10.201  -2.970
  550    HA   ALA  73           HA       ALA  73  12.168  -9.228  -3.603
  551    HB1  ALA  73           HB1      ALA  73  13.642 -11.728  -2.745
  552    HB2  ALA  73           HB2      ALA  73  14.341 -10.123  -3.050
  553    HB3  ALA  73           HB3      ALA  73  13.213 -10.358  -1.702
  554    H    MET  74           H        MET  74  10.499 -10.340  -5.294
  555    HA   MET  74           HA       MET  74  11.914 -10.446  -7.816
  556    HB2  MET  74           HB2      MET  74  10.753 -12.462  -8.573
  557    HB3  MET  74           HB3      MET  74  11.935 -12.816  -7.319
  558    HG2  MET  74           HG2      MET  74  10.115 -13.026  -5.674
  559    HG3  MET  74           HG3      MET  74   8.921 -12.600  -6.906
  560    HE1  MET  74           HE1      MET  74   7.581 -14.740  -6.086
  561    HE2  MET  74           HE2      MET  74   8.246 -16.390  -6.085
  562    HE3  MET  74           HE3      MET  74   8.876 -15.177  -4.950
  563    HA   PRO  75           HA       PRO  75   8.106  -8.266  -8.849
  564    HB2  PRO  75           HB2      PRO  75   8.362  -9.515 -11.576
  565    HB3  PRO  75           HB3      PRO  75   8.179  -7.788 -11.130
  566    HG2  PRO  75           HG2      PRO  75  10.578  -8.788 -11.917
  567    HG3  PRO  75           HG3      PRO  75  10.459  -7.582 -10.595
  568    HD2  PRO  75           HD2      PRO  75  10.849 -10.575 -10.373
  569    HD3  PRO  75           HD3      PRO  75  11.584  -9.234  -9.457
  570    H    VAL  76           H        VAL  76   5.966  -8.744  -8.528
  571    HA   VAL  76           HA       VAL  76   4.840 -11.394  -9.397
  572    HB   VAL  76           HB       VAL  76   4.227  -9.897  -6.827
  573   HG11  VAL  76          HG11      VAL  76   3.224 -12.588  -7.869
  574   HG12  VAL  76          HG12      VAL  76   2.943 -11.948  -6.239
  575   HG13  VAL  76          HG13      VAL  76   2.243 -11.125  -7.627
  576   HG21  VAL  76          HG21      VAL  76   6.419 -10.986  -6.663
  577   HG22  VAL  76          HG22      VAL  76   5.240 -11.893  -5.719
  578   HG23  VAL  76          HG23      VAL  76   5.749 -12.500  -7.309
  579    H    ALA  77           H        ALA  77   3.009 -11.372 -10.555
  580    HA   ALA  77           HA       ALA  77   1.917  -8.785 -11.388
  581    HB1  ALA  77           HB1      ALA  77   1.059 -11.567 -12.226
  582    HB2  ALA  77           HB2      ALA  77   0.655 -10.038 -13.026
  583    HB3  ALA  77           HB3      ALA  77   2.335 -10.604 -13.007
  584    H    LYS  78           H        LYS  78  -0.019  -7.938 -11.121
  585    HA   LYS  78           HA       LYS  78  -2.093  -9.247  -9.377
  586    HB2  LYS  78           HB2      LYS  78  -1.519  -6.265  -9.634
  587    HB3  LYS  78           HB3      LYS  78  -2.670  -7.020  -8.534
  588    HG2  LYS  78           HG2      LYS  78   0.361  -7.317  -8.401
  589    HG3  LYS  78           HG3      LYS  78  -0.603  -6.211  -7.437
  590    HD2  LYS  78           HD2      LYS  78  -1.720  -8.004  -6.281
  591    HD3  LYS  78           HD3      LYS  78  -0.957  -9.233  -7.310
  592    HE2  LYS  78           HE2      LYS  78   1.253  -8.653  -6.459
  593    HE3  LYS  78           HE3      LYS  78   0.587  -7.301  -5.528
  594    HZ1  LYS  78           HZ1      LYS  78  -0.087 -10.155  -5.064
  595    HZ2  LYS  78           HZ2      LYS  78   0.978  -9.262  -4.167
  596    HZ3  LYS  78           HZ3      LYS  78  -0.626  -8.885  -4.165
  597    H    LYS  79           H        LYS  79  -4.296  -8.787  -9.809
  598    HA   LYS  79           HA       LYS  79  -5.164  -7.295 -12.152
  599    HB2  LYS  79           HB2      LYS  79  -4.985 -10.213 -12.161
  600    HB3  LYS  79           HB3      LYS  79  -6.680  -9.767 -12.051
  601    HG2  LYS  79           HG2      LYS  79  -6.217  -8.154 -14.042
  602    HG3  LYS  79           HG3      LYS  79  -4.689  -9.004 -14.219
  603    HD2  LYS  79           HD2      LYS  79  -7.466 -10.256 -14.327
  604    HD3  LYS  79           HD3      LYS  79  -6.459  -9.871 -15.723
  605    HE2  LYS  79           HE2      LYS  79  -4.731 -11.484 -14.933
  606    HE3  LYS  79           HE3      LYS  79  -5.733 -11.851 -13.518
  607    HZ1  LYS  79           HZ1      LYS  79  -6.202 -13.516 -15.081
  608    HZ2  LYS  79           HZ2      LYS  79  -7.501 -12.527 -15.165
  609    HZ3  LYS  79           HZ3      LYS  79  -6.347 -12.487 -16.345
  610    HA   PRO  80           HA       PRO  80  -8.480  -6.389  -9.329
  611    HB2  PRO  80           HB2      PRO  80 -10.591  -7.851 -10.891
  612    HB3  PRO  80           HB3      PRO  80 -10.630  -6.194 -10.199
  613    HG2  PRO  80           HG2      PRO  80 -10.171  -6.540 -12.785
  614    HG3  PRO  80           HG3      PRO  80  -9.142  -5.378 -11.892
  615    HD2  PRO  80           HD2      PRO  80  -8.505  -8.255 -12.655
  616    HD3  PRO  80           HD3      PRO  80  -7.491  -6.792 -12.840
  617    H    GLY  81           H        GLY  81  -9.465  -7.080  -7.546
  618    HA2  GLY  81           HA2      GLY  81 -10.168  -8.468  -5.804
  619    HA3  GLY  81           HA3      GLY  81 -10.176  -9.855  -6.892
  620    H    SER  82           H        SER  82  -7.287  -7.768  -6.433
  621    HA   SER  82           HA       SER  82  -5.859 -10.151  -5.278
  622    HB2  SER  82           HB2      SER  82  -5.312  -9.594  -7.692
  623    HB3  SER  82           HB3      SER  82  -4.663  -8.046  -7.101
  624    HG   SER  82           HG       SER  82  -3.793 -10.689  -6.699
  625    H    THR  83           H        THR  83  -4.166  -9.655  -3.626
  626    HA   THR  83           HA       THR  83  -4.807  -7.106  -2.262
  627    HB   THR  83           HB       THR  83  -3.729  -8.270  -0.290
  628    HG1  THR  83           HG1      THR  83  -3.914 -10.611  -0.547
  629   HG21  THR  83          HG21      THR  83  -6.215  -9.569  -1.494
  630   HG22  THR  83          HG22      THR  83  -5.743  -9.541   0.220
  631   HG23  THR  83          HG23      THR  83  -6.189  -8.034  -0.591
  632    H    VAL  84           H        VAL  84  -3.364  -5.735  -1.457
  633    HA   VAL  84           HA       VAL  84  -0.468  -6.023  -2.088
  634    HB   VAL  84           HB       VAL  84  -0.404  -3.649  -2.800
  635   HG11  VAL  84          HG11      VAL  84  -2.203  -5.356  -4.555
  636   HG12  VAL  84          HG12      VAL  84  -1.202  -3.982  -5.064
  637   HG13  VAL  84          HG13      VAL  84  -0.433  -5.463  -4.464
  638   HG21  VAL  84          HG21      VAL  84  -2.515  -2.833  -1.785
  639   HG22  VAL  84          HG22      VAL  84  -2.421  -2.478  -3.515
  640   HG23  VAL  84          HG23      VAL  84  -3.445  -3.809  -2.940
  641    H    ILE  85           H        ILE  85   0.798  -4.209  -1.006
  642    HA   ILE  85           HA       ILE  85  -0.259  -3.460   1.644
  643    HB   ILE  85           HB       ILE  85   1.607  -4.310   2.825
  644   HG12  ILE  85          HG12      ILE  85   3.414  -4.105   1.355
  645   HG13  ILE  85          HG13      ILE  85   3.304  -5.790   1.868
  646   HG21  ILE  85          HG21      ILE  85   0.532  -6.607   1.162
  647   HG22  ILE  85          HG22      ILE  85   1.295  -6.692   2.758
  648   HG23  ILE  85          HG23      ILE  85  -0.251  -5.859   2.578
  649   HD11  ILE  85          HD11      ILE  85   2.744  -4.666  -0.861
  650   HD12  ILE  85          HD12      ILE  85   4.019  -5.776  -0.332
  651   HD13  ILE  85          HD13      ILE  85   2.334  -6.341  -0.374
  652    H    ALA  86           H        ALA  86   0.993  -1.834   2.748
  653    HA   ALA  86           HA       ALA  86   1.784   0.207   0.962
  654    HB1  ALA  86           HB1      ALA  86   2.188   0.112   3.959
  655    HB2  ALA  86           HB2      ALA  86   2.129   1.556   2.943
  656    HB3  ALA  86           HB3      ALA  86   0.686   0.543   3.159
  657    H    GLY  87           H        GLY  87   3.723   1.366   0.762
  658    HA2  GLY  87           HA2      GLY  87   6.039   1.803   0.850
  659    HA3  GLY  87           HA3      GLY  87   6.234   0.428   1.950
  660    H    SER  88           H        SER  88   4.594  -0.904  -0.524
  661    HA   SER  88           HA       SER  88   7.031  -1.838  -1.960
  662    HB2  SER  88           HB2      SER  88   4.217  -2.977  -1.936
  663    HB3  SER  88           HB3      SER  88   5.626  -3.657  -2.778
  664    HG   SER  88           HG       SER  88   5.275  -3.262   0.015
  665    H    ILE  89           H        ILE  89   6.908  -1.979  -4.314
  666    HA   ILE  89           HA       ILE  89   5.776   0.569  -5.322
  667    HB   ILE  89           HB       ILE  89   7.836  -0.960  -6.860
  668   HG12  ILE  89          HG12      ILE  89   8.853  -1.118  -4.654
  669   HG13  ILE  89          HG13      ILE  89   9.726  -0.038  -5.714
  670   HG21  ILE  89          HG21      ILE  89   7.285   1.997  -6.334
  671   HG22  ILE  89          HG22      ILE  89   8.605   1.377  -7.344
  672   HG23  ILE  89          HG23      ILE  89   6.931   1.083  -7.813
  673   HD11  ILE  89          HD11      ILE  89   8.820   1.923  -4.564
  674   HD12  ILE  89          HD12      ILE  89   7.850   0.889  -3.490
  675   HD13  ILE  89          HD13      ILE  89   9.621   0.839  -3.424
  676    H    ASN  90           H        ASN  90   4.587   0.745  -7.156
  677    HA   ASN  90           HA       ASN  90   3.516  -1.713  -8.478
  678    HB2  ASN  90           HB2      ASN  90   1.893  -0.125  -7.404
  679    HB3  ASN  90           HB3      ASN  90   2.527   1.184  -8.396
  680   HD21  ASN  90          HD22      ASN  90   1.612   1.427 -10.429
  681   HD22  ASN  90          HD21      ASN  90   0.405   0.291 -11.025
  682    H    GLN  91           H        GLN  91   3.909  -2.059 -10.705
  683    HA   GLN  91           HA       GLN  91   5.114   0.037 -12.364
  684    HB2  GLN  91           HB2      GLN  91   6.899  -1.184 -10.898
  685    HB3  GLN  91           HB3      GLN  91   6.545  -2.609 -11.863
  686    HG2  GLN  91           HG2      GLN  91   8.524  -1.520 -12.726
  687    HG3  GLN  91           HG3      GLN  91   7.240  -1.321 -13.917
  688   HE21  GLN  91          HE22      GLN  91   6.696   0.822 -14.525
  689   HE22  GLN  91          HE21      GLN  91   7.274   2.224 -13.659
  690    H    ASN  92           H        ASN  92   4.588  -0.286 -14.524
  691    HA   ASN  92           HA       ASN  92   4.373  -1.326 -16.480
  692    HB2  ASN  92           HB2      ASN  92   5.179  -3.501 -15.568
  693    HB3  ASN  92           HB3      ASN  92   3.492  -3.932 -15.264
  694   HD21  ASN  92          HD22      ASN  92   2.169  -4.555 -17.040
  695   HD22  ASN  92          HD21      ASN  92   2.797  -4.595 -18.669
  696    H    GLY  93           H        GLY  93   1.790  -0.999 -14.152
  697    HA2  GLY  93           HA2      GLY  93   0.270   0.253 -16.269
  698    HA3  GLY  93           HA3      GLY  93  -0.439  -1.284 -15.794
  699    H    SER  94           H        SER  94  -1.769   1.199 -15.572
  700    HA   SER  94           HA       SER  94  -1.635   2.131 -12.795
  701    HB2  SER  94           HB2      SER  94  -3.478   2.932 -15.070
  702    HB3  SER  94           HB3      SER  94  -3.443   3.675 -13.460
  703    HG   SER  94           HG       SER  94  -2.188   4.906 -14.707
  704    H    LEU  95           H        LEU  95  -2.927   1.629 -11.147
  705    HA   LEU  95           HA       LEU  95  -5.344  -0.109 -11.544
  706    HB2  LEU  95           HB2      LEU  95  -3.340  -0.077  -9.273
  707    HB3  LEU  95           HB3      LEU  95  -4.680  -1.185  -9.436
  708    HG   LEU  95           HG       LEU  95  -2.173  -1.104 -11.164
  709   HD11  LEU  95          HD11      LEU  95  -1.617  -3.180  -9.906
  710   HD12  LEU  95          HD12      LEU  95  -1.740  -1.779  -8.834
  711   HD13  LEU  95          HD13      LEU  95  -3.062  -2.954  -8.908
  712   HD21  LEU  95          HD21      LEU  95  -4.057  -2.011 -12.391
  713   HD22  LEU  95          HD22      LEU  95  -3.015  -3.354 -11.863
  714   HD23  LEU  95          HD23      LEU  95  -4.532  -3.034 -11.018
  715    H    LEU  96           H        LEU  96  -6.883  -0.094  -9.791
  716    HA   LEU  96           HA       LEU  96  -6.783   2.280  -7.989
  717    HB2  LEU  96           HB2      LEU  96  -9.285   1.071  -9.213
  718    HB3  LEU  96           HB3      LEU  96  -9.263   2.132  -7.828
  719    HG   LEU  96           HG       LEU  96  -8.271   3.962  -9.189
  720   HD11  LEU  96          HD11      LEU  96  -8.652   3.723 -11.738
  721   HD12  LEU  96          HD12      LEU  96  -7.210   2.964 -11.074
  722   HD13  LEU  96          HD13      LEU  96  -8.635   1.982 -11.462
  723   HD21  LEU  96          HD21      LEU  96 -10.701   3.754  -8.773
  724   HD22  LEU  96          HD22      LEU  96 -10.377   4.485 -10.348
  725   HD23  LEU  96          HD23      LEU  96 -10.874   2.782 -10.249
  726    H    ILE  97           H        ILE  97  -6.814   1.872  -5.895
  727    HA   ILE  97           HA       ILE  97  -7.268  -0.941  -4.970
  728    HB   ILE  97           HB       ILE  97  -5.581   1.048  -3.447
  729   HG12  ILE  97          HG12      ILE  97  -3.604  -0.322  -4.590
  730   HG13  ILE  97          HG13      ILE  97  -4.719  -0.403  -5.949
  731   HG21  ILE  97          HG21      ILE  97  -5.405  -1.974  -3.682
  732   HG22  ILE  97          HG22      ILE  97  -4.522  -0.931  -2.554
  733   HG23  ILE  97          HG23      ILE  97  -6.269  -1.109  -2.389
  734   HD11  ILE  97          HD11      ILE  97  -3.181   1.513  -6.096
  735   HD12  ILE  97          HD12      ILE  97  -4.829   2.124  -5.934
  736   HD13  ILE  97          HD13      ILE  97  -3.728   2.127  -4.536
  737    H    CYS  98           H        CYS  98  -8.751  -1.337  -3.361
  738    HA   CYS  98           HA       CYS  98 -10.046   0.985  -2.034
  739    HB2  CYS  98           HB2      CYS  98 -11.659  -0.606  -1.162
  740    HB3  CYS  98           HB3      CYS  98 -11.562  -0.708  -2.920
  741    HG   CYS  98           HG       CYS  98  -9.896  -2.595  -0.809
  742    H    ALA  99           H        ALA  99  -9.108   1.793  -0.295
  743    HA   ALA  99           HA       ALA  99  -7.238   0.240   1.351
  744    HB1  ALA  99           HB1      ALA  99  -7.056   2.381   2.590
  745    HB2  ALA  99           HB2      ALA  99  -6.784   2.603   0.847
  746    HB3  ALA  99           HB3      ALA  99  -8.334   3.079   1.579
  747    H    THR 100           H        THR 100  -8.023  -1.159   2.811
  748    HA   THR 100           HA       THR 100 -10.612  -0.608   4.207
  749    HB   THR 100           HB       THR 100 -10.684  -3.137   4.410
  750    HG1  THR 100           HG1      THR 100  -9.309  -4.314   3.216
  751   HG21  THR 100          HG21      THR 100 -11.390  -3.536   2.106
  752   HG22  THR 100          HG22      THR 100 -11.962  -1.947   2.644
  753   HG23  THR 100          HG23      THR 100 -10.562  -2.067   1.556
  754    H    HIS 101           H        HIS 101  -7.568  -0.087   5.002
  755    HA   HIS 101           HA       HIS 101  -7.936  -0.830   7.841
  756    HB2  HIS 101           HB2      HIS 101  -5.432  -1.299   6.172
  757    HB3  HIS 101           HB3      HIS 101  -5.637  -1.691   7.871
  758    HD1  HIS 101           HD1      HIS 101  -5.982  -3.213   4.514
  759    HD2  HIS 101           HD2      HIS 101  -7.820  -3.618   8.269
  760    HE1  HIS 101           HE1      HIS 101  -7.189  -5.467   4.490
  761    H    VAL 102           H        VAL 102  -7.022   0.632   9.279
  762    HA   VAL 102           HA       VAL 102  -5.682   3.062   8.167
  763    HB   VAL 102           HB       VAL 102  -8.004   3.105   9.327
  764   HG11  VAL 102          HG11      VAL 102  -7.260   1.865  11.407
  765   HG12  VAL 102          HG12      VAL 102  -6.343   3.313  11.869
  766   HG13  VAL 102          HG13      VAL 102  -8.098   3.398  11.683
  767   HG21  VAL 102          HG21      VAL 102  -7.699   5.341  10.082
  768   HG22  VAL 102          HG22      VAL 102  -5.953   5.143  10.235
  769   HG23  VAL 102          HG23      VAL 102  -6.709   5.095   8.632
  770    H    GLY 103           H        GLY 103  -4.467   4.177  10.527
  771    HA2  GLY 103           HA2      GLY 103  -1.964   2.896  10.279
  772    HA3  GLY 103           HA3      GLY 103  -2.418   4.176  11.399
  773    H    ALA 104           H        ALA 104  -4.533   2.298  12.609
  774    HA   ALA 104           HA       ALA 104  -2.928   0.916  14.565
  775    HB1  ALA 104           HB1      ALA 104  -5.118   1.864  15.082
  776    HB2  ALA 104           HB2      ALA 104  -5.903   0.762  13.926
  777    HB3  ALA 104           HB3      ALA 104  -5.103   0.117  15.375
  778    H    ASP 105           H        ASP 105  -5.101  -0.327  11.983
  779    HA   ASP 105           HA       ASP 105  -4.306  -3.069  12.351
  780    HB2  ASP 105           HB2      ASP 105  -6.545  -2.380  11.635
  781    HB3  ASP 105           HB3      ASP 105  -5.888  -1.767  10.119
  782    H    THR 106           H        THR 106  -2.962  -0.546  10.311
  783    HA   THR 106           HA       THR 106  -2.434  -1.988   7.943
  784    HB   THR 106           HB       THR 106  -2.366   0.427   8.006
  785    HG1  THR 106           HG1      THR 106  -0.378   0.627   6.796
  786   HG21  THR 106          HG21      THR 106  -1.035   0.658  10.178
  787   HG22  THR 106          HG22      THR 106   0.412   0.278   9.223
  788   HG23  THR 106          HG23      THR 106  -0.549   1.713   8.841
  789    H    THR 107           H        THR 107  -1.080  -3.493   7.362
  790    HA   THR 107           HA       THR 107   0.225  -5.016   9.227
  791    HB   THR 107           HB       THR 107  -0.438  -5.856   7.070
  792    HG1  THR 107           HG1      THR 107   1.457  -7.145   6.721
  793   HG21  THR 107          HG21      THR 107   0.774  -5.631   5.067
  794   HG22  THR 107          HG22      THR 107   0.581  -3.969   5.649
  795   HG23  THR 107          HG23      THR 107   2.134  -4.824   5.861
  796    H    LEU 108           H        LEU 108   1.847  -2.379   7.465
  797    HA   LEU 108           HA       LEU 108   4.534  -2.975   8.230
  798    HB2  LEU 108           HB2      LEU 108   3.082  -0.348   7.655
  799    HB3  LEU 108           HB3      LEU 108   4.791  -0.410   8.050
  800    HG   LEU 108           HG       LEU 108   5.279  -1.742   6.055
  801   HD11  LEU 108          HD11      LEU 108   2.295  -1.508   5.517
  802   HD12  LEU 108          HD12      LEU 108   3.516  -1.919   4.279
  803   HD13  LEU 108          HD13      LEU 108   3.291  -2.984   5.647
  804   HD21  LEU 108          HD21      LEU 108   5.388   0.680   5.994
  805   HD22  LEU 108          HD22      LEU 108   4.825   0.061   4.432
  806   HD23  LEU 108          HD23      LEU 108   3.661   0.775   5.583
  807    H    SER 109           H        SER 109   2.098  -0.929   9.836
  808    HA   SER 109           HA       SER 109   3.761  -0.267  12.125
  809    HB2  SER 109           HB2      SER 109   0.758  -0.020  11.726
  810    HB3  SER 109           HB3      SER 109   1.723   0.719  13.018
  811    HG   SER 109           HG       SER 109   1.525   2.256  11.544
  812    H    GLN 110           H        GLN 110   1.663  -2.901  11.262
  813    HA   GLN 110           HA       GLN 110   1.205  -3.889  13.963
  814    HB2  GLN 110           HB2      GLN 110  -0.144  -4.254  11.709
  815    HB3  GLN 110           HB3      GLN 110   0.966  -5.594  11.486
  816    HG2  GLN 110           HG2      GLN 110  -0.901  -6.509  12.562
  817    HG3  GLN 110           HG3      GLN 110   0.303  -6.366  13.850
  818   HE21  GLN 110          HE22      GLN 110  -2.307  -4.400  12.299
  819   HE22  GLN 110          HE21      GLN 110  -2.719  -3.572  13.770
  820    H    ILE 111           H        ILE 111   3.374  -4.832  11.290
  821    HA   ILE 111           HA       ILE 111   4.793  -6.939  12.486
  822    HB   ILE 111           HB       ILE 111   5.648  -4.818  10.482
  823   HG12  ILE 111          HG12      ILE 111   5.144  -7.789  10.026
  824   HG13  ILE 111          HG13      ILE 111   3.839  -6.620   9.983
  825   HG21  ILE 111          HG21      ILE 111   7.212  -7.309  11.308
  826   HG22  ILE 111          HG22      ILE 111   7.581  -6.299   9.900
  827   HG23  ILE 111          HG23      ILE 111   7.736  -5.621  11.511
  828   HD11  ILE 111          HD11      ILE 111   5.006  -5.366   8.165
  829   HD12  ILE 111          HD12      ILE 111   6.246  -6.645   8.122
  830   HD13  ILE 111          HD13      ILE 111   4.563  -7.026   7.727
  831    H    VAL 112           H        VAL 112   5.705  -3.419  12.635
  832    HA   VAL 112           HA       VAL 112   7.880  -3.921  14.378
  833    HB   VAL 112           HB       VAL 112   7.979  -1.557  14.834
  834   HG11  VAL 112          HG11      VAL 112   7.308  -2.078  11.916
  835   HG12  VAL 112          HG12      VAL 112   8.360  -0.802  12.567
  836   HG13  VAL 112          HG13      VAL 112   8.847  -2.501  12.696
  837   HG21  VAL 112          HG21      VAL 112   6.455   0.057  13.833
  838   HG22  VAL 112          HG22      VAL 112   5.400  -1.255  13.263
  839   HG23  VAL 112          HG23      VAL 112   5.592  -0.949  15.007
  840    H    LYS 113           H        LYS 113   4.578  -3.908  15.225
  841    HA   LYS 113           HA       LYS 113   5.063  -3.494  18.119
  842    HB2  LYS 113           HB2      LYS 113   2.635  -4.556  16.598
  843    HB3  LYS 113           HB3      LYS 113   2.738  -4.455  18.355
  844    HG2  LYS 113           HG2      LYS 113   3.082  -2.041  18.245
  845    HG3  LYS 113           HG3      LYS 113   3.070  -2.080  16.496
  846    HD2  LYS 113           HD2      LYS 113   0.950  -1.307  17.074
  847    HD3  LYS 113           HD3      LYS 113   0.681  -2.996  16.613
  848    HE2  LYS 113           HE2      LYS 113   0.548  -3.664  18.933
  849    HE3  LYS 113           HE3      LYS 113   1.213  -2.113  19.462
  850    HZ1  LYS 113           HZ1      LYS 113  -1.188  -2.164  19.793
  851    HZ2  LYS 113           HZ2      LYS 113  -0.822  -1.030  18.658
  852    HZ3  LYS 113           HZ3      LYS 113  -1.446  -2.448  18.189
  853    H    LEU 114           H        LEU 114   4.867  -6.210  15.835
  854    HA   LEU 114           HA       LEU 114   4.752  -8.252  17.891
  855    HB2  LEU 114           HB2      LEU 114   3.991  -8.117  15.261
  856    HB3  LEU 114           HB3      LEU 114   5.523  -8.954  15.080
  857    HG   LEU 114           HG       LEU 114   3.142  -9.828  16.756
  858   HD11  LEU 114          HD11      LEU 114   4.412 -10.996  14.243
  859   HD12  LEU 114          HD12      LEU 114   3.019 -11.665  15.122
  860   HD13  LEU 114          HD13      LEU 114   2.887 -10.102  14.307
  861   HD21  LEU 114          HD21      LEU 114   5.822 -11.169  16.267
  862   HD22  LEU 114          HD22      LEU 114   5.201 -10.608  17.839
  863   HD23  LEU 114          HD23      LEU 114   4.419 -11.965  17.017
  864    H    VAL 115           H        VAL 115   7.239  -7.257  15.491
  865    HA   VAL 115           HA       VAL 115   9.219  -9.144  16.315
  866    HB   VAL 115           HB       VAL 115   9.469  -6.528  14.777
  867   HG11  VAL 115          HG11      VAL 115  11.466  -8.822  14.998
  868   HG12  VAL 115          HG12      VAL 115  11.549  -7.512  13.801
  869   HG13  VAL 115          HG13      VAL 115  11.721  -7.137  15.512
  870   HG21  VAL 115          HG21      VAL 115   7.980  -8.201  13.697
  871   HG22  VAL 115          HG22      VAL 115   9.481  -8.009  12.790
  872   HG23  VAL 115          HG23      VAL 115   9.257  -9.425  13.837
  873    H    GLU 116           H        GLU 116   8.311  -6.191  17.806
  874    HA   GLU 116           HA       GLU 116  10.826  -5.554  19.170
  875    HB2  GLU 116           HB2      GLU 116   8.975  -3.951  18.518
  876    HB3  GLU 116           HB3      GLU 116   7.942  -4.734  19.703
  877    HG2  GLU 116           HG2      GLU 116   9.488  -4.023  21.511
  878    HG3  GLU 116           HG3      GLU 116  10.560  -3.291  20.298
  879    H    GLU 117           H        GLU 117   8.083  -7.758  19.745
  880    HA   GLU 117           HA       GLU 117   8.580  -7.825  22.645
  881    HB2  GLU 117           HB2      GLU 117   6.517  -9.318  21.004
  882    HB3  GLU 117           HB3      GLU 117   6.690  -9.326  22.775
  883    HG2  GLU 117           HG2      GLU 117   6.546  -6.711  22.568
  884    HG3  GLU 117           HG3      GLU 117   5.878  -7.028  20.976
  885    H    ALA 118           H        ALA 118  10.018  -9.291  19.944
  886    HA   ALA 118           HA       ALA 118  10.583 -11.855  21.266
  887    HB1  ALA 118           HB1      ALA 118  12.161 -12.110  19.325
  888    HB2  ALA 118           HB2      ALA 118  10.462 -11.893  18.886
  889    HB3  ALA 118           HB3      ALA 118  11.585 -10.536  18.721
  890    H    GLN 119           H        GLN 119  12.864  -9.356  20.145
  891    HA   GLN 119           HA       GLN 119  14.893  -9.761  21.793
  892    HB2  GLN 119           HB2      GLN 119  13.968  -7.100  20.658
  893    HB3  GLN 119           HB3      GLN 119  15.515  -7.316  21.447
  894    HG2  GLN 119           HG2      GLN 119  15.956  -7.511  19.140
  895    HG3  GLN 119           HG3      GLN 119  16.062  -9.167  19.799
  896   HE21  GLN 119          HE22      GLN 119  13.979  -6.837  18.129
  897   HE22  GLN 119          HE21      GLN 119  12.766  -8.042  17.740
  Start of MODEL   17
    1    H    SER   1           H        SER   1  18.350  -2.433  15.765
    2    HA   SER   1           HA       SER   1  15.509  -1.845  15.664
    3    HB2  SER   1           HB2      SER   1  17.857  -0.109  16.508
    4    HB3  SER   1           HB3      SER   1  16.141   0.214  16.809
    5    HG   SER   1           HG       SER   1  17.089  -0.714  18.622
    6    H    GLU   2           H        GLU   2  18.281  -1.136  13.590
    7    HA   GLU   2           HA       GLU   2  16.908   1.084  12.203
    8    HB2  GLU   2           HB2      GLU   2  19.476  -0.434  11.636
    9    HB3  GLU   2           HB3      GLU   2  18.887   0.901  10.650
   10    HG2  GLU   2           HG2      GLU   2  19.404   1.248  13.632
   11    HG3  GLU   2           HG3      GLU   2  20.682   1.378  12.434
   12    H    ALA   3           H        ALA   3  17.026  -2.407  11.898
   13    HA   ALA   3           HA       ALA   3  15.927  -2.404   9.145
   14    HB1  ALA   3           HB1      ALA   3  16.257  -4.633  11.200
   15    HB2  ALA   3           HB2      ALA   3  15.667  -4.824   9.534
   16    HB3  ALA   3           HB3      ALA   3  17.328  -4.283   9.819
   17    H    LEU   4           H        LEU   4  14.901  -2.566  12.535
   18    HA   LEU   4           HA       LEU   4  12.085  -2.953  12.124
   19    HB2  LEU   4           HB2      LEU   4  13.470  -3.228  14.271
   20    HB3  LEU   4           HB3      LEU   4  13.545  -1.479  14.348
   21    HG   LEU   4           HG       LEU   4  10.970  -1.484  14.407
   22   HD11  LEU   4          HD11      LEU   4  11.566  -4.396  15.069
   23   HD12  LEU   4          HD12      LEU   4  10.007  -3.586  15.306
   24   HD13  LEU   4          HD13      LEU   4  10.638  -3.819  13.663
   25   HD21  LEU   4          HD21      LEU   4  12.413  -1.020  16.367
   26   HD22  LEU   4          HD22      LEU   4  10.949  -1.900  16.807
   27   HD23  LEU   4          HD23      LEU   4  12.503  -2.761  16.708
   28    H    ALA   5           H        ALA   5  14.149  -0.060  11.660
   29    HA   ALA   5           HA       ALA   5  11.921   1.831  11.801
   30    HB1  ALA   5           HB1      ALA   5  14.861   2.106  11.023
   31    HB2  ALA   5           HB2      ALA   5  13.699   3.431  11.194
   32    HB3  ALA   5           HB3      ALA   5  14.157   2.478  12.612
   33    H    LYS   6           H        LYS   6  13.529  -0.278   9.459
   34    HA   LYS   6           HA       LYS   6  13.300   1.430   7.165
   35    HB2  LYS   6           HB2      LYS   6  14.949  -0.405   7.524
   36    HB3  LYS   6           HB3      LYS   6  13.656  -1.590   7.278
   37    HG2  LYS   6           HG2      LYS   6  13.307  -0.824   5.001
   38    HG3  LYS   6           HG3      LYS   6  14.406   0.553   5.236
   39    HD2  LYS   6           HD2      LYS   6  16.300  -0.983   5.552
   40    HD3  LYS   6           HD3      LYS   6  15.217  -2.385   5.380
   41    HE2  LYS   6           HE2      LYS   6  14.645  -1.646   3.082
   42    HE3  LYS   6           HE3      LYS   6  15.689  -0.232   3.277
   43    HZ1  LYS   6           HZ1      LYS   6  17.592  -1.718   3.504
   44    HZ2  LYS   6           HZ2      LYS   6  16.666  -3.052   3.366
   45    HZ3  LYS   6           HZ3      LYS   6  16.816  -2.015   2.095
   46    H    LEU   7           H        LEU   7  11.271  -1.225   8.358
   47    HA   LEU   7           HA       LEU   7   9.292  -1.389   6.364
   48    HB2  LEU   7           HB2      LEU   7   9.270  -1.637   9.384
   49    HB3  LEU   7           HB3      LEU   7   7.749  -1.712   8.522
   50    HG   LEU   7           HG       LEU   7   8.688  -3.916   9.116
   51   HD11  LEU   7          HD11      LEU   7   7.055  -3.722   7.333
   52   HD12  LEU   7          HD12      LEU   7   8.340  -3.443   6.133
   53   HD13  LEU   7          HD13      LEU   7   8.217  -5.003   6.971
   54   HD21  LEU   7          HD21      LEU   7  11.089  -3.477   8.732
   55   HD22  LEU   7          HD22      LEU   7  10.509  -4.908   7.867
   56   HD23  LEU   7          HD23      LEU   7  10.784  -3.404   6.977
   57    H    ILE   8           H        ILE   8   9.472   1.018   9.004
   58    HA   ILE   8           HA       ILE   8   7.089   2.455   8.161
   59    HB   ILE   8           HB       ILE   8   9.311   3.145  10.089
   60   HG12  ILE   8          HG12      ILE   8   8.041   1.191  10.791
   61   HG13  ILE   8          HG13      ILE   8   7.774   2.558  11.857
   62   HG21  ILE   8          HG21      ILE   8   6.696   4.603   9.571
   63   HG22  ILE   8          HG22      ILE   8   7.718   4.831  11.014
   64   HG23  ILE   8          HG23      ILE   8   8.350   5.236   9.412
   65   HD11  ILE   8          HD11      ILE   8   5.707   1.316  11.503
   66   HD12  ILE   8          HD12      ILE   8   5.547   2.934  10.808
   67   HD13  ILE   8          HD13      ILE   8   5.822   1.525   9.750
   68    H    SER   9           H        SER   9  10.558   2.738   7.428
   69    HA   SER   9           HA       SER   9  10.358   5.366   6.191
   70    HB2  SER   9           HB2      SER   9  12.512   3.226   6.053
   71    HB3  SER   9           HB3      SER   9  12.642   4.845   5.353
   72    HG   SER   9           HG       SER   9  13.538   4.553   7.524
   73    H    LEU  10           H        LEU  10   9.896   2.057   5.014
   74    HA   LEU  10           HA       LEU  10   9.809   2.673   2.223
   75    HB2  LEU  10           HB2      LEU  10   8.754   0.459   3.974
   76    HB3  LEU  10           HB3      LEU  10   8.017   0.663   2.402
   77    HG   LEU  10           HG       LEU  10  10.325   0.566   1.349
   78   HD11  LEU  10          HD11      LEU  10  11.045  -0.618   4.059
   79   HD12  LEU  10          HD12      LEU  10  12.067  -0.610   2.607
   80   HD13  LEU  10          HD13      LEU  10  11.681   0.915   3.411
   81   HD21  LEU  10          HD21      LEU  10   9.213  -1.827   2.863
   82   HD22  LEU  10          HD22      LEU  10   8.747  -1.292   1.241
   83   HD23  LEU  10          HD23      LEU  10  10.374  -1.914   1.506
   84    H    GLN  11           H        GLN  11   7.499   3.655   4.665
   85    HA   GLN  11           HA       GLN  11   5.145   3.569   3.008
   86    HB2  GLN  11           HB2      GLN  11   5.707   5.043   5.618
   87    HB3  GLN  11           HB3      GLN  11   4.144   4.909   4.849
   88    HG2  GLN  11           HG2      GLN  11   4.304   2.419   4.987
   89    HG3  GLN  11           HG3      GLN  11   5.793   2.589   5.928
   90   HE21  GLN  11          HE22      GLN  11   2.287   3.402   5.916
   91   HE22  GLN  11          HE21      GLN  11   2.206   3.608   7.653
   92    H    ALA  12           H        ALA  12   3.728   5.606   2.754
   93    HA   ALA  12           HA       ALA  12   5.355   7.617   1.233
   94    HB1  ALA  12           HB1      ALA  12   3.432   7.734  -0.281
   95    HB2  ALA  12           HB2      ALA  12   4.047   6.075  -0.154
   96    HB3  ALA  12           HB3      ALA  12   2.563   6.542   0.710
   97    H    THR  13           H        THR  13   2.754   7.344   3.623
   98    HA   THR  13           HA       THR  13   1.934   8.829   5.112
   99    HB   THR  13           HB       THR  13   3.812  11.009   4.232
  100    HG1  THR  13           HG1      THR  13   4.452   8.842   5.965
  101   HG21  THR  13          HG21      THR  13   2.783  10.091   6.957
  102   HG22  THR  13          HG22      THR  13   3.951  11.408   6.683
  103   HG23  THR  13          HG23      THR  13   2.297  11.556   6.085
  104    H    GLU  14           H        GLU  14   1.805   9.628   1.803
  105    HA   GLU  14           HA       GLU  14  -0.632  11.294   2.252
  106    HB2  GLU  14           HB2      GLU  14  -0.066  12.617   0.345
  107    HB3  GLU  14           HB3      GLU  14   1.305  12.643   1.471
  108    HG2  GLU  14           HG2      GLU  14   2.533  11.051   0.062
  109    HG3  GLU  14           HG3      GLU  14   1.123  10.833  -0.983
  110    H    ALA  15           H        ALA  15  -2.265  11.172   0.563
  111    HA   ALA  15           HA       ALA  15  -2.123   8.791  -1.215
  112    HB1  ALA  15           HB1      ALA  15  -3.139   8.068   0.924
  113    HB2  ALA  15           HB2      ALA  15  -4.351   9.363   0.774
  114    HB3  ALA  15           HB3      ALA  15  -4.317   8.030  -0.402
  115    H    THR  16           H        THR  16  -3.698   8.736  -2.856
  116    HA   THR  16           HA       THR  16  -5.098  11.310  -3.519
  117    HB   THR  16           HB       THR  16  -3.935   9.316  -5.492
  118    HG1  THR  16           HG1      THR  16  -2.591  11.281  -5.864
  119   HG21  THR  16          HG21      THR  16  -4.342  11.143  -7.127
  120   HG22  THR  16          HG22      THR  16  -5.857  10.572  -6.418
  121   HG23  THR  16          HG23      THR  16  -5.145  12.102  -5.860
  122    H    ILE  17           H        ILE  17  -7.163  10.994  -2.936
  123    HA   ILE  17           HA       ILE  17  -8.485   8.359  -3.180
  124    HB   ILE  17           HB       ILE  17  -9.790  10.920  -2.214
  125   HG12  ILE  17          HG12      ILE  17  -8.061   9.115  -0.477
  126   HG13  ILE  17          HG13      ILE  17  -7.770  10.802  -0.863
  127   HG21  ILE  17          HG21      ILE  17 -10.262   7.966  -1.613
  128   HG22  ILE  17          HG22      ILE  17 -11.190   9.308  -0.912
  129   HG23  ILE  17          HG23      ILE  17 -11.281   9.019  -2.620
  130   HD11  ILE  17          HD11      ILE  17  -9.925  11.395   0.307
  131   HD12  ILE  17          HD12      ILE  17 -10.000   9.703   0.878
  132   HD13  ILE  17          HD13      ILE  17  -8.653  10.725   1.341
  133    H    VAL  18           H        VAL  18 -10.279   7.949  -4.515
  134    HA   VAL  18           HA       VAL  18 -11.118  10.127  -6.406
  135    HB   VAL  18           HB       VAL  18 -12.227   8.108  -7.629
  136   HG11  VAL  18          HG11      VAL  18  -9.372   9.006  -7.920
  137   HG12  VAL  18          HG12      VAL  18 -10.201   7.939  -9.087
  138   HG13  VAL  18          HG13      VAL  18 -10.855   9.531  -8.772
  139   HG21  VAL  18          HG21      VAL  18 -11.376   6.343  -6.047
  140   HG22  VAL  18          HG22      VAL  18 -10.878   6.108  -7.737
  141   HG23  VAL  18          HG23      VAL  18  -9.720   6.762  -6.564
  142    H    THR  19           H        THR  19 -12.994  10.971  -6.177
  143    HA   THR  19           HA       THR  19 -15.080   9.680  -4.442
  144    HB   THR  19           HB       THR  19 -14.224  12.605  -4.474
  145    HG1  THR  19           HG1      THR  19 -13.253  12.287  -2.607
  146   HG21  THR  19          HG21      THR  19 -16.180  11.032  -2.754
  147   HG22  THR  19          HG22      THR  19 -15.539  12.615  -2.286
  148   HG23  THR  19          HG23      THR  19 -16.514  12.465  -3.754
  149    H    LEU  20           H        LEU  20 -17.250   9.915  -5.113
  150    HA   LEU  20           HA       LEU  20 -17.750  11.506  -7.571
  151    HB2  LEU  20           HB2      LEU  20 -19.548   9.623  -5.989
  152    HB3  LEU  20           HB3      LEU  20 -20.071  10.598  -7.349
  153    HG   LEU  20           HG       LEU  20 -17.909   8.451  -7.492
  154   HD11  LEU  20          HD11      LEU  20 -20.805   8.460  -8.455
  155   HD12  LEU  20          HD12      LEU  20 -19.605   7.187  -8.766
  156   HD13  LEU  20          HD13      LEU  20 -20.135   7.504  -7.114
  157   HD21  LEU  20          HD21      LEU  20 -17.506  10.100  -9.204
  158   HD22  LEU  20          HD22      LEU  20 -18.273   8.720  -9.978
  159   HD23  LEU  20          HD23      LEU  20 -19.225  10.191  -9.624
  160    H    ASP  21           H        ASP  21 -18.096  13.520  -7.390
  161    HA   ASP  21           HA       ASP  21 -19.319  14.723  -4.920
  162    HB2  ASP  21           HB2      ASP  21 -17.607  15.862  -7.137
  163    HB3  ASP  21           HB3      ASP  21 -18.616  16.894  -6.128
  164    H    SER  22           H        SER  22 -20.100  13.596  -7.841
  165    HA   SER  22           HA       SER  22 -22.811  14.317  -7.575
  166    HB2  SER  22           HB2      SER  22 -21.788  15.461 -10.156
  167    HB3  SER  22           HB3      SER  22 -23.459  15.363  -9.610
  168    HG   SER  22           HG       SER  22 -21.957  16.492  -7.687
  169    H    ASP  23           H        ASP  23 -24.109  12.850  -8.468
  170    HA   ASP  23           HA       ASP  23 -23.492  10.343  -8.570
  171    HB2  ASP  23           HB2      ASP  23 -25.707  11.385  -8.326
  172    HB3  ASP  23           HB3      ASP  23 -25.816  11.567 -10.073
  173    H    ASN  24           H        ASN  24 -21.523  10.538  -9.995
  174    HA   ASN  24           HA       ASN  24 -20.245   9.380 -11.477
  175    HB2  ASN  24           HB2      ASN  24 -22.752   8.174 -12.741
  176    HB3  ASN  24           HB3      ASN  24 -21.102   7.684 -13.021
  177   HD21  ASN  24          HD22      ASN  24 -23.476   7.769 -10.380
  178   HD22  ASN  24          HD21      ASN  24 -22.820   6.234  -9.830
  179    H    ILE  25           H        ILE  25 -21.383  11.925 -11.634
  180    HA   ILE  25           HA       ILE  25 -21.069  12.626 -14.525
  181    HB   ILE  25           HB       ILE  25 -22.778  14.376 -14.321
  182   HG12  ILE  25          HG12      ILE  25 -23.488  13.139 -11.646
  183   HG13  ILE  25          HG13      ILE  25 -22.720  14.714 -11.911
  184   HG21  ILE  25          HG21      ILE  25 -23.861  11.590 -13.681
  185   HG22  ILE  25          HG22      ILE  25 -24.694  12.876 -14.576
  186   HG23  ILE  25          HG23      ILE  25 -23.268  12.115 -15.268
  187   HD11  ILE  25          HD11      ILE  25 -24.745  15.455 -13.170
  188   HD12  ILE  25          HD12      ILE  25 -25.536  13.922 -12.720
  189   HD13  ILE  25          HD13      ILE  25 -25.054  15.069 -11.465
  190    H    LEU  26           H        LEU  26 -20.251  13.259 -11.251
  191    HA   LEU  26           HA       LEU  26 -18.093  15.059 -12.177
  192    HB2  LEU  26           HB2      LEU  26 -19.909  16.447 -11.132
  193    HB3  LEU  26           HB3      LEU  26 -19.754  15.457  -9.686
  194    HG   LEU  26           HG       LEU  26 -17.411  16.251  -9.379
  195   HD11  LEU  26          HD11      LEU  26 -18.254  18.105 -11.613
  196   HD12  LEU  26          HD12      LEU  26 -16.805  18.323 -10.602
  197   HD13  LEU  26          HD13      LEU  26 -16.928  16.916 -11.678
  198   HD21  LEU  26          HD21      LEU  26 -19.438  17.313  -8.264
  199   HD22  LEU  26          HD22      LEU  26 -18.068  18.413  -8.498
  200   HD23  LEU  26          HD23      LEU  26 -19.474  18.489  -9.576
  201    H    LEU  27           H        LEU  27 -17.015  13.056 -12.253
  202    HA   LEU  27           HA       LEU  27 -16.223  11.825  -9.658
  203    HB2  LEU  27           HB2      LEU  27 -16.691  10.503 -11.772
  204    HB3  LEU  27           HB3      LEU  27 -15.198  11.138 -12.438
  205    HG   LEU  27           HG       LEU  27 -15.346   9.564  -9.819
  206   HD11  LEU  27          HD11      LEU  27 -14.761   8.575 -12.636
  207   HD12  LEU  27          HD12      LEU  27 -14.653   7.605 -11.147
  208   HD13  LEU  27          HD13      LEU  27 -16.223   8.214 -11.691
  209   HD21  LEU  27          HD21      LEU  27 -13.217  10.758 -10.018
  210   HD22  LEU  27          HD22      LEU  27 -12.956   9.047 -10.327
  211   HD23  LEU  27          HD23      LEU  27 -13.021  10.183 -11.689
  212    H    SER  28           H        SER  28 -14.542  12.536  -8.514
  213    HA   SER  28           HA       SER  28 -12.596  14.433  -9.735
  214    HB2  SER  28           HB2      SER  28 -14.663  15.580  -8.790
  215    HB3  SER  28           HB3      SER  28 -14.165  14.993  -7.194
  216    HG   SER  28           HG       SER  28 -13.480  17.151  -7.807
  217    H    GLU  29           H        GLU  29 -10.671  14.746  -8.461
  218    HA   GLU  29           HA       GLU  29 -10.088  12.381  -6.733
  219    HB2  GLU  29           HB2      GLU  29  -8.061  13.640  -8.575
  220    HB3  GLU  29           HB3      GLU  29  -8.049  12.048  -7.768
  221    HG2  GLU  29           HG2      GLU  29  -9.909  11.314  -9.160
  222    HG3  GLU  29           HG3      GLU  29  -9.937  12.856 -10.016
  223    H    GLU  30           H        GLU  30  -8.944  12.683  -4.871
  224    HA   GLU  30           HA       GLU  30  -8.419  15.518  -4.030
  225    HB2  GLU  30           HB2      GLU  30  -9.481  13.303  -2.238
  226    HB3  GLU  30           HB3      GLU  30  -9.361  15.031  -1.915
  227    HG2  GLU  30           HG2      GLU  30 -11.018  15.308  -3.889
  228    HG3  GLU  30           HG3      GLU  30 -11.288  13.564  -3.756
  229    H    GLN  31           H        GLN  31  -6.366  15.909  -3.069
  230    HA   GLN  31           HA       GLN  31  -4.812  13.497  -2.273
  231    HB2  GLN  31           HB2      GLN  31  -3.932  16.208  -3.239
  232    HB3  GLN  31           HB3      GLN  31  -2.917  15.274  -2.154
  233    HG2  GLN  31           HG2      GLN  31  -3.794  13.469  -4.229
  234    HG3  GLN  31           HG3      GLN  31  -3.251  14.950  -5.006
  235   HE21  GLN  31          HE21      GLN  31  -2.164  12.722  -2.332
  236   HE22  GLN  31          HE22      GLN  31  -0.450  12.902  -2.721
  237    H    VAL  32           H        VAL  32  -4.466  13.108  -0.280
  238    HA   VAL  32           HA       VAL  32  -4.804  15.198   1.824
  239    HB   VAL  32           HB       VAL  32  -6.237  13.851   3.161
  240   HG11  VAL  32          HG11      VAL  32  -8.296  13.738   1.920
  241   HG12  VAL  32          HG12      VAL  32  -7.396  15.177   1.408
  242   HG13  VAL  32          HG13      VAL  32  -7.441  13.722   0.372
  243   HG21  VAL  32          HG21      VAL  32  -5.371  11.583   2.571
  244   HG22  VAL  32          HG22      VAL  32  -7.118  11.698   2.571
  245   HG23  VAL  32          HG23      VAL  32  -6.228  11.689   1.021
  246    H    ASP  33           H        ASP  33  -4.206  14.436   3.976
  247    HA   ASP  33           HA       ASP  33  -1.708  12.850   3.994
  248    HB2  ASP  33           HB2      ASP  33  -3.249  14.175   6.257
  249    HB3  ASP  33           HB3      ASP  33  -1.679  13.384   6.391
  250    H    VAL  34           H        VAL  34  -1.495  10.786   4.774
  251    HA   VAL  34           HA       VAL  34  -3.631   9.051   4.235
  252    HB   VAL  34           HB       VAL  34  -1.180   8.586   4.095
  253   HG11  VAL  34          HG11      VAL  34  -1.422   7.826   7.039
  254   HG12  VAL  34          HG12      VAL  34  -0.033   7.545   5.976
  255   HG13  VAL  34          HG13      VAL  34  -0.500   9.199   6.391
  256   HG21  VAL  34          HG21      VAL  34  -2.873   6.847   3.707
  257   HG22  VAL  34          HG22      VAL  34  -1.374   6.199   4.397
  258   HG23  VAL  34          HG23      VAL  34  -2.806   6.396   5.423
  259    H    GLU  35           H        GLU  35  -2.986  10.398   7.417
  260    HA   GLU  35           HA       GLU  35  -4.569   8.564   8.967
  261    HB2  GLU  35           HB2      GLU  35  -2.958  10.538   9.642
  262    HB3  GLU  35           HB3      GLU  35  -4.380  11.555   9.456
  263    HG2  GLU  35           HG2      GLU  35  -4.286  11.075  11.744
  264    HG3  GLU  35           HG3      GLU  35  -5.502   9.933  11.171
  265    H    LEU  36           H        LEU  36  -5.500  10.959   6.640
  266    HA   LEU  36           HA       LEU  36  -8.208  11.391   7.696
  267    HB2  LEU  36           HB2      LEU  36  -6.873  12.655   5.290
  268    HB3  LEU  36           HB3      LEU  36  -8.244  13.254   6.208
  269    HG   LEU  36           HG       LEU  36  -5.359  13.138   7.183
  270   HD11  LEU  36          HD11      LEU  36  -7.162  15.489   6.479
  271   HD12  LEU  36          HD12      LEU  36  -5.492  15.576   7.081
  272   HD13  LEU  36          HD13      LEU  36  -5.823  14.869   5.490
  273   HD21  LEU  36          HD21      LEU  36  -7.816  14.285   8.567
  274   HD22  LEU  36          HD22      LEU  36  -6.934  12.821   9.070
  275   HD23  LEU  36          HD23      LEU  36  -6.129  14.386   9.122
  276    H    VAL  37           H        VAL  37  -6.906   9.192   5.513
  277    HA   VAL  37           HA       VAL  37  -8.816   9.404   3.388
  278    HB   VAL  37           HB       VAL  37  -7.878   7.425   2.452
  279   HG11  VAL  37          HG11      VAL  37  -6.553   9.351   2.159
  280   HG12  VAL  37          HG12      VAL  37  -5.744   9.134   3.727
  281   HG13  VAL  37          HG13      VAL  37  -5.483   7.970   2.413
  282   HG21  VAL  37          HG21      VAL  37  -6.113   6.082   3.590
  283   HG22  VAL  37          HG22      VAL  37  -6.524   6.890   5.110
  284   HG23  VAL  37          HG23      VAL  37  -7.715   5.860   4.279
  285    H    GLN  38           H        GLN  38  -8.748   7.176   6.203
  286    HA   GLN  38           HA       GLN  38 -10.058   5.799   7.108
  287    HB2  GLN  38           HB2      GLN  38 -12.310   7.424   5.965
  288    HB3  GLN  38           HB3      GLN  38 -12.489   6.137   7.167
  289    HG2  GLN  38           HG2      GLN  38 -10.882   7.302   8.674
  290    HG3  GLN  38           HG3      GLN  38 -10.745   8.638   7.513
  291   HE21  GLN  38          HE22      GLN  38 -13.191   9.284   6.818
  292   HE22  GLN  38          HE21      GLN  38 -14.339   9.123   8.109
  293    H    ARG  39           H        ARG  39 -11.163   3.912   7.050
  294    HA   ARG  39           HA       ARG  39 -10.239   2.442   4.690
  295    HB2  ARG  39           HB2      ARG  39 -10.273   0.496   5.997
  296    HB3  ARG  39           HB3      ARG  39  -9.664   1.812   7.001
  297    HG2  ARG  39           HG2      ARG  39 -12.210   1.980   7.744
  298    HG3  ARG  39           HG3      ARG  39 -12.311   0.328   7.144
  299    HD2  ARG  39           HD2      ARG  39 -10.417  -0.307   8.641
  300    HD3  ARG  39           HD3      ARG  39 -10.299   1.375   9.173
  301    HE   ARG  39           HE       ARG  39 -12.628   1.159  10.070
  302   HH11  ARG  39          HH11      ARG  39 -10.926  -1.881   9.734
  303   HH12  ARG  39          HH12      ARG  39 -11.394  -2.425  11.325
  304   HH21  ARG  39          HH21      ARG  39 -13.297   0.369  11.994
  305   HH22  ARG  39          HH22      ARG  39 -12.791  -1.215  12.525
  306    H    GLY  40           H        GLY  40 -12.784   3.917   4.374
  307    HA2  GLY  40           HA2      GLY  40 -14.265   1.678   3.036
  308    HA3  GLY  40           HA3      GLY  40 -15.036   3.131   3.667
  309    H    ASP  41           H        ASP  41 -12.011   3.902   2.275
  310    HA   ASP  41           HA       ASP  41 -13.323   4.855  -0.233
  311    HB2  ASP  41           HB2      ASP  41 -11.281   6.037   1.621
  312    HB3  ASP  41           HB3      ASP  41 -11.147   6.408  -0.090
  313    H    ILE  42           H        ILE  42 -11.785   5.334  -2.009
  314    HA   ILE  42           HA       ILE  42 -10.052   2.993  -2.632
  315    HB   ILE  42           HB       ILE  42 -12.045   4.382  -4.455
  316   HG12  ILE  42          HG12      ILE  42 -11.999   1.500  -3.444
  317   HG13  ILE  42          HG13      ILE  42 -13.039   2.760  -2.790
  318   HG21  ILE  42          HG21      ILE  42 -10.125   2.078  -5.057
  319   HG22  ILE  42          HG22      ILE  42 -11.342   2.737  -6.172
  320   HG23  ILE  42          HG23      ILE  42  -9.986   3.735  -5.690
  321   HD11  ILE  42          HD11      ILE  42 -14.356   1.452  -4.279
  322   HD12  ILE  42          HD12      ILE  42 -14.102   3.039  -5.024
  323   HD13  ILE  42          HD13      ILE  42 -13.189   1.616  -5.596
  324    H    ILE  43           H        ILE  43  -8.058   3.491  -3.174
  325    HA   ILE  43           HA       ILE  43  -7.285   6.291  -3.674
  326    HB   ILE  43           HB       ILE  43  -5.710   3.932  -2.577
  327   HG12  ILE  43          HG12      ILE  43  -7.474   4.303  -0.978
  328   HG13  ILE  43          HG13      ILE  43  -5.949   4.857  -0.328
  329   HG21  ILE  43          HG21      ILE  43  -5.117   6.915  -2.582
  330   HG22  ILE  43          HG22      ILE  43  -4.180   5.696  -1.694
  331   HG23  ILE  43          HG23      ILE  43  -4.245   5.642  -3.454
  332   HD11  ILE  43          HD11      ILE  43  -8.130   6.664  -1.465
  333   HD12  ILE  43          HD12      ILE  43  -7.783   6.384   0.246
  334   HD13  ILE  43          HD13      ILE  43  -6.589   7.213  -0.766
  335    H    LYS  44           H        LYS  44  -6.294   6.824  -5.533
  336    HA   LYS  44           HA       LYS  44  -5.598   4.928  -7.603
  337    HB2  LYS  44           HB2      LYS  44  -4.995   7.905  -7.225
  338    HB3  LYS  44           HB3      LYS  44  -4.689   7.018  -8.705
  339    HG2  LYS  44           HG2      LYS  44  -7.417   7.412  -7.447
  340    HG3  LYS  44           HG3      LYS  44  -6.771   8.368  -8.773
  341    HD2  LYS  44           HD2      LYS  44  -7.349   5.411  -8.785
  342    HD3  LYS  44           HD3      LYS  44  -8.336   6.636  -9.568
  343    HE2  LYS  44           HE2      LYS  44  -5.545   5.702 -10.366
  344    HE3  LYS  44           HE3      LYS  44  -7.093   5.422 -11.206
  345    HZ1  LYS  44           HZ1      LYS  44  -7.224   7.788 -11.634
  346    HZ2  LYS  44           HZ2      LYS  44  -5.802   8.086 -10.854
  347    HZ3  LYS  44           HZ3      LYS  44  -5.791   7.211 -12.219
  348    H    VAL  45           H        VAL  45  -3.708   3.967  -8.119
  349    HA   VAL  45           HA       VAL  45  -1.220   5.367  -7.288
  350    HB   VAL  45           HB       VAL  45  -1.853   3.135  -6.143
  351   HG11  VAL  45          HG11      VAL  45  -0.575   1.973  -8.652
  352   HG12  VAL  45          HG12      VAL  45  -1.052   1.108  -7.188
  353   HG13  VAL  45          HG13      VAL  45  -2.291   1.850  -8.232
  354   HG21  VAL  45          HG21      VAL  45   0.527   2.541  -5.942
  355   HG22  VAL  45          HG22      VAL  45   0.917   3.501  -7.383
  356   HG23  VAL  45          HG23      VAL  45   0.327   4.300  -5.908
  357    H    VAL  46           H        VAL  46   0.194   5.934  -8.754
  358    HA   VAL  46           HA       VAL  46  -0.212   5.313 -11.594
  359    HB   VAL  46           HB       VAL  46   1.824   6.813 -11.890
  360   HG11  VAL  46          HG11      VAL  46   0.621   8.865 -11.496
  361   HG12  VAL  46          HG12      VAL  46  -0.483   7.628 -12.124
  362   HG13  VAL  46          HG13      VAL  46  -0.500   8.037 -10.399
  363   HG21  VAL  46          HG21      VAL  46   1.489   7.452  -8.942
  364   HG22  VAL  46          HG22      VAL  46   2.834   6.517  -9.641
  365   HG23  VAL  46          HG23      VAL  46   2.593   8.204 -10.107
  366    HA   PRO  47           HA       PRO  47   3.145   2.325 -12.122
  367    HB2  PRO  47           HB2      PRO  47   4.432   3.322 -14.371
  368    HB3  PRO  47           HB3      PRO  47   2.939   2.329 -14.404
  369    HG2  PRO  47           HG2      PRO  47   3.189   5.353 -14.516
  370    HG3  PRO  47           HG3      PRO  47   2.198   4.280 -15.556
  371    HD2  PRO  47           HD2      PRO  47   1.082   5.568 -13.490
  372    HD3  PRO  47           HD3      PRO  47   0.658   3.864 -13.790
  373    H    GLY  48           H        GLY  48   5.021   2.222 -11.073
  374    HA2  GLY  48           HA2      GLY  48   7.041   2.779 -10.108
  375    HA3  GLY  48           HA3      GLY  48   6.970   4.389 -10.828
  376    H    GLY  49           H        GLY  49   3.997   4.137  -9.411
  377    HA2  GLY  49           HA2      GLY  49   4.656   5.727  -7.117
  378    HA3  GLY  49           HA3      GLY  49   3.068   5.104  -7.557
  379    H    LYS  50           H        LYS  50   3.622   5.250  -4.977
  380    HA   LYS  50           HA       LYS  50   4.279   2.453  -4.064
  381    HB2  LYS  50           HB2      LYS  50   4.695   5.141  -2.707
  382    HB3  LYS  50           HB3      LYS  50   4.807   3.587  -1.861
  383    HG2  LYS  50           HG2      LYS  50   6.639   2.854  -3.238
  384    HG3  LYS  50           HG3      LYS  50   6.505   4.266  -4.301
  385    HD2  LYS  50           HD2      LYS  50   7.147   5.771  -2.515
  386    HD3  LYS  50           HD3      LYS  50   7.136   4.445  -1.327
  387    HE2  LYS  50           HE2      LYS  50   8.978   3.339  -2.459
  388    HE3  LYS  50           HE3      LYS  50   8.956   4.530  -3.771
  389    HZ1  LYS  50           HZ1      LYS  50   9.677   6.196  -2.299
  390    HZ2  LYS  50           HZ2      LYS  50   9.445   5.315  -0.954
  391    HZ3  LYS  50           HZ3      LYS  50  10.679   4.938  -2.003
  392    H    PHE  51           H        PHE  51   2.924   1.426  -2.658
  393    HA   PHE  51           HA       PHE  51   0.165   2.413  -2.524
  394    HB2  PHE  51           HB2      PHE  51   1.412  -0.070  -1.317
  395    HB3  PHE  51           HB3      PHE  51  -0.304   0.302  -1.355
  396    HD1  PHE  51           HD2      PHE  51  -1.601   0.114  -3.484
  397    HD2  PHE  51           HD1      PHE  51   2.601  -0.785  -3.322
  398    HE1  PHE  51           HE2      PHE  51  -1.735  -1.028  -5.697
  399    HE2  PHE  51           HE1      PHE  51   2.475  -1.874  -5.523
  400    HZ   PHE  51           HZ       PHE  51   0.295  -1.996  -6.733
  401    HA   PRO  52           HA       PRO  52   1.256   4.353   1.413
  402    HB2  PRO  52           HB2      PRO  52  -0.855   6.015   1.772
  403    HB3  PRO  52           HB3      PRO  52   0.318   6.243   0.444
  404    HG2  PRO  52           HG2      PRO  52  -2.394   4.910   0.300
  405    HG3  PRO  52           HG3      PRO  52  -1.711   6.158  -0.788
  406    HD2  PRO  52           HD2      PRO  52  -1.616   3.457  -1.348
  407    HD3  PRO  52           HD3      PRO  52  -0.361   4.610  -1.885
  408    H    VAL  53           H        VAL  53  -1.222   2.085   1.008
  409    HA   VAL  53           HA       VAL  53  -1.758   1.606   3.833
  410    HB   VAL  53           HB       VAL  53  -4.206   1.596   3.530
  411   HG11  VAL  53          HG11      VAL  53  -3.050   4.368   3.061
  412   HG12  VAL  53          HG12      VAL  53  -4.579   3.947   3.862
  413   HG13  VAL  53          HG13      VAL  53  -3.041   3.513   4.619
  414   HG21  VAL  53          HG21      VAL  53  -3.625   3.051   0.920
  415   HG22  VAL  53          HG22      VAL  53  -4.424   1.476   1.116
  416   HG23  VAL  53          HG23      VAL  53  -5.203   2.957   1.703
  417    H    ASP  54           H        ASP  54  -3.105  -0.486   4.021
  418    HA   ASP  54           HA       ASP  54  -2.476  -2.280   1.727
  419    HB2  ASP  54           HB2      ASP  54  -2.322  -4.101   3.207
  420    HB3  ASP  54           HB3      ASP  54  -1.286  -2.806   3.796
  421    H    GLY  55           H        GLY  55  -3.923  -3.799   0.954
  422    HA2  GLY  55           HA2      GLY  55  -6.573  -4.257   1.616
  423    HA3  GLY  55           HA3      GLY  55  -6.600  -2.703   0.784
  424    H    ARG  56           H        ARG  56  -7.855  -3.547  -0.815
  425    HA   ARG  56           HA       ARG  56  -6.710  -5.692  -2.572
  426    HB2  ARG  56           HB2      ARG  56  -8.780  -6.108  -1.141
  427    HB3  ARG  56           HB3      ARG  56  -9.625  -5.018  -2.236
  428    HG2  ARG  56           HG2      ARG  56  -9.128  -6.564  -4.134
  429    HG3  ARG  56           HG3      ARG  56  -8.266  -7.623  -3.004
  430    HD2  ARG  56           HD2      ARG  56 -10.424  -8.568  -3.254
  431    HD3  ARG  56           HD3      ARG  56 -10.387  -7.843  -1.654
  432    HE   ARG  56           HE       ARG  56 -12.006  -7.041  -3.991
  433   HH11  ARG  56          HH11      ARG  56 -11.298  -6.209  -0.581
  434   HH12  ARG  56          HH12      ARG  56 -12.507  -4.941  -0.669
  435   HH21  ARG  56          HH21      ARG  56 -13.630  -5.448  -3.761
  436   HH22  ARG  56          HH22      ARG  56 -13.676  -4.582  -2.230
  437    H    VAL  57           H        VAL  57  -6.578  -5.499  -4.707
  438    HA   VAL  57           HA       VAL  57  -6.853  -2.849  -6.018
  439    HB   VAL  57           HB       VAL  57  -5.679  -5.485  -7.026
  440   HG11  VAL  57          HG11      VAL  57  -5.531  -2.654  -8.152
  441   HG12  VAL  57          HG12      VAL  57  -4.645  -4.066  -8.782
  442   HG13  VAL  57          HG13      VAL  57  -6.396  -4.029  -8.874
  443   HG21  VAL  57          HG21      VAL  57  -4.292  -4.646  -5.185
  444   HG22  VAL  57          HG22      VAL  57  -3.464  -4.471  -6.732
  445   HG23  VAL  57          HG23      VAL  57  -4.196  -3.053  -5.961
  446    H    ILE  58           H        ILE  58  -8.637  -2.474  -7.294
  447    HA   ILE  58           HA       ILE  58 -10.138  -4.794  -8.452
  448    HB   ILE  58           HB       ILE  58 -12.290  -3.620  -7.644
  449   HG12  ILE  58          HG12      ILE  58 -10.432  -2.573  -5.480
  450   HG13  ILE  58          HG13      ILE  58 -10.933  -1.555  -6.846
  451   HG21  ILE  58          HG21      ILE  58 -12.302  -4.878  -5.577
  452   HG22  ILE  58          HG22      ILE  58 -11.473  -5.813  -6.821
  453   HG23  ILE  58          HG23      ILE  58 -10.539  -4.979  -5.554
  454   HD11  ILE  58          HD11      ILE  58 -13.318  -1.884  -6.230
  455   HD12  ILE  58          HD12      ILE  58 -12.799  -2.771  -4.771
  456   HD13  ILE  58          HD13      ILE  58 -12.371  -1.061  -4.978
  457    H    GLU  59           H        GLU  59  -8.409  -2.749  -9.564
  458    HA   GLU  59           HA       GLU  59  -9.784  -2.632 -12.049
  459    HB2  GLU  59           HB2      GLU  59 -10.451  -0.419 -10.642
  460    HB3  GLU  59           HB3      GLU  59  -8.831   0.064 -11.096
  461    HG2  GLU  59           HG2      GLU  59 -10.410   0.990 -12.620
  462    HG3  GLU  59           HG3      GLU  59  -9.389  -0.159 -13.473
  463    H    GLY  60           H        GLY  60  -8.123  -3.146 -13.455
  464    HA2  GLY  60           HA2      GLY  60  -6.133  -2.815 -14.554
  465    HA3  GLY  60           HA3      GLY  60  -5.533  -1.818 -13.230
  466    H    HIS  61           H        HIS  61  -3.719  -3.085 -14.154
  467    HA   HIS  61           HA       HIS  61  -3.088  -5.417 -12.482
  468    HB2  HIS  61           HB2      HIS  61  -2.412  -6.856 -14.381
  469    HB3  HIS  61           HB3      HIS  61  -4.139  -6.582 -14.260
  470    HD1  HIS  61           HD1      HIS  61  -5.319  -5.739 -16.412
  471    HD2  HIS  61           HD2      HIS  61  -1.121  -5.457 -16.473
  472    HE1  HIS  61           HE1      HIS  61  -4.686  -5.061 -18.784
  473    H    SER  62           H        SER  62  -1.089  -5.484 -11.871
  474    HA   SER  62           HA       SER  62   1.120  -4.406 -13.441
  475    HB2  SER  62           HB2      SER  62   0.093  -2.940 -11.030
  476    HB3  SER  62           HB3      SER  62   1.821  -2.990 -11.271
  477    HG   SER  62           HG       SER  62  -0.050  -2.377 -13.334
  478    H    MET  63           H        MET  63   3.265  -4.627 -12.318
  479    HA   MET  63           HA       MET  63   3.288  -7.134 -10.697
  480    HB2  MET  63           HB2      MET  63   4.096  -7.509 -12.930
  481    HB3  MET  63           HB3      MET  63   5.251  -6.170 -12.800
  482    HG2  MET  63           HG2      MET  63   6.530  -7.267 -11.185
  483    HG3  MET  63           HG3      MET  63   5.270  -8.440 -10.789
  484    HE1  MET  63           HE1      MET  63   5.480 -11.140 -13.471
  485    HE2  MET  63           HE2      MET  63   4.967 -10.711 -11.823
  486    HE3  MET  63           HE3      MET  63   4.270  -9.862 -13.226
  487    H    VAL  64           H        VAL  64   3.674  -6.715  -8.696
  488    HA   VAL  64           HA       VAL  64   4.790  -4.137  -7.839
  489    HB   VAL  64           HB       VAL  64   3.159  -6.320  -6.519
  490   HG11  VAL  64          HG11      VAL  64   4.160  -3.820  -5.101
  491   HG12  VAL  64          HG12      VAL  64   2.908  -4.918  -4.512
  492   HG13  VAL  64          HG13      VAL  64   4.555  -5.508  -4.681
  493   HG21  VAL  64          HG21      VAL  64   1.954  -4.793  -8.005
  494   HG22  VAL  64          HG22      VAL  64   1.536  -4.396  -6.327
  495   HG23  VAL  64          HG23      VAL  64   2.686  -3.390  -7.218
  496    H    ASP  65           H        ASP  65   6.231  -3.916  -6.064
  497    HA   ASP  65           HA       ASP  65   8.303  -6.053  -5.835
  498    HB2  ASP  65           HB2      ASP  65   8.955  -3.983  -7.061
  499    HB3  ASP  65           HB3      ASP  65   8.573  -3.029  -5.638
  500    H    GLU  66           H        GLU  66   7.408  -7.124  -4.075
  501    HA   GLU  66           HA       GLU  66   7.174  -5.623  -1.500
  502    HB2  GLU  66           HB2      GLU  66   5.643  -7.347  -0.715
  503    HB3  GLU  66           HB3      GLU  66   5.026  -6.437  -2.093
  504    HG2  GLU  66           HG2      GLU  66   5.414  -8.253  -3.600
  505    HG3  GLU  66           HG3      GLU  66   6.296  -9.181  -2.371
  506    H    SER  67           H        SER  67   9.535  -6.939  -2.910
  507    HA   SER  67           HA       SER  67  10.403  -9.259  -1.648
  508    HB2  SER  67           HB2      SER  67  12.652  -8.569  -2.399
  509    HB3  SER  67           HB3      SER  67  11.422  -8.325  -3.650
  510    HG   SER  67           HG       SER  67  12.644  -6.506  -3.596
  511    H    LEU  68           H        LEU  68  10.615  -5.936  -0.300
  512    HA   LEU  68           HA       LEU  68  12.412  -6.858   1.826
  513    HB2  LEU  68           HB2      LEU  68  12.448  -4.586   0.809
  514    HB3  LEU  68           HB3      LEU  68  10.841  -4.263   1.418
  515    HG   LEU  68           HG       LEU  68  12.749  -3.148   2.576
  516   HD11  LEU  68          HD11      LEU  68  11.241  -4.838   4.584
  517   HD12  LEU  68          HD12      LEU  68  11.894  -3.209   4.756
  518   HD13  LEU  68          HD13      LEU  68  10.510  -3.495   3.692
  519   HD21  LEU  68          HD21      LEU  68  14.347  -5.023   2.594
  520   HD22  LEU  68          HD22      LEU  68  14.097  -4.328   4.209
  521   HD23  LEU  68          HD23      LEU  68  13.342  -5.871   3.789
  522    H    ILE  69           H        ILE  69   8.976  -6.624   1.392
  523    HA   ILE  69           HA       ILE  69   8.329  -6.703   4.277
  524    HB   ILE  69           HB       ILE  69   6.334  -7.271   2.072
  525   HG12  ILE  69          HG12      ILE  69   7.449  -5.150   1.371
  526   HG13  ILE  69          HG13      ILE  69   5.745  -5.040   1.708
  527   HG21  ILE  69          HG21      ILE  69   6.199  -6.163   4.911
  528   HG22  ILE  69          HG22      ILE  69   4.816  -6.190   3.819
  529   HG23  ILE  69          HG23      ILE  69   5.564  -7.706   4.305
  530   HD11  ILE  69          HD11      ILE  69   6.902  -3.073   2.551
  531   HD12  ILE  69          HD12      ILE  69   6.156  -3.985   3.862
  532   HD13  ILE  69          HD13      ILE  69   7.918  -4.095   3.606
  533    H    THR  70           H        THR  70   8.031  -8.817   1.456
  534    HA   THR  70           HA       THR  70   7.347 -11.150   3.137
  535    HB   THR  70           HB       THR  70   7.146 -10.967   0.121
  536    HG1  THR  70           HG1      THR  70   5.206 -10.036   0.282
  537   HG21  THR  70          HG21      THR  70   6.604 -13.175   1.112
  538   HG22  THR  70          HG22      THR  70   5.501 -12.395   2.265
  539   HG23  THR  70          HG23      THR  70   5.130 -12.393   0.530
  540    H    GLY  71           H        GLY  71  10.109 -10.017   1.419
  541    HA2  GLY  71           HA2      GLY  71  12.237 -10.905   1.412
  542    HA3  GLY  71           HA3      GLY  71  11.638 -12.347   2.230
  543    H    GLU  72           H        GLU  72   9.833 -11.944  -0.503
  544    HA   GLU  72           HA       GLU  72  10.558 -14.360  -1.654
  545    HB2  GLU  72           HB2      GLU  72   9.203 -12.030  -3.064
  546    HB3  GLU  72           HB3      GLU  72   9.141 -13.711  -3.586
  547    HG2  GLU  72           HG2      GLU  72   8.054 -12.764  -0.904
  548    HG3  GLU  72           HG3      GLU  72   7.104 -12.814  -2.377
  549    H    ALA  73           H        ALA  73  11.554 -11.213  -3.030
  550    HA   ALA  73           HA       ALA  73  13.507 -10.517  -3.938
  551    HB1  ALA  73           HB1      ALA  73  14.795 -12.295  -2.749
  552    HB2  ALA  73           HB2      ALA  73  14.534 -13.354  -4.152
  553    HB3  ALA  73           HB3      ALA  73  15.433 -11.842  -4.341
  554    H    MET  74           H        MET  74  11.407 -12.873  -5.188
  555    HA   MET  74           HA       MET  74  11.797 -12.047  -7.992
  556    HB2  MET  74           HB2      MET  74   9.906 -13.595  -8.371
  557    HB3  MET  74           HB3      MET  74  11.357 -14.377  -7.734
  558    HG2  MET  74           HG2      MET  74  10.333 -14.548  -5.537
  559    HG3  MET  74           HG3      MET  74   8.944 -13.577  -6.051
  560    HE1  MET  74           HE1      MET  74   7.374 -15.475  -4.972
  561    HE2  MET  74           HE2      MET  74   7.534 -17.195  -5.394
  562    HE3  MET  74           HE3      MET  74   8.849 -16.373  -4.535
  563    HA   PRO  75           HA       PRO  75   8.462  -9.048  -7.559
  564    HB2  PRO  75           HB2      PRO  75   7.843  -8.537 -10.111
  565    HB3  PRO  75           HB3      PRO  75   9.442  -8.112  -9.440
  566    HG2  PRO  75           HG2      PRO  75   8.704 -10.581 -11.054
  567    HG3  PRO  75           HG3      PRO  75  10.068  -9.449 -11.335
  568    HD2  PRO  75           HD2      PRO  75  10.354 -11.784  -9.930
  569    HD3  PRO  75           HD3      PRO  75  11.279 -10.309  -9.515
  570    H    VAL  76           H        VAL  76   6.202  -8.849  -7.676
  571    HA   VAL  76           HA       VAL  76   4.752 -11.464  -8.015
  572    HB   VAL  76           HB       VAL  76   4.290  -9.282  -5.947
  573   HG11  VAL  76          HG11      VAL  76   2.844 -10.971  -4.854
  574   HG12  VAL  76          HG12      VAL  76   2.217 -10.533  -6.447
  575   HG13  VAL  76          HG13      VAL  76   3.081 -12.068  -6.228
  576   HG21  VAL  76          HG21      VAL  76   6.390 -10.444  -5.446
  577   HG22  VAL  76          HG22      VAL  76   5.142 -10.978  -4.321
  578   HG23  VAL  76          HG23      VAL  76   5.605 -12.023  -5.677
  579    H    ALA  77           H        ALA  77   3.012 -11.544  -9.336
  580    HA   ALA  77           HA       ALA  77   2.140  -9.109 -10.696
  581    HB1  ALA  77           HB1      ALA  77   2.524 -11.215 -11.914
  582    HB2  ALA  77           HB2      ALA  77   1.247 -12.003 -10.962
  583    HB3  ALA  77           HB3      ALA  77   0.843 -10.677 -12.064
  584    H    LYS  78           H        LYS  78   0.305  -8.035 -10.492
  585    HA   LYS  78           HA       LYS  78  -1.859  -8.933  -8.625
  586    HB2  LYS  78           HB2      LYS  78  -0.999  -6.064  -9.134
  587    HB3  LYS  78           HB3      LYS  78  -2.171  -6.622  -7.946
  588    HG2  LYS  78           HG2      LYS  78   0.804  -7.247  -7.892
  589    HG3  LYS  78           HG3      LYS  78   0.032  -5.914  -7.050
  590    HD2  LYS  78           HD2      LYS  78  -1.246  -7.512  -5.655
  591    HD3  LYS  78           HD3      LYS  78  -0.578  -8.879  -6.567
  592    HE2  LYS  78           HE2      LYS  78   1.709  -8.266  -5.881
  593    HE3  LYS  78           HE3      LYS  78   1.095  -6.869  -4.989
  594    HZ1  LYS  78           HZ1      LYS  78   0.416  -9.690  -4.380
  595    HZ2  LYS  78           HZ2      LYS  78   1.512  -8.788  -3.542
  596    HZ3  LYS  78           HZ3      LYS  78  -0.092  -8.399  -3.516
  597    H    LYS  79           H        LYS  79  -3.928  -8.369  -9.160
  598    HA   LYS  79           HA       LYS  79  -4.691  -7.565 -11.924
  599    HB2  LYS  79           HB2      LYS  79  -4.944 -10.270 -10.530
  600    HB3  LYS  79           HB3      LYS  79  -6.095  -9.817 -11.769
  601    HG2  LYS  79           HG2      LYS  79  -4.340  -9.657 -13.452
  602    HG3  LYS  79           HG3      LYS  79  -3.084  -9.885 -12.231
  603    HD2  LYS  79           HD2      LYS  79  -3.400 -11.958 -13.439
  604    HD3  LYS  79           HD3      LYS  79  -3.887 -12.152 -11.753
  605    HE2  LYS  79           HE2      LYS  79  -6.297 -11.776 -12.514
  606    HE3  LYS  79           HE3      LYS  79  -5.708 -11.792 -14.177
  607    HZ1  LYS  79           HZ1      LYS  79  -4.887 -14.080 -13.753
  608    HZ2  LYS  79           HZ2      LYS  79  -5.524 -14.033 -12.229
  609    HZ3  LYS  79           HZ3      LYS  79  -6.486 -13.962 -13.573
  610    HA   PRO  80           HA       PRO  80  -8.418  -6.186  -9.717
  611    HB2  PRO  80           HB2      PRO  80 -10.548  -7.325 -11.086
  612    HB3  PRO  80           HB3      PRO  80  -9.660  -5.863 -11.620
  613    HG2  PRO  80           HG2      PRO  80  -9.227  -8.741 -12.483
  614    HG3  PRO  80           HG3      PRO  80  -9.373  -7.284 -13.521
  615    HD2  PRO  80           HD2      PRO  80  -6.953  -8.259 -12.899
  616    HD3  PRO  80           HD3      PRO  80  -7.228  -6.503 -12.873
  617    H    GLY  81           H        GLY  81  -9.322  -6.902  -7.884
  618    HA2  GLY  81           HA2      GLY  81 -10.180  -8.296  -6.249
  619    HA3  GLY  81           HA3      GLY  81 -10.101  -9.684  -7.338
  620    H    SER  82           H        SER  82  -7.171  -7.686  -6.860
  621    HA   SER  82           HA       SER  82  -5.907 -10.081  -5.546
  622    HB2  SER  82           HB2      SER  82  -5.023  -9.336  -7.833
  623    HB3  SER  82           HB3      SER  82  -4.445  -7.876  -7.015
  624    HG   SER  82           HG       SER  82  -3.787 -10.603  -6.489
  625    H    THR  83           H        THR  83  -4.085  -9.550  -3.919
  626    HA   THR  83           HA       THR  83  -4.885  -7.140  -2.352
  627    HB   THR  83           HB       THR  83  -4.091  -8.421  -0.346
  628    HG1  THR  83           HG1      THR  83  -4.189 -10.622  -0.468
  629   HG21  THR  83          HG21      THR  83  -6.539  -9.460  -1.840
  630   HG22  THR  83          HG22      THR  83  -6.245  -9.541  -0.088
  631   HG23  THR  83          HG23      THR  83  -6.470  -7.974  -0.870
  632    H    VAL  84           H        VAL  84  -3.473  -5.933  -1.271
  633    HA   VAL  84           HA       VAL  84  -0.569  -6.194  -1.860
  634    HB   VAL  84           HB       VAL  84  -0.502  -3.749  -2.391
  635   HG11  VAL  84          HG11      VAL  84  -2.095  -5.434  -4.353
  636   HG12  VAL  84          HG12      VAL  84  -1.152  -3.974  -4.725
  637   HG13  VAL  84          HG13      VAL  84  -0.329  -5.431  -4.151
  638   HG21  VAL  84          HG21      VAL  84  -3.515  -3.988  -2.793
  639   HG22  VAL  84          HG22      VAL  84  -2.721  -3.072  -1.494
  640   HG23  VAL  84          HG23      VAL  84  -2.489  -2.595  -3.181
  641    H    ILE  85           H        ILE  85   0.777  -4.825  -0.607
  642    HA   ILE  85           HA       ILE  85  -0.352  -3.935   1.991
  643    HB   ILE  85           HB       ILE  85   1.619  -4.482   3.150
  644   HG12  ILE  85          HG12      ILE  85   3.417  -4.088   1.674
  645   HG13  ILE  85          HG13      ILE  85   3.493  -5.746   2.226
  646   HG21  ILE  85          HG21      ILE  85   0.830  -6.925   1.529
  647   HG22  ILE  85          HG22      ILE  85   1.614  -6.885   3.120
  648   HG23  ILE  85          HG23      ILE  85  -0.041  -6.273   2.934
  649   HD11  ILE  85          HD11      ILE  85   2.611  -4.857  -0.530
  650   HD12  ILE  85          HD12      ILE  85   4.139  -5.612  -0.074
  651   HD13  ILE  85          HD13      ILE  85   2.642  -6.544   0.054
  652    H    ALA  86           H        ALA  86   0.539  -2.123   2.977
  653    HA   ALA  86           HA       ALA  86   1.309  -0.014   1.256
  654    HB1  ALA  86           HB1      ALA  86   1.591  -0.262   4.292
  655    HB2  ALA  86           HB2      ALA  86   1.621   1.256   3.364
  656    HB3  ALA  86           HB3      ALA  86   0.144   0.281   3.445
  657    H    GLY  87           H        GLY  87   3.238   1.099   1.003
  658    HA2  GLY  87           HA2      GLY  87   5.519   1.576   1.176
  659    HA3  GLY  87           HA3      GLY  87   5.747   0.171   2.231
  660    H    SER  88           H        SER  88   4.164  -1.155  -0.299
  661    HA   SER  88           HA       SER  88   6.629  -2.066  -1.657
  662    HB2  SER  88           HB2      SER  88   5.181  -3.625  -2.846
  663    HB3  SER  88           HB3      SER  88   4.973  -3.769  -1.106
  664    HG   SER  88           HG       SER  88   2.978  -2.752  -1.262
  665    H    ILE  89           H        ILE  89   6.704  -2.009  -4.040
  666    HA   ILE  89           HA       ILE  89   5.742   0.639  -5.028
  667    HB   ILE  89           HB       ILE  89   7.873  -0.765  -6.543
  668   HG12  ILE  89          HG12      ILE  89   8.753  -1.197  -4.300
  669   HG13  ILE  89          HG13      ILE  89   9.725  -0.075  -5.225
  670   HG21  ILE  89          HG21      ILE  89   7.032   1.407  -7.265
  671   HG22  ILE  89          HG22      ILE  89   7.385   2.126  -5.683
  672   HG23  ILE  89          HG23      ILE  89   8.708   1.578  -6.737
  673   HD11  ILE  89          HD11      ILE  89   8.966   1.805  -3.914
  674   HD12  ILE  89          HD12      ILE  89   7.770   0.798  -3.057
  675   HD13  ILE  89          HD13      ILE  89   9.497   0.509  -2.826
  676    H    ASN  90           H        ASN  90   4.742   0.881  -6.978
  677    HA   ASN  90           HA       ASN  90   3.613  -1.559  -8.253
  678    HB2  ASN  90           HB2      ASN  90   2.045   0.190  -7.346
  679    HB3  ASN  90           HB3      ASN  90   2.782   1.373  -8.424
  680   HD21  ASN  90          HD22      ASN  90   1.528   1.659 -10.204
  681   HD22  ASN  90          HD21      ASN  90   0.655   0.377 -11.012
  682    H    GLN  91           H        GLN  91   3.812  -1.969 -10.509
  683    HA   GLN  91           HA       GLN  91   5.116  -0.017 -12.255
  684    HB2  GLN  91           HB2      GLN  91   6.877  -1.470 -10.863
  685    HB3  GLN  91           HB3      GLN  91   6.430  -2.735 -11.997
  686    HG2  GLN  91           HG2      GLN  91   8.351  -1.723 -12.877
  687    HG3  GLN  91           HG3      GLN  91   7.049  -1.076 -13.872
  688   HE21  GLN  91          HE22      GLN  91   6.627   1.244 -13.743
  689   HE22  GLN  91          HE21      GLN  91   7.675   2.283 -12.778
  690    H    ASN  92           H        ASN  92   4.527  -0.284 -14.371
  691    HA   ASN  92           HA       ASN  92   4.243  -1.484 -16.326
  692    HB2  ASN  92           HB2      ASN  92   4.029  -3.748 -15.447
  693    HB3  ASN  92           HB3      ASN  92   2.403  -3.381 -14.860
  694   HD21  ASN  92          HD22      ASN  92   0.652  -3.372 -16.320
  695   HD22  ASN  92          HD21      ASN  92   0.877  -3.678 -18.035
  696    H    GLY  93           H        GLY  93   1.564  -0.645 -14.032
  697    HA2  GLY  93           HA2      GLY  93   0.648   1.421 -15.890
  698    HA3  GLY  93           HA3      GLY  93  -0.421   0.026 -15.789
  699    H    SER  94           H        SER  94  -1.790   1.966 -15.139
  700    HA   SER  94           HA       SER  94  -1.519   2.889 -12.341
  701    HB2  SER  94           HB2      SER  94  -3.602   3.624 -14.420
  702    HB3  SER  94           HB3      SER  94  -3.276   4.466 -12.898
  703    HG   SER  94           HG       SER  94  -2.371   5.206 -15.083
  704    H    LEU  95           H        LEU  95  -2.847   2.188 -10.651
  705    HA   LEU  95           HA       LEU  95  -5.195   0.414 -11.293
  706    HB2  LEU  95           HB2      LEU  95  -3.609   0.084  -8.793
  707    HB3  LEU  95           HB3      LEU  95  -4.603  -1.071  -9.616
  708    HG   LEU  95           HG       LEU  95  -1.813  -0.220 -10.521
  709   HD11  LEU  95          HD11      LEU  95  -2.795  -2.580  -8.844
  710   HD12  LEU  95          HD12      LEU  95  -1.151  -2.390  -9.471
  711   HD13  LEU  95          HD13      LEU  95  -1.762  -1.239  -8.294
  712   HD21  LEU  95          HD21      LEU  95  -3.525  -2.641 -11.206
  713   HD22  LEU  95          HD22      LEU  95  -3.313  -1.233 -12.272
  714   HD23  LEU  95          HD23      LEU  95  -1.919  -2.237 -11.868
  715    H    LEU  96           H        LEU  96  -6.784   0.177  -9.643
  716    HA   LEU  96           HA       LEU  96  -7.021   2.463  -7.708
  717    HB2  LEU  96           HB2      LEU  96  -9.218   0.952  -9.168
  718    HB3  LEU  96           HB3      LEU  96  -9.486   1.970  -7.785
  719    HG   LEU  96           HG       LEU  96  -8.745   3.928  -8.919
  720   HD11  LEU  96          HD11      LEU  96  -8.273   2.191 -11.379
  721   HD12  LEU  96          HD12      LEU  96  -8.498   3.935 -11.471
  722   HD13  LEU  96          HD13      LEU  96  -7.125   3.289 -10.592
  723   HD21  LEU  96          HD21      LEU  96 -11.095   3.341  -9.091
  724   HD22  LEU  96          HD22      LEU  96 -10.498   4.252 -10.498
  725   HD23  LEU  96          HD23      LEU  96 -10.768   2.495 -10.626
  726    H    ILE  97           H        ILE  97  -6.750   1.881  -5.673
  727    HA   ILE  97           HA       ILE  97  -7.306  -0.944  -4.838
  728    HB   ILE  97           HB       ILE  97  -5.343   1.013  -3.588
  729   HG12  ILE  97          HG12      ILE  97  -3.747  -0.910  -4.640
  730   HG13  ILE  97          HG13      ILE  97  -5.019  -0.941  -5.855
  731   HG21  ILE  97          HG21      ILE  97  -4.468  -0.963  -2.438
  732   HG22  ILE  97          HG22      ILE  97  -6.177  -0.774  -2.063
  733   HG23  ILE  97          HG23      ILE  97  -5.660  -2.001  -3.241
  734   HD11  ILE  97          HD11      ILE  97  -4.650   1.527  -6.235
  735   HD12  ILE  97          HD12      ILE  97  -3.375   1.486  -4.999
  736   HD13  ILE  97          HD13      ILE  97  -3.209   0.550  -6.497
  737    H    CYS  98           H        CYS  98  -8.787  -1.300  -3.280
  738    HA   CYS  98           HA       CYS  98 -10.005   1.020  -1.883
  739    HB2  CYS  98           HB2      CYS  98 -11.660  -0.515  -1.043
  740    HB3  CYS  98           HB3      CYS  98 -11.549  -0.620  -2.802
  741    HG   CYS  98           HG       CYS  98  -9.863  -2.726  -2.751
  742    H    ALA  99           H        ALA  99  -9.408   1.678   0.096
  743    HA   ALA  99           HA       ALA  99  -7.138   0.396   1.382
  744    HB1  ALA  99           HB1      ALA  99  -8.876   2.784   2.172
  745    HB2  ALA  99           HB2      ALA  99  -7.296   2.362   2.864
  746    HB3  ALA  99           HB3      ALA  99  -7.423   2.865   1.160
  747    H    THR 100           H        THR 100  -7.223  -1.074   3.042
  748    HA   THR 100           HA       THR 100  -9.849  -1.433   4.468
  749    HB   THR 100           HB       THR 100  -9.216  -3.696   4.946
  750    HG1  THR 100           HG1      THR 100  -6.738  -3.017   3.765
  751   HG21  THR 100          HG21      THR 100 -10.303  -3.283   2.773
  752   HG22  THR 100          HG22      THR 100  -8.721  -3.141   1.991
  753   HG23  THR 100          HG23      THR 100  -9.218  -4.682   2.722
  754    H    HIS 101           H        HIS 101  -6.755  -0.173   5.015
  755    HA   HIS 101           HA       HIS 101  -7.544   0.251   7.811
  756    HB2  HIS 101           HB2      HIS 101  -4.758  -0.654   6.992
  757    HB3  HIS 101           HB3      HIS 101  -5.267  -0.207   8.621
  758    HD1  HIS 101           HD1      HIS 101  -4.869  -3.228   6.470
  759    HD2  HIS 101           HD2      HIS 101  -7.263  -1.964   9.705
  760    HE1  HIS 101           HE1      HIS 101  -5.889  -5.319   7.447
  761    H    VAL 102           H        VAL 102  -6.700   2.260   8.659
  762    HA   VAL 102           HA       VAL 102  -5.555   4.184   6.701
  763    HB   VAL 102           HB       VAL 102  -5.454   5.771   8.607
  764   HG11  VAL 102          HG11      VAL 102  -8.188   4.574   8.017
  765   HG12  VAL 102          HG12      VAL 102  -7.846   6.231   8.571
  766   HG13  VAL 102          HG13      VAL 102  -7.286   5.704   6.975
  767   HG21  VAL 102          HG21      VAL 102  -5.474   4.085  10.488
  768   HG22  VAL 102          HG22      VAL 102  -6.679   5.377  10.637
  769   HG23  VAL 102          HG23      VAL 102  -7.185   3.773  10.104
  770    H    GLY 103           H        GLY 103  -3.420   5.447   7.629
  771    HA2  GLY 103           HA2      GLY 103  -1.519   3.461   6.802
  772    HA3  GLY 103           HA3      GLY 103  -1.166   5.081   7.292
  773    H    ALA 104           H        ALA 104  -2.123   4.996   9.996
  774    HA   ALA 104           HA       ALA 104   0.075   3.578  11.277
  775    HB1  ALA 104           HB1      ALA 104  -2.251   5.165  12.404
  776    HB2  ALA 104           HB2      ALA 104  -0.879   4.543  13.348
  777    HB3  ALA 104           HB3      ALA 104  -0.609   5.750  12.079
  778    H    ASP 105           H        ASP 105  -3.442   2.983  11.119
  779    HA   ASP 105           HA       ASP 105  -3.382   0.598  12.754
  780    HB2  ASP 105           HB2      ASP 105  -5.363   2.077  12.454
  781    HB3  ASP 105           HB3      ASP 105  -5.496   1.489  10.793
  782    H    THR 106           H        THR 106  -2.110   1.034   9.703
  783    HA   THR 106           HA       THR 106  -2.911  -1.120   8.121
  784    HB   THR 106           HB       THR 106  -0.562  -1.114   7.167
  785    HG1  THR 106           HG1      THR 106  -0.067   1.199   8.568
  786   HG21  THR 106          HG21      THR 106  -2.085   1.438   7.227
  787   HG22  THR 106          HG22      THR 106  -0.664   1.147   6.197
  788   HG23  THR 106          HG23      THR 106  -2.130   0.160   6.026
  789    H    THR 107           H        THR 107  -2.195  -3.067   7.610
  790    HA   THR 107           HA       THR 107  -1.359  -4.938   9.604
  791    HB   THR 107           HB       THR 107  -2.556  -5.167   7.268
  792    HG1  THR 107           HG1      THR 107  -2.030  -7.317   7.274
  793   HG21  THR 107          HG21      THR 107  -1.238  -6.083   5.484
  794   HG22  THR 107          HG22      THR 107  -0.573  -4.493   5.869
  795   HG23  THR 107          HG23      THR 107   0.258  -5.970   6.427
  796    H    LEU 108           H        LEU 108   0.464  -2.960   7.318
  797    HA   LEU 108           HA       LEU 108   3.077  -3.985   7.652
  798    HB2  LEU 108           HB2      LEU 108   2.281  -2.399   5.871
  799    HB3  LEU 108           HB3      LEU 108   2.070  -1.158   7.099
  800    HG   LEU 108           HG       LEU 108   4.617  -1.441   7.592
  801   HD11  LEU 108          HD11      LEU 108   4.941  -3.553   6.342
  802   HD12  LEU 108          HD12      LEU 108   4.414  -2.749   4.846
  803   HD13  LEU 108          HD13      LEU 108   5.914  -2.236   5.647
  804   HD21  LEU 108          HD21      LEU 108   5.219   0.088   5.836
  805   HD22  LEU 108          HD22      LEU 108   3.796  -0.358   4.882
  806   HD23  LEU 108          HD23      LEU 108   3.600   0.494   6.437
  807    H    SER 109           H        SER 109   1.422  -1.292   9.414
  808    HA   SER 109           HA       SER 109   3.739  -0.765  11.093
  809    HB2  SER 109           HB2      SER 109   0.855   0.093  11.429
  810    HB3  SER 109           HB3      SER 109   2.247   0.726  12.333
  811    HG   SER 109           HG       SER 109   1.656   0.968   9.576
  812    H    GLN 110           H        GLN 110   1.207  -3.147  11.265
  813    HA   GLN 110           HA       GLN 110   1.551  -3.660  14.122
  814    HB2  GLN 110           HB2      GLN 110  -0.567  -4.153  12.934
  815    HB3  GLN 110           HB3      GLN 110   0.247  -5.350  11.968
  816    HG2  GLN 110           HG2      GLN 110  -0.840  -6.529  13.668
  817    HG3  GLN 110           HG3      GLN 110   0.869  -6.619  14.062
  818   HE21  GLN 110          HE22      GLN 110  -1.939  -4.372  14.663
  819   HE22  GLN 110          HE21      GLN 110  -1.502  -4.131  16.328
  820    H    ILE 111           H        ILE 111   2.891  -5.047  11.079
  821    HA   ILE 111           HA       ILE 111   4.259  -7.248  12.095
  822    HB   ILE 111           HB       ILE 111   5.232  -5.322   9.952
  823   HG12  ILE 111          HG12      ILE 111   3.997  -8.101   9.651
  824   HG13  ILE 111          HG13      ILE 111   3.049  -6.629   9.623
  825   HG21  ILE 111          HG21      ILE 111   6.735  -7.171   9.191
  826   HG22  ILE 111          HG22      ILE 111   7.195  -6.571  10.770
  827   HG23  ILE 111          HG23      ILE 111   6.300  -8.101  10.639
  828   HD11  ILE 111          HD11      ILE 111   5.167  -7.427   7.606
  829   HD12  ILE 111          HD12      ILE 111   3.429  -7.216   7.355
  830   HD13  ILE 111          HD13      ILE 111   4.448  -5.803   7.684
  831    H    VAL 112           H        VAL 112   5.712  -3.910  12.013
  832    HA   VAL 112           HA       VAL 112   8.036  -4.653  13.472
  833    HB   VAL 112           HB       VAL 112   8.312  -2.241  13.946
  834   HG11  VAL 112          HG11      VAL 112   7.482  -2.836  11.076
  835   HG12  VAL 112          HG12      VAL 112   8.557  -1.540  11.634
  836   HG13  VAL 112          HG13      VAL 112   9.059  -3.228  11.805
  837   HG21  VAL 112          HG21      VAL 112   5.654  -1.849  12.492
  838   HG22  VAL 112          HG22      VAL 112   5.947  -1.532  14.218
  839   HG23  VAL 112          HG23      VAL 112   6.786  -0.584  12.996
  840    H    LYS 113           H        LYS 113   4.836  -4.135  14.671
  841    HA   LYS 113           HA       LYS 113   5.672  -3.660  17.471
  842    HB2  LYS 113           HB2      LYS 113   2.972  -3.795  16.111
  843    HB3  LYS 113           HB3      LYS 113   3.171  -3.793  17.876
  844    HG2  LYS 113           HG2      LYS 113   4.456  -1.677  17.713
  845    HG3  LYS 113           HG3      LYS 113   4.293  -1.746  15.949
  846    HD2  LYS 113           HD2      LYS 113   1.676  -1.873  16.522
  847    HD3  LYS 113           HD3      LYS 113   2.218  -1.092  18.042
  848    HE2  LYS 113           HE2      LYS 113   3.522   0.527  16.632
  849    HE3  LYS 113           HE3      LYS 113   2.890  -0.295  15.199
  850    HZ1  LYS 113           HZ1      LYS 113   0.629   0.321  15.977
  851    HZ2  LYS 113           HZ2      LYS 113   1.255   1.214  17.192
  852    HZ3  LYS 113           HZ3      LYS 113   1.526   1.634  15.614
  853    H    LEU 114           H        LEU 114   4.596  -6.262  15.360
  854    HA   LEU 114           HA       LEU 114   4.273  -8.301  17.414
  855    HB2  LEU 114           HB2      LEU 114   3.414  -8.010  14.864
  856    HB3  LEU 114           HB3      LEU 114   4.875  -8.943  14.535
  857    HG   LEU 114           HG       LEU 114   2.544  -9.725  16.330
  858   HD11  LEU 114          HD11      LEU 114   3.446 -10.812  13.629
  859   HD12  LEU 114          HD12      LEU 114   2.075 -11.400  14.596
  860   HD13  LEU 114          HD13      LEU 114   2.034  -9.764  13.909
  861   HD21  LEU 114          HD21      LEU 114   4.537 -10.756  17.208
  862   HD22  LEU 114          HD22      LEU 114   3.644 -11.994  16.320
  863   HD23  LEU 114          HD23      LEU 114   5.072 -11.233  15.576
  864    H    VAL 115           H        VAL 115   6.858  -7.307  15.179
  865    HA   VAL 115           HA       VAL 115   8.900  -9.118  16.112
  866    HB   VAL 115           HB       VAL 115   9.073  -6.374  14.819
  867   HG11  VAL 115          HG11      VAL 115  11.329  -8.328  15.437
  868   HG12  VAL 115          HG12      VAL 115  11.450  -6.965  14.304
  869   HG13  VAL 115          HG13      VAL 115  11.165  -6.645  16.009
  870   HG21  VAL 115          HG21      VAL 115   9.607  -9.187  13.758
  871   HG22  VAL 115          HG22      VAL 115   8.150  -8.239  13.423
  872   HG23  VAL 115          HG23      VAL 115   9.714  -7.674  12.830
  873    H    GLU 116           H        GLU 116   8.333  -5.674  17.223
  874    HA   GLU 116           HA       GLU 116   9.915  -5.928  19.480
  875    HB2  GLU 116           HB2      GLU 116   7.664  -4.133  18.670
  876    HB3  GLU 116           HB3      GLU 116   8.115  -4.091  20.360
  877    HG2  GLU 116           HG2      GLU 116  10.105  -3.751  18.088
  878    HG3  GLU 116           HG3      GLU 116   9.320  -2.411  18.927
  879    H    GLU 117           H        GLU 117   6.998  -7.778  19.257
  880    HA   GLU 117           HA       GLU 117   6.638  -7.926  22.169
  881    HB2  GLU 117           HB2      GLU 117   5.740  -9.876  20.005
  882    HB3  GLU 117           HB3      GLU 117   5.346  -9.952  21.716
  883    HG2  GLU 117           HG2      GLU 117   4.373  -7.548  21.387
  884    HG3  GLU 117           HG3      GLU 117   4.394  -7.950  19.673
  885    H    ALA 118           H        ALA 118   8.867  -9.339  19.853
  886    HA   ALA 118           HA       ALA 118   9.755 -11.456  21.682
  887    HB1  ALA 118           HB1      ALA 118  10.788 -10.492  18.996
  888    HB2  ALA 118           HB2      ALA 118  11.468 -11.850  19.927
  889    HB3  ALA 118           HB3      ALA 118   9.800 -11.917  19.321
  890    H    GLN 119           H        GLN 119  11.462  -8.617  20.276
  891    HA   GLN 119           HA       GLN 119  13.334  -8.469  22.367
  892    HB2  GLN 119           HB2      GLN 119  12.636  -6.296  20.399
  893    HB3  GLN 119           HB3      GLN 119  14.044  -6.342  21.452
  894    HG2  GLN 119           HG2      GLN 119  14.805  -7.074  19.336
  895    HG3  GLN 119           HG3      GLN 119  14.738  -8.525  20.369
  896   HE21  GLN 119          HE22      GLN 119  12.779  -6.599  18.110
  897   HE22  GLN 119          HE21      GLN 119  11.708  -7.964  17.783
  Start of MODEL   18
    1    H    SER   1           H        SER   1  16.921  -6.196  15.610
    2    HA   SER   1           HA       SER   1  16.887  -3.481  15.277
    3    HB2  SER   1           HB2      SER   1  17.836  -4.589  17.242
    4    HB3  SER   1           HB3      SER   1  19.273  -4.989  16.286
    5    HG   SER   1           HG       SER   1  18.412  -2.480  17.258
    6    H    GLU   2           H        GLU   2  18.333  -1.831  14.557
    7    HA   GLU   2           HA       GLU   2  19.239  -0.617  12.938
    8    HB2  GLU   2           HB2      GLU   2  21.240  -2.018  13.336
    9    HB3  GLU   2           HB3      GLU   2  20.773  -3.053  11.978
   10    HG2  GLU   2           HG2      GLU   2  20.976  -1.188  10.425
   11    HG3  GLU   2           HG3      GLU   2  21.253  -0.057  11.754
   12    H    ALA   3           H        ALA   3  18.141  -3.747  11.513
   13    HA   ALA   3           HA       ALA   3  17.042  -2.448   9.139
   14    HB1  ALA   3           HB1      ALA   3  16.639  -5.235  10.297
   15    HB2  ALA   3           HB2      ALA   3  16.138  -4.683   8.686
   16    HB3  ALA   3           HB3      ALA   3  17.862  -4.761   9.093
   17    H    LEU   4           H        LEU   4  16.033  -2.583  12.369
   18    HA   LEU   4           HA       LEU   4  13.271  -3.099  12.277
   19    HB2  LEU   4           HB2      LEU   4  14.764  -2.965  14.310
   20    HB3  LEU   4           HB3      LEU   4  14.826  -1.226  14.111
   21    HG   LEU   4           HG       LEU   4  12.193  -1.338  14.355
   22   HD11  LEU   4          HD11      LEU   4  13.077  -3.893  15.764
   23   HD12  LEU   4          HD12      LEU   4  11.468  -3.152  15.869
   24   HD13  LEU   4          HD13      LEU   4  12.048  -3.827  14.320
   25   HD21  LEU   4          HD21      LEU   4  13.727  -0.266  15.958
   26   HD22  LEU   4          HD22      LEU   4  12.418  -1.122  16.763
   27   HD23  LEU   4          HD23      LEU   4  14.045  -1.843  16.720
   28    H    ALA   5           H        ALA   5  14.995  -0.007  11.569
   29    HA   ALA   5           HA       ALA   5  12.598   1.603  11.663
   30    HB1  ALA   5           HB1      ALA   5  14.106   3.335  10.790
   31    HB2  ALA   5           HB2      ALA   5  14.846   2.492  12.161
   32    HB3  ALA   5           HB3      ALA   5  15.371   2.121  10.500
   33    H    LYS   6           H        LYS   6  13.927  -0.601   9.181
   34    HA   LYS   6           HA       LYS   6  13.141   0.778   6.850
   35    HB2  LYS   6           HB2      LYS   6  14.676  -1.182   7.135
   36    HB3  LYS   6           HB3      LYS   6  13.262  -2.215   7.385
   37    HG2  LYS   6           HG2      LYS   6  12.467  -1.794   5.134
   38    HG3  LYS   6           HG3      LYS   6  13.669  -0.502   4.897
   39    HD2  LYS   6           HD2      LYS   6  15.501  -2.130   5.148
   40    HD3  LYS   6           HD3      LYS   6  14.331  -3.447   5.378
   41    HE2  LYS   6           HE2      LYS   6  13.469  -3.176   3.138
   42    HE3  LYS   6           HE3      LYS   6  14.359  -1.659   2.917
   43    HZ1  LYS   6           HZ1      LYS   6  16.388  -2.802   2.886
   44    HZ2  LYS   6           HZ2      LYS   6  15.752  -4.228   3.410
   45    HZ3  LYS   6           HZ3      LYS   6  15.392  -3.691   1.895
   46    H    LEU   7           H        LEU   7  11.285  -1.288   9.060
   47    HA   LEU   7           HA       LEU   7   9.002  -1.671   7.375
   48    HB2  LEU   7           HB2      LEU   7   9.448  -1.807  10.361
   49    HB3  LEU   7           HB3      LEU   7   7.882  -2.119   9.643
   50    HG   LEU   7           HG       LEU   7   9.075  -4.183  10.179
   51   HD11  LEU   7          HD11      LEU   7   8.784  -3.864   7.160
   52   HD12  LEU   7          HD12      LEU   7   8.741  -5.373   8.089
   53   HD13  LEU   7          HD13      LEU   7   7.464  -4.177   8.306
   54   HD21  LEU   7          HD21      LEU   7  11.414  -3.417   9.721
   55   HD22  LEU   7          HD22      LEU   7  10.997  -4.972   8.983
   56   HD23  LEU   7          HD23      LEU   7  11.050  -3.519   7.973
   57    H    ILE   8           H        ILE   8   9.664   0.818   9.863
   58    HA   ILE   8           HA       ILE   8   7.229   2.296   9.303
   59    HB   ILE   8           HB       ILE   8   9.766   3.182  10.697
   60   HG12  ILE   8          HG12      ILE   8   8.692   1.280  11.815
   61   HG13  ILE   8          HG13      ILE   8   8.600   2.744  12.778
   62   HG21  ILE   8          HG21      ILE   8   7.015   4.493  10.530
   63   HG22  ILE   8          HG22      ILE   8   8.264   4.930  11.718
   64   HG23  ILE   8          HG23      ILE   8   8.575   5.157   9.998
   65   HD11  ILE   8          HD11      ILE   8   6.309   1.507  11.178
   66   HD12  ILE   8          HD12      ILE   8   6.527   1.462  12.934
   67   HD13  ILE   8          HD13      ILE   8   6.203   3.005  12.138
   68    H    SER   9           H        SER   9  10.499   2.344   7.929
   69    HA   SER   9           HA       SER   9  10.294   4.925   6.636
   70    HB2  SER   9           HB2      SER   9  12.131   2.578   6.027
   71    HB3  SER   9           HB3      SER   9  12.324   4.233   5.447
   72    HG   SER   9           HG       SER   9  12.337   3.420   8.176
   73    H    LEU  10           H        LEU  10   9.419   1.631   5.749
   74    HA   LEU  10           HA       LEU  10   9.267   1.840   2.910
   75    HB2  LEU  10           HB2      LEU  10   8.236   0.036   5.105
   76    HB3  LEU  10           HB3      LEU  10   7.517  -0.136   3.525
   77    HG   LEU  10           HG       LEU  10  10.533  -0.266   3.801
   78   HD11  LEU  10          HD11      LEU  10   9.680  -1.928   5.373
   79   HD12  LEU  10          HD12      LEU  10   8.507  -2.523   4.178
   80   HD13  LEU  10          HD13      LEU  10  10.255  -2.741   3.923
   81   HD21  LEU  10          HD21      LEU  10   9.512  -0.140   1.522
   82   HD22  LEU  10          HD22      LEU  10  10.324  -1.676   1.801
   83   HD23  LEU  10          HD23      LEU  10   8.547  -1.584   1.888
   84    H    GLN  11           H        GLN  11   6.960   2.826   5.461
   85    HA   GLN  11           HA       GLN  11   4.667   2.587   3.682
   86    HB2  GLN  11           HB2      GLN  11   4.896   3.689   6.499
   87    HB3  GLN  11           HB3      GLN  11   3.403   3.546   5.551
   88    HG2  GLN  11           HG2      GLN  11   4.180   1.064   5.180
   89    HG3  GLN  11           HG3      GLN  11   5.152   1.316   6.631
   90   HE21  GLN  11          HE22      GLN  11   3.833   1.919   8.695
   91   HE22  GLN  11          HE21      GLN  11   2.175   1.330   8.685
   92    H    ALA  12           H        ALA  12   3.741   4.026   2.413
   93    HA   ALA  12           HA       ALA  12   5.067   6.528   1.882
   94    HB1  ALA  12           HB1      ALA  12   3.461   6.709   0.040
   95    HB2  ALA  12           HB2      ALA  12   4.197   5.098   0.112
   96    HB3  ALA  12           HB3      ALA  12   2.538   5.340   0.687
   97    H    THR  13           H        THR  13   4.094   8.602   1.750
   98    HA   THR  13           HA       THR  13   2.551   9.156   4.221
   99    HB   THR  13           HB       THR  13   4.332  11.078   2.722
  100    HG1  THR  13           HG1      THR  13   5.054   9.270   4.784
  101   HG21  THR  13          HG21      THR  13   4.756  11.911   5.066
  102   HG22  THR  13          HG22      THR  13   3.096  12.131   4.526
  103   HG23  THR  13          HG23      THR  13   3.481  10.807   5.637
  104    H    GLU  14           H        GLU  14   1.845   9.231   0.957
  105    HA   GLU  14           HA       GLU  14  -0.430  11.083   1.402
  106    HB2  GLU  14           HB2      GLU  14  -0.071  12.299  -0.636
  107    HB3  GLU  14           HB3      GLU  14   1.303  12.490   0.436
  108    HG2  GLU  14           HG2      GLU  14   1.195  10.617  -1.969
  109    HG3  GLU  14           HG3      GLU  14   1.886  12.234  -1.975
  110    H    ALA  15           H        ALA  15  -2.137  10.994  -0.241
  111    HA   ALA  15           HA       ALA  15  -2.246   8.510  -1.855
  112    HB1  ALA  15           HB1      ALA  15  -4.441   7.926  -0.868
  113    HB2  ALA  15           HB2      ALA  15  -3.165   7.925   0.364
  114    HB3  ALA  15           HB3      ALA  15  -4.303   9.286   0.264
  115    H    THR  16           H        THR  16  -3.870   8.501  -3.448
  116    HA   THR  16           HA       THR  16  -5.211  11.113  -4.090
  117    HB   THR  16           HB       THR  16  -4.268   9.023  -6.073
  118    HG1  THR  16           HG1      THR  16  -2.622  10.330  -5.179
  119   HG21  THR  16          HG21      THR  16  -5.609  11.745  -6.453
  120   HG22  THR  16          HG22      THR  16  -4.853  10.790  -7.750
  121   HG23  THR  16          HG23      THR  16  -6.280  10.166  -6.919
  122    H    ILE  17           H        ILE  17  -7.293  10.980  -3.501
  123    HA   ILE  17           HA       ILE  17  -8.714   8.366  -3.493
  124    HB   ILE  17           HB       ILE  17  -9.688  10.973  -2.278
  125   HG12  ILE  17          HG12      ILE  17  -7.794   8.956  -1.044
  126   HG13  ILE  17          HG13      ILE  17  -7.553  10.683  -1.257
  127   HG21  ILE  17          HG21      ILE  17 -10.349   8.049  -1.728
  128   HG22  ILE  17          HG22      ILE  17 -11.065   9.444  -0.887
  129   HG23  ILE  17          HG23      ILE  17 -11.382   9.208  -2.581
  130   HD11  ILE  17          HD11      ILE  17  -9.486   9.371   0.677
  131   HD12  ILE  17          HD12      ILE  17  -8.004  10.227   1.059
  132   HD13  ILE  17          HD13      ILE  17  -9.375  11.128   0.377
  133    H    VAL  18           H        VAL  18 -10.649   7.989  -4.737
  134    HA   VAL  18           HA       VAL  18 -11.561  10.255  -6.462
  135    HB   VAL  18           HB       VAL  18 -11.340   7.362  -7.314
  136   HG11  VAL  18          HG11      VAL  18 -11.736   8.371  -9.585
  137   HG12  VAL  18          HG12      VAL  18 -13.123   8.456  -8.497
  138   HG13  VAL  18          HG13      VAL  18 -12.138   9.899  -8.784
  139   HG21  VAL  18          HG21      VAL  18  -9.082   8.181  -7.117
  140   HG22  VAL  18          HG22      VAL  18  -9.523   8.156  -8.828
  141   HG23  VAL  18          HG23      VAL  18  -9.510   9.697  -7.945
  142    H    THR  19           H        THR  19 -13.573  10.754  -6.235
  143    HA   THR  19           HA       THR  19 -15.633   8.750  -5.359
  144    HB   THR  19           HB       THR  19 -15.522  11.598  -4.317
  145    HG1  THR  19           HG1      THR  19 -13.714  10.660  -3.517
  146   HG21  THR  19          HG21      THR  19 -17.698  10.445  -4.039
  147   HG22  THR  19          HG22      THR  19 -16.874   9.055  -3.296
  148   HG23  THR  19          HG23      THR  19 -16.889  10.633  -2.482
  149    H    LEU  20           H        LEU  20 -17.839   9.173  -6.030
  150    HA   LEU  20           HA       LEU  20 -18.025  10.907  -8.420
  151    HB2  LEU  20           HB2      LEU  20 -19.860   8.788  -7.251
  152    HB3  LEU  20           HB3      LEU  20 -20.286   9.781  -8.630
  153    HG   LEU  20           HG       LEU  20 -17.834   7.967  -8.568
  154   HD11  LEU  20          HD11      LEU  20 -19.201   6.410  -9.935
  155   HD12  LEU  20          HD12      LEU  20 -19.840   6.601  -8.300
  156   HD13  LEU  20          HD13      LEU  20 -20.635   7.428  -9.646
  157   HD21  LEU  20          HD21      LEU  20 -19.359   9.329 -10.834
  158   HD22  LEU  20          HD22      LEU  20 -17.760   9.774 -10.242
  159   HD23  LEU  20          HD23      LEU  20 -17.983   8.203 -11.023
  160    H    ASP  21           H        ASP  21 -19.359  12.540  -8.677
  161    HA   ASP  21           HA       ASP  21 -21.091  13.414  -6.377
  162    HB2  ASP  21           HB2      ASP  21 -18.989  14.941  -7.714
  163    HB3  ASP  21           HB3      ASP  21 -20.552  15.719  -7.903
  164    H    SER  22           H        SER  22 -21.084  12.264  -9.415
  165    HA   SER  22           HA       SER  22 -23.944  12.486  -9.673
  166    HB2  SER  22           HB2      SER  22 -22.341  13.463 -12.048
  167    HB3  SER  22           HB3      SER  22 -24.095  13.229 -11.960
  168    HG   SER  22           HG       SER  22 -23.586  15.354 -11.835
  169    H    ASP  23           H        ASP  23 -24.639  10.546 -10.459
  170    HA   ASP  23           HA       ASP  23 -23.162   8.347 -10.227
  171    HB2  ASP  23           HB2      ASP  23 -25.581   8.494 -10.098
  172    HB3  ASP  23           HB3      ASP  23 -25.688   8.632 -11.852
  173    H    ASN  24           H        ASN  24 -21.247   8.660 -11.359
  174    HA   ASN  24           HA       ASN  24 -19.615   7.852 -12.697
  175    HB2  ASN  24           HB2      ASN  24 -21.749   6.178 -14.086
  176    HB3  ASN  24           HB3      ASN  24 -20.026   6.037 -14.358
  177   HD21  ASN  24          HD22      ASN  24 -22.459   5.592 -11.839
  178   HD22  ASN  24          HD21      ASN  24 -21.484   4.287 -11.205
  179    H    ILE  25           H        ILE  25 -21.037  10.160 -13.080
  180    HA   ILE  25           HA       ILE  25 -20.530  10.842 -15.948
  181    HB   ILE  25           HB       ILE  25 -22.621  12.129 -16.114
  182   HG12  ILE  25          HG12      ILE  25 -23.455  10.762 -13.550
  183   HG13  ILE  25          HG13      ILE  25 -23.013  12.463 -13.752
  184   HG21  ILE  25          HG21      ILE  25 -22.330   9.799 -17.014
  185   HG22  ILE  25          HG22      ILE  25 -23.049   9.162 -15.529
  186   HG23  ILE  25          HG23      ILE  25 -24.005  10.180 -16.618
  187   HD11  ILE  25          HD11      ILE  25 -24.913  12.776 -15.299
  188   HD12  ILE  25          HD12      ILE  25 -25.407  11.095 -14.988
  189   HD13  ILE  25          HD13      ILE  25 -25.415  12.273 -13.675
  190    H    LEU  26           H        LEU  26 -20.565  11.905 -12.623
  191    HA   LEU  26           HA       LEU  26 -18.537  13.889 -13.502
  192    HB2  LEU  26           HB2      LEU  26 -20.593  15.100 -12.929
  193    HB3  LEU  26           HB3      LEU  26 -20.492  14.491 -11.269
  194    HG   LEU  26           HG       LEU  26 -17.959  15.706 -12.340
  195   HD11  LEU  26          HD11      LEU  26 -20.423  17.365 -11.766
  196   HD12  LEU  26          HD12      LEU  26 -18.762  17.991 -11.927
  197   HD13  LEU  26          HD13      LEU  26 -19.555  17.210 -13.319
  198   HD21  LEU  26          HD21      LEU  26 -19.494  16.237  -9.784
  199   HD22  LEU  26          HD22      LEU  26 -18.231  14.991  -9.946
  200   HD23  LEU  26          HD23      LEU  26 -17.820  16.699 -10.141
  201    H    LEU  27           H        LEU  27 -16.772  13.274 -12.848
  202    HA   LEU  27           HA       LEU  27 -16.332  11.792 -10.276
  203    HB2  LEU  27           HB2      LEU  27 -14.669  11.979 -12.806
  204    HB3  LEU  27           HB3      LEU  27 -13.975  11.497 -11.264
  205    HG   LEU  27           HG       LEU  27 -15.692   9.673 -11.075
  206   HD11  LEU  27          HD11      LEU  27 -16.192  10.342 -14.009
  207   HD12  LEU  27          HD12      LEU  27 -16.696   8.839 -13.210
  208   HD13  LEU  27          HD13      LEU  27 -17.402  10.376 -12.709
  209   HD21  LEU  27          HD21      LEU  27 -13.406   9.267 -11.747
  210   HD22  LEU  27          HD22      LEU  27 -14.507   8.181 -12.602
  211   HD23  LEU  27          HD23      LEU  27 -13.816   9.590 -13.451
  212    H    SER  28           H        SER  28 -14.993  12.429  -8.743
  213    HA   SER  28           HA       SER  28 -13.548  15.044  -8.898
  214    HB2  SER  28           HB2      SER  28 -15.615  15.614  -7.903
  215    HB3  SER  28           HB3      SER  28 -15.695  14.125  -6.972
  216    HG   SER  28           HG       SER  28 -15.168  15.789  -5.633
  217    H    GLU  29           H        GLU  29 -11.499  15.037  -7.895
  218    HA   GLU  29           HA       GLU  29 -10.766  12.558  -6.456
  219    HB2  GLU  29           HB2      GLU  29  -8.865  13.904  -8.373
  220    HB3  GLU  29           HB3      GLU  29  -8.708  12.372  -7.537
  221    HG2  GLU  29           HG2      GLU  29  -9.207  11.668  -9.670
  222    HG3  GLU  29           HG3      GLU  29 -10.776  11.598  -8.882
  223    H    GLU  30           H        GLU  30  -9.395  12.794  -4.757
  224    HA   GLU  30           HA       GLU  30  -8.457  15.545  -4.039
  225    HB2  GLU  30           HB2      GLU  30  -9.105  13.339  -2.058
  226    HB3  GLU  30           HB3      GLU  30  -8.659  14.999  -1.699
  227    HG2  GLU  30           HG2      GLU  30 -11.229  13.970  -2.891
  228    HG3  GLU  30           HG3      GLU  30 -11.016  14.726  -1.321
  229    H    GLN  31           H        GLN  31  -6.433  15.812  -3.219
  230    HA   GLN  31           HA       GLN  31  -4.613  13.438  -3.125
  231    HB2  GLN  31           HB2      GLN  31  -4.032  16.258  -4.130
  232    HB3  GLN  31           HB3      GLN  31  -2.789  15.022  -3.841
  233    HG2  GLN  31           HG2      GLN  31  -4.077  13.475  -5.340
  234    HG3  GLN  31           HG3      GLN  31  -5.052  14.877  -5.887
  235   HE21  GLN  31          HE22      GLN  31  -2.026  13.368  -5.483
  236   HE22  GLN  31          HE21      GLN  31  -1.170  14.680  -6.094
  237    H    VAL  32           H        VAL  32  -4.176  12.959  -1.085
  238    HA   VAL  32           HA       VAL  32  -4.296  15.116   0.974
  239    HB   VAL  32           HB       VAL  32  -5.592  13.746   2.409
  240   HG11  VAL  32          HG11      VAL  32  -6.916  13.541  -0.323
  241   HG12  VAL  32          HG12      VAL  32  -7.702  13.585   1.260
  242   HG13  VAL  32          HG13      VAL  32  -6.845  15.018   0.668
  243   HG21  VAL  32          HG21      VAL  32  -4.702  11.490   1.834
  244   HG22  VAL  32          HG22      VAL  32  -6.454  11.558   1.866
  245   HG23  VAL  32          HG23      VAL  32  -5.603  11.545   0.300
  246    H    ASP  33           H        ASP  33  -3.495  14.578   3.040
  247    HA   ASP  33           HA       ASP  33  -0.951  13.083   3.052
  248    HB2  ASP  33           HB2      ASP  33  -1.450  15.214   4.368
  249    HB3  ASP  33           HB3      ASP  33  -2.408  14.231   5.459
  250    H    VAL  34           H        VAL  34  -0.524  11.142   4.219
  251    HA   VAL  34           HA       VAL  34  -2.556   9.176   4.051
  252    HB   VAL  34           HB       VAL  34  -0.136   8.755   3.893
  253   HG11  VAL  34          HG11      VAL  34  -0.105   8.938   6.938
  254   HG12  VAL  34          HG12      VAL  34   1.232   8.445   5.894
  255   HG13  VAL  34          HG13      VAL  34   0.638  10.114   5.836
  256   HG21  VAL  34          HG21      VAL  34  -1.783   6.916   4.270
  257   HG22  VAL  34          HG22      VAL  34  -0.147   6.565   4.845
  258   HG23  VAL  34          HG23      VAL  34  -1.416   6.994   6.005
  259    H    GLU  35           H        GLU  35  -1.878  11.365   6.725
  260    HA   GLU  35           HA       GLU  35  -3.194   9.698   8.740
  261    HB2  GLU  35           HB2      GLU  35  -1.469  11.624   9.009
  262    HB3  GLU  35           HB3      GLU  35  -2.862  12.695   8.873
  263    HG2  GLU  35           HG2      GLU  35  -2.425  12.319  11.203
  264    HG3  GLU  35           HG3      GLU  35  -3.909  11.459  10.795
  265    H    LEU  36           H        LEU  36  -4.403  11.610   6.180
  266    HA   LEU  36           HA       LEU  36  -7.025  12.204   7.456
  267    HB2  LEU  36           HB2      LEU  36  -5.884  13.169   4.811
  268    HB3  LEU  36           HB3      LEU  36  -7.244  13.854   5.691
  269    HG   LEU  36           HG       LEU  36  -4.328  13.934   6.591
  270   HD11  LEU  36          HD11      LEU  36  -4.831  15.319   4.619
  271   HD12  LEU  36          HD12      LEU  36  -6.139  16.127   5.510
  272   HD13  LEU  36          HD13      LEU  36  -4.448  16.303   6.042
  273   HD21  LEU  36          HD21      LEU  36  -5.836  13.971   8.527
  274   HD22  LEU  36          HD22      LEU  36  -5.088  15.553   8.260
  275   HD23  LEU  36          HD23      LEU  36  -6.779  15.283   7.775
  276    H    VAL  37           H        VAL  37  -5.823   9.836   5.389
  277    HA   VAL  37           HA       VAL  37  -8.358   9.459   3.875
  278    HB   VAL  37           HB       VAL  37  -6.379   9.145   2.558
  279   HG11  VAL  37          HG11      VAL  37  -4.719   8.542   4.213
  280   HG12  VAL  37          HG12      VAL  37  -5.515   6.976   4.507
  281   HG13  VAL  37          HG13      VAL  37  -4.767   7.331   2.936
  282   HG21  VAL  37          HG21      VAL  37  -7.616   6.422   3.123
  283   HG22  VAL  37          HG22      VAL  37  -8.305   7.680   2.075
  284   HG23  VAL  37          HG23      VAL  37  -6.756   6.931   1.662
  285    H    GLN  38           H        GLN  38  -9.688   7.668   4.229
  286    HA   GLN  38           HA       GLN  38  -9.331   6.299   6.875
  287    HB2  GLN  38           HB2      GLN  38 -11.714   6.469   7.236
  288    HB3  GLN  38           HB3      GLN  38 -11.034   8.080   7.051
  289    HG2  GLN  38           HG2      GLN  38 -12.096   8.387   4.936
  290    HG3  GLN  38           HG3      GLN  38 -12.305   6.659   4.670
  291   HE21  GLN  38          HE22      GLN  38 -13.918   5.565   6.088
  292   HE22  GLN  38          HE21      GLN  38 -15.282   6.574   6.532
  293    H    ARG  39           H        ARG  39 -10.615   4.316   7.106
  294    HA   ARG  39           HA       ARG  39 -10.418   2.632   4.694
  295    HB2  ARG  39           HB2      ARG  39 -11.134   0.804   5.979
  296    HB3  ARG  39           HB3      ARG  39  -9.918   1.688   6.903
  297    HG2  ARG  39           HG2      ARG  39 -11.916   2.743   8.137
  298    HG3  ARG  39           HG3      ARG  39 -12.926   1.529   7.346
  299    HD2  ARG  39           HD2      ARG  39 -11.446  -0.287   8.244
  300    HD3  ARG  39           HD3      ARG  39 -10.479   0.931   9.074
  301    HE   ARG  39           HE       ARG  39 -12.114   1.185  10.706
  302   HH11  ARG  39          HH11      ARG  39 -13.520  -0.900   8.212
  303   HH12  ARG  39          HH12      ARG  39 -14.701  -1.517   9.354
  304   HH21  ARG  39          HH21      ARG  39 -13.656   0.476  11.952
  305   HH22  ARG  39          HH22      ARG  39 -14.967  -0.517  11.325
  306    H    GLY  40           H        GLY  40 -12.033   2.200   3.286
  307    HA2  GLY  40           HA2      GLY  40 -14.452   2.027   2.741
  308    HA3  GLY  40           HA3      GLY  40 -14.688   3.503   3.675
  309    H    ASP  41           H        ASP  41 -11.827   4.242   2.349
  310    HA   ASP  41           HA       ASP  41 -12.984   5.728   0.105
  311    HB2  ASP  41           HB2      ASP  41 -10.256   5.716   1.444
  312    HB3  ASP  41           HB3      ASP  41 -10.672   6.736   0.076
  313    H    ILE  42           H        ILE  42 -12.202   5.784  -2.026
  314    HA   ILE  42           HA       ILE  42 -10.836   3.314  -3.033
  315    HB   ILE  42           HB       ILE  42 -12.580   5.309  -4.492
  316   HG12  ILE  42          HG12      ILE  42 -13.946   3.931  -3.036
  317   HG13  ILE  42          HG13      ILE  42 -14.187   3.510  -4.720
  318   HG21  ILE  42          HG21      ILE  42 -11.139   2.815  -5.471
  319   HG22  ILE  42          HG22      ILE  42 -12.461   3.612  -6.356
  320   HG23  ILE  42          HG23      ILE  42 -10.960   4.485  -6.047
  321   HD11  ILE  42          HD11      ILE  42 -12.695   1.499  -4.393
  322   HD12  ILE  42          HD12      ILE  42 -12.643   1.911  -2.656
  323   HD13  ILE  42          HD13      ILE  42 -14.176   1.486  -3.431
  324    H    ILE  43           H        ILE  43  -8.686   3.569  -3.429
  325    HA   ILE  43           HA       ILE  43  -7.624   6.258  -4.035
  326    HB   ILE  43           HB       ILE  43  -6.141   3.835  -2.959
  327   HG12  ILE  43          HG12      ILE  43  -7.938   4.121  -1.369
  328   HG13  ILE  43          HG13      ILE  43  -6.392   4.562  -0.680
  329   HG21  ILE  43          HG21      ILE  43  -4.603   5.534  -2.018
  330   HG22  ILE  43          HG22      ILE  43  -4.715   5.639  -3.777
  331   HG23  ILE  43          HG23      ILE  43  -5.576   6.817  -2.771
  332   HD11  ILE  43          HD11      ILE  43  -8.407   6.599  -1.715
  333   HD12  ILE  43          HD12      ILE  43  -8.254   6.076  -0.031
  334   HD13  ILE  43          HD13      ILE  43  -6.905   6.920  -0.811
  335    H    LYS  44           H        LYS  44  -6.665   6.630  -5.989
  336    HA   LYS  44           HA       LYS  44  -5.914   4.357  -7.714
  337    HB2  LYS  44           HB2      LYS  44  -7.179   6.440  -8.443
  338    HB3  LYS  44           HB3      LYS  44  -5.615   7.267  -8.417
  339    HG2  LYS  44           HG2      LYS  44  -4.692   5.654 -10.018
  340    HG3  LYS  44           HG3      LYS  44  -6.154   4.659  -9.949
  341    HD2  LYS  44           HD2      LYS  44  -6.177   7.539 -10.849
  342    HD3  LYS  44           HD3      LYS  44  -5.871   6.191 -11.953
  343    HE2  LYS  44           HE2      LYS  44  -8.048   5.246 -11.611
  344    HE3  LYS  44           HE3      LYS  44  -8.395   6.326 -10.255
  345    HZ1  LYS  44           HZ1      LYS  44  -8.146   8.189 -11.923
  346    HZ2  LYS  44           HZ2      LYS  44  -8.131   7.063 -13.127
  347    HZ3  LYS  44           HZ3      LYS  44  -9.458   7.252 -12.191
  348    H    VAL  45           H        VAL  45  -3.938   3.654  -8.260
  349    HA   VAL  45           HA       VAL  45  -1.542   5.071  -7.193
  350    HB   VAL  45           HB       VAL  45  -2.289   3.058  -5.927
  351   HG11  VAL  45          HG11      VAL  45  -1.451   1.493  -8.388
  352   HG12  VAL  45          HG12      VAL  45  -1.868   0.836  -6.804
  353   HG13  VAL  45          HG13      VAL  45  -3.105   1.673  -7.738
  354   HG21  VAL  45          HG21      VAL  45   0.069   3.755  -5.815
  355   HG22  VAL  45          HG22      VAL  45  -0.088   1.992  -5.753
  356   HG23  VAL  45          HG23      VAL  45   0.443   2.776  -7.255
  357    H    VAL  46           H        VAL  46   0.128   5.428  -8.502
  358    HA   VAL  46           HA       VAL  46  -0.306   4.853 -11.388
  359    HB   VAL  46           HB       VAL  46   0.836   6.907 -11.829
  360   HG11  VAL  46          HG11      VAL  46  -1.017   7.406  -9.481
  361   HG12  VAL  46          HG12      VAL  46  -0.625   8.502 -10.813
  362   HG13  VAL  46          HG13      VAL  46  -1.543   7.024 -11.139
  363   HG21  VAL  46          HG21      VAL  46   1.438   7.155  -8.871
  364   HG22  VAL  46          HG22      VAL  46   2.632   6.833 -10.134
  365   HG23  VAL  46          HG23      VAL  46   1.761   8.370 -10.115
  366    HA   PRO  47           HA       PRO  47   3.598   2.819 -12.254
  367    HB2  PRO  47           HB2      PRO  47   4.310   5.255 -13.925
  368    HB3  PRO  47           HB3      PRO  47   4.579   3.528 -14.309
  369    HG2  PRO  47           HG2      PRO  47   2.460   4.773 -15.386
  370    HG3  PRO  47           HG3      PRO  47   2.209   3.172 -14.609
  371    HD2  PRO  47           HD2      PRO  47   1.713   5.917 -13.457
  372    HD3  PRO  47           HD3      PRO  47   0.629   4.491 -13.434
  373    H    GLY  48           H        GLY  48   5.512   2.686 -11.185
  374    HA2  GLY  48           HA2      GLY  48   7.329   3.242  -9.855
  375    HA3  GLY  48           HA3      GLY  48   7.103   4.934 -10.277
  376    H    GLY  49           H        GLY  49   4.158   4.355  -9.082
  377    HA2  GLY  49           HA2      GLY  49   4.689   5.795  -6.660
  378    HA3  GLY  49           HA3      GLY  49   3.132   5.171  -7.197
  379    H    LYS  50           H        LYS  50   3.850   5.245  -4.535
  380    HA   LYS  50           HA       LYS  50   4.377   2.388  -3.763
  381    HB2  LYS  50           HB2      LYS  50   4.624   4.988  -2.217
  382    HB3  LYS  50           HB3      LYS  50   4.779   3.372  -1.496
  383    HG2  LYS  50           HG2      LYS  50   6.720   2.867  -2.829
  384    HG3  LYS  50           HG3      LYS  50   6.600   4.405  -3.710
  385    HD2  LYS  50           HD2      LYS  50   7.015   5.686  -1.705
  386    HD3  LYS  50           HD3      LYS  50   6.887   4.242  -0.679
  387    HE2  LYS  50           HE2      LYS  50   8.903   3.293  -1.676
  388    HE3  LYS  50           HE3      LYS  50   9.051   4.663  -2.784
  389    HZ1  LYS  50           HZ1      LYS  50   9.022   5.002   0.176
  390    HZ2  LYS  50           HZ2      LYS  50  10.415   4.817  -0.653
  391    HZ3  LYS  50           HZ3      LYS  50   9.439   6.117  -0.931
  392    H    PHE  51           H        PHE  51   3.101   1.359  -2.224
  393    HA   PHE  51           HA       PHE  51   0.288   2.237  -2.087
  394    HB2  PHE  51           HB2      PHE  51   1.702  -0.281  -1.191
  395    HB3  PHE  51           HB3      PHE  51  -0.011   0.027  -0.937
  396    HD1  PHE  51           HD1      PHE  51  -1.611   0.044  -2.803
  397    HD2  PHE  51           HD2      PHE  51   2.569  -0.713  -3.485
  398    HE1  PHE  51           HE1      PHE  51  -2.105  -0.749  -5.098
  399    HE2  PHE  51           HE2      PHE  51   2.076  -1.468  -5.782
  400    HZ   PHE  51           HZ       PHE  51  -0.270  -1.486  -6.605
  401    HA   PRO  52           HA       PRO  52   1.255   3.976   2.006
  402    HB2  PRO  52           HB2      PRO  52  -0.907   5.574   2.372
  403    HB3  PRO  52           HB3      PRO  52   0.339   5.938   1.145
  404    HG2  PRO  52           HG2      PRO  52  -2.334   4.571   0.733
  405    HG3  PRO  52           HG3      PRO  52  -1.613   5.907  -0.217
  406    HD2  PRO  52           HD2      PRO  52  -1.450   3.267  -0.978
  407    HD3  PRO  52           HD3      PRO  52  -0.167   4.461  -1.339
  408    H    VAL  53           H        VAL  53  -1.248   1.744   1.377
  409    HA   VAL  53           HA       VAL  53  -1.608   0.912   4.092
  410    HB   VAL  53           HB       VAL  53  -4.114   0.966   4.036
  411   HG11  VAL  53          HG11      VAL  53  -2.882   3.737   4.208
  412   HG12  VAL  53          HG12      VAL  53  -4.359   3.148   4.993
  413   HG13  VAL  53          HG13      VAL  53  -2.786   2.497   5.478
  414   HG21  VAL  53          HG21      VAL  53  -3.754   3.164   1.970
  415   HG22  VAL  53          HG22      VAL  53  -4.388   1.535   1.625
  416   HG23  VAL  53          HG23      VAL  53  -5.272   2.628   2.712
  417    H    ASP  54           H        ASP  54  -3.259  -1.089   3.981
  418    HA   ASP  54           HA       ASP  54  -2.635  -2.518   1.428
  419    HB2  ASP  54           HB2      ASP  54  -2.576  -4.553   2.560
  420    HB3  ASP  54           HB3      ASP  54  -1.562  -3.430   3.456
  421    H    GLY  55           H        GLY  55  -4.153  -3.785   0.352
  422    HA2  GLY  55           HA2      GLY  55  -6.920  -4.001   1.060
  423    HA3  GLY  55           HA3      GLY  55  -6.686  -2.529   0.121
  424    H    ARG  56           H        ARG  56  -8.151  -3.518  -1.352
  425    HA   ARG  56           HA       ARG  56  -7.040  -5.710  -3.072
  426    HB2  ARG  56           HB2      ARG  56  -8.916  -6.409  -1.763
  427    HB3  ARG  56           HB3      ARG  56  -9.879  -5.033  -2.284
  428    HG2  ARG  56           HG2      ARG  56  -9.953  -5.902  -4.582
  429    HG3  ARG  56           HG3      ARG  56  -8.917  -7.270  -4.120
  430    HD2  ARG  56           HD2      ARG  56 -10.578  -8.127  -2.599
  431    HD3  ARG  56           HD3      ARG  56 -11.577  -6.683  -2.783
  432    HE   ARG  56           HE       ARG  56 -12.371  -7.411  -4.838
  433   HH11  ARG  56          HH11      ARG  56 -10.163  -9.883  -3.589
  434   HH12  ARG  56          HH12      ARG  56 -10.865 -11.039  -4.668
  435   HH21  ARG  56          HH21      ARG  56 -13.042  -8.938  -6.179
  436   HH22  ARG  56          HH22      ARG  56 -12.308 -10.532  -6.174
  437    H    VAL  57           H        VAL  57  -7.138  -5.650  -5.225
  438    HA   VAL  57           HA       VAL  57  -7.167  -2.991  -6.552
  439    HB   VAL  57           HB       VAL  57  -6.239  -5.715  -7.578
  440   HG11  VAL  57          HG11      VAL  57  -5.733  -2.889  -8.596
  441   HG12  VAL  57          HG12      VAL  57  -4.984  -4.373  -9.239
  442   HG13  VAL  57          HG13      VAL  57  -6.717  -4.139  -9.391
  443   HG21  VAL  57          HG21      VAL  57  -4.815  -5.093  -5.664
  444   HG22  VAL  57          HG22      VAL  57  -3.939  -5.029  -7.194
  445   HG23  VAL  57          HG23      VAL  57  -4.481  -3.527  -6.433
  446    H    ILE  58           H        ILE  58  -8.910  -2.468  -7.844
  447    HA   ILE  58           HA       ILE  58 -10.421  -4.669  -9.192
  448    HB   ILE  58           HB       ILE  58 -12.573  -3.356  -8.522
  449   HG12  ILE  58          HG12      ILE  58 -10.838  -2.600  -6.146
  450   HG13  ILE  58          HG13      ILE  58 -11.139  -1.467  -7.480
  451   HG21  ILE  58          HG21      ILE  58 -11.993  -5.662  -7.809
  452   HG22  ILE  58          HG22      ILE  58 -11.162  -4.987  -6.390
  453   HG23  ILE  58          HG23      ILE  58 -12.909  -4.758  -6.600
  454   HD11  ILE  58          HD11      ILE  58 -12.693  -0.979  -5.704
  455   HD12  ILE  58          HD12      ILE  58 -13.577  -1.618  -7.099
  456   HD13  ILE  58          HD13      ILE  58 -13.282  -2.654  -5.676
  457    H    GLU  59           H        GLU  59  -8.524  -2.631 -10.191
  458    HA   GLU  59           HA       GLU  59  -9.942  -2.375 -12.690
  459    HB2  GLU  59           HB2      GLU  59 -10.536  -0.170 -11.350
  460    HB3  GLU  59           HB3      GLU  59  -8.845   0.251 -11.635
  461    HG2  GLU  59           HG2      GLU  59  -9.260  -0.158 -14.118
  462    HG3  GLU  59           HG3      GLU  59 -10.971  -0.320 -13.736
  463    H    GLY  60           H        GLY  60  -8.382  -2.798 -14.247
  464    HA2  GLY  60           HA2      GLY  60  -6.431  -2.325 -15.421
  465    HA3  GLY  60           HA3      GLY  60  -5.816  -1.454 -14.027
  466    H    HIS  61           H        HIS  61  -3.882  -2.490 -14.878
  467    HA   HIS  61           HA       HIS  61  -3.219  -4.914 -13.397
  468    HB2  HIS  61           HB2      HIS  61  -2.414  -6.227 -15.298
  469    HB3  HIS  61           HB3      HIS  61  -4.151  -6.014 -15.280
  470    HD1  HIS  61           HD1      HIS  61  -5.221  -5.035 -17.459
  471    HD2  HIS  61           HD2      HIS  61  -1.022  -4.793 -17.240
  472    HE1  HIS  61           HE1      HIS  61  -4.408  -4.412 -19.804
  473    H    SER  62           H        SER  62  -1.310  -4.809 -12.660
  474    HA   SER  62           HA       SER  62   0.934  -3.390 -13.969
  475    HB2  SER  62           HB2      SER  62  -0.449  -1.827 -12.350
  476    HB3  SER  62           HB3      SER  62   0.495  -2.592 -11.092
  477    HG   SER  62           HG       SER  62   1.281  -0.648 -12.382
  478    H    MET  63           H        MET  63   3.045  -3.568 -12.623
  479    HA   MET  63           HA       MET  63   3.121  -6.251 -11.313
  480    HB2  MET  63           HB2      MET  63   4.152  -6.194 -13.513
  481    HB3  MET  63           HB3      MET  63   5.238  -4.897 -13.007
  482    HG2  MET  63           HG2      MET  63   6.383  -6.275 -11.494
  483    HG3  MET  63           HG3      MET  63   5.128  -7.520 -11.494
  484    HE1  MET  63           HE1      MET  63   4.399  -8.434 -14.221
  485    HE2  MET  63           HE2      MET  63   5.680  -9.612 -14.596
  486    HE3  MET  63           HE3      MET  63   5.025  -9.506 -12.948
  487    H    VAL  64           H        VAL  64   3.662  -6.283  -9.253
  488    HA   VAL  64           HA       VAL  64   4.664  -3.777  -7.980
  489    HB   VAL  64           HB       VAL  64   2.883  -5.948  -6.843
  490   HG11  VAL  64          HG11      VAL  64   3.920  -3.350  -5.618
  491   HG12  VAL  64          HG12      VAL  64   2.568  -4.282  -4.971
  492   HG13  VAL  64          HG13      VAL  64   4.179  -5.006  -5.016
  493   HG21  VAL  64          HG21      VAL  64   1.710  -4.507  -8.476
  494   HG22  VAL  64          HG22      VAL  64   1.177  -4.128  -6.834
  495   HG23  VAL  64          HG23      VAL  64   2.326  -3.058  -7.665
  496    H    ASP  65           H        ASP  65   6.286  -3.759  -6.547
  497    HA   ASP  65           HA       ASP  65   7.888  -6.255  -6.196
  498    HB2  ASP  65           HB2      ASP  65   9.002  -4.428  -7.416
  499    HB3  ASP  65           HB3      ASP  65   8.769  -3.356  -6.032
  500    H    GLU  66           H        GLU  66   7.484  -7.195  -4.386
  501    HA   GLU  66           HA       GLU  66   6.846  -5.708  -1.876
  502    HB2  GLU  66           HB2      GLU  66   5.145  -7.515  -1.472
  503    HB3  GLU  66           HB3      GLU  66   4.777  -6.363  -2.749
  504    HG2  GLU  66           HG2      GLU  66   5.344  -7.999  -4.480
  505    HG3  GLU  66           HG3      GLU  66   5.874  -9.156  -3.258
  506    H    SER  67           H        SER  67   9.258  -7.277  -2.967
  507    HA   SER  67           HA       SER  67   9.719  -9.655  -1.780
  508    HB2  SER  67           HB2      SER  67  12.097  -9.250  -2.008
  509    HB3  SER  67           HB3      SER  67  11.226  -8.580  -3.388
  510    HG   SER  67           HG       SER  67  12.920  -7.272  -2.368
  511    H    LEU  68           H        LEU  68   9.919  -6.656   0.117
  512    HA   LEU  68           HA       LEU  68  11.248  -8.030   2.382
  513    HB2  LEU  68           HB2      LEU  68  11.602  -5.612   1.642
  514    HB3  LEU  68           HB3      LEU  68   9.988  -5.256   2.209
  515    HG   LEU  68           HG       LEU  68  11.707  -4.440   3.670
  516   HD11  LEU  68          HD11      LEU  68  10.891  -5.069   5.790
  517   HD12  LEU  68          HD12      LEU  68   9.518  -5.179   4.679
  518   HD13  LEU  68          HD13      LEU  68  10.356  -6.650   5.228
  519   HD21  LEU  68          HD21      LEU  68  13.464  -6.105   3.308
  520   HD22  LEU  68          HD22      LEU  68  13.160  -5.774   5.026
  521   HD23  LEU  68          HD23      LEU  68  12.547  -7.274   4.288
  522    H    ILE  69           H        ILE  69   8.011  -7.193   1.319
  523    HA   ILE  69           HA       ILE  69   6.805  -7.575   3.969
  524    HB   ILE  69           HB       ILE  69   5.239  -7.351   1.387
  525   HG12  ILE  69          HG12      ILE  69   6.625  -5.415   1.230
  526   HG13  ILE  69          HG13      ILE  69   5.026  -4.929   1.752
  527   HG21  ILE  69          HG21      ILE  69   4.674  -6.780   4.332
  528   HG22  ILE  69          HG22      ILE  69   3.592  -6.319   3.018
  529   HG23  ILE  69          HG23      ILE  69   3.940  -8.026   3.305
  530   HD11  ILE  69          HD11      ILE  69   7.545  -5.019   3.424
  531   HD12  ILE  69          HD12      ILE  69   6.526  -3.622   3.004
  532   HD13  ILE  69          HD13      ILE  69   5.930  -4.852   4.135
  533    H    THR  70           H        THR  70   6.348  -9.254   0.796
  534    HA   THR  70           HA       THR  70   5.263 -11.614   2.190
  535    HB   THR  70           HB       THR  70   4.697 -12.331  -0.163
  536    HG1  THR  70           HG1      THR  70   4.725 -10.462  -1.619
  537   HG21  THR  70          HG21      THR  70   3.118 -11.084   1.352
  538   HG22  THR  70          HG22      THR  70   3.662  -9.569   0.592
  539   HG23  THR  70          HG23      THR  70   2.845 -10.820  -0.373
  540    H    GLY  71           H        GLY  71   8.274 -10.722   1.247
  541    HA2  GLY  71           HA2      GLY  71  10.287 -11.888   1.706
  542    HA3  GLY  71           HA3      GLY  71   9.364 -13.370   1.998
  543    H    GLU  72           H        GLU  72   8.830 -11.595  -0.891
  544    HA   GLU  72           HA       GLU  72   9.716 -13.758  -2.675
  545    HB2  GLU  72           HB2      GLU  72   8.514 -10.995  -3.143
  546    HB3  GLU  72           HB3      GLU  72   8.852 -12.130  -4.433
  547    HG2  GLU  72           HG2      GLU  72   6.926 -12.619  -2.123
  548    HG3  GLU  72           HG3      GLU  72   6.475 -12.149  -3.757
  549    H    ALA  73           H        ALA  73  10.726 -12.383  -4.801
  550    HA   ALA  73           HA       ALA  73  13.029 -10.742  -4.092
  551    HB1  ALA  73           HB1      ALA  73  13.939 -13.041  -3.725
  552    HB2  ALA  73           HB2      ALA  73  13.484 -13.469  -5.388
  553    HB3  ALA  73           HB3      ALA  73  14.714 -12.225  -5.091
  554    H    MET  74           H        MET  74  11.170 -12.553  -6.515
  555    HA   MET  74           HA       MET  74  11.804 -10.693  -8.719
  556    HB2  MET  74           HB2      MET  74   9.820 -12.984  -8.526
  557    HB3  MET  74           HB3      MET  74  10.240 -12.095  -9.991
  558    HG2  MET  74           HG2      MET  74  12.145 -13.810  -8.345
  559    HG3  MET  74           HG3      MET  74  11.365 -14.286  -9.845
  560    HE1  MET  74           HE1      MET  74  15.197 -13.965 -10.735
  561    HE2  MET  74           HE2      MET  74  14.543 -14.406  -9.142
  562    HE3  MET  74           HE3      MET  74  13.805 -15.065 -10.621
  563    HA   PRO  75           HA       PRO  75   8.083  -8.190  -8.007
  564    HB2  PRO  75           HB2      PRO  75   7.961  -8.086 -11.002
  565    HB3  PRO  75           HB3      PRO  75   7.873  -6.734  -9.820
  566    HG2  PRO  75           HG2      PRO  75  10.137  -7.179 -11.241
  567    HG3  PRO  75           HG3      PRO  75  10.235  -6.800  -9.487
  568    HD2  PRO  75           HD2      PRO  75  10.396  -9.537 -10.812
  569    HD3  PRO  75           HD3      PRO  75  11.412  -8.813  -9.536
  570    H    VAL  76           H        VAL  76   5.782  -8.266  -8.369
  571    HA   VAL  76           HA       VAL  76   4.691 -10.894  -9.337
  572    HB   VAL  76           HB       VAL  76   3.880  -9.184  -6.952
  573   HG11  VAL  76          HG11      VAL  76   1.882 -10.271  -7.881
  574   HG12  VAL  76          HG12      VAL  76   2.735 -11.831  -7.945
  575   HG13  VAL  76          HG13      VAL  76   2.363 -11.063  -6.387
  576   HG21  VAL  76          HG21      VAL  76   5.956 -10.461  -6.529
  577   HG22  VAL  76          HG22      VAL  76   4.611 -11.121  -5.603
  578   HG23  VAL  76          HG23      VAL  76   5.160 -11.952  -7.075
  579    H    ALA  77           H        ALA  77   3.106 -10.835 -10.834
  580    HA   ALA  77           HA       ALA  77   2.004  -8.328 -11.774
  581    HB1  ALA  77           HB1      ALA  77   1.367 -11.220 -12.482
  582    HB2  ALA  77           HB2      ALA  77   0.849  -9.791 -13.395
  583    HB3  ALA  77           HB3      ALA  77   2.574 -10.184 -13.275
  584    H    LYS  78           H        LYS  78   0.191  -7.328 -11.281
  585    HA   LYS  78           HA       LYS  78  -2.009  -8.665  -9.726
  586    HB2  LYS  78           HB2      LYS  78  -1.366  -5.701  -9.913
  587    HB3  LYS  78           HB3      LYS  78  -2.553  -6.449  -8.863
  588    HG2  LYS  78           HG2      LYS  78   0.480  -6.690  -8.656
  589    HG3  LYS  78           HG3      LYS  78  -0.569  -5.713  -7.643
  590    HD2  LYS  78           HD2      LYS  78  -1.642  -7.704  -6.700
  591    HD3  LYS  78           HD3      LYS  78  -0.636  -8.758  -7.715
  592    HE2  LYS  78           HE2      LYS  78   1.395  -8.022  -6.596
  593    HE3  LYS  78           HE3      LYS  78   0.514  -6.770  -5.714
  594    HZ1  LYS  78           HZ1      LYS  78   0.078  -9.687  -5.303
  595    HZ2  LYS  78           HZ2      LYS  78   0.948  -8.687  -4.323
  596    HZ3  LYS  78           HZ3      LYS  78  -0.674  -8.476  -4.509
  597    H    LYS  79           H        LYS  79  -4.214  -8.127 -10.284
  598    HA   LYS  79           HA       LYS  79  -4.847  -7.032 -12.962
  599    HB2  LYS  79           HB2      LYS  79  -4.997  -9.908 -11.989
  600    HB3  LYS  79           HB3      LYS  79  -6.349  -9.331 -12.925
  601    HG2  LYS  79           HG2      LYS  79  -4.687  -8.528 -14.690
  602    HG3  LYS  79           HG3      LYS  79  -3.442  -9.397 -13.800
  603    HD2  LYS  79           HD2      LYS  79  -5.946 -10.604 -15.073
  604    HD3  LYS  79           HD3      LYS  79  -4.302 -10.682 -15.718
  605    HE2  LYS  79           HE2      LYS  79  -3.617 -11.908 -13.599
  606    HE3  LYS  79           HE3      LYS  79  -5.323 -11.973 -13.156
  607    HZ1  LYS  79           HZ1      LYS  79  -4.669 -13.988 -14.273
  608    HZ2  LYS  79           HZ2      LYS  79  -5.709 -13.179 -15.285
  609    HZ3  LYS  79           HZ3      LYS  79  -4.091 -13.197 -15.579
  610    HA   PRO  80           HA       PRO  80  -8.552  -5.858 -10.651
  611    HB2  PRO  80           HB2      PRO  80 -10.764  -6.554 -12.104
  612    HB3  PRO  80           HB3      PRO  80  -9.679  -5.202 -12.555
  613    HG2  PRO  80           HG2      PRO  80  -9.660  -8.038 -13.630
  614    HG3  PRO  80           HG3      PRO  80  -9.613  -6.508 -14.556
  615    HD2  PRO  80           HD2      PRO  80  -7.352  -7.889 -14.010
  616    HD3  PRO  80           HD3      PRO  80  -7.375  -6.117 -13.990
  617    H    GLY  81           H        GLY  81  -9.360  -6.811  -8.869
  618    HA2  GLY  81           HA2      GLY  81 -10.268  -8.447  -7.477
  619    HA3  GLY  81           HA3      GLY  81 -10.103  -9.675  -8.728
  620    H    SER  82           H        SER  82  -7.401  -7.550  -7.675
  621    HA   SER  82           HA       SER  82  -5.945  -9.964  -6.620
  622    HB2  SER  82           HB2      SER  82  -4.862  -7.517  -8.057
  623    HB3  SER  82           HB3      SER  82  -3.871  -8.740  -7.275
  624    HG   SER  82           HG       SER  82  -4.988 -10.304  -8.697
  625    H    THR  83           H        THR  83  -4.054  -9.117  -4.952
  626    HA   THR  83           HA       THR  83  -5.217  -6.926  -3.297
  627    HB   THR  83           HB       THR  83  -4.743  -8.171  -1.275
  628    HG1  THR  83           HG1      THR  83  -3.482  -9.776  -1.441
  629   HG21  THR  83          HG21      THR  83  -7.025  -8.331  -2.246
  630   HG22  THR  83          HG22      THR  83  -6.534  -9.793  -3.133
  631   HG23  THR  83          HG23      THR  83  -6.550  -9.796  -1.364
  632    H    VAL  84           H        VAL  84  -3.858  -5.761  -2.021
  633    HA   VAL  84           HA       VAL  84  -0.936  -5.981  -2.586
  634    HB   VAL  84           HB       VAL  84  -0.939  -3.476  -2.863
  635   HG11  VAL  84          HG11      VAL  84  -2.443  -5.088  -4.961
  636   HG12  VAL  84          HG12      VAL  84  -1.618  -3.541  -5.229
  637   HG13  VAL  84          HG13      VAL  84  -0.684  -4.973  -4.774
  638   HG21  VAL  84          HG21      VAL  84  -3.206  -3.002  -1.920
  639   HG22  VAL  84          HG22      VAL  84  -2.985  -2.339  -3.540
  640   HG23  VAL  84          HG23      VAL  84  -3.940  -3.810  -3.322
  641    H    ILE  85           H        ILE  85   0.458  -5.101  -1.155
  642    HA   ILE  85           HA       ILE  85  -0.615  -4.417   1.534
  643    HB   ILE  85           HB       ILE  85   1.942  -5.158   2.097
  644   HG12  ILE  85          HG12      ILE  85   2.289  -7.444   1.214
  645   HG13  ILE  85          HG13      ILE  85   0.971  -7.218   0.069
  646   HG21  ILE  85          HG21      ILE  85  -0.504  -6.943   2.168
  647   HG22  ILE  85          HG22      ILE  85   0.967  -7.109   3.156
  648   HG23  ILE  85          HG23      ILE  85  -0.075  -5.701   3.371
  649   HD11  ILE  85          HD11      ILE  85   3.035  -6.868  -1.077
  650   HD12  ILE  85          HD12      ILE  85   2.314  -5.264  -0.906
  651   HD13  ILE  85          HD13      ILE  85   3.635  -5.745   0.165
  652    H    ALA  86           H        ALA  86   0.344  -2.918   2.824
  653    HA   ALA  86           HA       ALA  86   1.130  -0.549   1.508
  654    HB1  ALA  86           HB1      ALA  86   1.470  -1.254   4.455
  655    HB2  ALA  86           HB2      ALA  86   1.324   0.369   3.748
  656    HB3  ALA  86           HB3      ALA  86  -0.058  -0.738   3.724
  657    H    GLY  87           H        GLY  87   3.023   0.520   1.299
  658    HA2  GLY  87           HA2      GLY  87   5.257   1.026   1.413
  659    HA3  GLY  87           HA3      GLY  87   5.567  -0.406   2.416
  660    H    SER  88           H        SER  88   3.909  -1.445  -0.316
  661    HA   SER  88           HA       SER  88   6.379  -2.382  -1.644
  662    HB2  SER  88           HB2      SER  88   4.917  -3.755  -3.001
  663    HB3  SER  88           HB3      SER  88   4.625  -4.034  -1.284
  664    HG   SER  88           HG       SER  88   2.683  -2.958  -1.440
  665    H    ILE  89           H        ILE  89   6.557  -2.150  -3.978
  666    HA   ILE  89           HA       ILE  89   5.762   0.612  -4.823
  667    HB   ILE  89           HB       ILE  89   8.137  -0.661  -6.074
  668   HG12  ILE  89          HG12      ILE  89   8.632  -1.304  -3.779
  669   HG13  ILE  89          HG13      ILE  89   9.740  -0.114  -4.421
  670   HG21  ILE  89          HG21      ILE  89   7.599   2.153  -5.022
  671   HG22  ILE  89          HG22      ILE  89   8.952   1.626  -6.038
  672   HG23  ILE  89          HG23      ILE  89   7.313   1.595  -6.683
  673   HD11  ILE  89          HD11      ILE  89   8.811   1.647  -3.074
  674   HD12  ILE  89          HD12      ILE  89   7.472   0.613  -2.526
  675   HD13  ILE  89          HD13      ILE  89   9.132   0.251  -2.035
  676    H    ASN  90           H        ASN  90   4.933   1.006  -6.808
  677    HA   ASN  90           HA       ASN  90   4.054  -1.281  -8.458
  678    HB2  ASN  90           HB2      ASN  90   2.625   0.684  -7.512
  679    HB3  ASN  90           HB3      ASN  90   3.365   1.662  -8.771
  680   HD21  ASN  90          HD22      ASN  90   1.624   1.966 -10.114
  681   HD22  ASN  90          HD21      ASN  90   0.666   0.670 -10.820
  682    H    GLN  91           H        GLN  91   4.558  -1.554 -10.700
  683    HA   GLN  91           HA       GLN  91   7.001  -0.185 -11.606
  684    HB2  GLN  91           HB2      GLN  91   6.942  -2.633 -11.603
  685    HB3  GLN  91           HB3      GLN  91   5.588  -2.599 -12.709
  686    HG2  GLN  91           HG2      GLN  91   7.362  -3.051 -14.117
  687    HG3  GLN  91           HG3      GLN  91   7.245  -1.309 -14.315
  688   HE21  GLN  91          HE22      GLN  91   8.828   0.012 -12.737
  689   HE22  GLN  91          HE21      GLN  91  10.384  -0.758 -12.525
  690    H    ASN  92           H        ASN  92   4.621  -1.338 -13.971
  691    HA   ASN  92           HA       ASN  92   3.726   1.400 -14.598
  692    HB2  ASN  92           HB2      ASN  92   5.677   0.802 -16.106
  693    HB3  ASN  92           HB3      ASN  92   4.698  -0.509 -16.764
  694   HD21  ASN  92          HD22      ASN  92   2.782   0.038 -18.074
  695   HD22  ASN  92          HD21      ASN  92   2.536   1.697 -18.587
  696    H    GLY  93           H        GLY  93   1.437   1.374 -15.437
  697    HA2  GLY  93           HA2      GLY  93  -0.421   0.052 -15.859
  698    HA3  GLY  93           HA3      GLY  93   0.122  -1.132 -14.657
  699    H    SER  94           H        SER  94  -1.873   1.494 -15.158
  700    HA   SER  94           HA       SER  94  -1.689   2.657 -12.456
  701    HB2  SER  94           HB2      SER  94  -3.538   3.378 -14.745
  702    HB3  SER  94           HB3      SER  94  -3.194   4.332 -13.289
  703    HG   SER  94           HG       SER  94  -2.038   5.036 -15.093
  704    H    LEU  95           H        LEU  95  -2.824   1.829 -10.809
  705    HA   LEU  95           HA       LEU  95  -5.192   0.083 -11.398
  706    HB2  LEU  95           HB2      LEU  95  -3.111   0.013  -9.216
  707    HB3  LEU  95           HB3      LEU  95  -4.511  -1.042  -9.253
  708    HG   LEU  95           HG       LEU  95  -2.177  -0.975 -11.209
  709   HD11  LEU  95          HD11      LEU  95  -1.619  -3.163 -10.161
  710   HD12  LEU  95          HD12      LEU  95  -1.542  -1.833  -9.001
  711   HD13  LEU  95          HD13      LEU  95  -2.938  -2.936  -8.996
  712   HD21  LEU  95          HD21      LEU  95  -3.172  -3.164 -11.936
  713   HD22  LEU  95          HD22      LEU  95  -4.625  -2.771 -11.015
  714   HD23  LEU  95          HD23      LEU  95  -4.135  -1.728 -12.360
  715    H    LEU  96           H        LEU  96  -6.923   0.014  -9.974
  716    HA   LEU  96           HA       LEU  96  -7.193   2.362  -8.147
  717    HB2  LEU  96           HB2      LEU  96  -8.598   2.222 -10.318
  718    HB3  LEU  96           HB3      LEU  96  -9.494   0.942  -9.494
  719    HG   LEU  96           HG       LEU  96 -10.222   2.528  -7.776
  720   HD11  LEU  96          HD11      LEU  96  -9.771   5.000  -8.158
  721   HD12  LEU  96          HD12      LEU  96  -8.426   4.056  -7.520
  722   HD13  LEU  96          HD13      LEU  96  -8.458   4.482  -9.245
  723   HD21  LEU  96          HD21      LEU  96 -11.498   2.333  -9.903
  724   HD22  LEU  96          HD22      LEU  96 -11.619   3.954  -9.206
  725   HD23  LEU  96          HD23      LEU  96 -10.540   3.665 -10.589
  726    H    ILE  97           H        ILE  97  -7.222   1.901  -6.095
  727    HA   ILE  97           HA       ILE  97  -7.636  -0.898  -5.202
  728    HB   ILE  97           HB       ILE  97  -6.189   1.299  -3.711
  729   HG12  ILE  97          HG12      ILE  97  -5.042   1.341  -5.825
  730   HG13  ILE  97          HG13      ILE  97  -4.043   0.662  -4.563
  731   HG21  ILE  97          HG21      ILE  97  -5.934  -1.732  -3.650
  732   HG22  ILE  97          HG22      ILE  97  -4.970  -0.593  -2.686
  733   HG23  ILE  97          HG23      ILE  97  -6.714  -0.712  -2.431
  734   HD11  ILE  97          HD11      ILE  97  -5.525  -0.995  -6.648
  735   HD12  ILE  97          HD12      ILE  97  -3.809  -0.538  -6.705
  736   HD13  ILE  97          HD13      ILE  97  -4.395  -1.590  -5.406
  737    H    CYS  98           H        CYS  98  -9.287  -1.368  -3.736
  738    HA   CYS  98           HA       CYS  98 -10.652   0.920  -2.403
  739    HB2  CYS  98           HB2      CYS  98 -12.313  -0.695  -1.654
  740    HB3  CYS  98           HB3      CYS  98 -12.156  -0.622  -3.411
  741    HG   CYS  98           HG       CYS  98 -12.688  -3.054  -2.767
  742    H    ALA  99           H        ALA  99  -9.918   1.691  -0.523
  743    HA   ALA  99           HA       ALA  99  -8.020   0.088   1.032
  744    HB1  ALA  99           HB1      ALA  99  -7.500   2.421   0.505
  745    HB2  ALA  99           HB2      ALA  99  -9.001   2.960   1.296
  746    HB3  ALA  99           HB3      ALA  99  -7.712   2.209   2.256
  747    H    THR 100           H        THR 100  -8.657  -1.158   2.632
  748    HA   THR 100           HA       THR 100 -11.105  -0.436   4.195
  749    HB   THR 100           HB       THR 100 -11.426  -2.304   2.614
  750    HG1  THR 100           HG1      THR 100 -12.542  -3.490   4.160
  751   HG21  THR 100          HG21      THR 100 -10.626  -4.493   3.111
  752   HG22  THR 100          HG22      THR 100  -9.204  -3.453   2.991
  753   HG23  THR 100          HG23      THR 100  -9.809  -3.948   4.593
  754    H    HIS 101           H        HIS 101  -7.888  -0.265   4.610
  755    HA   HIS 101           HA       HIS 101  -8.125  -0.807   7.509
  756    HB2  HIS 101           HB2      HIS 101  -5.688  -1.269   5.752
  757    HB3  HIS 101           HB3      HIS 101  -5.854  -1.636   7.460
  758    HD1  HIS 101           HD1      HIS 101  -6.251  -3.170   4.123
  759    HD2  HIS 101           HD2      HIS 101  -7.645  -3.755   8.051
  760    HE1  HIS 101           HE1      HIS 101  -7.053  -5.588   4.239
  761    H    VAL 102           H        VAL 102  -7.344   0.771   8.778
  762    HA   VAL 102           HA       VAL 102  -6.015   3.135   7.562
  763    HB   VAL 102           HB       VAL 102  -8.108   3.300   8.949
  764   HG11  VAL 102          HG11      VAL 102  -6.273   2.739  11.308
  765   HG12  VAL 102          HG12      VAL 102  -7.972   3.245  11.362
  766   HG13  VAL 102          HG13      VAL 102  -7.558   1.670  10.695
  767   HG21  VAL 102          HG21      VAL 102  -5.800   4.954  10.012
  768   HG22  VAL 102          HG22      VAL 102  -6.738   5.259   8.526
  769   HG23  VAL 102          HG23      VAL 102  -7.527   5.317  10.103
  770    H    GLY 103           H        GLY 103  -4.225   4.205   9.328
  771    HA2  GLY 103           HA2      GLY 103  -2.011   2.566   8.725
  772    HA3  GLY 103           HA3      GLY 103  -2.026   4.014   9.716
  773    H    ALA 104           H        ALA 104  -3.862   2.842  11.789
  774    HA   ALA 104           HA       ALA 104  -1.972   1.542  13.482
  775    HB1  ALA 104           HB1      ALA 104  -5.021   1.618  13.597
  776    HB2  ALA 104           HB2      ALA 104  -3.936   1.207  14.945
  777    HB3  ALA 104           HB3      ALA 104  -3.918   2.839  14.272
  778    H    ASP 105           H        ASP 105  -4.078   0.157  11.047
  779    HA   ASP 105           HA       ASP 105  -4.041  -2.596  12.127
  780    HB2  ASP 105           HB2      ASP 105  -5.972  -1.723  10.870
  781    HB3  ASP 105           HB3      ASP 105  -4.943  -1.514   9.451
  782    H    THR 106           H        THR 106  -1.740  -0.694  10.435
  783    HA   THR 106           HA       THR 106  -1.160  -2.471   8.277
  784    HB   THR 106           HB       THR 106   0.853  -1.105   7.870
  785    HG1  THR 106           HG1      THR 106  -0.061   0.591   9.926
  786   HG21  THR 106          HG21      THR 106  -1.793   0.345   8.290
  787   HG22  THR 106          HG22      THR 106  -0.408   1.028   7.417
  788   HG23  THR 106          HG23      THR 106  -1.197  -0.439   6.820
  789    H    THR 107           H        THR 107   0.013  -4.231   8.095
  790    HA   THR 107           HA       THR 107   0.980  -5.562  10.400
  791    HB   THR 107           HB       THR 107   0.202  -6.729   8.415
  792    HG1  THR 107           HG1      THR 107   1.521  -7.883   9.805
  793   HG21  THR 107          HG21      THR 107   2.893  -6.269   7.104
  794   HG22  THR 107          HG22      THR 107   1.460  -7.064   6.441
  795   HG23  THR 107          HG23      THR 107   1.457  -5.310   6.663
  796    H    LEU 108           H        LEU 108   2.798  -3.617   8.053
  797    HA   LEU 108           HA       LEU 108   5.422  -4.139   8.893
  798    HB2  LEU 108           HB2      LEU 108   4.081  -1.590   7.890
  799    HB3  LEU 108           HB3      LEU 108   5.806  -1.698   8.188
  800    HG   LEU 108           HG       LEU 108   6.118  -3.340   6.427
  801   HD11  LEU 108          HD11      LEU 108   3.091  -3.160   6.089
  802   HD12  LEU 108          HD12      LEU 108   4.167  -3.717   4.809
  803   HD13  LEU 108          HD13      LEU 108   4.111  -4.624   6.321
  804   HD21  LEU 108          HD21      LEU 108   4.309  -1.093   5.521
  805   HD22  LEU 108          HD22      LEU 108   6.024  -0.874   5.966
  806   HD23  LEU 108          HD23      LEU 108   5.589  -1.871   4.562
  807    H    SER 109           H        SER 109   3.196  -1.632  10.194
  808    HA   SER 109           HA       SER 109   5.053  -0.795  12.264
  809    HB2  SER 109           HB2      SER 109   3.255   0.554  13.124
  810    HB3  SER 109           HB3      SER 109   3.348   0.745  11.369
  811    HG   SER 109           HG       SER 109   1.484  -0.371  11.130
  812    H    GLN 110           H        GLN 110   2.590  -3.288  12.034
  813    HA   GLN 110           HA       GLN 110   2.357  -3.700  14.905
  814    HB2  GLN 110           HB2      GLN 110   0.624  -4.368  13.216
  815    HB3  GLN 110           HB3      GLN 110   1.694  -5.631  12.655
  816    HG2  GLN 110           HG2      GLN 110   0.112  -6.613  14.149
  817    HG3  GLN 110           HG3      GLN 110   1.693  -6.666  14.936
  818   HE21  GLN 110          HE22      GLN 110  -1.219  -4.537  14.651
  819   HE22  GLN 110          HE21      GLN 110  -0.977  -3.825  16.242
  820    H    ILE 111           H        ILE 111   4.284  -5.269  12.347
  821    HA   ILE 111           HA       ILE 111   5.502  -7.323  13.819
  822    HB   ILE 111           HB       ILE 111   6.441  -5.666  11.458
  823   HG12  ILE 111          HG12      ILE 111   5.644  -8.608  11.559
  824   HG13  ILE 111          HG13      ILE 111   4.446  -7.339  11.375
  825   HG21  ILE 111          HG21      ILE 111   7.854  -8.115  12.609
  826   HG22  ILE 111          HG22      ILE 111   8.203  -7.382  11.035
  827   HG23  ILE 111          HG23      ILE 111   8.518  -6.468  12.498
  828   HD11  ILE 111          HD11      ILE 111   6.718  -7.912   9.433
  829   HD12  ILE 111          HD12      ILE 111   4.986  -8.187   9.193
  830   HD13  ILE 111          HD13      ILE 111   5.603  -6.530   9.314
  831    H    VAL 112           H        VAL 112   6.870  -4.019  13.311
  832    HA   VAL 112           HA       VAL 112   9.017  -4.414  15.133
  833    HB   VAL 112           HB       VAL 112   9.413  -2.023  15.010
  834   HG11  VAL 112          HG11      VAL 112  10.071  -3.548  13.129
  835   HG12  VAL 112          HG12      VAL 112   8.572  -3.097  12.290
  836   HG13  VAL 112          HG13      VAL 112   9.802  -1.867  12.646
  837   HG21  VAL 112          HG21      VAL 112   7.094  -1.133  15.062
  838   HG22  VAL 112          HG22      VAL 112   8.009  -0.521  13.683
  839   HG23  VAL 112          HG23      VAL 112   6.810  -1.804  13.441
  840    H    LYS 113           H        LYS 113   5.716  -3.512  15.843
  841    HA   LYS 113           HA       LYS 113   6.294  -2.651  18.608
  842    HB2  LYS 113           HB2      LYS 113   3.742  -3.257  17.117
  843    HB3  LYS 113           HB3      LYS 113   3.797  -2.908  18.849
  844    HG2  LYS 113           HG2      LYS 113   4.975  -0.757  18.398
  845    HG3  LYS 113           HG3      LYS 113   4.832  -1.055  16.663
  846    HD2  LYS 113           HD2      LYS 113   2.528  -0.692  18.627
  847    HD3  LYS 113           HD3      LYS 113   3.107   0.497  17.444
  848    HE2  LYS 113           HE2      LYS 113   2.625  -1.191  15.633
  849    HE3  LYS 113           HE3      LYS 113   1.894  -2.233  16.856
  850    HZ1  LYS 113           HZ1      LYS 113   0.257  -0.465  17.277
  851    HZ2  LYS 113           HZ2      LYS 113   0.944   0.491  16.116
  852    HZ3  LYS 113           HZ3      LYS 113   0.255  -0.938  15.703
  853    H    LEU 114           H        LEU 114   5.370  -5.691  16.978
  854    HA   LEU 114           HA       LEU 114   5.025  -7.167  19.427
  855    HB2  LEU 114           HB2      LEU 114   4.594  -7.585  16.676
  856    HB3  LEU 114           HB3      LEU 114   5.821  -8.773  17.105
  857    HG   LEU 114           HG       LEU 114   3.140  -8.374  18.461
  858   HD11  LEU 114          HD11      LEU 114   4.067 -10.552  16.549
  859   HD12  LEU 114          HD12      LEU 114   2.485 -10.470  17.356
  860   HD13  LEU 114          HD13      LEU 114   2.932  -9.237  16.169
  861   HD21  LEU 114          HD21      LEU 114   5.214 -10.584  18.786
  862   HD22  LEU 114          HD22      LEU 114   4.785  -9.375  20.008
  863   HD23  LEU 114          HD23      LEU 114   3.589 -10.581  19.514
  864    H    VAL 115           H        VAL 115   7.815  -6.537  17.389
  865    HA   VAL 115           HA       VAL 115   9.697  -8.177  18.911
  866    HB   VAL 115           HB       VAL 115  10.072  -5.926  16.898
  867   HG11  VAL 115          HG11      VAL 115  12.213  -7.584  18.284
  868   HG12  VAL 115          HG12      VAL 115  12.482  -6.645  16.802
  869   HG13  VAL 115          HG13      VAL 115  12.053  -5.815  18.297
  870   HG21  VAL 115          HG21      VAL 115  10.860  -7.740  15.433
  871   HG22  VAL 115          HG22      VAL 115  10.617  -8.924  16.735
  872   HG23  VAL 115          HG23      VAL 115   9.227  -8.095  16.011
  873    H    GLU 116           H        GLU 116   9.497  -4.572  18.772
  874    HA   GLU 116           HA       GLU 116  11.247  -4.315  20.916
  875    HB2  GLU 116           HB2      GLU 116   9.271  -2.429  19.669
  876    HB3  GLU 116           HB3      GLU 116  10.179  -1.938  21.108
  877    HG2  GLU 116           HG2      GLU 116  12.288  -2.662  19.800
  878    HG3  GLU 116           HG3      GLU 116  11.244  -2.672  18.369
  879    H    GLU 117           H        GLU 117   7.766  -4.906  21.342
  880    HA   GLU 117           HA       GLU 117   7.923  -4.200  24.183
  881    HB2  GLU 117           HB2      GLU 117   5.783  -5.706  22.649
  882    HB3  GLU 117           HB3      GLU 117   5.724  -5.285  24.366
  883    HG2  GLU 117           HG2      GLU 117   6.214  -2.840  23.555
  884    HG3  GLU 117           HG3      GLU 117   5.655  -3.401  21.995
  885    H    ALA 118           H        ALA 118   9.028  -6.906  22.411
  886    HA   ALA 118           HA       ALA 118   9.005  -8.766  24.667
  887    HB1  ALA 118           HB1      ALA 118  10.532 -10.131  23.381
  888    HB2  ALA 118           HB2      ALA 118   9.240  -9.534  22.323
  889    HB3  ALA 118           HB3      ALA 118  10.857  -8.807  22.253
  890    H    GLN 119           H        GLN 119  11.646  -6.757  23.295
  891    HA   GLN 119           HA       GLN 119  13.560  -6.906  25.269
  892    HB2  GLN 119           HB2      GLN 119  12.715  -4.571  23.483
  893    HB3  GLN 119           HB3      GLN 119  14.084  -4.499  24.546
  894    HG2  GLN 119           HG2      GLN 119  15.228  -5.104  22.735
  895    HG3  GLN 119           HG3      GLN 119  14.835  -6.718  23.350
  896   HE21  GLN 119          HE22      GLN 119  13.154  -7.921  22.343
  897   HE22  GLN 119          HE21      GLN 119  12.204  -7.152  21.092
  Start of MODEL   19
    1    H    SER   1           H        SER   1  18.998  -4.092  13.617
    2    HA   SER   1           HA       SER   1  16.770  -2.610  14.772
    3    HB2  SER   1           HB2      SER   1  19.715  -1.969  14.542
    4    HB3  SER   1           HB3      SER   1  18.534  -0.996  15.445
    5    HG   SER   1           HG       SER   1  19.845  -2.810  16.476
    6    H    GLU   2           H        GLU   2  18.756  -2.129  11.769
    7    HA   GLU   2           HA       GLU   2  17.284   0.332  11.182
    8    HB2  GLU   2           HB2      GLU   2  18.329   0.414   9.093
    9    HB3  GLU   2           HB3      GLU   2  19.537   0.091  10.323
   10    HG2  GLU   2           HG2      GLU   2  19.662  -2.264   9.624
   11    HG3  GLU   2           HG3      GLU   2  18.378  -2.011   8.434
   12    H    ALA   3           H        ALA   3  16.876  -3.118  10.284
   13    HA   ALA   3           HA       ALA   3  14.610  -2.835   8.657
   14    HB1  ALA   3           HB1      ALA   3  14.112  -5.137   9.295
   15    HB2  ALA   3           HB2      ALA   3  15.850  -4.927   8.996
   16    HB3  ALA   3           HB3      ALA   3  15.231  -5.037  10.657
   17    H    LEU   4           H        LEU   4  14.746  -2.857  12.245
   18    HA   LEU   4           HA       LEU   4  11.924  -2.697  12.669
   19    HB2  LEU   4           HB2      LEU   4  13.723  -3.291  14.365
   20    HB3  LEU   4           HB3      LEU   4  14.141  -1.589  14.432
   21    HG   LEU   4           HG       LEU   4  11.766  -1.098  15.202
   22   HD11  LEU   4          HD11      LEU   4  11.752  -4.128  15.468
   23   HD12  LEU   4          HD12      LEU   4  10.539  -3.031  16.180
   24   HD13  LEU   4          HD13      LEU   4  10.689  -3.170  14.418
   25   HD21  LEU   4          HD21      LEU   4  13.418  -2.975  16.936
   26   HD22  LEU   4          HD22      LEU   4  13.656  -1.222  16.771
   27   HD23  LEU   4          HD23      LEU   4  12.163  -1.840  17.494
   28    H    ALA   5           H        ALA   5  14.231  -0.210  11.699
   29    HA   ALA   5           HA       ALA   5  12.295   1.984  12.027
   30    HB1  ALA   5           HB1      ALA   5  14.033   3.323  10.906
   31    HB2  ALA   5           HB2      ALA   5  14.674   2.470  12.323
   32    HB3  ALA   5           HB3      ALA   5  15.031   1.880  10.686
   33    H    LYS   6           H        LYS   6  13.551  -0.149   9.430
   34    HA   LYS   6           HA       LYS   6  12.373   1.078   7.229
   35    HB2  LYS   6           HB2      LYS   6  14.042  -1.005   7.624
   36    HB3  LYS   6           HB3      LYS   6  12.590  -1.911   7.210
   37    HG2  LYS   6           HG2      LYS   6  13.954   0.241   5.551
   38    HG3  LYS   6           HG3      LYS   6  14.083  -1.487   5.345
   39    HD2  LYS   6           HD2      LYS   6  11.595  -1.540   4.906
   40    HD3  LYS   6           HD3      LYS   6  11.655   0.240   4.810
   41    HE2  LYS   6           HE2      LYS   6  13.389  -1.630   3.161
   42    HE3  LYS   6           HE3      LYS   6  11.850  -0.954   2.593
   43    HZ1  LYS   6           HZ1      LYS   6  14.248   0.631   3.340
   44    HZ2  LYS   6           HZ2      LYS   6  13.723   0.372   1.825
   45    HZ3  LYS   6           HZ3      LYS   6  12.801   1.261   2.842
   46    H    LEU   7           H        LEU   7  10.744  -1.276   9.405
   47    HA   LEU   7           HA       LEU   7   8.385  -1.541   7.772
   48    HB2  LEU   7           HB2      LEU   7   8.971  -1.874  10.699
   49    HB3  LEU   7           HB3      LEU   7   7.299  -1.863  10.150
   50    HG   LEU   7           HG       LEU   7   8.026  -4.116  10.415
   51   HD11  LEU   7          HD11      LEU   7   7.959  -3.681   7.410
   52   HD12  LEU   7          HD12      LEU   7   7.403  -5.079   8.336
   53   HD13  LEU   7          HD13      LEU   7   6.532  -3.541   8.464
   54   HD21  LEU   7          HD21      LEU   7  10.442  -3.896  10.082
   55   HD22  LEU   7          HD22      LEU   7   9.763  -5.171   9.063
   56   HD23  LEU   7          HD23      LEU   7  10.191  -3.609   8.340
   57    H    ILE   8           H        ILE   8   9.332   1.007  10.005
   58    HA   ILE   8           HA       ILE   8   6.975   2.637   9.432
   59    HB   ILE   8           HB       ILE   8   9.625   3.437  10.654
   60   HG12  ILE   8          HG12      ILE   8   8.363   1.894  12.052
   61   HG13  ILE   8          HG13      ILE   8   8.413   3.505  12.742
   62   HG21  ILE   8          HG21      ILE   8   7.103   5.075  10.265
   63   HG22  ILE   8          HG22      ILE   8   8.428   5.496  11.372
   64   HG23  ILE   8          HG23      ILE   8   8.729   5.418   9.636
   65   HD11  ILE   8          HD11      ILE   8   6.022   2.189  11.376
   66   HD12  ILE   8          HD12      ILE   8   6.215   2.566  13.093
   67   HD13  ILE   8          HD13      ILE   8   6.047   3.882  11.930
   68    H    SER   9           H        SER   9  10.413   2.758   8.018
   69    HA   SER   9           HA       SER   9   9.730   4.804   6.252
   70    HB2  SER   9           HB2      SER   9  11.810   2.645   5.803
   71    HB3  SER   9           HB3      SER   9  11.781   4.277   5.117
   72    HG   SER   9           HG       SER   9  11.884   5.093   7.269
   73    H    LEU  10           H        LEU  10   8.739   1.510   5.959
   74    HA   LEU  10           HA       LEU  10   8.162   1.468   3.097
   75    HB2  LEU  10           HB2      LEU  10   7.297  -0.076   5.571
   76    HB3  LEU  10           HB3      LEU  10   6.497  -0.358   4.037
   77    HG   LEU  10           HG       LEU  10   9.505  -0.603   4.286
   78   HD11  LEU  10          HD11      LEU  10   8.751  -3.167   4.335
   79   HD12  LEU  10          HD12      LEU  10   8.936  -2.221   5.812
   80   HD13  LEU  10          HD13      LEU  10   7.321  -2.499   5.118
   81   HD21  LEU  10          HD21      LEU  10   9.319  -2.015   2.329
   82   HD22  LEU  10          HD22      LEU  10   7.548  -1.908   2.363
   83   HD23  LEU  10          HD23      LEU  10   8.536  -0.475   1.997
   84    H    GLN  11           H        GLN  11   6.552   2.818   5.948
   85    HA   GLN  11           HA       GLN  11   3.920   2.950   4.672
   86    HB2  GLN  11           HB2      GLN  11   5.016   3.681   7.366
   87    HB3  GLN  11           HB3      GLN  11   3.461   4.319   6.850
   88    HG2  GLN  11           HG2      GLN  11   2.551   2.123   6.440
   89    HG3  GLN  11           HG3      GLN  11   4.117   1.358   6.765
   90   HE21  GLN  11          HE22      GLN  11   4.836   1.131   8.928
   91   HE22  GLN  11          HE21      GLN  11   3.734   1.564  10.246
   92    H    ALA  12           H        ALA  12   3.100   4.591   3.574
   93    HA   ALA  12           HA       ALA  12   4.837   6.724   2.639
   94    HB1  ALA  12           HB1      ALA  12   2.961   7.152   1.105
   95    HB2  ALA  12           HB2      ALA  12   3.339   5.422   1.158
   96    HB3  ALA  12           HB3      ALA  12   1.928   6.057   2.044
   97    H    THR  13           H        THR  13   4.083   8.966   2.461
   98    HA   THR  13           HA       THR  13   2.717   9.949   4.935
   99    HB   THR  13           HB       THR  13   3.784  12.161   4.215
  100    HG1  THR  13           HG1      THR  13   4.519  11.752   2.139
  101   HG21  THR  13          HG21      THR  13   5.621   9.813   4.871
  102   HG22  THR  13          HG22      THR  13   5.921  11.532   5.225
  103   HG23  THR  13          HG23      THR  13   4.609  10.667   6.051
  104    H    GLU  14           H        GLU  14   2.296   9.982   1.436
  105    HA   GLU  14           HA       GLU  14  -0.291  11.359   1.824
  106    HB2  GLU  14           HB2      GLU  14   0.081  12.824  -0.052
  107    HB3  GLU  14           HB3      GLU  14   1.252  13.107   1.223
  108    HG2  GLU  14           HG2      GLU  14   1.781  11.547  -1.338
  109    HG3  GLU  14           HG3      GLU  14   2.204  13.237  -1.063
  110    H    ALA  15           H        ALA  15  -1.852  11.110   0.205
  111    HA   ALA  15           HA       ALA  15  -1.501   8.920  -1.774
  112    HB1  ALA  15           HB1      ALA  15  -3.659   8.955   0.385
  113    HB2  ALA  15           HB2      ALA  15  -3.501   7.760  -0.923
  114    HB3  ALA  15           HB3      ALA  15  -2.259   7.859   0.337
  115    H    THR  16           H        THR  16  -3.463   8.704  -3.172
  116    HA   THR  16           HA       THR  16  -4.928  11.292  -3.556
  117    HB   THR  16           HB       THR  16  -3.873   9.429  -5.677
  118    HG1  THR  16           HG1      THR  16  -2.340  10.816  -5.877
  119   HG21  THR  16          HG21      THR  16  -5.465  12.021  -5.949
  120   HG22  THR  16          HG22      THR  16  -4.615  11.202  -7.277
  121   HG23  THR  16          HG23      THR  16  -5.979  10.407  -6.485
  122    H    ILE  17           H        ILE  17  -7.007  11.066  -3.015
  123    HA   ILE  17           HA       ILE  17  -8.398   8.450  -3.131
  124    HB   ILE  17           HB       ILE  17  -9.439  11.143  -2.175
  125   HG12  ILE  17          HG12      ILE  17  -8.363   8.871  -0.468
  126   HG13  ILE  17          HG13      ILE  17  -7.525  10.389  -0.779
  127   HG21  ILE  17          HG21      ILE  17 -10.547   8.326  -1.787
  128   HG22  ILE  17          HG22      ILE  17 -11.233   9.812  -1.089
  129   HG23  ILE  17          HG23      ILE  17 -11.248   9.597  -2.816
  130   HD11  ILE  17          HD11      ILE  17 -10.109  10.044   0.783
  131   HD12  ILE  17          HD12      ILE  17  -8.529  10.514   1.394
  132   HD13  ILE  17          HD13      ILE  17  -9.415  11.619   0.320
  133    H    VAL  18           H        VAL  18 -10.162   7.979  -4.565
  134    HA   VAL  18           HA       VAL  18 -10.784  10.063  -6.606
  135    HB   VAL  18           HB       VAL  18 -10.275   7.139  -7.223
  136   HG11  VAL  18          HG11      VAL  18 -12.009   8.030  -8.680
  137   HG12  VAL  18          HG12      VAL  18 -11.052   9.488  -9.004
  138   HG13  VAL  18          HG13      VAL  18 -10.508   7.902  -9.592
  139   HG21  VAL  18          HG21      VAL  18  -8.141   8.070  -6.908
  140   HG22  VAL  18          HG22      VAL  18  -8.411   8.223  -8.658
  141   HG23  VAL  18          HG23      VAL  18  -8.591   9.626  -7.592
  142    H    THR  19           H        THR  19 -12.780  10.510  -6.659
  143    HA   THR  19           HA       THR  19 -14.908   8.555  -5.826
  144    HB   THR  19           HB       THR  19 -14.634  11.459  -5.000
  145    HG1  THR  19           HG1      THR  19 -13.882  10.782  -3.181
  146   HG21  THR  19          HG21      THR  19 -16.589   9.302  -4.099
  147   HG22  THR  19          HG22      THR  19 -16.383  10.881  -3.311
  148   HG23  THR  19          HG23      THR  19 -16.999  10.810  -4.960
  149    H    LEU  20           H        LEU  20 -17.050   8.951  -6.644
  150    HA   LEU  20           HA       LEU  20 -17.056  10.374  -9.252
  151    HB2  LEU  20           HB2      LEU  20 -18.917   8.281  -8.060
  152    HB3  LEU  20           HB3      LEU  20 -19.170   9.070  -9.611
  153    HG   LEU  20           HG       LEU  20 -16.674   7.428  -8.963
  154   HD11  LEU  20          HD11      LEU  20 -18.644   5.998  -8.829
  155   HD12  LEU  20          HD12      LEU  20 -19.224   6.589 -10.396
  156   HD13  LEU  20          HD13      LEU  20 -17.721   5.643 -10.292
  157   HD21  LEU  20          HD21      LEU  20 -17.854   8.503 -11.566
  158   HD22  LEU  20          HD22      LEU  20 -16.332   8.988 -10.804
  159   HD23  LEU  20          HD23      LEU  20 -16.491   7.359 -11.459
  160    H    ASP  21           H        ASP  21 -18.136  12.163  -9.550
  161    HA   ASP  21           HA       ASP  21 -19.840  13.271  -7.313
  162    HB2  ASP  21           HB2      ASP  21 -17.832  14.510  -9.105
  163    HB3  ASP  21           HB3      ASP  21 -19.356  15.381  -9.015
  164    H    SER  22           H        SER  22 -19.993  11.875 -10.297
  165    HA   SER  22           HA       SER  22 -22.847  12.234 -10.454
  166    HB2  SER  22           HB2      SER  22 -21.292  12.884 -12.937
  167    HB3  SER  22           HB3      SER  22 -23.028  12.649 -12.818
  168    HG   SER  22           HG       SER  22 -23.276  14.449 -11.740
  169    H    ASP  23           H        ASP  23 -23.680  10.280 -10.943
  170    HA   ASP  23           HA       ASP  23 -22.473   7.990 -10.524
  171    HB2  ASP  23           HB2      ASP  23 -24.969   8.461 -12.171
  172    HB3  ASP  23           HB3      ASP  23 -24.443   6.849 -11.686
  173    H    ASN  24           H        ASN  24 -20.465   7.968 -11.622
  174    HA   ASN  24           HA       ASN  24 -18.933   7.023 -12.958
  175    HB2  ASN  24           HB2      ASN  24 -21.196   5.331 -14.160
  176    HB3  ASN  24           HB3      ASN  24 -19.486   5.021 -14.355
  177   HD21  ASN  24          HD22      ASN  24 -22.074   4.847 -12.087
  178   HD22  ASN  24          HD21      ASN  24 -21.101   3.875 -10.988
  179    H    ILE  25           H        ILE  25 -19.925   9.352 -13.512
  180    HA   ILE  25           HA       ILE  25 -19.525   9.745 -16.414
  181    HB   ILE  25           HB       ILE  25 -21.531  11.131 -16.737
  182   HG12  ILE  25          HG12      ILE  25 -22.484  10.091 -14.083
  183   HG13  ILE  25          HG13      ILE  25 -22.035  11.749 -14.527
  184   HG21  ILE  25          HG21      ILE  25 -22.256   8.284 -15.916
  185   HG22  ILE  25          HG22      ILE  25 -23.021   9.271 -17.175
  186   HG23  ILE  25          HG23      ILE  25 -21.375   8.684 -17.402
  187   HD11  ILE  25          HD11      ILE  25 -24.440  11.581 -14.488
  188   HD12  ILE  25          HD12      ILE  25 -23.906  11.802 -16.167
  189   HD13  ILE  25          HD13      ILE  25 -24.417  10.195 -15.585
  190    H    LEU  26           H        LEU  26 -19.565  11.184 -13.198
  191    HA   LEU  26           HA       LEU  26 -17.572  13.151 -14.277
  192    HB2  LEU  26           HB2      LEU  26 -19.691  14.286 -13.639
  193    HB3  LEU  26           HB3      LEU  26 -19.519  13.601 -12.019
  194    HG   LEU  26           HG       LEU  26 -17.455  14.892 -11.650
  195   HD11  LEU  26          HD11      LEU  26 -18.275  16.083 -14.320
  196   HD12  LEU  26          HD12      LEU  26 -17.069  16.810 -13.224
  197   HD13  LEU  26          HD13      LEU  26 -16.754  15.229 -13.959
  198   HD21  LEU  26          HD21      LEU  26 -19.851  15.721 -11.095
  199   HD22  LEU  26          HD22      LEU  26 -18.552  16.930 -11.171
  200   HD23  LEU  26          HD23      LEU  26 -19.696  16.753 -12.518
  201    H    LEU  27           H        LEU  27 -15.670  12.958 -13.499
  202    HA   LEU  27           HA       LEU  27 -15.116  11.407 -10.982
  203    HB2  LEU  27           HB2      LEU  27 -13.536  11.752 -13.553
  204    HB3  LEU  27           HB3      LEU  27 -12.764  11.289 -12.046
  205    HG   LEU  27           HG       LEU  27 -14.213   9.286 -11.877
  206   HD11  LEU  27          HD11      LEU  27 -15.105  10.059 -14.691
  207   HD12  LEU  27          HD12      LEU  27 -15.337   8.458 -13.954
  208   HD13  LEU  27          HD13      LEU  27 -16.147   9.861 -13.263
  209   HD21  LEU  27          HD21      LEU  27 -12.615   9.534 -14.458
  210   HD22  LEU  27          HD22      LEU  27 -11.951   9.190 -12.846
  211   HD23  LEU  27          HD23      LEU  27 -13.025   8.021 -13.620
  212    H    SER  28           H        SER  28 -14.088  12.311  -9.339
  213    HA   SER  28           HA       SER  28 -12.418  14.759  -9.745
  214    HB2  SER  28           HB2      SER  28 -14.693  15.437  -9.051
  215    HB3  SER  28           HB3      SER  28 -14.567  14.425  -7.613
  216    HG   SER  28           HG       SER  28 -14.051  16.493  -7.067
  217    H    GLU  29           H        GLU  29 -10.404  14.629  -8.710
  218    HA   GLU  29           HA       GLU  29 -10.031  12.406  -6.770
  219    HB2  GLU  29           HB2      GLU  29  -7.909  13.644  -8.549
  220    HB3  GLU  29           HB3      GLU  29  -7.774  12.226  -7.503
  221    HG2  GLU  29           HG2      GLU  29  -9.483  11.078  -8.970
  222    HG3  GLU  29           HG3      GLU  29  -9.422  12.458 -10.046
  223    H    GLU  30           H        GLU  30  -9.084  12.794  -4.852
  224    HA   GLU  30           HA       GLU  30  -8.280  15.601  -4.098
  225    HB2  GLU  30           HB2      GLU  30  -8.930  13.306  -2.208
  226    HB3  GLU  30           HB3      GLU  30  -8.596  14.980  -1.782
  227    HG2  GLU  30           HG2      GLU  30 -10.669  15.678  -2.923
  228    HG3  GLU  30           HG3      GLU  30 -11.007  13.971  -3.310
  229    H    GLN  31           H        GLN  31  -6.242  15.929  -3.044
  230    HA   GLN  31           HA       GLN  31  -4.497  13.513  -2.784
  231    HB2  GLN  31           HB2      GLN  31  -3.615  16.329  -3.478
  232    HB3  GLN  31           HB3      GLN  31  -2.573  14.945  -3.107
  233    HG2  GLN  31           HG2      GLN  31  -3.852  13.743  -5.036
  234    HG3  GLN  31           HG3      GLN  31  -4.314  15.379  -5.555
  235   HE21  GLN  31          HE22      GLN  31  -1.951  12.987  -5.397
  236   HE22  GLN  31          HE21      GLN  31  -0.738  14.011  -4.889
  237    H    VAL  32           H        VAL  32  -3.930  13.036  -0.807
  238    HA   VAL  32           HA       VAL  32  -4.409  15.033   1.391
  239    HB   VAL  32           HB       VAL  32  -5.605  13.348   2.619
  240   HG11  VAL  32          HG11      VAL  32  -6.869  13.583  -0.129
  241   HG12  VAL  32          HG12      VAL  32  -7.686  13.308   1.418
  242   HG13  VAL  32          HG13      VAL  32  -6.881  14.857   1.116
  243   HG21  VAL  32          HG21      VAL  32  -6.356  11.230   1.660
  244   HG22  VAL  32          HG22      VAL  32  -5.422  11.537   0.178
  245   HG23  VAL  32          HG23      VAL  32  -4.599  11.271   1.732
  246    H    ASP  33           H        ASP  33  -3.621  14.564   3.456
  247    HA   ASP  33           HA       ASP  33  -1.071  13.104   3.631
  248    HB2  ASP  33           HB2      ASP  33  -1.516  15.193   4.941
  249    HB3  ASP  33           HB3      ASP  33  -2.799  14.364   5.803
  250    H    VAL  34           H        VAL  34  -0.739  11.162   4.784
  251    HA   VAL  34           HA       VAL  34  -2.731   9.215   4.430
  252    HB   VAL  34           HB       VAL  34  -0.283   8.913   4.378
  253   HG11  VAL  34          HG11      VAL  34   0.946   8.463   6.415
  254   HG12  VAL  34          HG12      VAL  34   0.293  10.098   6.464
  255   HG13  VAL  34          HG13      VAL  34  -0.474   8.800   7.416
  256   HG21  VAL  34          HG21      VAL  34  -1.610   6.874   6.192
  257   HG22  VAL  34          HG22      VAL  34  -1.822   6.957   4.429
  258   HG23  VAL  34          HG23      VAL  34  -0.221   6.644   5.122
  259    H    GLU  35           H        GLU  35  -2.599  11.388   7.099
  260    HA   GLU  35           HA       GLU  35  -4.121   9.617   8.886
  261    HB2  GLU  35           HB2      GLU  35  -2.598  11.539   9.579
  262    HB3  GLU  35           HB3      GLU  35  -3.897  12.636   9.079
  263    HG2  GLU  35           HG2      GLU  35  -5.433  11.549  10.699
  264    HG3  GLU  35           HG3      GLU  35  -4.186  10.361  11.098
  265    H    LEU  36           H        LEU  36  -4.986  11.584   6.156
  266    HA   LEU  36           HA       LEU  36  -7.786  11.980   7.052
  267    HB2  LEU  36           HB2      LEU  36  -6.437  12.869   4.510
  268    HB3  LEU  36           HB3      LEU  36  -7.945  13.484   5.178
  269    HG   LEU  36           HG       LEU  36  -5.147  13.896   6.336
  270   HD11  LEU  36          HD11      LEU  36  -5.501  16.225   5.679
  271   HD12  LEU  36          HD12      LEU  36  -5.612  15.155   4.277
  272   HD13  LEU  36          HD13      LEU  36  -7.096  15.817   5.006
  273   HD21  LEU  36          HD21      LEU  36  -6.807  13.821   8.160
  274   HD22  LEU  36          HD22      LEU  36  -6.221  15.465   7.900
  275   HD23  LEU  36          HD23      LEU  36  -7.826  14.997   7.295
  276    H    VAL  37           H        VAL  37  -6.228   9.499   5.540
  277    HA   VAL  37           HA       VAL  37  -8.507   8.709   3.809
  278    HB   VAL  37           HB       VAL  37  -6.526   8.509   2.583
  279   HG11  VAL  37          HG11      VAL  37  -5.278   6.967   4.900
  280   HG12  VAL  37          HG12      VAL  37  -4.559   7.170   3.287
  281   HG13  VAL  37          HG13      VAL  37  -4.818   8.580   4.314
  282   HG21  VAL  37          HG21      VAL  37  -8.066   6.583   2.406
  283   HG22  VAL  37          HG22      VAL  37  -6.381   6.145   2.071
  284   HG23  VAL  37          HG23      VAL  37  -7.112   5.705   3.620
  285    H    GLN  38           H        GLN  38  -9.705   6.968   4.302
  286    HA   GLN  38           HA       GLN  38  -9.353   5.646   6.973
  287    HB2  GLN  38           HB2      GLN  38 -11.809   6.827   5.630
  288    HB3  GLN  38           HB3      GLN  38 -11.910   5.704   6.981
  289    HG2  GLN  38           HG2      GLN  38 -10.687   7.229   8.441
  290    HG3  GLN  38           HG3      GLN  38 -10.478   8.397   7.122
  291   HE21  GLN  38          HE22      GLN  38 -12.617   9.091   6.117
  292   HE22  GLN  38          HE21      GLN  38 -14.041   8.984   7.175
  293    H    ARG  39           H        ARG  39 -10.734   3.729   7.174
  294    HA   ARG  39           HA       ARG  39  -9.978   1.838   5.122
  295    HB2  ARG  39           HB2      ARG  39 -10.573   0.172   6.690
  296    HB3  ARG  39           HB3      ARG  39  -9.836   1.491   7.590
  297    HG2  ARG  39           HG2      ARG  39 -12.407   2.213   7.869
  298    HG3  ARG  39           HG3      ARG  39 -12.674   0.507   7.510
  299    HD2  ARG  39           HD2      ARG  39 -11.355  -0.184   9.430
  300    HD3  ARG  39           HD3      ARG  39 -10.827   1.480   9.732
  301    HE   ARG  39           HE       ARG  39 -13.594   1.629   9.802
  302   HH11  ARG  39          HH11      ARG  39 -11.243  -0.046  11.840
  303   HH12  ARG  39          HH12      ARG  39 -12.431  -0.254  13.103
  304   HH21  ARG  39          HH21      ARG  39 -14.929   1.407  11.441
  305   HH22  ARG  39          HH22      ARG  39 -14.437   0.606  12.924
  306    H    GLY  40           H        GLY  40 -12.039   3.768   4.307
  307    HA2  GLY  40           HA2      GLY  40 -13.761   1.875   2.839
  308    HA3  GLY  40           HA3      GLY  40 -14.544   3.183   3.734
  309    H    ASP  41           H        ASP  41 -11.454   4.182   2.492
  310    HA   ASP  41           HA       ASP  41 -12.713   5.694   0.278
  311    HB2  ASP  41           HB2      ASP  41  -9.948   5.723   1.525
  312    HB3  ASP  41           HB3      ASP  41 -10.382   6.682   0.117
  313    H    ILE  42           H        ILE  42 -11.626   5.792  -1.846
  314    HA   ILE  42           HA       ILE  42 -10.237   3.278  -2.663
  315    HB   ILE  42           HB       ILE  42 -12.222   4.916  -4.273
  316   HG12  ILE  42          HG12      ILE  42 -12.307   2.001  -3.350
  317   HG13  ILE  42          HG13      ILE  42 -13.184   3.317  -2.581
  318   HG21  ILE  42          HG21      ILE  42 -10.539   2.505  -5.120
  319   HG22  ILE  42          HG22      ILE  42 -11.805   3.280  -6.099
  320   HG23  ILE  42          HG23      ILE  42 -10.347   4.171  -5.715
  321   HD11  ILE  42          HD11      ILE  42 -14.420   3.725  -4.722
  322   HD12  ILE  42          HD12      ILE  42 -13.667   2.251  -5.383
  323   HD13  ILE  42          HD13      ILE  42 -14.726   2.147  -3.971
  324    H    ILE  43           H        ILE  43  -8.225   3.583  -3.328
  325    HA   ILE  43           HA       ILE  43  -7.227   6.332  -3.818
  326    HB   ILE  43           HB       ILE  43  -5.844   3.832  -2.774
  327   HG12  ILE  43          HG12      ILE  43  -7.475   4.426  -1.110
  328   HG13  ILE  43          HG13      ILE  43  -5.874   4.841  -0.537
  329   HG21  ILE  43          HG21      ILE  43  -4.082   5.414  -1.990
  330   HG22  ILE  43          HG22      ILE  43  -4.221   5.340  -3.744
  331   HG23  ILE  43          HG23      ILE  43  -4.900   6.722  -2.868
  332   HD11  ILE  43          HD11      ILE  43  -7.901   6.819  -1.665
  333   HD12  ILE  43          HD12      ILE  43  -7.530   6.568   0.036
  334   HD13  ILE  43          HD13      ILE  43  -6.289   7.239  -1.037
  335    H    LYS  44           H        LYS  44  -6.321   6.827  -5.787
  336    HA   LYS  44           HA       LYS  44  -5.639   4.712  -7.726
  337    HB2  LYS  44           HB2      LYS  44  -6.873   6.604  -8.416
  338    HB3  LYS  44           HB3      LYS  44  -5.540   7.694  -7.974
  339    HG2  LYS  44           HG2      LYS  44  -4.084   6.558  -9.626
  340    HG3  LYS  44           HG3      LYS  44  -5.376   5.413 -10.027
  341    HD2  LYS  44           HD2      LYS  44  -5.729   8.405 -10.259
  342    HD3  LYS  44           HD3      LYS  44  -4.976   7.442 -11.550
  343    HE2  LYS  44           HE2      LYS  44  -6.995   6.083 -11.775
  344    HE3  LYS  44           HE3      LYS  44  -7.786   6.976 -10.465
  345    HZ1  LYS  44           HZ1      LYS  44  -8.386   7.711 -12.737
  346    HZ2  LYS  44           HZ2      LYS  44  -7.725   8.963 -11.848
  347    HZ3  LYS  44           HZ3      LYS  44  -6.856   8.185 -13.009
  348    H    VAL  45           H        VAL  45  -3.723   3.861  -8.110
  349    HA   VAL  45           HA       VAL  45  -1.256   5.167  -7.056
  350    HB   VAL  45           HB       VAL  45  -1.941   2.852  -6.288
  351   HG11  VAL  45          HG11      VAL  45  -0.863   1.979  -9.004
  352   HG12  VAL  45          HG12      VAL  45  -1.348   0.936  -7.655
  353   HG13  VAL  45          HG13      VAL  45  -2.563   1.918  -8.488
  354   HG21  VAL  45          HG21      VAL  45   0.835   3.174  -7.510
  355   HG22  VAL  45          HG22      VAL  45   0.315   3.698  -5.894
  356   HG23  VAL  45          HG23      VAL  45   0.364   1.979  -6.281
  357    H    VAL  46           H        VAL  46   0.403   5.790  -8.377
  358    HA   VAL  46           HA       VAL  46   0.001   5.536 -11.291
  359    HB   VAL  46           HB       VAL  46   1.540   7.362 -11.524
  360   HG11  VAL  46          HG11      VAL  46  -0.410   8.008  -9.291
  361   HG12  VAL  46          HG12      VAL  46   0.266   9.120 -10.492
  362   HG13  VAL  46          HG13      VAL  46  -0.845   7.838 -11.003
  363   HG21  VAL  46          HG21      VAL  46   2.545   8.552  -9.688
  364   HG22  VAL  46          HG22      VAL  46   1.880   7.418  -8.511
  365   HG23  VAL  46          HG23      VAL  46   3.126   6.879  -9.661
  366    HA   PRO  47           HA       PRO  47   3.489   2.894 -12.307
  367    HB2  PRO  47           HB2      PRO  47   4.328   5.211 -14.073
  368    HB3  PRO  47           HB3      PRO  47   4.346   3.466 -14.452
  369    HG2  PRO  47           HG2      PRO  47   2.317   4.978 -15.369
  370    HG3  PRO  47           HG3      PRO  47   1.927   3.415 -14.576
  371    HD2  PRO  47           HD2      PRO  47   1.862   6.198 -13.382
  372    HD3  PRO  47           HD3      PRO  47   0.631   4.904 -13.276
  373    H    GLY  48           H        GLY  48   5.564   2.593 -11.494
  374    HA2  GLY  48           HA2      GLY  48   7.509   3.038 -10.326
  375    HA3  GLY  48           HA3      GLY  48   7.338   4.738 -10.724
  376    H    GLY  49           H        GLY  49   4.478   4.211  -9.237
  377    HA2  GLY  49           HA2      GLY  49   5.254   5.469  -6.762
  378    HA3  GLY  49           HA3      GLY  49   3.644   4.976  -7.257
  379    H    LYS  50           H        LYS  50   3.964   4.701  -4.741
  380    HA   LYS  50           HA       LYS  50   4.306   1.773  -4.241
  381    HB2  LYS  50           HB2      LYS  50   4.943   4.048  -2.307
  382    HB3  LYS  50           HB3      LYS  50   4.877   2.332  -1.905
  383    HG2  LYS  50           HG2      LYS  50   7.077   2.458  -2.245
  384    HG3  LYS  50           HG3      LYS  50   6.596   2.076  -3.887
  385    HD2  LYS  50           HD2      LYS  50   6.753   4.551  -4.418
  386    HD3  LYS  50           HD3      LYS  50   7.277   4.818  -2.744
  387    HE2  LYS  50           HE2      LYS  50   9.168   3.189  -3.157
  388    HE3  LYS  50           HE3      LYS  50   8.698   3.145  -4.865
  389    HZ1  LYS  50           HZ1      LYS  50  10.470   4.719  -4.443
  390    HZ2  LYS  50           HZ2      LYS  50   9.143   5.543  -4.966
  391    HZ3  LYS  50           HZ3      LYS  50   9.569   5.537  -3.359
  392    H    PHE  51           H        PHE  51   2.951   0.793  -2.813
  393    HA   PHE  51           HA       PHE  51   0.221   1.835  -2.710
  394    HB2  PHE  51           HB2      PHE  51   1.494  -0.731  -1.729
  395    HB3  PHE  51           HB3      PHE  51  -0.211  -0.351  -1.535
  396    HD1  PHE  51           HD1      PHE  51   2.449  -1.063  -4.046
  397    HD2  PHE  51           HD2      PHE  51  -1.759  -0.492  -3.384
  398    HE1  PHE  51           HE1      PHE  51   2.003  -1.832  -6.346
  399    HE2  PHE  51           HE2      PHE  51  -2.224  -1.331  -5.681
  400    HZ   PHE  51           HZ       PHE  51  -0.335  -1.990  -7.171
  401    HA   PRO  52           HA       PRO  52   1.290   3.688   1.230
  402    HB2  PRO  52           HB2      PRO  52  -0.796   5.384   1.583
  403    HB3  PRO  52           HB3      PRO  52   0.370   5.571   0.238
  404    HG2  PRO  52           HG2      PRO  52  -2.369   4.280   0.145
  405    HG3  PRO  52           HG3      PRO  52  -1.669   5.488  -0.976
  406    HD2  PRO  52           HD2      PRO  52  -1.637   2.773  -1.464
  407    HD3  PRO  52           HD3      PRO  52  -0.366   3.888  -2.045
  408    H    VAL  53           H        VAL  53  -1.376   1.542   0.973
  409    HA   VAL  53           HA       VAL  53  -1.552   0.914   3.769
  410    HB   VAL  53           HB       VAL  53  -4.101   1.073   3.776
  411   HG11  VAL  53          HG11      VAL  53  -2.603   3.706   3.990
  412   HG12  VAL  53          HG12      VAL  53  -4.134   3.260   4.771
  413   HG13  VAL  53          HG13      VAL  53  -2.637   2.437   5.233
  414   HG21  VAL  53          HG21      VAL  53  -5.150   2.850   2.526
  415   HG22  VAL  53          HG22      VAL  53  -3.614   3.303   1.775
  416   HG23  VAL  53          HG23      VAL  53  -4.367   1.734   1.382
  417    H    ASP  54           H        ASP  54  -3.306  -1.009   3.905
  418    HA   ASP  54           HA       ASP  54  -2.852  -2.663   1.485
  419    HB2  ASP  54           HB2      ASP  54  -2.944  -4.583   2.684
  420    HB3  ASP  54           HB3      ASP  54  -1.994  -3.496   3.681
  421    H    GLY  55           H        GLY  55  -4.439  -3.989   0.571
  422    HA2  GLY  55           HA2      GLY  55  -7.178  -4.037   1.088
  423    HA3  GLY  55           HA3      GLY  55  -6.931  -2.559   0.160
  424    H    ARG  56           H        ARG  56  -8.387  -3.637  -1.335
  425    HA   ARG  56           HA       ARG  56  -7.030  -5.627  -3.113
  426    HB2  ARG  56           HB2      ARG  56  -9.274  -6.060  -1.862
  427    HB3  ARG  56           HB3      ARG  56 -10.001  -5.121  -3.172
  428    HG2  ARG  56           HG2      ARG  56  -8.968  -6.698  -4.829
  429    HG3  ARG  56           HG3      ARG  56  -8.278  -7.618  -3.486
  430    HD2  ARG  56           HD2      ARG  56 -11.195  -7.301  -4.231
  431    HD3  ARG  56           HD3      ARG  56 -10.218  -8.779  -4.223
  432    HE   ARG  56           HE       ARG  56 -11.321  -7.334  -1.848
  433   HH11  ARG  56          HH11      ARG  56  -9.515 -10.227  -2.893
  434   HH12  ARG  56          HH12      ARG  56  -9.661 -10.851  -1.247
  435   HH21  ARG  56          HH21      ARG  56 -11.363  -8.251   0.047
  436   HH22  ARG  56          HH22      ARG  56 -10.652  -9.864   0.284
  437    H    VAL  57           H        VAL  57  -7.031  -5.491  -5.297
  438    HA   VAL  57           HA       VAL  57  -7.426  -2.826  -6.576
  439    HB   VAL  57           HB       VAL  57  -5.878  -5.306  -7.465
  440   HG11  VAL  57          HG11      VAL  57  -6.348  -2.658  -8.910
  441   HG12  VAL  57          HG12      VAL  57  -5.186  -3.911  -9.418
  442   HG13  VAL  57          HG13      VAL  57  -6.901  -4.258  -9.437
  443   HG21  VAL  57          HG21      VAL  57  -3.893  -4.000  -7.274
  444   HG22  VAL  57          HG22      VAL  57  -4.810  -2.510  -6.972
  445   HG23  VAL  57          HG23      VAL  57  -4.756  -3.797  -5.747
  446    H    ILE  58           H        ILE  58  -9.278  -2.669  -7.657
  447    HA   ILE  58           HA       ILE  58 -10.374  -5.032  -9.122
  448    HB   ILE  58           HB       ILE  58 -12.700  -4.224  -8.509
  449   HG12  ILE  58          HG12      ILE  58 -11.315  -2.948  -6.121
  450   HG13  ILE  58          HG13      ILE  58 -11.743  -1.995  -7.549
  451   HG21  ILE  58          HG21      ILE  58 -11.040  -5.360  -6.226
  452   HG22  ILE  58          HG22      ILE  58 -12.787  -5.536  -6.472
  453   HG23  ILE  58          HG23      ILE  58 -11.663  -6.288  -7.607
  454   HD11  ILE  58          HD11      ILE  58 -13.725  -3.498  -5.799
  455   HD12  ILE  58          HD12      ILE  58 -13.465  -1.743  -5.871
  456   HD13  ILE  58          HD13      ILE  58 -14.117  -2.590  -7.285
  457    H    GLU  59           H        GLU  59  -8.724  -2.815  -9.936
  458    HA   GLU  59           HA       GLU  59 -10.061  -2.085 -12.397
  459    HB2  GLU  59           HB2      GLU  59 -10.176  -0.264 -10.094
  460    HB3  GLU  59           HB3      GLU  59  -9.235   0.462 -11.378
  461    HG2  GLU  59           HG2      GLU  59 -12.020  -0.687 -11.817
  462    HG3  GLU  59           HG3      GLU  59 -11.707   0.977 -11.336
  463    H    GLY  60           H        GLY  60  -8.413  -2.315 -13.841
  464    HA2  GLY  60           HA2      GLY  60  -6.442  -1.668 -14.866
  465    HA3  GLY  60           HA3      GLY  60  -5.804  -1.041 -13.356
  466    H    HIS  61           H        HIS  61  -4.002  -2.138 -14.628
  467    HA   HIS  61           HA       HIS  61  -3.437  -4.787 -13.476
  468    HB2  HIS  61           HB2      HIS  61  -3.039  -5.946 -15.462
  469    HB3  HIS  61           HB3      HIS  61  -4.616  -5.209 -15.667
  470    HD1  HIS  61           HD1      HIS  61  -4.667  -3.102 -17.541
  471    HD2  HIS  61           HD2      HIS  61  -1.091  -5.276 -17.100
  472    HE1  HIS  61           HE1      HIS  61  -3.293  -2.646 -19.629
  473    H    SER  62           H        SER  62  -1.429  -4.970 -12.883
  474    HA   SER  62           HA       SER  62   0.793  -3.381 -14.047
  475    HB2  SER  62           HB2      SER  62  -0.179  -1.830 -12.460
  476    HB3  SER  62           HB3      SER  62  -0.148  -2.977 -11.207
  477    HG   SER  62           HG       SER  62   2.094  -1.829 -12.429
  478    H    MET  63           H        MET  63   2.915  -3.816 -12.856
  479    HA   MET  63           HA       MET  63   3.060  -6.583 -11.776
  480    HB2  MET  63           HB2      MET  63   4.026  -6.526 -14.008
  481    HB3  MET  63           HB3      MET  63   5.082  -5.177 -13.560
  482    HG2  MET  63           HG2      MET  63   6.387  -6.488 -12.137
  483    HG3  MET  63           HG3      MET  63   5.153  -7.743 -11.961
  484    HE1  MET  63           HE1      MET  63   5.481 -10.015 -14.963
  485    HE2  MET  63           HE2      MET  63   5.000  -9.856 -13.262
  486    HE3  MET  63           HE3      MET  63   4.214  -8.858 -14.510
  487    H    VAL  64           H        VAL  64   3.715  -6.641  -9.766
  488    HA   VAL  64           HA       VAL  64   4.827  -4.166  -8.506
  489    HB   VAL  64           HB       VAL  64   2.759  -6.120  -7.448
  490   HG11  VAL  64          HG11      VAL  64   3.904  -3.615  -6.138
  491   HG12  VAL  64          HG12      VAL  64   2.484  -4.512  -5.569
  492   HG13  VAL  64          HG13      VAL  64   4.066  -5.286  -5.554
  493   HG21  VAL  64          HG21      VAL  64   1.812  -4.608  -9.131
  494   HG22  VAL  64          HG22      VAL  64   1.269  -4.105  -7.527
  495   HG23  VAL  64          HG23      VAL  64   2.568  -3.210  -8.347
  496    H    ASP  65           H        ASP  65   6.315  -4.248  -6.966
  497    HA   ASP  65           HA       ASP  65   7.816  -6.779  -6.504
  498    HB2  ASP  65           HB2      ASP  65   9.163  -5.133  -7.529
  499    HB3  ASP  65           HB3      ASP  65   8.519  -3.838  -6.517
  500    H    GLU  66           H        GLU  66   7.539  -7.708  -4.642
  501    HA   GLU  66           HA       GLU  66   6.765  -6.157  -2.203
  502    HB2  GLU  66           HB2      GLU  66   6.125  -9.019  -2.926
  503    HB3  GLU  66           HB3      GLU  66   5.489  -8.086  -1.545
  504    HG2  GLU  66           HG2      GLU  66   4.354  -6.577  -3.219
  505    HG3  GLU  66           HG3      GLU  66   4.834  -7.720  -4.488
  506    H    SER  67           H        SER  67   9.600  -7.030  -3.117
  507    HA   SER  67           HA       SER  67  10.462  -9.259  -1.718
  508    HB2  SER  67           HB2      SER  67  12.696  -8.510  -2.265
  509    HB3  SER  67           HB3      SER  67  11.593  -8.180  -3.608
  510    HG   SER  67           HG       SER  67  12.654  -6.347  -3.385
  511    H    LEU  68           H        LEU  68   9.484  -6.585  -0.011
  512    HA   LEU  68           HA       LEU  68  11.318  -7.189   2.288
  513    HB2  LEU  68           HB2      LEU  68  11.160  -4.764   1.327
  514    HB3  LEU  68           HB3      LEU  68   9.542  -4.746   1.976
  515    HG   LEU  68           HG       LEU  68  10.779  -3.583   3.510
  516   HD11  LEU  68          HD11      LEU  68  10.959  -6.330   4.787
  517   HD12  LEU  68          HD12      LEU  68  10.840  -4.763   5.597
  518   HD13  LEU  68          HD13      LEU  68   9.458  -5.378   4.678
  519   HD21  LEU  68          HD21      LEU  68  13.019  -4.067   2.701
  520   HD22  LEU  68          HD22      LEU  68  12.910  -4.112   4.466
  521   HD23  LEU  68          HD23      LEU  68  12.989  -5.634   3.538
  522    H    ILE  69           H        ILE  69   8.017  -6.638   1.191
  523    HA   ILE  69           HA       ILE  69   6.787  -7.251   3.772
  524    HB   ILE  69           HB       ILE  69   5.396  -6.972   1.088
  525   HG12  ILE  69          HG12      ILE  69   6.670  -4.905   1.584
  526   HG13  ILE  69          HG13      ILE  69   4.939  -4.676   1.590
  527   HG21  ILE  69          HG21      ILE  69   4.428  -6.991   3.979
  528   HG22  ILE  69          HG22      ILE  69   3.465  -6.319   2.663
  529   HG23  ILE  69          HG23      ILE  69   3.910  -8.032   2.640
  530   HD11  ILE  69          HD11      ILE  69   5.973  -3.421   3.390
  531   HD12  ILE  69          HD12      ILE  69   4.904  -4.654   4.059
  532   HD13  ILE  69          HD13      ILE  69   6.670  -4.903   4.084
  533    H    THR  70           H        THR  70   6.553  -8.965   0.596
  534    HA   THR  70           HA       THR  70   5.877 -11.492   2.046
  535    HB   THR  70           HB       THR  70   4.897 -12.266  -0.030
  536    HG1  THR  70           HG1      THR  70   4.743 -10.448  -1.678
  537   HG21  THR  70          HG21      THR  70   3.481 -10.808   1.441
  538   HG22  THR  70          HG22      THR  70   3.912  -9.421   0.410
  539   HG23  THR  70          HG23      THR  70   3.021 -10.798  -0.267
  540    H    GLY  71           H        GLY  71   8.507 -10.011   0.668
  541    HA2  GLY  71           HA2      GLY  71  10.690 -10.799   0.617
  542    HA3  GLY  71           HA3      GLY  71  10.116 -12.428   0.992
  543    H    GLU  72           H        GLU  72   8.431 -11.249  -1.696
  544    HA   GLU  72           HA       GLU  72   9.657 -13.145  -3.487
  545    HB2  GLU  72           HB2      GLU  72   7.609 -10.936  -3.924
  546    HB3  GLU  72           HB3      GLU  72   8.061 -12.124  -5.139
  547    HG2  GLU  72           HG2      GLU  72   6.787 -12.747  -2.442
  548    HG3  GLU  72           HG3      GLU  72   5.957 -12.683  -3.992
  549    H    ALA  73           H        ALA  73  11.661 -12.843  -4.266
  550    HA   ALA  73           HA       ALA  73  12.788 -10.209  -4.776
  551    HB1  ALA  73           HB1      ALA  73  13.822 -13.010  -5.402
  552    HB2  ALA  73           HB2      ALA  73  14.770 -11.507  -5.432
  553    HB3  ALA  73           HB3      ALA  73  14.115 -12.105  -3.897
  554    H    MET  74           H        MET  74  10.865 -12.389  -6.621
  555    HA   MET  74           HA       MET  74  11.425 -10.886  -9.122
  556    HB2  MET  74           HB2      MET  74  11.976 -13.348  -9.129
  557    HB3  MET  74           HB3      MET  74  10.253 -13.678  -8.851
  558    HG2  MET  74           HG2      MET  74   9.670 -12.605 -10.927
  559    HG3  MET  74           HG3      MET  74  11.335 -12.041 -11.152
  560    HE1  MET  74           HE1      MET  74   9.368 -13.651 -13.250
  561    HE2  MET  74           HE2      MET  74  10.927 -12.892 -13.653
  562    HE3  MET  74           HE3      MET  74  10.624 -14.587 -14.088
  563    HA   PRO  75           HA       PRO  75   7.555  -9.182  -8.087
  564    HB2  PRO  75           HB2      PRO  75   6.886  -7.709 -10.248
  565    HB3  PRO  75           HB3      PRO  75   8.366  -7.391  -9.300
  566    HG2  PRO  75           HG2      PRO  75   8.124  -9.044 -11.843
  567    HG3  PRO  75           HG3      PRO  75   9.257  -7.692 -11.520
  568    HD2  PRO  75           HD2      PRO  75   9.957 -10.298 -11.182
  569    HD3  PRO  75           HD3      PRO  75  10.562  -9.039 -10.073
  570    H    VAL  76           H        VAL  76   5.307  -8.887  -8.602
  571    HA   VAL  76           HA       VAL  76   4.082 -11.360  -9.782
  572    HB   VAL  76           HB       VAL  76   3.185  -9.740  -7.360
  573   HG11  VAL  76          HG11      VAL  76   2.229 -12.426  -8.440
  574   HG12  VAL  76          HG12      VAL  76   1.729 -11.699  -6.902
  575   HG13  VAL  76          HG13      VAL  76   1.290 -10.910  -8.416
  576   HG21  VAL  76          HG21      VAL  76   5.271 -10.925  -6.815
  577   HG22  VAL  76          HG22      VAL  76   3.910 -11.718  -6.028
  578   HG23  VAL  76          HG23      VAL  76   4.613 -12.426  -7.500
  579    H    ALA  77           H        ALA  77   2.255 -11.198 -11.042
  580    HA   ALA  77           HA       ALA  77   1.548  -8.501 -12.005
  581    HB1  ALA  77           HB1      ALA  77   0.564 -11.220 -12.929
  582    HB2  ALA  77           HB2      ALA  77   0.306  -9.663 -13.735
  583    HB3  ALA  77           HB3      ALA  77   1.946 -10.327 -13.609
  584    H    LYS  78           H        LYS  78  -0.132  -7.352 -11.389
  585    HA   LYS  78           HA       LYS  78  -2.287  -8.539  -9.668
  586    HB2  LYS  78           HB2      LYS  78  -1.563  -5.623 -10.126
  587    HB3  LYS  78           HB3      LYS  78  -2.761  -6.221  -8.992
  588    HG2  LYS  78           HG2      LYS  78   0.254  -6.689  -8.821
  589    HG3  LYS  78           HG3      LYS  78  -0.668  -5.498  -7.916
  590    HD2  LYS  78           HD2      LYS  78  -1.881  -7.282  -6.720
  591    HD3  LYS  78           HD3      LYS  78  -0.971  -8.518  -7.622
  592    HE2  LYS  78           HE2      LYS  78   1.147  -7.712  -6.692
  593    HE3  LYS  78           HE3      LYS  78   0.341  -6.352  -5.905
  594    HZ1  LYS  78           HZ1      LYS  78  -0.123  -9.203  -5.232
  595    HZ2  LYS  78           HZ2      LYS  78   0.781  -8.146  -4.341
  596    HZ3  LYS  78           HZ3      LYS  78  -0.849  -7.949  -4.492
  597    H    LYS  79           H        LYS  79  -4.540  -8.044 -10.145
  598    HA   LYS  79           HA       LYS  79  -5.196  -7.059 -12.852
  599    HB2  LYS  79           HB2      LYS  79  -6.175  -9.009 -13.589
  600    HB3  LYS  79           HB3      LYS  79  -4.832  -9.667 -12.701
  601    HG2  LYS  79           HG2      LYS  79  -6.354 -10.009 -10.713
  602    HG3  LYS  79           HG3      LYS  79  -7.718  -9.476 -11.700
  603    HD2  LYS  79           HD2      LYS  79  -5.933 -11.843 -12.337
  604    HD3  LYS  79           HD3      LYS  79  -7.507 -11.936 -11.527
  605    HE2  LYS  79           HE2      LYS  79  -8.571 -10.880 -13.551
  606    HE3  LYS  79           HE3      LYS  79  -7.000 -10.943 -14.367
  607    HZ1  LYS  79           HZ1      LYS  79  -8.634 -13.240 -13.458
  608    HZ2  LYS  79           HZ2      LYS  79  -8.194 -12.889 -14.990
  609    HZ3  LYS  79           HZ3      LYS  79  -7.058 -13.401 -13.916
  610    HA   PRO  80           HA       PRO  80  -8.703  -5.480 -10.509
  611    HB2  PRO  80           HB2      PRO  80 -10.909  -5.620 -12.082
  612    HB3  PRO  80           HB3      PRO  80  -9.497  -4.610 -12.515
  613    HG2  PRO  80           HG2      PRO  80 -10.101  -7.427 -13.471
  614    HG3  PRO  80           HG3      PRO  80  -9.716  -5.989 -14.464
  615    HD2  PRO  80           HD2      PRO  80  -7.836  -7.785 -13.761
  616    HD3  PRO  80           HD3      PRO  80  -7.446  -6.044 -13.852
  617    H    GLY  81           H        GLY  81  -8.126  -7.445  -9.198
  618    HA2  GLY  81           HA2      GLY  81 -10.221  -8.686  -7.889
  619    HA3  GLY  81           HA3      GLY  81  -9.774  -9.837  -9.159
  620    H    SER  82           H        SER  82  -7.496  -7.657  -7.366
  621    HA   SER  82           HA       SER  82  -6.033 -10.076  -6.368
  622    HB2  SER  82           HB2      SER  82  -4.899  -7.649  -7.824
  623    HB3  SER  82           HB3      SER  82  -3.921  -8.821  -6.931
  624    HG   SER  82           HG       SER  82  -4.417 -10.390  -8.375
  625    H    THR  83           H        THR  83  -4.792  -9.713  -4.443
  626    HA   THR  83           HA       THR  83  -5.537  -7.246  -2.944
  627    HB   THR  83           HB       THR  83  -4.670  -8.567  -0.948
  628    HG1  THR  83           HG1      THR  83  -3.677 -10.267  -1.760
  629   HG21  THR  83          HG21      THR  83  -7.127  -9.460  -2.526
  630   HG22  THR  83          HG22      THR  83  -6.813  -9.863  -0.824
  631   HG23  THR  83          HG23      THR  83  -7.042  -8.176  -1.305
  632    H    VAL  84           H        VAL  84  -4.123  -5.974  -1.854
  633    HA   VAL  84           HA       VAL  84  -1.233  -6.156  -2.529
  634    HB   VAL  84           HB       VAL  84  -1.262  -3.724  -3.054
  635   HG11  VAL  84          HG11      VAL  84  -3.000  -5.392  -4.917
  636   HG12  VAL  84          HG12      VAL  84  -2.065  -3.942  -5.341
  637   HG13  VAL  84          HG13      VAL  84  -1.225  -5.410  -4.839
  638   HG21  VAL  84          HG21      VAL  84  -3.428  -3.080  -2.012
  639   HG22  VAL  84          HG22      VAL  84  -3.330  -2.608  -3.713
  640   HG23  VAL  84          HG23      VAL  84  -4.292  -4.019  -3.248
  641    H    ILE  85           H        ILE  85   0.163  -5.053  -1.215
  642    HA   ILE  85           HA       ILE  85  -0.892  -4.187   1.431
  643    HB   ILE  85           HB       ILE  85   1.390  -5.234   2.289
  644   HG12  ILE  85          HG12      ILE  85   1.808  -7.469   1.362
  645   HG13  ILE  85          HG13      ILE  85   0.636  -7.221   0.080
  646   HG21  ILE  85          HG21      ILE  85  -0.800  -5.710   3.196
  647   HG22  ILE  85          HG22      ILE  85  -1.179  -6.794   1.837
  648   HG23  ILE  85          HG23      ILE  85   0.105  -7.205   2.998
  649   HD11  ILE  85          HD11      ILE  85   2.032  -5.541  -0.965
  650   HD12  ILE  85          HD12      ILE  85   3.137  -5.515   0.417
  651   HD13  ILE  85          HD13      ILE  85   3.038  -6.957  -0.619
  652    H    ALA  86           H        ALA  86   0.232  -2.747   2.632
  653    HA   ALA  86           HA       ALA  86   1.195  -0.555   1.182
  654    HB1  ALA  86           HB1      ALA  86   0.062  -0.503   3.406
  655    HB2  ALA  86           HB2      ALA  86   1.545  -1.125   4.153
  656    HB3  ALA  86           HB3      ALA  86   1.541   0.470   3.361
  657    H    GLY  87           H        GLY  87   3.192   0.350   0.825
  658    HA2  GLY  87           HA2      GLY  87   5.499   0.592   0.816
  659    HA3  GLY  87           HA3      GLY  87   5.658  -0.758   1.935
  660    H    SER  88           H        SER  88   3.812  -1.823  -0.692
  661    HA   SER  88           HA       SER  88   6.141  -3.073  -2.035
  662    HB2  SER  88           HB2      SER  88   4.512  -4.243  -3.417
  663    HB3  SER  88           HB3      SER  88   4.314  -4.553  -1.692
  664    HG   SER  88           HG       SER  88   2.485  -3.232  -1.679
  665    H    ILE  89           H        ILE  89   6.540  -2.825  -4.312
  666    HA   ILE  89           HA       ILE  89   6.085   0.016  -5.104
  667    HB   ILE  89           HB       ILE  89   8.386  -1.549  -6.197
  668   HG12  ILE  89          HG12      ILE  89   8.650  -2.052  -3.831
  669   HG13  ILE  89          HG13      ILE  89   9.901  -0.999  -4.447
  670   HG21  ILE  89          HG21      ILE  89   7.965   0.639  -7.116
  671   HG22  ILE  89          HG22      ILE  89   7.852   1.369  -5.513
  672   HG23  ILE  89          HG23      ILE  89   9.412   0.751  -6.107
  673   HD11  ILE  89          HD11      ILE  89   8.931   0.940  -3.337
  674   HD12  ILE  89          HD12      ILE  89   7.540  -0.025  -2.789
  675   HD13  ILE  89          HD13      ILE  89   9.166  -0.375  -2.178
  676    H    ASN  90           H        ASN  90   5.336   0.604  -7.023
  677    HA   ASN  90           HA       ASN  90   4.362  -1.410  -8.946
  678    HB2  ASN  90           HB2      ASN  90   3.009   0.513  -8.062
  679    HB3  ASN  90           HB3      ASN  90   4.131   1.635  -8.817
  680   HD21  ASN  90          HD22      ASN  90   1.152   0.709  -9.183
  681   HD22  ASN  90          HD21      ASN  90   1.046   0.591 -10.939
  682    H    GLN  91           H        GLN  91   5.369  -1.899 -10.879
  683    HA   GLN  91           HA       GLN  91   7.730  -0.369 -11.753
  684    HB2  GLN  91           HB2      GLN  91   7.696  -2.831 -11.920
  685    HB3  GLN  91           HB3      GLN  91   6.278  -2.761 -12.965
  686    HG2  GLN  91           HG2      GLN  91   8.250  -3.090 -14.326
  687    HG3  GLN  91           HG3      GLN  91   7.602  -1.485 -14.666
  688   HE21  GLN  91          HE22      GLN  91  10.167  -3.263 -12.849
  689   HE22  GLN  91          HE21      GLN  91  11.252  -1.890 -12.774
  690    H    ASN  92           H        ASN  92   4.806  -1.417 -13.543
  691    HA   ASN  92           HA       ASN  92   4.055   1.288 -14.315
  692    HB2  ASN  92           HB2      ASN  92   5.617   0.682 -16.094
  693    HB3  ASN  92           HB3      ASN  92   4.865  -0.890 -16.275
  694   HD21  ASN  92          HD22      ASN  92   3.350  -1.078 -17.859
  695   HD22  ASN  92          HD21      ASN  92   2.441   0.274 -18.531
  696    H    GLY  93           H        GLY  93   1.747   1.195 -15.192
  697    HA2  GLY  93           HA2      GLY  93  -0.248   0.095 -15.496
  698    HA3  GLY  93           HA3      GLY  93   0.192  -1.089 -14.291
  699    H    SER  94           H        SER  94  -1.551   1.791 -14.846
  700    HA   SER  94           HA       SER  94  -1.467   2.677 -12.011
  701    HB2  SER  94           HB2      SER  94  -1.488   4.418 -13.735
  702    HB3  SER  94           HB3      SER  94  -3.043   3.817 -14.337
  703    HG   SER  94           HG       SER  94  -2.572   4.647 -11.637
  704    H    LEU  95           H        LEU  95  -2.884   2.038 -10.514
  705    HA   LEU  95           HA       LEU  95  -5.331   0.513 -11.332
  706    HB2  LEU  95           HB2      LEU  95  -3.813   0.040  -8.793
  707    HB3  LEU  95           HB3      LEU  95  -4.910  -1.031  -9.609
  708    HG   LEU  95           HG       LEU  95  -2.061  -0.379 -10.496
  709   HD11  LEU  95          HD11      LEU  95  -1.461  -2.521  -9.577
  710   HD12  LEU  95          HD12      LEU  95  -2.290  -1.610  -8.311
  711   HD13  LEU  95          HD13      LEU  95  -3.149  -2.893  -9.185
  712   HD21  LEU  95          HD21      LEU  95  -3.483  -1.092 -12.369
  713   HD22  LEU  95          HD22      LEU  95  -2.384  -2.397 -11.908
  714   HD23  LEU  95          HD23      LEU  95  -4.084  -2.466 -11.407
  715    H    LEU  96           H        LEU  96  -7.030   0.414  -9.683
  716    HA   LEU  96           HA       LEU  96  -6.951   2.630  -7.667
  717    HB2  LEU  96           HB2      LEU  96  -9.371   1.636  -9.196
  718    HB3  LEU  96           HB3      LEU  96  -9.453   2.508  -7.680
  719    HG   LEU  96           HG       LEU  96  -8.169   4.414  -8.765
  720   HD11  LEU  96          HD11      LEU  96  -8.853   2.837 -11.286
  721   HD12  LEU  96          HD12      LEU  96  -8.472   4.562 -11.278
  722   HD13  LEU  96          HD13      LEU  96  -7.247   3.403 -10.777
  723   HD21  LEU  96          HD21      LEU  96 -10.600   4.466  -8.358
  724   HD22  LEU  96          HD22      LEU  96 -10.195   5.289  -9.869
  725   HD23  LEU  96          HD23      LEU  96 -10.887   3.654  -9.914
  726    H    ILE  97           H        ILE  97  -6.902   2.016  -5.688
  727    HA   ILE  97           HA       ILE  97  -7.447  -0.812  -4.961
  728    HB   ILE  97           HB       ILE  97  -5.743   1.242  -3.491
  729   HG12  ILE  97          HG12      ILE  97  -3.863  -0.381  -4.241
  730   HG13  ILE  97          HG13      ILE  97  -4.962  -0.872  -5.520
  731   HG21  ILE  97          HG21      ILE  97  -4.890  -0.728  -2.264
  732   HG22  ILE  97          HG22      ILE  97  -6.628  -0.579  -2.044
  733   HG23  ILE  97          HG23      ILE  97  -5.981  -1.787  -3.177
  734   HD11  ILE  97          HD11      ILE  97  -3.231   0.828  -6.144
  735   HD12  ILE  97          HD12      ILE  97  -4.859   1.397  -6.478
  736   HD13  ILE  97          HD13      ILE  97  -3.993   1.985  -5.037
  737    H    CYS  98           H        CYS  98  -9.132  -1.273  -3.602
  738    HA   CYS  98           HA       CYS  98 -10.417   0.949  -2.088
  739    HB2  CYS  98           HB2      CYS  98 -12.148  -0.708  -1.554
  740    HB3  CYS  98           HB3      CYS  98 -12.005  -0.345  -3.273
  741    HG   CYS  98           HG       CYS  98 -12.629  -2.890  -2.726
  742    H    ALA  99           H        ALA  99  -9.460   1.458  -0.278
  743    HA   ALA  99           HA       ALA  99  -7.658  -0.385   1.095
  744    HB1  ALA  99           HB1      ALA  99  -8.531   2.462   1.748
  745    HB2  ALA  99           HB2      ALA  99  -7.203   1.569   2.522
  746    HB3  ALA  99           HB3      ALA  99  -7.100   1.990   0.798
  747    H    THR 100           H        THR 100  -8.010  -1.543   2.880
  748    HA   THR 100           HA       THR 100 -10.620  -1.250   4.346
  749    HB   THR 100           HB       THR 100 -10.011  -3.849   4.776
  750    HG1  THR 100           HG1      THR 100  -8.925  -4.735   3.245
  751   HG21  THR 100          HG21      THR 100 -11.404  -2.702   2.329
  752   HG22  THR 100          HG22      THR 100 -11.550  -4.381   2.899
  753   HG23  THR 100          HG23      THR 100 -12.137  -3.051   3.908
  754    H    HIS 101           H        HIS 101  -7.377  -0.759   4.922
  755    HA   HIS 101           HA       HIS 101  -7.932  -0.769   7.814
  756    HB2  HIS 101           HB2      HIS 101  -5.395  -1.877   6.537
  757    HB3  HIS 101           HB3      HIS 101  -5.683  -1.690   8.267
  758    HD1  HIS 101           HD1      HIS 101  -6.354  -4.082   5.421
  759    HD2  HIS 101           HD2      HIS 101  -7.566  -3.375   9.380
  760    HE1  HIS 101           HE1      HIS 101  -7.722  -6.117   6.132
  761    H    VAL 102           H        VAL 102  -6.958   0.909   8.953
  762    HA   VAL 102           HA       VAL 102  -5.545   3.024   7.422
  763    HB   VAL 102           HB       VAL 102  -5.551   4.287   9.560
  764   HG11  VAL 102          HG11      VAL 102  -8.269   3.381   8.545
  765   HG12  VAL 102          HG12      VAL 102  -7.920   4.873   9.441
  766   HG13  VAL 102          HG13      VAL 102  -7.232   4.639   7.826
  767   HG21  VAL 102          HG21      VAL 102  -5.749   2.406  11.171
  768   HG22  VAL 102          HG22      VAL 102  -7.017   3.619  11.383
  769   HG23  VAL 102          HG23      VAL 102  -7.401   2.087  10.586
  770    H    GLY 103           H        GLY 103  -3.462   4.030   8.723
  771    HA2  GLY 103           HA2      GLY 103  -1.552   1.963   8.050
  772    HA3  GLY 103           HA3      GLY 103  -1.210   3.586   8.583
  773    H    ALA 104           H        ALA 104  -2.643   3.441  11.158
  774    HA   ALA 104           HA       ALA 104  -0.652   2.120  12.765
  775    HB1  ALA 104           HB1      ALA 104  -3.386   3.217  13.525
  776    HB2  ALA 104           HB2      ALA 104  -2.016   2.920  14.616
  777    HB3  ALA 104           HB3      ALA 104  -1.894   4.182  13.389
  778    H    ASP 105           H        ASP 105  -3.626   1.010  11.381
  779    HA   ASP 105           HA       ASP 105  -3.973  -1.342  13.136
  780    HB2  ASP 105           HB2      ASP 105  -5.867   0.100  12.080
  781    HB3  ASP 105           HB3      ASP 105  -5.550  -0.855  10.633
  782    H    THR 106           H        THR 106  -1.871  -0.648  10.613
  783    HA   THR 106           HA       THR 106  -2.172  -3.039   8.995
  784    HB   THR 106           HB       THR 106   0.010  -2.457   8.021
  785    HG1  THR 106           HG1      THR 106   0.079  -0.149   9.571
  786   HG21  THR 106          HG21      THR 106  -1.938  -0.168   8.216
  787   HG22  THR 106          HG22      THR 106  -0.559  -0.233   7.090
  788   HG23  THR 106          HG23      THR 106  -1.864  -1.432   6.988
  789    H    THR 107           H        THR 107  -0.641  -4.732   8.738
  790    HA   THR 107           HA       THR 107   0.364  -5.908  11.184
  791    HB   THR 107           HB       THR 107  -0.368  -7.186   9.161
  792    HG1  THR 107           HG1      THR 107   0.692  -8.333  10.642
  793   HG21  THR 107          HG21      THR 107   0.964  -5.865   7.450
  794   HG22  THR 107          HG22      THR 107   2.426  -6.667   8.083
  795   HG23  THR 107          HG23      THR 107   1.119  -7.619   7.362
  796    H    LEU 108           H        LEU 108   1.857  -3.847   8.685
  797    HA   LEU 108           HA       LEU 108   4.582  -4.059   9.422
  798    HB2  LEU 108           HB2      LEU 108   2.940  -1.663   8.472
  799    HB3  LEU 108           HB3      LEU 108   4.681  -1.629   8.670
  800    HG   LEU 108           HG       LEU 108   4.987  -3.257   6.857
  801   HD11  LEU 108          HD11      LEU 108   1.957  -3.132   6.573
  802   HD12  LEU 108          HD12      LEU 108   3.057  -3.717   5.308
  803   HD13  LEU 108          HD13      LEU 108   2.975  -4.583   6.840
  804   HD21  LEU 108          HD21      LEU 108   4.931  -0.838   6.468
  805   HD22  LEU 108          HD22      LEU 108   4.258  -1.704   5.073
  806   HD23  LEU 108          HD23      LEU 108   3.167  -0.906   6.239
  807    H    SER 109           H        SER 109   2.157  -1.697  10.628
  808    HA   SER 109           HA       SER 109   3.749  -0.656  12.746
  809    HB2  SER 109           HB2      SER 109   0.737  -0.706  12.364
  810    HB3  SER 109           HB3      SER 109   1.613   0.318  13.525
  811    HG   SER 109           HG       SER 109   1.076   1.038  11.152
  812    H    GLN 110           H        GLN 110   1.565  -3.427  12.597
  813    HA   GLN 110           HA       GLN 110   1.401  -3.963  15.420
  814    HB2  GLN 110           HB2      GLN 110   0.001  -4.990  13.530
  815    HB3  GLN 110           HB3      GLN 110   1.359  -6.043  13.198
  816    HG2  GLN 110           HG2      GLN 110  -0.122  -7.305  14.499
  817    HG3  GLN 110           HG3      GLN 110   1.222  -6.905  15.572
  818   HE21  GLN 110          HE22      GLN 110  -1.976  -5.606  14.514
  819   HE22  GLN 110          HE21      GLN 110  -2.313  -4.842  16.043
  820    H    ILE 111           H        ILE 111   3.736  -5.027  12.960
  821    HA   ILE 111           HA       ILE 111   5.321  -6.753  14.581
  822    HB   ILE 111           HB       ILE 111   5.918  -5.210  12.033
  823   HG12  ILE 111          HG12      ILE 111   5.503  -8.209  12.390
  824   HG13  ILE 111          HG13      ILE 111   4.159  -7.121  12.115
  825   HG21  ILE 111          HG21      ILE 111   7.887  -6.702  11.720
  826   HG22  ILE 111          HG22      ILE 111   8.092  -5.656  13.109
  827   HG23  ILE 111          HG23      ILE 111   7.643  -7.360  13.346
  828   HD11  ILE 111          HD11      ILE 111   6.475  -7.583  10.200
  829   HD12  ILE 111          HD12      ILE 111   4.784  -8.069  10.004
  830   HD13  ILE 111          HD13      ILE 111   5.210  -6.348   9.982
  831    H    VAL 112           H        VAL 112   5.973  -3.296  13.698
  832    HA   VAL 112           HA       VAL 112   8.329  -3.184  15.258
  833    HB   VAL 112           HB       VAL 112   8.303  -0.781  15.149
  834   HG11  VAL 112          HG11      VAL 112   7.286  -1.975  12.551
  835   HG12  VAL 112          HG12      VAL 112   8.271  -0.509  12.743
  836   HG13  VAL 112          HG13      VAL 112   8.957  -2.087  13.156
  837   HG21  VAL 112          HG21      VAL 112   5.930  -0.272  15.588
  838   HG22  VAL 112          HG22      VAL 112   6.485   0.478  14.094
  839   HG23  VAL 112          HG23      VAL 112   5.491  -0.988  14.020
  840    H    LYS 113           H        LYS 113   5.026  -2.761  16.433
  841    HA   LYS 113           HA       LYS 113   5.895  -1.915  19.089
  842    HB2  LYS 113           HB2      LYS 113   3.294  -3.155  18.084
  843    HB3  LYS 113           HB3      LYS 113   3.576  -2.633  19.746
  844    HG2  LYS 113           HG2      LYS 113   4.192  -0.319  18.787
  845    HG3  LYS 113           HG3      LYS 113   3.554  -0.895  17.253
  846    HD2  LYS 113           HD2      LYS 113   1.752   0.246  18.220
  847    HD3  LYS 113           HD3      LYS 113   1.380  -1.463  18.514
  848    HE2  LYS 113           HE2      LYS 113   2.484  -1.201  20.786
  849    HE3  LYS 113           HE3      LYS 113   2.679   0.523  20.428
  850    HZ1  LYS 113           HZ1      LYS 113   0.231   0.647  20.228
  851    HZ2  LYS 113           HZ2      LYS 113   0.109  -0.945  20.601
  852    HZ3  LYS 113           HZ3      LYS 113   0.659   0.091  21.737
  853    H    LEU 114           H        LEU 114   5.383  -5.077  17.596
  854    HA   LEU 114           HA       LEU 114   5.539  -6.606  20.052
  855    HB2  LEU 114           HB2      LEU 114   4.431  -7.041  17.633
  856    HB3  LEU 114           HB3      LEU 114   5.966  -7.860  17.357
  857    HG   LEU 114           HG       LEU 114   3.929  -8.433  19.543
  858   HD11  LEU 114          HD11      LEU 114   4.778 -10.020  17.079
  859   HD12  LEU 114          HD12      LEU 114   3.601 -10.529  18.305
  860   HD13  LEU 114          HD13      LEU 114   3.245  -9.132  17.278
  861   HD21  LEU 114          HD21      LEU 114   6.105  -8.992  20.431
  862   HD22  LEU 114          HD22      LEU 114   5.339 -10.496  19.933
  863   HD23  LEU 114          HD23      LEU 114   6.589  -9.768  18.895
  864    H    VAL 115           H        VAL 115   7.841  -6.210  17.282
  865    HA   VAL 115           HA       VAL 115   9.871  -7.881  18.511
  866    HB   VAL 115           HB       VAL 115  10.082  -5.836  16.264
  867   HG11  VAL 115          HG11      VAL 115  11.978  -8.091  17.067
  868   HG12  VAL 115          HG12      VAL 115  12.068  -7.178  15.545
  869   HG13  VAL 115          HG13      VAL 115  12.336  -6.349  17.076
  870   HG21  VAL 115          HG21      VAL 115   9.688  -8.864  16.188
  871   HG22  VAL 115          HG22      VAL 115   8.470  -7.646  15.751
  872   HG23  VAL 115          HG23      VAL 115   9.930  -7.813  14.776
  873    H    GLU 116           H        GLU 116   9.048  -4.579  18.957
  874    HA   GLU 116           HA       GLU 116  11.528  -3.674  20.208
  875    HB2  GLU 116           HB2      GLU 116   9.839  -2.209  19.128
  876    HB3  GLU 116           HB3      GLU 116   8.665  -2.657  20.366
  877    HG2  GLU 116           HG2      GLU 116  10.179  -1.602  22.081
  878    HG3  GLU 116           HG3      GLU 116  11.269  -1.121  20.765
  879    H    GLU 117           H        GLU 117   8.718  -5.551  21.315
  880    HA   GLU 117           HA       GLU 117   9.111  -5.073  24.139
  881    HB2  GLU 117           HB2      GLU 117   7.714  -7.337  22.670
  882    HB3  GLU 117           HB3      GLU 117   7.715  -7.165  24.404
  883    HG2  GLU 117           HG2      GLU 117   6.847  -4.722  22.913
  884    HG3  GLU 117           HG3      GLU 117   5.798  -6.125  22.776
  885    H    ALA 118           H        ALA 118  10.819  -7.303  21.929
  886    HA   ALA 118           HA       ALA 118  11.497  -9.212  23.985
  887    HB1  ALA 118           HB1      ALA 118  13.042 -10.051  22.232
  888    HB2  ALA 118           HB2      ALA 118  11.405  -9.800  21.608
  889    HB3  ALA 118           HB3      ALA 118  12.672  -8.626  21.223
  890    H    GLN 119           H        GLN 119  13.511  -6.789  22.288
  891    HA   GLN 119           HA       GLN 119  15.575  -6.501  24.063
  892    HB2  GLN 119           HB2      GLN 119  14.221  -4.404  22.374
  893    HB3  GLN 119           HB3      GLN 119  15.711  -4.100  23.253
  894    HG2  GLN 119           HG2      GLN 119  16.409  -4.651  21.089
  895    HG3  GLN 119           HG3      GLN 119  16.728  -6.119  22.044
  896   HE21  GLN 119          HE22      GLN 119  14.297  -4.518  20.000
  897   HE22  GLN 119          HE21      GLN 119  13.463  -6.026  19.655
  Start of MODEL   20
    1    H    SER   1           H        SER   1  19.346  -4.380  12.860
    2    HA   SER   1           HA       SER   1  16.722  -3.367  13.749
    3    HB2  SER   1           HB2      SER   1  19.539  -2.370  14.292
    4    HB3  SER   1           HB3      SER   1  18.060  -1.777  15.076
    5    HG   SER   1           HG       SER   1  17.712  -3.832  15.930
    6    H    GLU   2           H        GLU   2  19.035  -2.486  11.261
    7    HA   GLU   2           HA       GLU   2  17.909   0.197  10.785
    8    HB2  GLU   2           HB2      GLU   2  19.620  -1.451   8.876
    9    HB3  GLU   2           HB3      GLU   2  19.264   0.258   8.811
   10    HG2  GLU   2           HG2      GLU   2  21.504   0.044   9.548
   11    HG3  GLU   2           HG3      GLU   2  20.556   0.603  10.924
   12    H    ALA   3           H        ALA   3  17.662  -3.088   9.370
   13    HA   ALA   3           HA       ALA   3  15.664  -2.537   7.442
   14    HB1  ALA   3           HB1      ALA   3  15.373  -4.977   7.447
   15    HB2  ALA   3           HB2      ALA   3  17.093  -4.544   7.513
   16    HB3  ALA   3           HB3      ALA   3  16.260  -5.100   8.982
   17    H    LEU   4           H        LEU   4  15.347  -3.330  10.914
   18    HA   LEU   4           HA       LEU   4  12.477  -3.607  10.892
   19    HB2  LEU   4           HB2      LEU   4  14.026  -4.433  12.710
   20    HB3  LEU   4           HB3      LEU   4  14.269  -2.765  13.199
   21    HG   LEU   4           HG       LEU   4  11.845  -2.566  13.733
   22   HD11  LEU   4          HD11      LEU   4  11.877  -5.525  13.048
   23   HD12  LEU   4          HD12      LEU   4  10.554  -4.706  13.927
   24   HD13  LEU   4          HD13      LEU   4  10.918  -4.261  12.253
   25   HD21  LEU   4          HD21      LEU   4  13.260  -4.907  15.074
   26   HD22  LEU   4          HD22      LEU   4  13.500  -3.185  15.452
   27   HD23  LEU   4          HD23      LEU   4  11.928  -3.940  15.754
   28    H    ALA   5           H        ALA   5  14.583  -0.785  10.934
   29    HA   ALA   5           HA       ALA   5  12.412   1.127  11.464
   30    HB1  ALA   5           HB1      ALA   5  14.175   2.777  10.945
   31    HB2  ALA   5           HB2      ALA   5  14.668   1.657  12.226
   32    HB3  ALA   5           HB3      ALA   5  15.311   1.475  10.581
   33    H    LYS   6           H        LYS   6  14.220  -0.200   8.663
   34    HA   LYS   6           HA       LYS   6  13.216   1.471   6.646
   35    HB2  LYS   6           HB2      LYS   6  15.136  -0.097   6.417
   36    HB3  LYS   6           HB3      LYS   6  13.992  -1.451   6.339
   37    HG2  LYS   6           HG2      LYS   6  12.973  -0.522   4.318
   38    HG3  LYS   6           HG3      LYS   6  14.019   0.904   4.407
   39    HD2  LYS   6           HD2      LYS   6  15.996  -0.502   3.968
   40    HD3  LYS   6           HD3      LYS   6  14.982  -1.967   3.986
   41    HE2  LYS   6           HE2      LYS   6  13.631  -1.038   2.108
   42    HE3  LYS   6           HE3      LYS   6  14.650   0.402   2.087
   43    HZ1  LYS   6           HZ1      LYS   6  15.246  -1.232   0.392
   44    HZ2  LYS   6           HZ2      LYS   6  16.525  -0.987   1.428
   45    HZ3  LYS   6           HZ3      LYS   6  15.610  -2.359   1.483
   46    H    LEU   7           H        LEU   7  11.670  -1.467   7.961
   47    HA   LEU   7           HA       LEU   7   9.504  -1.767   6.216
   48    HB2  LEU   7           HB2      LEU   7   9.924  -2.197   9.171
   49    HB3  LEU   7           HB3      LEU   7   8.264  -2.127   8.636
   50    HG   LEU   7           HG       LEU   7   9.008  -4.402   8.813
   51   HD11  LEU   7          HD11      LEU   7   8.561  -3.703   5.886
   52   HD12  LEU   7          HD12      LEU   7   8.232  -5.249   6.690
   53   HD13  LEU   7          HD13      LEU   7   7.293  -3.815   7.129
   54   HD21  LEU   7          HD21      LEU   7  11.370  -4.219   8.317
   55   HD22  LEU   7          HD22      LEU   7  10.614  -5.394   7.227
   56   HD23  LEU   7          HD23      LEU   7  11.029  -3.773   6.634
   57    H    ILE   8           H        ILE   8   9.606   0.523   8.973
   58    HA   ILE   8           HA       ILE   8   7.087   1.763   8.204
   59    HB   ILE   8           HB       ILE   8   9.178   2.506  10.253
   60   HG12  ILE   8          HG12      ILE   8   8.042   0.455  10.804
   61   HG13  ILE   8          HG13      ILE   8   7.484   1.728  11.876
   62   HG21  ILE   8          HG21      ILE   8   6.449   3.804   9.861
   63   HG22  ILE   8          HG22      ILE   8   7.541   4.063  11.228
   64   HG23  ILE   8          HG23      ILE   8   8.022   4.571   9.609
   65   HD11  ILE   8          HD11      ILE   8   5.949   0.493   9.546
   66   HD12  ILE   8          HD12      ILE   8   5.602   0.347  11.269
   67   HD13  ILE   8          HD13      ILE   8   5.379   1.904  10.466
   68    H    SER   9           H        SER   9  10.500   2.523   7.534
   69    HA   SER   9           HA       SER   9  10.167   5.188   6.560
   70    HB2  SER   9           HB2      SER   9  12.141   3.038   5.709
   71    HB3  SER   9           HB3      SER   9  12.250   4.742   5.282
   72    HG   SER   9           HG       SER   9  12.682   5.304   7.307
   73    H    LEU  10           H        LEU  10   9.591   2.049   5.025
   74    HA   LEU  10           HA       LEU  10   9.566   2.800   2.327
   75    HB2  LEU  10           HB2      LEU  10   8.765   0.498   3.947
   76    HB3  LEU  10           HB3      LEU  10   7.536   0.815   2.747
   77    HG   LEU  10           HG       LEU  10   9.411   0.874   0.986
   78   HD11  LEU  10          HD11      LEU  10  10.886  -0.465   3.291
   79   HD12  LEU  10          HD12      LEU  10  11.463  -0.359   1.606
   80   HD13  LEU  10          HD13      LEU  10  11.307   1.111   2.587
   81   HD21  LEU  10          HD21      LEU  10   7.887  -1.024   1.190
   82   HD22  LEU  10          HD22      LEU  10   9.525  -1.612   0.890
   83   HD23  LEU  10          HD23      LEU  10   8.837  -1.690   2.534
   84    H    GLN  11           H        GLN  11   7.150   3.747   4.690
   85    HA   GLN  11           HA       GLN  11   4.812   3.587   3.097
   86    HB2  GLN  11           HB2      GLN  11   5.597   5.019   5.604
   87    HB3  GLN  11           HB3      GLN  11   4.009   5.269   4.857
   88    HG2  GLN  11           HG2      GLN  11   3.561   2.848   4.901
   89    HG3  GLN  11           HG3      GLN  11   5.162   2.564   5.617
   90   HE21  GLN  11          HE22      GLN  11   5.613   3.721   7.705
   91   HE22  GLN  11          HE21      GLN  11   4.249   3.826   8.826
   92    H    ALA  12           H        ALA  12   3.388   5.450   2.523
   93    HA   ALA  12           HA       ALA  12   4.898   7.164   0.631
   94    HB1  ALA  12           HB1      ALA  12   1.947   6.437   0.780
   95    HB2  ALA  12           HB2      ALA  12   2.785   7.189  -0.589
   96    HB3  ALA  12           HB3      ALA  12   3.166   5.520  -0.128
   97    H    THR  13           H        THR  13   2.576   7.479   3.271
   98    HA   THR  13           HA       THR  13   1.942   9.139   4.620
   99    HB   THR  13           HB       THR  13   3.984  11.073   3.592
  100    HG1  THR  13           HG1      THR  13   5.541  10.065   4.738
  101   HG21  THR  13          HG21      THR  13   3.037  10.313   6.390
  102   HG22  THR  13          HG22      THR  13   4.235  11.569   5.994
  103   HG23  THR  13          HG23      THR  13   2.555  11.767   5.496
  104    H    GLU  14           H        GLU  14   1.820   9.753   1.282
  105    HA   GLU  14           HA       GLU  14  -0.568  11.449   1.685
  106    HB2  GLU  14           HB2      GLU  14   0.059  13.012  -0.029
  107    HB3  GLU  14           HB3      GLU  14   1.277  12.996   1.245
  108    HG2  GLU  14           HG2      GLU  14   2.701  11.529  -0.204
  109    HG3  GLU  14           HG3      GLU  14   1.512  11.692  -1.501
  110    H    ALA  15           H        ALA  15  -2.136  11.331  -0.052
  111    HA   ALA  15           HA       ALA  15  -1.848   9.048  -1.909
  112    HB1  ALA  15           HB1      ALA  15  -3.982   9.194   0.270
  113    HB2  ALA  15           HB2      ALA  15  -3.829   7.935  -0.975
  114    HB3  ALA  15           HB3      ALA  15  -2.582   8.100   0.276
  115    H    THR  16           H        THR  16  -3.807   8.775  -3.191
  116    HA   THR  16           HA       THR  16  -5.356  11.322  -3.674
  117    HB   THR  16           HB       THR  16  -4.584   9.305  -5.784
  118    HG1  THR  16           HG1      THR  16  -2.950  10.459  -6.200
  119   HG21  THR  16          HG21      THR  16  -6.622  10.556  -6.342
  120   HG22  THR  16          HG22      THR  16  -5.803  12.093  -5.985
  121   HG23  THR  16          HG23      THR  16  -5.271  11.092  -7.354
  122    H    ILE  17           H        ILE  17  -7.443  11.196  -3.315
  123    HA   ILE  17           HA       ILE  17  -8.890   8.593  -3.161
  124    HB   ILE  17           HB       ILE  17  -9.800  11.389  -2.320
  125   HG12  ILE  17          HG12      ILE  17  -8.610   9.123  -0.661
  126   HG13  ILE  17          HG13      ILE  17  -7.890  10.705  -0.944
  127   HG21  ILE  17          HG21      ILE  17 -10.975   8.622  -1.749
  128   HG22  ILE  17          HG22      ILE  17 -11.571  10.155  -1.078
  129   HG23  ILE  17          HG23      ILE  17 -11.695   9.870  -2.786
  130   HD11  ILE  17          HD11      ILE  17  -9.833  11.745   0.294
  131   HD12  ILE  17          HD12      ILE  17 -10.335  10.098   0.754
  132   HD13  ILE  17          HD13      ILE  17  -8.771  10.712   1.275
  133    H    VAL  18           H        VAL  18 -10.696   8.128  -4.499
  134    HA   VAL  18           HA       VAL  18 -11.368  10.155  -6.606
  135    HB   VAL  18           HB       VAL  18 -11.798   7.178  -6.813
  136   HG11  VAL  18          HG11      VAL  18 -13.320   8.484  -8.211
  137   HG12  VAL  18          HG12      VAL  18 -11.964   9.436  -8.844
  138   HG13  VAL  18          HG13      VAL  18 -12.100   7.703  -9.219
  139   HG21  VAL  18          HG21      VAL  18  -9.926   7.215  -8.452
  140   HG22  VAL  18          HG22      VAL  18  -9.511   8.847  -7.855
  141   HG23  VAL  18          HG23      VAL  18  -9.429   7.447  -6.775
  142    H    THR  19           H        THR  19 -13.266  11.052  -6.531
  143    HA   THR  19           HA       THR  19 -15.546   9.861  -4.956
  144    HB   THR  19           HB       THR  19 -14.632  12.763  -4.868
  145    HG1  THR  19           HG1      THR  19 -13.170  11.367  -3.873
  146   HG21  THR  19          HG21      THR  19 -16.645  11.198  -3.197
  147   HG22  THR  19          HG22      THR  19 -16.026  12.810  -2.778
  148   HG23  THR  19          HG23      THR  19 -16.969  12.597  -4.251
  149    H    LEU  20           H        LEU  20 -17.722  10.600  -5.586
  150    HA   LEU  20           HA       LEU  20 -17.886  11.472  -8.391
  151    HB2  LEU  20           HB2      LEU  20 -20.146  10.997  -6.412
  152    HB3  LEU  20           HB3      LEU  20 -20.303  11.277  -8.130
  153    HG   LEU  20           HG       LEU  20 -18.882   8.849  -6.946
  154   HD11  LEU  20          HD11      LEU  20 -21.688   9.153  -8.092
  155   HD12  LEU  20          HD12      LEU  20 -20.905   7.615  -7.653
  156   HD13  LEU  20          HD13      LEU  20 -21.262   8.814  -6.405
  157   HD21  LEU  20          HD21      LEU  20 -18.101   9.389  -9.210
  158   HD22  LEU  20          HD22      LEU  20 -19.122   7.951  -9.249
  159   HD23  LEU  20          HD23      LEU  20 -19.771   9.523  -9.790
  160    H    ASP  21           H        ASP  21 -18.539  13.378  -9.141
  161    HA   ASP  21           HA       ASP  21 -19.191  15.577  -7.198
  162    HB2  ASP  21           HB2      ASP  21 -17.111  15.492  -9.224
  163    HB3  ASP  21           HB3      ASP  21 -18.277  16.753  -9.617
  164    H    SER  22           H        SER  22 -20.388  13.689  -9.564
  165    HA   SER  22           HA       SER  22 -22.924  15.047  -9.567
  166    HB2  SER  22           HB2      SER  22 -21.674  14.661 -12.310
  167    HB3  SER  22           HB3      SER  22 -23.356  15.086 -11.983
  168    HG   SER  22           HG       SER  22 -22.398  16.973 -10.810
  169    H    ASP  23           H        ASP  23 -24.498  13.732  -9.846
  170    HA   ASP  23           HA       ASP  23 -24.724  11.364  -8.898
  171    HB2  ASP  23           HB2      ASP  23 -26.565  12.836  -9.484
  172    HB3  ASP  23           HB3      ASP  23 -26.473  12.357 -11.176
  173    H    ASN  24           H        ASN  24 -22.832  10.283  -9.683
  174    HA   ASN  24           HA       ASN  24 -21.847   8.317 -10.375
  175    HB2  ASN  24           HB2      ASN  24 -24.181   7.672 -12.208
  176    HB3  ASN  24           HB3      ASN  24 -22.961   6.573 -11.581
  177   HD21  ASN  24          HD22      ASN  24 -23.076   6.298  -9.104
  178   HD22  ASN  24          HD21      ASN  24 -24.708   6.518  -8.438
  179    H    ILE  25           H        ILE  25 -23.227  10.589 -12.574
  180    HA   ILE  25           HA       ILE  25 -21.852   9.914 -14.918
  181    HB   ILE  25           HB       ILE  25 -22.962  12.043 -15.667
  182   HG12  ILE  25          HG12      ILE  25 -24.089  12.237 -12.888
  183   HG13  ILE  25          HG13      ILE  25 -22.846  13.280 -13.579
  184   HG21  ILE  25          HG21      ILE  25 -24.689   9.991 -14.183
  185   HG22  ILE  25          HG22      ILE  25 -25.212  11.011 -15.540
  186   HG23  ILE  25          HG23      ILE  25 -23.978   9.768 -15.771
  187   HD11  ILE  25          HD11      ILE  25 -24.441  13.997 -15.348
  188   HD12  ILE  25          HD12      ILE  25 -25.711  13.020 -14.570
  189   HD13  ILE  25          HD13      ILE  25 -24.994  14.388 -13.709
  190    H    LEU  26           H        LEU  26 -20.735  11.884 -12.277
  191    HA   LEU  26           HA       LEU  26 -18.313  12.348 -13.915
  192    HB2  LEU  26           HB2      LEU  26 -19.634  14.405 -13.927
  193    HB3  LEU  26           HB3      LEU  26 -19.462  14.528 -12.172
  194    HG   LEU  26           HG       LEU  26 -16.902  14.080 -13.691
  195   HD11  LEU  26          HD11      LEU  26 -18.415  16.685 -13.855
  196   HD12  LEU  26          HD12      LEU  26 -16.712  16.418 -14.320
  197   HD13  LEU  26          HD13      LEU  26 -18.019  15.574 -15.199
  198   HD21  LEU  26          HD21      LEU  26 -17.010  14.547 -11.221
  199   HD22  LEU  26          HD22      LEU  26 -16.047  15.712 -12.126
  200   HD23  LEU  26          HD23      LEU  26 -17.681  16.152 -11.622
  201    H    LEU  27           H        LEU  27 -16.597  11.950 -13.080
  202    HA   LEU  27           HA       LEU  27 -16.151  11.334 -10.156
  203    HB2  LEU  27           HB2      LEU  27 -14.761  10.246 -12.636
  204    HB3  LEU  27           HB3      LEU  27 -14.066  10.141 -11.029
  205    HG   LEU  27           HG       LEU  27 -16.048   8.845 -10.243
  206   HD11  LEU  27          HD11      LEU  27 -17.379   7.649 -12.019
  207   HD12  LEU  27          HD12      LEU  27 -17.786   9.354 -11.871
  208   HD13  LEU  27          HD13      LEU  27 -16.752   8.806 -13.213
  209   HD21  LEU  27          HD21      LEU  27 -13.924   7.795 -10.933
  210   HD22  LEU  27          HD22      LEU  27 -15.310   6.768 -11.309
  211   HD23  LEU  27          HD23      LEU  27 -14.514   7.691 -12.605
  212    H    SER  28           H        SER  28 -14.512  12.281  -9.070
  213    HA   SER  28           HA       SER  28 -12.448  13.906 -10.515
  214    HB2  SER  28           HB2      SER  28 -14.043  15.509  -9.673
  215    HB3  SER  28           HB3      SER  28 -14.068  14.763  -8.088
  216    HG   SER  28           HG       SER  28 -12.312  15.849  -7.577
  217    H    GLU  29           H        GLU  29 -10.329  13.870  -9.555
  218    HA   GLU  29           HA       GLU  29 -10.055  11.993  -7.277
  219    HB2  GLU  29           HB2      GLU  29  -7.789  12.505  -9.165
  220    HB3  GLU  29           HB3      GLU  29  -8.011  11.275  -7.940
  221    HG2  GLU  29           HG2      GLU  29  -8.466   9.910  -9.603
  222    HG3  GLU  29           HG3      GLU  29 -10.081  10.561  -9.484
  223    H    GLU  30           H        GLU  30  -9.107  12.688  -5.477
  224    HA   GLU  30           HA       GLU  30  -8.304  15.564  -5.254
  225    HB2  GLU  30           HB2      GLU  30  -9.555  13.801  -3.118
  226    HB3  GLU  30           HB3      GLU  30  -9.381  15.542  -3.096
  227    HG2  GLU  30           HG2      GLU  30 -11.263  13.929  -4.889
  228    HG3  GLU  30           HG3      GLU  30 -11.689  14.688  -3.379
  229    H    GLN  31           H        GLN  31  -6.238  15.969  -4.190
  230    HA   GLN  31           HA       GLN  31  -4.843  13.541  -3.236
  231    HB2  GLN  31           HB2      GLN  31  -3.722  16.296  -3.806
  232    HB3  GLN  31           HB3      GLN  31  -2.839  14.828  -3.350
  233    HG2  GLN  31           HG2      GLN  31  -4.048  13.793  -5.469
  234    HG3  GLN  31           HG3      GLN  31  -4.079  15.492  -6.008
  235   HE21  GLN  31          HE22      GLN  31  -2.340  12.656  -5.478
  236   HE22  GLN  31          HE21      GLN  31  -0.988  13.432  -4.826
  237    H    VAL  32           H        VAL  32  -4.172  13.213  -1.252
  238    HA   VAL  32           HA       VAL  32  -4.849  15.128   0.945
  239    HB   VAL  32           HB       VAL  32  -5.887  13.318   2.195
  240   HG11  VAL  32          HG11      VAL  32  -7.246  13.565  -0.506
  241   HG12  VAL  32          HG12      VAL  32  -7.988  13.182   1.061
  242   HG13  VAL  32          HG13      VAL  32  -7.298  14.782   0.791
  243   HG21  VAL  32          HG21      VAL  32  -4.741  11.362   1.185
  244   HG22  VAL  32          HG22      VAL  32  -6.491  11.183   1.226
  245   HG23  VAL  32          HG23      VAL  32  -5.688  11.597  -0.303
  246    H    ASP  33           H        ASP  33  -4.111  14.488   3.029
  247    HA   ASP  33           HA       ASP  33  -1.427  13.214   3.154
  248    HB2  ASP  33           HB2      ASP  33  -1.823  15.332   4.359
  249    HB3  ASP  33           HB3      ASP  33  -3.102  14.570   5.300
  250    H    VAL  34           H        VAL  34  -1.033  11.334   4.441
  251    HA   VAL  34           HA       VAL  34  -2.944   9.250   4.288
  252    HB   VAL  34           HB       VAL  34  -0.491   8.989   4.384
  253   HG11  VAL  34          HG11      VAL  34  -0.800   9.338   7.397
  254   HG12  VAL  34          HG12      VAL  34   0.669   8.860   6.539
  255   HG13  VAL  34          HG13      VAL  34   0.006  10.484   6.305
  256   HG21  VAL  34          HG21      VAL  34  -0.444   6.867   5.490
  257   HG22  VAL  34          HG22      VAL  34  -1.880   7.251   6.444
  258   HG23  VAL  34          HG23      VAL  34  -2.009   7.049   4.681
  259    H    GLU  35           H        GLU  35  -2.694  11.669   6.799
  260    HA   GLU  35           HA       GLU  35  -4.228  10.239   8.813
  261    HB2  GLU  35           HB2      GLU  35  -3.632  13.107   8.349
  262    HB3  GLU  35           HB3      GLU  35  -4.556  12.541   9.736
  263    HG2  GLU  35           HG2      GLU  35  -2.664  11.161  10.484
  264    HG3  GLU  35           HG3      GLU  35  -1.710  11.647   9.075
  265    H    LEU  36           H        LEU  36  -5.156  11.911   5.881
  266    HA   LEU  36           HA       LEU  36  -7.915  12.409   6.849
  267    HB2  LEU  36           HB2      LEU  36  -6.578  13.294   4.287
  268    HB3  LEU  36           HB3      LEU  36  -8.064  13.929   4.986
  269    HG   LEU  36           HG       LEU  36  -5.246  14.246   6.116
  270   HD11  LEU  36          HD11      LEU  36  -7.150  16.284   4.909
  271   HD12  LEU  36          HD12      LEU  36  -5.522  16.596   5.555
  272   HD13  LEU  36          HD13      LEU  36  -5.718  15.600   4.106
  273   HD21  LEU  36          HD21      LEU  36  -6.828  14.169   7.981
  274   HD22  LEU  36          HD22      LEU  36  -6.255  15.820   7.729
  275   HD23  LEU  36          HD23      LEU  36  -7.880  15.355   7.166
  276    H    VAL  37           H        VAL  37  -6.439   9.917   5.215
  277    HA   VAL  37           HA       VAL  37  -8.813   9.170   3.586
  278    HB   VAL  37           HB       VAL  37  -6.802   8.810   2.411
  279   HG11  VAL  37          HG11      VAL  37  -5.131   8.788   4.178
  280   HG12  VAL  37          HG12      VAL  37  -5.735   7.235   4.794
  281   HG13  VAL  37          HG13      VAL  37  -4.966   7.334   3.193
  282   HG21  VAL  37          HG21      VAL  37  -8.460   7.028   2.189
  283   HG22  VAL  37          HG22      VAL  37  -6.810   6.415   1.982
  284   HG23  VAL  37          HG23      VAL  37  -7.675   6.099   3.491
  285    H    GLN  38           H        GLN  38 -10.138   7.481   4.156
  286    HA   GLN  38           HA       GLN  38  -9.740   6.304   6.885
  287    HB2  GLN  38           HB2      GLN  38 -12.101   6.294   7.201
  288    HB3  GLN  38           HB3      GLN  38 -11.596   7.929   6.825
  289    HG2  GLN  38           HG2      GLN  38 -12.753   7.947   4.788
  290    HG3  GLN  38           HG3      GLN  38 -12.635   6.203   4.558
  291   HE21  GLN  38          HE22      GLN  38 -14.262   8.592   6.626
  292   HE22  GLN  38          HE21      GLN  38 -15.568   7.456   7.015
  293    H    ARG  39           H        ARG  39 -10.907   4.316   7.268
  294    HA   ARG  39           HA       ARG  39 -10.243   2.224   5.410
  295    HB2  ARG  39           HB2      ARG  39 -10.932   0.744   7.139
  296    HB3  ARG  39           HB3      ARG  39 -10.196   2.139   7.925
  297    HG2  ARG  39           HG2      ARG  39 -12.632   3.033   8.202
  298    HG3  ARG  39           HG3      ARG  39 -13.125   1.381   7.754
  299    HD2  ARG  39           HD2      ARG  39 -11.526   0.579   9.592
  300    HD3  ARG  39           HD3      ARG  39 -11.408   2.250  10.082
  301    HE   ARG  39           HE       ARG  39 -13.752   2.195  10.746
  302   HH11  ARG  39          HH11      ARG  39 -12.669  -1.058   9.749
  303   HH12  ARG  39          HH12      ARG  39 -14.191  -1.734  10.278
  304   HH21  ARG  39          HH21      ARG  39 -15.523   1.175  11.428
  305   HH22  ARG  39          HH22      ARG  39 -15.692  -0.580  11.175
  306    H    GLY  40           H        GLY  40 -12.109   4.041   4.235
  307    HA2  GLY  40           HA2      GLY  40 -13.943   2.127   3.002
  308    HA3  GLY  40           HA3      GLY  40 -14.736   3.469   3.841
  309    H    ASP  41           H        ASP  41 -11.677   4.420   2.449
  310    HA   ASP  41           HA       ASP  41 -13.091   5.866   0.275
  311    HB2  ASP  41           HB2      ASP  41 -10.336   6.097   1.509
  312    HB3  ASP  41           HB3      ASP  41 -10.843   7.021   0.095
  313    H    ILE  42           H        ILE  42 -12.412   5.869  -1.889
  314    HA   ILE  42           HA       ILE  42 -10.951   3.429  -2.810
  315    HB   ILE  42           HB       ILE  42 -12.762   5.302  -4.346
  316   HG12  ILE  42          HG12      ILE  42 -14.107   4.007  -2.803
  317   HG13  ILE  42          HG13      ILE  42 -14.330   3.428  -4.439
  318   HG21  ILE  42          HG21      ILE  42 -11.323   2.743  -5.182
  319   HG22  ILE  42          HG22      ILE  42 -12.606   3.542  -6.122
  320   HG23  ILE  42          HG23      ILE  42 -11.078   4.377  -5.827
  321   HD11  ILE  42          HD11      ILE  42 -12.675   2.053  -2.285
  322   HD12  ILE  42          HD12      ILE  42 -14.268   1.564  -2.876
  323   HD13  ILE  42          HD13      ILE  42 -12.870   1.469  -3.959
  324    H    ILE  43           H        ILE  43  -8.843   3.701  -3.262
  325    HA   ILE  43           HA       ILE  43  -7.784   6.326  -3.886
  326    HB   ILE  43           HB       ILE  43  -6.533   3.681  -3.056
  327   HG12  ILE  43          HG12      ILE  43  -7.942   4.442  -1.264
  328   HG13  ILE  43          HG13      ILE  43  -6.275   4.699  -0.811
  329   HG21  ILE  43          HG21      ILE  43  -5.188   6.397  -3.175
  330   HG22  ILE  43          HG22      ILE  43  -4.545   4.982  -2.335
  331   HG23  ILE  43          HG23      ILE  43  -4.754   4.923  -4.074
  332   HD11  ILE  43          HD11      ILE  43  -6.500   7.134  -1.341
  333   HD12  ILE  43          HD12      ILE  43  -8.204   6.859  -1.781
  334   HD13  ILE  43          HD13      ILE  43  -7.674   6.588  -0.130
  335    H    LYS  44           H        LYS  44  -5.825   6.357  -5.248
  336    HA   LYS  44           HA       LYS  44  -5.997   4.812  -7.776
  337    HB2  LYS  44           HB2      LYS  44  -7.430   6.757  -8.181
  338    HB3  LYS  44           HB3      LYS  44  -6.045   7.833  -7.884
  339    HG2  LYS  44           HG2      LYS  44  -4.795   6.774  -9.706
  340    HG3  LYS  44           HG3      LYS  44  -6.061   5.555  -9.926
  341    HD2  LYS  44           HD2      LYS  44  -6.473   8.527 -10.356
  342    HD3  LYS  44           HD3      LYS  44  -5.964   7.370 -11.607
  343    HE2  LYS  44           HE2      LYS  44  -8.040   6.020 -11.035
  344    HE3  LYS  44           HE3      LYS  44  -8.619   7.430 -10.132
  345    HZ1  LYS  44           HZ1      LYS  44  -8.608   8.702 -12.169
  346    HZ2  LYS  44           HZ2      LYS  44  -7.815   7.509 -12.989
  347    HZ3  LYS  44           HZ3      LYS  44  -9.347   7.259 -12.523
  348    H    VAL  45           H        VAL  45  -3.997   4.166  -8.370
  349    HA   VAL  45           HA       VAL  45  -1.643   5.722  -7.391
  350    HB   VAL  45           HB       VAL  45  -2.235   3.448  -6.345
  351   HG11  VAL  45          HG11      VAL  45  -0.854   2.393  -8.853
  352   HG12  VAL  45          HG12      VAL  45  -1.326   1.465  -7.416
  353   HG13  VAL  45          HG13      VAL  45  -2.567   2.195  -8.452
  354   HG21  VAL  45          HG21      VAL  45  -0.071   4.637  -6.001
  355   HG22  VAL  45          HG22      VAL  45   0.146   2.882  -6.059
  356   HG23  VAL  45          HG23      VAL  45   0.587   3.868  -7.464
  357    H    VAL  46           H        VAL  46  -0.011   6.239  -8.708
  358    HA   VAL  46           HA       VAL  46  -0.232   5.647 -11.578
  359    HB   VAL  46           HB       VAL  46   1.425   7.371 -11.907
  360   HG11  VAL  46          HG11      VAL  46  -0.952   8.021 -11.610
  361   HG12  VAL  46          HG12      VAL  46  -0.635   8.335  -9.888
  362   HG13  VAL  46          HG13      VAL  46   0.187   9.289 -11.133
  363   HG21  VAL  46          HG21      VAL  46   2.894   7.045  -9.967
  364   HG22  VAL  46          HG22      VAL  46   2.333   8.715 -10.068
  365   HG23  VAL  46          HG23      VAL  46   1.612   7.617  -8.878
  366    HA   PRO  47           HA       PRO  47   3.104   2.711 -11.827
  367    HB2  PRO  47           HB2      PRO  47   4.311   4.128 -14.147
  368    HB3  PRO  47           HB3      PRO  47   3.668   2.467 -14.046
  369    HG2  PRO  47           HG2      PRO  47   2.339   4.479 -15.366
  370    HG3  PRO  47           HG3      PRO  47   1.485   3.170 -14.496
  371    HD2  PRO  47           HD2      PRO  47   2.002   5.987 -13.595
  372    HD3  PRO  47           HD3      PRO  47   0.543   4.967 -13.408
  373    H    GLY  48           H        GLY  48   5.089   2.482 -10.853
  374    HA2  GLY  48           HA2      GLY  48   7.161   3.028  -9.970
  375    HA3  GLY  48           HA3      GLY  48   7.001   4.689 -10.536
  376    H    GLY  49           H        GLY  49   4.132   4.366  -9.059
  377    HA2  GLY  49           HA2      GLY  49   4.992   5.748  -6.629
  378    HA3  GLY  49           HA3      GLY  49   3.346   5.491  -7.192
  379    H    LYS  50           H        LYS  50   3.693   5.303  -4.609
  380    HA   LYS  50           HA       LYS  50   4.040   2.438  -3.808
  381    HB2  LYS  50           HB2      LYS  50   4.088   5.037  -2.235
  382    HB3  LYS  50           HB3      LYS  50   4.246   3.425  -1.523
  383    HG2  LYS  50           HG2      LYS  50   6.309   3.023  -2.772
  384    HG3  LYS  50           HG3      LYS  50   6.189   4.617  -3.562
  385    HD2  LYS  50           HD2      LYS  50   6.349   5.758  -1.410
  386    HD3  LYS  50           HD3      LYS  50   6.255   4.209  -0.555
  387    HE2  LYS  50           HE2      LYS  50   8.386   3.518  -1.715
  388    HE3  LYS  50           HE3      LYS  50   8.531   5.167  -2.344
  389    HZ1  LYS  50           HZ1      LYS  50   9.745   4.842  -0.212
  390    HZ2  LYS  50           HZ2      LYS  50   8.593   5.983  -0.049
  391    HZ3  LYS  50           HZ3      LYS  50   8.318   4.469   0.532
  392    H    PHE  51           H        PHE  51   2.655   1.431  -2.391
  393    HA   PHE  51           HA       PHE  51  -0.160   2.299  -2.403
  394    HB2  PHE  51           HB2      PHE  51   1.169  -0.159  -1.235
  395    HB3  PHE  51           HB3      PHE  51  -0.565   0.155  -1.240
  396    HD1  PHE  51           HD2      PHE  51  -1.787   0.359  -3.472
  397    HD2  PHE  51           HD1      PHE  51   2.266  -1.058  -3.168
  398    HE1  PHE  51           HE2      PHE  51  -1.958  -0.633  -5.749
  399    HE2  PHE  51           HE1      PHE  51   2.132  -1.955  -5.462
  400    HZ   PHE  51           HZ       PHE  51   0.013  -1.770  -6.760
  401    HA   PRO  52           HA       PRO  52   0.795   4.411   1.417
  402    HB2  PRO  52           HB2      PRO  52  -1.443   5.918   1.753
  403    HB3  PRO  52           HB3      PRO  52  -0.330   6.159   0.374
  404    HG2  PRO  52           HG2      PRO  52  -2.908   4.559   0.407
  405    HG3  PRO  52           HG3      PRO  52  -2.396   5.810  -0.772
  406    HD2  PRO  52           HD2      PRO  52  -2.040   3.142  -1.239
  407    HD3  PRO  52           HD3      PRO  52  -0.865   4.373  -1.795
  408    H    VAL  53           H        VAL  53  -1.743   2.056   1.378
  409    HA   VAL  53           HA       VAL  53  -1.727   1.559   4.175
  410    HB   VAL  53           HB       VAL  53  -4.196   1.630   4.504
  411   HG11  VAL  53          HG11      VAL  53  -3.011   4.400   4.154
  412   HG12  VAL  53          HG12      VAL  53  -4.325   3.903   5.236
  413   HG13  VAL  53          HG13      VAL  53  -2.678   3.317   5.522
  414   HG21  VAL  53          HG21      VAL  53  -4.210   3.546   2.145
  415   HG22  VAL  53          HG22      VAL  53  -4.901   1.905   2.144
  416   HG23  VAL  53          HG23      VAL  53  -5.573   3.154   3.210
  417    H    ASP  54           H        ASP  54  -3.134  -0.458   4.596
  418    HA   ASP  54           HA       ASP  54  -2.599  -2.238   2.305
  419    HB2  ASP  54           HB2      ASP  54  -2.068  -3.824   3.652
  420    HB3  ASP  54           HB3      ASP  54  -1.749  -2.522   4.764
  421    H    GLY  55           H        GLY  55  -4.052  -3.541   1.250
  422    HA2  GLY  55           HA2      GLY  55  -6.756  -4.040   1.864
  423    HA3  GLY  55           HA3      GLY  55  -6.709  -2.491   1.023
  424    H    ARG  56           H        ARG  56  -8.057  -3.643  -0.508
  425    HA   ARG  56           HA       ARG  56  -6.708  -5.579  -2.306
  426    HB2  ARG  56           HB2      ARG  56  -8.697  -6.281  -1.071
  427    HB3  ARG  56           HB3      ARG  56  -9.619  -4.965  -1.792
  428    HG2  ARG  56           HG2      ARG  56  -9.438  -6.004  -4.013
  429    HG3  ARG  56           HG3      ARG  56  -8.381  -7.263  -3.362
  430    HD2  ARG  56           HD2      ARG  56 -10.689  -8.089  -3.620
  431    HD3  ARG  56           HD3      ARG  56 -10.130  -8.123  -1.950
  432    HE   ARG  56           HE       ARG  56 -11.512  -6.217  -1.422
  433   HH11  ARG  56          HH11      ARG  56 -12.445  -7.621  -4.583
  434   HH12  ARG  56          HH12      ARG  56 -13.908  -6.666  -4.550
  435   HH21  ARG  56          HH21      ARG  56 -13.489  -5.163  -1.577
  436   HH22  ARG  56          HH22      ARG  56 -14.531  -5.594  -2.910
  437    H    VAL  57           H        VAL  57  -6.498  -5.346  -4.406
  438    HA   VAL  57           HA       VAL  57  -6.867  -2.719  -5.731
  439    HB   VAL  57           HB       VAL  57  -5.431  -5.243  -6.667
  440   HG11  VAL  57          HG11      VAL  57  -5.431  -2.396  -7.769
  441   HG12  VAL  57          HG12      VAL  57  -4.385  -3.719  -8.332
  442   HG13  VAL  57          HG13      VAL  57  -6.123  -3.833  -8.557
  443   HG21  VAL  57          HG21      VAL  57  -4.238  -4.312  -4.734
  444   HG22  VAL  57          HG22      VAL  57  -3.330  -4.011  -6.216
  445   HG23  VAL  57          HG23      VAL  57  -4.262  -2.696  -5.470
  446    H    ILE  58           H        ILE  58  -8.406  -2.456  -7.279
  447    HA   ILE  58           HA       ILE  58  -9.904  -4.816  -8.346
  448    HB   ILE  58           HB       ILE  58 -12.053  -3.500  -7.799
  449   HG12  ILE  58          HG12      ILE  58 -10.296  -2.330  -5.611
  450   HG13  ILE  58          HG13      ILE  58 -10.675  -1.418  -7.089
  451   HG21  ILE  58          HG21      ILE  58 -11.315  -5.638  -6.708
  452   HG22  ILE  58          HG22      ILE  58 -10.575  -4.662  -5.421
  453   HG23  ILE  58          HG23      ILE  58 -12.323  -4.596  -5.702
  454   HD11  ILE  58          HD11      ILE  58 -12.708  -2.392  -5.043
  455   HD12  ILE  58          HD12      ILE  58 -12.199  -0.721  -5.357
  456   HD13  ILE  58          HD13      ILE  58 -13.102  -1.608  -6.597
  457    H    GLU  59           H        GLU  59  -8.007  -2.910  -9.554
  458    HA   GLU  59           HA       GLU  59  -9.358  -2.823 -12.086
  459    HB2  GLU  59           HB2      GLU  59 -10.132  -0.619 -11.046
  460    HB3  GLU  59           HB3      GLU  59  -8.439  -0.169 -10.882
  461    HG2  GLU  59           HG2      GLU  59  -9.370   0.888 -12.837
  462    HG3  GLU  59           HG3      GLU  59  -8.160  -0.272 -13.352
  463    H    GLY  60           H        GLY  60  -7.762  -3.238 -13.617
  464    HA2  GLY  60           HA2      GLY  60  -5.780  -2.813 -14.760
  465    HA3  GLY  60           HA3      GLY  60  -5.173  -1.896 -13.399
  466    H    HIS  61           H        HIS  61  -3.294  -3.081 -14.291
  467    HA   HIS  61           HA       HIS  61  -2.803  -5.688 -12.928
  468    HB2  HIS  61           HB2      HIS  61  -1.942  -6.689 -15.031
  469    HB3  HIS  61           HB3      HIS  61  -3.677  -6.428 -14.999
  470    HD1  HIS  61           HD1      HIS  61  -4.668  -4.555 -16.682
  471    HD2  HIS  61           HD2      HIS  61  -0.561  -5.441 -16.976
  472    HE1  HIS  61           HE1      HIS  61  -3.871  -3.536 -18.883
  473    H    SER  62           H        SER  62  -0.850  -5.817 -12.032
  474    HA   SER  62           HA       SER  62   1.430  -4.428 -13.192
  475    HB2  SER  62           HB2      SER  62   0.149  -3.485 -10.630
  476    HB3  SER  62           HB3      SER  62   1.870  -3.206 -10.886
  477    HG   SER  62           HG       SER  62  -0.015  -2.566 -12.900
  478    H    MET  63           H        MET  63   3.488  -4.644 -11.961
  479    HA   MET  63           HA       MET  63   3.587  -7.126 -10.326
  480    HB2  MET  63           HB2      MET  63   4.557  -7.477 -12.534
  481    HB3  MET  63           HB3      MET  63   5.640  -6.097 -12.322
  482    HG2  MET  63           HG2      MET  63   6.911  -7.176 -10.693
  483    HG3  MET  63           HG3      MET  63   5.651  -8.357 -10.306
  484    HE1  MET  63           HE1      MET  63   5.337 -10.618 -11.371
  485    HE2  MET  63           HE2      MET  63   4.730  -9.809 -12.837
  486    HE3  MET  63           HE3      MET  63   5.953 -11.088 -12.968
  487    H    VAL  64           H        VAL  64   4.068  -6.733  -8.318
  488    HA   VAL  64           HA       VAL  64   4.988  -4.019  -7.513
  489    HB   VAL  64           HB       VAL  64   3.214  -6.082  -6.166
  490   HG11  VAL  64          HG11      VAL  64   4.087  -3.376  -5.073
  491   HG12  VAL  64          HG12      VAL  64   2.794  -4.398  -4.410
  492   HG13  VAL  64          HG13      VAL  64   4.458  -4.972  -4.382
  493   HG21  VAL  64          HG21      VAL  64   2.092  -4.849  -7.946
  494   HG22  VAL  64          HG22      VAL  64   1.529  -4.227  -6.388
  495   HG23  VAL  64          HG23      VAL  64   2.717  -3.306  -7.329
  496    H    ASP  65           H        ASP  65   6.661  -3.636  -6.186
  497    HA   ASP  65           HA       ASP  65   8.510  -5.837  -5.587
  498    HB2  ASP  65           HB2      ASP  65   9.193  -3.768  -6.787
  499    HB3  ASP  65           HB3      ASP  65   8.753  -2.808  -5.377
  500    H    GLU  66           H        GLU  66   7.019  -6.782  -3.989
  501    HA   GLU  66           HA       GLU  66   6.868  -5.380  -1.371
  502    HB2  GLU  66           HB2      GLU  66   5.313  -7.136  -0.719
  503    HB3  GLU  66           HB3      GLU  66   4.773  -6.309  -2.179
  504    HG2  GLU  66           HG2      GLU  66   5.472  -8.165  -3.573
  505    HG3  GLU  66           HG3      GLU  66   6.256  -8.971  -2.209
  506    H    SER  67           H        SER  67   9.246  -7.094  -2.819
  507    HA   SER  67           HA       SER  67   9.656  -9.356  -1.286
  508    HB2  SER  67           HB2      SER  67  12.042  -7.841  -2.319
  509    HB3  SER  67           HB3      SER  67  11.656  -9.550  -2.348
  510    HG   SER  67           HG       SER  67  11.443  -7.949  -4.294
  511    H    LEU  68           H        LEU  68  10.533  -6.055  -0.342
  512    HA   LEU  68           HA       LEU  68  12.270  -6.938   1.838
  513    HB2  LEU  68           HB2      LEU  68  12.463  -4.784   0.652
  514    HB3  LEU  68           HB3      LEU  68  10.884  -4.280   1.206
  515    HG   LEU  68           HG       LEU  68  12.985  -3.278   2.245
  516   HD11  LEU  68          HD11      LEU  68  10.941  -4.340   4.215
  517   HD12  LEU  68          HD12      LEU  68  12.018  -2.952   4.421
  518   HD13  LEU  68          HD13      LEU  68  10.754  -2.913   3.182
  519   HD21  LEU  68          HD21      LEU  68  14.099  -4.353   4.048
  520   HD22  LEU  68          HD22      LEU  68  13.017  -5.749   4.005
  521   HD23  LEU  68          HD23      LEU  68  14.141  -5.463   2.668
  522    H    ILE  69           H        ILE  69   8.854  -6.835   1.434
  523    HA   ILE  69           HA       ILE  69   8.313  -6.753   4.351
  524    HB   ILE  69           HB       ILE  69   6.179  -7.303   2.303
  525   HG12  ILE  69          HG12      ILE  69   7.373  -5.221   1.458
  526   HG13  ILE  69          HG13      ILE  69   5.669  -5.144   1.755
  527   HG21  ILE  69          HG21      ILE  69   4.842  -6.102   4.125
  528   HG22  ILE  69          HG22      ILE  69   5.616  -7.609   4.622
  529   HG23  ILE  69          HG23      ILE  69   6.316  -6.046   5.077
  530   HD11  ILE  69          HD11      ILE  69   6.737  -3.102   2.487
  531   HD12  ILE  69          HD12      ILE  69   5.982  -3.949   3.832
  532   HD13  ILE  69          HD13      ILE  69   7.757  -4.018   3.632
  533    H    THR  70           H        THR  70   7.885  -8.960   1.540
  534    HA   THR  70           HA       THR  70   7.194 -11.199   3.375
  535    HB   THR  70           HB       THR  70   6.460 -12.330   1.269
  536    HG1  THR  70           HG1      THR  70   6.124 -10.633  -0.434
  537   HG21  THR  70          HG21      THR  70   4.451 -11.050   0.999
  538   HG22  THR  70          HG22      THR  70   4.914 -10.948   2.702
  539   HG23  THR  70          HG23      THR  70   5.215  -9.570   1.617
  540    H    GLY  71           H        GLY  71   9.958 -10.139   1.748
  541    HA2  GLY  71           HA2      GLY  71  12.080 -10.989   1.866
  542    HA3  GLY  71           HA3      GLY  71  11.465 -12.448   2.660
  543    H    GLU  72           H        GLU  72   9.663 -12.270  -0.113
  544    HA   GLU  72           HA       GLU  72  10.773 -14.492  -1.392
  545    HB2  GLU  72           HB2      GLU  72   9.093 -12.285  -2.627
  546    HB3  GLU  72           HB3      GLU  72   9.306 -13.884  -3.321
  547    HG2  GLU  72           HG2      GLU  72   7.954 -13.351  -0.641
  548    HG3  GLU  72           HG3      GLU  72   7.130 -13.489  -2.177
  549    H    ALA  73           H        ALA  73  12.501 -11.839  -1.334
  550    HA   ALA  73           HA       ALA  73  13.592 -10.269  -2.642
  551    HB1  ALA  73           HB1      ALA  73  14.963 -12.890  -3.166
  552    HB2  ALA  73           HB2      ALA  73  15.676 -11.268  -2.980
  553    HB3  ALA  73           HB3      ALA  73  14.921 -12.050  -1.591
  554    H    MET  74           H        MET  74  11.324 -11.021  -4.217
  555    HA   MET  74           HA       MET  74  12.130 -10.275  -6.881
  556    HB2  MET  74           HB2      MET  74  12.756 -12.424  -7.341
  557    HB3  MET  74           HB3      MET  74  11.754 -13.128  -6.100
  558    HG2  MET  74           HG2      MET  74   9.844 -13.120  -7.283
  559    HG3  MET  74           HG3      MET  74  10.441 -12.050  -8.563
  560    HE1  MET  74           HE1      MET  74  11.424 -12.856 -10.773
  561    HE2  MET  74           HE2      MET  74  12.896 -12.938  -9.790
  562    HE3  MET  74           HE3      MET  74  12.476 -14.279 -10.881
  563    HA   PRO  75           HA       PRO  75   8.152  -8.591  -6.184
  564    HB2  PRO  75           HB2      PRO  75   7.476  -7.588  -8.623
  565    HB3  PRO  75           HB3      PRO  75   8.852  -6.970  -7.670
  566    HG2  PRO  75           HG2      PRO  75   8.953  -9.055  -9.885
  567    HG3  PRO  75           HG3      PRO  75   9.924  -7.550  -9.743
  568    HD2  PRO  75           HD2      PRO  75  10.917  -9.920  -8.862
  569    HD3  PRO  75           HD3      PRO  75  11.168  -8.421  -7.916
  570    H    VAL  76           H        VAL  76   5.897  -8.573  -6.720
  571    HA   VAL  76           HA       VAL  76   4.868 -11.269  -7.573
  572    HB   VAL  76           HB       VAL  76   3.917  -9.506  -5.283
  573   HG11  VAL  76          HG11      VAL  76   2.070 -10.884  -6.173
  574   HG12  VAL  76          HG12      VAL  76   3.099 -12.334  -6.093
  575   HG13  VAL  76          HG13      VAL  76   2.603 -11.504  -4.607
  576   HG21  VAL  76          HG21      VAL  76   6.110 -10.565  -4.753
  577   HG22  VAL  76          HG22      VAL  76   4.806 -11.277  -3.807
  578   HG23  VAL  76          HG23      VAL  76   5.435 -12.148  -5.207
  579    H    ALA  77           H        ALA  77   3.078 -11.378  -8.853
  580    HA   ALA  77           HA       ALA  77   2.235  -8.919 -10.176
  581    HB1  ALA  77           HB1      ALA  77   1.376 -11.793 -10.604
  582    HB2  ALA  77           HB2      ALA  77   1.061 -10.426 -11.693
  583    HB3  ALA  77           HB3      ALA  77   2.723 -10.983 -11.427
  584    H    LYS  78           H        LYS  78   0.354  -7.919 -10.129
  585    HA   LYS  78           HA       LYS  78  -1.873  -8.823  -8.327
  586    HB2  LYS  78           HB2      LYS  78  -0.970  -5.957  -8.783
  587    HB3  LYS  78           HB3      LYS  78  -2.200  -6.509  -7.648
  588    HG2  LYS  78           HG2      LYS  78   0.779  -7.131  -7.468
  589    HG3  LYS  78           HG3      LYS  78  -0.057  -5.861  -6.593
  590    HD2  LYS  78           HD2      LYS  78  -1.349  -7.488  -5.315
  591    HD3  LYS  78           HD3      LYS  78  -0.694  -8.829  -6.274
  592    HE2  LYS  78           HE2      LYS  78   1.593  -8.302  -5.518
  593    HE3  LYS  78           HE3      LYS  78   0.982  -6.940  -4.566
  594    HZ1  LYS  78           HZ1      LYS  78   0.228  -9.773  -4.116
  595    HZ2  LYS  78           HZ2      LYS  78   1.348  -8.923  -3.236
  596    HZ3  LYS  78           HZ3      LYS  78  -0.241  -8.477  -3.197
  597    H    LYS  79           H        LYS  79  -3.984  -8.116  -8.859
  598    HA   LYS  79           HA       LYS  79  -4.724  -7.235 -11.548
  599    HB2  LYS  79           HB2      LYS  79  -5.927  -9.369 -12.016
  600    HB3  LYS  79           HB3      LYS  79  -4.186  -9.566 -11.981
  601    HG2  LYS  79           HG2      LYS  79  -4.282 -10.635  -9.793
  602    HG3  LYS  79           HG3      LYS  79  -5.988 -10.221  -9.608
  603    HD2  LYS  79           HD2      LYS  79  -5.693 -12.572 -10.183
  604    HD3  LYS  79           HD3      LYS  79  -6.621 -11.701 -11.407
  605    HE2  LYS  79           HE2      LYS  79  -4.688 -11.611 -12.900
  606    HE3  LYS  79           HE3      LYS  79  -3.646 -12.323 -11.658
  607    HZ1  LYS  79           HZ1      LYS  79  -4.920 -14.349 -11.785
  608    HZ2  LYS  79           HZ2      LYS  79  -5.968 -13.694 -12.865
  609    HZ3  LYS  79           HZ3      LYS  79  -4.413 -13.953 -13.322
  610    HA   PRO  80           HA       PRO  80  -8.385  -6.164  -9.124
  611    HB2  PRO  80           HB2      PRO  80 -10.587  -7.160 -10.543
  612    HB3  PRO  80           HB3      PRO  80  -9.771  -5.595 -10.822
  613    HG2  PRO  80           HG2      PRO  80  -9.361  -8.200 -12.287
  614    HG3  PRO  80           HG3      PRO  80  -9.465  -6.548 -12.956
  615    HD2  PRO  80           HD2      PRO  80  -7.074  -7.742 -12.616
  616    HD3  PRO  80           HD3      PRO  80  -7.294  -6.012 -12.254
  617    H    GLY  81           H        GLY  81  -9.279  -7.038  -7.343
  618    HA2  GLY  81           HA2      GLY  81  -9.954  -8.643  -5.795
  619    HA3  GLY  81           HA3      GLY  81  -9.892  -9.904  -7.028
  620    H    SER  82           H        SER  82  -7.192  -7.695  -6.193
  621    HA   SER  82           HA       SER  82  -5.657  -9.998  -5.010
  622    HB2  SER  82           HB2      SER  82  -4.968  -9.363  -7.380
  623    HB3  SER  82           HB3      SER  82  -4.474  -7.790  -6.719
  624    HG   SER  82           HG       SER  82  -3.522 -10.382  -6.063
  625    H    THR  83           H        THR  83  -3.839  -9.198  -3.480
  626    HA   THR  83           HA       THR  83  -4.819  -6.727  -2.094
  627    HB   THR  83           HB       THR  83  -4.350  -7.731   0.035
  628    HG1  THR  83           HG1      THR  83  -2.889  -9.209  -0.131
  629   HG21  THR  83          HG21      THR  83  -6.158  -9.327   0.143
  630   HG22  THR  83          HG22      THR  83  -6.625  -8.056  -0.997
  631   HG23  THR  83          HG23      THR  83  -6.084  -9.636  -1.601
  632    H    VAL  84           H        VAL  84  -3.451  -5.537  -0.826
  633    HA   VAL  84           HA       VAL  84  -0.522  -5.834  -1.238
  634    HB   VAL  84           HB       VAL  84  -0.301  -3.394  -1.459
  635   HG11  VAL  84          HG11      VAL  84  -0.234  -4.870  -3.434
  636   HG12  VAL  84          HG12      VAL  84  -1.984  -4.666  -3.655
  637   HG13  VAL  84          HG13      VAL  84  -0.894  -3.274  -3.818
  638   HG21  VAL  84          HG21      VAL  84  -2.187  -1.999  -2.132
  639   HG22  VAL  84          HG22      VAL  84  -3.313  -3.352  -1.939
  640   HG23  VAL  84          HG23      VAL  84  -2.489  -2.662  -0.521
  641    H    ILE  85           H        ILE  85   0.780  -4.955   0.338
  642    HA   ILE  85           HA       ILE  85  -0.412  -4.858   3.035
  643    HB   ILE  85           HB       ILE  85   1.820  -5.391   3.887
  644   HG12  ILE  85          HG12      ILE  85   3.389  -4.444   2.446
  645   HG13  ILE  85          HG13      ILE  85   3.605  -6.187   2.406
  646   HG21  ILE  85          HG21      ILE  85   1.966  -7.676   3.169
  647   HG22  ILE  85          HG22      ILE  85   0.265  -7.206   3.339
  648   HG23  ILE  85          HG23      ILE  85   0.991  -7.346   1.726
  649   HD11  ILE  85          HD11      ILE  85   3.976  -5.391   0.217
  650   HD12  ILE  85          HD12      ILE  85   2.449  -6.276   0.211
  651   HD13  ILE  85          HD13      ILE  85   2.463  -4.484   0.200
  652    H    ALA  86           H        ALA  86   0.492  -2.550   0.976
  653    HA   ALA  86           HA       ALA  86   1.036  -0.369   1.092
  654    HB1  ALA  86           HB1      ALA  86   0.864   0.951   3.019
  655    HB2  ALA  86           HB2      ALA  86  -0.303  -0.369   3.270
  656    HB3  ALA  86           HB3      ALA  86   1.248  -0.395   4.100
  657    H    GLY  87           H        GLY  87   2.808   1.022   1.276
  658    HA2  GLY  87           HA2      GLY  87   5.057   1.673   1.647
  659    HA3  GLY  87           HA3      GLY  87   5.389   0.102   2.394
  660    H    SER  88           H        SER  88   4.738  -1.726   0.536
  661    HA   SER  88           HA       SER  88   6.651  -1.855  -1.373
  662    HB2  SER  88           HB2      SER  88   5.355  -3.532  -2.584
  663    HB3  SER  88           HB3      SER  88   5.230  -3.746  -0.837
  664    HG   SER  88           HG       SER  88   3.212  -3.930  -1.995
  665    H    ILE  89           H        ILE  89   6.860  -1.722  -3.636
  666    HA   ILE  89           HA       ILE  89   5.677   0.809  -4.643
  667    HB   ILE  89           HB       ILE  89   8.029  -0.270  -6.061
  668   HG12  ILE  89          HG12      ILE  89   8.795  -0.872  -3.794
  669   HG13  ILE  89          HG13      ILE  89   9.764   0.338  -4.600
  670   HG21  ILE  89          HG21      ILE  89   7.012   1.894  -6.579
  671   HG22  ILE  89          HG22      ILE  89   7.320   2.470  -4.924
  672   HG23  ILE  89          HG23      ILE  89   8.674   2.111  -6.003
  673   HD11  ILE  89          HD11      ILE  89   9.419   0.778  -2.166
  674   HD12  ILE  89          HD12      ILE  89   8.910   2.113  -3.210
  675   HD13  ILE  89          HD13      ILE  89   7.694   1.037  -2.487
  676    H    ASN  90           H        ASN  90   4.682   0.938  -6.570
  677    HA   ASN  90           HA       ASN  90   4.069  -1.541  -8.110
  678    HB2  ASN  90           HB2      ASN  90   2.226   0.029  -7.579
  679    HB3  ASN  90           HB3      ASN  90   3.117   1.348  -8.330
  680   HD21  ASN  90          HD22      ASN  90   0.730   1.150  -9.266
  681   HD22  ASN  90          HD21      ASN  90   0.757   0.458 -10.881
  682    H    GLN  91           H        GLN  91   5.191  -2.053  -9.970
  683    HA   GLN  91           HA       GLN  91   6.501   0.144 -11.410
  684    HB2  GLN  91           HB2      GLN  91   8.184  -1.084  -9.868
  685    HB3  GLN  91           HB3      GLN  91   8.053  -2.405 -11.028
  686    HG2  GLN  91           HG2      GLN  91   9.857  -1.099 -11.861
  687    HG3  GLN  91           HG3      GLN  91   8.473  -0.595 -12.857
  688   HE21  GLN  91          HE22      GLN  91  10.218   0.288  -9.831
  689   HE22  GLN  91          HE21      GLN  91   9.826   2.009  -9.933
  690    H    ASN  92           H        ASN  92   4.357  -0.369 -12.473
  691    HA   ASN  92           HA       ASN  92   5.072  -1.608 -14.971
  692    HB2  ASN  92           HB2      ASN  92   4.415  -3.648 -13.747
  693    HB3  ASN  92           HB3      ASN  92   2.845  -2.929 -13.420
  694   HD21  ASN  92          HD22      ASN  92   1.188  -3.218 -15.149
  695   HD22  ASN  92          HD21      ASN  92   1.701  -3.838 -16.716
  696    H    GLY  93           H        GLY  93   2.053  -0.658 -13.208
  697    HA2  GLY  93           HA2      GLY  93   1.225   1.129 -15.427
  698    HA3  GLY  93           HA3      GLY  93   0.346  -0.381 -15.297
  699    H    SER  94           H        SER  94  -1.391   1.381 -15.196
  700    HA   SER  94           HA       SER  94  -1.587   2.815 -12.629
  701    HB2  SER  94           HB2      SER  94  -2.945   4.326 -13.738
  702    HB3  SER  94           HB3      SER  94  -1.803   3.835 -14.969
  703    HG   SER  94           HG       SER  94  -3.530   3.441 -16.104
  704    H    LEU  95           H        LEU  95  -2.812   2.118 -10.927
  705    HA   LEU  95           HA       LEU  95  -5.140   0.307 -11.421
  706    HB2  LEU  95           HB2      LEU  95  -3.432   0.213  -8.977
  707    HB3  LEU  95           HB3      LEU  95  -4.442  -1.034  -9.612
  708    HG   LEU  95           HG       LEU  95  -1.775  -0.192 -10.845
  709   HD11  LEU  95          HD11      LEU  95  -2.317  -2.458  -8.887
  710   HD12  LEU  95          HD12      LEU  95  -0.756  -1.944  -9.580
  711   HD13  LEU  95          HD13      LEU  95  -1.581  -0.898  -8.446
  712   HD21  LEU  95          HD21      LEU  95  -1.895  -2.498 -11.777
  713   HD22  LEU  95          HD22      LEU  95  -3.510  -2.695 -11.065
  714   HD23  LEU  95          HD23      LEU  95  -3.230  -1.483 -12.333
  715    H    LEU  96           H        LEU  96  -6.702   0.157  -9.658
  716    HA   LEU  96           HA       LEU  96  -6.751   2.460  -7.757
  717    HB2  LEU  96           HB2      LEU  96  -9.144   1.280  -9.205
  718    HB3  LEU  96           HB3      LEU  96  -9.248   2.202  -7.721
  719    HG   LEU  96           HG       LEU  96  -8.111   4.149  -8.885
  720   HD11  LEU  96          HD11      LEU  96  -8.651   2.395 -11.307
  721   HD12  LEU  96          HD12      LEU  96  -8.530   4.149 -11.423
  722   HD13  LEU  96          HD13      LEU  96  -7.140   3.222 -10.874
  723   HD21  LEU  96          HD21      LEU  96 -10.526   4.043  -8.428
  724   HD22  LEU  96          HD22      LEU  96 -10.214   4.849  -9.970
  725   HD23  LEU  96          HD23      LEU  96 -10.788   3.170  -9.955
  726    H    ILE  97           H        ILE  97  -7.092   2.049  -5.690
  727    HA   ILE  97           HA       ILE  97  -7.475  -0.793  -4.810
  728    HB   ILE  97           HB       ILE  97  -5.726   1.225  -3.370
  729   HG12  ILE  97          HG12      ILE  97  -3.840  -0.348  -4.449
  730   HG13  ILE  97          HG13      ILE  97  -4.987  -0.450  -5.771
  731   HG21  ILE  97          HG21      ILE  97  -5.682  -1.818  -3.389
  732   HG22  ILE  97          HG22      ILE  97  -4.723  -0.746  -2.361
  733   HG23  ILE  97          HG23      ILE  97  -6.473  -0.829  -2.138
  734   HD11  ILE  97          HD11      ILE  97  -3.356   1.329  -6.135
  735   HD12  ILE  97          HD12      ILE  97  -4.934   2.090  -5.915
  736   HD13  ILE  97          HD13      ILE  97  -3.759   2.088  -4.584
  737    H    CYS  98           H        CYS  98  -8.920  -1.184  -3.169
  738    HA   CYS  98           HA       CYS  98 -10.351   1.158  -2.012
  739    HB2  CYS  98           HB2      CYS  98 -12.035  -0.454  -1.274
  740    HB3  CYS  98           HB3      CYS  98 -11.787  -0.465  -3.019
  741    HG   CYS  98           HG       CYS  98 -10.050  -2.574  -2.919
  742    H    ALA  99           H        ALA  99  -9.741   1.989  -0.116
  743    HA   ALA  99           HA       ALA  99  -7.898   0.539   1.631
  744    HB1  ALA  99           HB1      ALA  99  -9.254   3.261   1.877
  745    HB2  ALA  99           HB2      ALA  99  -7.971   2.644   2.933
  746    HB3  ALA  99           HB3      ALA  99  -7.634   2.944   1.213
  747    H    THR 100           H        THR 100  -8.589  -0.927   3.066
  748    HA   THR 100           HA       THR 100 -11.121  -0.449   4.616
  749    HB   THR 100           HB       THR 100 -11.292  -2.945   4.807
  750    HG1  THR 100           HG1      THR 100  -9.992  -4.199   3.750
  751   HG21  THR 100          HG21      THR 100 -11.399  -1.855   1.962
  752   HG22  THR 100          HG22      THR 100 -12.202  -3.321   2.568
  753   HG23  THR 100          HG23      THR 100 -12.678  -1.730   3.183
  754    H    HIS 101           H        HIS 101  -7.930  -0.120   5.114
  755    HA   HIS 101           HA       HIS 101  -8.298  -0.565   8.003
  756    HB2  HIS 101           HB2      HIS 101  -5.725  -1.080   6.447
  757    HB3  HIS 101           HB3      HIS 101  -5.994  -1.318   8.173
  758    HD1  HIS 101           HD1      HIS 101  -6.663  -2.962   4.793
  759    HD2  HIS 101           HD2      HIS 101  -7.340  -3.561   8.905
  760    HE1  HIS 101           HE1      HIS 101  -7.667  -5.313   5.020
  761    H    VAL 102           H        VAL 102  -7.728   1.281   9.123
  762    HA   VAL 102           HA       VAL 102  -6.605   3.586   7.686
  763    HB   VAL 102           HB       VAL 102  -8.426   3.630   9.474
  764   HG11  VAL 102          HG11      VAL 102  -7.314   2.201  11.150
  765   HG12  VAL 102          HG12      VAL 102  -6.055   3.446  11.375
  766   HG13  VAL 102          HG13      VAL 102  -7.739   3.797  11.770
  767   HG21  VAL 102          HG21      VAL 102  -7.372   5.649   8.602
  768   HG22  VAL 102          HG22      VAL 102  -7.728   5.797  10.329
  769   HG23  VAL 102          HG23      VAL 102  -6.064   5.500   9.794
  770    H    GLY 103           H        GLY 103  -4.549   4.741   8.820
  771    HA2  GLY 103           HA2      GLY 103  -2.452   2.990   8.052
  772    HA3  GLY 103           HA3      GLY 103  -2.273   4.554   8.781
  773    H    ALA 104           H        ALA 104  -3.589   3.887  11.370
  774    HA   ALA 104           HA       ALA 104  -1.391   2.596  12.719
  775    HB1  ALA 104           HB1      ALA 104  -4.212   3.243  13.682
  776    HB2  ALA 104           HB2      ALA 104  -2.813   2.853  14.705
  777    HB3  ALA 104           HB3      ALA 104  -2.807   4.334  13.745
  778    H    ASP 105           H        ASP 105  -4.580   1.408  11.701
  779    HA   ASP 105           HA       ASP 105  -4.354  -1.205  12.947
  780    HB2  ASP 105           HB2      ASP 105  -6.474   0.090  12.566
  781    HB3  ASP 105           HB3      ASP 105  -6.292  -0.210  10.839
  782    H    THR 106           H        THR 106  -2.819   0.001  10.216
  783    HA   THR 106           HA       THR 106  -3.154  -2.031   8.284
  784    HB   THR 106           HB       THR 106  -0.937  -1.340   7.370
  785    HG1  THR 106           HG1      THR 106  -0.799   0.706   9.246
  786   HG21  THR 106          HG21      THR 106  -2.887  -0.190   6.621
  787   HG22  THR 106          HG22      THR 106  -2.843   0.883   8.020
  788   HG23  THR 106          HG23      THR 106  -1.542   0.958   6.810
  789    H    THR 107           H        THR 107  -2.054  -3.825   7.674
  790    HA   THR 107           HA       THR 107  -0.770  -5.497   9.600
  791    HB   THR 107           HB       THR 107  -1.878  -6.294   7.555
  792    HG1  THR 107           HG1      THR 107  -0.254  -7.584   8.665
  793   HG21  THR 107          HG21      THR 107  -0.843  -4.612   5.939
  794   HG22  THR 107          HG22      THR 107   0.652  -5.561   6.033
  795   HG23  THR 107          HG23      THR 107  -0.836  -6.299   5.405
  796    H    LEU 108           H        LEU 108   0.685  -3.169   7.275
  797    HA   LEU 108           HA       LEU 108   3.381  -3.757   7.740
  798    HB2  LEU 108           HB2      LEU 108   2.260  -2.159   6.051
  799    HB3  LEU 108           HB3      LEU 108   2.205  -0.974   7.344
  800    HG   LEU 108           HG       LEU 108   4.754  -1.206   7.515
  801   HD11  LEU 108          HD11      LEU 108   4.293  -2.758   4.921
  802   HD12  LEU 108          HD12      LEU 108   5.872  -2.116   5.462
  803   HD13  LEU 108          HD13      LEU 108   5.058  -3.382   6.394
  804   HD21  LEU 108          HD21      LEU 108   3.624  -0.346   4.821
  805   HD22  LEU 108          HD22      LEU 108   3.619   0.631   6.306
  806   HD23  LEU 108          HD23      LEU 108   5.163   0.177   5.546
  807    H    SER 109           H        SER 109   1.319  -1.444   9.561
  808    HA   SER 109           HA       SER 109   3.358  -0.797  11.501
  809    HB2  SER 109           HB2      SER 109   1.379   0.637  10.906
  810    HB3  SER 109           HB3      SER 109   0.348  -0.511  11.778
  811    HG   SER 109           HG       SER 109   2.315   1.273  12.768
  812    H    GLN 110           H        GLN 110   1.127  -3.519  11.255
  813    HA   GLN 110           HA       GLN 110   1.220  -4.295  14.067
  814    HB2  GLN 110           HB2      GLN 110  -0.659  -4.834  12.481
  815    HB3  GLN 110           HB3      GLN 110   0.420  -5.849  11.577
  816    HG2  GLN 110           HG2      GLN 110  -0.788  -7.330  12.883
  817    HG3  GLN 110           HG3      GLN 110   0.792  -7.257  13.663
  818   HE21  GLN 110          HE22      GLN 110  -2.347  -5.439  13.725
  819   HE22  GLN 110          HE21      GLN 110  -2.364  -5.318  15.476
  820    H    ILE 111           H        ILE 111   2.873  -5.255  11.025
  821    HA   ILE 111           HA       ILE 111   4.291  -7.478  11.957
  822    HB   ILE 111           HB       ILE 111   4.920  -5.425   9.817
  823   HG12  ILE 111          HG12      ILE 111   4.222  -8.384   9.559
  824   HG13  ILE 111          HG13      ILE 111   2.979  -7.158   9.687
  825   HG21  ILE 111          HG21      ILE 111   6.516  -7.958  10.423
  826   HG22  ILE 111          HG22      ILE 111   6.671  -6.990   8.945
  827   HG23  ILE 111          HG23      ILE 111   7.125  -6.287  10.488
  828   HD11  ILE 111          HD11      ILE 111   5.032  -7.375   7.450
  829   HD12  ILE 111          HD12      ILE 111   3.291  -7.679   7.362
  830   HD13  ILE 111          HD13      ILE 111   3.881  -6.031   7.642
  831    H    VAL 112           H        VAL 112   5.542  -4.041  12.029
  832    HA   VAL 112           HA       VAL 112   7.887  -4.847  13.467
  833    HB   VAL 112           HB       VAL 112   8.296  -2.508  13.869
  834   HG11  VAL 112          HG11      VAL 112   7.238  -2.886  11.038
  835   HG12  VAL 112          HG12      VAL 112   8.526  -1.791  11.585
  836   HG13  VAL 112          HG13      VAL 112   8.779  -3.540  11.636
  837   HG21  VAL 112          HG21      VAL 112   5.994  -1.682  14.319
  838   HG22  VAL 112          HG22      VAL 112   6.802  -0.743  13.071
  839   HG23  VAL 112          HG23      VAL 112   5.571  -1.934  12.606
  840    H    LYS 113           H        LYS 113   4.660  -4.291  14.656
  841    HA   LYS 113           HA       LYS 113   5.500  -3.685  17.429
  842    HB2  LYS 113           HB2      LYS 113   2.791  -4.306  16.155
  843    HB3  LYS 113           HB3      LYS 113   3.007  -4.037  17.883
  844    HG2  LYS 113           HG2      LYS 113   3.676  -1.760  17.578
  845    HG3  LYS 113           HG3      LYS 113   3.872  -1.969  15.852
  846    HD2  LYS 113           HD2      LYS 113   1.851  -0.836  15.950
  847    HD3  LYS 113           HD3      LYS 113   1.332  -2.516  15.767
  848    HE2  LYS 113           HE2      LYS 113   1.129  -2.640  18.276
  849    HE3  LYS 113           HE3      LYS 113   1.549  -0.926  18.350
  850    HZ1  LYS 113           HZ1      LYS 113  -0.481  -0.450  17.050
  851    HZ2  LYS 113           HZ2      LYS 113  -0.851  -2.046  16.976
  852    HZ3  LYS 113           HZ3      LYS 113  -0.851  -1.280  18.422
  853    H    LEU 114           H        LEU 114   4.741  -6.492  15.466
  854    HA   LEU 114           HA       LEU 114   4.793  -8.401  17.698
  855    HB2  LEU 114           HB2      LEU 114   4.487  -8.477  14.689
  856    HB3  LEU 114           HB3      LEU 114   5.005  -9.937  15.525
  857    HG   LEU 114           HG       LEU 114   2.463  -8.378  16.065
  858   HD11  LEU 114          HD11      LEU 114   1.319 -10.262  14.956
  859   HD12  LEU 114          HD12      LEU 114   2.458  -9.474  13.855
  860   HD13  LEU 114          HD13      LEU 114   2.889 -11.023  14.611
  861   HD21  LEU 114          HD21      LEU 114   1.809 -10.515  17.293
  862   HD22  LEU 114          HD22      LEU 114   3.498 -11.056  17.125
  863   HD23  LEU 114          HD23      LEU 114   3.102  -9.617  18.084
  864    H    VAL 115           H        VAL 115   6.926  -7.524  14.936
  865    HA   VAL 115           HA       VAL 115   8.939  -9.404  15.656
  866    HB   VAL 115           HB       VAL 115   8.967  -7.045  13.753
  867   HG11  VAL 115          HG11      VAL 115  11.048  -9.257  14.067
  868   HG12  VAL 115          HG12      VAL 115  10.954  -8.119  12.704
  869   HG13  VAL 115          HG13      VAL 115  11.312  -7.517  14.320
  870   HG21  VAL 115          HG21      VAL 115   7.437  -8.980  13.197
  871   HG22  VAL 115          HG22      VAL 115   8.757  -8.801  12.040
  872   HG23  VAL 115          HG23      VAL 115   8.829 -10.065  13.287
  873    H    GLU 116           H        GLU 116   8.493  -6.045  16.784
  874    HA   GLU 116           HA       GLU 116  11.218  -5.777  17.727
  875    HB2  GLU 116           HB2      GLU 116   9.469  -3.904  17.397
  876    HB3  GLU 116           HB3      GLU 116   8.779  -4.417  18.936
  877    HG2  GLU 116           HG2      GLU 116  10.887  -3.943  20.081
  878    HG3  GLU 116           HG3      GLU 116  11.721  -3.722  18.537
  879    H    GLU 117           H        GLU 117   8.400  -7.577  18.958
  880    HA   GLU 117           HA       GLU 117   9.593  -7.899  21.625
  881    HB2  GLU 117           HB2      GLU 117   6.910  -8.871  20.595
  882    HB3  GLU 117           HB3      GLU 117   7.548  -8.980  22.242
  883    HG2  GLU 117           HG2      GLU 117   7.764  -6.333  22.001
  884    HG3  GLU 117           HG3      GLU 117   6.554  -6.555  20.738
  885    H    ALA 118           H        ALA 118   9.736  -9.259  18.537
  886    HA   ALA 118           HA       ALA 118   9.766 -12.080  19.294
  887    HB1  ALA 118           HB1      ALA 118  10.238 -12.466  16.947
  888    HB2  ALA 118           HB2      ALA 118   8.937 -11.268  17.078
  889    HB3  ALA 118           HB3      ALA 118  10.596 -10.758  16.678
  890    H    GLN 119           H        GLN 119  12.096  -9.511  19.116
  891    HA   GLN 119           HA       GLN 119  14.564 -10.862  18.769
  892    HB2  GLN 119           HB2      GLN 119  13.738  -8.284  20.135
  893    HB3  GLN 119           HB3      GLN 119  15.412  -8.706  19.801
  894    HG2  GLN 119           HG2      GLN 119  13.307  -7.548  18.072
  895    HG3  GLN 119           HG3      GLN 119  15.049  -7.283  18.058
  896   HE21  GLN 119          HE22      GLN 119  12.428  -8.877  16.599
  897   HE22  GLN 119          HE21      GLN 119  13.208 -10.374  16.342
  Start of MODEL   21
    1    H    SER   1           H        SER   1  18.382  -5.595  13.092
    2    HA   SER   1           HA       SER   1  16.514  -3.957  14.619
    3    HB2  SER   1           HB2      SER   1  18.633  -3.017  15.577
    4    HB3  SER   1           HB3      SER   1  18.449  -4.770  15.738
    5    HG   SER   1           HG       SER   1  20.381  -3.368  14.492
    6    H    GLU   2           H        GLU   2  18.624  -3.385  11.769
    7    HA   GLU   2           HA       GLU   2  17.905  -0.522  11.618
    8    HB2  GLU   2           HB2      GLU   2  19.204  -2.494   9.707
    9    HB3  GLU   2           HB3      GLU   2  18.773  -0.867   9.203
   10    HG2  GLU   2           HG2      GLU   2  20.550  -1.326  11.626
   11    HG3  GLU   2           HG3      GLU   2  21.193  -1.307   9.986
   12    H    ALA   3           H        ALA   3  16.626  -3.574  10.360
   13    HA   ALA   3           HA       ALA   3  14.715  -2.412   8.540
   14    HB1  ALA   3           HB1      ALA   3  14.688  -5.140   9.888
   15    HB2  ALA   3           HB2      ALA   3  13.750  -4.653   8.467
   16    HB3  ALA   3           HB3      ALA   3  15.518  -4.746   8.364
   17    H    LEU   4           H        LEU   4  14.527  -3.394  11.939
   18    HA   LEU   4           HA       LEU   4  11.898  -2.853  12.643
   19    HB2  LEU   4           HB2      LEU   4  13.754  -3.636  14.157
   20    HB3  LEU   4           HB3      LEU   4  14.402  -2.008  14.146
   21    HG   LEU   4           HG       LEU   4  12.220  -1.211  15.203
   22   HD11  LEU   4          HD11      LEU   4  11.969  -4.180  15.798
   23   HD12  LEU   4          HD12      LEU   4  10.903  -2.883  16.376
   24   HD13  LEU   4          HD13      LEU   4  10.937  -3.305  14.651
   25   HD21  LEU   4          HD21      LEU   4  13.982  -3.186  16.721
   26   HD22  LEU   4          HD22      LEU   4  14.310  -1.458  16.477
   27   HD23  LEU   4          HD23      LEU   4  12.920  -1.960  17.452
   28    H    ALA   5           H        ALA   5  14.421  -0.378  11.974
   29    HA   ALA   5           HA       ALA   5  12.582   1.837  12.580
   30    HB1  ALA   5           HB1      ALA   5  15.412   1.767  11.450
   31    HB2  ALA   5           HB2      ALA   5  14.498   3.236  11.846
   32    HB3  ALA   5           HB3      ALA   5  14.945   2.100  13.132
   33    H    LYS   6           H        LYS   6  13.851   0.103   9.716
   34    HA   LYS   6           HA       LYS   6  12.766   1.928   7.790
   35    HB2  LYS   6           HB2      LYS   6  14.550   0.346   7.224
   36    HB3  LYS   6           HB3      LYS   6  13.415  -1.012   7.360
   37    HG2  LYS   6           HG2      LYS   6  12.120  -0.259   5.503
   38    HG3  LYS   6           HG3      LYS   6  12.872   1.344   5.521
   39    HD2  LYS   6           HD2      LYS   6  14.987   0.384   4.703
   40    HD3  LYS   6           HD3      LYS   6  14.251  -1.240   4.669
   41    HE2  LYS   6           HE2      LYS   6  12.541  -0.473   3.074
   42    HE3  LYS   6           HE3      LYS   6  13.097   1.195   3.234
   43    HZ1  LYS   6           HZ1      LYS   6  13.905   0.310   1.228
   44    HZ2  LYS   6           HZ2      LYS   6  15.196   0.536   2.194
   45    HZ3  LYS   6           HZ3      LYS   6  14.651  -0.984   1.931
   46    H    LEU   7           H        LEU   7  11.182  -0.807   9.445
   47    HA   LEU   7           HA       LEU   7   8.774  -0.780   7.907
   48    HB2  LEU   7           HB2      LEU   7   9.501  -1.561  10.725
   49    HB3  LEU   7           HB3      LEU   7   7.804  -1.384  10.324
   50    HG   LEU   7           HG       LEU   7   8.353  -3.673  10.188
   51   HD11  LEU   7          HD11      LEU   7   6.809  -2.711   8.464
   52   HD12  LEU   7          HD12      LEU   7   8.148  -2.765   7.295
   53   HD13  LEU   7          HD13      LEU   7   7.553  -4.260   8.028
   54   HD21  LEU   7          HD21      LEU   7  10.726  -3.661   9.792
   55   HD22  LEU   7          HD22      LEU   7   9.937  -4.616   8.534
   56   HD23  LEU   7          HD23      LEU   7  10.504  -2.971   8.164
   57    H    ILE   8           H        ILE   8   9.761   1.430  10.532
   58    HA   ILE   8           HA       ILE   8   7.319   2.982  10.377
   59    HB   ILE   8           HB       ILE   8  10.013   3.808  11.462
   60   HG12  ILE   8          HG12      ILE   8   9.099   1.842  12.618
   61   HG13  ILE   8          HG13      ILE   8   9.145   3.263  13.650
   62   HG21  ILE   8          HG21      ILE   8   7.258   5.091  11.695
   63   HG22  ILE   8          HG22      ILE   8   8.647   5.500  12.727
   64   HG23  ILE   8          HG23      ILE   8   8.726   5.790  10.988
   65   HD11  ILE   8          HD11      ILE   8   7.112   1.964  14.032
   66   HD12  ILE   8          HD12      ILE   8   6.679   3.540  13.359
   67   HD13  ILE   8          HD13      ILE   8   6.654   2.086  12.327
   68    H    SER   9           H        SER   9  10.482   3.247   8.674
   69    HA   SER   9           HA       SER   9   9.851   5.748   7.365
   70    HB2  SER   9           HB2      SER   9  11.867   3.587   6.659
   71    HB3  SER   9           HB3      SER   9  11.807   5.200   5.944
   72    HG   SER   9           HG       SER   9  13.225   4.645   7.898
   73    H    LEU  10           H        LEU  10   8.981   2.434   6.621
   74    HA   LEU  10           HA       LEU  10   8.344   2.834   3.817
   75    HB2  LEU  10           HB2      LEU  10   7.865   0.715   5.931
   76    HB3  LEU  10           HB3      LEU  10   7.023   0.611   4.393
   77    HG   LEU  10           HG       LEU  10  10.048   0.875   4.475
   78   HD11  LEU  10          HD11      LEU  10   8.369  -1.672   4.516
   79   HD12  LEU  10          HD12      LEU  10  10.117  -1.592   4.208
   80   HD13  LEU  10          HD13      LEU  10   9.483  -1.115   5.788
   81   HD21  LEU  10          HD21      LEU  10   8.899   1.274   2.293
   82   HD22  LEU  10          HD22      LEU  10   9.865  -0.208   2.265
   83   HD23  LEU  10          HD23      LEU  10   8.104  -0.310   2.441
   84    H    GLN  11           H        GLN  11   6.780   3.976   6.619
   85    HA   GLN  11           HA       GLN  11   4.082   3.588   5.566
   86    HB2  GLN  11           HB2      GLN  11   5.137   4.582   8.190
   87    HB3  GLN  11           HB3      GLN  11   3.420   4.682   7.776
   88    HG2  GLN  11           HG2      GLN  11   3.369   2.282   7.189
   89    HG3  GLN  11           HG3      GLN  11   5.065   2.134   7.657
   90   HE21  GLN  11          HE22      GLN  11   5.506   1.681   9.765
   91   HE22  GLN  11          HE21      GLN  11   4.274   1.872  11.039
   92    H    ALA  12           H        ALA  12   2.722   4.936   4.704
   93    HA   ALA  12           HA       ALA  12   3.830   7.077   3.208
   94    HB1  ALA  12           HB1      ALA  12   1.560   7.171   2.221
   95    HB2  ALA  12           HB2      ALA  12   2.161   5.515   2.344
   96    HB3  ALA  12           HB3      ALA  12   0.956   6.110   3.513
   97    H    THR  13           H        THR  13   3.083   9.163   2.926
   98    HA   THR  13           HA       THR  13   1.958  10.570   5.333
   99    HB   THR  13           HB       THR  13   3.312  12.517   4.424
  100    HG1  THR  13           HG1      THR  13   3.932  11.865   2.392
  101   HG21  THR  13          HG21      THR  13   4.888  10.055   5.278
  102   HG22  THR  13          HG22      THR  13   5.374  11.755   5.465
  103   HG23  THR  13          HG23      THR  13   3.988  11.120   6.378
  104    H    GLU  14           H        GLU  14   1.622  10.256   1.807
  105    HA   GLU  14           HA       GLU  14  -0.841  11.831   2.005
  106    HB2  GLU  14           HB2      GLU  14  -0.380  13.186   0.122
  107    HB3  GLU  14           HB3      GLU  14   0.829  13.469   1.355
  108    HG2  GLU  14           HG2      GLU  14   1.151  11.872  -1.211
  109    HG3  GLU  14           HG3      GLU  14   1.737  13.504  -0.933
  110    H    ALA  15           H        ALA  15  -2.373  11.474   0.342
  111    HA   ALA  15           HA       ALA  15  -1.930   9.174  -1.485
  112    HB1  ALA  15           HB1      ALA  15  -4.199   9.309   0.553
  113    HB2  ALA  15           HB2      ALA  15  -3.980   8.056  -0.689
  114    HB3  ALA  15           HB3      ALA  15  -2.799   8.214   0.623
  115    H    THR  16           H        THR  16  -3.672   8.906  -3.062
  116    HA   THR  16           HA       THR  16  -5.020  11.488  -3.779
  117    HB   THR  16           HB       THR  16  -4.385   9.409  -5.861
  118    HG1  THR  16           HG1      THR  16  -2.457   9.585  -5.069
  119   HG21  THR  16          HG21      THR  16  -4.435  12.459  -5.857
  120   HG22  THR  16          HG22      THR  16  -4.179  11.409  -7.270
  121   HG23  THR  16          HG23      THR  16  -5.744  11.406  -6.439
  122    H    ILE  17           H        ILE  17  -7.149  11.329  -3.132
  123    HA   ILE  17           HA       ILE  17  -8.594   8.741  -3.363
  124    HB   ILE  17           HB       ILE  17  -9.554  11.416  -2.271
  125   HG12  ILE  17          HG12      ILE  17  -8.693   8.911  -0.756
  126   HG13  ILE  17          HG13      ILE  17  -7.741  10.388  -0.889
  127   HG21  ILE  17          HG21      ILE  17 -10.836   8.640  -2.155
  128   HG22  ILE  17          HG22      ILE  17 -11.471  10.102  -1.367
  129   HG23  ILE  17          HG23      ILE  17 -11.432  10.018  -3.101
  130   HD11  ILE  17          HD11      ILE  17 -10.415  10.089   0.539
  131   HD12  ILE  17          HD12      ILE  17  -8.835  10.353   1.260
  132   HD13  ILE  17          HD13      ILE  17  -9.579  11.634   0.276
  133    H    VAL  18           H        VAL  18  -9.971   8.215  -5.014
  134    HA   VAL  18           HA       VAL  18 -10.727  10.320  -6.989
  135    HB   VAL  18           HB       VAL  18 -11.189   7.329  -7.100
  136   HG11  VAL  18          HG11      VAL  18 -11.474   9.498  -9.227
  137   HG12  VAL  18          HG12      VAL  18 -11.669   7.752  -9.487
  138   HG13  VAL  18          HG13      VAL  18 -12.807   8.614  -8.452
  139   HG21  VAL  18          HG21      VAL  18  -8.801   7.709  -7.215
  140   HG22  VAL  18          HG22      VAL  18  -9.409   7.312  -8.826
  141   HG23  VAL  18          HG23      VAL  18  -9.022   8.997  -8.417
  142    H    THR  19           H        THR  19 -12.474  11.453  -6.439
  143    HA   THR  19           HA       THR  19 -14.626  10.254  -4.738
  144    HB   THR  19           HB       THR  19 -13.996  13.188  -5.233
  145    HG1  THR  19           HG1      THR  19 -12.322  12.212  -4.133
  146   HG21  THR  19          HG21      THR  19 -15.708  11.791  -3.130
  147   HG22  THR  19          HG22      THR  19 -15.284  13.515  -3.118
  148   HG23  THR  19          HG23      THR  19 -16.287  12.877  -4.421
  149    H    LEU  20           H        LEU  20 -16.888  10.586  -5.373
  150    HA   LEU  20           HA       LEU  20 -17.201  11.143  -8.272
  151    HB2  LEU  20           HB2      LEU  20 -19.084   9.723  -6.372
  152    HB3  LEU  20           HB3      LEU  20 -19.287   9.923  -8.100
  153    HG   LEU  20           HG       LEU  20 -16.842   8.474  -6.985
  154   HD11  LEU  20          HD11      LEU  20 -19.495   7.228  -7.753
  155   HD12  LEU  20          HD12      LEU  20 -17.975   6.357  -7.459
  156   HD13  LEU  20          HD13      LEU  20 -18.749   7.256  -6.151
  157   HD21  LEU  20          HD21      LEU  20 -18.226   8.398  -9.699
  158   HD22  LEU  20          HD22      LEU  20 -16.706   9.238  -9.330
  159   HD23  LEU  20          HD23      LEU  20 -16.783   7.476  -9.225
  160    H    ASP  21           H        ASP  21 -17.558  13.185  -8.645
  161    HA   ASP  21           HA       ASP  21 -18.937  14.919  -6.669
  162    HB2  ASP  21           HB2      ASP  21 -16.903  15.325  -8.785
  163    HB3  ASP  21           HB3      ASP  21 -18.074  16.623  -8.631
  164    H    SER  22           H        SER  22 -19.981  13.090  -9.058
  165    HA   SER  22           HA       SER  22 -22.600  14.222  -8.934
  166    HB2  SER  22           HB2      SER  22 -21.378  14.184 -11.707
  167    HB3  SER  22           HB3      SER  22 -23.107  14.304 -11.363
  168    HG   SER  22           HG       SER  22 -21.439  16.080 -10.014
  169    H    ASP  23           H        ASP  23 -23.910  12.647  -8.913
  170    HA   ASP  23           HA       ASP  23 -24.339  10.554  -8.058
  171    HB2  ASP  23           HB2      ASP  23 -25.700  11.036 -10.142
  172    HB3  ASP  23           HB3      ASP  23 -24.672   9.885 -10.996
  173    H    ASN  24           H        ASN  24 -23.527   8.111 -10.138
  174    HA   ASN  24           HA       ASN  24 -20.724   7.930  -9.317
  175    HB2  ASN  24           HB2      ASN  24 -22.626   6.108  -9.356
  176    HB3  ASN  24           HB3      ASN  24 -22.267   5.973 -11.072
  177   HD21  ASN  24          HD22      ASN  24 -19.483   5.922 -11.070
  178   HD22  ASN  24          HD21      ASN  24 -19.037   4.523 -10.086
  179    H    ILE  25           H        ILE  25 -21.951   9.836 -11.535
  180    HA   ILE  25           HA       ILE  25 -20.682   9.003 -13.971
  181    HB   ILE  25           HB       ILE  25 -22.027  11.030 -14.745
  182   HG12  ILE  25          HG12      ILE  25 -23.219  11.069 -12.030
  183   HG13  ILE  25          HG13      ILE  25 -22.157  12.291 -12.739
  184   HG21  ILE  25          HG21      ILE  25 -22.714   8.605 -14.866
  185   HG22  ILE  25          HG22      ILE  25 -23.512   8.785 -13.291
  186   HG23  ILE  25          HG23      ILE  25 -24.094   9.691 -14.704
  187   HD11  ILE  25          HD11      ILE  25 -24.446  13.037 -12.912
  188   HD12  ILE  25          HD12      ILE  25 -23.844  12.670 -14.540
  189   HD13  ILE  25          HD13      ILE  25 -24.942  11.539 -13.707
  190    H    LEU  26           H        LEU  26 -19.946  11.568 -11.611
  191    HA   LEU  26           HA       LEU  26 -17.859  12.555 -13.539
  192    HB2  LEU  26           HB2      LEU  26 -19.654  14.110 -13.012
  193    HB3  LEU  26           HB3      LEU  26 -19.094  14.182 -11.336
  194    HG   LEU  26           HG       LEU  26 -17.014  14.597 -13.467
  195   HD11  LEU  26          HD11      LEU  26 -19.169  16.649 -12.881
  196   HD12  LEU  26          HD12      LEU  26 -17.677  16.934 -13.821
  197   HD13  LEU  26          HD13      LEU  26 -18.888  15.780 -14.413
  198   HD21  LEU  26          HD21      LEU  26 -17.648  16.165 -10.949
  199   HD22  LEU  26          HD22      LEU  26 -16.470  14.829 -11.052
  200   HD23  LEU  26          HD23      LEU  26 -16.204  16.319 -11.968
  201    H    LEU  27           H        LEU  27 -16.037  11.736 -13.141
  202    HA   LEU  27           HA       LEU  27 -15.128  10.935 -10.405
  203    HB2  LEU  27           HB2      LEU  27 -14.051  10.420 -13.203
  204    HB3  LEU  27           HB3      LEU  27 -13.104  10.108 -11.755
  205    HG   LEU  27           HG       LEU  27 -14.787   8.505 -10.937
  206   HD11  LEU  27          HD11      LEU  27 -16.144   8.957 -13.632
  207   HD12  LEU  27          HD12      LEU  27 -16.461   7.575 -12.556
  208   HD13  LEU  27          HD13      LEU  27 -16.860   9.203 -12.020
  209   HD21  LEU  27          HD21      LEU  27 -12.837   7.778 -12.260
  210   HD22  LEU  27          HD22      LEU  27 -14.235   6.739 -12.563
  211   HD23  LEU  27          HD23      LEU  27 -13.773   7.968 -13.760
  212    H    SER  28           H        SER  28 -14.068  12.357  -9.176
  213    HA   SER  28           HA       SER  28 -12.150  14.283 -10.433
  214    HB2  SER  28           HB2      SER  28 -14.358  15.393  -9.957
  215    HB3  SER  28           HB3      SER  28 -14.143  14.955  -8.253
  216    HG   SER  28           HG       SER  28 -13.316  16.938  -8.384
  217    H    GLU  29           H        GLU  29 -10.181  14.180  -9.472
  218    HA   GLU  29           HA       GLU  29 -10.000  12.537  -7.056
  219    HB2  GLU  29           HB2      GLU  29  -7.673  13.243  -8.818
  220    HB3  GLU  29           HB3      GLU  29  -7.893  11.909  -7.697
  221    HG2  GLU  29           HG2      GLU  29  -8.123  10.870  -9.751
  222    HG3  GLU  29           HG3      GLU  29  -9.784  11.077  -9.206
  223    H    GLU  30           H        GLU  30  -8.758  12.973  -5.284
  224    HA   GLU  30           HA       GLU  30  -8.222  15.866  -4.684
  225    HB2  GLU  30           HB2      GLU  30  -9.332  13.742  -2.818
  226    HB3  GLU  30           HB3      GLU  30  -9.192  15.462  -2.505
  227    HG2  GLU  30           HG2      GLU  30 -11.082  14.103  -4.488
  228    HG3  GLU  30           HG3      GLU  30 -11.510  14.794  -2.934
  229    H    GLN  31           H        GLN  31  -6.385  16.360  -3.392
  230    HA   GLN  31           HA       GLN  31  -4.483  14.096  -2.971
  231    HB2  GLN  31           HB2      GLN  31  -4.010  17.090  -3.290
  232    HB3  GLN  31           HB3      GLN  31  -2.773  15.901  -2.873
  233    HG2  GLN  31           HG2      GLN  31  -3.335  14.678  -5.012
  234    HG3  GLN  31           HG3      GLN  31  -4.274  16.112  -5.510
  235   HE21  GLN  31          HE22      GLN  31  -1.251  14.637  -5.043
  236   HE22  GLN  31          HE21      GLN  31  -0.533  16.014  -4.451
  237    H    VAL  32           H        VAL  32  -4.438  13.375  -0.924
  238    HA   VAL  32           HA       VAL  32  -5.090  15.263   1.308
  239    HB   VAL  32           HB       VAL  32  -6.307  13.552   2.412
  240   HG11  VAL  32          HG11      VAL  32  -7.336  13.653  -0.442
  241   HG12  VAL  32          HG12      VAL  32  -8.263  13.418   1.053
  242   HG13  VAL  32          HG13      VAL  32  -7.484  14.975   0.739
  243   HG21  VAL  32          HG21      VAL  32  -5.086  11.529   1.639
  244   HG22  VAL  32          HG22      VAL  32  -6.829  11.381   1.464
  245   HG23  VAL  32          HG23      VAL  32  -5.833  11.714   0.032
  246    H    ASP  33           H        ASP  33  -4.413  14.576   3.425
  247    HA   ASP  33           HA       ASP  33  -1.750  13.281   3.537
  248    HB2  ASP  33           HB2      ASP  33  -3.375  14.622   5.719
  249    HB3  ASP  33           HB3      ASP  33  -1.748  13.962   5.902
  250    H    VAL  34           H        VAL  34  -1.258  11.636   5.157
  251    HA   VAL  34           HA       VAL  34  -2.811   9.359   4.659
  252    HB   VAL  34           HB       VAL  34  -0.401   9.391   5.082
  253   HG11  VAL  34          HG11      VAL  34  -0.337  10.831   7.092
  254   HG12  VAL  34          HG12      VAL  34  -1.111   9.546   8.045
  255   HG13  VAL  34          HG13      VAL  34   0.496   9.300   7.352
  256   HG21  VAL  34          HG21      VAL  34  -0.233   7.221   6.113
  257   HG22  VAL  34          HG22      VAL  34  -1.821   7.390   6.878
  258   HG23  VAL  34          HG23      VAL  34  -1.690   7.263   5.111
  259    H    GLU  35           H        GLU  35  -3.126  11.409   7.587
  260    HA   GLU  35           HA       GLU  35  -4.900   9.468   8.862
  261    HB2  GLU  35           HB2      GLU  35  -3.538  11.242  10.033
  262    HB3  GLU  35           HB3      GLU  35  -4.722  12.429   9.458
  263    HG2  GLU  35           HG2      GLU  35  -6.507  11.224  10.694
  264    HG3  GLU  35           HG3      GLU  35  -5.353   9.972  11.167
  265    H    LEU  36           H        LEU  36  -5.390  11.705   6.238
  266    HA   LEU  36           HA       LEU  36  -8.254  12.082   6.768
  267    HB2  LEU  36           HB2      LEU  36  -6.495  13.127   4.540
  268    HB3  LEU  36           HB3      LEU  36  -8.084  13.727   5.003
  269    HG   LEU  36           HG       LEU  36  -5.522  13.919   6.661
  270   HD11  LEU  36          HD11      LEU  36  -7.132  16.070   5.253
  271   HD12  LEU  36          HD12      LEU  36  -5.669  16.310   6.230
  272   HD13  LEU  36          HD13      LEU  36  -5.587  15.414   4.707
  273   HD21  LEU  36          HD21      LEU  36  -7.426  13.743   8.178
  274   HD22  LEU  36          HD22      LEU  36  -6.858  15.415   8.132
  275   HD23  LEU  36          HD23      LEU  36  -8.324  14.953   7.234
  276    H    VAL  37           H        VAL  37  -6.453   9.776   5.138
  277    HA   VAL  37           HA       VAL  37  -8.646   9.007   3.278
  278    HB   VAL  37           HB       VAL  37  -6.539   8.920   2.208
  279   HG11  VAL  37          HG11      VAL  37  -5.513   7.158   4.469
  280   HG12  VAL  37          HG12      VAL  37  -4.668   7.475   2.939
  281   HG13  VAL  37          HG13      VAL  37  -4.975   8.803   4.058
  282   HG21  VAL  37          HG21      VAL  37  -8.108   7.066   1.728
  283   HG22  VAL  37          HG22      VAL  37  -6.408   6.609   1.497
  284   HG23  VAL  37          HG23      VAL  37  -7.279   6.056   2.933
  285    H    GLN  38           H        GLN  38  -9.882   7.221   3.625
  286    HA   GLN  38           HA       GLN  38  -9.650   5.812   6.247
  287    HB2  GLN  38           HB2      GLN  38 -11.992   7.364   5.128
  288    HB3  GLN  38           HB3      GLN  38 -12.120   6.256   6.499
  289    HG2  GLN  38           HG2      GLN  38 -10.536   7.621   7.791
  290    HG3  GLN  38           HG3      GLN  38 -10.318   8.729   6.426
  291   HE21  GLN  38          HE22      GLN  38 -12.442   9.709   5.630
  292   HE22  GLN  38          HE21      GLN  38 -13.738   9.775   6.815
  293    H    ARG  39           H        ARG  39 -11.346   4.073   6.470
  294    HA   ARG  39           HA       ARG  39 -10.558   2.183   4.473
  295    HB2  ARG  39           HB2      ARG  39 -11.138   0.570   5.946
  296    HB3  ARG  39           HB3      ARG  39 -10.927   1.918   7.047
  297    HG2  ARG  39           HG2      ARG  39 -13.474   2.237   6.847
  298    HG3  ARG  39           HG3      ARG  39 -13.504   0.659   6.043
  299    HD2  ARG  39           HD2      ARG  39 -12.205  -0.264   8.010
  300    HD3  ARG  39           HD3      ARG  39 -12.533   1.264   8.839
  301    HE   ARG  39           HE       ARG  39 -15.028   0.686   8.251
  302   HH11  ARG  39          HH11      ARG  39 -12.712  -1.782   9.323
  303   HH12  ARG  39          HH12      ARG  39 -13.978  -3.015   9.242
  304   HH21  ARG  39          HH21      ARG  39 -16.543  -0.999   8.523
  305   HH22  ARG  39          HH22      ARG  39 -15.926  -2.604   8.894
  306    H    GLY  40           H        GLY  40 -12.929   4.226   3.829
  307    HA2  GLY  40           HA2      GLY  40 -14.388   2.286   2.075
  308    HA3  GLY  40           HA3      GLY  40 -15.119   3.740   2.746
  309    H    ASP  41           H        ASP  41 -11.883   4.426   1.884
  310    HA   ASP  41           HA       ASP  41 -12.802   5.922  -0.481
  311    HB2  ASP  41           HB2      ASP  41 -10.143   5.924   0.982
  312    HB3  ASP  41           HB3      ASP  41 -10.582   7.000  -0.340
  313    H    ILE  42           H        ILE  42 -11.813   5.934  -2.503
  314    HA   ILE  42           HA       ILE  42 -10.364   3.451  -3.321
  315    HB   ILE  42           HB       ILE  42 -12.087   5.266  -5.001
  316   HG12  ILE  42          HG12      ILE  42 -13.553   4.084  -3.487
  317   HG13  ILE  42          HG13      ILE  42 -13.681   3.433  -5.108
  318   HG21  ILE  42          HG21      ILE  42 -10.342   4.232  -6.329
  319   HG22  ILE  42          HG22      ILE  42 -10.672   2.636  -5.627
  320   HG23  ILE  42          HG23      ILE  42 -11.870   3.424  -6.678
  321   HD11  ILE  42          HD11      ILE  42 -13.790   1.638  -3.496
  322   HD12  ILE  42          HD12      ILE  42 -12.294   1.477  -4.431
  323   HD13  ILE  42          HD13      ILE  42 -12.257   2.128  -2.769
  324    H    ILE  43           H        ILE  43  -8.222   3.804  -3.744
  325    HA   ILE  43           HA       ILE  43  -7.280   6.508  -4.425
  326    HB   ILE  43           HB       ILE  43  -5.843   4.055  -3.343
  327   HG12  ILE  43          HG12      ILE  43  -7.410   4.684  -1.653
  328   HG13  ILE  43          HG13      ILE  43  -5.803   5.164  -1.148
  329   HG21  ILE  43          HG21      ILE  43  -4.896   6.936  -3.559
  330   HG22  ILE  43          HG22      ILE  43  -4.055   5.651  -2.670
  331   HG23  ILE  43          HG23      ILE  43  -4.252   5.526  -4.415
  332   HD11  ILE  43          HD11      ILE  43  -7.437   6.880  -0.576
  333   HD12  ILE  43          HD12      ILE  43  -6.321   7.534  -1.787
  334   HD13  ILE  43          HD13      ILE  43  -7.960   7.007  -2.249
  335    H    LYS  44           H        LYS  44  -6.598   6.938  -6.502
  336    HA   LYS  44           HA       LYS  44  -5.779   4.780  -8.319
  337    HB2  LYS  44           HB2      LYS  44  -6.899   6.854  -9.102
  338    HB3  LYS  44           HB3      LYS  44  -5.390   7.732  -8.759
  339    HG2  LYS  44           HG2      LYS  44  -4.166   6.114 -10.248
  340    HG3  LYS  44           HG3      LYS  44  -5.690   5.294 -10.604
  341    HD2  LYS  44           HD2      LYS  44  -5.132   8.209 -11.202
  342    HD3  LYS  44           HD3      LYS  44  -4.818   6.874 -12.331
  343    HE2  LYS  44           HE2      LYS  44  -7.222   6.252 -12.270
  344    HE3  LYS  44           HE3      LYS  44  -7.543   7.624 -11.197
  345    HZ1  LYS  44           HZ1      LYS  44  -8.025   8.229 -13.448
  346    HZ2  LYS  44           HZ2      LYS  44  -6.713   9.084 -12.981
  347    HZ3  LYS  44           HZ3      LYS  44  -6.524   7.810 -13.991
  348    H    VAL  45           H        VAL  45  -3.826   3.883  -8.551
  349    HA   VAL  45           HA       VAL  45  -1.428   5.303  -7.515
  350    HB   VAL  45           HB       VAL  45  -2.076   3.363  -6.176
  351   HG11  VAL  45          HG11      VAL  45  -1.505   1.662  -8.632
  352   HG12  VAL  45          HG12      VAL  45  -1.832   1.094  -6.990
  353   HG13  VAL  45          HG13      VAL  45  -3.099   1.944  -7.892
  354   HG21  VAL  45          HG21      VAL  45   0.329   3.991  -6.371
  355   HG22  VAL  45          HG22      VAL  45   0.089   2.257  -6.092
  356   HG23  VAL  45          HG23      VAL  45   0.508   2.842  -7.714
  357    H    VAL  46           H        VAL  46   0.250   5.633  -8.828
  358    HA   VAL  46           HA       VAL  46  -0.131   5.115 -11.690
  359    HB   VAL  46           HB       VAL  46   1.675   6.716 -12.018
  360   HG11  VAL  46          HG11      VAL  46  -0.176   7.737  -9.840
  361   HG12  VAL  46          HG12      VAL  46   0.652   8.677 -11.095
  362   HG13  VAL  46          HG13      VAL  46  -0.622   7.537 -11.552
  363   HG21  VAL  46          HG21      VAL  46   2.071   6.712  -9.011
  364   HG22  VAL  46          HG22      VAL  46   3.226   6.166 -10.238
  365   HG23  VAL  46          HG23      VAL  46   2.770   7.870 -10.152
  366    HA   PRO  47           HA       PRO  47   3.137   2.025 -12.269
  367    HB2  PRO  47           HB2      PRO  47   4.516   2.948 -14.480
  368    HB3  PRO  47           HB3      PRO  47   2.951   2.092 -14.569
  369    HG2  PRO  47           HG2      PRO  47   3.443   5.085 -14.605
  370    HG3  PRO  47           HG3      PRO  47   2.399   4.119 -15.693
  371    HD2  PRO  47           HD2      PRO  47   1.334   5.448 -13.615
  372    HD3  PRO  47           HD3      PRO  47   0.777   3.807 -13.995
  373    H    GLY  48           H        GLY  48   5.061   1.871 -11.235
  374    HA2  GLY  48           HA2      GLY  48   7.108   2.469 -10.317
  375    HA3  GLY  48           HA3      GLY  48   6.952   4.096 -10.961
  376    H    GLY  49           H        GLY  49   4.062   3.871  -9.496
  377    HA2  GLY  49           HA2      GLY  49   4.798   5.389  -7.159
  378    HA3  GLY  49           HA3      GLY  49   3.196   4.827  -7.600
  379    H    LYS  50           H        LYS  50   3.670   4.853  -5.034
  380    HA   LYS  50           HA       LYS  50   4.164   2.008  -4.196
  381    HB2  LYS  50           HB2      LYS  50   4.252   4.499  -2.456
  382    HB3  LYS  50           HB3      LYS  50   4.566   2.829  -1.960
  383    HG2  LYS  50           HG2      LYS  50   6.507   2.811  -3.597
  384    HG3  LYS  50           HG3      LYS  50   6.267   4.557  -3.779
  385    HD2  LYS  50           HD2      LYS  50   6.565   4.826  -1.293
  386    HD3  LYS  50           HD3      LYS  50   6.823   3.083  -1.169
  387    HE2  LYS  50           HE2      LYS  50   9.014   3.544  -1.361
  388    HE3  LYS  50           HE3      LYS  50   8.673   3.679  -3.086
  389    HZ1  LYS  50           HZ1      LYS  50   9.904   5.552  -2.283
  390    HZ2  LYS  50           HZ2      LYS  50   8.426   6.090  -2.760
  391    HZ3  LYS  50           HZ3      LYS  50   8.804   5.933  -1.149
  392    H    PHE  51           H        PHE  51   2.786   1.037  -2.736
  393    HA   PHE  51           HA       PHE  51  -0.014   1.986  -2.724
  394    HB2  PHE  51           HB2      PHE  51   1.206  -0.511  -1.524
  395    HB3  PHE  51           HB3      PHE  51  -0.512  -0.134  -1.598
  396    HD1  PHE  51           HD1      PHE  51  -1.723  -0.163  -3.806
  397    HD2  PHE  51           HD2      PHE  51   2.416  -1.273  -3.482
  398    HE1  PHE  51           HE1      PHE  51  -1.776  -1.142  -6.097
  399    HE2  PHE  51           HE2      PHE  51   2.380  -2.152  -5.781
  400    HZ   PHE  51           HZ       PHE  51   0.267  -2.098  -7.106
  401    HA   PRO  52           HA       PRO  52   0.985   3.798   1.295
  402    HB2  PRO  52           HB2      PRO  52  -1.030   5.567   1.554
  403    HB3  PRO  52           HB3      PRO  52   0.165   5.689   0.227
  404    HG2  PRO  52           HG2      PRO  52  -2.622   4.492   0.115
  405    HG3  PRO  52           HG3      PRO  52  -1.865   5.650  -1.020
  406    HD2  PRO  52           HD2      PRO  52  -1.925   2.903  -1.419
  407    HD3  PRO  52           HD3      PRO  52  -0.648   3.980  -2.061
  408    H    VAL  53           H        VAL  53  -1.666   1.659   0.959
  409    HA   VAL  53           HA       VAL  53  -2.015   1.136   3.754
  410    HB   VAL  53           HB       VAL  53  -4.690   1.406   3.269
  411   HG11  VAL  53          HG11      VAL  53  -2.898   3.470   4.596
  412   HG12  VAL  53          HG12      VAL  53  -4.648   3.281   4.840
  413   HG13  VAL  53          HG13      VAL  53  -3.555   1.992   5.340
  414   HG21  VAL  53          HG21      VAL  53  -4.331   2.784   1.206
  415   HG22  VAL  53          HG22      VAL  53  -5.234   3.612   2.492
  416   HG23  VAL  53          HG23      VAL  53  -3.533   4.014   2.231
  417    H    ASP  54           H        ASP  54  -3.656  -0.755   3.974
  418    HA   ASP  54           HA       ASP  54  -3.153  -2.537   1.673
  419    HB2  ASP  54           HB2      ASP  54  -3.615  -4.381   3.094
  420    HB3  ASP  54           HB3      ASP  54  -2.440  -3.314   3.837
  421    H    GLY  55           H        GLY  55  -4.660  -3.984   0.834
  422    HA2  GLY  55           HA2      GLY  55  -7.365  -4.199   1.243
  423    HA3  GLY  55           HA3      GLY  55  -7.248  -2.728   0.283
  424    H    ARG  56           H        ARG  56  -7.769  -3.151  -1.684
  425    HA   ARG  56           HA       ARG  56  -6.599  -5.440  -3.158
  426    HB2  ARG  56           HB2      ARG  56  -9.608  -4.984  -3.140
  427    HB3  ARG  56           HB3      ARG  56  -8.760  -5.974  -4.324
  428    HG2  ARG  56           HG2      ARG  56  -7.872  -7.383  -2.466
  429    HG3  ARG  56           HG3      ARG  56  -8.912  -6.499  -1.344
  430    HD2  ARG  56           HD2      ARG  56  -9.777  -8.205  -3.720
  431    HD3  ARG  56           HD3      ARG  56  -9.935  -8.641  -2.025
  432    HE   ARG  56           HE       ARG  56 -11.778  -7.091  -3.589
  433   HH11  ARG  56          HH11      ARG  56 -10.674  -7.415  -0.253
  434   HH12  ARG  56          HH12      ARG  56 -12.010  -6.492   0.364
  435   HH21  ARG  56          HH21      ARG  56 -13.580  -6.159  -2.715
  436   HH22  ARG  56          HH22      ARG  56 -13.708  -5.987  -0.988
  437    H    VAL  57           H        VAL  57  -6.385  -5.310  -5.271
  438    HA   VAL  57           HA       VAL  57  -6.571  -2.686  -6.673
  439    HB   VAL  57           HB       VAL  57  -5.542  -5.450  -7.497
  440   HG11  VAL  57          HG11      VAL  57  -4.652  -4.298  -9.539
  441   HG12  VAL  57          HG12      VAL  57  -6.407  -4.356  -9.504
  442   HG13  VAL  57          HG13      VAL  57  -5.570  -2.845  -9.087
  443   HG21  VAL  57          HG21      VAL  57  -3.907  -2.918  -7.222
  444   HG22  VAL  57          HG22      VAL  57  -4.081  -4.101  -5.908
  445   HG23  VAL  57          HG23      VAL  57  -3.337  -4.569  -7.444
  446    H    ILE  58           H        ILE  58  -8.502  -2.254  -7.687
  447    HA   ILE  58           HA       ILE  58 -10.039  -4.537  -8.860
  448    HB   ILE  58           HB       ILE  58 -12.175  -3.411  -8.021
  449   HG12  ILE  58          HG12      ILE  58 -10.339  -2.328  -5.862
  450   HG13  ILE  58          HG13      ILE  58 -10.845  -1.319  -7.236
  451   HG21  ILE  58          HG21      ILE  58 -11.348  -5.579  -7.185
  452   HG22  ILE  58          HG22      ILE  58 -10.387  -4.738  -5.947
  453   HG23  ILE  58          HG23      ILE  58 -12.149  -4.640  -5.924
  454   HD11  ILE  58          HD11      ILE  58 -12.688  -2.528  -5.139
  455   HD12  ILE  58          HD12      ILE  58 -12.347  -0.814  -5.453
  456   HD13  ILE  58          HD13      ILE  58 -13.253  -1.755  -6.641
  457    H    GLU  59           H        GLU  59  -8.285  -2.511  -9.963
  458    HA   GLU  59           HA       GLU  59  -9.739  -2.342 -12.398
  459    HB2  GLU  59           HB2      GLU  59 -10.356  -0.136 -11.005
  460    HB3  GLU  59           HB3      GLU  59  -8.712   0.343 -11.418
  461    HG2  GLU  59           HG2      GLU  59 -10.199   1.250 -13.043
  462    HG3  GLU  59           HG3      GLU  59  -9.260  -0.016 -13.834
  463    H    GLY  60           H        GLY  60  -8.172  -2.816 -13.923
  464    HA2  GLY  60           HA2      GLY  60  -6.129  -2.653 -15.048
  465    HA3  GLY  60           HA3      GLY  60  -5.482  -1.654 -13.760
  466    H    HIS  61           H        HIS  61  -3.708  -3.105 -14.528
  467    HA   HIS  61           HA       HIS  61  -3.271  -5.331 -12.646
  468    HB2  HIS  61           HB2      HIS  61  -2.605  -6.912 -14.426
  469    HB3  HIS  61           HB3      HIS  61  -4.317  -6.524 -14.445
  470    HD1  HIS  61           HD1      HIS  61  -1.121  -5.815 -16.486
  471    HD2  HIS  61           HD2      HIS  61  -5.315  -5.575 -16.678
  472    HE1  HIS  61           HE1      HIS  61  -1.697  -5.200 -18.902
  473    H    SER  62           H        SER  62  -1.156  -5.679 -12.172
  474    HA   SER  62           HA       SER  62   1.024  -4.551 -13.688
  475    HB2  SER  62           HB2      SER  62   0.103  -3.070 -11.250
  476    HB3  SER  62           HB3      SER  62   1.825  -3.134 -11.553
  477    HG   SER  62           HG       SER  62  -0.074  -2.465 -13.549
  478    H    MET  63           H        MET  63   3.200  -4.679 -12.357
  479    HA   MET  63           HA       MET  63   3.149  -7.178 -10.726
  480    HB2  MET  63           HB2      MET  63   4.150  -7.543 -12.927
  481    HB3  MET  63           HB3      MET  63   5.354  -6.284 -12.609
  482    HG2  MET  63           HG2      MET  63   6.366  -7.521 -10.900
  483    HG3  MET  63           HG3      MET  63   4.987  -8.600 -10.683
  484    HE1  MET  63           HE1      MET  63   5.292 -11.257 -13.411
  485    HE2  MET  63           HE2      MET  63   4.541 -10.746 -11.884
  486    HE3  MET  63           HE3      MET  63   4.200  -9.859 -13.390
  487    H    VAL  64           H        VAL  64   3.813  -7.021  -8.740
  488    HA   VAL  64           HA       VAL  64   4.834  -4.398  -7.786
  489    HB   VAL  64           HB       VAL  64   2.962  -6.398  -6.494
  490   HG11  VAL  64          HG11      VAL  64   4.075  -3.785  -5.390
  491   HG12  VAL  64          HG12      VAL  64   2.648  -4.607  -4.750
  492   HG13  VAL  64          HG13      VAL  64   4.219  -5.408  -4.682
  493   HG21  VAL  64          HG21      VAL  64   1.893  -5.071  -8.254
  494   HG22  VAL  64          HG22      VAL  64   1.362  -4.473  -6.674
  495   HG23  VAL  64          HG23      VAL  64   2.582  -3.581  -7.600
  496    H    ASP  65           H        ASP  65   6.404  -4.192  -6.306
  497    HA   ASP  65           HA       ASP  65   8.095  -6.562  -5.705
  498    HB2  ASP  65           HB2      ASP  65   8.994  -4.549  -6.913
  499    HB3  ASP  65           HB3      ASP  65   8.654  -3.572  -5.485
  500    H    GLU  66           H        GLU  66   7.395  -7.533  -3.866
  501    HA   GLU  66           HA       GLU  66   6.952  -5.873  -1.433
  502    HB2  GLU  66           HB2      GLU  66   5.223  -7.405  -0.668
  503    HB3  GLU  66           HB3      GLU  66   4.806  -6.524  -2.124
  504    HG2  GLU  66           HG2      GLU  66   5.151  -8.522  -3.505
  505    HG3  GLU  66           HG3      GLU  66   5.683  -9.434  -2.087
  506    H    SER  67           H        SER  67   9.389  -7.005  -2.315
  507    HA   SER  67           HA       SER  67  10.158  -9.383  -1.047
  508    HB2  SER  67           HB2      SER  67  12.427  -8.765  -1.435
  509    HB3  SER  67           HB3      SER  67  11.469  -8.225  -2.806
  510    HG   SER  67           HG       SER  67  11.531  -6.076  -1.884
  511    H    LEU  68           H        LEU  68   9.850  -6.266   0.556
  512    HA   LEU  68           HA       LEU  68  11.315  -7.230   2.941
  513    HB2  LEU  68           HB2      LEU  68  11.557  -4.939   1.808
  514    HB3  LEU  68           HB3      LEU  68   9.943  -4.558   2.359
  515    HG   LEU  68           HG       LEU  68  11.684  -3.478   3.637
  516   HD11  LEU  68          HD11      LEU  68  10.446  -5.452   5.560
  517   HD12  LEU  68          HD12      LEU  68  10.908  -3.772   5.826
  518   HD13  LEU  68          HD13      LEU  68   9.520  -4.143   4.785
  519   HD21  LEU  68          HD21      LEU  68  13.449  -5.183   3.454
  520   HD22  LEU  68          HD22      LEU  68  13.205  -4.624   5.119
  521   HD23  LEU  68          HD23      LEU  68  12.577  -6.209   4.613
  522    H    ILE  69           H        ILE  69   8.018  -6.568   1.868
  523    HA   ILE  69           HA       ILE  69   6.856  -6.856   4.547
  524    HB   ILE  69           HB       ILE  69   5.286  -7.153   1.973
  525   HG12  ILE  69          HG12      ILE  69   6.595  -5.064   1.658
  526   HG13  ILE  69          HG13      ILE  69   4.898  -4.733   1.885
  527   HG21  ILE  69          HG21      ILE  69   4.616  -6.109   4.769
  528   HG22  ILE  69          HG22      ILE  69   3.500  -6.126   3.388
  529   HG23  ILE  69          HG23      ILE  69   4.115  -7.642   4.056
  530   HD11  ILE  69          HD11      ILE  69   6.324  -3.116   3.068
  531   HD12  ILE  69          HD12      ILE  69   5.250  -3.983   4.173
  532   HD13  ILE  69          HD13      ILE  69   6.978  -4.418   4.083
  533    H    THR  70           H        THR  70   6.812  -8.851   1.589
  534    HA   THR  70           HA       THR  70   5.795 -11.162   3.082
  535    HB   THR  70           HB       THR  70   6.138 -10.845   0.086
  536    HG1  THR  70           HG1      THR  70   4.114  -9.944   0.076
  537   HG21  THR  70          HG21      THR  70   4.045 -12.242   1.800
  538   HG22  THR  70          HG22      THR  70   4.125 -12.226   0.022
  539   HG23  THR  70          HG23      THR  70   5.370 -13.079   0.943
  540    H    GLY  71           H        GLY  71   8.781 -10.219   1.586
  541    HA2  GLY  71           HA2      GLY  71  10.862 -11.170   2.111
  542    HA3  GLY  71           HA3      GLY  71  10.072 -12.666   2.590
  543    H    GLU  72           H        GLU  72   8.613 -12.496  -0.191
  544    HA   GLU  72           HA       GLU  72  10.337 -14.243  -1.669
  545    HB2  GLU  72           HB2      GLU  72   8.060 -12.492  -2.680
  546    HB3  GLU  72           HB3      GLU  72   8.786 -13.829  -3.564
  547    HG2  GLU  72           HG2      GLU  72   7.306 -14.145  -0.914
  548    HG3  GLU  72           HG3      GLU  72   6.552 -14.263  -2.486
  549    H    ALA  73           H        ALA  73  12.225 -13.734  -2.657
  550    HA   ALA  73           HA       ALA  73  12.979 -10.984  -3.233
  551    HB1  ALA  73           HB1      ALA  73  15.155 -11.972  -3.726
  552    HB2  ALA  73           HB2      ALA  73  14.500 -12.621  -2.212
  553    HB3  ALA  73           HB3      ALA  73  14.453 -13.606  -3.692
  554    H    MET  74           H        MET  74  10.775 -11.700  -4.753
  555    HA   MET  74           HA       MET  74  11.650 -11.313  -7.496
  556    HB2  MET  74           HB2      MET  74  10.374 -13.262  -8.350
  557    HB3  MET  74           HB3      MET  74  11.840 -13.662  -7.475
  558    HG2  MET  74           HG2      MET  74  10.489 -14.240  -5.462
  559    HG3  MET  74           HG3      MET  74   9.022 -13.828  -6.340
  560    HE1  MET  74           HE1      MET  74  12.318 -15.926  -7.250
  561    HE2  MET  74           HE2      MET  74  11.788 -16.439  -5.629
  562    HE3  MET  74           HE3      MET  74  11.669 -17.559  -7.002
  563    HA   PRO  75           HA       PRO  75   7.919  -8.927  -7.123
  564    HB2  PRO  75           HB2      PRO  75   7.944  -9.034 -10.131
  565    HB3  PRO  75           HB3      PRO  75   7.673  -7.618  -9.053
  566    HG2  PRO  75           HG2      PRO  75  10.080  -7.983 -10.208
  567    HG3  PRO  75           HG3      PRO  75   9.994  -7.565  -8.463
  568    HD2  PRO  75           HD2      PRO  75  10.389 -10.306  -9.717
  569    HD3  PRO  75           HD3      PRO  75  11.256  -9.521  -8.362
  570    H    VAL  76           H        VAL  76   5.678  -8.933  -7.401
  571    HA   VAL  76           HA       VAL  76   4.455 -11.585  -8.087
  572    HB   VAL  76           HB       VAL  76   3.683  -9.670  -5.852
  573   HG11  VAL  76          HG11      VAL  76   2.811 -12.531  -6.460
  574   HG12  VAL  76          HG12      VAL  76   2.354 -11.587  -5.028
  575   HG13  VAL  76          HG13      VAL  76   1.801 -11.075  -6.623
  576   HG21  VAL  76          HG21      VAL  76   5.866 -10.666  -5.314
  577   HG22  VAL  76          HG22      VAL  76   4.613 -11.402  -4.320
  578   HG23  VAL  76          HG23      VAL  76   5.256 -12.286  -5.720
  579    H    ALA  77           H        ALA  77   2.660 -11.646  -9.336
  580    HA   ALA  77           HA       ALA  77   1.908  -9.197 -10.715
  581    HB1  ALA  77           HB1      ALA  77   2.258 -11.356 -11.884
  582    HB2  ALA  77           HB2      ALA  77   0.852 -12.024 -11.029
  583    HB3  ALA  77           HB3      ALA  77   0.643 -10.679 -12.168
  584    H    LYS  78           H        LYS  78   0.084  -8.090 -10.703
  585    HA   LYS  78           HA       LYS  78  -2.199  -8.860  -8.918
  586    HB2  LYS  78           HB2      LYS  78  -1.280  -6.040  -9.555
  587    HB3  LYS  78           HB3      LYS  78  -2.517  -6.523  -8.401
  588    HG2  LYS  78           HG2      LYS  78   0.474  -7.080  -8.133
  589    HG3  LYS  78           HG3      LYS  78  -0.400  -5.755  -7.383
  590    HD2  LYS  78           HD2      LYS  78  -1.694  -7.305  -5.996
  591    HD3  LYS  78           HD3      LYS  78  -0.959  -8.699  -6.815
  592    HE2  LYS  78           HE2      LYS  78   1.284  -7.999  -6.021
  593    HE3  LYS  78           HE3      LYS  78   0.572  -6.602  -5.200
  594    HZ1  LYS  78           HZ1      LYS  78   0.948  -8.448  -3.671
  595    HZ2  LYS  78           HZ2      LYS  78  -0.659  -8.126  -3.776
  596    HZ3  LYS  78           HZ3      LYS  78  -0.055  -9.431  -4.556
  597    H    LYS  79           H        LYS  79  -4.251  -8.281  -9.572
  598    HA   LYS  79           HA       LYS  79  -4.954  -7.270 -12.241
  599    HB2  LYS  79           HB2      LYS  79  -4.962 -10.166 -11.406
  600    HB3  LYS  79           HB3      LYS  79  -6.467  -9.608 -12.103
  601    HG2  LYS  79           HG2      LYS  79  -5.370  -8.901 -14.154
  602    HG3  LYS  79           HG3      LYS  79  -3.774  -9.168 -13.452
  603    HD2  LYS  79           HD2      LYS  79  -4.326 -10.956 -14.992
  604    HD3  LYS  79           HD3      LYS  79  -4.153 -11.574 -13.342
  605    HE2  LYS  79           HE2      LYS  79  -6.652 -11.547 -13.117
  606    HE3  LYS  79           HE3      LYS  79  -6.780 -11.036 -14.808
  607    HZ1  LYS  79           HZ1      LYS  79  -6.999 -13.472 -14.520
  608    HZ2  LYS  79           HZ2      LYS  79  -5.697 -13.121 -15.448
  609    HZ3  LYS  79           HZ3      LYS  79  -5.506 -13.568 -13.880
  610    HA   PRO  80           HA       PRO  80  -8.569  -5.994  -9.873
  611    HB2  PRO  80           HB2      PRO  80 -10.816  -6.989 -11.151
  612    HB3  PRO  80           HB3      PRO  80  -9.896  -5.544 -11.675
  613    HG2  PRO  80           HG2      PRO  80  -9.608  -8.395 -12.667
  614    HG3  PRO  80           HG3      PRO  80  -9.781  -6.898 -13.644
  615    HD2  PRO  80           HD2      PRO  80  -7.355  -7.954 -13.226
  616    HD3  PRO  80           HD3      PRO  80  -7.577  -6.191 -13.087
  617    H    GLY  81           H        GLY  81  -9.450  -6.742  -8.028
  618    HA2  GLY  81           HA2      GLY  81 -10.149  -8.173  -6.353
  619    HA3  GLY  81           HA3      GLY  81 -10.273  -9.505  -7.511
  620    H    SER  82           H        SER  82  -7.274  -7.615  -7.065
  621    HA   SER  82           HA       SER  82  -5.956 -10.039  -5.836
  622    HB2  SER  82           HB2      SER  82  -4.763  -7.756  -7.447
  623    HB3  SER  82           HB3      SER  82  -3.798  -8.833  -6.443
  624    HG   SER  82           HG       SER  82  -5.531  -9.914  -8.402
  625    H    THR  83           H        THR  83  -4.612  -9.694  -3.867
  626    HA   THR  83           HA       THR  83  -5.453  -7.254  -2.434
  627    HB   THR  83           HB       THR  83  -4.609  -8.227  -0.440
  628    HG1  THR  83           HG1      THR  83  -3.005  -9.478  -0.752
  629   HG21  THR  83          HG21      THR  83  -6.891  -8.824  -1.087
  630   HG22  THR  83          HG22      THR  83  -6.286 -10.255  -1.951
  631   HG23  THR  83          HG23      THR  83  -6.105 -10.112  -0.187
  632    H    VAL  84           H        VAL  84  -4.083  -5.849  -1.401
  633    HA   VAL  84           HA       VAL  84  -1.165  -5.974  -1.982
  634    HB   VAL  84           HB       VAL  84  -1.169  -3.504  -2.423
  635   HG11  VAL  84          HG11      VAL  84  -0.881  -5.127  -4.224
  636   HG12  VAL  84          HG12      VAL  84  -2.639  -5.213  -4.462
  637   HG13  VAL  84          HG13      VAL  84  -1.761  -3.702  -4.784
  638   HG21  VAL  84          HG21      VAL  84  -4.160  -3.851  -2.917
  639   HG22  VAL  84          HG22      VAL  84  -3.437  -2.943  -1.567
  640   HG23  VAL  84          HG23      VAL  84  -3.180  -2.408  -3.233
  641    H    ILE  85           H        ILE  85   0.138  -4.658  -0.680
  642    HA   ILE  85           HA       ILE  85  -0.954  -3.776   1.925
  643    HB   ILE  85           HB       ILE  85   1.503  -4.716   2.690
  644   HG12  ILE  85          HG12      ILE  85   1.653  -7.106   2.110
  645   HG13  ILE  85          HG13      ILE  85   0.404  -6.918   0.889
  646   HG21  ILE  85          HG21      ILE  85  -1.133  -6.205   2.870
  647   HG22  ILE  85          HG22      ILE  85   0.287  -6.408   3.923
  648   HG23  ILE  85          HG23      ILE  85  -0.583  -4.878   3.926
  649   HD11  ILE  85          HD11      ILE  85   1.890  -5.371  -0.374
  650   HD12  ILE  85          HD12      ILE  85   3.110  -5.512   0.893
  651   HD13  ILE  85          HD13      ILE  85   2.679  -6.931  -0.081
  652    H    ALA  86           H        ALA  86   0.246  -2.236   3.036
  653    HA   ALA  86           HA       ALA  86   1.120  -0.159   1.333
  654    HB1  ALA  86           HB1      ALA  86  -0.047   0.131   3.508
  655    HB2  ALA  86           HB2      ALA  86   1.419  -0.414   4.354
  656    HB3  ALA  86           HB3      ALA  86   1.440   1.088   3.405
  657    H    GLY  87           H        GLY  87   3.071   0.854   1.017
  658    HA2  GLY  87           HA2      GLY  87   5.380   1.240   1.082
  659    HA3  GLY  87           HA3      GLY  87   5.577  -0.071   2.244
  660    H    SER  88           H        SER  88   3.848  -1.446  -0.245
  661    HA   SER  88           HA       SER  88   6.254  -2.541  -1.576
  662    HB2  SER  88           HB2      SER  88   4.777  -4.067  -2.711
  663    HB3  SER  88           HB3      SER  88   4.576  -4.154  -0.963
  664    HG   SER  88           HG       SER  88   2.606  -3.059  -1.156
  665    H    ILE  89           H        ILE  89   6.458  -2.510  -3.915
  666    HA   ILE  89           HA       ILE  89   5.698   0.204  -4.924
  667    HB   ILE  89           HB       ILE  89   8.072  -1.273  -5.972
  668   HG12  ILE  89          HG12      ILE  89   8.469  -1.499  -3.576
  669   HG13  ILE  89          HG13      ILE  89   9.599  -0.424  -4.359
  670   HG21  ILE  89          HG21      ILE  89   7.363   0.826  -7.033
  671   HG22  ILE  89          HG22      ILE  89   7.449   1.676  -5.485
  672   HG23  ILE  89          HG23      ILE  89   8.927   1.038  -6.236
  673   HD11  ILE  89          HD11      ILE  89   7.231   0.573  -2.725
  674   HD12  ILE  89          HD12      ILE  89   8.884   0.367  -2.117
  675   HD13  ILE  89          HD13      ILE  89   8.566   1.537  -3.403
  676    H    ASN  90           H        ASN  90   4.749   0.523  -6.848
  677    HA   ASN  90           HA       ASN  90   3.779  -1.823  -8.343
  678    HB2  ASN  90           HB2      ASN  90   2.248   0.026  -7.500
  679    HB3  ASN  90           HB3      ASN  90   3.056   1.129  -8.612
  680   HD21  ASN  90          HD22      ASN  90   1.579   1.468 -10.262
  681   HD22  ASN  90          HD21      ASN  90   0.758   0.162 -11.100
  682    H    GLN  91           H        GLN  91   3.975  -2.144 -10.608
  683    HA   GLN  91           HA       GLN  91   5.221  -0.141 -12.276
  684    HB2  GLN  91           HB2      GLN  91   7.155  -1.450 -11.184
  685    HB3  GLN  91           HB3      GLN  91   6.589  -2.873 -12.050
  686    HG2  GLN  91           HG2      GLN  91   8.495  -1.671 -13.148
  687    HG3  GLN  91           HG3      GLN  91   7.079  -1.807 -14.194
  688   HE21  GLN  91          HE22      GLN  91   8.710   0.505 -11.906
  689   HE22  GLN  91          HE21      GLN  91   8.090   1.915 -12.776
  690    H    ASN  92           H        ASN  92   4.593  -0.309 -14.415
  691    HA   ASN  92           HA       ASN  92   4.330  -1.522 -16.398
  692    HB2  ASN  92           HB2      ASN  92   4.031  -3.750 -15.359
  693    HB3  ASN  92           HB3      ASN  92   2.357  -3.323 -14.987
  694   HD21  ASN  92          HD22      ASN  92   0.831  -3.054 -16.852
  695   HD22  ASN  92          HD21      ASN  92   1.199  -4.195 -18.126
  696    H    GLY  93           H        GLY  93   1.585  -0.627 -14.177
  697    HA2  GLY  93           HA2      GLY  93   0.999   1.628 -15.888
  698    HA3  GLY  93           HA3      GLY  93  -0.165   0.343 -16.148
  699    H    SER  94           H        SER  94  -1.311   2.496 -15.421
  700    HA   SER  94           HA       SER  94  -1.444   2.968 -12.565
  701    HB2  SER  94           HB2      SER  94  -3.198   4.045 -14.800
  702    HB3  SER  94           HB3      SER  94  -3.210   4.594 -13.115
  703    HG   SER  94           HG       SER  94  -1.067   4.737 -14.981
  704    H    LEU  95           H        LEU  95  -2.846   2.276 -11.083
  705    HA   LEU  95           HA       LEU  95  -5.164   0.539 -11.863
  706    HB2  LEU  95           HB2      LEU  95  -3.678   0.235  -9.287
  707    HB3  LEU  95           HB3      LEU  95  -4.620  -0.948 -10.128
  708    HG   LEU  95           HG       LEU  95  -1.819  -0.027 -10.933
  709   HD11  LEU  95          HD11      LEU  95  -2.747  -2.521  -9.443
  710   HD12  LEU  95          HD12      LEU  95  -1.079  -2.097  -9.886
  711   HD13  LEU  95          HD13      LEU  95  -1.927  -1.124  -8.706
  712   HD21  LEU  95          HD21      LEU  95  -3.494  -2.430 -11.758
  713   HD22  LEU  95          HD22      LEU  95  -3.208  -1.004 -12.785
  714   HD23  LEU  95          HD23      LEU  95  -1.849  -2.033 -12.322
  715    H    LEU  96           H        LEU  96  -6.831   0.342 -10.103
  716    HA   LEU  96           HA       LEU  96  -6.821   2.623  -8.174
  717    HB2  LEU  96           HB2      LEU  96  -9.285   1.616  -9.626
  718    HB3  LEU  96           HB3      LEU  96  -9.299   2.550  -8.147
  719    HG   LEU  96           HG       LEU  96  -7.877   4.317  -9.390
  720   HD11  LEU  96          HD11      LEU  96  -8.291   4.469 -11.799
  721   HD12  LEU  96          HD12      LEU  96  -7.376   3.013 -11.466
  722   HD13  LEU  96          HD13      LEU  96  -9.118   2.906 -11.794
  723   HD21  LEU  96          HD21      LEU  96 -10.203   4.680  -8.720
  724   HD22  LEU  96          HD22      LEU  96  -9.918   5.358 -10.330
  725   HD23  LEU  96          HD23      LEU  96 -10.777   3.815 -10.160
  726    H    ILE  97           H        ILE  97  -7.000   2.206  -6.180
  727    HA   ILE  97           HA       ILE  97  -7.243  -0.615  -5.286
  728    HB   ILE  97           HB       ILE  97  -5.791   1.670  -3.910
  729   HG12  ILE  97          HG12      ILE  97  -4.716   1.578  -6.046
  730   HG13  ILE  97          HG13      ILE  97  -3.666   0.924  -4.810
  731   HG21  ILE  97          HG21      ILE  97  -5.534  -1.353  -3.659
  732   HG22  ILE  97          HG22      ILE  97  -4.528  -0.157  -2.812
  733   HG23  ILE  97          HG23      ILE  97  -6.258  -0.249  -2.477
  734   HD11  ILE  97          HD11      ILE  97  -5.327  -0.786  -6.710
  735   HD12  ILE  97          HD12      ILE  97  -3.634  -0.372  -6.935
  736   HD13  ILE  97          HD13      ILE  97  -4.119  -1.353  -5.534
  737    H    CYS  98           H        CYS  98  -8.885  -1.111  -3.838
  738    HA   CYS  98           HA       CYS  98 -10.267   1.149  -2.468
  739    HB2  CYS  98           HB2      CYS  98 -11.807  -0.511  -1.593
  740    HB3  CYS  98           HB3      CYS  98 -11.764  -0.500  -3.358
  741    HG   CYS  98           HG       CYS  98 -10.023  -2.491  -1.407
  742    H    ALA  99           H        ALA  99  -9.380   1.945  -0.694
  743    HA   ALA  99           HA       ALA  99  -7.451   0.398   0.906
  744    HB1  ALA  99           HB1      ALA  99  -8.669   3.180   1.241
  745    HB2  ALA  99           HB2      ALA  99  -7.375   2.491   2.239
  746    HB3  ALA  99           HB3      ALA  99  -7.091   2.800   0.510
  747    H    THR 100           H        THR 100  -8.228  -1.116   2.219
  748    HA   THR 100           HA       THR 100 -10.996  -0.854   3.361
  749    HB   THR 100           HB       THR 100 -10.240  -2.750   1.801
  750    HG1  THR 100           HG1      THR 100 -11.485  -4.238   2.886
  751   HG21  THR 100          HG21      THR 100  -8.124  -3.242   3.231
  752   HG22  THR 100          HG22      THR 100  -9.251  -4.063   4.333
  753   HG23  THR 100          HG23      THR 100  -9.100  -4.608   2.657
  754    H    HIS 101           H        HIS 101  -7.996  -0.149   4.429
  755    HA   HIS 101           HA       HIS 101  -8.920  -0.199   7.212
  756    HB2  HIS 101           HB2      HIS 101  -6.313  -1.430   6.242
  757    HB3  HIS 101           HB3      HIS 101  -6.619  -0.982   7.911
  758    HD1  HIS 101           HD1      HIS 101  -7.095  -3.833   5.611
  759    HD2  HIS 101           HD2      HIS 101  -8.804  -2.301   9.139
  760    HE1  HIS 101           HE1      HIS 101  -8.509  -5.723   6.600
  761    H    VAL 102           H        VAL 102  -7.896   1.366   8.522
  762    HA   VAL 102           HA       VAL 102  -6.573   3.626   7.147
  763    HB   VAL 102           HB       VAL 102  -6.673   4.725   9.376
  764   HG11  VAL 102          HG11      VAL 102  -9.258   3.609   8.226
  765   HG12  VAL 102          HG12      VAL 102  -9.158   4.961   9.361
  766   HG13  VAL 102          HG13      VAL 102  -8.400   5.101   7.766
  767   HG21  VAL 102          HG21      VAL 102  -7.951   3.821  11.185
  768   HG22  VAL 102          HG22      VAL 102  -8.370   2.378  10.263
  769   HG23  VAL 102          HG23      VAL 102  -6.692   2.632  10.800
  770    H    GLY 103           H        GLY 103  -4.603   4.699   8.444
  771    HA2  GLY 103           HA2      GLY 103  -2.437   2.950   7.835
  772    HA3  GLY 103           HA3      GLY 103  -2.364   4.529   8.607
  773    H    ALA 104           H        ALA 104  -3.887   3.933  10.989
  774    HA   ALA 104           HA       ALA 104  -1.968   2.751  12.683
  775    HB1  ALA 104           HB1      ALA 104  -4.961   3.141  13.110
  776    HB2  ALA 104           HB2      ALA 104  -3.750   2.875  14.381
  777    HB3  ALA 104           HB3      ALA 104  -3.685   4.350  13.401
  778    H    ASP 105           H        ASP 105  -4.516   1.137  10.859
  779    HA   ASP 105           HA       ASP 105  -4.357  -1.396  12.385
  780    HB2  ASP 105           HB2      ASP 105  -6.477  -0.643  11.410
  781    HB3  ASP 105           HB3      ASP 105  -5.753  -0.713   9.807
  782    H    THR 106           H        THR 106  -2.353   0.103  10.006
  783    HA   THR 106           HA       THR 106  -2.130  -2.163   8.222
  784    HB   THR 106           HB       THR 106  -0.216  -1.053   7.172
  785    HG1  THR 106           HG1      THR 106  -0.694   0.956   9.100
  786   HG21  THR 106          HG21      THR 106  -1.413   0.936   6.319
  787   HG22  THR 106          HG22      THR 106  -2.422  -0.523   6.336
  788   HG23  THR 106          HG23      THR 106  -2.652   0.712   7.579
  789    H    THR 107           H        THR 107  -0.522  -3.604   7.902
  790    HA   THR 107           HA       THR 107   0.331  -4.806  10.305
  791    HB   THR 107           HB       THR 107  -0.294  -5.912   8.155
  792    HG1  THR 107           HG1      THR 107   0.562  -7.044   9.812
  793   HG21  THR 107          HG21      THR 107   2.616  -5.509   7.366
  794   HG22  THR 107          HG22      THR 107   1.383  -6.442   6.501
  795   HG23  THR 107          HG23      THR 107   1.228  -4.685   6.603
  796    H    LEU 108           H        LEU 108   2.080  -2.519   8.360
  797    HA   LEU 108           HA       LEU 108   4.740  -3.183   8.964
  798    HB2  LEU 108           HB2      LEU 108   3.354  -0.560   8.335
  799    HB3  LEU 108           HB3      LEU 108   5.089  -0.659   8.611
  800    HG   LEU 108           HG       LEU 108   5.381  -2.178   6.707
  801   HD11  LEU 108          HD11      LEU 108   2.386  -1.819   6.274
  802   HD12  LEU 108          HD12      LEU 108   3.526  -2.427   5.054
  803   HD13  LEU 108          HD13      LEU 108   3.278  -3.354   6.519
  804   HD21  LEU 108          HD21      LEU 108   4.883  -0.517   4.972
  805   HD22  LEU 108          HD22      LEU 108   3.741   0.294   6.069
  806   HD23  LEU 108          HD23      LEU 108   5.483   0.263   6.449
  807    H    SER 109           H        SER 109   2.626  -0.941  10.821
  808    HA   SER 109           HA       SER 109   4.610  -0.614  12.942
  809    HB2  SER 109           HB2      SER 109   1.712   0.203  12.696
  810    HB3  SER 109           HB3      SER 109   2.636   0.386  14.196
  811    HG   SER 109           HG       SER 109   3.393   2.133  13.376
  812    H    GLN 110           H        GLN 110   2.374  -3.103  12.197
  813    HA   GLN 110           HA       GLN 110   2.132  -4.084  14.974
  814    HB2  GLN 110           HB2      GLN 110   0.372  -4.351  13.110
  815    HB3  GLN 110           HB3      GLN 110   1.407  -5.591  12.456
  816    HG2  GLN 110           HG2      GLN 110  -0.081  -6.795  13.740
  817    HG3  GLN 110           HG3      GLN 110   1.336  -6.725  14.775
  818   HE21  GLN 110          HE22      GLN 110  -1.625  -4.833  14.011
  819   HE22  GLN 110          HE21      GLN 110  -1.966  -4.403  15.684
  820    H    ILE 111           H        ILE 111   3.937  -4.929  12.029
  821    HA   ILE 111           HA       ILE 111   5.370  -7.188  12.893
  822    HB   ILE 111           HB       ILE 111   6.090  -4.930  10.987
  823   HG12  ILE 111          HG12      ILE 111   5.493  -7.826  10.319
  824   HG13  ILE 111          HG13      ILE 111   4.180  -6.683  10.557
  825   HG21  ILE 111          HG21      ILE 111   7.651  -7.508  11.459
  826   HG22  ILE 111          HG22      ILE 111   7.897  -6.416  10.082
  827   HG23  ILE 111          HG23      ILE 111   8.246  -5.849  11.706
  828   HD11  ILE 111          HD11      ILE 111   5.050  -5.274   8.722
  829   HD12  ILE 111          HD12      ILE 111   6.361  -6.438   8.446
  830   HD13  ILE 111          HD13      ILE 111   4.676  -6.919   8.191
  831    H    VAL 112           H        VAL 112   6.379  -3.717  13.295
  832    HA   VAL 112           HA       VAL 112   8.768  -4.341  14.642
  833    HB   VAL 112           HB       VAL 112   8.800  -2.043  15.423
  834   HG11  VAL 112          HG11      VAL 112   7.782  -2.234  12.558
  835   HG12  VAL 112          HG12      VAL 112   8.815  -0.964  13.238
  836   HG13  VAL 112          HG13      VAL 112   9.441  -2.609  13.065
  837   HG21  VAL 112          HG21      VAL 112   6.394  -1.704  15.935
  838   HG22  VAL 112          HG22      VAL 112   7.071  -0.441  14.899
  839   HG23  VAL 112          HG23      VAL 112   6.060  -1.712  14.188
  840    H    LYS 113           H        LYS 113   5.614  -4.658  15.975
  841    HA   LYS 113           HA       LYS 113   6.451  -4.396  18.797
  842    HB2  LYS 113           HB2      LYS 113   3.958  -5.725  17.674
  843    HB3  LYS 113           HB3      LYS 113   4.287  -5.301  19.355
  844    HG2  LYS 113           HG2      LYS 113   4.440  -2.858  18.611
  845    HG3  LYS 113           HG3      LYS 113   3.890  -3.393  17.025
  846    HD2  LYS 113           HD2      LYS 113   1.922  -2.693  18.008
  847    HD3  LYS 113           HD3      LYS 113   1.870  -4.450  18.252
  848    HE2  LYS 113           HE2      LYS 113   2.935  -4.052  20.522
  849    HE3  LYS 113           HE3      LYS 113   2.761  -2.318  20.245
  850    HZ1  LYS 113           HZ1      LYS 113   0.915  -3.232  21.557
  851    HZ2  LYS 113           HZ2      LYS 113   0.319  -2.676  20.128
  852    HZ3  LYS 113           HZ3      LYS 113   0.538  -4.289  20.368
  853    H    LEU 114           H        LEU 114   6.421  -6.898  16.336
  854    HA   LEU 114           HA       LEU 114   7.002  -9.090  18.221
  855    HB2  LEU 114           HB2      LEU 114   6.123  -8.855  15.417
  856    HB3  LEU 114           HB3      LEU 114   7.496  -9.944  15.580
  857    HG   LEU 114           HG       LEU 114   4.871 -10.132  17.080
  858   HD11  LEU 114          HD11      LEU 114   4.487 -12.094  15.622
  859   HD12  LEU 114          HD12      LEU 114   4.661 -10.612  14.673
  860   HD13  LEU 114          HD13      LEU 114   6.009 -11.769  14.765
  861   HD21  LEU 114          HD21      LEU 114   6.675 -11.196  18.405
  862   HD22  LEU 114          HD22      LEU 114   5.668 -12.440  17.671
  863   HD23  LEU 114          HD23      LEU 114   7.246 -12.049  16.954
  864    H    VAL 115           H        VAL 115   8.556  -7.322  15.534
  865    HA   VAL 115           HA       VAL 115  11.082  -8.535  15.825
  866    HB   VAL 115           HB       VAL 115  10.433  -5.865  14.550
  867   HG11  VAL 115          HG11      VAL 115  12.865  -7.681  14.180
  868   HG12  VAL 115          HG12      VAL 115  12.480  -6.262  13.186
  869   HG13  VAL 115          HG13      VAL 115  12.889  -6.056  14.883
  870   HG21  VAL 115          HG21      VAL 115   9.194  -7.802  13.554
  871   HG22  VAL 115          HG22      VAL 115  10.414  -7.166  12.449
  872   HG23  VAL 115          HG23      VAL 115  10.729  -8.659  13.352
  873    H    GLU 116           H        GLU 116   9.840  -5.676  17.590
  874    HA   GLU 116           HA       GLU 116  12.334  -4.843  18.682
  875    HB2  GLU 116           HB2      GLU 116  10.307  -3.549  18.796
  876    HB3  GLU 116           HB3      GLU 116   9.492  -4.756  19.783
  877    HG2  GLU 116           HG2      GLU 116  12.041  -3.413  20.748
  878    HG3  GLU 116           HG3      GLU 116  10.501  -2.559  20.826
  879    H    GLU 117           H        GLU 117  10.217  -7.638  19.736
  880    HA   GLU 117           HA       GLU 117  11.957  -8.272  21.992
  881    HB2  GLU 117           HB2      GLU 117   9.573  -9.594  20.669
  882    HB3  GLU 117           HB3      GLU 117  10.368 -10.214  22.111
  883    HG2  GLU 117           HG2      GLU 117   9.236  -7.384  22.081
  884    HG3  GLU 117           HG3      GLU 117   8.208  -8.784  22.243
  885    H    ALA 118           H        ALA 118  12.174  -8.660  18.681
  886    HA   ALA 118           HA       ALA 118  12.977 -11.506  18.591
  887    HB1  ALA 118           HB1      ALA 118  13.288 -11.207  16.232
  888    HB2  ALA 118           HB2      ALA 118  11.737 -10.494  16.705
  889    HB3  ALA 118           HB3      ALA 118  13.157  -9.452  16.373
  890    H    GLN 119           H        GLN 119  14.598  -8.419  18.916
  891    HA   GLN 119           HA       GLN 119  17.294  -9.521  18.560
  892    HB2  GLN 119           HB2      GLN 119  16.236  -6.834  19.514
  893    HB3  GLN 119           HB3      GLN 119  17.916  -7.261  19.606
  894    HG2  GLN 119           HG2      GLN 119  18.123  -6.293  17.609
  895    HG3  GLN 119           HG3      GLN 119  17.533  -7.849  16.984
  896   HE21  GLN 119          HE22      GLN 119  15.439  -7.969  16.157
  897   HE22  GLN 119          HE21      GLN 119  14.263  -6.768  16.614
  Start of MODEL   22
    1    H    SER   1           H        SER   1  19.445  -3.191  15.414
    2    HA   SER   1           HA       SER   1  16.522  -2.956  15.454
    3    HB2  SER   1           HB2      SER   1  16.869  -1.408  17.271
    4    HB3  SER   1           HB3      SER   1  17.812  -2.884  17.540
    5    HG   SER   1           HG       SER   1  18.775  -0.616  17.784
    6    H    GLU   2           H        GLU   2  19.029  -1.497  13.631
    7    HA   GLU   2           HA       GLU   2  17.447   0.894  12.911
    8    HB2  GLU   2           HB2      GLU   2  20.051   0.649  13.001
    9    HB3  GLU   2           HB3      GLU   2  19.876  -0.208  11.480
   10    HG2  GLU   2           HG2      GLU   2  20.310   1.920  10.755
   11    HG3  GLU   2           HG3      GLU   2  18.552   1.971  10.732
   12    H    ALA   3           H        ALA   3  17.653  -2.425  11.917
   13    HA   ALA   3           HA       ALA   3  16.553  -2.036   9.205
   14    HB1  ALA   3           HB1      ALA   3  17.010  -4.595  10.786
   15    HB2  ALA   3           HB2      ALA   3  16.624  -4.456   9.073
   16    HB3  ALA   3           HB3      ALA   3  18.187  -3.871   9.661
   17    H    LEU   4           H        LEU   4  15.516  -2.718  12.497
   18    HA   LEU   4           HA       LEU   4  12.883  -3.632  12.104
   19    HB2  LEU   4           HB2      LEU   4  14.038  -3.644  14.254
   20    HB3  LEU   4           HB3      LEU   4  14.161  -1.893  14.246
   21    HG   LEU   4           HG       LEU   4  11.747  -1.642  14.546
   22   HD11  LEU   4          HD11      LEU   4  10.940  -3.680  13.483
   23   HD12  LEU   4          HD12      LEU   4  11.795  -4.672  14.687
   24   HD13  LEU   4          HD13      LEU   4  10.417  -3.649  15.182
   25   HD21  LEU   4          HD21      LEU   4  13.256  -1.775  16.504
   26   HD22  LEU   4          HD22      LEU   4  11.665  -2.461  16.861
   27   HD23  LEU   4          HD23      LEU   4  13.047  -3.538  16.551
   28    H    ALA   5           H        ALA   5  14.010  -0.094  12.147
   29    HA   ALA   5           HA       ALA   5  11.351   0.856  11.721
   30    HB1  ALA   5           HB1      ALA   5  12.553   2.990  11.501
   31    HB2  ALA   5           HB2      ALA   5  13.109   2.100  12.925
   32    HB3  ALA   5           HB3      ALA   5  14.108   2.131  11.450
   33    H    LYS   6           H        LYS   6  13.343  -0.861   9.546
   34    HA   LYS   6           HA       LYS   6  13.170   0.900   7.233
   35    HB2  LYS   6           HB2      LYS   6  14.889  -0.945   7.661
   36    HB3  LYS   6           HB3      LYS   6  13.635  -2.106   7.185
   37    HG2  LYS   6           HG2      LYS   6  13.462  -1.024   4.976
   38    HG3  LYS   6           HG3      LYS   6  14.608   0.229   5.483
   39    HD2  LYS   6           HD2      LYS   6  16.333  -1.591   5.827
   40    HD3  LYS   6           HD3      LYS   6  15.191  -2.740   5.090
   41    HE2  LYS   6           HE2      LYS   6  15.164  -1.412   3.007
   42    HE3  LYS   6           HE3      LYS   6  16.140  -0.159   3.776
   43    HZ1  LYS   6           HZ1      LYS   6  17.607  -1.422   2.507
   44    HZ2  LYS   6           HZ2      LYS   6  17.905  -1.893   4.044
   45    HZ3  LYS   6           HZ3      LYS   6  17.076  -2.882   3.045
   46    H    LEU   7           H        LEU   7  11.324  -1.899   8.386
   47    HA   LEU   7           HA       LEU   7   9.303  -2.226   6.506
   48    HB2  LEU   7           HB2      LEU   7   9.362  -2.287   9.549
   49    HB3  LEU   7           HB3      LEU   7   7.861  -2.592   8.696
   50    HG   LEU   7           HG       LEU   7   8.996  -4.624   9.440
   51   HD11  LEU   7          HD11      LEU   7   8.734  -5.904   7.379
   52   HD12  LEU   7          HD12      LEU   7   7.452  -4.702   7.544
   53   HD13  LEU   7          HD13      LEU   7   8.795  -4.421   6.407
   54   HD21  LEU   7          HD21      LEU   7  11.355  -3.945   9.121
   55   HD22  LEU   7          HD22      LEU   7  10.972  -5.502   8.378
   56   HD23  LEU   7          HD23      LEU   7  11.135  -4.070   7.354
   57    H    ILE   8           H        ILE   8   9.206   0.122   9.187
   58    HA   ILE   8           HA       ILE   8   6.757   1.394   8.306
   59    HB   ILE   8           HB       ILE   8   8.912   2.198  10.289
   60   HG12  ILE   8          HG12      ILE   8   7.665   0.216  10.959
   61   HG13  ILE   8          HG13      ILE   8   7.305   1.573  12.007
   62   HG21  ILE   8          HG21      ILE   8   6.290   3.633   9.751
   63   HG22  ILE   8          HG22      ILE   8   7.256   3.838  11.224
   64   HG23  ILE   8          HG23      ILE   8   7.932   4.294   9.663
   65   HD11  ILE   8          HD11      ILE   8   5.122   1.906  10.799
   66   HD12  ILE   8          HD12      ILE   8   5.482   0.459   9.824
   67   HD13  ILE   8          HD13      ILE   8   5.271   0.327  11.573
   68    H    SER   9           H        SER   9  10.091   1.884   7.477
   69    HA   SER   9           HA       SER   9   9.826   4.661   6.584
   70    HB2  SER   9           HB2      SER   9  12.084   2.651   6.265
   71    HB3  SER   9           HB3      SER   9  12.141   4.358   5.831
   72    HG   SER   9           HG       SER   9  11.836   3.176   8.388
   73    H    LEU  10           H        LEU  10   9.745   1.455   4.991
   74    HA   LEU  10           HA       LEU  10   9.881   2.389   2.309
   75    HB2  LEU  10           HB2      LEU  10   8.720  -0.069   3.650
   76    HB3  LEU  10           HB3      LEU  10   8.273   0.283   1.996
   77    HG   LEU  10           HG       LEU  10  10.756   0.416   1.411
   78   HD11  LEU  10          HD11      LEU  10  10.944  -1.102   4.043
   79   HD12  LEU  10          HD12      LEU  10  12.239  -0.949   2.827
   80   HD13  LEU  10          HD13      LEU  10  11.682   0.487   3.694
   81   HD21  LEU  10          HD21      LEU  10  10.894  -2.027   1.173
   82   HD22  LEU  10          HD22      LEU  10   9.549  -2.223   2.330
   83   HD23  LEU  10          HD23      LEU  10   9.281  -1.443   0.758
   84    H    GLN  11           H        GLN  11   7.238   2.743   4.541
   85    HA   GLN  11           HA       GLN  11   5.029   2.821   2.719
   86    HB2  GLN  11           HB2      GLN  11   5.313   4.064   5.427
   87    HB3  GLN  11           HB3      GLN  11   3.809   3.887   4.528
   88    HG2  GLN  11           HG2      GLN  11   3.979   1.444   4.602
   89    HG3  GLN  11           HG3      GLN  11   5.546   1.536   5.432
   90   HE21  GLN  11          HE22      GLN  11   5.543   2.997   7.443
   91   HE22  GLN  11          HE21      GLN  11   4.089   2.971   8.416
   92    H    ALA  12           H        ALA  12   4.023   4.405   1.636
   93    HA   ALA  12           HA       ALA  12   5.317   6.994   1.198
   94    HB1  ALA  12           HB1      ALA  12   3.511   7.261  -0.472
   95    HB2  ALA  12           HB2      ALA  12   4.364   5.719  -0.657
   96    HB3  ALA  12           HB3      ALA  12   2.763   5.753   0.096
   97    H    THR  13           H        THR  13   4.201   9.040   1.409
   98    HA   THR  13           HA       THR  13   2.689   9.127   3.978
   99    HB   THR  13           HB       THR  13   3.891  11.663   3.109
  100    HG1  THR  13           HG1      THR  13   5.480  10.314   2.248
  101   HG21  THR  13          HG21      THR  13   2.991  11.066   5.329
  102   HG22  THR  13          HG22      THR  13   4.271   9.851   5.516
  103   HG23  THR  13          HG23      THR  13   4.690  11.586   5.423
  104    H    GLU  14           H        GLU  14   1.909   9.517   0.859
  105    HA   GLU  14           HA       GLU  14  -0.389  11.300   1.479
  106    HB2  GLU  14           HB2      GLU  14  -0.127  12.579  -0.480
  107    HB3  GLU  14           HB3      GLU  14   1.374  12.660   0.423
  108    HG2  GLU  14           HG2      GLU  14   0.911  10.876  -2.022
  109    HG3  GLU  14           HG3      GLU  14   1.595  12.484  -2.091
  110    H    ALA  15           H        ALA  15  -2.244  11.100   0.020
  111    HA   ALA  15           HA       ALA  15  -2.319   8.639  -1.635
  112    HB1  ALA  15           HB1      ALA  15  -2.991   7.945   0.641
  113    HB2  ALA  15           HB2      ALA  15  -4.240   9.212   0.661
  114    HB3  ALA  15           HB3      ALA  15  -4.359   7.862  -0.487
  115    H    THR  16           H        THR  16  -3.775   8.660  -3.310
  116    HA   THR  16           HA       THR  16  -5.369  11.152  -3.748
  117    HB   THR  16           HB       THR  16  -4.459   9.094  -5.777
  118    HG1  THR  16           HG1      THR  16  -3.018  10.709  -6.363
  119   HG21  THR  16          HG21      THR  16  -5.073  10.869  -7.416
  120   HG22  THR  16          HG22      THR  16  -6.490  10.303  -6.522
  121   HG23  THR  16          HG23      THR  16  -5.736  11.854  -6.093
  122    H    ILE  17           H        ILE  17  -7.400  10.973  -3.111
  123    HA   ILE  17           HA       ILE  17  -8.911   8.418  -3.130
  124    HB   ILE  17           HB       ILE  17  -9.820  11.181  -2.213
  125   HG12  ILE  17          HG12      ILE  17  -8.535   8.998  -0.529
  126   HG13  ILE  17          HG13      ILE  17  -7.873  10.590  -0.869
  127   HG21  ILE  17          HG21      ILE  17 -10.906   8.383  -1.624
  128   HG22  ILE  17          HG22      ILE  17 -11.555   9.900  -0.961
  129   HG23  ILE  17          HG23      ILE  17 -11.671   9.603  -2.668
  130   HD11  ILE  17          HD11      ILE  17  -8.741  10.592   1.361
  131   HD12  ILE  17          HD12      ILE  17  -9.790  11.624   0.368
  132   HD13  ILE  17          HD13      ILE  17 -10.306   9.984   0.848
  133    H    VAL  18           H        VAL  18 -10.733   8.094  -4.486
  134    HA   VAL  18           HA       VAL  18 -11.405  10.355  -6.336
  135    HB   VAL  18           HB       VAL  18 -12.111   8.729  -8.060
  136   HG11  VAL  18          HG11      VAL  18  -9.181   8.828  -7.315
  137   HG12  VAL  18          HG12      VAL  18  -9.845   8.359  -8.909
  138   HG13  VAL  18          HG13      VAL  18 -10.112   9.984  -8.282
  139   HG21  VAL  18          HG21      VAL  18 -12.191   6.653  -6.636
  140   HG22  VAL  18          HG22      VAL  18 -11.165   6.480  -8.072
  141   HG23  VAL  18          HG23      VAL  18 -10.422   6.736  -6.480
  142    H    THR  19           H        THR  19 -13.358  10.960  -6.756
  143    HA   THR  19           HA       THR  19 -15.639   9.572  -5.385
  144    HB   THR  19           HB       THR  19 -16.648  11.944  -5.224
  145    HG1  THR  19           HG1      THR  19 -15.288  13.313  -6.133
  146   HG21  THR  19          HG21      THR  19 -15.966  10.579  -3.288
  147   HG22  THR  19          HG22      THR  19 -14.319  11.253  -3.407
  148   HG23  THR  19          HG23      THR  19 -15.718  12.309  -3.050
  149    H    LEU  20           H        LEU  20 -17.589   9.455  -6.272
  150    HA   LEU  20           HA       LEU  20 -17.920  10.230  -9.125
  151    HB2  LEU  20           HB2      LEU  20 -19.739   8.650  -7.268
  152    HB3  LEU  20           HB3      LEU  20 -20.129   9.111  -8.894
  153    HG   LEU  20           HG       LEU  20 -19.494   6.839  -8.793
  154   HD11  LEU  20          HD11      LEU  20 -17.469   8.477 -10.336
  155   HD12  LEU  20          HD12      LEU  20 -17.870   6.771 -10.621
  156   HD13  LEU  20          HD13      LEU  20 -19.115   8.007 -10.835
  157   HD21  LEU  20          HD21      LEU  20 -17.821   6.905  -6.936
  158   HD22  LEU  20          HD22      LEU  20 -17.325   5.957  -8.349
  159   HD23  LEU  20          HD23      LEU  20 -16.639   7.567  -8.095
  160    H    ASP  21           H        ASP  21 -17.774  12.372  -8.791
  161    HA   ASP  21           HA       ASP  21 -19.623  13.902  -7.093
  162    HB2  ASP  21           HB2      ASP  21 -17.459  14.531  -9.082
  163    HB3  ASP  21           HB3      ASP  21 -18.488  15.815  -8.488
  164    H    SER  22           H        SER  22 -19.327  12.993 -10.462
  165    HA   SER  22           HA       SER  22 -22.177  13.518 -10.949
  166    HB2  SER  22           HB2      SER  22 -20.079  14.389 -12.944
  167    HB3  SER  22           HB3      SER  22 -21.821  14.518 -13.118
  168    HG   SER  22           HG       SER  22 -21.891  16.168 -11.837
  169    H    ASP  23           H        ASP  23 -22.907  11.801 -11.564
  170    HA   ASP  23           HA       ASP  23 -22.801   9.392 -11.799
  171    HB2  ASP  23           HB2      ASP  23 -23.904  10.957 -14.160
  172    HB3  ASP  23           HB3      ASP  23 -24.296   9.277 -13.797
  173    H    ASN  24           H        ASN  24 -20.341   9.239 -12.060
  174    HA   ASN  24           HA       ASN  24 -18.467   8.364 -12.965
  175    HB2  ASN  24           HB2      ASN  24 -20.499   6.857 -14.589
  176    HB3  ASN  24           HB3      ASN  24 -18.806   6.790 -15.052
  177   HD21  ASN  24          HD21      ASN  24 -21.098   5.973 -12.425
  178   HD22  ASN  24          HD22      ASN  24 -19.930   4.937 -11.596
  179    H    ILE  25           H        ILE  25 -20.433  10.265 -15.102
  180    HA   ILE  25           HA       ILE  25 -18.732  10.873 -17.179
  181    HB   ILE  25           HB       ILE  25 -20.092  13.122 -17.027
  182   HG12  ILE  25          HG12      ILE  25 -21.684  11.637 -14.974
  183   HG13  ILE  25          HG13      ILE  25 -20.678  13.067 -14.716
  184   HG21  ILE  25          HG21      ILE  25 -20.489  11.140 -18.536
  185   HG22  ILE  25          HG22      ILE  25 -21.562  10.474 -17.286
  186   HG23  ILE  25          HG23      ILE  25 -21.967  11.998 -18.109
  187   HD11  ILE  25          HD11      ILE  25 -23.188  12.893 -16.430
  188   HD12  ILE  25          HD12      ILE  25 -23.006  13.717 -14.882
  189   HD13  ILE  25          HD13      ILE  25 -22.144  14.329 -16.305
  190    H    LEU  26           H        LEU  26 -18.398  12.069 -13.900
  191    HA   LEU  26           HA       LEU  26 -16.249  13.958 -14.827
  192    HB2  LEU  26           HB2      LEU  26 -18.171  14.837 -13.485
  193    HB3  LEU  26           HB3      LEU  26 -17.617  13.866 -12.122
  194    HG   LEU  26           HG       LEU  26 -15.303  15.240 -12.770
  195   HD11  LEU  26          HD11      LEU  26 -17.639  17.128 -13.277
  196   HD12  LEU  26          HD12      LEU  26 -15.924  17.562 -13.218
  197   HD13  LEU  26          HD13      LEU  26 -16.520  16.542 -14.542
  198   HD21  LEU  26          HD21      LEU  26 -15.913  16.845 -10.978
  199   HD22  LEU  26          HD22      LEU  26 -17.555  16.162 -10.969
  200   HD23  LEU  26          HD23      LEU  26 -16.134  15.146 -10.570
  201    H    LEU  27           H        LEU  27 -16.900  11.705 -12.277
  202    HA   LEU  27           HA       LEU  27 -15.547  10.654 -10.662
  203    HB2  LEU  27           HB2      LEU  27 -15.624   9.081 -12.544
  204    HB3  LEU  27           HB3      LEU  27 -14.170   9.803 -13.226
  205    HG   LEU  27           HG       LEU  27 -12.868   9.061 -11.223
  206   HD11  LEU  27          HD11      LEU  27 -15.386   7.551 -10.436
  207   HD12  LEU  27          HD12      LEU  27 -13.792   7.448  -9.668
  208   HD13  LEU  27          HD13      LEU  27 -14.713   8.945  -9.543
  209   HD21  LEU  27          HD21      LEU  27 -13.026   7.660 -13.256
  210   HD22  LEU  27          HD22      LEU  27 -12.862   6.681 -11.784
  211   HD23  LEU  27          HD23      LEU  27 -14.444   6.839 -12.574
  212    H    SER  28           H        SER  28 -14.770  12.486  -9.586
  213    HA   SER  28           HA       SER  28 -12.401  13.915 -10.497
  214    HB2  SER  28           HB2      SER  28 -14.422  14.917  -9.293
  215    HB3  SER  28           HB3      SER  28 -13.784  14.172  -7.815
  216    HG   SER  28           HG       SER  28 -12.334  15.643  -7.689
  217    H    GLU  29           H        GLU  29 -10.402  14.217  -9.282
  218    HA   GLU  29           HA       GLU  29  -9.701  11.997  -7.434
  219    HB2  GLU  29           HB2      GLU  29  -7.960  13.543  -9.381
  220    HB3  GLU  29           HB3      GLU  29  -7.406  12.292  -8.250
  221    HG2  GLU  29           HG2      GLU  29  -8.319  10.565  -9.487
  222    HG3  GLU  29           HG3      GLU  29  -9.478  11.604 -10.316
  223    H    GLU  30           H        GLU  30  -9.041  12.617  -5.460
  224    HA   GLU  30           HA       GLU  30  -8.391  15.484  -4.868
  225    HB2  GLU  30           HB2      GLU  30  -9.703  13.617  -2.894
  226    HB3  GLU  30           HB3      GLU  30  -9.656  15.369  -2.886
  227    HG2  GLU  30           HG2      GLU  30 -11.340  13.566  -4.689
  228    HG3  GLU  30           HG3      GLU  30 -11.897  14.477  -3.303
  229    H    GLN  31           H        GLN  31  -6.514  15.833  -3.507
  230    HA   GLN  31           HA       GLN  31  -4.968  13.372  -2.837
  231    HB2  GLN  31           HB2      GLN  31  -4.093  16.196  -3.541
  232    HB3  GLN  31           HB3      GLN  31  -3.020  14.889  -3.013
  233    HG2  GLN  31           HG2      GLN  31  -3.649  13.540  -4.934
  234    HG3  GLN  31           HG3      GLN  31  -4.677  14.856  -5.572
  235   HE21  GLN  31          HE22      GLN  31  -1.531  13.627  -4.969
  236   HE22  GLN  31          HE21      GLN  31  -0.899  15.117  -4.718
  237    H    VAL  32           H        VAL  32  -4.442  12.978  -0.807
  238    HA   VAL  32           HA       VAL  32  -4.679  15.098   1.296
  239    HB   VAL  32           HB       VAL  32  -5.938  13.666   2.722
  240   HG11  VAL  32          HG11      VAL  32  -7.331  13.595   0.023
  241   HG12  VAL  32          HG12      VAL  32  -8.075  13.570   1.629
  242   HG13  VAL  32          HG13      VAL  32  -7.227  15.024   1.079
  243   HG21  VAL  32          HG21      VAL  32  -6.820  11.503   2.086
  244   HG22  VAL  32          HG22      VAL  32  -5.971  11.561   0.523
  245   HG23  VAL  32          HG23      VAL  32  -5.061  11.447   2.047
  246    H    ASP  33           H        ASP  33  -3.913  14.376   3.433
  247    HA   ASP  33           HA       ASP  33  -1.265  13.111   3.337
  248    HB2  ASP  33           HB2      ASP  33  -1.568  15.091   4.672
  249    HB3  ASP  33           HB3      ASP  33  -2.895  14.359   5.555
  250    H    VAL  34           H        VAL  34  -0.615  11.267   4.491
  251    HA   VAL  34           HA       VAL  34  -2.348   9.055   4.439
  252    HB   VAL  34           HB       VAL  34   0.083   8.986   4.243
  253   HG11  VAL  34          HG11      VAL  34   0.143   9.200   7.280
  254   HG12  VAL  34          HG12      VAL  34   1.520   8.845   6.223
  255   HG13  VAL  34          HG13      VAL  34   0.728  10.428   6.141
  256   HG21  VAL  34          HG21      VAL  34   0.433   6.828   5.158
  257   HG22  VAL  34          HG22      VAL  34  -0.831   7.045   6.375
  258   HG23  VAL  34          HG23      VAL  34  -1.264   6.922   4.657
  259    H    GLU  35           H        GLU  35  -2.137  11.345   7.125
  260    HA   GLU  35           HA       GLU  35  -3.641   9.476   8.883
  261    HB2  GLU  35           HB2      GLU  35  -1.983  11.104   9.805
  262    HB3  GLU  35           HB3      GLU  35  -3.080  12.422   9.350
  263    HG2  GLU  35           HG2      GLU  35  -4.832  11.489  10.812
  264    HG3  GLU  35           HG3      GLU  35  -3.829  10.083  11.169
  265    H    LEU  36           H        LEU  36  -4.474  11.750   6.376
  266    HA   LEU  36           HA       LEU  36  -7.172  12.281   7.450
  267    HB2  LEU  36           HB2      LEU  36  -5.746  13.311   4.976
  268    HB3  LEU  36           HB3      LEU  36  -7.269  13.913   5.626
  269    HG   LEU  36           HG       LEU  36  -4.531  14.128   6.949
  270   HD11  LEU  36          HD11      LEU  36  -4.892  15.636   5.001
  271   HD12  LEU  36          HD12      LEU  36  -6.368  16.254   5.759
  272   HD13  LEU  36          HD13      LEU  36  -4.785  16.528   6.520
  273   HD21  LEU  36          HD21      LEU  36  -6.158  13.933   8.706
  274   HD22  LEU  36          HD22      LEU  36  -5.641  15.617   8.571
  275   HD23  LEU  36          HD23      LEU  36  -7.226  15.122   7.920
  276    H    VAL  37           H        VAL  37  -5.727  10.080   5.242
  277    HA   VAL  37           HA       VAL  37  -8.263   9.512   3.810
  278    HB   VAL  37           HB       VAL  37  -6.289   9.279   2.472
  279   HG11  VAL  37          HG11      VAL  37  -5.261   7.191   4.441
  280   HG12  VAL  37          HG12      VAL  37  -4.532   7.625   2.884
  281   HG13  VAL  37          HG13      VAL  37  -4.581   8.812   4.188
  282   HG21  VAL  37          HG21      VAL  37  -7.331   6.500   3.113
  283   HG22  VAL  37          HG22      VAL  37  -8.137   7.701   2.074
  284   HG23  VAL  37          HG23      VAL  37  -6.552   7.047   1.622
  285    H    GLN  38           H        GLN  38  -9.599   7.773   4.316
  286    HA   GLN  38           HA       GLN  38  -8.937   6.222   6.782
  287    HB2  GLN  38           HB2      GLN  38 -11.609   7.422   5.946
  288    HB3  GLN  38           HB3      GLN  38 -11.404   6.211   7.211
  289    HG2  GLN  38           HG2      GLN  38 -10.037   7.719   8.546
  290    HG3  GLN  38           HG3      GLN  38 -10.005   8.916   7.241
  291   HE21  GLN  38          HE22      GLN  38 -12.735   7.094   8.790
  292   HE22  GLN  38          HE21      GLN  38 -13.652   8.592   8.889
  293    H    ARG  39           H        ARG  39 -10.012   4.162   6.925
  294    HA   ARG  39           HA       ARG  39 -10.002   2.663   4.389
  295    HB2  ARG  39           HB2      ARG  39 -10.392   0.693   5.717
  296    HB3  ARG  39           HB3      ARG  39  -9.122   1.659   6.481
  297    HG2  ARG  39           HG2      ARG  39 -11.020   2.642   7.934
  298    HG3  ARG  39           HG3      ARG  39 -12.027   1.333   7.311
  299    HD2  ARG  39           HD2      ARG  39 -10.529  -0.318   8.259
  300    HD3  ARG  39           HD3      ARG  39  -9.408   0.942   8.806
  301    HE   ARG  39           HE       ARG  39 -11.134   1.791  10.324
  302   HH11  ARG  39          HH11      ARG  39 -11.465  -1.581   9.466
  303   HH12  ARG  39          HH12      ARG  39 -12.908  -1.764  10.447
  304   HH21  ARG  39          HH21      ARG  39 -12.819   1.428  11.689
  305   HH22  ARG  39          HH22      ARG  39 -13.488  -0.181  11.831
  306    H    GLY  40           H        GLY  40 -11.893   1.774   3.297
  307    HA2  GLY  40           HA2      GLY  40 -14.247   1.487   3.103
  308    HA3  GLY  40           HA3      GLY  40 -14.531   2.829   4.205
  309    H    ASP  41           H        ASP  41 -11.973   3.778   2.193
  310    HA   ASP  41           HA       ASP  41 -13.754   4.938   0.094
  311    HB2  ASP  41           HB2      ASP  41 -11.208   5.992   1.379
  312    HB3  ASP  41           HB3      ASP  41 -11.980   6.707  -0.039
  313    H    ILE  42           H        ILE  42 -12.395   5.542  -1.937
  314    HA   ILE  42           HA       ILE  42 -10.915   3.099  -2.856
  315    HB   ILE  42           HB       ILE  42 -12.680   4.951  -4.467
  316   HG12  ILE  42          HG12      ILE  42 -14.077   3.523  -3.104
  317   HG13  ILE  42          HG13      ILE  42 -14.139   3.026  -4.780
  318   HG21  ILE  42          HG21      ILE  42 -10.877   4.174  -5.877
  319   HG22  ILE  42          HG22      ILE  42 -11.047   2.509  -5.292
  320   HG23  ILE  42          HG23      ILE  42 -12.320   3.253  -6.289
  321   HD11  ILE  42          HD11      ILE  42 -12.675   1.609  -2.532
  322   HD12  ILE  42          HD12      ILE  42 -14.120   1.064  -3.395
  323   HD13  ILE  42          HD13      ILE  42 -12.573   1.127  -4.246
  324    H    ILE  43           H        ILE  43  -8.785   3.449  -3.224
  325    HA   ILE  43           HA       ILE  43  -7.814   6.180  -3.724
  326    HB   ILE  43           HB       ILE  43  -6.397   3.761  -2.562
  327   HG12  ILE  43          HG12      ILE  43  -8.216   4.175  -1.039
  328   HG13  ILE  43          HG13      ILE  43  -6.705   4.688  -0.321
  329   HG21  ILE  43          HG21      ILE  43  -5.711   6.728  -2.483
  330   HG22  ILE  43          HG22      ILE  43  -4.836   5.448  -1.616
  331   HG23  ILE  43          HG23      ILE  43  -4.854   5.462  -3.379
  332   HD11  ILE  43          HD11      ILE  43  -7.246   7.047  -0.734
  333   HD12  ILE  43          HD12      ILE  43  -8.745   6.586  -1.565
  334   HD13  ILE  43          HD13      ILE  43  -8.559   6.246   0.154
  335    H    LYS  44           H        LYS  44  -6.739   6.634  -5.531
  336    HA   LYS  44           HA       LYS  44  -5.940   4.598  -7.480
  337    HB2  LYS  44           HB2      LYS  44  -5.600   7.633  -7.361
  338    HB3  LYS  44           HB3      LYS  44  -5.184   6.653  -8.755
  339    HG2  LYS  44           HG2      LYS  44  -7.973   6.844  -7.559
  340    HG3  LYS  44           HG3      LYS  44  -7.404   7.819  -8.904
  341    HD2  LYS  44           HD2      LYS  44  -7.629   4.790  -8.868
  342    HD3  LYS  44           HD3      LYS  44  -8.785   5.887  -9.616
  343    HE2  LYS  44           HE2      LYS  44  -5.891   5.422 -10.480
  344    HE3  LYS  44           HE3      LYS  44  -7.369   4.861 -11.289
  345    HZ1  LYS  44           HZ1      LYS  44  -6.590   7.710 -10.962
  346    HZ2  LYS  44           HZ2      LYS  44  -6.524   6.850 -12.352
  347    HZ3  LYS  44           HZ3      LYS  44  -7.982   7.166 -11.655
  348    H    VAL  45           H        VAL  45  -3.944   3.810  -7.964
  349    HA   VAL  45           HA       VAL  45  -1.589   5.191  -6.749
  350    HB   VAL  45           HB       VAL  45  -2.244   2.831  -5.976
  351   HG11  VAL  45          HG11      VAL  45  -0.881   2.039  -8.585
  352   HG12  VAL  45          HG12      VAL  45  -1.424   0.963  -7.286
  353   HG13  VAL  45          HG13      VAL  45  -2.606   1.890  -8.240
  354   HG21  VAL  45          HG21      VAL  45  -0.074   3.921  -5.463
  355   HG22  VAL  45          HG22      VAL  45   0.116   2.184  -5.726
  356   HG23  VAL  45          HG23      VAL  45   0.601   3.321  -6.996
  357    H    VAL  46           H        VAL  46   0.160   5.680  -7.978
  358    HA   VAL  46           HA       VAL  46  -0.166   5.581 -10.906
  359    HB   VAL  46           HB       VAL  46   1.565   7.347 -10.917
  360   HG11  VAL  46          HG11      VAL  46  -0.694   7.929  -8.965
  361   HG12  VAL  46          HG12      VAL  46   0.203   9.105  -9.939
  362   HG13  VAL  46          HG13      VAL  46  -0.825   7.910 -10.740
  363   HG21  VAL  46          HG21      VAL  46   1.493   7.202  -7.876
  364   HG22  VAL  46          HG22      VAL  46   2.860   6.724  -8.912
  365   HG23  VAL  46          HG23      VAL  46   2.337   8.399  -8.874
  366    HA   PRO  47           HA       PRO  47   3.386   2.921 -11.712
  367    HB2  PRO  47           HB2      PRO  47   4.552   4.205 -13.872
  368    HB3  PRO  47           HB3      PRO  47   3.103   3.169 -13.986
  369    HG2  PRO  47           HG2      PRO  47   3.224   6.189 -13.762
  370    HG3  PRO  47           HG3      PRO  47   2.267   5.200 -14.914
  371    HD2  PRO  47           HD2      PRO  47   1.132   6.189 -12.691
  372    HD3  PRO  47           HD3      PRO  47   0.752   4.529 -13.212
  373    H    GLY  48           H        GLY  48   5.462   2.890 -10.967
  374    HA2  GLY  48           HA2      GLY  48   7.421   3.559  -9.946
  375    HA3  GLY  48           HA3      GLY  48   7.150   5.212 -10.512
  376    H    GLY  49           H        GLY  49   4.327   4.637  -8.948
  377    HA2  GLY  49           HA2      GLY  49   5.079   5.946  -6.490
  378    HA3  GLY  49           HA3      GLY  49   3.479   5.384  -6.960
  379    H    LYS  50           H        LYS  50   4.132   5.225  -4.430
  380    HA   LYS  50           HA       LYS  50   4.620   2.330  -3.818
  381    HB2  LYS  50           HB2      LYS  50   5.528   4.853  -2.389
  382    HB3  LYS  50           HB3      LYS  50   5.512   3.271  -1.591
  383    HG2  LYS  50           HG2      LYS  50   7.158   2.378  -3.032
  384    HG3  LYS  50           HG3      LYS  50   6.970   3.672  -4.225
  385    HD2  LYS  50           HD2      LYS  50   7.933   5.314  -2.717
  386    HD3  LYS  50           HD3      LYS  50   8.094   4.102  -1.425
  387    HE2  LYS  50           HE2      LYS  50   9.711   2.845  -2.670
  388    HE3  LYS  50           HE3      LYS  50   9.352   3.723  -4.170
  389    HZ1  LYS  50           HZ1      LYS  50  10.314   5.702  -3.210
  390    HZ2  LYS  50           HZ2      LYS  50  10.598   4.973  -1.780
  391    HZ3  LYS  50           HZ3      LYS  50  11.413   4.492  -3.129
  392    H    PHE  51           H        PHE  51   3.386   1.427  -2.149
  393    HA   PHE  51           HA       PHE  51   0.736   2.614  -1.862
  394    HB2  PHE  51           HB2      PHE  51   1.923   0.048  -0.803
  395    HB3  PHE  51           HB3      PHE  51   0.245   0.534  -0.571
  396    HD1  PHE  51           HD2      PHE  51  -1.236   0.936  -2.625
  397    HD2  PHE  51           HD1      PHE  51   2.587  -1.033  -2.837
  398    HE1  PHE  51           HE2      PHE  51  -1.813   0.035  -4.863
  399    HE2  PHE  51           HE1      PHE  51   2.033  -1.887  -5.095
  400    HZ   PHE  51           HZ       PHE  51  -0.180  -1.366  -6.111
  401    HA   PRO  52           HA       PRO  52   1.785   4.468   2.167
  402    HB2  PRO  52           HB2      PRO  52  -0.391   6.028   2.540
  403    HB3  PRO  52           HB3      PRO  52   0.796   6.380   1.253
  404    HG2  PRO  52           HG2      PRO  52  -1.857   4.942   0.988
  405    HG3  PRO  52           HG3      PRO  52  -1.204   6.257  -0.033
  406    HD2  PRO  52           HD2      PRO  52  -1.002   3.592  -0.699
  407    HD3  PRO  52           HD3      PRO  52   0.224   4.808  -1.163
  408    H    VAL  53           H        VAL  53  -0.864   2.349   1.527
  409    HA   VAL  53           HA       VAL  53  -1.136   1.427   4.257
  410    HB   VAL  53           HB       VAL  53  -3.564   1.548   4.320
  411   HG11  VAL  53          HG11      VAL  53  -2.351   4.330   4.134
  412   HG12  VAL  53          HG12      VAL  53  -3.798   3.848   5.038
  413   HG13  VAL  53          HG13      VAL  53  -2.203   3.239   5.524
  414   HG21  VAL  53          HG21      VAL  53  -3.375   3.500   1.998
  415   HG22  VAL  53          HG22      VAL  53  -4.057   1.857   1.917
  416   HG23  VAL  53          HG23      VAL  53  -4.835   3.089   2.922
  417    H    ASP  54           H        ASP  54  -2.794  -0.550   4.163
  418    HA   ASP  54           HA       ASP  54  -2.239  -2.008   1.626
  419    HB2  ASP  54           HB2      ASP  54  -2.060  -3.978   2.732
  420    HB3  ASP  54           HB3      ASP  54  -1.251  -2.871   3.824
  421    H    GLY  55           H        GLY  55  -3.828  -3.419   0.712
  422    HA2  GLY  55           HA2      GLY  55  -6.521  -3.548   1.554
  423    HA3  GLY  55           HA3      GLY  55  -6.398  -2.160   0.477
  424    H    ARG  56           H        ARG  56  -8.075  -3.649  -0.474
  425    HA   ARG  56           HA       ARG  56  -6.901  -5.707  -2.289
  426    HB2  ARG  56           HB2      ARG  56  -8.800  -6.254  -0.676
  427    HB3  ARG  56           HB3      ARG  56  -9.858  -5.338  -1.751
  428    HG2  ARG  56           HG2      ARG  56  -9.282  -6.872  -3.624
  429    HG3  ARG  56           HG3      ARG  56  -8.136  -7.721  -2.561
  430    HD2  ARG  56           HD2      ARG  56  -9.985  -8.328  -1.045
  431    HD3  ARG  56           HD3      ARG  56 -11.138  -7.566  -2.149
  432    HE   ARG  56           HE       ARG  56 -10.886  -9.358  -3.673
  433   HH11  ARG  56          HH11      ARG  56  -8.710  -9.974  -0.898
  434   HH12  ARG  56          HH12      ARG  56  -8.472 -11.614  -1.500
  435   HH21  ARG  56          HH21      ARG  56 -10.463 -11.398  -4.205
  436   HH22  ARG  56          HH22      ARG  56  -9.422 -12.384  -3.169
  437    H    VAL  57           H        VAL  57  -7.213  -5.742  -4.473
  438    HA   VAL  57           HA       VAL  57  -7.499  -3.065  -5.744
  439    HB   VAL  57           HB       VAL  57  -6.106  -5.572  -6.777
  440   HG11  VAL  57          HG11      VAL  57  -6.047  -2.665  -7.685
  441   HG12  VAL  57          HG12      VAL  57  -5.005  -3.965  -8.317
  442   HG13  VAL  57          HG13      VAL  57  -6.741  -4.045  -8.571
  443   HG21  VAL  57          HG21      VAL  57  -4.869  -3.182  -5.361
  444   HG22  VAL  57          HG22      VAL  57  -4.862  -4.868  -4.813
  445   HG23  VAL  57          HG23      VAL  57  -3.965  -4.416  -6.262
  446    H    ILE  58           H        ILE  58  -9.097  -2.789  -7.287
  447    HA   ILE  58           HA       ILE  58 -10.463  -5.220  -8.409
  448    HB   ILE  58           HB       ILE  58 -12.674  -4.001  -7.950
  449   HG12  ILE  58          HG12      ILE  58 -11.049  -2.627  -5.780
  450   HG13  ILE  58          HG13      ILE  58 -11.419  -1.823  -7.316
  451   HG21  ILE  58          HG21      ILE  58 -11.916  -6.057  -6.780
  452   HG22  ILE  58          HG22      ILE  58 -11.169  -5.043  -5.525
  453   HG23  ILE  58          HG23      ILE  58 -12.923  -5.008  -5.779
  454   HD11  ILE  58          HD11      ILE  58 -13.487  -2.796  -5.307
  455   HD12  ILE  58          HD12      ILE  58 -13.023  -1.119  -5.654
  456   HD13  ILE  58          HD13      ILE  58 -13.839  -2.076  -6.902
  457    H    GLU  59           H        GLU  59  -8.636  -3.090  -9.568
  458    HA   GLU  59           HA       GLU  59  -9.789  -3.370 -12.148
  459    HB2  GLU  59           HB2      GLU  59 -10.569  -0.939 -10.884
  460    HB3  GLU  59           HB3      GLU  59  -9.294  -0.491 -11.975
  461    HG2  GLU  59           HG2      GLU  59 -11.803  -2.044 -12.737
  462    HG3  GLU  59           HG3      GLU  59 -11.528  -0.326 -13.017
  463    H    GLY  60           H        GLY  60  -8.231  -3.089 -13.765
  464    HA2  GLY  60           HA2      GLY  60  -6.334  -2.110 -14.750
  465    HA3  GLY  60           HA3      GLY  60  -5.735  -1.624 -13.179
  466    H    HIS  61           H        HIS  61  -3.842  -2.400 -14.442
  467    HA   HIS  61           HA       HIS  61  -3.050  -5.123 -13.569
  468    HB2  HIS  61           HB2      HIS  61  -2.130  -5.592 -15.888
  469    HB3  HIS  61           HB3      HIS  61  -3.865  -5.723 -15.673
  470    HD1  HIS  61           HD1      HIS  61  -1.322  -3.808 -17.699
  471    HD2  HIS  61           HD2      HIS  61  -5.428  -3.752 -16.789
  472    HE1  HIS  61           HE1      HIS  61  -2.415  -2.219 -19.377
  473    H    SER  62           H        SER  62  -1.140  -5.056 -12.665
  474    HA   SER  62           HA       SER  62   1.030  -3.551 -13.860
  475    HB2  SER  62           HB2      SER  62  -0.048  -2.717 -11.162
  476    HB3  SER  62           HB3      SER  62   1.663  -2.488 -11.556
  477    HG   SER  62           HG       SER  62  -0.463  -1.644 -13.245
  478    H    MET  63           H        MET  63   3.146  -4.064 -13.094
  479    HA   MET  63           HA       MET  63   3.309  -6.619 -11.606
  480    HB2  MET  63           HB2      MET  63   4.136  -6.763 -13.883
  481    HB3  MET  63           HB3      MET  63   5.252  -5.418 -13.612
  482    HG2  MET  63           HG2      MET  63   6.649  -6.658 -12.273
  483    HG3  MET  63           HG3      MET  63   5.367  -7.717 -11.682
  484    HE1  MET  63           HE1      MET  63   4.921 -10.060 -12.442
  485    HE2  MET  63           HE2      MET  63   3.989  -9.239 -13.719
  486    HE3  MET  63           HE3      MET  63   5.083 -10.572 -14.137
  487    H    VAL  64           H        VAL  64   3.972  -6.466  -9.654
  488    HA   VAL  64           HA       VAL  64   5.001  -3.885  -8.566
  489    HB   VAL  64           HB       VAL  64   2.990  -5.942  -7.587
  490   HG11  VAL  64          HG11      VAL  64   3.929  -3.494  -6.069
  491   HG12  VAL  64          HG12      VAL  64   2.528  -4.493  -5.675
  492   HG13  VAL  64          HG13      VAL  64   4.144  -5.200  -5.601
  493   HG21  VAL  64          HG21      VAL  64   2.071  -4.383  -9.236
  494   HG22  VAL  64          HG22      VAL  64   1.458  -3.933  -7.643
  495   HG23  VAL  64          HG23      VAL  64   2.770  -2.997  -8.368
  496    H    ASP  65           H        ASP  65   6.425  -3.824  -6.876
  497    HA   ASP  65           HA       ASP  65   8.095  -6.254  -6.418
  498    HB2  ASP  65           HB2      ASP  65   9.178  -4.440  -7.623
  499    HB3  ASP  65           HB3      ASP  65   8.701  -3.279  -6.388
  500    H    GLU  66           H        GLU  66   7.677  -7.186  -4.549
  501    HA   GLU  66           HA       GLU  66   7.364  -5.544  -2.067
  502    HB2  GLU  66           HB2      GLU  66   5.829  -7.447  -1.237
  503    HB3  GLU  66           HB3      GLU  66   5.205  -6.214  -2.303
  504    HG2  GLU  66           HG2      GLU  66   5.259  -7.645  -4.218
  505    HG3  GLU  66           HG3      GLU  66   6.076  -8.932  -3.307
  506    H    SER  67           H        SER  67   9.726  -6.665  -3.263
  507    HA   SER  67           HA       SER  67  10.622  -9.051  -2.192
  508    HB2  SER  67           HB2      SER  67  12.869  -8.284  -2.700
  509    HB3  SER  67           HB3      SER  67  11.756  -7.790  -3.981
  510    HG   SER  67           HG       SER  67  13.397  -6.267  -2.740
  511    H    LEU  68           H        LEU  68  10.652  -5.963  -0.426
  512    HA   LEU  68           HA       LEU  68  12.205  -7.185   1.777
  513    HB2  LEU  68           HB2      LEU  68  12.565  -4.866   0.953
  514    HB3  LEU  68           HB3      LEU  68  10.950  -4.426   1.464
  515    HG   LEU  68           HG       LEU  68  12.842  -3.642   2.885
  516   HD11  LEU  68          HD11      LEU  68  10.509  -3.811   3.780
  517   HD12  LEU  68          HD12      LEU  68  10.960  -5.362   4.522
  518   HD13  LEU  68          HD13      LEU  68  11.798  -3.882   4.990
  519   HD21  LEU  68          HD21      LEU  68  14.241  -5.685   2.823
  520   HD22  LEU  68          HD22      LEU  68  13.933  -5.109   4.471
  521   HD23  LEU  68          HD23      LEU  68  13.053  -6.516   3.855
  522    H    ILE  69           H        ILE  69   8.875  -6.211   1.062
  523    HA   ILE  69           HA       ILE  69   7.888  -6.435   3.753
  524    HB   ILE  69           HB       ILE  69   6.266  -6.521   1.181
  525   HG12  ILE  69          HG12      ILE  69   7.715  -4.498   1.157
  526   HG13  ILE  69          HG13      ILE  69   5.997  -4.174   1.192
  527   HG21  ILE  69          HG21      ILE  69   5.590  -5.883   4.083
  528   HG22  ILE  69          HG22      ILE  69   4.528  -5.470   2.731
  529   HG23  ILE  69          HG23      ILE  69   4.914  -7.165   3.062
  530   HD11  ILE  69          HD11      ILE  69   7.800  -3.998   3.639
  531   HD12  ILE  69          HD12      ILE  69   7.256  -2.631   2.636
  532   HD13  ILE  69          HD13      ILE  69   6.070  -3.569   3.538
  533    H    THR  70           H        THR  70   7.069  -8.516   0.904
  534    HA   THR  70           HA       THR  70   6.280 -10.690   2.748
  535    HB   THR  70           HB       THR  70   5.252 -11.671   0.722
  536    HG1  THR  70           HG1      THR  70   5.176 -10.149  -1.102
  537   HG21  THR  70          HG21      THR  70   4.048  -9.969   2.171
  538   HG22  THR  70          HG22      THR  70   4.529  -8.719   0.999
  539   HG23  THR  70          HG23      THR  70   3.482 -10.055   0.500
  540    H    GLY  71           H        GLY  71   9.010  -9.861   1.006
  541    HA2  GLY  71           HA2      GLY  71  11.091 -10.984   1.083
  542    HA3  GLY  71           HA3      GLY  71  10.279 -12.478   1.560
  543    H    GLU  72           H        GLU  72   8.944 -10.794  -1.143
  544    HA   GLU  72           HA       GLU  72   9.542 -13.081  -2.908
  545    HB2  GLU  72           HB2      GLU  72   7.825 -10.594  -3.180
  546    HB3  GLU  72           HB3      GLU  72   8.082 -11.702  -4.525
  547    HG2  GLU  72           HG2      GLU  72   6.910 -12.508  -1.836
  548    HG3  GLU  72           HG3      GLU  72   5.992 -12.113  -3.290
  549    H    ALA  73           H        ALA  73  11.697 -13.063  -3.493
  550    HA   ALA  73           HA       ALA  73  12.971 -10.694  -4.578
  551    HB1  ALA  73           HB1      ALA  73  13.859 -13.604  -4.540
  552    HB2  ALA  73           HB2      ALA  73  14.880 -12.180  -4.821
  553    HB3  ALA  73           HB3      ALA  73  14.134 -12.419  -3.238
  554    H    MET  74           H        MET  74  10.506 -11.765  -5.960
  555    HA   MET  74           HA       MET  74  11.384 -11.627  -8.728
  556    HB2  MET  74           HB2      MET  74  11.354 -14.060  -8.073
  557    HB3  MET  74           HB3      MET  74   9.650 -13.888  -7.612
  558    HG2  MET  74           HG2      MET  74   9.066 -13.294  -9.888
  559    HG3  MET  74           HG3      MET  74  10.776 -13.324 -10.359
  560    HE1  MET  74           HE1      MET  74   8.620 -14.909 -12.057
  561    HE2  MET  74           HE2      MET  74  10.369 -14.883 -12.384
  562    HE3  MET  74           HE3      MET  74   9.496 -16.431 -12.316
  563    HA   PRO  75           HA       PRO  75   8.000  -8.846  -8.145
  564    HB2  PRO  75           HB2      PRO  75   7.421  -8.017 -10.650
  565    HB3  PRO  75           HB3      PRO  75   8.954  -7.620  -9.828
  566    HG2  PRO  75           HG2      PRO  75   8.444  -9.888 -11.788
  567    HG3  PRO  75           HG3      PRO  75   9.760  -8.668 -11.832
  568    HD2  PRO  75           HD2      PRO  75  10.141 -11.126 -10.742
  569    HD3  PRO  75           HD3      PRO  75  10.870  -9.673  -9.991
  570    H    VAL  76           H        VAL  76   5.783  -8.509  -8.342
  571    HA   VAL  76           HA       VAL  76   4.265 -11.050  -8.721
  572    HB   VAL  76           HB       VAL  76   3.750  -8.704  -6.833
  573   HG11  VAL  76          HG11      VAL  76   2.578 -11.509  -6.930
  574   HG12  VAL  76          HG12      VAL  76   2.279 -10.319  -5.651
  575   HG13  VAL  76          HG13      VAL  76   1.708 -10.001  -7.296
  576   HG21  VAL  76          HG21      VAL  76   5.816  -9.772  -6.123
  577   HG22  VAL  76          HG22      VAL  76   4.526 -10.299  -5.045
  578   HG23  VAL  76          HG23      VAL  76   5.094 -11.384  -6.322
  579    H    ALA  77           H        ALA  77   2.423 -11.108  -9.981
  580    HA   ALA  77           HA       ALA  77   1.657  -8.654 -11.435
  581    HB1  ALA  77           HB1      ALA  77   0.652 -11.521 -11.629
  582    HB2  ALA  77           HB2      ALA  77   0.234 -10.183 -12.722
  583    HB3  ALA  77           HB3      ALA  77   1.904 -10.782 -12.654
  584    H    LYS  78           H        LYS  78  -0.103  -7.469 -11.047
  585    HA   LYS  78           HA       LYS  78  -2.177  -8.415  -9.080
  586    HB2  LYS  78           HB2      LYS  78  -1.307  -5.554  -9.589
  587    HB3  LYS  78           HB3      LYS  78  -2.449  -6.098  -8.367
  588    HG2  LYS  78           HG2      LYS  78   0.543  -6.718  -8.407
  589    HG3  LYS  78           HG3      LYS  78  -0.240  -5.456  -7.472
  590    HD2  LYS  78           HD2      LYS  78  -1.467  -7.122  -6.143
  591    HD3  LYS  78           HD3      LYS  78  -0.743  -8.441  -7.087
  592    HE2  LYS  78           HE2      LYS  78   1.509  -7.785  -6.366
  593    HE3  LYS  78           HE3      LYS  78   0.871  -6.371  -5.521
  594    HZ1  LYS  78           HZ1      LYS  78   0.245  -9.183  -4.770
  595    HZ2  LYS  78           HZ2      LYS  78   1.310  -8.192  -3.991
  596    HZ3  LYS  78           HZ3      LYS  78  -0.299  -7.866  -4.002
  597    H    LYS  79           H        LYS  79  -4.341  -7.932  -9.474
  598    HA   LYS  79           HA       LYS  79  -5.221  -6.944 -12.132
  599    HB2  LYS  79           HB2      LYS  79  -6.421  -9.139 -12.460
  600    HB3  LYS  79           HB3      LYS  79  -4.670  -9.235 -12.591
  601    HG2  LYS  79           HG2      LYS  79  -4.526 -10.217 -10.362
  602    HG3  LYS  79           HG3      LYS  79  -6.284 -10.042 -10.136
  603    HD2  LYS  79           HD2      LYS  79  -4.860 -11.775 -12.190
  604    HD3  LYS  79           HD3      LYS  79  -5.580 -12.333 -10.671
  605    HE2  LYS  79           HE2      LYS  79  -7.807 -11.393 -11.528
  606    HE3  LYS  79           HE3      LYS  79  -7.007 -11.213 -13.103
  607    HZ1  LYS  79           HZ1      LYS  79  -7.463 -13.714 -11.587
  608    HZ2  LYS  79           HZ2      LYS  79  -8.075 -13.325 -13.058
  609    HZ3  LYS  79           HZ3      LYS  79  -6.474 -13.664 -12.901
  610    HA   PRO  80           HA       PRO  80  -9.020  -6.023  -9.812
  611    HB2  PRO  80           HB2      PRO  80 -11.076  -7.116 -11.350
  612    HB3  PRO  80           HB3      PRO  80 -10.297  -5.542 -11.669
  613    HG2  PRO  80           HG2      PRO  80  -9.634  -8.228 -12.915
  614    HG3  PRO  80           HG3      PRO  80  -9.881  -6.652 -13.738
  615    HD2  PRO  80           HD2      PRO  80  -7.398  -7.493 -13.236
  616    HD3  PRO  80           HD3      PRO  80  -7.827  -5.799 -12.896
  617    H    GLY  81           H        GLY  81  -9.460  -7.063  -8.005
  618    HA2  GLY  81           HA2      GLY  81 -10.053  -8.757  -6.518
  619    HA3  GLY  81           HA3      GLY  81 -10.021  -9.949  -7.819
  620    H    SER  82           H        SER  82  -7.493  -7.654  -6.562
  621    HA   SER  82           HA       SER  82  -5.832 -10.014  -5.737
  622    HB2  SER  82           HB2      SER  82  -4.799  -7.489  -7.088
  623    HB3  SER  82           HB3      SER  82  -3.785  -8.718  -6.321
  624    HG   SER  82           HG       SER  82  -4.861 -10.233  -7.833
  625    H    THR  83           H        THR  83  -4.103  -9.426  -4.079
  626    HA   THR  83           HA       THR  83  -5.002  -7.140  -2.349
  627    HB   THR  83           HB       THR  83  -4.116  -8.280  -0.441
  628    HG1  THR  83           HG1      THR  83  -2.539  -9.518  -1.050
  629   HG21  THR  83          HG21      THR  83  -6.472  -8.751  -1.171
  630   HG22  THR  83          HG22      THR  83  -5.884 -10.210  -1.999
  631   HG23  THR  83          HG23      THR  83  -5.728 -10.061  -0.238
  632    H    VAL  84           H        VAL  84  -3.529  -5.747  -1.392
  633    HA   VAL  84           HA       VAL  84  -0.653  -5.979  -2.124
  634    HB   VAL  84           HB       VAL  84  -0.545  -3.528  -2.531
  635   HG11  VAL  84          HG11      VAL  84  -2.266  -5.063  -4.509
  636   HG12  VAL  84          HG12      VAL  84  -1.316  -3.598  -4.846
  637   HG13  VAL  84          HG13      VAL  84  -0.492  -5.097  -4.390
  638   HG21  VAL  84          HG21      VAL  84  -2.720  -2.850  -1.508
  639   HG22  VAL  84          HG22      VAL  84  -2.504  -2.256  -3.159
  640   HG23  VAL  84          HG23      VAL  84  -3.571  -3.639  -2.852
  641    H    ILE  85           H        ILE  85   0.755  -4.735  -0.844
  642    HA   ILE  85           HA       ILE  85  -0.227  -3.958   1.839
  643    HB   ILE  85           HB       ILE  85   2.352  -4.620   2.443
  644   HG12  ILE  85          HG12      ILE  85   2.730  -6.952   1.754
  645   HG13  ILE  85          HG13      ILE  85   1.372  -6.884   0.646
  646   HG21  ILE  85          HG21      ILE  85  -0.118  -6.349   2.712
  647   HG22  ILE  85          HG22      ILE  85   1.383  -6.496   3.659
  648   HG23  ILE  85          HG23      ILE  85   0.397  -5.039   3.801
  649   HD11  ILE  85          HD11      ILE  85   2.558  -5.148  -0.693
  650   HD12  ILE  85          HD12      ILE  85   3.890  -5.163   0.471
  651   HD13  ILE  85          HD13      ILE  85   3.542  -6.609  -0.506
  652    H    ALA  86           H        ALA  86   0.762  -2.358   2.963
  653    HA   ALA  86           HA       ALA  86   1.566  -0.095   1.482
  654    HB1  ALA  86           HB1      ALA  86   2.010  -0.657   4.439
  655    HB2  ALA  86           HB2      ALA  86   1.913   0.932   3.646
  656    HB3  ALA  86           HB3      ALA  86   0.488  -0.112   3.745
  657    H    GLY  87           H        GLY  87   3.507   0.876   1.120
  658    HA2  GLY  87           HA2      GLY  87   5.776   1.233   1.047
  659    HA3  GLY  87           HA3      GLY  87   6.052  -0.155   2.109
  660    H    SER  88           H        SER  88   4.254  -1.469  -0.322
  661    HA   SER  88           HA       SER  88   6.565  -2.436  -1.869
  662    HB2  SER  88           HB2      SER  88   4.938  -4.060  -1.417
  663    HB3  SER  88           HB3      SER  88   3.599  -3.001  -1.913
  664    HG   SER  88           HG       SER  88   5.609  -4.023  -3.641
  665    H    ILE  89           H        ILE  89   6.652  -2.268  -4.157
  666    HA   ILE  89           HA       ILE  89   6.090   0.528  -5.049
  667    HB   ILE  89           HB       ILE  89   8.178  -0.991  -6.497
  668   HG12  ILE  89          HG12      ILE  89   8.776  -1.840  -4.289
  669   HG13  ILE  89          HG13      ILE  89   9.984  -0.801  -5.006
  670   HG21  ILE  89          HG21      ILE  89   8.026   1.807  -5.329
  671   HG22  ILE  89          HG22      ILE  89   9.326   1.181  -6.357
  672   HG23  ILE  89          HG23      ILE  89   7.685   1.325  -6.999
  673   HD11  ILE  89          HD11      ILE  89   9.434   1.025  -3.521
  674   HD12  ILE  89          HD12      ILE  89   8.051   0.136  -2.850
  675   HD13  ILE  89          HD13      ILE  89   9.704  -0.441  -2.568
  676    H    ASN  90           H        ASN  90   5.117   0.965  -6.999
  677    HA   ASN  90           HA       ASN  90   4.340  -1.330  -8.759
  678    HB2  ASN  90           HB2      ASN  90   2.507  -0.001  -7.905
  679    HB3  ASN  90           HB3      ASN  90   3.302   1.498  -8.361
  680   HD21  ASN  90          HD22      ASN  90   0.983   1.608  -9.199
  681   HD22  ASN  90          HD21      ASN  90   0.799   1.166 -10.889
  682    H    GLN  91           H        GLN  91   5.204  -1.532 -10.811
  683    HA   GLN  91           HA       GLN  91   6.523   0.824 -11.997
  684    HB2  GLN  91           HB2      GLN  91   8.187  -0.793 -10.776
  685    HB3  GLN  91           HB3      GLN  91   7.914  -1.849 -12.163
  686    HG2  GLN  91           HG2      GLN  91   9.584  -0.608 -13.122
  687    HG3  GLN  91           HG3      GLN  91   8.266   0.537 -13.451
  688   HE21  GLN  91          HE22      GLN  91   8.259   2.546 -12.277
  689   HE22  GLN  91          HE21      GLN  91   9.493   2.918 -11.059
  690    H    ASN  92           H        ASN  92   4.118   0.321 -12.851
  691    HA   ASN  92           HA       ASN  92   4.628  -0.348 -15.643
  692    HB2  ASN  92           HB2      ASN  92   4.106  -2.597 -14.783
  693    HB3  ASN  92           HB3      ASN  92   2.589  -1.997 -14.105
  694   HD21  ASN  92          HD22      ASN  92   0.737  -1.972 -15.512
  695   HD22  ASN  92          HD21      ASN  92   0.912  -2.160 -17.237
  696    H    GLY  93           H        GLY  93   1.829   0.305 -13.423
  697    HA2  GLY  93           HA2      GLY  93   0.893   2.534 -15.098
  698    HA3  GLY  93           HA3      GLY  93   0.021   1.035 -15.403
  699    H    SER  94           H        SER  94  -1.908   2.140 -14.725
  700    HA   SER  94           HA       SER  94  -2.179   2.973 -11.920
  701    HB2  SER  94           HB2      SER  94  -3.272   4.232 -13.725
  702    HB3  SER  94           HB3      SER  94  -4.215   2.798 -14.156
  703    HG   SER  94           HG       SER  94  -5.489   4.006 -12.866
  704    H    LEU  95           H        LEU  95  -4.011   2.216 -10.715
  705    HA   LEU  95           HA       LEU  95  -5.236  -0.271 -10.973
  706    HB2  LEU  95           HB2      LEU  95  -3.274  -0.156  -8.666
  707    HB3  LEU  95           HB3      LEU  95  -4.545  -1.329  -8.819
  708    HG   LEU  95           HG       LEU  95  -2.118  -1.124 -10.647
  709   HD11  LEU  95          HD11      LEU  95  -1.378  -3.153  -9.430
  710   HD12  LEU  95          HD12      LEU  95  -1.500  -1.748  -8.364
  711   HD13  LEU  95          HD13      LEU  95  -2.763  -2.999  -8.332
  712   HD21  LEU  95          HD21      LEU  95  -2.829  -3.393 -11.366
  713   HD22  LEU  95          HD22      LEU  95  -4.291  -3.259 -10.364
  714   HD23  LEU  95          HD23      LEU  95  -4.056  -2.165 -11.727
  715    H    LEU  96           H        LEU  96  -6.989  -0.409  -9.542
  716    HA   LEU  96           HA       LEU  96  -7.501   2.033  -7.855
  717    HB2  LEU  96           HB2      LEU  96  -9.339   0.270  -9.495
  718    HB3  LEU  96           HB3      LEU  96  -9.936   1.281  -8.192
  719    HG   LEU  96           HG       LEU  96  -9.133   3.296  -9.280
  720   HD11  LEU  96          HD11      LEU  96  -8.214   1.464 -11.533
  721   HD12  LEU  96          HD12      LEU  96  -8.528   3.186 -11.768
  722   HD13  LEU  96          HD13      LEU  96  -7.261   2.681 -10.659
  723   HD21  LEU  96          HD21      LEU  96 -10.709   3.415 -11.091
  724   HD22  LEU  96          HD22      LEU  96 -10.819   1.639 -11.168
  725   HD23  LEU  96          HD23      LEU  96 -11.410   2.512  -9.735
  726    H    ILE  97           H        ILE  97  -7.186   1.636  -5.768
  727    HA   ILE  97           HA       ILE  97  -7.713  -1.103  -4.706
  728    HB   ILE  97           HB       ILE  97  -5.883   1.003  -3.515
  729   HG12  ILE  97          HG12      ILE  97  -4.127  -0.825  -4.464
  730   HG13  ILE  97          HG13      ILE  97  -5.358  -0.999  -5.710
  731   HG21  ILE  97          HG21      ILE  97  -6.045  -2.016  -3.103
  732   HG22  ILE  97          HG22      ILE  97  -4.937  -0.897  -2.289
  733   HG23  ILE  97          HG23      ILE  97  -6.667  -0.793  -1.974
  734   HD11  ILE  97          HD11      ILE  97  -5.157   1.462  -6.191
  735   HD12  ILE  97          HD12      ILE  97  -3.948   1.583  -4.898
  736   HD13  ILE  97          HD13      ILE  97  -3.624   0.605  -6.346
  737    H    CYS  98           H        CYS  98  -9.228  -1.425  -3.219
  738    HA   CYS  98           HA       CYS  98 -10.545   0.879  -1.895
  739    HB2  CYS  98           HB2      CYS  98 -12.192  -0.704  -1.120
  740    HB3  CYS  98           HB3      CYS  98 -11.978  -0.861  -2.860
  741    HG   CYS  98           HG       CYS  98 -10.148  -2.896  -2.526
  742    H    ALA  99           H        ALA  99  -9.733   1.683  -0.003
  743    HA   ALA  99           HA       ALA  99  -7.573   0.254   1.284
  744    HB1  ALA  99           HB1      ALA  99  -8.963   2.892   1.912
  745    HB2  ALA  99           HB2      ALA  99  -7.466   2.301   2.668
  746    HB3  ALA  99           HB3      ALA  99  -7.494   2.665   0.932
  747    H    THR 100           H        THR 100  -7.761  -1.199   2.846
  748    HA   THR 100           HA       THR 100 -10.250  -1.299   4.512
  749    HB   THR 100           HB       THR 100  -9.743  -3.716   4.703
  750    HG1  THR 100           HG1      THR 100  -8.042  -4.524   3.386
  751   HG21  THR 100          HG21      THR 100 -11.071  -2.807   2.707
  752   HG22  THR 100          HG22      THR 100  -9.578  -2.945   1.763
  753   HG23  THR 100          HG23      THR 100 -10.305  -4.394   2.478
  754    H    HIS 101           H        HIS 101  -6.930  -0.609   4.844
  755    HA   HIS 101           HA       HIS 101  -7.280  -0.555   7.792
  756    HB2  HIS 101           HB2      HIS 101  -4.763  -1.506   6.376
  757    HB3  HIS 101           HB3      HIS 101  -5.022  -1.412   8.115
  758    HD1  HIS 101           HD1      HIS 101  -5.565  -3.725   5.169
  759    HD2  HIS 101           HD2      HIS 101  -6.718  -3.339   9.205
  760    HE1  HIS 101           HE1      HIS 101  -6.656  -5.917   5.798
  761    H    VAL 102           H        VAL 102  -6.155   1.119   8.802
  762    HA   VAL 102           HA       VAL 102  -4.754   3.146   7.096
  763    HB   VAL 102           HB       VAL 102  -4.973   4.640   9.092
  764   HG11  VAL 102          HG11      VAL 102  -7.551   3.674   7.804
  765   HG12  VAL 102          HG12      VAL 102  -7.280   5.247   8.596
  766   HG13  VAL 102          HG13      VAL 102  -6.381   4.838   7.127
  767   HG21  VAL 102          HG21      VAL 102  -5.457   2.893  10.822
  768   HG22  VAL 102          HG22      VAL 102  -6.655   4.196  10.773
  769   HG23  VAL 102          HG23      VAL 102  -7.051   2.625  10.062
  770    H    GLY 103           H        GLY 103  -2.766   4.290   8.590
  771    HA2  GLY 103           HA2      GLY 103  -0.825   2.212   8.513
  772    HA3  GLY 103           HA3      GLY 103  -0.637   3.866   9.093
  773    H    ALA 104           H        ALA 104  -2.751   3.550  11.209
  774    HA   ALA 104           HA       ALA 104  -1.285   2.262  13.318
  775    HB1  ALA 104           HB1      ALA 104  -4.205   3.133  13.106
  776    HB2  ALA 104           HB2      ALA 104  -3.363   2.711  14.608
  777    HB3  ALA 104           HB3      ALA 104  -2.845   4.123  13.670
  778    H    ASP 105           H        ASP 105  -4.062   1.161  11.357
  779    HA   ASP 105           HA       ASP 105  -4.519  -1.272  12.897
  780    HB2  ASP 105           HB2      ASP 105  -6.253   0.277  11.926
  781    HB3  ASP 105           HB3      ASP 105  -5.784  -0.279  10.324
  782    H    THR 106           H        THR 106  -2.428  -0.614  10.226
  783    HA   THR 106           HA       THR 106  -2.992  -3.009   8.728
  784    HB   THR 106           HB       THR 106  -2.175  -1.090   7.571
  785    HG1  THR 106           HG1      THR 106  -1.670  -2.886   6.537
  786   HG21  THR 106          HG21      THR 106   0.467  -1.456   9.022
  787   HG22  THR 106          HG22      THR 106   0.163  -0.358   7.660
  788   HG23  THR 106          HG23      THR 106  -0.653  -0.095   9.207
  789    H    THR 107           H        THR 107  -1.884  -4.883   8.415
  790    HA   THR 107           HA       THR 107  -0.550  -6.228  10.478
  791    HB   THR 107           HB       THR 107  -1.556  -7.319   8.549
  792    HG1  THR 107           HG1      THR 107   0.021  -8.430   9.686
  793   HG21  THR 107          HG21      THR 107  -0.521  -7.466   6.385
  794   HG22  THR 107          HG22      THR 107  -0.779  -5.758   6.729
  795   HG23  THR 107          HG23      THR 107   0.849  -6.462   6.887
  796    H    LEU 108           H        LEU 108   0.905  -4.099   7.998
  797    HA   LEU 108           HA       LEU 108   3.611  -4.805   8.394
  798    HB2  LEU 108           HB2      LEU 108   2.525  -3.391   6.547
  799    HB3  LEU 108           HB3      LEU 108   2.468  -2.064   7.699
  800    HG   LEU 108           HG       LEU 108   5.047  -2.337   7.899
  801   HD11  LEU 108          HD11      LEU 108   4.551  -3.846   5.284
  802   HD12  LEU 108          HD12      LEU 108   6.130  -3.296   5.905
  803   HD13  LEU 108          HD13      LEU 108   5.225  -4.560   6.772
  804   HD21  LEU 108          HD21      LEU 108   3.899  -0.520   6.660
  805   HD22  LEU 108          HD22      LEU 108   5.426  -1.003   5.890
  806   HD23  LEU 108          HD23      LEU 108   3.893  -1.543   5.201
  807    H    SER 109           H        SER 109   1.672  -2.266  10.076
  808    HA   SER 109           HA       SER 109   3.825  -1.586  11.896
  809    HB2  SER 109           HB2      SER 109   2.117  -0.193  13.012
  810    HB3  SER 109           HB3      SER 109   2.368   0.143  11.290
  811    HG   SER 109           HG       SER 109   0.228   0.106  11.541
  812    H    GLN 110           H        GLN 110   1.124  -3.892  11.959
  813    HA   GLN 110           HA       GLN 110   1.149  -4.426  14.779
  814    HB2  GLN 110           HB2      GLN 110  -0.600  -5.153  13.075
  815    HB3  GLN 110           HB3      GLN 110   0.525  -6.350  12.505
  816    HG2  GLN 110           HG2      GLN 110  -0.860  -7.556  13.897
  817    HG3  GLN 110           HG3      GLN 110   0.582  -7.322  14.882
  818   HE21  GLN 110          HE22      GLN 110  -2.475  -5.537  14.110
  819   HE22  GLN 110          HE21      GLN 110  -2.764  -5.072  15.773
  820    H    ILE 111           H        ILE 111   2.986  -5.873  12.064
  821    HA   ILE 111           HA       ILE 111   4.422  -7.845  13.513
  822    HB   ILE 111           HB       ILE 111   5.116  -6.278  11.003
  823   HG12  ILE 111          HG12      ILE 111   4.304  -9.205  11.214
  824   HG13  ILE 111          HG13      ILE 111   3.089  -7.944  11.129
  825   HG21  ILE 111          HG21      ILE 111   6.546  -8.719  12.164
  826   HG22  ILE 111          HG22      ILE 111   6.806  -8.078  10.532
  827   HG23  ILE 111          HG23      ILE 111   7.243  -7.103  11.924
  828   HD11  ILE 111          HD11      ILE 111   3.453  -8.809   8.908
  829   HD12  ILE 111          HD12      ILE 111   4.047  -7.139   8.972
  830   HD13  ILE 111          HD13      ILE 111   5.195  -8.501   9.004
  831    H    VAL 112           H        VAL 112   5.579  -4.488  12.683
  832    HA   VAL 112           HA       VAL 112   7.913  -4.828  14.316
  833    HB   VAL 112           HB       VAL 112   8.306  -2.447  14.151
  834   HG11  VAL 112          HG11      VAL 112   7.379  -3.577  11.478
  835   HG12  VAL 112          HG12      VAL 112   8.612  -2.327  11.770
  836   HG13  VAL 112          HG13      VAL 112   8.908  -3.992  12.284
  837   HG21  VAL 112          HG21      VAL 112   5.960  -1.599  14.282
  838   HG22  VAL 112          HG22      VAL 112   6.862  -0.955  12.910
  839   HG23  VAL 112          HG23      VAL 112   5.678  -2.253  12.651
  840    H    LYS 113           H        LYS 113   4.669  -3.787  15.228
  841    HA   LYS 113           HA       LYS 113   5.428  -2.758  17.849
  842    HB2  LYS 113           HB2      LYS 113   2.801  -3.706  16.642
  843    HB3  LYS 113           HB3      LYS 113   2.944  -3.242  18.340
  844    HG2  LYS 113           HG2      LYS 113   3.682  -0.995  17.762
  845    HG3  LYS 113           HG3      LYS 113   3.734  -1.404  16.060
  846    HD2  LYS 113           HD2      LYS 113   1.759  -0.136  16.399
  847    HD3  LYS 113           HD3      LYS 113   1.260  -1.811  16.081
  848    HE2  LYS 113           HE2      LYS 113   1.014  -2.202  18.497
  849    HE3  LYS 113           HE3      LYS 113   1.623  -0.575  18.837
  850    HZ1  LYS 113           HZ1      LYS 113  -0.891  -1.185  17.371
  851    HZ2  LYS 113           HZ2      LYS 113  -0.803  -0.668  18.938
  852    HZ3  LYS 113           HZ3      LYS 113  -0.352   0.335  17.741
  853    H    LEU 114           H        LEU 114   4.385  -5.985  16.722
  854    HA   LEU 114           HA       LEU 114   4.676  -7.266  19.277
  855    HB2  LEU 114           HB2      LEU 114   4.433  -8.099  16.391
  856    HB3  LEU 114           HB3      LEU 114   4.951  -9.310  17.551
  857    HG   LEU 114           HG       LEU 114   2.412  -7.672  17.719
  858   HD11  LEU 114          HD11      LEU 114   2.381  -9.198  15.801
  859   HD12  LEU 114          HD12      LEU 114   2.833 -10.560  16.852
  860   HD13  LEU 114          HD13      LEU 114   1.256  -9.753  17.052
  861   HD21  LEU 114          HD21      LEU 114   3.080  -8.478  19.966
  862   HD22  LEU 114          HD22      LEU 114   1.721  -9.441  19.391
  863   HD23  LEU 114          HD23      LEU 114   3.371 -10.103  19.319
  864    H    VAL 115           H        VAL 115   7.017  -6.735  16.684
  865    HA   VAL 115           HA       VAL 115   9.147  -8.293  17.939
  866    HB   VAL 115           HB       VAL 115   9.223  -6.137  15.801
  867   HG11  VAL 115          HG11      VAL 115  11.487  -7.932  16.782
  868   HG12  VAL 115          HG12      VAL 115  11.523  -6.939  15.319
  869   HG13  VAL 115          HG13      VAL 115  11.427  -6.152  16.892
  870   HG21  VAL 115          HG21      VAL 115   8.152  -8.331  15.177
  871   HG22  VAL 115          HG22      VAL 115   9.649  -8.029  14.292
  872   HG23  VAL 115          HG23      VAL 115   9.636  -9.163  15.659
  873    H    GLU 116           H        GLU 116   8.467  -4.823  17.862
  874    HA   GLU 116           HA       GLU 116  10.415  -3.953  19.694
  875    HB2  GLU 116           HB2      GLU 116   9.068  -2.521  18.232
  876    HB3  GLU 116           HB3      GLU 116   7.642  -2.767  19.233
  877    HG2  GLU 116           HG2      GLU 116  10.183  -1.665  20.472
  878    HG3  GLU 116           HG3      GLU 116   9.237  -0.632  19.416
  879    H    GLU 117           H        GLU 117   7.165  -5.280  20.541
  880    HA   GLU 117           HA       GLU 117   7.493  -4.834  23.399
  881    HB2  GLU 117           HB2      GLU 117   5.761  -6.659  21.696
  882    HB3  GLU 117           HB3      GLU 117   5.702  -6.648  23.460
  883    HG2  GLU 117           HG2      GLU 117   5.395  -4.037  21.981
  884    HG3  GLU 117           HG3      GLU 117   4.055  -5.167  22.018
  885    H    ALA 118           H        ALA 118   8.533  -7.410  21.171
  886    HA   ALA 118           HA       ALA 118   9.351  -9.222  23.294
  887    HB1  ALA 118           HB1      ALA 118  10.065  -9.174  20.336
  888    HB2  ALA 118           HB2      ALA 118  10.362 -10.506  21.477
  889    HB3  ALA 118           HB3      ALA 118   8.706 -10.021  21.078
  890    H    GLN 119           H        GLN 119  11.345  -7.442  20.943
  891    HA   GLN 119           HA       GLN 119  13.819  -7.768  21.912
  892    HB2  GLN 119           HB2      GLN 119  12.552  -5.429  20.450
  893    HB3  GLN 119           HB3      GLN 119  14.231  -5.399  20.904
  894    HG2  GLN 119           HG2      GLN 119  13.302  -6.326  18.524
  895    HG3  GLN 119           HG3      GLN 119  14.940  -6.468  19.170
  896   HE21  GLN 119          HE22      GLN 119  11.769  -8.043  19.149
  897   HE22  GLN 119          HE21      GLN 119  12.477  -9.610  19.560
  Start of MODEL   23
    1    H    SER   1           H        SER   1  17.578  -7.155  12.832
    2    HA   SER   1           HA       SER   1  16.298  -4.966  14.240
    3    HB2  SER   1           HB2      SER   1  19.276  -5.434  13.943
    4    HB3  SER   1           HB3      SER   1  18.405  -4.672  15.288
    5    HG   SER   1           HG       SER   1  17.420  -6.741  15.680
    6    H    GLU   2           H        GLU   2  18.012  -5.191  11.170
    7    HA   GLU   2           HA       GLU   2  18.168  -2.214  10.899
    8    HB2  GLU   2           HB2      GLU   2  19.119  -4.520   9.146
    9    HB3  GLU   2           HB3      GLU   2  19.089  -2.837   8.632
   10    HG2  GLU   2           HG2      GLU   2  21.293  -3.206   9.315
   11    HG3  GLU   2           HG3      GLU   2  20.557  -2.229  10.571
   12    H    ALA   3           H        ALA   3  16.256  -4.979   9.952
   13    HA   ALA   3           HA       ALA   3  14.554  -3.648   8.024
   14    HB1  ALA   3           HB1      ALA   3  13.892  -6.008   9.823
   15    HB2  ALA   3           HB2      ALA   3  13.110  -5.568   8.297
   16    HB3  ALA   3           HB3      ALA   3  14.799  -6.128   8.315
   17    H    LEU   4           H        LEU   4  14.423  -4.028  11.539
   18    HA   LEU   4           HA       LEU   4  12.057  -2.936  12.285
   19    HB2  LEU   4           HB2      LEU   4  14.036  -3.706  13.742
   20    HB3  LEU   4           HB3      LEU   4  14.702  -2.094  13.534
   21    HG   LEU   4           HG       LEU   4  12.357  -1.286  14.485
   22   HD11  LEU   4          HD11      LEU   4  12.575  -4.087  15.642
   23   HD12  LEU   4          HD12      LEU   4  11.359  -2.857  16.045
   24   HD13  LEU   4          HD13      LEU   4  11.376  -3.597  14.427
   25   HD21  LEU   4          HD21      LEU   4  14.476  -0.929  15.622
   26   HD22  LEU   4          HD22      LEU   4  13.255  -1.471  16.784
   27   HD23  LEU   4          HD23      LEU   4  14.490  -2.607  16.193
   28    H    ALA   5           H        ALA   5  14.804  -0.943  11.126
   29    HA   ALA   5           HA       ALA   5  13.341   1.588  11.474
   30    HB1  ALA   5           HB1      ALA   5  15.362   2.548  10.399
   31    HB2  ALA   5           HB2      ALA   5  15.783   1.533  11.792
   32    HB3  ALA   5           HB3      ALA   5  16.007   0.916  10.137
   33    H    LYS   6           H        LYS   6  14.088  -0.727   8.880
   34    HA   LYS   6           HA       LYS   6  13.208   0.851   6.666
   35    HB2  LYS   6           HB2      LYS   6  14.587  -1.216   6.531
   36    HB3  LYS   6           HB3      LYS   6  13.160  -2.189   6.909
   37    HG2  LYS   6           HG2      LYS   6  12.087  -1.646   4.873
   38    HG3  LYS   6           HG3      LYS   6  13.124  -0.243   4.593
   39    HD2  LYS   6           HD2      LYS   6  15.072  -1.720   4.235
   40    HD3  LYS   6           HD3      LYS   6  14.047  -3.152   4.484
   41    HE2  LYS   6           HE2      LYS   6  12.686  -2.577   2.534
   42    HE3  LYS   6           HE3      LYS   6  13.498  -1.013   2.378
   43    HZ1  LYS   6           HZ1      LYS   6  14.861  -3.633   2.020
   44    HZ2  LYS   6           HZ2      LYS   6  14.355  -2.631   0.815
   45    HZ3  LYS   6           HZ3      LYS   6  15.548  -2.166   1.858
   46    H    LEU   7           H        LEU   7  11.302  -1.243   8.859
   47    HA   LEU   7           HA       LEU   7   8.815  -0.978   7.519
   48    HB2  LEU   7           HB2      LEU   7   9.650  -1.449  10.370
   49    HB3  LEU   7           HB3      LEU   7   7.963  -1.094  10.038
   50    HG   LEU   7           HG       LEU   7   8.183  -3.441  10.204
   51   HD11  LEU   7          HD11      LEU   7   7.169  -4.190   8.211
   52   HD12  LEU   7          HD12      LEU   7   6.734  -2.476   8.362
   53   HD13  LEU   7          HD13      LEU   7   7.987  -2.978   7.210
   54   HD21  LEU   7          HD21      LEU   7  10.524  -3.794   9.730
   55   HD22  LEU   7          HD22      LEU   7   9.550  -4.807   8.663
   56   HD23  LEU   7          HD23      LEU   7  10.292  -3.321   8.025
   57    H    ILE   8           H        ILE   8  10.403   1.398   9.655
   58    HA   ILE   8           HA       ILE   8   8.217   3.291   9.552
   59    HB   ILE   8           HB       ILE   8  11.143   3.766  10.171
   60   HG12  ILE   8          HG12      ILE   8  10.126   2.159  11.694
   61   HG13  ILE   8          HG13      ILE   8  10.488   3.672  12.511
   62   HG21  ILE   8          HG21      ILE   8   8.721   5.561  10.537
   63   HG22  ILE   8          HG22      ILE   8  10.294   5.818  11.327
   64   HG23  ILE   8          HG23      ILE   8  10.172   5.875   9.566
   65   HD11  ILE   8          HD11      ILE   8   8.069   4.274  12.440
   66   HD12  ILE   8          HD12      ILE   8   7.720   2.735  11.611
   67   HD13  ILE   8          HD13      ILE   8   8.355   2.726  13.254
   68    H    SER   9           H        SER   9  11.139   2.819   7.489
   69    HA   SER   9           HA       SER   9  10.576   5.146   5.860
   70    HB2  SER   9           HB2      SER   9  12.296   2.718   5.258
   71    HB3  SER   9           HB3      SER   9  12.245   4.238   4.347
   72    HG   SER   9           HG       SER   9  12.782   5.287   6.404
   73    H    LEU  10           H        LEU  10   9.235   1.929   5.855
   74    HA   LEU  10           HA       LEU  10   8.289   1.971   3.089
   75    HB2  LEU  10           HB2      LEU  10   7.903   0.222   5.541
   76    HB3  LEU  10           HB3      LEU  10   6.927  -0.019   4.099
   77    HG   LEU  10           HG       LEU  10   9.962   0.015   3.892
   78   HD11  LEU  10          HD11      LEU  10   8.150  -2.347   4.555
   79   HD12  LEU  10          HD12      LEU  10   9.830  -2.473   3.994
   80   HD13  LEU  10          HD13      LEU  10   9.481  -1.705   5.544
   81   HD21  LEU  10          HD21      LEU  10   8.516   0.121   1.807
   82   HD22  LEU  10          HD22      LEU  10   9.545  -1.315   1.903
   83   HD23  LEU  10          HD23      LEU  10   7.824  -1.442   2.298
   84    H    GLN  11           H        GLN  11   7.217   3.398   6.079
   85    HA   GLN  11           HA       GLN  11   4.367   3.338   5.370
   86    HB2  GLN  11           HB2      GLN  11   5.893   4.227   7.790
   87    HB3  GLN  11           HB3      GLN  11   4.219   4.739   7.513
   88    HG2  GLN  11           HG2      GLN  11   3.489   2.391   7.260
   89    HG3  GLN  11           HG3      GLN  11   5.150   1.844   7.554
   90   HE21  GLN  11          HE22      GLN  11   6.025   2.020   9.672
   91   HE22  GLN  11          HE21      GLN  11   5.036   2.580  11.028
   92    H    ALA  12           H        ALA  12   3.118   4.978   4.780
   93    HA   ALA  12           HA       ALA  12   4.346   7.332   3.560
   94    HB1  ALA  12           HB1      ALA  12   2.030   7.532   2.590
   95    HB2  ALA  12           HB2      ALA  12   2.769   5.947   2.311
   96    HB3  ALA  12           HB3      ALA  12   1.537   6.156   3.585
   97    H    THR  13           H        THR  13   3.462   9.439   3.709
   98    HA   THR  13           HA       THR  13   1.810  10.058   6.154
   99    HB   THR  13           HB       THR  13   3.741  11.962   4.805
  100    HG1  THR  13           HG1      THR  13   5.014  10.551   5.748
  101   HG21  THR  13          HG21      THR  13   3.590  13.061   7.111
  102   HG22  THR  13          HG22      THR  13   2.171  13.256   6.083
  103   HG23  THR  13          HG23      THR  13   2.148  12.063   7.401
  104    H    GLU  14           H        GLU  14   1.543   9.885   2.799
  105    HA   GLU  14           HA       GLU  14  -0.832  11.637   2.800
  106    HB2  GLU  14           HB2      GLU  14  -0.090  12.680   0.717
  107    HB3  GLU  14           HB3      GLU  14   0.976  13.062   2.060
  108    HG2  GLU  14           HG2      GLU  14   2.635  11.403   1.306
  109    HG3  GLU  14           HG3      GLU  14   1.551  10.899   0.003
  110    H    ALA  15           H        ALA  15  -2.316  11.305   1.050
  111    HA   ALA  15           HA       ALA  15  -2.035   8.862  -0.585
  112    HB1  ALA  15           HB1      ALA  15  -4.213   7.987   0.164
  113    HB2  ALA  15           HB2      ALA  15  -3.082   8.108   1.527
  114    HB3  ALA  15           HB3      ALA  15  -4.364   9.323   1.328
  115    H    THR  16           H        THR  16  -3.644   8.720  -2.286
  116    HA   THR  16           HA       THR  16  -4.930  11.341  -3.045
  117    HB   THR  16           HB       THR  16  -3.580   9.375  -4.906
  118    HG1  THR  16           HG1      THR  16  -2.126  10.627  -3.810
  119   HG21  THR  16          HG21      THR  16  -4.986  12.027  -5.467
  120   HG22  THR  16          HG22      THR  16  -3.924  11.176  -6.609
  121   HG23  THR  16          HG23      THR  16  -5.442  10.429  -6.098
  122    H    ILE  17           H        ILE  17  -7.094  11.257  -3.036
  123    HA   ILE  17           HA       ILE  17  -8.460   8.634  -3.397
  124    HB   ILE  17           HB       ILE  17  -9.700  11.198  -2.353
  125   HG12  ILE  17          HG12      ILE  17  -8.287   9.037  -0.734
  126   HG13  ILE  17          HG13      ILE  17  -7.842  10.735  -0.863
  127   HG21  ILE  17          HG21      ILE  17 -11.390   9.620  -1.442
  128   HG22  ILE  17          HG22      ILE  17 -11.251   9.451  -3.178
  129   HG23  ILE  17          HG23      ILE  17 -10.468   8.255  -2.130
  130   HD11  ILE  17          HD11      ILE  17 -10.302   9.632   0.529
  131   HD12  ILE  17          HD12      ILE  17  -8.900  10.424   1.250
  132   HD13  ILE  17          HD13      ILE  17 -10.005  11.366   0.231
  133    H    VAL  18           H        VAL  18  -9.824   8.211  -5.085
  134    HA   VAL  18           HA       VAL  18 -10.399  10.398  -7.051
  135    HB   VAL  18           HB       VAL  18  -9.502   7.575  -7.707
  136   HG11  VAL  18          HG11      VAL  18 -10.217   9.914  -9.522
  137   HG12  VAL  18          HG12      VAL  18  -9.472   8.393 -10.050
  138   HG13  VAL  18          HG13      VAL  18 -11.102   8.381  -9.377
  139   HG21  VAL  18          HG21      VAL  18  -7.548   8.813  -8.758
  140   HG22  VAL  18          HG22      VAL  18  -8.089  10.254  -7.878
  141   HG23  VAL  18          HG23      VAL  18  -7.578   8.814  -6.988
  142    H    THR  19           H        THR  19 -12.462  10.735  -7.185
  143    HA   THR  19           HA       THR  19 -14.431   8.516  -6.799
  144    HB   THR  19           HB       THR  19 -14.763  11.303  -5.649
  145    HG1  THR  19           HG1      THR  19 -13.062  10.551  -4.584
  146   HG21  THR  19          HG21      THR  19 -16.842  10.062  -5.761
  147   HG22  THR  19          HG22      THR  19 -16.072   8.608  -5.070
  148   HG23  THR  19          HG23      THR  19 -16.300  10.065  -4.087
  149    H    LEU  20           H        LEU  20 -16.456   8.775  -7.835
  150    HA   LEU  20           HA       LEU  20 -16.431  10.632 -10.157
  151    HB2  LEU  20           HB2      LEU  20 -18.406   8.410  -9.598
  152    HB3  LEU  20           HB3      LEU  20 -18.182   9.291 -11.091
  153    HG   LEU  20           HG       LEU  20 -16.158   7.359  -9.861
  154   HD11  LEU  20          HD11      LEU  20 -18.176   7.025 -12.110
  155   HD12  LEU  20          HD12      LEU  20 -16.853   5.887 -11.748
  156   HD13  LEU  20          HD13      LEU  20 -18.136   6.169 -10.564
  157   HD21  LEU  20          HD21      LEU  20 -15.085   9.050 -11.264
  158   HD22  LEU  20          HD22      LEU  20 -15.083   7.486 -12.088
  159   HD23  LEU  20          HD23      LEU  20 -16.246   8.753 -12.570
  160    H    ASP  21           H        ASP  21 -17.938  12.166 -10.496
  161    HA   ASP  21           HA       ASP  21 -20.157  12.505  -8.511
  162    HB2  ASP  21           HB2      ASP  21 -18.050  14.409  -9.186
  163    HB3  ASP  21           HB3      ASP  21 -19.615  15.043  -9.661
  164    H    SER  22           H        SER  22 -19.447  11.877 -11.672
  165    HA   SER  22           HA       SER  22 -22.239  11.950 -12.386
  166    HB2  SER  22           HB2      SER  22 -20.371  13.462 -14.240
  167    HB3  SER  22           HB3      SER  22 -22.008  12.926 -14.618
  168    HG   SER  22           HG       SER  22 -22.275  14.923 -14.022
  169    H    ASP  23           H        ASP  23 -22.733  10.334 -13.530
  170    HA   ASP  23           HA       ASP  23 -21.891   8.009 -13.428
  171    HB2  ASP  23           HB2      ASP  23 -24.005   8.852 -14.486
  172    HB3  ASP  23           HB3      ASP  23 -23.181   8.840 -16.042
  173    H    ASN  24           H        ASN  24 -19.563   8.250 -13.521
  174    HA   ASN  24           HA       ASN  24 -17.492   7.580 -14.169
  175    HB2  ASN  24           HB2      ASN  24 -18.441   5.467 -14.938
  176    HB3  ASN  24           HB3      ASN  24 -18.816   6.177 -16.504
  177   HD21  ASN  24          HD22      ASN  24 -15.973   5.518 -14.478
  178   HD22  ASN  24          HD21      ASN  24 -15.085   5.164 -15.971
  179    H    ILE  25           H        ILE  25 -19.454   9.493 -16.378
  180    HA   ILE  25           HA       ILE  25 -17.454  10.479 -18.011
  181    HB   ILE  25           HB       ILE  25 -19.268  12.229 -18.388
  182   HG12  ILE  25          HG12      ILE  25 -20.940  10.601 -16.487
  183   HG13  ILE  25          HG13      ILE  25 -20.257  12.196 -16.148
  184   HG21  ILE  25          HG21      ILE  25 -20.095   9.295 -18.518
  185   HG22  ILE  25          HG22      ILE  25 -20.655  10.603 -19.586
  186   HG23  ILE  25          HG23      ILE  25 -18.975  10.069 -19.646
  187   HD11  ILE  25          HD11      ILE  25 -22.574  12.438 -16.821
  188   HD12  ILE  25          HD12      ILE  25 -21.540  13.119 -18.092
  189   HD13  ILE  25          HD13      ILE  25 -22.300  11.523 -18.306
  190    H    LEU  26           H        LEU  26 -17.999  11.354 -14.686
  191    HA   LEU  26           HA       LEU  26 -16.049  13.589 -15.064
  192    HB2  LEU  26           HB2      LEU  26 -18.284  14.521 -14.783
  193    HB3  LEU  26           HB3      LEU  26 -18.444  13.704 -13.225
  194    HG   LEU  26           HG       LEU  26 -15.953  15.301 -13.435
  195   HD11  LEU  26          HD11      LEU  26 -18.633  16.726 -13.518
  196   HD12  LEU  26          HD12      LEU  26 -17.050  17.484 -13.220
  197   HD13  LEU  26          HD13      LEU  26 -17.390  16.744 -14.796
  198   HD21  LEU  26          HD21      LEU  26 -16.622  16.110 -11.254
  199   HD22  LEU  26          HD22      LEU  26 -18.241  15.410 -11.463
  200   HD23  LEU  26          HD23      LEU  26 -16.814  14.350 -11.313
  201    H    LEU  27           H        LEU  27 -14.400  13.442 -14.014
  202    HA   LEU  27           HA       LEU  27 -14.045  11.615 -11.647
  203    HB2  LEU  27           HB2      LEU  27 -11.859  12.791 -13.406
  204    HB3  LEU  27           HB3      LEU  27 -11.668  11.642 -12.108
  205    HG   LEU  27           HG       LEU  27 -11.353  10.397 -13.990
  206   HD11  LEU  27          HD11      LEU  27 -14.298   9.914 -13.484
  207   HD12  LEU  27          HD12      LEU  27 -13.126   8.770 -14.155
  208   HD13  LEU  27          HD13      LEU  27 -12.962   9.297 -12.471
  209   HD21  LEU  27          HD21      LEU  27 -12.174  11.993 -15.692
  210   HD22  LEU  27          HD22      LEU  27 -12.652  10.322 -16.007
  211   HD23  LEU  27          HD23      LEU  27 -13.843  11.461 -15.366
  212    H    SER  28           H        SER  28 -13.647  12.466  -9.664
  213    HA   SER  28           HA       SER  28 -12.528  15.237  -9.447
  214    HB2  SER  28           HB2      SER  28 -14.901  15.294  -8.899
  215    HB3  SER  28           HB3      SER  28 -14.700  13.969  -7.740
  216    HG   SER  28           HG       SER  28 -14.640  16.358  -7.077
  217    H    GLU  29           H        GLU  29 -10.549  15.225  -8.425
  218    HA   GLU  29           HA       GLU  29  -9.842  12.816  -6.843
  219    HB2  GLU  29           HB2      GLU  29  -7.958  14.408  -8.592
  220    HB3  GLU  29           HB3      GLU  29  -7.638  12.932  -7.697
  221    HG2  GLU  29           HG2      GLU  29  -8.044  11.797  -9.556
  222    HG3  GLU  29           HG3      GLU  29  -9.748  12.114  -9.304
  223    H    GLU  30           H        GLU  30  -8.418  13.104  -5.145
  224    HA   GLU  30           HA       GLU  30  -7.937  15.867  -4.063
  225    HB2  GLU  30           HB2      GLU  30  -9.156  13.484  -2.604
  226    HB3  GLU  30           HB3      GLU  30  -8.688  14.989  -1.830
  227    HG2  GLU  30           HG2      GLU  30 -10.806  14.907  -4.024
  228    HG3  GLU  30           HG3      GLU  30 -11.153  14.530  -2.353
  229    H    GLN  31           H        GLN  31  -5.913  16.060  -3.037
  230    HA   GLN  31           HA       GLN  31  -4.523  13.508  -2.284
  231    HB2  GLN  31           HB2      GLN  31  -3.168  16.173  -2.756
  232    HB3  GLN  31           HB3      GLN  31  -2.414  14.588  -2.449
  233    HG2  GLN  31           HG2      GLN  31  -3.574  13.766  -4.563
  234    HG3  GLN  31           HG3      GLN  31  -3.788  15.489  -4.983
  235   HE21  GLN  31          HE22      GLN  31  -1.789  12.810  -4.763
  236   HE22  GLN  31          HE21      GLN  31  -0.436  13.656  -4.205
  237    H    VAL  32           H        VAL  32  -4.147  13.113  -0.193
  238    HA   VAL  32           HA       VAL  32  -4.837  15.205   1.842
  239    HB   VAL  32           HB       VAL  32  -6.254  13.648   2.998
  240   HG11  VAL  32          HG11      VAL  32  -8.154  13.527   1.528
  241   HG12  VAL  32          HG12      VAL  32  -7.280  15.034   1.193
  242   HG13  VAL  32          HG13      VAL  32  -7.134  13.646   0.089
  243   HG21  VAL  32          HG21      VAL  32  -5.196  11.488   2.412
  244   HG22  VAL  32          HG22      VAL  32  -6.933  11.484   2.094
  245   HG23  VAL  32          HG23      VAL  32  -5.798  11.648   0.744
  246    H    ASP  33           H        ASP  33  -4.341  14.579   4.038
  247    HA   ASP  33           HA       ASP  33  -1.755  13.227   4.388
  248    HB2  ASP  33           HB2      ASP  33  -1.896  15.040   5.812
  249    HB3  ASP  33           HB3      ASP  33  -3.615  14.868   6.083
  250    H    VAL  34           H        VAL  34  -1.371  11.359   5.589
  251    HA   VAL  34           HA       VAL  34  -3.171   9.258   5.015
  252    HB   VAL  34           HB       VAL  34  -0.686   9.149   5.151
  253   HG11  VAL  34          HG11      VAL  34  -1.155   8.785   8.140
  254   HG12  VAL  34          HG12      VAL  34   0.364   8.510   7.287
  255   HG13  VAL  34          HG13      VAL  34  -0.321  10.143   7.361
  256   HG21  VAL  34          HG21      VAL  34  -2.076   7.128   4.844
  257   HG22  VAL  34          HG22      VAL  34  -0.543   6.828   5.678
  258   HG23  VAL  34          HG23      VAL  34  -2.049   6.865   6.600
  259    H    GLU  35           H        GLU  35  -3.445  11.300   7.776
  260    HA   GLU  35           HA       GLU  35  -5.124   9.278   9.174
  261    HB2  GLU  35           HB2      GLU  35  -3.385  10.942  10.253
  262    HB3  GLU  35           HB3      GLU  35  -4.719  12.094  10.149
  263    HG2  GLU  35           HG2      GLU  35  -6.159  10.532  11.443
  264    HG3  GLU  35           HG3      GLU  35  -4.840   9.353  11.496
  265    H    LEU  36           H        LEU  36  -5.475  11.838   6.853
  266    HA   LEU  36           HA       LEU  36  -8.278  12.424   7.537
  267    HB2  LEU  36           HB2      LEU  36  -6.543  13.354   5.227
  268    HB3  LEU  36           HB3      LEU  36  -8.134  13.985   5.646
  269    HG   LEU  36           HG       LEU  36  -5.587  14.262   7.284
  270   HD11  LEU  36          HD11      LEU  36  -7.310  16.333   5.867
  271   HD12  LEU  36          HD12      LEU  36  -5.812  16.636   6.772
  272   HD13  LEU  36          HD13      LEU  36  -5.759  15.708   5.268
  273   HD21  LEU  36          HD21      LEU  36  -7.462  14.089   8.843
  274   HD22  LEU  36          HD22      LEU  36  -6.907  15.761   8.747
  275   HD23  LEU  36          HD23      LEU  36  -8.386  15.277   7.888
  276    H    VAL  37           H        VAL  37  -6.802   9.947   5.837
  277    HA   VAL  37           HA       VAL  37  -9.231   9.424   4.188
  278    HB   VAL  37           HB       VAL  37  -7.167   9.348   2.949
  279   HG11  VAL  37          HG11      VAL  37  -6.295   7.036   4.729
  280   HG12  VAL  37          HG12      VAL  37  -5.467   7.626   3.278
  281   HG13  VAL  37          HG13      VAL  37  -5.569   8.661   4.705
  282   HG21  VAL  37          HG21      VAL  37  -9.040   7.851   2.307
  283   HG22  VAL  37          HG22      VAL  37  -7.449   7.244   1.829
  284   HG23  VAL  37          HG23      VAL  37  -8.275   6.534   3.225
  285    H    GLN  38           H        GLN  38 -10.409   7.579   4.394
  286    HA   GLN  38           HA       GLN  38 -10.078   5.904   6.849
  287    HB2  GLN  38           HB2      GLN  38 -12.618   7.097   5.677
  288    HB3  GLN  38           HB3      GLN  38 -12.618   5.721   6.769
  289    HG2  GLN  38           HG2      GLN  38 -11.428   7.094   8.492
  290    HG3  GLN  38           HG3      GLN  38 -11.588   8.504   7.430
  291   HE21  GLN  38          HE22      GLN  38 -13.902   9.079   6.900
  292   HE22  GLN  38          HE21      GLN  38 -15.123   8.546   8.064
  293    H    ARG  39           H        ARG  39 -11.396   3.845   6.621
  294    HA   ARG  39           HA       ARG  39 -10.719   2.513   4.078
  295    HB2  ARG  39           HB2      ARG  39 -11.541   0.510   5.013
  296    HB3  ARG  39           HB3      ARG  39 -10.589   1.322   6.260
  297    HG2  ARG  39           HG2      ARG  39 -12.863   2.189   7.130
  298    HG3  ARG  39           HG3      ARG  39 -13.612   1.009   6.056
  299    HD2  ARG  39           HD2      ARG  39 -12.308  -0.810   7.207
  300    HD3  ARG  39           HD3      ARG  39 -11.595   0.407   8.258
  301    HE   ARG  39           HE       ARG  39 -13.532   0.490   9.525
  302   HH11  ARG  39          HH11      ARG  39 -14.407  -1.317   6.588
  303   HH12  ARG  39          HH12      ARG  39 -15.966  -1.715   7.325
  304   HH21  ARG  39          HH21      ARG  39 -15.466  -0.069  10.226
  305   HH22  ARG  39          HH22      ARG  39 -16.518  -1.106   9.229
  306    H    GLY  40           H        GLY  40 -12.170   1.947   2.380
  307    HA2  GLY  40           HA2      GLY  40 -14.437   1.449   1.686
  308    HA3  GLY  40           HA3      GLY  40 -15.008   2.824   2.627
  309    H    ASP  41           H        ASP  41 -12.197   3.997   1.327
  310    HA   ASP  41           HA       ASP  41 -13.590   5.138  -1.054
  311    HB2  ASP  41           HB2      ASP  41 -11.347   6.172   0.698
  312    HB3  ASP  41           HB3      ASP  41 -11.691   6.836  -0.894
  313    H    ILE  42           H        ILE  42 -12.208   5.747  -2.907
  314    HA   ILE  42           HA       ILE  42 -10.514   3.405  -3.654
  315    HB   ILE  42           HB       ILE  42 -12.738   4.802  -5.125
  316   HG12  ILE  42          HG12      ILE  42 -11.983   1.880  -4.625
  317   HG13  ILE  42          HG13      ILE  42 -13.121   2.796  -3.643
  318   HG21  ILE  42          HG21      ILE  42 -10.549   3.089  -6.371
  319   HG22  ILE  42          HG22      ILE  42 -12.067   3.566  -7.182
  320   HG23  ILE  42          HG23      ILE  42 -10.903   4.798  -6.743
  321   HD11  ILE  42          HD11      ILE  42 -13.505   1.969  -6.540
  322   HD12  ILE  42          HD12      ILE  42 -14.345   1.371  -5.106
  323   HD13  ILE  42          HD13      ILE  42 -14.606   3.048  -5.638
  324    H    ILE  43           H        ILE  43  -8.578   3.667  -4.277
  325    HA   ILE  43           HA       ILE  43  -7.416   6.303  -4.847
  326    HB   ILE  43           HB       ILE  43  -6.266   3.649  -3.899
  327   HG12  ILE  43          HG12      ILE  43  -7.812   4.209  -2.238
  328   HG13  ILE  43          HG13      ILE  43  -6.199   4.515  -1.627
  329   HG21  ILE  43          HG21      ILE  43  -4.557   5.156  -4.847
  330   HG22  ILE  43          HG22      ILE  43  -4.989   6.384  -3.645
  331   HG23  ILE  43          HG23      ILE  43  -4.325   4.837  -3.126
  332   HD11  ILE  43          HD11      ILE  43  -8.192   6.637  -2.523
  333   HD12  ILE  43          HD12      ILE  43  -7.810   6.204  -0.861
  334   HD13  ILE  43          HD13      ILE  43  -6.561   6.959  -1.878
  335    H    LYS  44           H        LYS  44  -6.986   6.605  -7.023
  336    HA   LYS  44           HA       LYS  44  -6.078   4.324  -8.660
  337    HB2  LYS  44           HB2      LYS  44  -7.719   6.219  -9.412
  338    HB3  LYS  44           HB3      LYS  44  -6.229   7.108  -9.792
  339    HG2  LYS  44           HG2      LYS  44  -5.451   5.197 -11.187
  340    HG3  LYS  44           HG3      LYS  44  -6.860   4.262 -10.683
  341    HD2  LYS  44           HD2      LYS  44  -8.223   6.281 -11.767
  342    HD3  LYS  44           HD3      LYS  44  -6.699   6.519 -12.662
  343    HE2  LYS  44           HE2      LYS  44  -6.784   3.976 -13.124
  344    HE3  LYS  44           HE3      LYS  44  -8.385   3.987 -12.428
  345    HZ1  LYS  44           HZ1      LYS  44  -7.568   5.534 -14.838
  346    HZ2  LYS  44           HZ2      LYS  44  -8.483   4.182 -14.850
  347    HZ3  LYS  44           HZ3      LYS  44  -9.067   5.568 -14.163
  348    H    VAL  45           H        VAL  45  -4.092   3.715  -8.835
  349    HA   VAL  45           HA       VAL  45  -1.969   5.423  -7.685
  350    HB   VAL  45           HB       VAL  45  -2.490   3.083  -6.887
  351   HG11  VAL  45          HG11      VAL  45  -0.915   2.242  -9.359
  352   HG12  VAL  45          HG12      VAL  45  -1.502   1.195  -8.054
  353   HG13  VAL  45          HG13      VAL  45  -2.653   2.025  -9.126
  354   HG21  VAL  45          HG21      VAL  45  -0.158   2.499  -6.434
  355   HG22  VAL  45          HG22      VAL  45   0.400   3.606  -7.686
  356   HG23  VAL  45          HG23      VAL  45  -0.412   4.243  -6.240
  357    H    VAL  46           H        VAL  46  -0.097   6.035  -8.680
  358    HA   VAL  46           HA       VAL  46   0.204   5.636 -11.590
  359    HB   VAL  46           HB       VAL  46   2.131   7.178 -11.342
  360   HG11  VAL  46          HG11      VAL  46   0.860   9.177 -10.866
  361   HG12  VAL  46          HG12      VAL  46  -0.141   8.047 -11.787
  362   HG13  VAL  46          HG13      VAL  46  -0.403   8.245 -10.038
  363   HG21  VAL  46          HG21      VAL  46   2.645   8.291  -9.301
  364   HG22  VAL  46          HG22      VAL  46   1.351   7.461  -8.421
  365   HG23  VAL  46          HG23      VAL  46   2.767   6.561  -9.000
  366    HA   PRO  47           HA       PRO  47   3.487   2.539 -11.433
  367    HB2  PRO  47           HB2      PRO  47   5.381   3.642 -13.146
  368    HB3  PRO  47           HB3      PRO  47   3.943   2.718 -13.674
  369    HG2  PRO  47           HG2      PRO  47   4.270   5.729 -13.457
  370    HG3  PRO  47           HG3      PRO  47   3.590   4.785 -14.823
  371    HD2  PRO  47           HD2      PRO  47   1.950   5.942 -13.064
  372    HD3  PRO  47           HD3      PRO  47   1.612   4.276 -13.593
  373    H    GLY  48           H        GLY  48   5.439   2.237 -10.286
  374    HA2  GLY  48           HA2      GLY  48   7.089   2.666  -8.787
  375    HA3  GLY  48           HA3      GLY  48   7.111   4.344  -9.284
  376    H    GLY  49           H        GLY  49   3.919   3.720  -8.345
  377    HA2  GLY  49           HA2      GLY  49   4.039   5.044  -5.814
  378    HA3  GLY  49           HA3      GLY  49   2.671   4.124  -6.445
  379    H    LYS  50           H        LYS  50   3.790   4.288  -3.741
  380    HA   LYS  50           HA       LYS  50   4.784   1.518  -3.224
  381    HB2  LYS  50           HB2      LYS  50   5.314   4.022  -1.595
  382    HB3  LYS  50           HB3      LYS  50   6.061   2.431  -1.402
  383    HG2  LYS  50           HG2      LYS  50   7.024   2.710  -3.740
  384    HG3  LYS  50           HG3      LYS  50   6.425   4.371  -3.727
  385    HD2  LYS  50           HD2      LYS  50   7.713   4.807  -1.637
  386    HD3  LYS  50           HD3      LYS  50   8.389   3.167  -1.732
  387    HE2  LYS  50           HE2      LYS  50   9.397   3.689  -3.929
  388    HE3  LYS  50           HE3      LYS  50   8.649   5.290  -3.905
  389    HZ1  LYS  50           HZ1      LYS  50   9.933   5.801  -1.918
  390    HZ2  LYS  50           HZ2      LYS  50  10.706   4.332  -1.992
  391    HZ3  LYS  50           HZ3      LYS  50  10.914   5.453  -3.173
  392    H    PHE  51           H        PHE  51   1.944   2.849  -2.982
  393    HA   PHE  51           HA       PHE  51   0.078   2.678  -1.839
  394    HB2  PHE  51           HB2      PHE  51   1.234   0.040  -0.982
  395    HB3  PHE  51           HB3      PHE  51  -0.451   0.506  -0.783
  396    HD1  PHE  51           HD2      PHE  51  -1.657   1.410  -3.003
  397    HD2  PHE  51           HD1      PHE  51   1.815  -1.134  -2.940
  398    HE1  PHE  51           HE2      PHE  51  -2.123   0.704  -5.332
  399    HE2  PHE  51           HE1      PHE  51   1.344  -1.851  -5.257
  400    HZ   PHE  51           HZ       PHE  51  -0.633  -0.931  -6.470
  401    HA   PRO  52           HA       PRO  52   1.000   4.348   2.228
  402    HB2  PRO  52           HB2      PRO  52  -1.134   6.003   2.554
  403    HB3  PRO  52           HB3      PRO  52   0.159   6.321   1.359
  404    HG2  PRO  52           HG2      PRO  52  -2.530   5.028   0.854
  405    HG3  PRO  52           HG3      PRO  52  -1.754   6.368  -0.047
  406    HD2  PRO  52           HD2      PRO  52  -1.599   3.760  -0.863
  407    HD3  PRO  52           HD3      PRO  52  -0.257   4.919  -1.115
  408    H    VAL  53           H        VAL  53  -1.500   2.154   1.562
  409    HA   VAL  53           HA       VAL  53  -1.979   1.341   4.265
  410    HB   VAL  53           HB       VAL  53  -4.486   1.453   4.096
  411   HG11  VAL  53          HG11      VAL  53  -3.211   4.196   4.327
  412   HG12  VAL  53          HG12      VAL  53  -4.727   3.626   5.051
  413   HG13  VAL  53          HG13      VAL  53  -3.183   2.950   5.594
  414   HG21  VAL  53          HG21      VAL  53  -5.526   3.162   2.725
  415   HG22  VAL  53          HG22      VAL  53  -3.959   3.630   2.044
  416   HG23  VAL  53          HG23      VAL  53  -4.641   2.025   1.682
  417    H    ASP  54           H        ASP  54  -3.733  -0.595   4.087
  418    HA   ASP  54           HA       ASP  54  -3.031  -2.087   1.620
  419    HB2  ASP  54           HB2      ASP  54  -3.397  -4.099   2.687
  420    HB3  ASP  54           HB3      ASP  54  -2.406  -3.115   3.747
  421    H    GLY  55           H        GLY  55  -4.518  -3.218   0.383
  422    HA2  GLY  55           HA2      GLY  55  -7.372  -2.676   0.554
  423    HA3  GLY  55           HA3      GLY  55  -6.537  -1.575  -0.538
  424    H    ARG  56           H        ARG  56  -8.438  -2.902  -1.577
  425    HA   ARG  56           HA       ARG  56  -7.348  -5.319  -2.975
  426    HB2  ARG  56           HB2      ARG  56  -9.298  -5.529  -1.370
  427    HB3  ARG  56           HB3      ARG  56 -10.287  -4.673  -2.556
  428    HG2  ARG  56           HG2      ARG  56 -10.013  -6.418  -4.183
  429    HG3  ARG  56           HG3      ARG  56  -8.665  -7.144  -3.307
  430    HD2  ARG  56           HD2      ARG  56 -11.540  -7.108  -2.327
  431    HD3  ARG  56           HD3      ARG  56 -10.694  -8.456  -3.112
  432    HE   ARG  56           HE       ARG  56  -9.268  -7.529  -0.755
  433   HH11  ARG  56          HH11      ARG  56 -11.818  -9.754  -1.753
  434   HH12  ARG  56          HH12      ARG  56 -11.631 -10.688  -0.282
  435   HH21  ARG  56          HH21      ARG  56  -9.113  -8.699   0.966
  436   HH22  ARG  56          HH22      ARG  56 -10.097 -10.136   1.219
  437    H    VAL  57           H        VAL  57  -7.423  -5.526  -5.156
  438    HA   VAL  57           HA       VAL  57  -7.434  -2.946  -6.633
  439    HB   VAL  57           HB       VAL  57  -6.217  -5.645  -7.351
  440   HG11  VAL  57          HG11      VAL  57  -5.760  -2.869  -8.518
  441   HG12  VAL  57          HG12      VAL  57  -4.916  -4.371  -8.988
  442   HG13  VAL  57          HG13      VAL  57  -6.633  -4.200  -9.309
  443   HG21  VAL  57          HG21      VAL  57  -5.049  -4.819  -5.369
  444   HG22  VAL  57          HG22      VAL  57  -4.022  -4.649  -6.792
  445   HG23  VAL  57          HG23      VAL  57  -4.841  -3.226  -6.121
  446    H    ILE  58           H        ILE  58  -8.982  -2.598  -8.170
  447    HA   ILE  58           HA       ILE  58 -10.492  -4.917  -9.324
  448    HB   ILE  58           HB       ILE  58 -12.629  -3.583  -8.788
  449   HG12  ILE  58          HG12      ILE  58 -10.840  -2.405  -6.621
  450   HG13  ILE  58          HG13      ILE  58 -11.313  -1.502  -8.074
  451   HG21  ILE  58          HG21      ILE  58 -11.183  -4.792  -6.408
  452   HG22  ILE  58          HG22      ILE  58 -12.930  -4.702  -6.699
  453   HG23  ILE  58          HG23      ILE  58 -11.925  -5.736  -7.715
  454   HD11  ILE  58          HD11      ILE  58 -12.755  -0.847  -6.260
  455   HD12  ILE  58          HD12      ILE  58 -13.714  -1.770  -7.434
  456   HD13  ILE  58          HD13      ILE  58 -13.191  -2.530  -5.910
  457    H    GLU  59           H        GLU  59  -8.554  -2.923 -10.477
  458    HA   GLU  59           HA       GLU  59  -9.817  -2.933 -13.053
  459    HB2  GLU  59           HB2      GLU  59 -10.449  -0.632 -11.680
  460    HB3  GLU  59           HB3      GLU  59  -8.948  -0.136 -12.407
  461    HG2  GLU  59           HG2      GLU  59 -11.357  -1.256 -13.902
  462    HG3  GLU  59           HG3      GLU  59 -11.010   0.456 -13.685
  463    H    GLY  60           H        GLY  60  -8.146  -3.051 -14.619
  464    HA2  GLY  60           HA2      GLY  60  -6.194  -2.262 -15.666
  465    HA3  GLY  60           HA3      GLY  60  -5.622  -1.599 -14.153
  466    H    HIS  61           H        HIS  61  -3.638  -2.569 -15.208
  467    HA   HIS  61           HA       HIS  61  -3.116  -5.192 -13.914
  468    HB2  HIS  61           HB2      HIS  61  -2.070  -6.164 -15.829
  469    HB3  HIS  61           HB3      HIS  61  -3.714  -5.712 -16.244
  470    HD1  HIS  61           HD1      HIS  61  -3.854  -3.299 -17.782
  471    HD2  HIS  61           HD2      HIS  61  -0.213  -5.392 -17.480
  472    HE1  HIS  61           HE1      HIS  61  -2.369  -2.434 -19.667
  473    H    SER  62           H        SER  62  -1.334  -5.137 -12.709
  474    HA   SER  62           HA       SER  62   1.067  -3.871 -13.720
  475    HB2  SER  62           HB2      SER  62  -0.289  -2.700 -11.286
  476    HB3  SER  62           HB3      SER  62   1.461  -2.737 -11.373
  477    HG   SER  62           HG       SER  62  -0.214  -1.830 -13.494
  478    H    MET  63           H        MET  63   3.043  -4.566 -12.752
  479    HA   MET  63           HA       MET  63   2.765  -6.896 -10.936
  480    HB2  MET  63           HB2      MET  63   3.981  -7.321 -12.987
  481    HB3  MET  63           HB3      MET  63   5.096  -5.986 -12.652
  482    HG2  MET  63           HG2      MET  63   6.043  -7.084 -10.793
  483    HG3  MET  63           HG3      MET  63   4.715  -8.239 -10.655
  484    HE1  MET  63           HE1      MET  63   4.143  -9.732 -13.083
  485    HE2  MET  63           HE2      MET  63   5.407 -10.983 -13.156
  486    HE3  MET  63           HE3      MET  63   4.684 -10.545 -11.594
  487    H    VAL  64           H        VAL  64   3.520  -6.821  -8.935
  488    HA   VAL  64           HA       VAL  64   4.616  -4.250  -7.865
  489    HB   VAL  64           HB       VAL  64   2.436  -6.049  -6.748
  490   HG11  VAL  64          HG11      VAL  64   3.763  -5.206  -4.893
  491   HG12  VAL  64          HG12      VAL  64   3.688  -3.548  -5.536
  492   HG13  VAL  64          HG13      VAL  64   2.222  -4.356  -4.942
  493   HG21  VAL  64          HG21      VAL  64   2.381  -3.160  -7.730
  494   HG22  VAL  64          HG22      VAL  64   1.619  -4.551  -8.528
  495   HG23  VAL  64          HG23      VAL  64   1.034  -3.999  -6.953
  496    H    ASP  65           H        ASP  65   6.271  -4.334  -6.554
  497    HA   ASP  65           HA       ASP  65   7.520  -6.928  -5.840
  498    HB2  ASP  65           HB2      ASP  65   8.903  -5.210  -6.871
  499    HB3  ASP  65           HB3      ASP  65   8.475  -4.058  -5.604
  500    H    GLU  66           H        GLU  66   7.149  -7.882  -3.970
  501    HA   GLU  66           HA       GLU  66   6.287  -6.315  -1.557
  502    HB2  GLU  66           HB2      GLU  66   5.759  -9.228  -2.201
  503    HB3  GLU  66           HB3      GLU  66   5.113  -8.287  -0.840
  504    HG2  GLU  66           HG2      GLU  66   3.784  -6.934  -2.436
  505    HG3  GLU  66           HG3      GLU  66   4.339  -7.976  -3.755
  506    H    SER  67           H        SER  67   9.136  -7.302  -2.539
  507    HA   SER  67           HA       SER  67   9.958  -9.498  -1.098
  508    HB2  SER  67           HB2      SER  67  12.199  -8.849  -1.769
  509    HB3  SER  67           HB3      SER  67  11.034  -8.519  -3.061
  510    HG   SER  67           HG       SER  67  12.295  -6.711  -2.855
  511    H    LEU  68           H        LEU  68   9.173  -6.786   0.625
  512    HA   LEU  68           HA       LEU  68  10.981  -7.618   2.855
  513    HB2  LEU  68           HB2      LEU  68  11.375  -5.280   1.909
  514    HB3  LEU  68           HB3      LEU  68   9.771  -4.852   2.462
  515    HG   LEU  68           HG       LEU  68  11.524  -4.027   3.911
  516   HD11  LEU  68          HD11      LEU  68  10.173  -6.173   5.556
  517   HD12  LEU  68          HD12      LEU  68  10.684  -4.557   6.031
  518   HD13  LEU  68          HD13      LEU  68   9.302  -4.751   4.937
  519   HD21  LEU  68          HD21      LEU  68  13.238  -5.738   3.580
  520   HD22  LEU  68          HD22      LEU  68  12.935  -5.441   5.297
  521   HD23  LEU  68          HD23      LEU  68  12.285  -6.897   4.534
  522    H    ILE  69           H        ILE  69   7.767  -6.543   1.830
  523    HA   ILE  69           HA       ILE  69   6.516  -6.917   4.419
  524    HB   ILE  69           HB       ILE  69   5.157  -6.794   1.705
  525   HG12  ILE  69          HG12      ILE  69   6.508  -4.757   2.045
  526   HG13  ILE  69          HG13      ILE  69   4.789  -4.435   2.063
  527   HG21  ILE  69          HG21      ILE  69   4.145  -6.532   4.568
  528   HG22  ILE  69          HG22      ILE  69   3.237  -5.925   3.181
  529   HG23  ILE  69          HG23      ILE  69   3.598  -7.653   3.307
  530   HD11  ILE  69          HD11      ILE  69   6.563  -4.598   4.539
  531   HD12  ILE  69          HD12      ILE  69   5.946  -3.123   3.766
  532   HD13  ILE  69          HD13      ILE  69   4.814  -4.246   4.529
  533    H    THR  70           H        THR  70   6.291  -8.975   1.434
  534    HA   THR  70           HA       THR  70   5.543 -11.280   3.182
  535    HB   THR  70           HB       THR  70   4.887 -12.386   1.066
  536    HG1  THR  70           HG1      THR  70   4.590 -10.614  -0.645
  537   HG21  THR  70          HG21      THR  70   2.875 -11.121   0.666
  538   HG22  THR  70          HG22      THR  70   3.228 -11.062   2.403
  539   HG23  THR  70          HG23      THR  70   3.581  -9.651   1.374
  540    H    GLY  71           H        GLY  71   8.299 -10.052   1.547
  541    HA2  GLY  71           HA2      GLY  71  10.451 -10.795   1.923
  542    HA3  GLY  71           HA3      GLY  71   9.833 -12.321   2.548
  543    H    GLU  72           H        GLU  72   8.371 -11.954  -0.368
  544    HA   GLU  72           HA       GLU  72  10.190 -13.808  -1.719
  545    HB2  GLU  72           HB2      GLU  72   8.344 -13.599  -3.535
  546    HB3  GLU  72           HB3      GLU  72   8.137 -14.568  -2.082
  547    HG2  GLU  72           HG2      GLU  72   6.811 -12.693  -1.072
  548    HG3  GLU  72           HG3      GLU  72   6.849 -11.858  -2.639
  549    H    ALA  73           H        ALA  73  11.735 -13.362  -3.140
  550    HA   ALA  73           HA       ALA  73  12.254 -10.553  -3.802
  551    HB1  ALA  73           HB1      ALA  73  13.972 -12.025  -2.788
  552    HB2  ALA  73           HB2      ALA  73  13.940 -13.047  -4.246
  553    HB3  ALA  73           HB3      ALA  73  14.479 -11.354  -4.344
  554    H    MET  74           H        MET  74  10.203 -12.310  -5.154
  555    HA   MET  74           HA       MET  74  10.864 -11.908  -8.047
  556    HB2  MET  74           HB2      MET  74   9.522 -14.215  -6.601
  557    HB3  MET  74           HB3      MET  74   9.382 -13.954  -8.342
  558    HG2  MET  74           HG2      MET  74  11.723 -14.275  -8.691
  559    HG3  MET  74           HG3      MET  74  12.077 -14.156  -6.971
  560    HE1  MET  74           HE1      MET  74   9.887 -17.825  -8.812
  561    HE2  MET  74           HE2      MET  74   9.007 -16.339  -8.400
  562    HE3  MET  74           HE3      MET  74  10.219 -16.321  -9.698
  563    HA   PRO  75           HA       PRO  75   7.403  -9.210  -7.029
  564    HB2  PRO  75           HB2      PRO  75   7.726  -8.597  -9.969
  565    HB3  PRO  75           HB3      PRO  75   7.333  -7.469  -8.626
  566    HG2  PRO  75           HG2      PRO  75   9.877  -7.636  -9.468
  567    HG3  PRO  75           HG3      PRO  75   9.561  -7.740  -7.704
  568    HD2  PRO  75           HD2      PRO  75  10.010 -10.016  -9.666
  569    HD3  PRO  75           HD3      PRO  75  10.756  -9.746  -8.061
  570    H    VAL  76           H        VAL  76   5.232  -8.938  -7.414
  571    HA   VAL  76           HA       VAL  76   3.919 -11.438  -8.343
  572    HB   VAL  76           HB       VAL  76   3.013  -9.488  -6.200
  573   HG11  VAL  76          HG11      VAL  76   1.663 -11.419  -5.441
  574   HG12  VAL  76          HG12      VAL  76   1.213 -10.940  -7.088
  575   HG13  VAL  76          HG13      VAL  76   2.236 -12.372  -6.816
  576   HG21  VAL  76          HG21      VAL  76   5.153 -10.446  -5.452
  577   HG22  VAL  76          HG22      VAL  76   3.826 -11.160  -4.553
  578   HG23  VAL  76          HG23      VAL  76   4.591 -12.079  -5.869
  579    H    ALA  77           H        ALA  77   2.398 -11.395  -9.859
  580    HA   ALA  77           HA       ALA  77   1.741  -8.868 -11.167
  581    HB1  ALA  77           HB1      ALA  77   2.220 -10.876 -12.468
  582    HB2  ALA  77           HB2      ALA  77   0.867 -11.728 -11.711
  583    HB3  ALA  77           HB3      ALA  77   0.565 -10.326 -12.759
  584    H    LYS  78           H        LYS  78   0.010  -7.614 -10.904
  585    HA   LYS  78           HA       LYS  78  -2.351  -8.556  -9.319
  586    HB2  LYS  78           HB2      LYS  78  -1.239  -5.732  -9.452
  587    HB3  LYS  78           HB3      LYS  78  -2.508  -6.321  -8.392
  588    HG2  LYS  78           HG2      LYS  78   0.431  -7.151  -8.242
  589    HG3  LYS  78           HG3      LYS  78  -0.319  -5.871  -7.311
  590    HD2  LYS  78           HD2      LYS  78  -1.816  -7.495  -6.203
  591    HD3  LYS  78           HD3      LYS  78  -1.147  -8.813  -7.188
  592    HE2  LYS  78           HE2      LYS  78   1.059  -8.529  -6.185
  593    HE3  LYS  78           HE3      LYS  78   0.526  -7.084  -5.322
  594    HZ1  LYS  78           HZ1      LYS  78  -0.498  -9.830  -4.782
  595    HZ2  LYS  78           HZ2      LYS  78   0.520  -8.948  -3.832
  596    HZ3  LYS  78           HZ3      LYS  78  -1.035  -8.472  -4.077
  597    H    LYS  79           H        LYS  79  -4.363  -7.880  -9.962
  598    HA   LYS  79           HA       LYS  79  -4.919  -6.340 -12.388
  599    HB2  LYS  79           HB2      LYS  79  -4.767  -9.340 -12.221
  600    HB3  LYS  79           HB3      LYS  79  -6.223  -8.729 -12.964
  601    HG2  LYS  79           HG2      LYS  79  -4.967  -7.515 -14.662
  602    HG3  LYS  79           HG3      LYS  79  -3.442  -7.850 -13.850
  603    HD2  LYS  79           HD2      LYS  79  -3.618  -9.310 -15.740
  604    HD3  LYS  79           HD3      LYS  79  -3.710 -10.265 -14.254
  605    HE2  LYS  79           HE2      LYS  79  -6.219 -10.274 -14.474
  606    HE3  LYS  79           HE3      LYS  79  -6.055  -9.389 -16.002
  607    HZ1  LYS  79           HZ1      LYS  79  -4.809 -11.268 -16.883
  608    HZ2  LYS  79           HZ2      LYS  79  -4.936 -12.085 -15.459
  609    HZ3  LYS  79           HZ3      LYS  79  -6.283 -11.768 -16.356
  610    HA   PRO  80           HA       PRO  80  -8.925  -6.002 -10.282
  611    HB2  PRO  80           HB2      PRO  80 -10.783  -7.356 -11.962
  612    HB3  PRO  80           HB3      PRO  80 -10.352  -5.619 -12.000
  613    HG2  PRO  80           HG2      PRO  80  -9.249  -7.892 -13.657
  614    HG3  PRO  80           HG3      PRO  80  -9.653  -6.216 -14.166
  615    HD2  PRO  80           HD2      PRO  80  -7.112  -6.897 -13.745
  616    HD3  PRO  80           HD3      PRO  80  -7.736  -5.343 -13.131
  617    H    GLY  81           H        GLY  81  -9.687  -7.068  -8.584
  618    HA2  GLY  81           HA2      GLY  81 -10.275  -8.767  -7.133
  619    HA3  GLY  81           HA3      GLY  81 -10.063  -9.975  -8.399
  620    H    SER  82           H        SER  82  -7.521  -7.604  -7.394
  621    HA   SER  82           HA       SER  82  -5.902  -9.883  -6.274
  622    HB2  SER  82           HB2      SER  82  -4.838  -7.420  -7.684
  623    HB3  SER  82           HB3      SER  82  -3.885  -8.692  -6.922
  624    HG   SER  82           HG       SER  82  -5.062 -10.152  -8.478
  625    H    THR  83           H        THR  83  -4.200  -8.980  -4.558
  626    HA   THR  83           HA       THR  83  -5.435  -6.687  -3.072
  627    HB   THR  83           HB       THR  83  -5.025  -7.776  -0.996
  628    HG1  THR  83           HG1      THR  83  -4.494 -10.251  -2.118
  629   HG21  THR  83          HG21      THR  83  -6.588  -9.582  -2.887
  630   HG22  THR  83          HG22      THR  83  -6.630  -9.688  -1.131
  631   HG23  THR  83          HG23      THR  83  -7.207  -8.226  -1.939
  632    H    VAL  84           H        VAL  84  -4.087  -5.323  -1.921
  633    HA   VAL  84           HA       VAL  84  -1.145  -5.725  -2.213
  634    HB   VAL  84           HB       VAL  84  -0.879  -3.299  -2.697
  635   HG11  VAL  84          HG11      VAL  84  -2.371  -4.874  -4.827
  636   HG12  VAL  84          HG12      VAL  84  -1.297  -3.486  -5.092
  637   HG13  VAL  84          HG13      VAL  84  -0.639  -5.000  -4.450
  638   HG21  VAL  84          HG21      VAL  84  -3.133  -2.486  -2.030
  639   HG22  VAL  84          HG22      VAL  84  -2.700  -2.019  -3.679
  640   HG23  VAL  84          HG23      VAL  84  -3.844  -3.350  -3.411
  641    H    ILE  85           H        ILE  85   0.154  -4.724  -0.755
  642    HA   ILE  85           HA       ILE  85  -1.093  -3.700   1.741
  643    HB   ILE  85           HB       ILE  85   1.226  -4.739   2.706
  644   HG12  ILE  85          HG12      ILE  85   1.407  -7.103   2.072
  645   HG13  ILE  85          HG13      ILE  85   0.236  -6.898   0.783
  646   HG21  ILE  85          HG21      ILE  85  -1.472  -6.126   2.539
  647   HG22  ILE  85          HG22      ILE  85  -0.176  -6.499   3.701
  648   HG23  ILE  85          HG23      ILE  85  -0.945  -4.922   3.741
  649   HD11  ILE  85          HD11      ILE  85   2.891  -5.404   0.865
  650   HD12  ILE  85          HD12      ILE  85   2.672  -6.983   0.082
  651   HD13  ILE  85          HD13      ILE  85   1.786  -5.577  -0.516
  652    H    ALA  86           H        ALA  86   0.065  -2.193   2.932
  653    HA   ALA  86           HA       ALA  86   1.261  -0.191   1.348
  654    HB1  ALA  86           HB1      ALA  86   0.021   0.256   3.417
  655    HB2  ALA  86           HB2      ALA  86   1.263  -0.587   4.373
  656    HB3  ALA  86           HB3      ALA  86   1.651   0.930   3.537
  657    H    GLY  87           H        GLY  87   3.362   0.373   0.869
  658    HA2  GLY  87           HA2      GLY  87   5.722   0.354   1.057
  659    HA3  GLY  87           HA3      GLY  87   5.637  -0.966   2.226
  660    H    SER  88           H        SER  88   3.656  -1.817  -0.367
  661    HA   SER  88           HA       SER  88   5.834  -3.302  -1.742
  662    HB2  SER  88           HB2      SER  88   4.143  -4.528  -2.905
  663    HB3  SER  88           HB3      SER  88   3.929  -4.633  -1.166
  664    HG   SER  88           HG       SER  88   2.218  -3.154  -1.307
  665    H    ILE  89           H        ILE  89   6.389  -2.968  -3.889
  666    HA   ILE  89           HA       ILE  89   5.781  -0.175  -4.755
  667    HB   ILE  89           HB       ILE  89   8.196  -1.735  -5.637
  668   HG12  ILE  89          HG12      ILE  89   8.312  -1.925  -3.221
  669   HG13  ILE  89          HG13      ILE  89   9.554  -0.882  -3.867
  670   HG21  ILE  89          HG21      ILE  89   9.126   0.611  -5.767
  671   HG22  ILE  89          HG22      ILE  89   7.777   0.296  -6.864
  672   HG23  ILE  89          HG23      ILE  89   7.507   1.220  -5.379
  673   HD11  ILE  89          HD11      ILE  89   8.462   1.099  -3.054
  674   HD12  ILE  89          HD12      ILE  89   7.006   0.185  -2.577
  675   HD13  ILE  89          HD13      ILE  89   8.544  -0.068  -1.731
  676    H    ASN  90           H        ASN  90   4.630   0.214  -6.525
  677    HA   ASN  90           HA       ASN  90   3.979  -1.860  -8.472
  678    HB2  ASN  90           HB2      ASN  90   2.353  -0.114  -7.747
  679    HB3  ASN  90           HB3      ASN  90   3.429   1.138  -8.348
  680   HD21  ASN  90          HD22      ASN  90   1.172   1.553  -9.374
  681   HD22  ASN  90          HD21      ASN  90   1.029   0.928 -11.002
  682    H    GLN  91           H        GLN  91   4.954  -2.318 -10.364
  683    HA   GLN  91           HA       GLN  91   7.352  -0.711 -11.105
  684    HB2  GLN  91           HB2      GLN  91   6.530  -3.513 -11.980
  685    HB3  GLN  91           HB3      GLN  91   8.110  -2.768 -12.197
  686    HG2  GLN  91           HG2      GLN  91   6.839  -3.423  -9.515
  687    HG3  GLN  91           HG3      GLN  91   7.952  -4.480 -10.366
  688   HE21  GLN  91          HE22      GLN  91   7.912  -2.412  -7.833
  689   HE22  GLN  91          HE21      GLN  91   9.584  -1.836  -7.924
  690    H    ASN  92           H        ASN  92   4.270  -1.804 -12.453
  691    HA   ASN  92           HA       ASN  92   5.288  -1.268 -15.200
  692    HB2  ASN  92           HB2      ASN  92   4.401  -3.537 -14.549
  693    HB3  ASN  92           HB3      ASN  92   2.796  -2.799 -14.446
  694   HD21  ASN  92          HD22      ASN  92   2.319  -4.516 -16.186
  695   HD22  ASN  92          HD21      ASN  92   2.708  -4.014 -17.835
  696    H    GLY  93           H        GLY  93   2.385  -0.304 -13.264
  697    HA2  GLY  93           HA2      GLY  93   1.929   2.013 -14.988
  698    HA3  GLY  93           HA3      GLY  93   1.022   0.626 -15.567
  699    H    SER  94           H        SER  94  -1.003   1.335 -15.280
  700    HA   SER  94           HA       SER  94  -1.815   2.753 -12.818
  701    HB2  SER  94           HB2      SER  94  -2.355   3.540 -15.190
  702    HB3  SER  94           HB3      SER  94  -3.511   2.198 -15.269
  703    HG   SER  94           HG       SER  94  -4.560   4.047 -14.556
  704    H    LEU  95           H        LEU  95  -3.726   2.182 -11.730
  705    HA   LEU  95           HA       LEU  95  -5.092  -0.234 -11.902
  706    HB2  LEU  95           HB2      LEU  95  -3.167  -0.067  -9.555
  707    HB3  LEU  95           HB3      LEU  95  -4.593  -1.075  -9.533
  708    HG   LEU  95           HG       LEU  95  -2.192  -1.419 -11.365
  709   HD11  LEU  95          HD11      LEU  95  -1.635  -1.930  -9.065
  710   HD12  LEU  95          HD12      LEU  95  -3.127  -2.866  -8.850
  711   HD13  LEU  95          HD13      LEU  95  -1.855  -3.462  -9.929
  712   HD21  LEU  95          HD21      LEU  95  -4.694  -3.118 -10.963
  713   HD22  LEU  95          HD22      LEU  95  -4.209  -2.258 -12.420
  714   HD23  LEU  95          HD23      LEU  95  -3.249  -3.636 -11.853
  715    H    LEU  96           H        LEU  96  -6.885  -0.291 -10.500
  716    HA   LEU  96           HA       LEU  96  -7.347   2.174  -8.855
  717    HB2  LEU  96           HB2      LEU  96  -8.754   1.714 -11.002
  718    HB3  LEU  96           HB3      LEU  96  -9.466   0.401 -10.054
  719    HG   LEU  96           HG       LEU  96 -10.167   2.105  -8.345
  720   HD11  LEU  96          HD11      LEU  96  -9.239   4.017 -10.544
  721   HD12  LEU  96          HD12      LEU  96 -10.298   4.490  -9.202
  722   HD13  LEU  96          HD13      LEU  96  -8.649   3.955  -8.863
  723   HD21  LEU  96          HD21      LEU  96 -11.727   1.228 -10.027
  724   HD22  LEU  96          HD22      LEU  96 -12.056   2.938  -9.720
  725   HD23  LEU  96          HD23      LEU  96 -11.189   2.456 -11.194
  726    H    ILE  97           H        ILE  97  -7.374   1.814  -6.706
  727    HA   ILE  97           HA       ILE  97  -7.950  -0.937  -5.692
  728    HB   ILE  97           HB       ILE  97  -5.970   1.071  -4.552
  729   HG12  ILE  97          HG12      ILE  97  -4.298  -0.825  -5.415
  730   HG13  ILE  97          HG13      ILE  97  -5.538  -1.077  -6.639
  731   HG21  ILE  97          HG21      ILE  97  -6.286  -1.917  -4.047
  732   HG22  ILE  97          HG22      ILE  97  -5.134  -0.821  -3.262
  733   HG23  ILE  97          HG23      ILE  97  -6.855  -0.632  -2.956
  734   HD11  ILE  97          HD11      ILE  97  -5.244   1.253  -7.416
  735   HD12  ILE  97          HD12      ILE  97  -4.186   1.598  -6.038
  736   HD13  ILE  97          HD13      ILE  97  -3.675   0.457  -7.298
  737    H    CYS  98           H        CYS  98  -9.398  -1.140  -4.049
  738    HA   CYS  98           HA       CYS  98 -10.505   1.326  -2.787
  739    HB2  CYS  98           HB2      CYS  98 -12.160  -0.263  -3.636
  740    HB3  CYS  98           HB3      CYS  98 -11.456  -1.557  -2.655
  741    HG   CYS  98           HG       CYS  98 -12.534   1.382  -1.512
  742    H    ALA  99           H        ALA  99  -9.779   1.983  -0.873
  743    HA   ALA  99           HA       ALA  99  -7.751   0.427   0.599
  744    HB1  ALA  99           HB1      ALA  99  -9.002   3.173   1.057
  745    HB2  ALA  99           HB2      ALA  99  -7.679   2.474   2.009
  746    HB3  ALA  99           HB3      ALA  99  -7.434   2.836   0.286
  747    H    THR 100           H        THR 100  -8.268  -0.967   2.172
  748    HA   THR 100           HA       THR 100 -11.081  -0.929   3.252
  749    HB   THR 100           HB       THR 100 -10.359  -2.708   1.596
  750    HG1  THR 100           HG1      THR 100 -11.264  -4.407   2.942
  751   HG21  THR 100          HG21      THR 100  -8.084  -3.101   2.799
  752   HG22  THR 100          HG22      THR 100  -9.032  -4.066   3.948
  753   HG23  THR 100          HG23      THR 100  -8.994  -4.501   2.226
  754    H    HIS 101           H        HIS 101  -8.036  -0.273   4.303
  755    HA   HIS 101           HA       HIS 101  -8.861  -0.475   7.128
  756    HB2  HIS 101           HB2      HIS 101  -6.309  -1.568   5.864
  757    HB3  HIS 101           HB3      HIS 101  -6.460  -1.234   7.577
  758    HD1  HIS 101           HD1      HIS 101  -6.832  -4.049   5.321
  759    HD2  HIS 101           HD2      HIS 101  -8.825  -2.560   8.721
  760    HE1  HIS 101           HE1      HIS 101  -8.174  -6.006   6.291
  761    H    VAL 102           H        VAL 102  -7.919   1.141   8.435
  762    HA   VAL 102           HA       VAL 102  -6.570   3.406   7.065
  763    HB   VAL 102           HB       VAL 102  -6.607   4.478   9.339
  764   HG11  VAL 102          HG11      VAL 102  -9.209   3.620   8.057
  765   HG12  VAL 102          HG12      VAL 102  -9.013   4.997   9.176
  766   HG13  VAL 102          HG13      VAL 102  -8.197   5.001   7.601
  767   HG21  VAL 102          HG21      VAL 102  -6.884   2.344  10.685
  768   HG22  VAL 102          HG22      VAL 102  -8.007   3.663  11.075
  769   HG23  VAL 102          HG23      VAL 102  -8.564   2.305  10.096
  770    H    GLY 103           H        GLY 103  -4.655   4.484   8.396
  771    HA2  GLY 103           HA2      GLY 103  -2.457   2.733   7.816
  772    HA3  GLY 103           HA3      GLY 103  -2.398   4.324   8.553
  773    H    ALA 104           H        ALA 104  -4.027   3.663  10.901
  774    HA   ALA 104           HA       ALA 104  -2.101   2.471  12.651
  775    HB1  ALA 104           HB1      ALA 104  -3.754   4.142  13.341
  776    HB2  ALA 104           HB2      ALA 104  -5.083   3.010  12.983
  777    HB3  ALA 104           HB3      ALA 104  -3.944   2.667  14.303
  778    H    ASP 105           H        ASP 105  -4.575   0.964  10.708
  779    HA   ASP 105           HA       ASP 105  -4.646  -1.568  12.252
  780    HB2  ASP 105           HB2      ASP 105  -6.636  -0.725  11.030
  781    HB3  ASP 105           HB3      ASP 105  -5.745  -0.881   9.522
  782    H    THR 106           H        THR 106  -2.445  -0.103  10.035
  783    HA   THR 106           HA       THR 106  -2.061  -2.443   8.349
  784    HB   THR 106           HB       THR 106  -0.225  -1.298   7.273
  785    HG1  THR 106           HG1      THR 106  -0.680   0.802   9.105
  786   HG21  THR 106          HG21      THR 106  -1.411   0.658   6.360
  787   HG22  THR 106          HG22      THR 106  -2.428  -0.796   6.419
  788   HG23  THR 106          HG23      THR 106  -2.654   0.485   7.619
  789    H    THR 107           H        THR 107  -0.413  -3.892   8.292
  790    HA   THR 107           HA       THR 107   0.445  -4.615  10.907
  791    HB   THR 107           HB       THR 107  -0.195  -6.115   8.976
  792    HG1  THR 107           HG1      THR 107   0.473  -6.893  10.869
  793   HG21  THR 107          HG21      THR 107   1.588  -7.064   7.624
  794   HG22  THR 107          HG22      THR 107   1.405  -5.340   7.270
  795   HG23  THR 107          HG23      THR 107   2.762  -5.908   8.280
  796    H    LEU 108           H        LEU 108   2.068  -2.612   8.633
  797    HA   LEU 108           HA       LEU 108   4.770  -3.186   9.139
  798    HB2  LEU 108           HB2      LEU 108   3.348  -0.587   8.397
  799    HB3  LEU 108           HB3      LEU 108   5.095  -0.722   8.506
  800    HG   LEU 108           HG       LEU 108   5.091  -2.464   6.716
  801   HD11  LEU 108          HD11      LEU 108   2.134  -1.764   6.502
  802   HD12  LEU 108          HD12      LEU 108   3.074  -2.592   5.238
  803   HD13  LEU 108          HD13      LEU 108   2.848  -3.382   6.782
  804   HD21  LEU 108          HD21      LEU 108   5.478  -0.074   6.272
  805   HD22  LEU 108          HD22      LEU 108   4.653  -0.856   4.914
  806   HD23  LEU 108          HD23      LEU 108   3.727   0.168   6.036
  807    H    SER 109           H        SER 109   2.757  -0.721  10.808
  808    HA   SER 109           HA       SER 109   4.802  -0.155  12.806
  809    HB2  SER 109           HB2      SER 109   3.090   1.258  13.851
  810    HB3  SER 109           HB3      SER 109   3.319   1.605  12.131
  811    HG   SER 109           HG       SER 109   1.244   1.432  12.120
  812    H    GLN 110           H        GLN 110   2.427  -2.602  12.447
  813    HA   GLN 110           HA       GLN 110   2.095  -3.223  15.265
  814    HB2  GLN 110           HB2      GLN 110   0.452  -3.828  13.415
  815    HB3  GLN 110           HB3      GLN 110   1.565  -5.078  12.925
  816    HG2  GLN 110           HG2      GLN 110   0.011  -6.168  14.279
  817    HG3  GLN 110           HG3      GLN 110   1.456  -6.041  15.272
  818   HE21  GLN 110          HE22      GLN 110  -1.702  -4.489  14.549
  819   HE22  GLN 110          HE21      GLN 110  -1.799  -3.649  16.087
  820    H    ILE 111           H        ILE 111   4.109  -4.467  12.608
  821    HA   ILE 111           HA       ILE 111   5.398  -6.598  13.940
  822    HB   ILE 111           HB       ILE 111   6.234  -4.829  11.615
  823   HG12  ILE 111          HG12      ILE 111   5.381  -7.755  11.576
  824   HG13  ILE 111          HG13      ILE 111   4.198  -6.461  11.518
  825   HG21  ILE 111          HG21      ILE 111   7.604  -7.392  12.552
  826   HG22  ILE 111          HG22      ILE 111   7.938  -6.550  11.030
  827   HG23  ILE 111          HG23      ILE 111   8.327  -5.764  12.544
  828   HD11  ILE 111          HD11      ILE 111   6.388  -6.925   9.456
  829   HD12  ILE 111          HD12      ILE 111   4.655  -7.218   9.271
  830   HD13  ILE 111          HD13      ILE 111   5.249  -5.556   9.458
  831    H    VAL 112           H        VAL 112   6.756  -3.282  13.463
  832    HA   VAL 112           HA       VAL 112   9.080  -3.726  14.887
  833    HB   VAL 112           HB       VAL 112   9.342  -1.290  15.021
  834   HG11  VAL 112          HG11      VAL 112   9.282  -0.863  12.630
  835   HG12  VAL 112          HG12      VAL 112   9.815  -2.527  12.916
  836   HG13  VAL 112          HG13      VAL 112   8.155  -2.204  12.369
  837   HG21  VAL 112          HG21      VAL 112   7.655   0.213  14.057
  838   HG22  VAL 112          HG22      VAL 112   6.507  -1.130  13.911
  839   HG23  VAL 112          HG23      VAL 112   7.031  -0.569  15.517
  840    H    LYS 113           H        LYS 113   6.046  -3.359  16.388
  841    HA   LYS 113           HA       LYS 113   7.000  -2.549  19.047
  842    HB2  LYS 113           HB2      LYS 113   4.504  -4.002  18.121
  843    HB3  LYS 113           HB3      LYS 113   4.765  -3.418  19.764
  844    HG2  LYS 113           HG2      LYS 113   4.516  -1.158  19.160
  845    HG3  LYS 113           HG3      LYS 113   4.898  -1.465  17.472
  846    HD2  LYS 113           HD2      LYS 113   2.575  -1.018  17.559
  847    HD3  LYS 113           HD3      LYS 113   2.806  -2.721  17.170
  848    HE2  LYS 113           HE2      LYS 113   2.371  -3.379  19.455
  849    HE3  LYS 113           HE3      LYS 113   2.315  -1.683  19.961
  850    HZ1  LYS 113           HZ1      LYS 113   0.340  -1.371  18.631
  851    HZ2  LYS 113           HZ2      LYS 113   0.420  -2.899  18.014
  852    HZ3  LYS 113           HZ3      LYS 113   0.070  -2.684  19.602
  853    H    LEU 114           H        LEU 114   6.556  -5.650  17.307
  854    HA   LEU 114           HA       LEU 114   7.113  -7.335  19.670
  855    HB2  LEU 114           HB2      LEU 114   5.419  -7.628  17.564
  856    HB3  LEU 114           HB3      LEU 114   6.866  -8.322  16.831
  857    HG   LEU 114           HG       LEU 114   5.464  -9.225  19.374
  858   HD11  LEU 114          HD11      LEU 114   4.908 -11.223  18.049
  859   HD12  LEU 114          HD12      LEU 114   4.266  -9.763  17.284
  860   HD13  LEU 114          HD13      LEU 114   5.730 -10.534  16.633
  861   HD21  LEU 114          HD21      LEU 114   7.811  -9.712  19.650
  862   HD22  LEU 114          HD22      LEU 114   7.010 -11.209  19.181
  863   HD23  LEU 114          HD23      LEU 114   7.942 -10.303  17.965
  864    H    VAL 115           H        VAL 115   8.545  -6.576  16.463
  865    HA   VAL 115           HA       VAL 115  10.899  -8.062  16.972
  866    HB   VAL 115           HB       VAL 115  10.557  -5.824  14.957
  867   HG11  VAL 115          HG11      VAL 115  12.580  -8.112  15.153
  868   HG12  VAL 115          HG12      VAL 115  12.340  -7.111  13.711
  869   HG13  VAL 115          HG13      VAL 115  12.949  -6.375  15.187
  870   HG21  VAL 115          HG21      VAL 115   8.882  -7.639  14.669
  871   HG22  VAL 115          HG22      VAL 115  10.090  -7.685  13.385
  872   HG23  VAL 115          HG23      VAL 115  10.179  -8.849  14.722
  873    H    GLU 116           H        GLU 116  10.223  -4.748  18.074
  874    HA   GLU 116           HA       GLU 116  12.852  -3.982  18.814
  875    HB2  GLU 116           HB2      GLU 116  10.944  -2.529  19.207
  876    HB3  GLU 116           HB3      GLU 116  10.240  -3.684  20.353
  877    HG2  GLU 116           HG2      GLU 116  12.105  -3.346  21.909
  878    HG3  GLU 116           HG3      GLU 116  12.959  -2.361  20.713
  879    H    GLU 117           H        GLU 117  10.768  -6.583  20.265
  880    HA   GLU 117           HA       GLU 117  12.465  -6.908  22.576
  881    HB2  GLU 117           HB2      GLU 117  10.148  -8.584  21.533
  882    HB3  GLU 117           HB3      GLU 117  10.908  -8.645  23.138
  883    HG2  GLU 117           HG2      GLU 117  10.256  -6.011  23.078
  884    HG3  GLU 117           HG3      GLU 117   9.054  -6.594  21.933
  885    H    ALA 118           H        ALA 118  13.116  -7.613  19.447
  886    HA   ALA 118           HA       ALA 118  14.284 -10.316  19.772
  887    HB1  ALA 118           HB1      ALA 118  14.353  -8.487  17.348
  888    HB2  ALA 118           HB2      ALA 118  14.790 -10.197  17.428
  889    HB3  ALA 118           HB3      ALA 118  13.093  -9.715  17.638
  890    H    GLN 119           H        GLN 119  15.107  -6.922  19.926
  891    HA   GLN 119           HA       GLN 119  17.983  -7.257  19.454
  892    HB2  GLN 119           HB2      GLN 119  16.168  -4.901  20.055
  893    HB3  GLN 119           HB3      GLN 119  17.901  -4.755  20.175
  894    HG2  GLN 119           HG2      GLN 119  17.314  -4.016  18.006
  895    HG3  GLN 119           HG3      GLN 119  18.165  -5.569  17.821
  896   HE21  GLN 119          HE22      GLN 119  14.969  -4.080  18.093
  897   HE22  GLN 119          HE21      GLN 119  14.164  -5.492  17.416
  Start of MODEL   24
    1    H    SER   1           H        SER   1  17.270  -5.464  14.554
    2    HA   SER   1           HA       SER   1  15.560  -3.464  15.979
    3    HB2  SER   1           HB2      SER   1  18.529  -3.964  16.304
    4    HB3  SER   1           HB3      SER   1  17.492  -2.968  17.331
    5    HG   SER   1           HG       SER   1  18.060  -5.532  17.531
    6    H    GLU   2           H        GLU   2  18.366  -3.633  13.761
    7    HA   GLU   2           HA       GLU   2  18.575  -0.759  13.347
    8    HB2  GLU   2           HB2      GLU   2  20.473  -2.301  13.188
    9    HB3  GLU   2           HB3      GLU   2  19.720  -3.165  11.851
   10    HG2  GLU   2           HG2      GLU   2  20.057  -1.383  10.341
   11    HG3  GLU   2           HG3      GLU   2  20.259  -0.204  11.637
   12    H    ALA   3           H        ALA   3  17.119  -3.469  11.600
   13    HA   ALA   3           HA       ALA   3  16.002  -1.916   9.440
   14    HB1  ALA   3           HB1      ALA   3  14.819  -4.007   8.910
   15    HB2  ALA   3           HB2      ALA   3  16.522  -4.325   9.294
   16    HB3  ALA   3           HB3      ALA   3  15.257  -4.677  10.496
   17    H    LEU   4           H        LEU   4  14.950  -1.960  12.719
   18    HA   LEU   4           HA       LEU   4  12.202  -2.418  12.418
   19    HB2  LEU   4           HB2      LEU   4  13.425  -2.421  14.598
   20    HB3  LEU   4           HB3      LEU   4  13.548  -0.678  14.518
   21    HG   LEU   4           HG       LEU   4  11.081  -0.461  14.602
   22   HD11  LEU   4          HD11      LEU   4  11.248  -3.472  14.899
   23   HD12  LEU   4          HD12      LEU   4   9.799  -2.521  15.307
   24   HD13  LEU   4          HD13      LEU   4  10.383  -2.571  13.635
   25   HD21  LEU   4          HD21      LEU   4  12.423  -0.406  16.674
   26   HD22  LEU   4          HD22      LEU   4  10.802  -1.072  16.917
   27   HD23  LEU   4          HD23      LEU   4  12.204  -2.163  16.845
   28    H    ALA   5           H        ALA   5  13.873   0.872  12.167
   29    HA   ALA   5           HA       ALA   5  11.385   2.220  11.733
   30    HB1  ALA   5           HB1      ALA   5  14.293   2.937  11.147
   31    HB2  ALA   5           HB2      ALA   5  12.910   4.051  11.139
   32    HB3  ALA   5           HB3      ALA   5  13.408   3.286  12.650
   33    H    LYS   6           H        LYS   6  13.210   0.093   9.583
   34    HA   LYS   6           HA       LYS   6  12.988   1.871   7.277
   35    HB2  LYS   6           HB2      LYS   6  14.894   0.273   7.623
   36    HB3  LYS   6           HB3      LYS   6  13.789  -1.060   7.226
   37    HG2  LYS   6           HG2      LYS   6  13.347  -0.076   5.026
   38    HG3  LYS   6           HG3      LYS   6  14.250   1.385   5.451
   39    HD2  LYS   6           HD2      LYS   6  16.334   0.007   5.599
   40    HD3  LYS   6           HD3      LYS   6  15.407  -1.399   5.021
   41    HE2  LYS   6           HE2      LYS   6  14.789  -0.124   2.963
   42    HE3  LYS   6           HE3      LYS   6  15.693   1.273   3.553
   43    HZ1  LYS   6           HZ1      LYS   6  16.852  -1.373   2.858
   44    HZ2  LYS   6           HZ2      LYS   6  17.017   0.022   1.995
   45    HZ3  LYS   6           HZ3      LYS   6  17.707  -0.108   3.488
   46    H    LEU   7           H        LEU   7  11.298  -1.074   8.369
   47    HA   LEU   7           HA       LEU   7   9.401  -1.452   6.349
   48    HB2  LEU   7           HB2      LEU   7   9.232  -1.615   9.389
   49    HB3  LEU   7           HB3      LEU   7   7.838  -1.983   8.400
   50    HG   LEU   7           HG       LEU   7   9.059  -3.963   9.200
   51   HD11  LEU   7          HD11      LEU   7   8.912  -3.652   6.179
   52   HD12  LEU   7          HD12      LEU   7   9.042  -5.192   7.051
   53   HD13  LEU   7          HD13      LEU   7   7.620  -4.173   7.286
   54   HD21  LEU   7          HD21      LEU   7  11.133  -4.700   8.204
   55   HD22  LEU   7          HD22      LEU   7  11.258  -3.226   7.234
   56   HD23  LEU   7          HD23      LEU   7  11.385  -3.151   9.015
   57    H    ILE   8           H        ILE   8   9.088   0.797   9.076
   58    HA   ILE   8           HA       ILE   8   6.675   2.063   8.089
   59    HB   ILE   8           HB       ILE   8   8.648   2.846  10.252
   60   HG12  ILE   8          HG12      ILE   8   7.489   0.761  10.736
   61   HG13  ILE   8          HG13      ILE   8   6.935   2.034  11.809
   62   HG21  ILE   8          HG21      ILE   8   5.940   4.091   9.649
   63   HG22  ILE   8          HG22      ILE   8   6.891   4.346  11.126
   64   HG23  ILE   8          HG23      ILE   8   7.522   4.890   9.575
   65   HD11  ILE   8          HD11      ILE   8   5.407   0.892   9.422
   66   HD12  ILE   8          HD12      ILE   8   5.056   0.647  11.133
   67   HD13  ILE   8          HD13      ILE   8   4.844   2.249  10.428
   68    H    SER   9           H        SER   9  10.067   2.667   7.412
   69    HA   SER   9           HA       SER   9   9.666   5.412   6.491
   70    HB2  SER   9           HB2      SER   9  12.032   3.538   6.138
   71    HB3  SER   9           HB3      SER   9  11.988   5.261   5.755
   72    HG   SER   9           HG       SER   9  11.601   4.064   8.308
   73    H    LEU  10           H        LEU  10   9.546   2.172   5.017
   74    HA   LEU  10           HA       LEU  10   9.454   3.113   2.265
   75    HB2  LEU  10           HB2      LEU  10   8.623   0.528   3.648
   76    HB3  LEU  10           HB3      LEU  10   8.152   0.872   1.998
   77    HG   LEU  10           HG       LEU  10  10.639   1.213   1.445
   78   HD11  LEU  10          HD11      LEU  10  10.847  -0.384   4.033
   79   HD12  LEU  10          HD12      LEU  10  12.157  -0.176   2.841
   80   HD13  LEU  10          HD13      LEU  10  11.551   1.231   3.719
   81   HD21  LEU  10          HD21      LEU  10   9.371  -0.664   0.622
   82   HD22  LEU  10          HD22      LEU  10  10.914  -1.280   1.202
   83   HD23  LEU  10          HD23      LEU  10   9.441  -1.488   2.192
   84    H    GLN  11           H        GLN  11   7.054   3.229   4.854
   85    HA   GLN  11           HA       GLN  11   4.739   3.137   3.094
   86    HB2  GLN  11           HB2      GLN  11   5.005   4.236   5.891
   87    HB3  GLN  11           HB3      GLN  11   3.517   4.118   4.941
   88    HG2  GLN  11           HG2      GLN  11   3.999   1.611   4.715
   89    HG3  GLN  11           HG3      GLN  11   5.193   1.829   6.007
   90   HE21  GLN  11          HE22      GLN  11   4.144   3.279   7.971
   91   HE22  GLN  11          HE21      GLN  11   2.545   2.687   8.379
   92    H    ALA  12           H        ALA  12   3.745   4.705   1.989
   93    HA   ALA  12           HA       ALA  12   5.097   7.129   1.377
   94    HB1  ALA  12           HB1      ALA  12   3.674   5.888  -0.204
   95    HB2  ALA  12           HB2      ALA  12   2.247   6.263   0.794
   96    HB3  ALA  12           HB3      ALA  12   3.132   7.568  -0.023
   97    H    THR  13           H        THR  13   4.548   9.258   1.721
   98    HA   THR  13           HA       THR  13   3.308   9.955   4.297
   99    HB   THR  13           HB       THR  13   4.067  12.292   3.486
  100    HG1  THR  13           HG1      THR  13   5.221  12.431   1.764
  101   HG21  THR  13          HG21      THR  13   5.384  10.931   5.120
  102   HG22  THR  13          HG22      THR  13   6.194  10.112   3.765
  103   HG23  THR  13          HG23      THR  13   6.435  11.854   4.028
  104    H    GLU  14           H        GLU  14   2.384  10.022   0.913
  105    HA   GLU  14           HA       GLU  14  -0.109  11.481   1.623
  106    HB2  GLU  14           HB2      GLU  14   0.039  12.781  -0.384
  107    HB3  GLU  14           HB3      GLU  14   1.463  13.056   0.604
  108    HG2  GLU  14           HG2      GLU  14   1.367  11.225  -1.832
  109    HG3  GLU  14           HG3      GLU  14   1.845  12.921  -1.857
  110    H    ALA  15           H        ALA  15  -1.901  11.187   0.181
  111    HA   ALA  15           HA       ALA  15  -1.844   8.815  -1.594
  112    HB1  ALA  15           HB1      ALA  15  -3.782   9.090   0.744
  113    HB2  ALA  15           HB2      ALA  15  -3.804   7.814  -0.496
  114    HB3  ALA  15           HB3      ALA  15  -2.441   7.924   0.635
  115    H    THR  16           H        THR  16  -3.576   8.703  -3.066
  116    HA   THR  16           HA       THR  16  -5.126  11.252  -3.432
  117    HB   THR  16           HB       THR  16  -4.256   9.286  -5.564
  118    HG1  THR  16           HG1      THR  16  -3.049  11.278  -6.133
  119   HG21  THR  16          HG21      THR  16  -5.559  12.047  -5.754
  120   HG22  THR  16          HG22      THR  16  -5.023  11.037  -7.119
  121   HG23  THR  16          HG23      THR  16  -6.370  10.507  -6.118
  122    H    ILE  17           H        ILE  17  -7.147  11.120  -2.829
  123    HA   ILE  17           HA       ILE  17  -8.628   8.547  -2.789
  124    HB   ILE  17           HB       ILE  17  -9.397  11.302  -1.710
  125   HG12  ILE  17          HG12      ILE  17  -8.218   8.939  -0.181
  126   HG13  ILE  17          HG13      ILE  17  -7.400  10.460  -0.517
  127   HG21  ILE  17          HG21      ILE  17 -11.347   9.872  -2.161
  128   HG22  ILE  17          HG22      ILE  17 -10.612   8.539  -1.249
  129   HG23  ILE  17          HG23      ILE  17 -11.128  10.038  -0.443
  130   HD11  ILE  17          HD11      ILE  17  -9.807  10.076   1.301
  131   HD12  ILE  17          HD12      ILE  17  -8.161  10.489   1.758
  132   HD13  ILE  17          HD13      ILE  17  -9.132  11.659   0.839
  133    H    VAL  18           H        VAL  18 -10.369   8.134  -4.233
  134    HA   VAL  18           HA       VAL  18 -11.192  10.412  -5.997
  135    HB   VAL  18           HB       VAL  18 -12.453   8.674  -7.270
  136   HG11  VAL  18          HG11      VAL  18  -9.427   8.691  -7.258
  137   HG12  VAL  18          HG12      VAL  18 -10.431   7.998  -8.562
  138   HG13  VAL  18          HG13      VAL  18 -10.548   9.706  -8.182
  139   HG21  VAL  18          HG21      VAL  18 -12.263   6.762  -5.665
  140   HG22  VAL  18          HG22      VAL  18 -11.629   6.392  -7.271
  141   HG23  VAL  18          HG23      VAL  18 -10.502   6.746  -5.947
  142    H    THR  19           H        THR  19 -12.771  11.565  -5.264
  143    HA   THR  19           HA       THR  19 -14.541  10.625  -3.151
  144    HB   THR  19           HB       THR  19 -14.507  13.234  -4.707
  145    HG1  THR  19           HG1      THR  19 -12.743  13.233  -3.554
  146   HG21  THR  19          HG21      THR  19 -15.898  12.495  -2.097
  147   HG22  THR  19          HG22      THR  19 -15.725  14.138  -2.744
  148   HG23  THR  19          HG23      THR  19 -16.695  12.943  -3.612
  149    H    LEU  20           H        LEU  20 -16.697  10.146  -3.223
  150    HA   LEU  20           HA       LEU  20 -17.997   9.871  -5.867
  151    HB2  LEU  20           HB2      LEU  20 -18.525   7.676  -3.906
  152    HB3  LEU  20           HB3      LEU  20 -18.805   7.792  -5.595
  153    HG   LEU  20           HG       LEU  20 -15.990   7.579  -4.446
  154   HD11  LEU  20          HD11      LEU  20 -17.667   5.328  -5.621
  155   HD12  LEU  20          HD12      LEU  20 -16.001   5.239  -5.022
  156   HD13  LEU  20          HD13      LEU  20 -17.323   5.561  -3.901
  157   HD21  LEU  20          HD21      LEU  20 -16.145   8.498  -6.773
  158   HD22  LEU  20          HD22      LEU  20 -15.350   6.929  -6.712
  159   HD23  LEU  20          HD23      LEU  20 -17.034   7.044  -7.266
  160    H    ASP  21           H        ASP  21 -18.552  12.044  -4.853
  161    HA   ASP  21           HA       ASP  21 -20.474  12.092  -2.646
  162    HB2  ASP  21           HB2      ASP  21 -18.811  14.004  -3.740
  163    HB3  ASP  21           HB3      ASP  21 -20.323  14.379  -4.536
  164    H    SER  22           H        SER  22 -20.629  11.038  -5.680
  165    HA   SER  22           HA       SER  22 -23.525  11.191  -6.022
  166    HB2  SER  22           HB2      SER  22 -21.639  11.867  -8.319
  167    HB3  SER  22           HB3      SER  22 -23.398  11.739  -8.389
  168    HG   SER  22           HG       SER  22 -23.451  13.458  -6.808
  169    H    ASP  23           H        ASP  23 -24.069   9.313  -6.208
  170    HA   ASP  23           HA       ASP  23 -23.591   7.043  -5.742
  171    HB2  ASP  23           HB2      ASP  23 -25.696   7.749  -6.805
  172    HB3  ASP  23           HB3      ASP  23 -25.017   7.433  -8.392
  173    H    ASN  24           H        ASN  24 -21.300   6.804  -5.895
  174    HA   ASN  24           HA       ASN  24 -19.320   6.205  -6.747
  175    HB2  ASN  24           HB2      ASN  24 -19.175   3.875  -7.522
  176    HB3  ASN  24           HB3      ASN  24 -20.204   4.083  -6.122
  177   HD21  ASN  24          HD22      ASN  24 -22.285   3.364  -6.248
  178   HD22  ASN  24          HD21      ASN  24 -22.868   2.510  -7.671
  179    H    ILE  25           H        ILE  25 -20.938   7.934  -8.681
  180    HA   ILE  25           HA       ILE  25 -19.511   7.416 -11.178
  181    HB   ILE  25           HB       ILE  25 -21.232   9.265 -11.848
  182   HG12  ILE  25          HG12      ILE  25 -22.707   8.460  -9.401
  183   HG13  ILE  25          HG13      ILE  25 -21.859   9.994  -9.655
  184   HG21  ILE  25          HG21      ILE  25 -22.016   6.432 -11.087
  185   HG22  ILE  25          HG22      ILE  25 -22.918   7.453 -12.227
  186   HG23  ILE  25          HG23      ILE  25 -21.273   6.956 -12.606
  187   HD11  ILE  25          HD11      ILE  25 -24.237   8.966 -11.227
  188   HD12  ILE  25          HD12      ILE  25 -24.214  10.295 -10.069
  189   HD13  ILE  25          HD13      ILE  25 -23.339  10.453 -11.604
  190    H    LEU  26           H        LEU  26 -19.559   9.811  -8.590
  191    HA   LEU  26           HA       LEU  26 -18.824  12.025 -10.089
  192    HB2  LEU  26           HB2      LEU  26 -19.549  12.179  -7.763
  193    HB3  LEU  26           HB3      LEU  26 -18.049  11.436  -7.227
  194    HG   LEU  26           HG       LEU  26 -16.763  13.383  -8.071
  195   HD11  LEU  26          HD11      LEU  26 -17.994  15.474  -8.642
  196   HD12  LEU  26          HD12      LEU  26 -18.286  14.214  -9.845
  197   HD13  LEU  26          HD13      LEU  26 -19.521  14.571  -8.615
  198   HD21  LEU  26          HD21      LEU  26 -17.457  14.974  -6.380
  199   HD22  LEU  26          HD22      LEU  26 -19.012  14.140  -6.235
  200   HD23  LEU  26          HD23      LEU  26 -17.490  13.321  -5.759
  201    H    LEU  27           H        LEU  27 -16.249  10.000  -8.318
  202    HA   LEU  27           HA       LEU  27 -14.152   9.739  -8.668
  203    HB2  LEU  27           HB2      LEU  27 -15.051   9.770 -11.553
  204    HB3  LEU  27           HB3      LEU  27 -13.365   9.568 -11.105
  205    HG   LEU  27           HG       LEU  27 -14.024   7.619  -9.634
  206   HD11  LEU  27          HD11      LEU  27 -16.084   6.402 -10.246
  207   HD12  LEU  27          HD12      LEU  27 -16.482   7.948  -9.504
  208   HD13  LEU  27          HD13      LEU  27 -16.593   7.756 -11.268
  209   HD21  LEU  27          HD21      LEU  27 -12.923   7.341 -11.794
  210   HD22  LEU  27          HD22      LEU  27 -14.156   6.085 -11.590
  211   HD23  LEU  27          HD23      LEU  27 -14.476   7.481 -12.640
  212    H    SER  28           H        SER  28 -14.575  12.098  -7.687
  213    HA   SER  28           HA       SER  28 -12.949  14.111  -9.197
  214    HB2  SER  28           HB2      SER  28 -15.025  15.024  -8.440
  215    HB3  SER  28           HB3      SER  28 -14.811  14.343  -6.816
  216    HG   SER  28           HG       SER  28 -14.112  16.715  -7.614
  217    H    GLU  29           H        GLU  29 -10.760  13.697  -8.853
  218    HA   GLU  29           HA       GLU  29  -9.967  12.322  -6.535
  219    HB2  GLU  29           HB2      GLU  29  -8.012  13.661  -8.373
  220    HB3  GLU  29           HB3      GLU  29  -7.868  12.187  -7.416
  221    HG2  GLU  29           HG2      GLU  29  -8.240  11.113  -9.352
  222    HG3  GLU  29           HG3      GLU  29  -9.930  11.470  -9.035
  223    H    GLU  30           H        GLU  30  -8.997  12.870  -4.703
  224    HA   GLU  30           HA       GLU  30  -8.152  15.702  -4.122
  225    HB2  GLU  30           HB2      GLU  30  -9.242  13.685  -2.132
  226    HB3  GLU  30           HB3      GLU  30  -8.939  15.387  -1.855
  227    HG2  GLU  30           HG2      GLU  30 -11.090  14.273  -3.716
  228    HG3  GLU  30           HG3      GLU  30 -11.320  14.610  -2.018
  229    H    GLN  31           H        GLN  31  -5.830  15.834  -3.552
  230    HA   GLN  31           HA       GLN  31  -4.505  13.373  -2.747
  231    HB2  GLN  31           HB2      GLN  31  -3.574  14.260  -4.525
  232    HB3  GLN  31           HB3      GLN  31  -3.728  15.942  -4.057
  233    HG2  GLN  31           HG2      GLN  31  -1.951  15.934  -2.683
  234    HG3  GLN  31           HG3      GLN  31  -2.169  14.226  -2.223
  235   HE21  GLN  31          HE21      GLN  31  -1.815  15.856  -5.391
  236   HE22  GLN  31          HE22      GLN  31  -0.971  14.475  -6.006
  237    H    VAL  32           H        VAL  32  -3.907  13.079  -0.751
  238    HA   VAL  32           HA       VAL  32  -4.235  15.186   1.372
  239    HB   VAL  32           HB       VAL  32  -5.348  13.580   2.773
  240   HG11  VAL  32          HG11      VAL  32  -6.791  13.650   0.105
  241   HG12  VAL  32          HG12      VAL  32  -7.505  13.384   1.707
  242   HG13  VAL  32          HG13      VAL  32  -6.773  14.944   1.327
  243   HG21  VAL  32          HG21      VAL  32  -4.356  11.448   1.876
  244   HG22  VAL  32          HG22      VAL  32  -6.099  11.397   2.101
  245   HG23  VAL  32          HG23      VAL  32  -5.432  11.598   0.470
  246    H    ASP  33           H        ASP  33  -3.384  14.501   3.492
  247    HA   ASP  33           HA       ASP  33  -0.778  13.067   3.329
  248    HB2  ASP  33           HB2      ASP  33  -0.920  15.076   4.748
  249    HB3  ASP  33           HB3      ASP  33  -2.177  14.314   5.723
  250    H    VAL  34           H        VAL  34  -0.381  11.098   4.384
  251    HA   VAL  34           HA       VAL  34  -2.459   9.186   4.222
  252    HB   VAL  34           HB       VAL  34  -0.038   8.871   3.831
  253   HG11  VAL  34          HG11      VAL  34   0.210   8.537   6.843
  254   HG12  VAL  34          HG12      VAL  34   1.485   8.436   5.616
  255   HG13  VAL  34          HG13      VAL  34   0.732   9.984   5.950
  256   HG21  VAL  34          HG21      VAL  34  -1.602   6.935   3.986
  257   HG22  VAL  34          HG22      VAL  34   0.070   6.570   4.428
  258   HG23  VAL  34          HG23      VAL  34  -1.150   6.750   5.696
  259    H    GLU  35           H        GLU  35  -1.973  11.284   6.904
  260    HA   GLU  35           HA       GLU  35  -3.303   9.586   8.894
  261    HB2  GLU  35           HB2      GLU  35  -1.859  11.491   9.459
  262    HB3  GLU  35           HB3      GLU  35  -2.985  12.608   8.681
  263    HG2  GLU  35           HG2      GLU  35  -4.709  12.119  10.334
  264    HG3  GLU  35           HG3      GLU  35  -3.737  10.816  11.028
  265    H    LEU  36           H        LEU  36  -4.373  11.735   6.318
  266    HA   LEU  36           HA       LEU  36  -7.061  12.102   7.405
  267    HB2  LEU  36           HB2      LEU  36  -5.909  13.099   4.801
  268    HB3  LEU  36           HB3      LEU  36  -7.268  13.770   5.696
  269    HG   LEU  36           HG       LEU  36  -4.332  13.849   6.528
  270   HD11  LEU  36          HD11      LEU  36  -4.958  15.370   4.679
  271   HD12  LEU  36          HD12      LEU  36  -6.230  16.072   5.702
  272   HD13  LEU  36          HD13      LEU  36  -4.518  16.237   6.158
  273   HD21  LEU  36          HD21      LEU  36  -5.727  13.707   8.546
  274   HD22  LEU  36          HD22      LEU  36  -5.101  15.345   8.350
  275   HD23  LEU  36          HD23      LEU  36  -6.790  14.981   7.917
  276    H    VAL  37           H        VAL  37  -5.876   9.587   5.814
  277    HA   VAL  37           HA       VAL  37  -8.306   9.007   4.193
  278    HB   VAL  37           HB       VAL  37  -6.252   8.820   2.961
  279   HG11  VAL  37          HG11      VAL  37  -4.552   7.141   3.389
  280   HG12  VAL  37          HG12      VAL  37  -4.658   8.245   4.760
  281   HG13  VAL  37          HG13      VAL  37  -5.374   6.617   4.868
  282   HG21  VAL  37          HG21      VAL  37  -8.080   7.329   2.393
  283   HG22  VAL  37          HG22      VAL  37  -6.512   6.559   2.088
  284   HG23  VAL  37          HG23      VAL  37  -7.465   6.081   3.504
  285    H    GLN  38           H        GLN  38  -9.650   7.400   4.691
  286    HA   GLN  38           HA       GLN  38  -9.270   5.916   7.259
  287    HB2  GLN  38           HB2      GLN  38 -11.635   5.957   7.596
  288    HB3  GLN  38           HB3      GLN  38 -11.066   7.601   7.389
  289    HG2  GLN  38           HG2      GLN  38 -12.183   7.850   5.329
  290    HG3  GLN  38           HG3      GLN  38 -12.205   6.125   4.985
  291   HE21  GLN  38          HE22      GLN  38 -13.683   8.573   7.053
  292   HE22  GLN  38          HE21      GLN  38 -15.061   7.544   7.441
  293    H    ARG  39           H        ARG  39 -10.510   3.788   7.317
  294    HA   ARG  39           HA       ARG  39  -9.691   2.183   5.063
  295    HB2  ARG  39           HB2      ARG  39 -10.488   0.335   6.244
  296    HB3  ARG  39           HB3      ARG  39  -9.849   1.439   7.462
  297    HG2  ARG  39           HG2      ARG  39 -12.307   2.194   7.774
  298    HG3  ARG  39           HG3      ARG  39 -12.741   0.807   6.760
  299    HD2  ARG  39           HD2      ARG  39 -11.591  -0.714   8.378
  300    HD3  ARG  39           HD3      ARG  39 -11.148   0.693   9.343
  301    HE   ARG  39           HE       ARG  39 -13.202   0.556  10.353
  302   HH11  ARG  39          HH11      ARG  39 -13.579  -1.345   7.412
  303   HH12  ARG  39          HH12      ARG  39 -15.309  -1.494   7.700
  304   HH21  ARG  39          HH21      ARG  39 -15.401   0.283  10.581
  305   HH22  ARG  39          HH22      ARG  39 -16.174  -0.890   9.520
  306    H    GLY  40           H        GLY  40 -12.529   4.023   5.392
  307    HA2  GLY  40           HA2      GLY  40 -14.055   2.495   3.373
  308    HA3  GLY  40           HA3      GLY  40 -14.586   3.930   4.241
  309    H    ASP  41           H        ASP  41 -11.468   4.542   2.917
  310    HA   ASP  41           HA       ASP  41 -12.668   6.048   0.659
  311    HB2  ASP  41           HB2      ASP  41  -9.921   6.055   1.932
  312    HB3  ASP  41           HB3      ASP  41 -10.354   7.013   0.518
  313    H    ILE  42           H        ILE  42 -11.797   6.006  -1.453
  314    HA   ILE  42           HA       ILE  42 -10.642   3.390  -2.341
  315    HB   ILE  42           HB       ILE  42 -12.387   5.330  -3.858
  316   HG12  ILE  42          HG12      ILE  42 -13.724   4.132  -2.199
  317   HG13  ILE  42          HG13      ILE  42 -14.092   3.621  -3.831
  318   HG21  ILE  42          HG21      ILE  42 -11.143   2.666  -4.660
  319   HG22  ILE  42          HG22      ILE  42 -12.406   3.513  -5.588
  320   HG23  ILE  42          HG23      ILE  42 -10.819   4.256  -5.372
  321   HD11  ILE  42          HD11      ILE  42 -14.093   1.741  -2.261
  322   HD12  ILE  42          HD12      ILE  42 -12.855   1.535  -3.509
  323   HD13  ILE  42          HD13      ILE  42 -12.398   2.047  -1.859
  324    H    ILE  43           H        ILE  43  -8.521   3.520  -2.992
  325    HA   ILE  43           HA       ILE  43  -7.409   6.172  -3.626
  326    HB   ILE  43           HB       ILE  43  -6.124   3.666  -2.476
  327   HG12  ILE  43          HG12      ILE  43  -7.788   4.352  -0.860
  328   HG13  ILE  43          HG13      ILE  43  -6.184   4.698  -0.260
  329   HG21  ILE  43          HG21      ILE  43  -5.127   6.535  -2.624
  330   HG22  ILE  43          HG22      ILE  43  -4.353   5.246  -1.684
  331   HG23  ILE  43          HG23      ILE  43  -4.449   5.114  -3.439
  332   HD11  ILE  43          HD11      ILE  43  -7.996   6.803  -1.521
  333   HD12  ILE  43          HD12      ILE  43  -7.870   6.485   0.200
  334   HD13  ILE  43          HD13      ILE  43  -6.452   7.085  -0.688
  335    H    LYS  44           H        LYS  44  -6.397   6.558  -5.519
  336    HA   LYS  44           HA       LYS  44  -5.758   4.304  -7.331
  337    HB2  LYS  44           HB2      LYS  44  -5.408   7.222  -8.001
  338    HB3  LYS  44           HB3      LYS  44  -5.704   5.863  -9.076
  339    HG2  LYS  44           HG2      LYS  44  -7.654   7.197  -7.177
  340    HG3  LYS  44           HG3      LYS  44  -7.656   7.293  -8.928
  341    HD2  LYS  44           HD2      LYS  44  -8.192   4.749  -7.326
  342    HD3  LYS  44           HD3      LYS  44  -9.437   5.810  -7.950
  343    HE2  LYS  44           HE2      LYS  44  -7.417   4.376  -9.725
  344    HE3  LYS  44           HE3      LYS  44  -9.006   3.765  -9.308
  345    HZ1  LYS  44           HZ1      LYS  44  -8.653   6.390 -10.633
  346    HZ2  LYS  44           HZ2      LYS  44  -8.893   4.976 -11.434
  347    HZ3  LYS  44           HZ3      LYS  44 -10.047   5.551 -10.408
  348    H    VAL  45           H        VAL  45  -3.807   3.827  -8.233
  349    HA   VAL  45           HA       VAL  45  -1.398   5.244  -7.160
  350    HB   VAL  45           HB       VAL  45  -1.892   2.949  -6.247
  351   HG11  VAL  45          HG11      VAL  45  -0.894   1.958  -8.950
  352   HG12  VAL  45          HG12      VAL  45  -1.245   0.986  -7.514
  353   HG13  VAL  45          HG13      VAL  45  -2.562   1.830  -8.348
  354   HG21  VAL  45          HG21      VAL  45   0.787   3.320  -7.666
  355   HG22  VAL  45          HG22      VAL  45   0.341   4.001  -6.083
  356   HG23  VAL  45          HG23      VAL  45   0.463   2.247  -6.290
  357    H    VAL  46           H        VAL  46   0.119   5.982  -8.547
  358    HA   VAL  46           HA       VAL  46  -0.488   5.932 -11.389
  359    HB   VAL  46           HB       VAL  46   1.410   7.437 -11.668
  360   HG11  VAL  46          HG11      VAL  46  -0.779   8.316 -10.913
  361   HG12  VAL  46          HG12      VAL  46  -0.177   8.264  -9.239
  362   HG13  VAL  46          HG13      VAL  46   0.609   9.305 -10.433
  363   HG21  VAL  46          HG21      VAL  46   3.030   6.549 -10.083
  364   HG22  VAL  46          HG22      VAL  46   2.717   8.255  -9.774
  365   HG23  VAL  46          HG23      VAL  46   1.994   7.036  -8.717
  366    HA   PRO  47           HA       PRO  47   2.518   2.877 -12.789
  367    HB2  PRO  47           HB2      PRO  47   3.486   4.632 -14.958
  368    HB3  PRO  47           HB3      PRO  47   2.620   3.082 -15.078
  369    HG2  PRO  47           HG2      PRO  47   1.454   5.492 -15.741
  370    HG3  PRO  47           HG3      PRO  47   0.525   4.131 -15.052
  371    HD2  PRO  47           HD2      PRO  47   1.651   6.536 -13.638
  372    HD3  PRO  47           HD3      PRO  47   0.031   5.799 -13.482
  373    H    GLY  48           H        GLY  48   4.420   2.578 -11.698
  374    HA2  GLY  48           HA2      GLY  48   6.589   3.011 -10.909
  375    HA3  GLY  48           HA3      GLY  48   6.486   4.675 -11.458
  376    H    GLY  49           H        GLY  49   3.644   4.268  -9.744
  377    HA2  GLY  49           HA2      GLY  49   4.556   5.751  -7.477
  378    HA3  GLY  49           HA3      GLY  49   2.938   5.114  -7.745
  379    H    LYS  50           H        LYS  50   3.560   5.191  -5.241
  380    HA   LYS  50           HA       LYS  50   4.335   2.398  -4.439
  381    HB2  LYS  50           HB2      LYS  50   4.725   4.921  -2.794
  382    HB3  LYS  50           HB3      LYS  50   5.198   3.270  -2.353
  383    HG2  LYS  50           HG2      LYS  50   6.746   3.232  -4.333
  384    HG3  LYS  50           HG3      LYS  50   6.310   4.912  -4.653
  385    HD2  LYS  50           HD2      LYS  50   7.108   5.468  -2.302
  386    HD3  LYS  50           HD3      LYS  50   7.792   3.833  -2.225
  387    HE2  LYS  50           HE2      LYS  50   9.217   4.290  -4.174
  388    HE3  LYS  50           HE3      LYS  50   8.407   5.840  -4.432
  389    HZ1  LYS  50           HZ1      LYS  50  10.492   6.229  -3.305
  390    HZ2  LYS  50           HZ2      LYS  50   9.279   6.591  -2.267
  391    HZ3  LYS  50           HZ3      LYS  50  10.098   5.208  -2.079
  392    H    PHE  51           H        PHE  51   3.191   1.344  -2.883
  393    HA   PHE  51           HA       PHE  51   0.376   2.108  -2.701
  394    HB2  PHE  51           HB2      PHE  51   1.891  -0.338  -1.785
  395    HB3  PHE  51           HB3      PHE  51   0.179  -0.098  -1.484
  396    HD1  PHE  51           HD1      PHE  51   2.703  -0.699  -4.137
  397    HD2  PHE  51           HD2      PHE  51  -1.486  -0.255  -3.270
  398    HE1  PHE  51           HE1      PHE  51   2.165  -1.642  -6.346
  399    HE2  PHE  51           HE2      PHE  51  -2.028  -1.214  -5.505
  400    HZ   PHE  51           HZ       PHE  51  -0.203  -1.890  -7.051
  401    HA   PRO  52           HA       PRO  52   1.171   3.992   1.290
  402    HB2  PRO  52           HB2      PRO  52  -1.065   5.486   1.584
  403    HB3  PRO  52           HB3      PRO  52   0.100   5.783   0.261
  404    HG2  PRO  52           HG2      PRO  52  -2.495   4.234   0.118
  405    HG3  PRO  52           HG3      PRO  52  -1.893   5.506  -0.989
  406    HD2  PRO  52           HD2      PRO  52  -1.587   2.806  -1.475
  407    HD3  PRO  52           HD3      PRO  52  -0.424   4.045  -2.029
  408    H    VAL  53           H        VAL  53  -1.419   1.654   1.001
  409    HA   VAL  53           HA       VAL  53  -1.521   1.146   3.863
  410    HB   VAL  53           HB       VAL  53  -4.063   1.117   3.855
  411   HG11  VAL  53          HG11      VAL  53  -2.777   3.870   3.824
  412   HG12  VAL  53          HG12      VAL  53  -4.253   3.367   4.675
  413   HG13  VAL  53          HG13      VAL  53  -2.683   2.712   5.163
  414   HG21  VAL  53          HG21      VAL  53  -5.259   2.670   2.473
  415   HG22  VAL  53          HG22      VAL  53  -3.769   3.240   1.708
  416   HG23  VAL  53          HG23      VAL  53  -4.355   1.583   1.396
  417    H    ASP  54           H        ASP  54  -3.009  -0.882   4.227
  418    HA   ASP  54           HA       ASP  54  -2.553  -2.698   1.938
  419    HB2  ASP  54           HB2      ASP  54  -2.380  -4.513   3.220
  420    HB3  ASP  54           HB3      ASP  54  -1.536  -3.287   4.133
  421    H    GLY  55           H        GLY  55  -4.088  -4.000   1.008
  422    HA2  GLY  55           HA2      GLY  55  -6.833  -4.102   1.555
  423    HA3  GLY  55           HA3      GLY  55  -6.585  -2.610   0.650
  424    H    ARG  56           H        ARG  56  -8.085  -3.673  -0.720
  425    HA   ARG  56           HA       ARG  56  -7.031  -5.856  -2.476
  426    HB2  ARG  56           HB2      ARG  56  -9.079  -6.178  -1.009
  427    HB3  ARG  56           HB3      ARG  56  -9.933  -5.063  -2.073
  428    HG2  ARG  56           HG2      ARG  56  -9.546  -6.610  -3.992
  429    HG3  ARG  56           HG3      ARG  56  -8.584  -7.657  -2.933
  430    HD2  ARG  56           HD2      ARG  56 -10.674  -8.688  -3.030
  431    HD3  ARG  56           HD3      ARG  56 -10.614  -7.928  -1.454
  432    HE   ARG  56           HE       ARG  56 -12.256  -6.349  -2.107
  433   HH11  ARG  56          HH11      ARG  56 -12.043  -8.940  -4.436
  434   HH12  ARG  56          HH12      ARG  56 -13.381  -8.338  -5.328
  435   HH21  ARG  56          HH21      ARG  56 -13.858  -5.519  -3.472
  436   HH22  ARG  56          HH22      ARG  56 -14.241  -6.414  -4.930
  437    H    VAL  57           H        VAL  57  -7.181  -5.807  -4.693
  438    HA   VAL  57           HA       VAL  57  -7.319  -3.077  -5.909
  439    HB   VAL  57           HB       VAL  57  -5.637  -5.424  -6.850
  440   HG11  VAL  57          HG11      VAL  57  -6.118  -3.724  -8.582
  441   HG12  VAL  57          HG12      VAL  57  -5.524  -2.445  -7.498
  442   HG13  VAL  57          HG13      VAL  57  -4.423  -3.695  -8.111
  443   HG21  VAL  57          HG21      VAL  57  -4.820  -3.107  -5.060
  444   HG22  VAL  57          HG22      VAL  57  -4.741  -4.840  -4.685
  445   HG23  VAL  57          HG23      VAL  57  -3.681  -4.164  -5.922
  446    H    ILE  58           H        ILE  58  -8.725  -2.785  -7.563
  447    HA   ILE  58           HA       ILE  58  -9.882  -5.166  -8.956
  448    HB   ILE  58           HB       ILE  58 -12.183  -4.272  -8.566
  449   HG12  ILE  58          HG12      ILE  58 -10.850  -2.638  -6.363
  450   HG13  ILE  58          HG13      ILE  58 -11.416  -1.966  -7.903
  451   HG21  ILE  58          HG21      ILE  58 -11.203  -6.210  -7.327
  452   HG22  ILE  58          HG22      ILE  58 -10.771  -5.097  -6.007
  453   HG23  ILE  58          HG23      ILE  58 -12.468  -5.346  -6.459
  454   HD11  ILE  58          HD11      ILE  58 -13.729  -2.661  -7.373
  455   HD12  ILE  58          HD12      ILE  58 -13.178  -3.249  -5.782
  456   HD13  ILE  58          HD13      ILE  58 -13.058  -1.528  -6.188
  457    H    GLU  59           H        GLU  59  -8.063  -3.147 -10.023
  458    HA   GLU  59           HA       GLU  59  -9.387  -3.050 -12.556
  459    HB2  GLU  59           HB2      GLU  59 -10.092  -0.841 -11.177
  460    HB3  GLU  59           HB3      GLU  59  -8.476  -0.318 -11.617
  461    HG2  GLU  59           HG2      GLU  59  -9.991   0.525 -13.218
  462    HG3  GLU  59           HG3      GLU  59  -9.097  -0.755 -14.044
  463    H    GLY  60           H        GLY  60  -7.869  -3.112 -14.212
  464    HA2  GLY  60           HA2      GLY  60  -5.955  -2.476 -15.378
  465    HA3  GLY  60           HA3      GLY  60  -5.260  -1.802 -13.918
  466    H    HIS  61           H        HIS  61  -3.346  -2.751 -14.820
  467    HA   HIS  61           HA       HIS  61  -2.722  -5.210 -13.410
  468    HB2  HIS  61           HB2      HIS  61  -1.783  -6.511 -15.270
  469    HB3  HIS  61           HB3      HIS  61  -3.521  -6.393 -15.251
  470    HD1  HIS  61           HD1      HIS  61  -3.181  -7.297 -17.797
  471    HD2  HIS  61           HD2      HIS  61  -2.085  -3.316 -16.997
  472    HE1  HIS  61           HE1      HIS  61  -2.955  -6.142 -20.058
  473    H    SER  62           H        SER  62  -0.813  -5.215 -12.603
  474    HA   SER  62           HA       SER  62   1.512  -4.070 -13.965
  475    HB2  SER  62           HB2      SER  62   0.468  -2.810 -11.419
  476    HB3  SER  62           HB3      SER  62   2.158  -2.700 -11.847
  477    HG   SER  62           HG       SER  62   0.098  -2.047 -13.684
  478    H    MET  63           H        MET  63   3.580  -4.358 -12.748
  479    HA   MET  63           HA       MET  63   3.481  -6.869 -11.150
  480    HB2  MET  63           HB2      MET  63   4.524  -7.209 -13.285
  481    HB3  MET  63           HB3      MET  63   5.605  -5.832 -13.044
  482    HG2  MET  63           HG2      MET  63   6.817  -6.891 -11.370
  483    HG3  MET  63           HG3      MET  63   5.558  -8.092 -11.036
  484    HE1  MET  63           HE1      MET  63   5.956 -10.756 -13.749
  485    HE2  MET  63           HE2      MET  63   5.365 -10.399 -12.111
  486    HE3  MET  63           HE3      MET  63   4.707  -9.520 -13.516
  487    H    VAL  64           H        VAL  64   4.021  -6.695  -9.145
  488    HA   VAL  64           HA       VAL  64   4.976  -4.085  -8.097
  489    HB   VAL  64           HB       VAL  64   3.025  -6.153  -7.041
  490   HG11  VAL  64          HG11      VAL  64   3.923  -3.626  -5.610
  491   HG12  VAL  64          HG12      VAL  64   2.556  -4.654  -5.144
  492   HG13  VAL  64          HG13      VAL  64   4.194  -5.301  -5.067
  493   HG21  VAL  64          HG21      VAL  64   2.088  -4.669  -8.739
  494   HG22  VAL  64          HG22      VAL  64   1.457  -4.179  -7.159
  495   HG23  VAL  64          HG23      VAL  64   2.756  -3.248  -7.922
  496    H    ASP  65           H        ASP  65   6.459  -3.884  -6.435
  497    HA   ASP  65           HA       ASP  65   8.186  -6.230  -5.933
  498    HB2  ASP  65           HB2      ASP  65   9.113  -4.178  -6.938
  499    HB3  ASP  65           HB3      ASP  65   8.564  -3.234  -5.554
  500    H    GLU  66           H        GLU  66   7.164  -7.371  -4.292
  501    HA   GLU  66           HA       GLU  66   6.373  -6.021  -1.766
  502    HB2  GLU  66           HB2      GLU  66   6.237  -8.974  -2.460
  503    HB3  GLU  66           HB3      GLU  66   5.462  -8.128  -1.111
  504    HG2  GLU  66           HG2      GLU  66   4.036  -6.905  -2.753
  505    HG3  GLU  66           HG3      GLU  66   4.710  -7.913  -4.039
  506    H    SER  67           H        SER  67   9.126  -7.485  -3.041
  507    HA   SER  67           HA       SER  67  10.217  -9.304  -1.525
  508    HB2  SER  67           HB2      SER  67  11.344  -8.244  -3.423
  509    HB3  SER  67           HB3      SER  67  11.789  -6.864  -2.413
  510    HG   SER  67           HG       SER  67  13.486  -8.271  -2.530
  511    H    LEU  68           H        LEU  68  10.535  -5.909  -0.275
  512    HA   LEU  68           HA       LEU  68  12.007  -6.906   2.055
  513    HB2  LEU  68           HB2      LEU  68  12.366  -4.690   1.014
  514    HB3  LEU  68           HB3      LEU  68  10.724  -4.204   1.366
  515    HG   LEU  68           HG       LEU  68  12.512  -3.153   2.723
  516   HD11  LEU  68          HD11      LEU  68  10.615  -4.629   4.559
  517   HD12  LEU  68          HD12      LEU  68  11.354  -3.038   4.761
  518   HD13  LEU  68          HD13      LEU  68  10.126  -3.281   3.511
  519   HD21  LEU  68          HD21      LEU  68  13.974  -5.101   3.081
  520   HD22  LEU  68          HD22      LEU  68  13.536  -4.297   4.598
  521   HD23  LEU  68          HD23      LEU  68  12.749  -5.825   4.152
  522    H    ILE  69           H        ILE  69   8.634  -6.315   1.356
  523    HA   ILE  69           HA       ILE  69   7.713  -6.207   4.122
  524    HB   ILE  69           HB       ILE  69   6.055  -6.759   1.629
  525   HG12  ILE  69          HG12      ILE  69   7.349  -4.753   1.088
  526   HG13  ILE  69          HG13      ILE  69   5.644  -4.429   1.272
  527   HG21  ILE  69          HG21      ILE  69   5.450  -5.657   4.390
  528   HG22  ILE  69          HG22      ILE  69   4.330  -5.501   3.029
  529   HG23  ILE  69          HG23      ILE  69   4.789  -7.106   3.612
  530   HD11  ILE  69          HD11      ILE  69   7.677  -3.855   3.464
  531   HD12  ILE  69          HD12      ILE  69   7.103  -2.675   2.263
  532   HD13  ILE  69          HD13      ILE  69   5.959  -3.384   3.404
  533    H    THR  70           H        THR  70   7.501  -8.581   1.475
  534    HA   THR  70           HA       THR  70   6.581 -10.707   3.329
  535    HB   THR  70           HB       THR  70   5.856 -11.802   1.241
  536    HG1  THR  70           HG1      THR  70   6.012 -10.505  -0.651
  537   HG21  THR  70          HG21      THR  70   5.009  -8.865   1.359
  538   HG22  THR  70          HG22      THR  70   4.142 -10.172   0.552
  539   HG23  THR  70          HG23      THR  70   4.313 -10.191   2.315
  540    H    GLY  71           H        GLY  71   9.489  -9.891   1.727
  541    HA2  GLY  71           HA2      GLY  71  11.519 -10.950   1.837
  542    HA3  GLY  71           HA3      GLY  71  10.762 -12.436   2.434
  543    H    GLU  72           H        GLU  72   9.043 -11.545  -0.265
  544    HA   GLU  72           HA       GLU  72   9.522 -13.781  -1.759
  545    HB2  GLU  72           HB2      GLU  72   8.629 -11.024  -2.642
  546    HB3  GLU  72           HB3      GLU  72   8.729 -12.344  -3.798
  547    HG2  GLU  72           HG2      GLU  72   7.122 -12.585  -1.244
  548    HG3  GLU  72           HG3      GLU  72   6.454 -11.899  -2.726
  549    H    ALA  73           H        ALA  73  11.097 -10.677  -2.751
  550    HA   ALA  73           HA       ALA  73  13.021 -10.214  -3.803
  551    HB1  ALA  73           HB1      ALA  73  14.111 -11.315  -1.944
  552    HB2  ALA  73           HB2      ALA  73  14.026 -12.870  -2.795
  553    HB3  ALA  73           HB3      ALA  73  15.019 -11.544  -3.449
  554    H    MET  74           H        MET  74  10.878 -11.307  -5.107
  555    HA   MET  74           HA       MET  74  11.877 -11.196  -7.765
  556    HB2  MET  74           HB2      MET  74  12.161 -13.569  -7.661
  557    HB3  MET  74           HB3      MET  74  10.685 -13.781  -6.735
  558    HG2  MET  74           HG2      MET  74   9.345 -13.094  -8.698
  559    HG3  MET  74           HG3      MET  74  10.826 -13.006  -9.658
  560    HE1  MET  74           HE1      MET  74  12.556 -15.491  -8.942
  561    HE2  MET  74           HE2      MET  74  11.879 -16.759  -9.985
  562    HE3  MET  74           HE3      MET  74  12.100 -15.118 -10.619
  563    HA   PRO  75           HA       PRO  75   8.151  -8.906  -7.237
  564    HB2  PRO  75           HB2      PRO  75   7.618  -7.979  -9.706
  565    HB3  PRO  75           HB3      PRO  75   9.069  -7.508  -8.788
  566    HG2  PRO  75           HG2      PRO  75   8.859  -9.691 -10.901
  567    HG3  PRO  75           HG3      PRO  75  10.048  -8.347 -10.829
  568    HD2  PRO  75           HD2      PRO  75  10.632 -10.818  -9.848
  569    HD3  PRO  75           HD3      PRO  75  11.182  -9.341  -9.001
  570    H    VAL  76           H        VAL  76   5.915  -8.656  -7.800
  571    HA   VAL  76           HA       VAL  76   4.613 -11.292  -8.402
  572    HB   VAL  76           HB       VAL  76   3.764  -9.106  -6.455
  573   HG11  VAL  76          HG11      VAL  76   2.712 -11.915  -6.958
  574   HG12  VAL  76          HG12      VAL  76   2.234 -10.877  -5.597
  575   HG13  VAL  76          HG13      VAL  76   1.839 -10.397  -7.247
  576   HG21  VAL  76          HG21      VAL  76   5.768 -10.114  -5.567
  577   HG22  VAL  76          HG22      VAL  76   4.409 -10.848  -4.719
  578   HG23  VAL  76          HG23      VAL  76   5.223 -11.742  -6.016
  579    H    ALA  77           H        ALA  77   2.942 -11.409  -9.912
  580    HA   ALA  77           HA       ALA  77   2.275  -8.967 -11.381
  581    HB1  ALA  77           HB1      ALA  77   1.398 -11.866 -11.716
  582    HB2  ALA  77           HB2      ALA  77   1.128 -10.542 -12.867
  583    HB3  ALA  77           HB3      ALA  77   2.777 -11.099 -12.535
  584    H    LYS  78           H        LYS  78   0.405  -7.885 -11.308
  585    HA   LYS  78           HA       LYS  78  -1.828  -8.813  -9.529
  586    HB2  LYS  78           HB2      LYS  78  -0.952  -5.955 -10.074
  587    HB3  LYS  78           HB3      LYS  78  -2.185  -6.472  -8.933
  588    HG2  LYS  78           HG2      LYS  78   0.794  -7.119  -8.676
  589    HG3  LYS  78           HG3      LYS  78  -0.018  -5.755  -7.933
  590    HD2  LYS  78           HD2      LYS  78  -1.436  -7.267  -6.595
  591    HD3  LYS  78           HD3      LYS  78  -0.710  -8.683  -7.384
  592    HE2  LYS  78           HE2      LYS  78   1.500  -8.082  -6.466
  593    HE3  LYS  78           HE3      LYS  78   0.814  -6.640  -5.705
  594    HZ1  LYS  78           HZ1      LYS  78   0.025  -9.436  -5.057
  595    HZ2  LYS  78           HZ2      LYS  78   1.005  -8.516  -4.126
  596    HZ3  LYS  78           HZ3      LYS  78  -0.580  -8.122  -4.324
  597    H    LYS  79           H        LYS  79  -3.932  -8.192 -10.040
  598    HA   LYS  79           HA       LYS  79  -4.767  -7.202 -12.677
  599    HB2  LYS  79           HB2      LYS  79  -5.155 -10.074 -11.677
  600    HB3  LYS  79           HB3      LYS  79  -6.251  -9.359 -12.829
  601    HG2  LYS  79           HG2      LYS  79  -4.281  -8.888 -14.350
  602    HG3  LYS  79           HG3      LYS  79  -3.280  -9.794 -13.208
  603    HD2  LYS  79           HD2      LYS  79  -3.871 -11.193 -15.074
  604    HD3  LYS  79           HD3      LYS  79  -4.600 -11.825 -13.595
  605    HE2  LYS  79           HE2      LYS  79  -6.790 -11.018 -14.218
  606    HE3  LYS  79           HE3      LYS  79  -6.123 -10.053 -15.554
  607    HZ1  LYS  79           HZ1      LYS  79  -5.563 -12.005 -16.722
  608    HZ2  LYS  79           HZ2      LYS  79  -5.891 -13.001 -15.464
  609    HZ3  LYS  79           HZ3      LYS  79  -7.129 -12.230 -16.241
  610    HA   PRO  80           HA       PRO  80  -8.334  -6.138 -10.056
  611    HB2  PRO  80           HB2      PRO  80 -10.591  -6.985 -11.421
  612    HB3  PRO  80           HB3      PRO  80  -9.658  -5.512 -11.834
  613    HG2  PRO  80           HG2      PRO  80  -9.369  -8.275 -13.071
  614    HG3  PRO  80           HG3      PRO  80  -9.602  -6.704 -13.914
  615    HD2  PRO  80           HD2      PRO  80  -7.125  -7.655 -13.647
  616    HD3  PRO  80           HD3      PRO  80  -7.448  -5.944 -13.274
  617    H    GLY  81           H        GLY  81  -9.295  -7.147  -8.326
  618    HA2  GLY  81           HA2      GLY  81 -10.008  -8.875  -6.923
  619    HA3  GLY  81           HA3      GLY  81  -9.891 -10.039  -8.248
  620    H    SER  82           H        SER  82  -7.439  -7.769  -6.841
  621    HA   SER  82           HA       SER  82  -5.723 -10.078  -6.039
  622    HB2  SER  82           HB2      SER  82  -5.030  -9.038  -8.193
  623    HB3  SER  82           HB3      SER  82  -4.828  -7.490  -7.356
  624    HG   SER  82           HG       SER  82  -3.393  -9.918  -7.044
  625    H    THR  83           H        THR  83  -3.925  -9.207  -4.442
  626    HA   THR  83           HA       THR  83  -5.071  -7.141  -2.614
  627    HB   THR  83           HB       THR  83  -4.320  -8.602  -0.710
  628    HG1  THR  83           HG1      THR  83  -4.474 -10.657  -2.674
  629   HG21  THR  83          HG21      THR  83  -6.338  -9.986  -0.703
  630   HG22  THR  83          HG22      THR  83  -6.706  -8.357  -1.286
  631   HG23  THR  83          HG23      THR  83  -6.580  -9.703  -2.440
  632    H    VAL  84           H        VAL  84  -3.653  -6.005  -1.303
  633    HA   VAL  84           HA       VAL  84  -0.743  -6.252  -1.838
  634    HB   VAL  84           HB       VAL  84  -0.598  -3.783  -2.229
  635   HG11  VAL  84          HG11      VAL  84  -2.172  -5.286  -4.342
  636   HG12  VAL  84          HG12      VAL  84  -1.144  -3.860  -4.583
  637   HG13  VAL  84          HG13      VAL  84  -0.419  -5.391  -4.069
  638   HG21  VAL  84          HG21      VAL  84  -2.796  -3.071  -1.354
  639   HG22  VAL  84          HG22      VAL  84  -2.557  -2.550  -3.028
  640   HG23  VAL  84          HG23      VAL  84  -3.609  -3.930  -2.676
  641    H    ILE  85           H        ILE  85   0.607  -5.009  -0.550
  642    HA   ILE  85           HA       ILE  85  -0.424  -3.980   2.023
  643    HB   ILE  85           HB       ILE  85   2.203  -4.625   2.626
  644   HG12  ILE  85          HG12      ILE  85   2.456  -7.043   2.303
  645   HG13  ILE  85          HG13      ILE  85   1.066  -7.085   1.226
  646   HG21  ILE  85          HG21      ILE  85  -0.299  -6.205   3.270
  647   HG22  ILE  85          HG22      ILE  85   1.247  -6.234   4.151
  648   HG23  ILE  85          HG23      ILE  85   0.308  -4.750   4.114
  649   HD11  ILE  85          HD11      ILE  85   3.592  -5.452   0.721
  650   HD12  ILE  85          HD12      ILE  85   3.322  -7.092   0.089
  651   HD13  ILE  85          HD13      ILE  85   2.288  -5.758  -0.439
  652    H    ALA  86           H        ALA  86   0.728  -2.286   2.968
  653    HA   ALA  86           HA       ALA  86   1.525  -0.286   1.111
  654    HB1  ALA  86           HB1      ALA  86   0.385   0.128   3.309
  655    HB2  ALA  86           HB2      ALA  86   1.866  -0.350   4.149
  656    HB3  ALA  86           HB3      ALA  86   1.856   1.096   3.119
  657    H    GLY  87           H        GLY  87   3.508   0.821   0.892
  658    HA2  GLY  87           HA2      GLY  87   5.850   1.057   0.876
  659    HA3  GLY  87           HA3      GLY  87   6.017  -0.350   1.934
  660    H    SER  88           H        SER  88   4.005  -1.227  -0.634
  661    HA   SER  88           HA       SER  88   6.194  -2.500  -2.148
  662    HB2  SER  88           HB2      SER  88   3.277  -2.598  -2.912
  663    HB3  SER  88           HB3      SER  88   4.603  -3.719  -3.309
  664    HG   SER  88           HG       SER  88   3.199  -3.409  -0.885
  665    H    ILE  89           H        ILE  89   6.578  -2.103  -4.401
  666    HA   ILE  89           HA       ILE  89   5.840   0.649  -5.321
  667    HB   ILE  89           HB       ILE  89   8.082  -0.951  -6.520
  668   HG12  ILE  89          HG12      ILE  89   8.663  -1.041  -4.160
  669   HG13  ILE  89          HG13      ILE  89   9.750  -0.017  -5.064
  670   HG21  ILE  89          HG21      ILE  89   7.519   2.036  -6.206
  671   HG22  ILE  89          HG22      ILE  89   8.991   1.350  -6.919
  672   HG23  ILE  89          HG23      ILE  89   7.433   1.075  -7.694
  673   HD11  ILE  89          HD11      ILE  89   8.759   2.000  -4.135
  674   HD12  ILE  89          HD12      ILE  89   7.493   1.051  -3.313
  675   HD13  ILE  89          HD13      ILE  89   9.189   0.893  -2.826
  676    H    ASN  90           H        ASN  90   5.023   0.973  -7.422
  677    HA   ASN  90           HA       ASN  90   3.830  -1.437  -8.721
  678    HB2  ASN  90           HB2      ASN  90   2.295   0.315  -7.709
  679    HB3  ASN  90           HB3      ASN  90   2.991   1.498  -8.809
  680   HD21  ASN  90          HD22      ASN  90   1.570   1.843 -10.475
  681   HD22  ASN  90          HD21      ASN  90   0.700   0.555 -11.280
  682    H    GLN  91           H        GLN  91   4.073  -1.838 -10.970
  683    HA   GLN  91           HA       GLN  91   5.292   0.238 -12.669
  684    HB2  GLN  91           HB2      GLN  91   7.107  -1.137 -11.427
  685    HB3  GLN  91           HB3      GLN  91   6.616  -2.476 -12.442
  686    HG2  GLN  91           HG2      GLN  91   8.481  -1.551 -13.525
  687    HG3  GLN  91           HG3      GLN  91   7.112  -0.968 -14.472
  688   HE21  GLN  91          HE22      GLN  91   9.058   0.007 -11.581
  689   HE22  GLN  91          HE21      GLN  91   9.002   1.738 -11.940
  690    H    ASN  92           H        ASN  92   4.023   0.283 -14.381
  691    HA   ASN  92           HA       ASN  92   4.135  -0.957 -16.617
  692    HB2  ASN  92           HB2      ASN  92   3.426  -3.194 -15.784
  693    HB3  ASN  92           HB3      ASN  92   1.875  -2.487 -15.308
  694   HD21  ASN  92          HD22      ASN  92   0.517  -3.576 -16.713
  695   HD22  ASN  92          HD21      ASN  92   0.802  -3.611 -18.460
  696    H    GLY  93           H        GLY  93   1.341  -0.222 -14.447
  697    HA2  GLY  93           HA2      GLY  93   0.514   2.108 -16.030
  698    HA3  GLY  93           HA3      GLY  93  -0.551   0.709 -16.103
  699    H    SER  94           H        SER  94  -1.876   2.710 -15.114
  700    HA   SER  94           HA       SER  94  -1.522   2.912 -12.197
  701    HB2  SER  94           HB2      SER  94  -3.338   4.594 -12.322
  702    HB3  SER  94           HB3      SER  94  -1.926   4.965 -13.319
  703    HG   SER  94           HG       SER  94  -3.753   5.350 -14.504
  704    H    LEU  95           H        LEU  95  -2.758   2.017 -10.647
  705    HA   LEU  95           HA       LEU  95  -5.091   0.338 -11.478
  706    HB2  LEU  95           HB2      LEU  95  -3.329  -0.219  -9.112
  707    HB3  LEU  95           HB3      LEU  95  -4.485  -1.278  -9.875
  708    HG   LEU  95           HG       LEU  95  -1.737  -0.473 -10.927
  709   HD11  LEU  95          HD11      LEU  95  -1.291  -2.898 -10.419
  710   HD12  LEU  95          HD12      LEU  95  -1.681  -1.952  -8.983
  711   HD13  LEU  95          HD13      LEU  95  -2.899  -3.027  -9.719
  712   HD21  LEU  95          HD21      LEU  95  -3.730  -2.497 -12.013
  713   HD22  LEU  95          HD22      LEU  95  -3.332  -0.948 -12.788
  714   HD23  LEU  95          HD23      LEU  95  -2.081  -2.177 -12.626
  715    H    LEU  96           H        LEU  96  -6.593  -0.200  -9.747
  716    HA   LEU  96           HA       LEU  96  -7.172   2.108  -7.929
  717    HB2  LEU  96           HB2      LEU  96  -8.591   1.702  -9.957
  718    HB3  LEU  96           HB3      LEU  96  -9.082   0.160  -9.272
  719    HG   LEU  96           HG       LEU  96  -9.564   2.806  -7.837
  720   HD11  LEU  96          HD11      LEU  96 -11.399   1.265  -9.725
  721   HD12  LEU  96          HD12      LEU  96 -11.814   2.741  -8.827
  722   HD13  LEU  96          HD13      LEU  96 -10.590   2.803 -10.102
  723   HD21  LEU  96          HD21      LEU  96  -9.851   1.095  -6.300
  724   HD22  LEU  96          HD22      LEU  96 -11.461   1.550  -6.854
  725   HD23  LEU  96          HD23      LEU  96 -10.712   0.064  -7.476
  726    H    ILE  97           H        ILE  97  -6.790   1.658  -5.847
  727    HA   ILE  97           HA       ILE  97  -7.313  -1.080  -4.805
  728    HB   ILE  97           HB       ILE  97  -5.726   1.112  -3.433
  729   HG12  ILE  97          HG12      ILE  97  -3.755  -0.519  -4.157
  730   HG13  ILE  97          HG13      ILE  97  -4.798  -0.853  -5.536
  731   HG21  ILE  97          HG21      ILE  97  -5.758  -1.920  -3.088
  732   HG22  ILE  97          HG22      ILE  97  -4.813  -0.761  -2.137
  733   HG23  ILE  97          HG23      ILE  97  -6.572  -0.761  -2.018
  734   HD11  ILE  97          HD11      ILE  97  -3.108   0.911  -5.954
  735   HD12  ILE  97          HD12      ILE  97  -4.733   1.563  -6.147
  736   HD13  ILE  97          HD13      ILE  97  -3.807   1.909  -4.668
  737    H    CYS  98           H        CYS  98  -9.098  -1.398  -3.598
  738    HA   CYS  98           HA       CYS  98 -10.388   0.916  -2.234
  739    HB2  CYS  98           HB2      CYS  98 -12.147  -0.695  -1.596
  740    HB3  CYS  98           HB3      CYS  98 -11.986  -0.478  -3.343
  741    HG   CYS  98           HG       CYS  98 -10.370  -2.807  -1.694
  742    H    ALA  99           H        ALA  99  -9.749   1.437  -0.231
  743    HA   ALA  99           HA       ALA  99  -7.727  -0.180   1.071
  744    HB1  ALA  99           HB1      ALA  99  -9.210   2.312   2.027
  745    HB2  ALA  99           HB2      ALA  99  -7.718   1.644   2.722
  746    HB3  ALA  99           HB3      ALA  99  -7.708   2.302   1.074
  747    H    THR 100           H        THR 100  -7.844  -1.033   3.226
  748    HA   THR 100           HA       THR 100 -10.567  -1.415   4.376
  749    HB   THR 100           HB       THR 100 -10.104  -3.307   2.840
  750    HG1  THR 100           HG1      THR 100 -10.731  -4.857   4.305
  751   HG21  THR 100          HG21      THR 100  -8.448  -4.884   3.166
  752   HG22  THR 100          HG22      THR 100  -7.563  -3.421   3.606
  753   HG23  THR 100          HG23      THR 100  -8.221  -4.467   4.870
  754    H    HIS 101           H        HIS 101  -7.240  -0.848   4.974
  755    HA   HIS 101           HA       HIS 101  -7.954  -0.580   7.822
  756    HB2  HIS 101           HB2      HIS 101  -5.344  -1.774   6.808
  757    HB3  HIS 101           HB3      HIS 101  -5.739  -1.421   8.487
  758    HD1  HIS 101           HD1      HIS 101  -5.842  -4.206   6.096
  759    HD2  HIS 101           HD2      HIS 101  -8.154  -2.846   9.341
  760    HE1  HIS 101           HE1      HIS 101  -7.317  -6.177   6.815
  761    H    VAL 102           H        VAL 102  -7.066   1.265   8.788
  762    HA   VAL 102           HA       VAL 102  -5.762   3.279   7.089
  763    HB   VAL 102           HB       VAL 102  -5.509   4.598   9.135
  764   HG11  VAL 102          HG11      VAL 102  -8.283   3.462   8.728
  765   HG12  VAL 102          HG12      VAL 102  -7.873   5.044   9.439
  766   HG13  VAL 102          HG13      VAL 102  -7.468   4.710   7.741
  767   HG21  VAL 102          HG21      VAL 102  -6.929   2.394  10.647
  768   HG22  VAL 102          HG22      VAL 102  -5.225   2.859  10.850
  769   HG23  VAL 102          HG23      VAL 102  -6.510   4.001  11.247
  770    H    GLY 103           H        GLY 103  -3.537   4.256   8.003
  771    HA2  GLY 103           HA2      GLY 103  -1.693   2.153   7.206
  772    HA3  GLY 103           HA3      GLY 103  -1.263   3.761   7.697
  773    H    ALA 104           H        ALA 104  -2.423   3.751  10.339
  774    HA   ALA 104           HA       ALA 104  -0.542   2.326  11.948
  775    HB1  ALA 104           HB1      ALA 104  -3.272   3.553  12.543
  776    HB2  ALA 104           HB2      ALA 104  -2.109   3.043  13.771
  777    HB3  ALA 104           HB3      ALA 104  -1.690   4.361  12.659
  778    H    ASP 105           H        ASP 105  -3.753   1.443  10.841
  779    HA   ASP 105           HA       ASP 105  -4.004  -0.951  12.516
  780    HB2  ASP 105           HB2      ASP 105  -5.881   0.661  11.979
  781    HB3  ASP 105           HB3      ASP 105  -5.905  -0.034  10.359
  782    H    THR 106           H        THR 106  -2.323  -0.376   9.676
  783    HA   THR 106           HA       THR 106  -2.941  -2.733   8.143
  784    HB   THR 106           HB       THR 106  -0.772  -2.398   7.018
  785    HG1  THR 106           HG1      THR 106  -0.328  -0.096   8.498
  786   HG21  THR 106          HG21      THR 106  -2.355   0.132   7.297
  787   HG22  THR 106          HG22      THR 106  -1.149  -0.215   6.038
  788   HG23  THR 106          HG23      THR 106  -2.641  -1.181   6.160
  789    H    THR 107           H        THR 107  -1.682  -4.602   7.774
  790    HA   THR 107           HA       THR 107  -0.705  -5.969  10.103
  791    HB   THR 107           HB       THR 107  -0.268  -6.600   7.162
  792    HG1  THR 107           HG1      THR 107  -2.110  -7.645   9.040
  793   HG21  THR 107          HG21      THR 107  -0.079  -8.969   7.979
  794   HG22  THR 107          HG22      THR 107   1.287  -7.951   8.448
  795   HG23  THR 107          HG23      THR 107   0.040  -8.350   9.646
  796    H    LEU 108           H        LEU 108   1.034  -4.172   7.552
  797    HA   LEU 108           HA       LEU 108   3.697  -4.635   8.269
  798    HB2  LEU 108           HB2      LEU 108   2.636  -3.263   6.338
  799    HB3  LEU 108           HB3      LEU 108   2.445  -1.960   7.498
  800    HG   LEU 108           HG       LEU 108   5.047  -2.208   7.871
  801   HD11  LEU 108          HD11      LEU 108   4.628  -3.546   5.164
  802   HD12  LEU 108          HD12      LEU 108   6.194  -2.971   5.790
  803   HD13  LEU 108          HD13      LEU 108   5.342  -4.312   6.602
  804   HD21  LEU 108          HD21      LEU 108   3.898  -1.178   5.244
  805   HD22  LEU 108          HD22      LEU 108   3.977  -0.304   6.796
  806   HD23  LEU 108          HD23      LEU 108   5.469  -0.733   5.936
  807    H    SER 109           H        SER 109   1.477  -2.123   9.584
  808    HA   SER 109           HA       SER 109   3.217  -1.163  11.624
  809    HB2  SER 109           HB2      SER 109   0.235  -1.022  11.156
  810    HB3  SER 109           HB3      SER 109   0.993  -0.292  12.574
  811    HG   SER 109           HG       SER 109   0.786   0.765  10.207
  812    H    GLN 110           H        GLN 110   0.888  -3.868  11.698
  813    HA   GLN 110           HA       GLN 110   1.145  -4.381  14.545
  814    HB2  GLN 110           HB2      GLN 110  -0.750  -5.210  13.241
  815    HB3  GLN 110           HB3      GLN 110   0.295  -6.222  12.288
  816    HG2  GLN 110           HG2      GLN 110  -0.573  -7.724  13.773
  817    HG3  GLN 110           HG3      GLN 110   0.983  -7.391  14.508
  818   HE21  GLN 110          HE22      GLN 110  -2.491  -6.662  14.598
  819   HE22  GLN 110          HE21      GLN 110  -2.481  -6.063  16.251
  820    H    ILE 111           H        ILE 111   2.940  -5.642  11.684
  821    HA   ILE 111           HA       ILE 111   4.510  -7.565  13.049
  822    HB   ILE 111           HB       ILE 111   5.023  -5.937  10.539
  823   HG12  ILE 111          HG12      ILE 111   4.433  -8.914  10.881
  824   HG13  ILE 111          HG13      ILE 111   3.160  -7.721  10.687
  825   HG21  ILE 111          HG21      ILE 111   6.717  -8.237  11.619
  826   HG22  ILE 111          HG22      ILE 111   6.874  -7.523  10.002
  827   HG23  ILE 111          HG23      ILE 111   7.251  -6.556  11.412
  828   HD11  ILE 111          HD11      ILE 111   4.109  -7.030   8.495
  829   HD12  ILE 111          HD12      ILE 111   5.322  -8.327   8.631
  830   HD13  ILE 111          HD13      ILE 111   3.605  -8.732   8.545
  831    H    VAL 112           H        VAL 112   5.423  -4.131  12.357
  832    HA   VAL 112           HA       VAL 112   7.777  -4.261  13.933
  833    HB   VAL 112           HB       VAL 112   7.782  -1.814  14.034
  834   HG11  VAL 112          HG11      VAL 112   7.123  -2.870  11.262
  835   HG12  VAL 112          HG12      VAL 112   8.104  -1.445  11.684
  836   HG13  VAL 112          HG13      VAL 112   8.686  -3.061  12.096
  837   HG21  VAL 112          HG21      VAL 112   5.344  -1.369  14.187
  838   HG22  VAL 112          HG22      VAL 112   6.132  -0.474  12.889
  839   HG23  VAL 112          HG23      VAL 112   5.163  -1.911  12.501
  840    H    LYS 113           H        LYS 113   4.462  -3.780  15.088
  841    HA   LYS 113           HA       LYS 113   5.321  -3.037  17.794
  842    HB2  LYS 113           HB2      LYS 113   2.668  -4.037  16.696
  843    HB3  LYS 113           HB3      LYS 113   2.961  -3.644  18.399
  844    HG2  LYS 113           HG2      LYS 113   3.580  -1.334  17.809
  845    HG3  LYS 113           HG3      LYS 113   3.390  -1.684  16.105
  846    HD2  LYS 113           HD2      LYS 113   1.419  -0.571  16.681
  847    HD3  LYS 113           HD3      LYS 113   0.938  -2.275  16.596
  848    HE2  LYS 113           HE2      LYS 113   1.146  -2.476  19.034
  849    HE3  LYS 113           HE3      LYS 113   1.806  -0.840  19.138
  850    HZ1  LYS 113           HZ1      LYS 113  -0.924  -1.392  18.119
  851    HZ2  LYS 113           HZ2      LYS 113  -0.591  -0.972  19.687
  852    HZ3  LYS 113           HZ3      LYS 113  -0.251   0.070  18.476
  853    H    LEU 114           H        LEU 114   4.306  -6.167  16.280
  854    HA   LEU 114           HA       LEU 114   4.574  -7.756  18.603
  855    HB2  LEU 114           HB2      LEU 114   4.614  -8.142  15.607
  856    HB3  LEU 114           HB3      LEU 114   5.082  -9.508  16.619
  857    HG   LEU 114           HG       LEU 114   2.473  -8.006  16.824
  858   HD11  LEU 114          HD11      LEU 114   3.076 -10.636  15.414
  859   HD12  LEU 114          HD12      LEU 114   1.469  -9.913  15.619
  860   HD13  LEU 114          HD13      LEU 114   2.685  -9.095  14.623
  861   HD21  LEU 114          HD21      LEU 114   1.710 -10.048  18.053
  862   HD22  LEU 114          HD22      LEU 114   3.332 -10.754  17.879
  863   HD23  LEU 114          HD23      LEU 114   3.090  -9.317  18.882
  864    H    VAL 115           H        VAL 115   7.028  -6.861  16.150
  865    HA   VAL 115           HA       VAL 115   9.078  -8.464  17.448
  866    HB   VAL 115           HB       VAL 115   8.895  -7.806  14.959
  867   HG11  VAL 115          HG11      VAL 115  10.599  -5.467  15.861
  868   HG12  VAL 115          HG12      VAL 115  10.126  -5.905  14.205
  869   HG13  VAL 115          HG13      VAL 115   8.906  -5.335  15.363
  870   HG21  VAL 115          HG21      VAL 115  10.703  -9.160  15.935
  871   HG22  VAL 115          HG22      VAL 115  11.297  -8.077  14.670
  872   HG23  VAL 115          HG23      VAL 115  11.586  -7.680  16.378
  873    H    GLU 116           H        GLU 116   8.042  -5.139  17.860
  874    HA   GLU 116           HA       GLU 116  10.530  -4.329  19.236
  875    HB2  GLU 116           HB2      GLU 116   9.243  -2.700  17.898
  876    HB3  GLU 116           HB3      GLU 116   7.881  -2.859  19.021
  877    HG2  GLU 116           HG2      GLU 116   9.343  -2.014  20.856
  878    HG3  GLU 116           HG3      GLU 116  10.689  -1.883  19.720
  879    H    GLU 117           H        GLU 117   7.189  -5.259  20.177
  880    HA   GLU 117           HA       GLU 117   7.648  -4.768  23.025
  881    HB2  GLU 117           HB2      GLU 117   5.386  -6.071  21.468
  882    HB3  GLU 117           HB3      GLU 117   5.333  -5.679  23.186
  883    HG2  GLU 117           HG2      GLU 117   5.849  -3.515  21.080
  884    HG3  GLU 117           HG3      GLU 117   4.254  -4.055  21.506
  885    H    ALA 118           H        ALA 118   8.353  -7.329  20.906
  886    HA   ALA 118           HA       ALA 118   8.305  -9.534  22.771
  887    HB1  ALA 118           HB1      ALA 118  10.053  -9.041  20.318
  888    HB2  ALA 118           HB2      ALA 118   9.895 -10.582  21.185
  889    HB3  ALA 118           HB3      ALA 118   8.494  -9.880  20.362
  890    H    GLN 119           H        GLN 119  11.127  -7.506  21.723
  891    HA   GLN 119           HA       GLN 119  12.794  -8.313  23.818
  892    HB2  GLN 119           HB2      GLN 119  12.838  -5.927  21.972
  893    HB3  GLN 119           HB3      GLN 119  14.117  -6.235  23.100
  894    HG2  GLN 119           HG2      GLN 119  15.148  -7.572  21.661
  895    HG3  GLN 119           HG3      GLN 119  13.811  -8.721  21.806
  896   HE21  GLN 119          HE22      GLN 119  12.561  -9.056  19.938
  897   HE22  GLN 119          HE21      GLN 119  12.110  -7.624  19.045
  Start of MODEL   25
    1    H    SER   1           H        SER   1  19.373  -1.794  14.015
    2    HA   SER   1           HA       SER   1  16.567  -1.218  14.630
    3    HB2  SER   1           HB2      SER   1  19.056   0.520  14.892
    4    HB3  SER   1           HB3      SER   1  17.458   0.892  15.559
    5    HG   SER   1           HG       SER   1  18.684  -0.014  17.156
    6    H    GLU   2           H        GLU   2  18.869  -0.170  12.162
    7    HA   GLU   2           HA       GLU   2  17.307   1.817  10.826
    8    HB2  GLU   2           HB2      GLU   2  19.762   1.273  10.525
    9    HB3  GLU   2           HB3      GLU   2  19.308  -0.211   9.704
   10    HG2  GLU   2           HG2      GLU   2  18.215   1.099   7.920
   11    HG3  GLU   2           HG3      GLU   2  18.572   2.599   8.785
   12    H    ALA   3           H        ALA   3  17.684  -1.683  10.188
   13    HA   ALA   3           HA       ALA   3  15.598  -2.050   8.380
   14    HB1  ALA   3           HB1      ALA   3  15.828  -4.431   8.987
   15    HB2  ALA   3           HB2      ALA   3  17.403  -3.645   8.861
   16    HB3  ALA   3           HB3      ALA   3  16.703  -3.992  10.458
   17    H    LEU   4           H        LEU   4  15.309  -2.109  11.979
   18    HA   LEU   4           HA       LEU   4  12.478  -2.614  12.021
   19    HB2  LEU   4           HB2      LEU   4  13.970  -2.951  13.968
   20    HB3  LEU   4           HB3      LEU   4  14.304  -1.224  14.013
   21    HG   LEU   4           HG       LEU   4  11.986  -0.708  14.626
   22   HD11  LEU   4          HD11      LEU   4  11.715  -3.728  14.693
   23   HD12  LEU   4          HD12      LEU   4  10.529  -2.579  15.383
   24   HD13  LEU   4          HD13      LEU   4  10.836  -2.608  13.632
   25   HD21  LEU   4          HD21      LEU   4  13.312  -2.800  16.393
   26   HD22  LEU   4          HD22      LEU   4  13.652  -1.049  16.391
   27   HD23  LEU   4          HD23      LEU   4  12.056  -1.642  16.895
   28    H    ALA   5           H        ALA   5  14.298   0.485  11.564
   29    HA   ALA   5           HA       ALA   5  11.938   2.134  11.991
   30    HB1  ALA   5           HB1      ALA   5  14.233   2.984  12.381
   31    HB2  ALA   5           HB2      ALA   5  14.640   2.697  10.679
   32    HB3  ALA   5           HB3      ALA   5  13.416   3.904  11.109
   33    H    LYS   6           H        LYS   6  13.573   0.529   9.244
   34    HA   LYS   6           HA       LYS   6  12.647   1.887   7.130
   35    HB2  LYS   6           HB2      LYS   6  14.226  -0.154   7.354
   36    HB3  LYS   6           HB3      LYS   6  12.798  -1.152   7.066
   37    HG2  LYS   6           HG2      LYS   6  12.474  -0.055   4.869
   38    HG3  LYS   6           HG3      LYS   6  13.788   1.084   5.237
   39    HD2  LYS   6           HD2      LYS   6  15.310  -0.975   5.468
   40    HD3  LYS   6           HD3      LYS   6  13.999  -1.911   4.718
   41    HE2  LYS   6           HE2      LYS   6  14.084  -0.355   2.743
   42    HE3  LYS   6           HE3      LYS   6  15.367   0.552   3.552
   43    HZ1  LYS   6           HZ1      LYS   6  15.536  -2.196   2.499
   44    HZ2  LYS   6           HZ2      LYS   6  16.429  -0.902   2.077
   45    HZ3  LYS   6           HZ3      LYS   6  16.661  -1.600   3.555
   46    H    LEU   7           H        LEU   7  10.686  -0.576   8.794
   47    HA   LEU   7           HA       LEU   7   8.599  -0.818   6.894
   48    HB2  LEU   7           HB2      LEU   7   8.749  -1.126   9.893
   49    HB3  LEU   7           HB3      LEU   7   7.237  -1.384   9.049
   50    HG   LEU   7           HG       LEU   7   8.412  -3.472   9.581
   51   HD11  LEU   7          HD11      LEU   7   8.192  -2.997   6.580
   52   HD12  LEU   7          HD12      LEU   7   8.178  -4.565   7.412
   53   HD13  LEU   7          HD13      LEU   7   6.867  -3.418   7.693
   54   HD21  LEU   7          HD21      LEU   7  10.756  -2.732   9.286
   55   HD22  LEU   7          HD22      LEU   7  10.373  -4.227   8.423
   56   HD23  LEU   7          HD23      LEU   7  10.503  -2.712   7.517
   57    H    ILE   8           H        ILE   8   8.827   1.566   9.576
   58    HA   ILE   8           HA       ILE   8   6.320   2.862   8.817
   59    HB   ILE   8           HB       ILE   8   8.580   3.734  10.630
   60   HG12  ILE   8          HG12      ILE   8   7.414   1.776  11.461
   61   HG13  ILE   8          HG13      ILE   8   7.074   3.176  12.461
   62   HG21  ILE   8          HG21      ILE   8   5.896   5.080  10.141
   63   HG22  ILE   8          HG22      ILE   8   6.952   5.418  11.527
   64   HG23  ILE   8          HG23      ILE   8   7.513   5.766   9.889
   65   HD11  ILE   8          HD11      ILE   8   5.065   1.845  12.198
   66   HD12  ILE   8          HD12      ILE   8   4.824   3.380  11.350
   67   HD13  ILE   8          HD13      ILE   8   5.181   1.897  10.435
   68    H    SER   9           H        SER   9   9.653   3.247   7.773
   69    HA   SER   9           HA       SER   9   9.163   5.837   6.455
   70    HB2  SER   9           HB2      SER   9  11.562   3.970   6.456
   71    HB3  SER   9           HB3      SER   9  11.491   5.545   5.655
   72    HG   SER   9           HG       SER   9  12.470   5.563   7.743
   73    H    LEU  10           H        LEU  10   8.928   2.464   5.695
   74    HA   LEU  10           HA       LEU  10   9.040   2.527   2.852
   75    HB2  LEU  10           HB2      LEU  10   8.294   0.654   5.033
   76    HB3  LEU  10           HB3      LEU  10   7.419   0.359   3.563
   77    HG   LEU  10           HG       LEU  10  10.436   0.696   3.475
   78   HD11  LEU  10          HD11      LEU  10   8.892  -1.864   4.092
   79   HD12  LEU  10          HD12      LEU  10  10.618  -1.754   3.668
   80   HD13  LEU  10          HD13      LEU  10  10.040  -1.033   5.167
   81   HD21  LEU  10          HD21      LEU  10   9.076   0.617   1.353
   82   HD22  LEU  10          HD22      LEU  10  10.182  -0.764   1.512
   83   HD23  LEU  10          HD23      LEU  10   8.452  -0.971   1.860
   84    H    GLN  11           H        GLN  11   6.266   2.811   5.068
   85    HA   GLN  11           HA       GLN  11   4.113   2.804   3.236
   86    HB2  GLN  11           HB2      GLN  11   4.568   4.472   5.734
   87    HB3  GLN  11           HB3      GLN  11   3.033   4.407   4.860
   88    HG2  GLN  11           HG2      GLN  11   2.834   2.002   5.284
   89    HG3  GLN  11           HG3      GLN  11   4.400   1.978   6.112
   90   HE21  GLN  11          HE22      GLN  11   0.992   2.923   6.400
   91   HE22  GLN  11          HE21      GLN  11   1.162   3.439   8.086
   92    H    ALA  12           H        ALA  12   3.406   4.173   1.673
   93    HA   ALA  12           HA       ALA  12   5.109   6.041   0.528
   94    HB1  ALA  12           HB1      ALA  12   2.095   5.880   0.188
   95    HB2  ALA  12           HB2      ALA  12   3.283   6.438  -1.005
   96    HB3  ALA  12           HB3      ALA  12   3.243   4.726  -0.536
   97    H    THR  13           H        THR  13   2.943   6.684   3.102
   98    HA   THR  13           HA       THR  13   2.702   8.411   4.525
   99    HB   THR  13           HB       THR  13   4.762   9.990   3.006
  100    HG1  THR  13           HG1      THR  13   6.224   8.977   4.410
  101   HG21  THR  13          HG21      THR  13   3.630  11.305   4.763
  102   HG22  THR  13          HG22      THR  13   3.883   9.993   5.933
  103   HG23  THR  13          HG23      THR  13   5.267  10.900   5.281
  104    H    GLU  14           H        GLU  14   2.368   9.167   1.135
  105    HA   GLU  14           HA       GLU  14  -0.014  10.783   1.880
  106    HB2  GLU  14           HB2      GLU  14   0.308  12.356   0.268
  107    HB3  GLU  14           HB3      GLU  14   1.942  12.097   0.895
  108    HG2  GLU  14           HG2      GLU  14   2.496  10.760  -1.097
  109    HG3  GLU  14           HG3      GLU  14   0.837  10.865  -1.682
  110    H    ALA  15           H        ALA  15  -1.853  10.616   0.431
  111    HA   ALA  15           HA       ALA  15  -1.902   8.230  -1.326
  112    HB1  ALA  15           HB1      ALA  15  -3.804   8.695   1.014
  113    HB2  ALA  15           HB2      ALA  15  -3.899   7.374  -0.172
  114    HB3  ALA  15           HB3      ALA  15  -2.526   7.461   0.953
  115    H    THR  16           H        THR  16  -3.497   8.245  -2.859
  116    HA   THR  16           HA       THR  16  -4.817  10.876  -3.347
  117    HB   THR  16           HB       THR  16  -4.025   8.736  -5.321
  118    HG1  THR  16           HG1      THR  16  -2.370  10.006  -5.749
  119   HG21  THR  16          HG21      THR  16  -5.079  11.573  -5.749
  120   HG22  THR  16          HG22      THR  16  -4.431  10.514  -7.013
  121   HG23  THR  16          HG23      THR  16  -5.927  10.072  -6.182
  122    H    ILE  17           H        ILE  17  -6.900  10.937  -2.772
  123    HA   ILE  17           HA       ILE  17  -8.547   8.456  -2.704
  124    HB   ILE  17           HB       ILE  17  -9.168  11.200  -1.518
  125   HG12  ILE  17          HG12      ILE  17  -7.966   8.762  -0.159
  126   HG13  ILE  17          HG13      ILE  17  -7.184  10.318  -0.412
  127   HG21  ILE  17          HG21      ILE  17 -11.171   9.810  -1.981
  128   HG22  ILE  17          HG22      ILE  17 -10.446   8.466  -1.069
  129   HG23  ILE  17          HG23      ILE  17 -10.924   9.981  -0.268
  130   HD11  ILE  17          HD11      ILE  17  -9.544   9.767   1.429
  131   HD12  ILE  17          HD12      ILE  17  -7.896  10.157   1.880
  132   HD13  ILE  17          HD13      ILE  17  -8.890  11.389   1.073
  133    H    VAL  18           H        VAL  18 -10.295   8.118  -4.089
  134    HA   VAL  18           HA       VAL  18 -10.987  10.261  -6.028
  135    HB   VAL  18           HB       VAL  18 -12.069   7.465  -5.786
  136   HG11  VAL  18          HG11      VAL  18 -12.305   9.485  -8.051
  137   HG12  VAL  18          HG12      VAL  18 -12.860   7.798  -8.106
  138   HG13  VAL  18          HG13      VAL  18 -13.627   8.930  -6.999
  139   HG21  VAL  18          HG21      VAL  18  -9.723   7.300  -6.319
  140   HG22  VAL  18          HG22      VAL  18 -10.691   6.910  -7.741
  141   HG23  VAL  18          HG23      VAL  18  -9.899   8.499  -7.619
  142    H    THR  19           H        THR  19 -12.645  11.601  -5.773
  143    HA   THR  19           HA       THR  19 -14.851  10.977  -3.847
  144    HB   THR  19           HB       THR  19 -13.912  13.786  -4.496
  145    HG1  THR  19           HG1      THR  19 -12.158  12.989  -3.634
  146   HG21  THR  19          HG21      THR  19 -15.406  12.565  -2.140
  147   HG22  THR  19          HG22      THR  19 -14.816  14.238  -2.223
  148   HG23  THR  19          HG23      THR  19 -16.057  13.698  -3.352
  149    H    LEU  20           H        LEU  20 -16.935  11.750  -4.383
  150    HA   LEU  20           HA       LEU  20 -17.365  12.331  -7.276
  151    HB2  LEU  20           HB2      LEU  20 -19.211  11.028  -5.254
  152    HB3  LEU  20           HB3      LEU  20 -19.555  11.276  -6.949
  153    HG   LEU  20           HG       LEU  20 -17.255   9.549  -5.912
  154   HD11  LEU  20          HD11      LEU  20 -18.758   7.638  -6.531
  155   HD12  LEU  20          HD12      LEU  20 -19.257   8.576  -5.107
  156   HD13  LEU  20          HD13      LEU  20 -20.102   8.808  -6.616
  157   HD21  LEU  20          HD21      LEU  20 -18.471   9.902  -8.677
  158   HD22  LEU  20          HD22      LEU  20 -16.820  10.252  -8.163
  159   HD23  LEU  20          HD23      LEU  20 -17.371   8.575  -8.221
  160    H    ASP  21           H        ASP  21 -17.629  14.436  -7.628
  161    HA   ASP  21           HA       ASP  21 -18.737  16.161  -5.482
  162    HB2  ASP  21           HB2      ASP  21 -16.565  16.400  -7.439
  163    HB3  ASP  21           HB3      ASP  21 -17.561  17.823  -7.423
  164    H    SER  22           H        SER  22 -20.146  14.825  -7.868
  165    HA   SER  22           HA       SER  22 -22.264  16.959  -8.075
  166    HB2  SER  22           HB2      SER  22 -21.384  15.252 -10.441
  167    HB3  SER  22           HB3      SER  22 -22.884  16.150 -10.395
  168    HG   SER  22           HG       SER  22 -21.576  18.075 -10.050
  169    H    ASP  23           H        ASP  23 -21.640  13.683  -9.110
  170    HA   ASP  23           HA       ASP  23 -23.209  12.303  -7.205
  171    HB2  ASP  23           HB2      ASP  23 -24.167  12.371 -10.115
  172    HB3  ASP  23           HB3      ASP  23 -24.611  11.106  -8.977
  173    H    ASN  24           H        ASN  24 -23.178   9.854  -8.389
  174    HA   ASN  24           HA       ASN  24 -20.467   9.063  -8.603
  175    HB2  ASN  24           HB2      ASN  24 -22.695   7.747  -8.151
  176    HB3  ASN  24           HB3      ASN  24 -22.708   7.494  -9.902
  177   HD21  ASN  24          HD22      ASN  24 -19.795   7.175 -10.078
  178   HD22  ASN  24          HD21      ASN  24 -19.602   5.560  -9.407
  179    H    ILE  25           H        ILE  25 -22.346  10.616 -11.043
  180    HA   ILE  25           HA       ILE  25 -20.986   9.749 -13.375
  181    HB   ILE  25           HB       ILE  25 -22.090  11.579 -14.442
  182   HG12  ILE  25          HG12      ILE  25 -22.460  12.801 -11.675
  183   HG13  ILE  25          HG13      ILE  25 -21.566  13.463 -13.042
  184   HG21  ILE  25          HG21      ILE  25 -23.996  10.723 -12.229
  185   HG22  ILE  25          HG22      ILE  25 -24.359  11.067 -13.929
  186   HG23  ILE  25          HG23      ILE  25 -23.442   9.612 -13.506
  187   HD11  ILE  25          HD11      ILE  25 -23.717  13.695 -14.304
  188   HD12  ILE  25          HD12      ILE  25 -24.583  13.208 -12.825
  189   HD13  ILE  25          HD13      ILE  25 -23.609  14.682 -12.833
  190    H    LEU  26           H        LEU  26 -19.962  12.059 -10.888
  191    HA   LEU  26           HA       LEU  26 -17.902  13.182 -12.755
  192    HB2  LEU  26           HB2      LEU  26 -19.587  14.821 -12.195
  193    HB3  LEU  26           HB3      LEU  26 -19.291  14.579 -10.471
  194    HG   LEU  26           HG       LEU  26 -16.807  15.161 -12.004
  195   HD11  LEU  26          HD11      LEU  26 -18.912  17.333 -11.813
  196   HD12  LEU  26          HD12      LEU  26 -17.230  17.526 -12.341
  197   HD13  LEU  26          HD13      LEU  26 -18.350  16.548 -13.314
  198   HD21  LEU  26          HD21      LEU  26 -18.084  16.544  -9.627
  199   HD22  LEU  26          HD22      LEU  26 -16.926  15.189  -9.533
  200   HD23  LEU  26          HD23      LEU  26 -16.418  16.742 -10.201
  201    H    LEU  27           H        LEU  27 -16.022  12.602 -12.323
  202    HA   LEU  27           HA       LEU  27 -15.192  11.730  -9.576
  203    HB2  LEU  27           HB2      LEU  27 -14.048  11.096 -12.284
  204    HB3  LEU  27           HB3      LEU  27 -13.000  11.114 -10.869
  205    HG   LEU  27           HG       LEU  27 -14.560   9.538  -9.695
  206   HD11  LEU  27          HD11      LEU  27 -15.845   9.277 -12.448
  207   HD12  LEU  27          HD12      LEU  27 -16.079   8.146 -11.094
  208   HD13  LEU  27          HD13      LEU  27 -16.645   9.806 -10.946
  209   HD21  LEU  27          HD21      LEU  27 -12.489   8.813 -10.807
  210   HD22  LEU  27          HD22      LEU  27 -13.750   7.570 -10.866
  211   HD23  LEU  27          HD23      LEU  27 -13.397   8.534 -12.316
  212    H    SER  28           H        SER  28 -14.076  12.834  -8.311
  213    HA   SER  28           HA       SER  28 -12.411  15.178  -9.115
  214    HB2  SER  28           HB2      SER  28 -14.562  15.980  -8.342
  215    HB3  SER  28           HB3      SER  28 -14.506  14.923  -6.925
  216    HG   SER  28           HG       SER  28 -14.018  17.011  -6.404
  217    H    GLU  29           H        GLU  29 -10.447  14.017  -8.849
  218    HA   GLU  29           HA       GLU  29 -10.141  12.398  -6.408
  219    HB2  GLU  29           HB2      GLU  29  -8.100  12.686  -8.597
  220    HB3  GLU  29           HB3      GLU  29  -8.249  11.426  -7.337
  221    HG2  GLU  29           HG2      GLU  29 -10.309  10.597  -8.322
  222    HG3  GLU  29           HG3      GLU  29 -10.270  11.834  -9.578
  223    H    GLU  30           H        GLU  30  -8.620  12.651  -4.878
  224    HA   GLU  30           HA       GLU  30  -7.718  15.444  -4.276
  225    HB2  GLU  30           HB2      GLU  30  -8.881  13.266  -2.485
  226    HB3  GLU  30           HB3      GLU  30  -8.431  14.861  -1.943
  227    HG2  GLU  30           HG2      GLU  30 -10.699  14.223  -3.889
  228    HG3  GLU  30           HG3      GLU  30 -10.860  14.469  -2.159
  229    H    GLN  31           H        GLN  31  -5.878  15.584  -2.770
  230    HA   GLN  31           HA       GLN  31  -4.446  13.015  -2.240
  231    HB2  GLN  31           HB2      GLN  31  -3.140  15.665  -2.946
  232    HB3  GLN  31           HB3      GLN  31  -2.315  14.221  -2.341
  233    HG2  GLN  31           HG2      GLN  31  -3.471  12.993  -4.342
  234    HG3  GLN  31           HG3      GLN  31  -3.634  14.621  -5.044
  235   HE21  GLN  31          HE22      GLN  31  -1.661  11.964  -4.349
  236   HE22  GLN  31          HE21      GLN  31  -0.390  12.904  -3.737
  237    H    VAL  32           H        VAL  32  -3.731  12.608  -0.281
  238    HA   VAL  32           HA       VAL  32  -3.894  14.675   1.872
  239    HB   VAL  32           HB       VAL  32  -5.126  13.230   3.321
  240   HG11  VAL  32          HG11      VAL  32  -6.460  14.637   1.766
  241   HG12  VAL  32          HG12      VAL  32  -6.640  13.236   0.688
  242   HG13  VAL  32          HG13      VAL  32  -7.309  13.190   2.329
  243   HG21  VAL  32          HG21      VAL  32  -4.328  10.997   2.551
  244   HG22  VAL  32          HG22      VAL  32  -6.073  11.097   2.710
  245   HG23  VAL  32          HG23      VAL  32  -5.331  11.163   1.093
  246    H    ASP  33           H        ASP  33  -2.999  13.972   3.897
  247    HA   ASP  33           HA       ASP  33  -0.534  12.328   3.731
  248    HB2  ASP  33           HB2      ASP  33  -0.463  14.359   5.074
  249    HB3  ASP  33           HB3      ASP  33  -1.804  13.805   6.064
  250    H    VAL  34           H        VAL  34  -0.209  10.355   4.743
  251    HA   VAL  34           HA       VAL  34  -2.384   8.575   4.765
  252    HB   VAL  34           HB       VAL  34   0.007   8.042   4.334
  253   HG11  VAL  34          HG11      VAL  34   0.229   7.803   7.365
  254   HG12  VAL  34          HG12      VAL  34   1.446   7.312   6.181
  255   HG13  VAL  34          HG13      VAL  34   1.028   9.025   6.358
  256   HG21  VAL  34          HG21      VAL  34  -1.733   6.281   4.523
  257   HG22  VAL  34          HG22      VAL  34  -0.112   5.742   4.985
  258   HG23  VAL  34          HG23      VAL  34  -1.311   6.085   6.238
  259    H    GLU  35           H        GLU  35  -1.587  10.660   7.423
  260    HA   GLU  35           HA       GLU  35  -3.036   8.947   9.355
  261    HB2  GLU  35           HB2      GLU  35  -1.123  10.901   9.668
  262    HB3  GLU  35           HB3      GLU  35  -2.600  11.799  10.009
  263    HG2  GLU  35           HG2      GLU  35  -1.775  10.941  12.084
  264    HG3  GLU  35           HG3      GLU  35  -3.206   9.992  11.685
  265    H    LEU  36           H        LEU  36  -3.985  11.091   6.871
  266    HA   LEU  36           HA       LEU  36  -6.524  11.911   8.171
  267    HB2  LEU  36           HB2      LEU  36  -5.281  12.785   5.547
  268    HB3  LEU  36           HB3      LEU  36  -6.614  13.558   6.387
  269    HG   LEU  36           HG       LEU  36  -3.714  13.474   7.318
  270   HD11  LEU  36          HD11      LEU  36  -4.164  14.963   5.386
  271   HD12  LEU  36          HD12      LEU  36  -5.447  15.768   6.312
  272   HD13  LEU  36          HD13      LEU  36  -3.755  15.875   6.847
  273   HD21  LEU  36          HD21      LEU  36  -5.167  13.512   9.283
  274   HD22  LEU  36          HD22      LEU  36  -4.438  15.100   9.041
  275   HD23  LEU  36          HD23      LEU  36  -6.132  14.832   8.576
  276    H    VAL  37           H        VAL  37  -5.534   9.469   6.054
  277    HA   VAL  37           HA       VAL  37  -8.135   9.265   4.647
  278    HB   VAL  37           HB       VAL  37  -6.161   8.834   3.337
  279   HG11  VAL  37          HG11      VAL  37  -5.581   6.464   5.171
  280   HG12  VAL  37          HG12      VAL  37  -4.715   6.885   3.681
  281   HG13  VAL  37          HG13      VAL  37  -4.627   7.961   5.077
  282   HG21  VAL  37          HG21      VAL  37  -6.721   6.705   2.332
  283   HG22  VAL  37          HG22      VAL  37  -7.701   6.247   3.738
  284   HG23  VAL  37          HG23      VAL  37  -8.176   7.625   2.711
  285    H    GLN  38           H        GLN  38  -9.628   7.647   4.975
  286    HA   GLN  38           HA       GLN  38  -9.380   5.940   7.408
  287    HB2  GLN  38           HB2      GLN  38 -11.697   6.296   7.902
  288    HB3  GLN  38           HB3      GLN  38 -10.857   7.838   7.870
  289    HG2  GLN  38           HG2      GLN  38 -11.800   8.326   5.643
  290    HG3  GLN  38           HG3      GLN  38 -12.589   6.743   5.605
  291   HE21  GLN  38          HE22      GLN  38 -14.028   6.538   7.872
  292   HE22  GLN  38          HE21      GLN  38 -14.969   8.014   8.045
  293    H    ARG  39           H        ARG  39 -10.965   3.972   7.268
  294    HA   ARG  39           HA       ARG  39 -10.712   2.758   4.578
  295    HB2  ARG  39           HB2      ARG  39 -11.356   0.756   5.389
  296    HB3  ARG  39           HB3      ARG  39 -10.384   1.433   6.693
  297    HG2  ARG  39           HG2      ARG  39 -12.479   2.020   7.896
  298    HG3  ARG  39           HG3      ARG  39 -13.437   1.347   6.563
  299    HD2  ARG  39           HD2      ARG  39 -12.400  -0.848   6.889
  300    HD3  ARG  39           HD3      ARG  39 -11.459  -0.224   8.251
  301    HE   ARG  39           HE       ARG  39 -14.466  -0.380   8.117
  302   HH11  ARG  39          HH11      ARG  39 -11.559  -0.556  10.193
  303   HH12  ARG  39          HH12      ARG  39 -12.582  -0.950  11.565
  304   HH21  ARG  39          HH21      ARG  39 -15.555  -0.904   9.987
  305   HH22  ARG  39          HH22      ARG  39 -14.625  -1.088  11.470
  306    H    GLY  40           H        GLY  40 -12.553   2.115   3.163
  307    HA2  GLY  40           HA2      GLY  40 -14.861   2.100   2.685
  308    HA3  GLY  40           HA3      GLY  40 -15.142   3.431   3.799
  309    H    ASP  41           H        ASP  41 -12.417   3.395   1.469
  310    HA   ASP  41           HA       ASP  41 -13.800   5.148  -0.419
  311    HB2  ASP  41           HB2      ASP  41 -11.378   6.021   1.206
  312    HB3  ASP  41           HB3      ASP  41 -11.802   6.737  -0.350
  313    H    ILE  42           H        ILE  42 -12.435   5.587  -2.309
  314    HA   ILE  42           HA       ILE  42 -10.905   3.130  -3.103
  315    HB   ILE  42           HB       ILE  42 -12.436   5.043  -4.873
  316   HG12  ILE  42          HG12      ILE  42 -14.049   3.743  -3.635
  317   HG13  ILE  42          HG13      ILE  42 -13.961   3.172  -5.287
  318   HG21  ILE  42          HG21      ILE  42 -10.885   2.492  -5.496
  319   HG22  ILE  42          HG22      ILE  42 -12.009   3.288  -6.619
  320   HG23  ILE  42          HG23      ILE  42 -10.552   4.134  -6.085
  321   HD11  ILE  42          HD11      ILE  42 -12.589   1.220  -4.520
  322   HD12  ILE  42          HD12      ILE  42 -12.799   1.792  -2.842
  323   HD13  ILE  42          HD13      ILE  42 -14.203   1.291  -3.793
  324    H    ILE  43           H        ILE  43  -8.715   3.422  -3.317
  325    HA   ILE  43           HA       ILE  43  -7.650   6.129  -3.650
  326    HB   ILE  43           HB       ILE  43  -6.374   3.555  -2.668
  327   HG12  ILE  43          HG12      ILE  43  -8.198   3.985  -1.145
  328   HG13  ILE  43          HG13      ILE  43  -6.659   4.300  -0.372
  329   HG21  ILE  43          HG21      ILE  43  -5.486   6.450  -2.367
  330   HG22  ILE  43          HG22      ILE  43  -4.719   5.055  -1.583
  331   HG23  ILE  43          HG23      ILE  43  -4.709   5.191  -3.340
  332   HD11  ILE  43          HD11      ILE  43  -8.544   6.446  -1.441
  333   HD12  ILE  43          HD12      ILE  43  -8.344   5.972   0.251
  334   HD13  ILE  43          HD13      ILE  43  -6.994   6.731  -0.609
  335    H    LYS  44           H        LYS  44  -6.623   6.696  -5.514
  336    HA   LYS  44           HA       LYS  44  -5.896   4.780  -7.575
  337    HB2  LYS  44           HB2      LYS  44  -5.022   7.685  -7.308
  338    HB3  LYS  44           HB3      LYS  44  -4.997   6.724  -8.777
  339    HG2  LYS  44           HG2      LYS  44  -7.495   7.515  -7.265
  340    HG3  LYS  44           HG3      LYS  44  -6.815   8.428  -8.598
  341    HD2  LYS  44           HD2      LYS  44  -7.791   5.556  -8.796
  342    HD3  LYS  44           HD3      LYS  44  -8.767   6.958  -9.196
  343    HE2  LYS  44           HE2      LYS  44  -6.291   6.001 -10.673
  344    HE3  LYS  44           HE3      LYS  44  -7.978   5.986 -11.214
  345    HZ1  LYS  44           HZ1      LYS  44  -7.072   7.860 -12.215
  346    HZ2  LYS  44           HZ2      LYS  44  -7.800   8.542 -10.899
  347    HZ3  LYS  44           HZ3      LYS  44  -6.170   8.284 -10.937
  348    H    VAL  45           H        VAL  45  -3.954   3.875  -8.085
  349    HA   VAL  45           HA       VAL  45  -1.498   5.204  -7.033
  350    HB   VAL  45           HB       VAL  45  -2.061   3.016  -5.975
  351   HG11  VAL  45          HG11      VAL  45  -1.188   1.793  -8.631
  352   HG12  VAL  45          HG12      VAL  45  -1.541   0.935  -7.124
  353   HG13  VAL  45          HG13      VAL  45  -2.842   1.782  -7.975
  354   HG21  VAL  45          HG21      VAL  45   0.221   3.979  -5.947
  355   HG22  VAL  45          HG22      VAL  45   0.240   2.210  -5.966
  356   HG23  VAL  45          HG23      VAL  45   0.607   3.107  -7.451
  357    H    VAL  46           H        VAL  46   0.092   5.722  -8.351
  358    HA   VAL  46           HA       VAL  46  -0.327   5.509 -11.235
  359    HB   VAL  46           HB       VAL  46   1.500   7.108 -11.423
  360   HG11  VAL  46          HG11      VAL  46  -0.369   7.905  -9.171
  361   HG12  VAL  46          HG12      VAL  46   0.516   8.971 -10.274
  362   HG13  VAL  46          HG13      VAL  46  -0.767   7.925 -10.904
  363   HG21  VAL  46          HG21      VAL  46   3.049   6.391  -9.705
  364   HG22  VAL  46          HG22      VAL  46   2.573   8.060  -9.394
  365   HG23  VAL  46          HG23      VAL  46   1.873   6.752  -8.428
  366    HA   PRO  47           HA       PRO  47   2.927   2.539 -12.166
  367    HB2  PRO  47           HB2      PRO  47   3.988   4.322 -14.304
  368    HB3  PRO  47           HB3      PRO  47   3.334   2.657 -14.426
  369    HG2  PRO  47           HG2      PRO  47   1.941   4.818 -15.351
  370    HG3  PRO  47           HG3      PRO  47   1.130   3.412 -14.591
  371    HD2  PRO  47           HD2      PRO  47   1.874   6.059 -13.341
  372    HD3  PRO  47           HD3      PRO  47   0.330   5.159 -13.238
  373    H    GLY  48           H        GLY  48   4.953   2.276 -11.220
  374    HA2  GLY  48           HA2      GLY  48   6.979   2.827 -10.186
  375    HA3  GLY  48           HA3      GLY  48   6.800   4.499 -10.698
  376    H    GLY  49           H        GLY  49   3.888   4.044  -9.291
  377    HA2  GLY  49           HA2      GLY  49   4.476   5.516  -6.932
  378    HA3  GLY  49           HA3      GLY  49   2.950   4.733  -7.326
  379    H    LYS  50           H        LYS  50   3.866   4.930  -4.728
  380    HA   LYS  50           HA       LYS  50   4.491   2.096  -3.966
  381    HB2  LYS  50           HB2      LYS  50   4.879   4.656  -2.372
  382    HB3  LYS  50           HB3      LYS  50   5.232   3.014  -1.810
  383    HG2  LYS  50           HG2      LYS  50   6.983   2.782  -3.523
  384    HG3  LYS  50           HG3      LYS  50   6.637   4.411  -4.127
  385    HD2  LYS  50           HD2      LYS  50   7.174   5.351  -1.881
  386    HD3  LYS  50           HD3      LYS  50   7.560   3.714  -1.312
  387    HE2  LYS  50           HE2      LYS  50   9.404   3.553  -2.908
  388    HE3  LYS  50           HE3      LYS  50   9.009   5.137  -3.589
  389    HZ1  LYS  50           HZ1      LYS  50   9.861   6.202  -1.726
  390    HZ2  LYS  50           HZ2      LYS  50   9.500   4.978  -0.704
  391    HZ3  LYS  50           HZ3      LYS  50  10.805   4.844  -1.663
  392    H    PHE  51           H        PHE  51   3.212   1.103  -2.424
  393    HA   PHE  51           HA       PHE  51   0.465   2.074  -2.265
  394    HB2  PHE  51           HB2      PHE  51   1.809  -0.425  -1.248
  395    HB3  PHE  51           HB3      PHE  51   0.111  -0.061  -0.956
  396    HD1  PHE  51           HD1      PHE  51  -1.537  -0.041  -2.796
  397    HD2  PHE  51           HD2      PHE  51   2.590  -1.050  -3.503
  398    HE1  PHE  51           HE1      PHE  51  -2.135  -0.966  -5.024
  399    HE2  PHE  51           HE2      PHE  51   2.000  -1.930  -5.736
  400    HZ   PHE  51           HZ       PHE  51  -0.360  -1.887  -6.511
  401    HA   PRO  52           HA       PRO  52   1.176   4.029   1.746
  402    HB2  PRO  52           HB2      PRO  52  -1.218   5.271   2.107
  403    HB3  PRO  52           HB3      PRO  52  -0.057   5.781   0.853
  404    HG2  PRO  52           HG2      PRO  52  -2.497   4.023   0.521
  405    HG3  PRO  52           HG3      PRO  52  -1.968   5.396  -0.498
  406    HD2  PRO  52           HD2      PRO  52  -1.446   2.769  -1.125
  407    HD3  PRO  52           HD3      PRO  52  -0.352   4.112  -1.571
  408    H    VAL  53           H        VAL  53  -1.275   1.585   1.289
  409    HA   VAL  53           HA       VAL  53  -1.378   0.853   4.088
  410    HB   VAL  53           HB       VAL  53  -3.864   0.698   4.158
  411   HG11  VAL  53          HG11      VAL  53  -2.835   3.552   3.984
  412   HG12  VAL  53          HG12      VAL  53  -4.248   2.959   4.883
  413   HG13  VAL  53          HG13      VAL  53  -2.620   2.460   5.367
  414   HG21  VAL  53          HG21      VAL  53  -3.820   2.718   1.889
  415   HG22  VAL  53          HG22      VAL  53  -4.300   1.008   1.711
  416   HG23  VAL  53          HG23      VAL  53  -5.237   2.094   2.755
  417    H    ASP  54           H        ASP  54  -3.073  -1.221   4.104
  418    HA   ASP  54           HA       ASP  54  -2.326  -2.859   1.737
  419    HB2  ASP  54           HB2      ASP  54  -2.346  -4.843   3.072
  420    HB3  ASP  54           HB3      ASP  54  -1.139  -3.685   3.619
  421    H    GLY  55           H        GLY  55  -3.846  -4.284   0.855
  422    HA2  GLY  55           HA2      GLY  55  -6.593  -4.459   1.535
  423    HA3  GLY  55           HA3      GLY  55  -6.406  -2.962   0.636
  424    H    ARG  56           H        ARG  56  -7.930  -4.055  -0.807
  425    HA   ARG  56           HA       ARG  56  -6.612  -5.858  -2.797
  426    HB2  ARG  56           HB2      ARG  56  -8.471  -6.837  -1.581
  427    HB3  ARG  56           HB3      ARG  56  -9.530  -5.507  -2.069
  428    HG2  ARG  56           HG2      ARG  56  -9.476  -6.197  -4.376
  429    HG3  ARG  56           HG3      ARG  56  -8.183  -7.361  -4.072
  430    HD2  ARG  56           HD2      ARG  56 -10.427  -8.391  -4.350
  431    HD3  ARG  56           HD3      ARG  56  -9.619  -8.809  -2.834
  432    HE   ARG  56           HE       ARG  56 -11.153  -6.738  -2.000
  433   HH11  ARG  56          HH11      ARG  56 -12.138  -9.554  -3.938
  434   HH12  ARG  56          HH12      ARG  56 -13.620  -9.659  -2.993
  435   HH21  ARG  56          HH21      ARG  56 -13.068  -7.012  -0.998
  436   HH22  ARG  56          HH22      ARG  56 -14.113  -8.361  -1.488
  437    H    VAL  57           H        VAL  57  -6.589  -5.502  -4.896
  438    HA   VAL  57           HA       VAL  57  -7.220  -2.837  -6.024
  439    HB   VAL  57           HB       VAL  57  -5.567  -5.209  -6.994
  440   HG11  VAL  57          HG11      VAL  57  -6.282  -2.658  -8.500
  441   HG12  VAL  57          HG12      VAL  57  -4.984  -3.779  -8.971
  442   HG13  VAL  57          HG13      VAL  57  -6.647  -4.333  -8.985
  443   HG21  VAL  57          HG21      VAL  57  -4.727  -2.325  -6.553
  444   HG22  VAL  57          HG22      VAL  57  -4.492  -3.614  -5.346
  445   HG23  VAL  57          HG23      VAL  57  -3.686  -3.711  -6.917
  446    H    ILE  58           H        ILE  58  -8.931  -2.647  -7.416
  447    HA   ILE  58           HA       ILE  58 -10.062  -5.110  -8.680
  448    HB   ILE  58           HB       ILE  58 -12.399  -4.183  -8.213
  449   HG12  ILE  58          HG12      ILE  58 -11.001  -2.781  -5.905
  450   HG13  ILE  58          HG13      ILE  58 -11.440  -1.924  -7.391
  451   HG21  ILE  58          HG21      ILE  58 -10.884  -5.171  -5.782
  452   HG22  ILE  58          HG22      ILE  58 -12.605  -5.371  -6.147
  453   HG23  ILE  58          HG23      ILE  58 -11.403  -6.205  -7.131
  454   HD11  ILE  58          HD11      ILE  58 -13.825  -2.534  -7.050
  455   HD12  ILE  58          HD12      ILE  58 -13.395  -3.283  -5.491
  456   HD13  ILE  58          HD13      ILE  58 -13.164  -1.542  -5.739
  457    H    GLU  59           H        GLU  59  -8.389  -2.912  -9.706
  458    HA   GLU  59           HA       GLU  59  -9.600  -3.010 -12.269
  459    HB2  GLU  59           HB2      GLU  59 -10.711  -0.864 -11.208
  460    HB3  GLU  59           HB3      GLU  59  -9.132  -0.126 -11.413
  461    HG2  GLU  59           HG2      GLU  59  -9.141  -0.489 -13.788
  462    HG3  GLU  59           HG3      GLU  59 -10.504  -1.605 -13.696
  463    H    GLY  60           H        GLY  60  -7.987  -2.947 -13.806
  464    HA2  GLY  60           HA2      GLY  60  -6.008  -2.315 -14.809
  465    HA3  GLY  60           HA3      GLY  60  -5.480  -1.497 -13.344
  466    H    HIS  61           H        HIS  61  -3.570  -2.590 -14.428
  467    HA   HIS  61           HA       HIS  61  -2.902  -5.095 -13.031
  468    HB2  HIS  61           HB2      HIS  61  -2.089  -6.200 -15.084
  469    HB3  HIS  61           HB3      HIS  61  -3.831  -5.972 -15.055
  470    HD1  HIS  61           HD1      HIS  61  -4.882  -4.490 -16.988
  471    HD2  HIS  61           HD2      HIS  61  -0.674  -4.612 -16.867
  472    HE1  HIS  61           HE1      HIS  61  -4.064  -3.479 -19.191
  473    H    SER  62           H        SER  62  -0.859  -5.261 -12.446
  474    HA   SER  62           HA       SER  62   1.331  -3.873 -13.761
  475    HB2  SER  62           HB2      SER  62   0.426  -2.904 -11.038
  476    HB3  SER  62           HB3      SER  62   2.085  -2.728 -11.559
  477    HG   SER  62           HG       SER  62   0.063  -2.016 -13.347
  478    H    MET  63           H        MET  63   3.463  -4.213 -12.483
  479    HA   MET  63           HA       MET  63   3.405  -6.788 -10.970
  480    HB2  MET  63           HB2      MET  63   4.369  -7.149 -13.169
  481    HB3  MET  63           HB3      MET  63   5.567  -5.872 -12.892
  482    HG2  MET  63           HG2      MET  63   6.640  -7.086 -11.188
  483    HG3  MET  63           HG3      MET  63   5.285  -8.194 -10.955
  484    HE1  MET  63           HE1      MET  63   5.602 -10.837 -13.670
  485    HE2  MET  63           HE2      MET  63   5.028 -10.459 -12.032
  486    HE3  MET  63           HE3      MET  63   4.415  -9.535 -13.428
  487    H    VAL  64           H        VAL  64   4.179  -6.738  -9.010
  488    HA   VAL  64           HA       VAL  64   5.259  -4.160  -8.001
  489    HB   VAL  64           HB       VAL  64   3.396  -6.190  -6.736
  490   HG11  VAL  64          HG11      VAL  64   4.458  -3.577  -5.590
  491   HG12  VAL  64          HG12      VAL  64   3.111  -4.511  -4.925
  492   HG13  VAL  64          HG13      VAL  64   4.728  -5.219  -4.955
  493   HG21  VAL  64          HG21      VAL  64   2.292  -4.778  -8.439
  494   HG22  VAL  64          HG22      VAL  64   1.763  -4.315  -6.817
  495   HG23  VAL  64          HG23      VAL  64   2.950  -3.322  -7.674
  496    H    ASP  65           H        ASP  65   7.016  -4.020  -6.701
  497    HA   ASP  65           HA       ASP  65   8.595  -6.454  -6.192
  498    HB2  ASP  65           HB2      ASP  65   9.572  -4.398  -7.187
  499    HB3  ASP  65           HB3      ASP  65   9.229  -3.520  -5.697
  500    H    GLU  66           H        GLU  66   7.943  -7.595  -4.474
  501    HA   GLU  66           HA       GLU  66   7.286  -6.242  -1.901
  502    HB2  GLU  66           HB2      GLU  66   6.677  -9.086  -2.689
  503    HB3  GLU  66           HB3      GLU  66   6.073  -8.162  -1.295
  504    HG2  GLU  66           HG2      GLU  66   4.862  -6.664  -2.891
  505    HG3  GLU  66           HG3      GLU  66   5.315  -7.765  -4.202
  506    H    SER  67           H        SER  67  10.111  -7.074  -2.972
  507    HA   SER  67           HA       SER  67  10.938  -9.368  -1.596
  508    HB2  SER  67           HB2      SER  67  13.065  -9.010  -2.308
  509    HB3  SER  67           HB3      SER  67  12.151  -8.060  -3.481
  510    HG   SER  67           HG       SER  67  12.677  -6.186  -2.290
  511    H    LEU  68           H        LEU  68  10.640  -6.205  -0.114
  512    HA   LEU  68           HA       LEU  68  12.011  -7.162   2.317
  513    HB2  LEU  68           HB2      LEU  68  12.199  -4.844   1.359
  514    HB3  LEU  68           HB3      LEU  68  10.510  -4.573   1.715
  515    HG   LEU  68           HG       LEU  68  12.012  -3.439   3.228
  516   HD11  LEU  68          HD11      LEU  68  10.651  -5.557   4.913
  517   HD12  LEU  68          HD12      LEU  68  10.982  -3.873   5.301
  518   HD13  LEU  68          HD13      LEU  68   9.769  -4.258   4.069
  519   HD21  LEU  68          HD21      LEU  68  13.907  -4.976   3.282
  520   HD22  LEU  68          HD22      LEU  68  13.366  -4.512   4.904
  521   HD23  LEU  68          HD23      LEU  68  12.959  -6.123   4.260
  522    H    ILE  69           H        ILE  69   8.655  -6.599   1.238
  523    HA   ILE  69           HA       ILE  69   7.571  -6.912   3.922
  524    HB   ILE  69           HB       ILE  69   6.102  -6.779   1.270
  525   HG12  ILE  69          HG12      ILE  69   7.449  -4.720   1.659
  526   HG13  ILE  69          HG13      ILE  69   5.721  -4.450   1.652
  527   HG21  ILE  69          HG21      ILE  69   4.209  -6.010   2.822
  528   HG22  ILE  69          HG22      ILE  69   4.620  -7.725   2.900
  529   HG23  ILE  69          HG23      ILE  69   5.175  -6.621   4.170
  530   HD11  ILE  69          HD11      ILE  69   5.685  -4.316   4.113
  531   HD12  ILE  69          HD12      ILE  69   7.437  -4.600   4.163
  532   HD13  ILE  69          HD13      ILE  69   6.786  -3.129   3.402
  533    H    THR  70           H        THR  70   6.960  -8.891   0.938
  534    HA   THR  70           HA       THR  70   6.227 -11.195   2.657
  535    HB   THR  70           HB       THR  70   5.422 -12.194   0.540
  536    HG1  THR  70           HG1      THR  70   5.292 -10.432  -1.177
  537   HG21  THR  70          HG21      THR  70   4.373  -9.349   0.883
  538   HG22  THR  70          HG22      THR  70   3.518 -10.747   0.204
  539   HG23  THR  70          HG23      THR  70   3.927 -10.721   1.924
  540    H    GLY  71           H        GLY  71   8.991 -10.053   1.124
  541    HA2  GLY  71           HA2      GLY  71  11.129 -10.956   1.201
  542    HA3  GLY  71           HA3      GLY  71  10.480 -12.531   1.674
  543    H    GLU  72           H        GLU  72   9.003 -11.109  -1.051
  544    HA   GLU  72           HA       GLU  72   9.958 -13.230  -2.851
  545    HB2  GLU  72           HB2      GLU  72   7.973 -10.960  -3.239
  546    HB3  GLU  72           HB3      GLU  72   8.302 -12.218  -4.430
  547    HG2  GLU  72           HG2      GLU  72   7.244 -12.773  -1.622
  548    HG3  GLU  72           HG3      GLU  72   6.248 -12.600  -3.069
  549    H    ALA  73           H        ALA  73  11.976 -13.010  -3.711
  550    HA   ALA  73           HA       ALA  73  13.025 -10.399  -4.547
  551    HB1  ALA  73           HB1      ALA  73  14.143 -13.212  -4.881
  552    HB2  ALA  73           HB2      ALA  73  15.019 -11.688  -5.104
  553    HB3  ALA  73           HB3      ALA  73  14.449 -12.146  -3.487
  554    H    MET  74           H        MET  74  11.049 -12.782  -5.890
  555    HA   MET  74           HA       MET  74  11.428 -11.903  -8.708
  556    HB2  MET  74           HB2      MET  74  10.148 -14.301  -7.354
  557    HB3  MET  74           HB3      MET  74   9.668 -13.796  -8.958
  558    HG2  MET  74           HG2      MET  74  11.309 -15.468  -9.265
  559    HG3  MET  74           HG3      MET  74  12.060 -13.936  -9.702
  560    HE1  MET  74           HE1      MET  74  15.151 -15.863  -8.400
  561    HE2  MET  74           HE2      MET  74  13.814 -16.441  -9.423
  562    HE3  MET  74           HE3      MET  74  14.488 -14.811  -9.667
  563    HA   PRO  75           HA       PRO  75   8.152  -9.024  -7.406
  564    HB2  PRO  75           HB2      PRO  75   8.190  -8.617 -10.406
  565    HB3  PRO  75           HB3      PRO  75   7.972  -7.382  -9.119
  566    HG2  PRO  75           HG2      PRO  75  10.392  -7.699 -10.234
  567    HG3  PRO  75           HG3      PRO  75  10.262  -7.621  -8.446
  568    HD2  PRO  75           HD2      PRO  75  10.516 -10.072 -10.218
  569    HD3  PRO  75           HD3      PRO  75  11.385  -9.681  -8.703
  570    H    VAL  76           H        VAL  76   5.920  -8.836  -7.536
  571    HA   VAL  76           HA       VAL  76   4.567 -11.334  -8.455
  572    HB   VAL  76           HB       VAL  76   3.817  -9.449  -6.191
  573   HG11  VAL  76          HG11      VAL  76   2.753 -12.200  -6.987
  574   HG12  VAL  76          HG12      VAL  76   2.345 -11.337  -5.492
  575   HG13  VAL  76          HG13      VAL  76   1.857 -10.664  -7.049
  576   HG21  VAL  76          HG21      VAL  76   5.915 -10.644  -5.648
  577   HG22  VAL  76          HG22      VAL  76   4.573 -11.271  -4.694
  578   HG23  VAL  76          HG23      VAL  76   5.156 -12.189  -6.097
  579    H    ALA  77           H        ALA  77   2.915 -11.261  -9.879
  580    HA   ALA  77           HA       ALA  77   2.167  -8.721 -11.080
  581    HB1  ALA  77           HB1      ALA  77   0.821 -10.146 -12.559
  582    HB2  ALA  77           HB2      ALA  77   2.479 -10.763 -12.413
  583    HB3  ALA  77           HB3      ALA  77   1.153 -11.555 -11.533
  584    H    LYS  78           H        LYS  78   0.298  -7.631 -10.999
  585    HA   LYS  78           HA       LYS  78  -1.909  -8.516  -9.175
  586    HB2  LYS  78           HB2      LYS  78  -1.060  -5.649  -9.711
  587    HB3  LYS  78           HB3      LYS  78  -2.271  -6.199  -8.556
  588    HG2  LYS  78           HG2      LYS  78   0.726  -6.718  -8.386
  589    HG3  LYS  78           HG3      LYS  78  -0.163  -5.483  -7.505
  590    HD2  LYS  78           HD2      LYS  78  -1.399  -7.205  -6.251
  591    HD3  LYS  78           HD3      LYS  78  -0.594  -8.488  -7.175
  592    HE2  LYS  78           HE2      LYS  78   1.611  -7.742  -6.362
  593    HE3  LYS  78           HE3      LYS  78   0.855  -6.423  -5.455
  594    HZ1  LYS  78           HZ1      LYS  78  -0.325  -8.106  -4.136
  595    HZ2  LYS  78           HZ2      LYS  78   0.372  -9.308  -4.974
  596    HZ3  LYS  78           HZ3      LYS  78   1.310  -8.327  -4.028
  597    H    LYS  79           H        LYS  79  -3.969  -8.007  -9.753
  598    HA   LYS  79           HA       LYS  79  -4.739  -7.096 -12.470
  599    HB2  LYS  79           HB2      LYS  79  -5.124  -9.909 -11.309
  600    HB3  LYS  79           HB3      LYS  79  -6.074  -9.315 -12.655
  601    HG2  LYS  79           HG2      LYS  79  -3.881  -8.871 -13.894
  602    HG3  LYS  79           HG3      LYS  79  -3.079  -9.794 -12.617
  603    HD2  LYS  79           HD2      LYS  79  -5.225 -10.804 -14.531
  604    HD3  LYS  79           HD3      LYS  79  -3.504 -11.205 -14.543
  605    HE2  LYS  79           HE2      LYS  79  -3.856 -12.134 -12.163
  606    HE3  LYS  79           HE3      LYS  79  -5.594 -11.971 -12.468
  607    HZ1  LYS  79           HZ1      LYS  79  -5.266 -13.466 -14.423
  608    HZ2  LYS  79           HZ2      LYS  79  -3.688 -13.642 -14.033
  609    HZ3  LYS  79           HZ3      LYS  79  -4.828 -14.202 -13.016
  610    HA   PRO  80           HA       PRO  80  -8.477  -5.939 -10.147
  611    HB2  PRO  80           HB2      PRO  80 -10.616  -6.883 -11.634
  612    HB3  PRO  80           HB3      PRO  80  -9.694  -5.402 -12.029
  613    HG2  PRO  80           HG2      PRO  80  -9.311  -8.189 -13.170
  614    HG3  PRO  80           HG3      PRO  80  -9.431  -6.634 -14.055
  615    HD2  PRO  80           HD2      PRO  80  -7.029  -7.720 -13.533
  616    HD3  PRO  80           HD3      PRO  80  -7.273  -5.966 -13.349
  617    H    GLY  81           H        GLY  81  -9.113  -6.945  -8.303
  618    HA2  GLY  81           HA2      GLY  81  -9.743  -8.640  -6.830
  619    HA3  GLY  81           HA3      GLY  81  -9.795  -9.817  -8.142
  620    H    SER  82           H        SER  82  -7.262  -7.651  -6.774
  621    HA   SER  82           HA       SER  82  -5.571 -10.028  -6.073
  622    HB2  SER  82           HB2      SER  82  -5.000  -9.004  -8.317
  623    HB3  SER  82           HB3      SER  82  -4.516  -7.540  -7.445
  624    HG   SER  82           HG       SER  82  -3.464 -10.188  -7.180
  625    H    THR  83           H        THR  83  -4.264  -9.736  -4.161
  626    HA   THR  83           HA       THR  83  -5.003  -7.307  -2.611
  627    HB   THR  83           HB       THR  83  -4.228  -8.537  -0.621
  628    HG1  THR  83           HG1      THR  83  -3.939 -10.691  -0.745
  629   HG21  THR  83          HG21      THR  83  -6.621  -8.438  -1.218
  630   HG22  THR  83          HG22      THR  83  -6.444  -9.907  -2.210
  631   HG23  THR  83          HG23      THR  83  -6.206  -9.974  -0.449
  632    H    VAL  84           H        VAL  84  -3.594  -6.059  -1.555
  633    HA   VAL  84           HA       VAL  84  -0.727  -6.178  -2.337
  634    HB   VAL  84           HB       VAL  84  -0.813  -3.716  -2.709
  635   HG11  VAL  84          HG11      VAL  84  -2.602  -5.332  -4.572
  636   HG12  VAL  84          HG12      VAL  84  -1.759  -3.819  -4.961
  637   HG13  VAL  84          HG13      VAL  84  -0.824  -5.273  -4.597
  638   HG21  VAL  84          HG21      VAL  84  -2.941  -3.202  -1.502
  639   HG22  VAL  84          HG22      VAL  84  -2.916  -2.580  -3.156
  640   HG23  VAL  84          HG23      VAL  84  -3.844  -4.040  -2.785
  641    H    ILE  85           H        ILE  85   0.680  -4.940  -1.089
  642    HA   ILE  85           HA       ILE  85  -0.240  -4.172   1.624
  643    HB   ILE  85           HB       ILE  85   2.117  -5.085   2.362
  644   HG12  ILE  85          HG12      ILE  85   2.640  -7.304   1.434
  645   HG13  ILE  85          HG13      ILE  85   1.440  -7.104   0.168
  646   HG21  ILE  85          HG21      ILE  85  -0.328  -6.849   2.026
  647   HG22  ILE  85          HG22      ILE  85   1.034  -7.147   3.127
  648   HG23  ILE  85          HG23      ILE  85   0.015  -5.731   3.371
  649   HD11  ILE  85          HD11      ILE  85   3.843  -5.270   0.534
  650   HD12  ILE  85          HD12      ILE  85   3.798  -6.675  -0.559
  651   HD13  ILE  85          HD13      ILE  85   2.708  -5.304  -0.825
  652    H    ALA  86           H        ALA  86   0.842  -2.575   2.682
  653    HA   ALA  86           HA       ALA  86   1.619  -0.429   1.052
  654    HB1  ALA  86           HB1      ALA  86   0.564  -0.182   3.243
  655    HB2  ALA  86           HB2      ALA  86   2.001  -0.824   4.035
  656    HB3  ALA  86           HB3      ALA  86   2.077   0.733   3.178
  657    H    GLY  87           H        GLY  87   3.548   0.745   0.823
  658    HA2  GLY  87           HA2      GLY  87   5.831   1.146   0.707
  659    HA3  GLY  87           HA3      GLY  87   6.108  -0.171   1.859
  660    H    SER  88           H        SER  88   4.373  -1.600  -0.573
  661    HA   SER  88           HA       SER  88   6.776  -2.588  -1.978
  662    HB2  SER  88           HB2      SER  88   5.314  -4.087  -3.132
  663    HB3  SER  88           HB3      SER  88   5.075  -4.219  -1.395
  664    HG   SER  88           HG       SER  88   3.108  -3.150  -1.582
  665    H    ILE  89           H        ILE  89   6.984  -2.384  -4.313
  666    HA   ILE  89           HA       ILE  89   6.148   0.368  -5.122
  667    HB   ILE  89           HB       ILE  89   8.497  -0.972  -6.393
  668   HG12  ILE  89          HG12      ILE  89   9.031  -1.377  -4.040
  669   HG13  ILE  89          HG13      ILE  89  10.106  -0.231  -4.805
  670   HG21  ILE  89          HG21      ILE  89   7.699   1.180  -7.240
  671   HG22  ILE  89          HG22      ILE  89   7.806   1.907  -5.629
  672   HG23  ILE  89          HG23      ILE  89   9.279   1.396  -6.481
  673   HD11  ILE  89          HD11      ILE  89   9.519   0.404  -2.482
  674   HD12  ILE  89          HD12      ILE  89   9.070   1.642  -3.656
  675   HD13  ILE  89          HD13      ILE  89   7.820   0.582  -2.960
  676    H    ASN  90           H        ASN  90   5.121   0.729  -6.987
  677    HA   ASN  90           HA       ASN  90   4.084  -1.595  -8.464
  678    HB2  ASN  90           HB2      ASN  90   2.629   0.227  -7.437
  679    HB3  ASN  90           HB3      ASN  90   3.314   1.357  -8.609
  680   HD21  ASN  90          HD22      ASN  90   1.649   1.719 -10.077
  681   HD22  ASN  90          HD21      ASN  90   0.839   0.392 -10.898
  682    H    GLN  91           H        GLN  91   4.061  -1.808 -10.794
  683    HA   GLN  91           HA       GLN  91   5.483   0.159 -12.451
  684    HB2  GLN  91           HB2      GLN  91   7.051  -1.818 -11.353
  685    HB3  GLN  91           HB3      GLN  91   6.478  -2.655 -12.767
  686    HG2  GLN  91           HG2      GLN  91   8.493  -1.726 -13.464
  687    HG3  GLN  91           HG3      GLN  91   7.324  -0.579 -14.109
  688   HE21  GLN  91          HE22      GLN  91   7.312   1.574 -13.215
  689   HE22  GLN  91          HE21      GLN  91   8.563   2.116 -12.105
  690    H    ASN  92           H        ASN  92   4.523   0.239 -14.469
  691    HA   ASN  92           HA       ASN  92   4.131  -0.571 -16.526
  692    HB2  ASN  92           HB2      ASN  92   4.643  -2.912 -16.054
  693    HB3  ASN  92           HB3      ASN  92   3.003  -3.139 -15.433
  694   HD21  ASN  92          HD22      ASN  92   1.866  -4.329 -16.907
  695   HD22  ASN  92          HD21      ASN  92   1.770  -3.886 -18.607
  696    H    GLY  93           H        GLY  93   1.740  -0.112 -13.968
  697    HA2  GLY  93           HA2      GLY  93  -0.064   1.098 -15.922
  698    HA3  GLY  93           HA3      GLY  93  -0.636  -0.402 -15.212
  699    H    SER  94           H        SER  94  -2.262   1.539 -14.759
  700    HA   SER  94           HA       SER  94  -1.720   2.566 -12.004
  701    HB2  SER  94           HB2      SER  94  -1.703   4.373 -13.666
  702    HB3  SER  94           HB3      SER  94  -3.346   3.941 -14.164
  703    HG   SER  94           HG       SER  94  -2.718   4.511 -11.446
  704    H    LEU  95           H        LEU  95  -3.057   1.986 -10.483
  705    HA   LEU  95           HA       LEU  95  -5.456   0.316 -11.177
  706    HB2  LEU  95           HB2      LEU  95  -3.898  -0.194  -8.694
  707    HB3  LEU  95           HB3      LEU  95  -4.729  -1.320  -9.717
  708    HG   LEU  95           HG       LEU  95  -1.990  -0.107 -10.323
  709   HD11  LEU  95          HD11      LEU  95  -1.076  -2.224  -9.566
  710   HD12  LEU  95          HD12      LEU  95  -1.995  -1.474  -8.260
  711   HD13  LEU  95          HD13      LEU  95  -2.700  -2.831  -9.169
  712   HD21  LEU  95          HD21      LEU  95  -1.815  -1.924 -11.930
  713   HD22  LEU  95          HD22      LEU  95  -3.420  -2.533 -11.461
  714   HD23  LEU  95          HD23      LEU  95  -3.261  -0.978 -12.311
  715    H    LEU  96           H        LEU  96  -6.994   0.004  -9.496
  716    HA   LEU  96           HA       LEU  96  -7.285   2.295  -7.576
  717    HB2  LEU  96           HB2      LEU  96  -9.335   0.779  -9.220
  718    HB3  LEU  96           HB3      LEU  96  -9.770   1.575  -7.720
  719    HG   LEU  96           HG       LEU  96  -9.057   3.747  -8.559
  720   HD11  LEU  96          HD11      LEU  96  -7.350   3.335 -10.209
  721   HD12  LEU  96          HD12      LEU  96  -8.420   2.258 -11.141
  722   HD13  LEU  96          HD13      LEU  96  -8.725   3.998 -11.086
  723   HD21  LEU  96          HD21      LEU  96 -11.381   2.981  -8.895
  724   HD22  LEU  96          HD22      LEU  96 -10.845   4.068 -10.191
  725   HD23  LEU  96          HD23      LEU  96 -10.917   2.313 -10.474
  726    H    ILE  97           H        ILE  97  -6.941   1.734  -5.560
  727    HA   ILE  97           HA       ILE  97  -7.428  -1.052  -4.632
  728    HB   ILE  97           HB       ILE  97  -6.067   1.149  -3.043
  729   HG12  ILE  97          HG12      ILE  97  -3.929  -0.210  -3.600
  730   HG13  ILE  97          HG13      ILE  97  -4.798  -0.765  -5.024
  731   HG21  ILE  97          HG21      ILE  97  -5.929  -1.895  -2.876
  732   HG22  ILE  97          HG22      ILE  97  -5.164  -0.742  -1.770
  733   HG23  ILE  97          HG23      ILE  97  -6.924  -0.865  -1.818
  734   HD11  ILE  97          HD11      ILE  97  -4.848   1.512  -5.913
  735   HD12  ILE  97          HD12      ILE  97  -4.300   2.172  -4.349
  736   HD13  ILE  97          HD13      ILE  97  -3.221   1.171  -5.331
  737    H    CYS  98           H        CYS  98  -9.268  -1.488  -3.531
  738    HA   CYS  98           HA       CYS  98 -10.861   0.725  -2.368
  739    HB2  CYS  98           HB2      CYS  98 -12.539  -0.979  -1.884
  740    HB3  CYS  98           HB3      CYS  98 -12.099  -0.917  -3.590
  741    HG   CYS  98           HG       CYS  98 -10.230  -2.958  -3.259
  742    H    ALA  99           H        ALA  99 -10.178   1.573  -0.480
  743    HA   ALA  99           HA       ALA  99  -8.364   0.044   1.179
  744    HB1  ALA  99           HB1      ALA  99  -9.569   2.815   1.530
  745    HB2  ALA  99           HB2      ALA  99  -8.246   2.118   2.495
  746    HB3  ALA  99           HB3      ALA  99  -8.015   2.409   0.761
  747    H    THR 100           H        THR 100  -9.018  -1.460   2.492
  748    HA   THR 100           HA       THR 100 -11.519  -1.133   4.097
  749    HB   THR 100           HB       THR 100 -11.225  -3.034   2.400
  750    HG1  THR 100           HG1      THR 100 -12.539  -4.205   3.487
  751   HG21  THR 100          HG21      THR 100 -10.174  -5.075   3.170
  752   HG22  THR 100          HG22      THR 100  -8.952  -3.793   3.124
  753   HG23  THR 100          HG23      THR 100  -9.651  -4.306   4.677
  754    H    HIS 101           H        HIS 101  -8.220  -0.780   4.458
  755    HA   HIS 101           HA       HIS 101  -8.345  -1.053   7.409
  756    HB2  HIS 101           HB2      HIS 101  -6.094  -1.860   5.516
  757    HB3  HIS 101           HB3      HIS 101  -5.981  -1.881   7.255
  758    HD1  HIS 101           HD1      HIS 101  -5.789  -4.338   5.065
  759    HD2  HIS 101           HD2      HIS 101  -8.532  -3.543   8.126
  760    HE1  HIS 101           HE1      HIS 101  -6.887  -6.577   5.609
  761    H    VAL 102           H        VAL 102  -7.390   0.676   8.454
  762    HA   VAL 102           HA       VAL 102  -6.294   2.943   6.891
  763    HB   VAL 102           HB       VAL 102  -6.309   4.156   9.018
  764   HG11  VAL 102          HG11      VAL 102  -8.961   2.797   8.458
  765   HG12  VAL 102          HG12      VAL 102  -8.684   4.399   9.176
  766   HG13  VAL 102          HG13      VAL 102  -8.230   4.095   7.482
  767   HG21  VAL 102          HG21      VAL 102  -5.976   2.261  10.602
  768   HG22  VAL 102          HG22      VAL 102  -7.387   3.251  11.000
  769   HG23  VAL 102          HG23      VAL 102  -7.614   1.684  10.208
  770    H    GLY 103           H        GLY 103  -4.338   4.127   8.415
  771    HA2  GLY 103           HA2      GLY 103  -2.045   2.553   7.587
  772    HA3  GLY 103           HA3      GLY 103  -2.025   4.072   8.442
  773    H    ALA 104           H        ALA 104  -3.497   3.392  10.779
  774    HA   ALA 104           HA       ALA 104  -1.648   1.987  12.436
  775    HB1  ALA 104           HB1      ALA 104  -3.602   2.024  14.040
  776    HB2  ALA 104           HB2      ALA 104  -3.275   3.597  13.282
  777    HB3  ALA 104           HB3      ALA 104  -4.630   2.590  12.717
  778    H    ASP 105           H        ASP 105  -4.285   0.822  10.505
  779    HA   ASP 105           HA       ASP 105  -4.453  -1.893  11.571
  780    HB2  ASP 105           HB2      ASP 105  -6.312  -0.341  10.673
  781    HB3  ASP 105           HB3      ASP 105  -5.781  -0.859   9.092
  782    H    THR 106           H        THR 106  -2.108  -0.427   9.655
  783    HA   THR 106           HA       THR 106  -1.889  -2.390   7.567
  784    HB   THR 106           HB       THR 106   0.360  -1.487   7.098
  785    HG1  THR 106           HG1      THR 106  -0.220   0.455   9.029
  786   HG21  THR 106          HG21      THR 106  -1.942   0.438   7.258
  787   HG22  THR 106          HG22      THR 106  -0.410   0.774   6.407
  788   HG23  THR 106          HG23      THR 106  -1.448  -0.581   5.907
  789    H    THR 107           H        THR 107  -0.684  -4.191   7.298
  790    HA   THR 107           HA       THR 107   0.283  -5.637   9.532
  791    HB   THR 107           HB       THR 107  -0.434  -6.637   7.403
  792    HG1  THR 107           HG1      THR 107   0.875  -8.302   7.622
  793   HG21  THR 107          HG21      THR 107   1.073  -6.927   5.555
  794   HG22  THR 107          HG22      THR 107   0.831  -5.189   5.796
  795   HG23  THR 107          HG23      THR 107   2.339  -5.976   6.345
  796    H    LEU 108           H        LEU 108   2.053  -3.397   7.435
  797    HA   LEU 108           HA       LEU 108   4.713  -3.820   8.332
  798    HB2  LEU 108           HB2      LEU 108   3.184  -1.290   7.573
  799    HB3  LEU 108           HB3      LEU 108   4.892  -1.277   7.979
  800    HG   LEU 108           HG       LEU 108   5.460  -2.655   6.053
  801   HD11  LEU 108          HD11      LEU 108   2.477  -2.589   5.444
  802   HD12  LEU 108          HD12      LEU 108   3.751  -3.014   4.274
  803   HD13  LEU 108          HD13      LEU 108   3.513  -4.035   5.684
  804   HD21  LEU 108          HD21      LEU 108   5.340  -0.229   5.895
  805   HD22  LEU 108          HD22      LEU 108   4.834  -0.943   4.360
  806   HD23  LEU 108          HD23      LEU 108   3.617  -0.308   5.512
  807    H    SER 109           H        SER 109   2.154  -1.723   9.733
  808    HA   SER 109           HA       SER 109   3.702  -0.851  12.000
  809    HB2  SER 109           HB2      SER 109   0.677  -1.015  11.680
  810    HB3  SER 109           HB3      SER 109   1.559  -0.141  12.941
  811    HG   SER 109           HG       SER 109   1.430   0.383  10.167
  812    H    GLN 110           H        GLN 110   1.642  -3.687  11.370
  813    HA   GLN 110           HA       GLN 110   1.513  -4.523  14.155
  814    HB2  GLN 110           HB2      GLN 110  -0.128  -5.206  12.388
  815    HB3  GLN 110           HB3      GLN 110   1.092  -6.232  11.679
  816    HG2  GLN 110           HG2      GLN 110  -0.157  -7.692  12.995
  817    HG3  GLN 110           HG3      GLN 110   1.291  -7.423  13.958
  818   HE21  GLN 110          HE22      GLN 110  -2.108  -6.476  13.506
  819   HE22  GLN 110          HE21      GLN 110  -2.280  -5.793  15.126
  820    H    ILE 111           H        ILE 111   3.678  -5.388  11.458
  821    HA   ILE 111           HA       ILE 111   5.211  -7.391  12.771
  822    HB   ILE 111           HB       ILE 111   5.897  -5.421  10.558
  823   HG12  ILE 111          HG12      ILE 111   5.470  -8.435  10.373
  824   HG13  ILE 111          HG13      ILE 111   4.131  -7.309  10.253
  825   HG21  ILE 111          HG21      ILE 111   7.576  -7.784  11.522
  826   HG22  ILE 111          HG22      ILE 111   7.878  -6.853  10.044
  827   HG23  ILE 111          HG23      ILE 111   8.037  -6.071  11.606
  828   HD11  ILE 111          HD11      ILE 111   5.233  -6.199   8.305
  829   HD12  ILE 111          HD12      ILE 111   6.507  -7.444   8.355
  830   HD13  ILE 111          HD13      ILE 111   4.828  -7.903   8.030
  831    H    VAL 112           H        VAL 112   5.942  -3.849  12.510
  832    HA   VAL 112           HA       VAL 112   8.090  -4.063  14.396
  833    HB   VAL 112           HB       VAL 112   8.300  -1.712  14.407
  834   HG11  VAL 112          HG11      VAL 112   8.691  -1.321  12.106
  835   HG12  VAL 112          HG12      VAL 112   8.972  -3.050  12.372
  836   HG13  VAL 112          HG13      VAL 112   7.468  -2.508  11.600
  837   HG21  VAL 112          HG21      VAL 112   5.946  -0.959  14.583
  838   HG22  VAL 112          HG22      VAL 112   6.755  -0.198  13.212
  839   HG23  VAL 112          HG23      VAL 112   5.635  -1.545  12.933
  840    H    LYS 113           H        LYS 113   4.647  -3.474  14.957
  841    HA   LYS 113           HA       LYS 113   4.812  -2.650  17.721
  842    HB2  LYS 113           HB2      LYS 113   2.719  -4.106  16.066
  843    HB3  LYS 113           HB3      LYS 113   2.520  -3.937  17.806
  844    HG2  LYS 113           HG2      LYS 113   2.385  -1.574  17.704
  845    HG3  LYS 113           HG3      LYS 113   3.037  -1.522  16.076
  846    HD2  LYS 113           HD2      LYS 113   0.637  -1.044  16.087
  847    HD3  LYS 113           HD3      LYS 113   1.045  -2.463  15.110
  848    HE2  LYS 113           HE2      LYS 113   0.390  -3.964  16.871
  849    HE3  LYS 113           HE3      LYS 113   0.105  -2.606  17.977
  850    HZ1  LYS 113           HZ1      LYS 113  -1.391  -2.925  15.432
  851    HZ2  LYS 113           HZ2      LYS 113  -1.946  -3.538  16.851
  852    HZ3  LYS 113           HZ3      LYS 113  -1.740  -1.910  16.673
  853    H    LEU 114           H        LEU 114   4.597  -5.889  16.242
  854    HA   LEU 114           HA       LEU 114   4.843  -7.348  18.674
  855    HB2  LEU 114           HB2      LEU 114   5.028  -7.902  15.729
  856    HB3  LEU 114           HB3      LEU 114   5.746  -9.104  16.783
  857    HG   LEU 114           HG       LEU 114   2.883  -8.117  16.885
  858   HD11  LEU 114          HD11      LEU 114   4.042 -10.748  15.879
  859   HD12  LEU 114          HD12      LEU 114   2.313 -10.328  15.961
  860   HD13  LEU 114          HD13      LEU 114   3.388  -9.440  14.869
  861   HD21  LEU 114          HD21      LEU 114   3.490  -8.917  19.114
  862   HD22  LEU 114          HD22      LEU 114   2.565 -10.198  18.336
  863   HD23  LEU 114          HD23      LEU 114   4.334 -10.321  18.433
  864    H    VAL 115           H        VAL 115   7.403  -6.252  16.445
  865    HA   VAL 115           HA       VAL 115   9.558  -7.617  17.888
  866    HB   VAL 115           HB       VAL 115   9.604  -5.236  15.995
  867   HG11  VAL 115          HG11      VAL 115  11.917  -6.731  17.302
  868   HG12  VAL 115          HG12      VAL 115  12.092  -5.716  15.862
  869   HG13  VAL 115          HG13      VAL 115  11.572  -4.989  17.385
  870   HG21  VAL 115          HG21      VAL 115   9.012  -7.439  14.981
  871   HG22  VAL 115          HG22      VAL 115  10.578  -6.851  14.418
  872   HG23  VAL 115          HG23      VAL 115  10.501  -8.133  15.646
  873    H    GLU 116           H        GLU 116   8.338  -4.319  17.936
  874    HA   GLU 116           HA       GLU 116   9.956  -3.250  19.968
  875    HB2  GLU 116           HB2      GLU 116   8.446  -2.042  18.408
  876    HB3  GLU 116           HB3      GLU 116   7.059  -2.522  19.368
  877    HG2  GLU 116           HG2      GLU 116   9.405  -0.802  20.247
  878    HG3  GLU 116           HG3      GLU 116   7.854  -0.184  19.704
  879    H    GLU 117           H        GLU 117   6.905  -5.124  20.436
  880    HA   GLU 117           HA       GLU 117   6.808  -4.791  23.303
  881    HB2  GLU 117           HB2      GLU 117   5.653  -6.818  21.354
  882    HB3  GLU 117           HB3      GLU 117   5.308  -6.856  23.081
  883    HG2  GLU 117           HG2      GLU 117   4.791  -4.313  21.528
  884    HG3  GLU 117           HG3      GLU 117   3.665  -5.663  21.438
  885    H    ALA 118           H        ALA 118   8.674  -6.953  21.285
  886    HA   ALA 118           HA       ALA 118   8.872  -9.135  23.152
  887    HB1  ALA 118           HB1      ALA 118   9.249  -9.347  20.717
  888    HB2  ALA 118           HB2      ALA 118  10.757  -8.418  20.867
  889    HB3  ALA 118           HB3      ALA 118  10.604  -9.997  21.661
  890    H    GLN 119           H        GLN 119  11.204  -6.508  22.453
  891    HA   GLN 119           HA       GLN 119  13.034  -6.824  24.461
  892    HB2  GLN 119           HB2      GLN 119  11.836  -4.308  23.222
  893    HB3  GLN 119           HB3      GLN 119  13.148  -4.264  24.359
  894    HG2  GLN 119           HG2      GLN 119  14.409  -4.219  22.511
  895    HG3  GLN 119           HG3      GLN 119  14.315  -5.980  22.739
  896   HE21  GLN 119          HE22      GLN 119  12.982  -7.212  21.374
  897   HE22  GLN 119          HE21      GLN 119  11.863  -6.373  20.288
  Start of MODEL   26
    1    H    SER   1           H        SER   1  18.436  -6.376  12.510
    2    HA   SER   1           HA       SER   1  17.114  -4.582  14.284
    3    HB2  SER   1           HB2      SER   1  19.350  -3.566  14.635
    4    HB3  SER   1           HB3      SER   1  19.404  -5.329  14.720
    5    HG   SER   1           HG       SER   1  21.042  -4.100  13.431
    6    H    GLU   2           H        GLU   2  18.638  -3.839  11.124
    7    HA   GLU   2           HA       GLU   2  17.854  -1.026  11.276
    8    HB2  GLU   2           HB2      GLU   2  19.960  -1.845  10.360
    9    HB3  GLU   2           HB3      GLU   2  19.134  -2.672   9.059
   10    HG2  GLU   2           HG2      GLU   2  18.750   0.315   9.452
   11    HG3  GLU   2           HG3      GLU   2  20.263  -0.273   8.782
   12    H    ALA   3           H        ALA   3  16.525  -3.928   9.823
   13    HA   ALA   3           HA       ALA   3  14.561  -2.698   8.121
   14    HB1  ALA   3           HB1      ALA   3  15.241  -5.065   7.943
   15    HB2  ALA   3           HB2      ALA   3  14.517  -5.399   9.532
   16    HB3  ALA   3           HB3      ALA   3  13.491  -4.901   8.173
   17    H    LEU   4           H        LEU   4  14.446  -3.730  11.533
   18    HA   LEU   4           HA       LEU   4  11.817  -3.102  12.143
   19    HB2  LEU   4           HB2      LEU   4  13.717  -4.078  13.662
   20    HB3  LEU   4           HB3      LEU   4  14.065  -2.405  14.066
   21    HG   LEU   4           HG       LEU   4  11.541  -2.230  14.737
   22   HD11  LEU   4          HD11      LEU   4  11.961  -5.241  14.734
   23   HD12  LEU   4          HD12      LEU   4  10.548  -4.390  15.414
   24   HD13  LEU   4          HD13      LEU   4  10.851  -4.368  13.665
   25   HD21  LEU   4          HD21      LEU   4  13.359  -2.268  16.408
   26   HD22  LEU   4          HD22      LEU   4  11.933  -3.163  16.957
   27   HD23  LEU   4          HD23      LEU   4  13.365  -4.046  16.368
   28    H    ALA   5           H        ALA   5  14.397  -0.733  11.714
   29    HA   ALA   5           HA       ALA   5  12.669   1.543  12.452
   30    HB1  ALA   5           HB1      ALA   5  15.476   1.430  11.250
   31    HB2  ALA   5           HB2      ALA   5  14.628   2.895  11.789
   32    HB3  ALA   5           HB3      ALA   5  15.076   1.647  12.966
   33    H    LYS   6           H        LYS   6  13.954  -0.051   9.519
   34    HA   LYS   6           HA       LYS   6  13.136   1.872   7.614
   35    HB2  LYS   6           HB2      LYS   6  14.741  -0.153   7.390
   36    HB3  LYS   6           HB3      LYS   6  13.300  -1.107   7.029
   37    HG2  LYS   6           HG2      LYS   6  12.833   0.323   5.068
   38    HG3  LYS   6           HG3      LYS   6  14.172   1.398   5.517
   39    HD2  LYS   6           HD2      LYS   6  15.752  -0.552   5.261
   40    HD3  LYS   6           HD3      LYS   6  14.403  -1.515   4.626
   41    HE2  LYS   6           HE2      LYS   6  14.117   0.093   2.765
   42    HE3  LYS   6           HE3      LYS   6  15.367   1.133   3.460
   43    HZ1  LYS   6           HZ1      LYS   6  16.365  -0.177   1.721
   44    HZ2  LYS   6           HZ2      LYS   6  16.937  -0.774   3.146
   45    HZ3  LYS   6           HZ3      LYS   6  15.803  -1.586   2.323
   46    H    LEU   7           H        LEU   7  11.254  -0.855   8.956
   47    HA   LEU   7           HA       LEU   7   8.969  -0.625   7.284
   48    HB2  LEU   7           HB2      LEU   7   9.513  -1.634  10.063
   49    HB3  LEU   7           HB3      LEU   7   7.842  -1.314   9.648
   50    HG   LEU   7           HG       LEU   7   8.353  -3.646   9.358
   51   HD11  LEU   7          HD11      LEU   7   7.464  -4.014   7.146
   52   HD12  LEU   7          HD12      LEU   7   6.675  -2.606   7.878
   53   HD13  LEU   7          HD13      LEU   7   7.920  -2.387   6.621
   54   HD21  LEU   7          HD21      LEU   7  10.705  -3.610   8.792
   55   HD22  LEU   7          HD22      LEU   7   9.801  -4.467   7.538
   56   HD23  LEU   7          HD23      LEU   7  10.360  -2.810   7.238
   57    H    ILE   8           H        ILE   8   9.833   1.411  10.093
   58    HA   ILE   8           HA       ILE   8   7.338   2.929   9.962
   59    HB   ILE   8           HB       ILE   8   9.973   3.486  11.353
   60   HG12  ILE   8          HG12      ILE   8   8.823   1.512  12.237
   61   HG13  ILE   8          HG13      ILE   8   8.851   2.831  13.394
   62   HG21  ILE   8          HG21      ILE   8   7.341   4.988  11.466
   63   HG22  ILE   8          HG22      ILE   8   8.622   5.138  12.692
   64   HG23  ILE   8          HG23      ILE   8   8.934   5.623  11.022
   65   HD11  ILE   8          HD11      ILE   8   6.448   3.331  12.838
   66   HD12  ILE   8          HD12      ILE   8   6.449   1.921  11.748
   67   HD13  ILE   8          HD13      ILE   8   6.705   1.709  13.484
   68    H    SER   9           H        SER   9  10.602   3.273   8.560
   69    HA   SER   9           HA       SER   9  10.231   5.924   7.473
   70    HB2  SER   9           HB2      SER   9  12.076   3.702   6.533
   71    HB3  SER   9           HB3      SER   9  12.215   5.429   6.161
   72    HG   SER   9           HG       SER   9  13.539   4.570   7.959
   73    H    LEU  10           H        LEU  10   9.245   2.731   6.408
   74    HA   LEU  10           HA       LEU  10   8.620   3.388   3.657
   75    HB2  LEU  10           HB2      LEU  10   8.155   1.087   5.567
   76    HB3  LEU  10           HB3      LEU  10   7.306   1.113   4.036
   77    HG   LEU  10           HG       LEU  10  10.324   1.478   4.076
   78   HD11  LEU  10          HD11      LEU  10   8.792  -1.160   4.068
   79   HD12  LEU  10          HD12      LEU  10  10.521  -0.955   3.686
   80   HD13  LEU  10          HD13      LEU  10   9.935  -0.595   5.311
   81   HD21  LEU  10          HD21      LEU  10  10.131   0.498   1.842
   82   HD22  LEU  10          HD22      LEU  10   8.399   0.208   2.083
   83   HD23  LEU  10          HD23      LEU  10   9.016   1.877   1.968
   84    H    GLN  11           H        GLN  11   6.900   4.155   6.606
   85    HA   GLN  11           HA       GLN  11   4.235   3.887   5.433
   86    HB2  GLN  11           HB2      GLN  11   5.222   5.051   8.044
   87    HB3  GLN  11           HB3      GLN  11   3.550   5.167   7.500
   88    HG2  GLN  11           HG2      GLN  11   3.298   2.775   7.427
   89    HG3  GLN  11           HG3      GLN  11   5.006   2.490   7.757
   90   HE21  GLN  11          HE22      GLN  11   1.930   2.771   9.239
   91   HE22  GLN  11          HE21      GLN  11   2.558   3.132  10.846
   92    H    ALA  12           H        ALA  12   2.867   5.509   4.759
   93    HA   ALA  12           HA       ALA  12   4.183   7.769   3.447
   94    HB1  ALA  12           HB1      ALA  12   1.978   7.995   2.329
   95    HB2  ALA  12           HB2      ALA  12   2.605   6.338   2.238
   96    HB3  ALA  12           HB3      ALA  12   1.315   6.741   3.394
   97    H    THR  13           H        THR  13   3.527   9.989   3.596
   98    HA   THR  13           HA       THR  13   2.279  10.843   6.155
   99    HB   THR  13           HB       THR  13   2.883  13.143   5.294
  100    HG1  THR  13           HG1      THR  13   4.241  13.233   3.554
  101   HG21  THR  13          HG21      THR  13   5.315  12.880   5.649
  102   HG22  THR  13          HG22      THR  13   4.370  12.009   6.868
  103   HG23  THR  13          HG23      THR  13   5.139  11.114   5.541
  104    H    GLU  14           H        GLU  14   1.530  10.773   2.720
  105    HA   GLU  14           HA       GLU  14  -1.174  11.899   3.194
  106    HB2  GLU  14           HB2      GLU  14  -0.898  13.264   1.125
  107    HB3  GLU  14           HB3      GLU  14   0.133  13.796   2.454
  108    HG2  GLU  14           HG2      GLU  14   2.084  12.896   1.389
  109    HG3  GLU  14           HG3      GLU  14   1.114  11.944   0.267
  110    H    ALA  15           H        ALA  15  -2.666  11.596   1.407
  111    HA   ALA  15           HA       ALA  15  -2.038   9.440  -0.526
  112    HB1  ALA  15           HB1      ALA  15  -4.366   9.299   1.436
  113    HB2  ALA  15           HB2      ALA  15  -4.060   8.159   0.105
  114    HB3  ALA  15           HB3      ALA  15  -2.915   8.271   1.457
  115    H    THR  16           H        THR  16  -3.581   9.243  -2.260
  116    HA   THR  16           HA       THR  16  -5.068  11.760  -2.826
  117    HB   THR  16           HB       THR  16  -4.143   9.674  -4.799
  118    HG1  THR  16           HG1      THR  16  -2.998  11.877  -5.339
  119   HG21  THR  16          HG21      THR  16  -5.300  12.454  -5.284
  120   HG22  THR  16          HG22      THR  16  -4.738  11.296  -6.516
  121   HG23  THR  16          HG23      THR  16  -6.167  10.929  -5.570
  122    H    ILE  17           H        ILE  17  -7.260  11.748  -2.771
  123    HA   ILE  17           HA       ILE  17  -8.734   9.133  -2.830
  124    HB   ILE  17           HB       ILE  17  -9.756  11.825  -1.817
  125   HG12  ILE  17          HG12      ILE  17  -8.430   9.539  -0.281
  126   HG13  ILE  17          HG13      ILE  17  -7.881  11.206  -0.400
  127   HG21  ILE  17          HG21      ILE  17 -11.537  10.457  -0.821
  128   HG22  ILE  17          HG22      ILE  17 -11.493  10.168  -2.537
  129   HG23  ILE  17          HG23      ILE  17 -10.787   8.966  -1.435
  130   HD11  ILE  17          HD11      ILE  17  -8.868  10.847   1.768
  131   HD12  ILE  17          HD12      ILE  17  -9.906  11.955   0.846
  132   HD13  ILE  17          HD13      ILE  17 -10.362  10.243   1.070
  133    H    VAL  18           H        VAL  18 -10.131   8.650  -4.471
  134    HA   VAL  18           HA       VAL  18 -10.804  10.804  -6.439
  135    HB   VAL  18           HB       VAL  18 -10.989   9.132  -8.148
  136   HG11  VAL  18          HG11      VAL  18  -8.749  10.236  -7.605
  137   HG12  VAL  18          HG12      VAL  18  -8.308   8.758  -6.755
  138   HG13  VAL  18          HG13      VAL  18  -8.649   8.709  -8.496
  139   HG21  VAL  18          HG21      VAL  18 -11.585   7.105  -6.877
  140   HG22  VAL  18          HG22      VAL  18 -10.170   6.844  -7.890
  141   HG23  VAL  18          HG23      VAL  18  -9.967   7.086  -6.142
  142    H    THR  19           H        THR  19 -12.873  11.294  -6.835
  143    HA   THR  19           HA       THR  19 -15.041   9.462  -5.849
  144    HB   THR  19           HB       THR  19 -15.022  12.456  -5.340
  145    HG1  THR  19           HG1      THR  19 -13.493  11.722  -4.047
  146   HG21  THR  19          HG21      THR  19 -17.277  11.471  -5.326
  147   HG22  THR  19          HG22      THR  19 -16.724  10.171  -4.241
  148   HG23  THR  19          HG23      THR  19 -16.774  11.855  -3.676
  149    H    LEU  20           H        LEU  20 -16.793   9.251  -7.141
  150    HA   LEU  20           HA       LEU  20 -17.080  11.058  -9.473
  151    HB2  LEU  20           HB2      LEU  20 -17.981   8.185  -9.047
  152    HB3  LEU  20           HB3      LEU  20 -18.533   9.192 -10.349
  153    HG   LEU  20           HG       LEU  20 -16.877   7.685 -11.146
  154   HD11  LEU  20          HD11      LEU  20 -15.525   9.234 -12.346
  155   HD12  LEU  20          HD12      LEU  20 -17.058  10.081 -12.008
  156   HD13  LEU  20          HD13      LEU  20 -15.636  10.426 -11.045
  157   HD21  LEU  20          HD21      LEU  20 -14.548   7.710 -10.578
  158   HD22  LEU  20          HD22      LEU  20 -14.758   9.031  -9.424
  159   HD23  LEU  20          HD23      LEU  20 -15.451   7.429  -9.081
  160    H    ASP  21           H        ASP  21 -19.018  12.112  -9.877
  161    HA   ASP  21           HA       ASP  21 -21.209  11.756  -7.890
  162    HB2  ASP  21           HB2      ASP  21 -19.277  13.503  -7.333
  163    HB3  ASP  21           HB3      ASP  21 -20.145  14.520  -8.450
  164    H    SER  22           H        SER  22 -21.135  11.311 -10.820
  165    HA   SER  22           HA       SER  22 -23.711  12.614 -11.374
  166    HB2  SER  22           HB2      SER  22 -21.445  13.120 -13.304
  167    HB3  SER  22           HB3      SER  22 -23.155  13.242 -13.732
  168    HG   SER  22           HG       SER  22 -22.520  15.240 -13.151
  169    H    ASP  23           H        ASP  23 -21.324  10.961 -13.424
  170    HA   ASP  23           HA       ASP  23 -22.962   8.623 -14.005
  171    HB2  ASP  23           HB2      ASP  23 -24.001  10.613 -15.300
  172    HB3  ASP  23           HB3      ASP  23 -22.523  10.651 -16.253
  173    H    ASN  24           H        ASN  24 -20.437   8.894 -12.928
  174    HA   ASN  24           HA       ASN  24 -18.248   8.551 -13.022
  175    HB2  ASN  24           HB2      ASN  24 -19.099   6.493 -14.310
  176    HB3  ASN  24           HB3      ASN  24 -18.358   7.246 -15.729
  177   HD21  ASN  24          HD22      ASN  24 -15.955   8.093 -14.884
  178   HD22  ASN  24          HD21      ASN  24 -15.115   6.714 -14.172
  179    H    ILE  25           H        ILE  25 -19.541  10.411 -15.683
  180    HA   ILE  25           HA       ILE  25 -17.122  11.498 -16.668
  181    HB   ILE  25           HB       ILE  25 -18.469  13.334 -17.552
  182   HG12  ILE  25          HG12      ILE  25 -20.740  12.209 -15.840
  183   HG13  ILE  25          HG13      ILE  25 -19.990  13.802 -15.696
  184   HG21  ILE  25          HG21      ILE  25 -19.973  10.703 -17.826
  185   HG22  ILE  25          HG22      ILE  25 -19.768  11.978 -19.042
  186   HG23  ILE  25          HG23      ILE  25 -18.382  10.999 -18.557
  187   HD11  ILE  25          HD11      ILE  25 -21.700  12.836 -18.012
  188   HD12  ILE  25          HD12      ILE  25 -22.117  14.036 -16.783
  189   HD13  ILE  25          HD13      ILE  25 -20.832  14.392 -17.957
  190    H    LEU  26           H        LEU  26 -19.031  12.628 -13.900
  191    HA   LEU  26           HA       LEU  26 -17.267  14.861 -13.329
  192    HB2  LEU  26           HB2      LEU  26 -19.622  15.087 -12.979
  193    HB3  LEU  26           HB3      LEU  26 -19.673  13.678 -11.915
  194    HG   LEU  26           HG       LEU  26 -18.587  14.817 -10.145
  195   HD11  LEU  26          HD11      LEU  26 -18.107  17.136 -12.028
  196   HD12  LEU  26          HD12      LEU  26 -17.798  17.122 -10.274
  197   HD13  LEU  26          HD13      LEU  26 -16.852  16.074 -11.326
  198   HD21  LEU  26          HD21      LEU  26 -20.964  15.423 -10.455
  199   HD22  LEU  26          HD22      LEU  26 -19.998  16.660  -9.645
  200   HD23  LEU  26          HD23      LEU  26 -20.455  16.866 -11.355
  201    H    LEU  27           H        LEU  27 -15.374  13.647 -13.266
  202    HA   LEU  27           HA       LEU  27 -14.746  12.225 -10.713
  203    HB2  LEU  27           HB2      LEU  27 -14.195  11.310 -13.067
  204    HB3  LEU  27           HB3      LEU  27 -12.852  12.443 -13.077
  205    HG   LEU  27           HG       LEU  27 -13.280  10.440 -10.810
  206   HD11  LEU  27          HD11      LEU  27 -11.797   8.883 -11.957
  207   HD12  LEU  27          HD12      LEU  27 -13.214   9.200 -12.963
  208   HD13  LEU  27          HD13      LEU  27 -11.662   9.986 -13.340
  209   HD21  LEU  27          HD21      LEU  27 -10.789  11.848 -11.852
  210   HD22  LEU  27          HD22      LEU  27 -11.606  12.155 -10.306
  211   HD23  LEU  27          HD23      LEU  27 -10.810  10.608 -10.583
  212    H    SER  28           H        SER  28 -13.834  13.147  -9.069
  213    HA   SER  28           HA       SER  28 -12.245  15.637  -9.394
  214    HB2  SER  28           HB2      SER  28 -14.407  16.449  -8.852
  215    HB3  SER  28           HB3      SER  28 -14.682  15.230  -7.613
  216    HG   SER  28           HG       SER  28 -13.781  16.526  -6.253
  217    H    GLU  29           H        GLU  29 -10.407  15.609  -8.236
  218    HA   GLU  29           HA       GLU  29  -9.903  13.262  -6.453
  219    HB2  GLU  29           HB2      GLU  29  -7.915  14.653  -8.249
  220    HB3  GLU  29           HB3      GLU  29  -7.678  13.183  -7.298
  221    HG2  GLU  29           HG2      GLU  29  -9.307  11.986  -8.734
  222    HG3  GLU  29           HG3      GLU  29  -9.581  13.460  -9.661
  223    H    GLU  30           H        GLU  30  -8.651  13.521  -4.601
  224    HA   GLU  30           HA       GLU  30  -7.866  16.316  -3.779
  225    HB2  GLU  30           HB2      GLU  30  -9.185  14.096  -2.167
  226    HB3  GLU  30           HB3      GLU  30  -8.561  15.582  -1.472
  227    HG2  GLU  30           HG2      GLU  30 -10.666  15.774  -3.638
  228    HG3  GLU  30           HG3      GLU  30 -11.100  15.202  -2.032
  229    H    GLN  31           H        GLN  31  -5.944  16.458  -2.629
  230    HA   GLN  31           HA       GLN  31  -4.552  13.901  -1.885
  231    HB2  GLN  31           HB2      GLN  31  -3.289  16.589  -2.563
  232    HB3  GLN  31           HB3      GLN  31  -2.465  15.221  -1.801
  233    HG2  GLN  31           HG2      GLN  31  -3.395  13.877  -3.883
  234    HG3  GLN  31           HG3      GLN  31  -3.397  15.476  -4.656
  235   HE21  GLN  31          HE22      GLN  31  -1.644  12.814  -3.587
  236   HE22  GLN  31          HE21      GLN  31  -0.439  13.713  -2.831
  237    H    VAL  32           H        VAL  32  -4.437  13.509   0.223
  238    HA   VAL  32           HA       VAL  32  -4.986  15.716   2.175
  239    HB   VAL  32           HB       VAL  32  -6.540  14.365   3.354
  240   HG11  VAL  32          HG11      VAL  32  -7.314  14.111   0.422
  241   HG12  VAL  32          HG12      VAL  32  -8.388  14.207   1.825
  242   HG13  VAL  32          HG13      VAL  32  -7.411  15.615   1.371
  243   HG21  VAL  32          HG21      VAL  32  -5.586  12.097   3.013
  244   HG22  VAL  32          HG22      VAL  32  -7.309  12.166   2.669
  245   HG23  VAL  32          HG23      VAL  32  -6.145  12.125   1.324
  246    H    ASP  33           H        ASP  33  -4.451  15.228   4.431
  247    HA   ASP  33           HA       ASP  33  -1.916  13.780   4.706
  248    HB2  ASP  33           HB2      ASP  33  -3.778  14.960   6.811
  249    HB3  ASP  33           HB3      ASP  33  -2.170  14.321   7.115
  250    H    VAL  34           H        VAL  34  -1.612  11.756   5.618
  251    HA   VAL  34           HA       VAL  34  -3.674   9.896   5.209
  252    HB   VAL  34           HB       VAL  34  -1.197   9.563   5.009
  253   HG11  VAL  34          HG11      VAL  34  -1.400   8.877   7.969
  254   HG12  VAL  34          HG12      VAL  34  -0.023   8.545   6.920
  255   HG13  VAL  34          HG13      VAL  34  -0.494  10.219   7.253
  256   HG21  VAL  34          HG21      VAL  34  -2.697   7.282   6.326
  257   HG22  VAL  34          HG22      VAL  34  -2.814   7.748   4.614
  258   HG23  VAL  34          HG23      VAL  34  -1.277   7.178   5.271
  259    H    GLU  35           H        GLU  35  -3.526  11.794   7.876
  260    HA   GLU  35           HA       GLU  35  -4.906  10.103   9.843
  261    HB2  GLU  35           HB2      GLU  35  -3.391  12.004  10.378
  262    HB3  GLU  35           HB3      GLU  35  -4.500  13.111   9.563
  263    HG2  GLU  35           HG2      GLU  35  -6.257  12.481  11.247
  264    HG3  GLU  35           HG3      GLU  35  -5.042  11.501  12.088
  265    H    LEU  36           H        LEU  36  -5.823  12.111   7.092
  266    HA   LEU  36           HA       LEU  36  -8.587  12.525   8.062
  267    HB2  LEU  36           HB2      LEU  36  -7.166  13.719   5.665
  268    HB3  LEU  36           HB3      LEU  36  -8.623  14.308   6.461
  269    HG   LEU  36           HG       LEU  36  -5.814  14.311   7.663
  270   HD11  LEU  36          HD11      LEU  36  -6.139  15.922   5.833
  271   HD12  LEU  36          HD12      LEU  36  -7.534  16.613   6.697
  272   HD13  LEU  36          HD13      LEU  36  -5.904  16.718   7.401
  273   HD21  LEU  36          HD21      LEU  36  -6.790  15.741   9.410
  274   HD22  LEU  36          HD22      LEU  36  -8.412  15.462   8.740
  275   HD23  LEU  36          HD23      LEU  36  -7.486  14.113   9.445
  276    H    VAL  37           H        VAL  37  -7.024  10.405   6.038
  277    HA   VAL  37           HA       VAL  37  -9.365   9.716   4.341
  278    HB   VAL  37           HB       VAL  37  -7.102   9.758   3.336
  279   HG11  VAL  37          HG11      VAL  37  -6.433   7.367   5.095
  280   HG12  VAL  37          HG12      VAL  37  -5.422   8.092   3.831
  281   HG13  VAL  37          HG13      VAL  37  -5.776   9.002   5.306
  282   HG21  VAL  37          HG21      VAL  37  -8.298   6.968   3.415
  283   HG22  VAL  37          HG22      VAL  37  -8.784   8.307   2.349
  284   HG23  VAL  37          HG23      VAL  37  -7.173   7.603   2.197
  285    H    GLN  38           H        GLN  38 -10.491   7.736   4.673
  286    HA   GLN  38           HA       GLN  38 -10.061   6.461   7.359
  287    HB2  GLN  38           HB2      GLN  38 -12.398   5.844   7.343
  288    HB3  GLN  38           HB3      GLN  38 -12.188   7.582   7.253
  289    HG2  GLN  38           HG2      GLN  38 -13.003   7.708   5.049
  290    HG3  GLN  38           HG3      GLN  38 -12.637   6.013   4.699
  291   HE21  GLN  38          HE22      GLN  38 -14.836   7.921   6.852
  292   HE22  GLN  38          HE21      GLN  38 -16.033   6.619   6.764
  293    H    ARG  39           H        ARG  39 -10.451   4.162   7.575
  294    HA   ARG  39           HA       ARG  39  -9.156   2.646   5.479
  295    HB2  ARG  39           HB2      ARG  39  -9.029   0.900   6.995
  296    HB3  ARG  39           HB3      ARG  39  -8.799   2.370   7.916
  297    HG2  ARG  39           HG2      ARG  39 -11.324   2.150   8.520
  298    HG3  ARG  39           HG3      ARG  39 -11.184   0.494   7.898
  299    HD2  ARG  39           HD2      ARG  39  -9.216   0.139   9.421
  300    HD3  ARG  39           HD3      ARG  39  -9.510   1.764  10.083
  301    HE   ARG  39           HE       ARG  39 -11.940   0.337  10.280
  302   HH11  ARG  39          HH11      ARG  39  -8.680  -0.073  11.696
  303   HH12  ARG  39          HH12      ARG  39  -9.373  -0.917  13.064
  304   HH21  ARG  39          HH21      ARG  39 -12.636  -0.619  12.196
  305   HH22  ARG  39          HH22      ARG  39 -11.407  -1.178  13.325
  306    H    GLY  40           H        GLY  40 -11.549   3.702   4.573
  307    HA2  GLY  40           HA2      GLY  40 -12.472   1.342   3.079
  308    HA3  GLY  40           HA3      GLY  40 -13.727   2.299   3.881
  309    H    ASP  41           H        ASP  41 -10.966   4.106   2.720
  310    HA   ASP  41           HA       ASP  41 -12.633   5.352   0.628
  311    HB2  ASP  41           HB2      ASP  41 -10.003   6.055   1.938
  312    HB3  ASP  41           HB3      ASP  41 -10.469   6.803   0.417
  313    H    ILE  42           H        ILE  42 -11.866   5.770  -1.510
  314    HA   ILE  42           HA       ILE  42 -10.627   3.345  -2.701
  315    HB   ILE  42           HB       ILE  42 -12.527   5.415  -3.829
  316   HG12  ILE  42          HG12      ILE  42 -13.684   4.024  -2.216
  317   HG13  ILE  42          HG13      ILE  42 -14.182   3.613  -3.843
  318   HG21  ILE  42          HG21      ILE  42 -11.274   2.952  -5.088
  319   HG22  ILE  42          HG22      ILE  42 -12.746   3.726  -5.719
  320   HG23  ILE  42          HG23      ILE  42 -11.239   4.634  -5.674
  321   HD11  ILE  42          HD11      ILE  42 -12.710   1.581  -3.763
  322   HD12  ILE  42          HD12      ILE  42 -12.308   1.991  -2.075
  323   HD13  ILE  42          HD13      ILE  42 -13.971   1.595  -2.518
  324    H    ILE  43           H        ILE  43  -8.626   3.447  -3.495
  325    HA   ILE  43           HA       ILE  43  -7.480   6.002  -4.412
  326    HB   ILE  43           HB       ILE  43  -6.186   3.483  -3.316
  327   HG12  ILE  43          HG12      ILE  43  -7.646   4.290  -1.558
  328   HG13  ILE  43          HG13      ILE  43  -5.956   4.460  -1.152
  329   HG21  ILE  43          HG21      ILE  43  -4.632   4.897  -4.553
  330   HG22  ILE  43          HG22      ILE  43  -5.111   6.309  -3.585
  331   HG23  ILE  43          HG23      ILE  43  -4.261   4.949  -2.828
  332   HD11  ILE  43          HD11      ILE  43  -7.343   6.370  -0.394
  333   HD12  ILE  43          HD12      ILE  43  -6.040   6.873  -1.478
  334   HD13  ILE  43          HD13      ILE  43  -7.714   6.769  -2.079
  335    H    LYS  44           H        LYS  44  -7.156   6.145  -6.584
  336    HA   LYS  44           HA       LYS  44  -6.513   3.797  -8.282
  337    HB2  LYS  44           HB2      LYS  44  -6.912   6.773  -8.728
  338    HB3  LYS  44           HB3      LYS  44  -6.165   5.791  -9.975
  339    HG2  LYS  44           HG2      LYS  44  -8.854   4.984  -8.808
  340    HG3  LYS  44           HG3      LYS  44  -8.727   6.221 -10.069
  341    HD2  LYS  44           HD2      LYS  44  -7.560   4.639 -11.563
  342    HD3  LYS  44           HD3      LYS  44  -7.619   3.397 -10.312
  343    HE2  LYS  44           HE2      LYS  44  -9.308   2.933 -11.932
  344    HE3  LYS  44           HE3      LYS  44 -10.115   3.407 -10.423
  345    HZ1  LYS  44           HZ1      LYS  44 -10.962   4.356 -12.575
  346    HZ2  LYS  44           HZ2      LYS  44 -10.754   5.414 -11.347
  347    HZ3  LYS  44           HZ3      LYS  44  -9.649   5.359 -12.600
  348    H    VAL  45           H        VAL  45  -4.492   2.993  -8.495
  349    HA   VAL  45           HA       VAL  45  -2.205   4.700  -7.621
  350    HB   VAL  45           HB       VAL  45  -2.457   2.592  -6.456
  351   HG11  VAL  45          HG11      VAL  45  -1.860   1.261  -9.128
  352   HG12  VAL  45          HG12      VAL  45  -1.868   0.463  -7.546
  353   HG13  VAL  45          HG13      VAL  45  -3.361   1.165  -8.174
  354   HG21  VAL  45          HG21      VAL  45  -0.160   1.846  -6.562
  355   HG22  VAL  45          HG22      VAL  45   0.088   2.609  -8.141
  356   HG23  VAL  45          HG23      VAL  45  -0.203   3.610  -6.698
  357    H    VAL  46           H        VAL  46  -0.597   5.334  -8.877
  358    HA   VAL  46           HA       VAL  46  -0.901   5.059 -11.760
  359    HB   VAL  46           HB       VAL  46   0.822   6.750 -11.960
  360   HG11  VAL  46          HG11      VAL  46  -0.319   8.579 -10.846
  361   HG12  VAL  46          HG12      VAL  46  -1.498   7.423 -11.487
  362   HG13  VAL  46          HG13      VAL  46  -1.143   7.452  -9.753
  363   HG21  VAL  46          HG21      VAL  46   2.402   6.187 -10.222
  364   HG22  VAL  46          HG22      VAL  46   1.831   7.837  -9.978
  365   HG23  VAL  46          HG23      VAL  46   1.207   6.528  -8.954
  366    HA   PRO  47           HA       PRO  47   2.336   2.068 -12.581
  367    HB2  PRO  47           HB2      PRO  47   3.373   2.984 -14.951
  368    HB3  PRO  47           HB3      PRO  47   1.792   2.152 -14.818
  369    HG2  PRO  47           HG2      PRO  47   2.309   5.146 -14.855
  370    HG3  PRO  47           HG3      PRO  47   1.142   4.215 -15.848
  371    HD2  PRO  47           HD2      PRO  47   0.320   5.457 -13.632
  372    HD3  PRO  47           HD3      PRO  47  -0.273   3.813 -13.988
  373    H    GLY  48           H        GLY  48   4.514   1.888 -12.147
  374    HA2  GLY  48           HA2      GLY  48   6.682   2.510 -11.608
  375    HA3  GLY  48           HA3      GLY  48   6.337   4.138 -12.167
  376    H    GLY  49           H        GLY  49   3.953   3.972 -10.037
  377    HA2  GLY  49           HA2      GLY  49   5.352   5.564  -8.063
  378    HA3  GLY  49           HA3      GLY  49   3.641   5.159  -8.093
  379    H    LYS  50           H        LYS  50   4.279   5.229  -5.708
  380    HA   LYS  50           HA       LYS  50   4.836   2.441  -4.753
  381    HB2  LYS  50           HB2      LYS  50   5.183   5.020  -3.184
  382    HB3  LYS  50           HB3      LYS  50   5.481   3.376  -2.609
  383    HG2  LYS  50           HG2      LYS  50   7.274   3.151  -4.363
  384    HG3  LYS  50           HG3      LYS  50   7.046   4.867  -4.755
  385    HD2  LYS  50           HD2      LYS  50   7.533   5.435  -2.349
  386    HD3  LYS  50           HD3      LYS  50   7.850   3.713  -2.046
  387    HE2  LYS  50           HE2      LYS  50   9.622   3.839  -3.886
  388    HE3  LYS  50           HE3      LYS  50   9.385   5.590  -3.899
  389    HZ1  LYS  50           HZ1      LYS  50  11.217   4.908  -2.429
  390    HZ2  LYS  50           HZ2      LYS  50  10.042   5.636  -1.554
  391    HZ3  LYS  50           HZ3      LYS  50  10.197   3.999  -1.519
  392    H    PHE  51           H        PHE  51   3.581   1.697  -2.961
  393    HA   PHE  51           HA       PHE  51   0.760   2.598  -3.070
  394    HB2  PHE  51           HB2      PHE  51   2.112   0.168  -1.880
  395    HB3  PHE  51           HB3      PHE  51   0.405   0.521  -1.677
  396    HD1  PHE  51           HD2      PHE  51   3.008  -0.438  -4.149
  397    HD2  PHE  51           HD1      PHE  51  -1.197   0.191  -3.471
  398    HE1  PHE  51           HE2      PHE  51   2.505  -1.554  -6.298
  399    HE2  PHE  51           HE1      PHE  51  -1.703  -0.950  -5.614
  400    HZ   PHE  51           HZ       PHE  51   0.144  -1.818  -7.041
  401    HA   PRO  52           HA       PRO  52   1.586   4.605   0.909
  402    HB2  PRO  52           HB2      PRO  52  -0.484   6.332   1.042
  403    HB3  PRO  52           HB3      PRO  52   0.778   6.471  -0.219
  404    HG2  PRO  52           HG2      PRO  52  -1.952   5.161  -0.461
  405    HG3  PRO  52           HG3      PRO  52  -1.205   6.364  -1.554
  406    HD2  PRO  52           HD2      PRO  52  -1.100   3.645  -2.012
  407    HD3  PRO  52           HD3      PRO  52   0.207   4.760  -2.507
  408    H    VAL  53           H        VAL  53  -1.049   2.432   0.457
  409    HA   VAL  53           HA       VAL  53  -1.361   1.958   3.301
  410    HB   VAL  53           HB       VAL  53  -3.934   1.896   3.035
  411   HG11  VAL  53          HG11      VAL  53  -2.719   3.347   4.616
  412   HG12  VAL  53          HG12      VAL  53  -2.604   4.606   3.366
  413   HG13  VAL  53          HG13      VAL  53  -4.190   4.094   3.979
  414   HG21  VAL  53          HG21      VAL  53  -4.965   3.566   1.660
  415   HG22  VAL  53          HG22      VAL  53  -3.400   4.158   1.087
  416   HG23  VAL  53          HG23      VAL  53  -3.971   2.536   0.607
  417    H    ASP  54           H        ASP  54  -2.720  -0.088   3.635
  418    HA   ASP  54           HA       ASP  54  -2.266  -1.881   1.319
  419    HB2  ASP  54           HB2      ASP  54  -1.967  -3.685   2.619
  420    HB3  ASP  54           HB3      ASP  54  -1.099  -2.423   3.467
  421    H    GLY  55           H        GLY  55  -3.785  -3.122   0.388
  422    HA2  GLY  55           HA2      GLY  55  -6.610  -2.977   1.103
  423    HA3  GLY  55           HA3      GLY  55  -6.152  -1.852  -0.165
  424    H    ARG  56           H        ARG  56  -7.976  -3.479  -0.856
  425    HA   ARG  56           HA       ARG  56  -6.797  -5.782  -2.346
  426    HB2  ARG  56           HB2      ARG  56  -8.711  -6.104  -0.746
  427    HB3  ARG  56           HB3      ARG  56  -9.748  -5.246  -1.883
  428    HG2  ARG  56           HG2      ARG  56  -9.434  -6.938  -3.572
  429    HG3  ARG  56           HG3      ARG  56  -8.109  -7.684  -2.677
  430    HD2  ARG  56           HD2      ARG  56 -10.968  -7.647  -1.693
  431    HD3  ARG  56           HD3      ARG  56 -10.206  -8.951  -2.614
  432    HE   ARG  56           HE       ARG  56  -9.317  -8.085   0.117
  433   HH11  ARG  56          HH11      ARG  56  -9.919 -10.789  -2.104
  434   HH12  ARG  56          HH12      ARG  56  -9.199 -11.915  -0.991
  435   HH21  ARG  56          HH21      ARG  56  -8.348  -9.637   1.398
  436   HH22  ARG  56          HH22      ARG  56  -8.148 -11.241   0.757
  437    H    VAL  57           H        VAL  57  -7.188  -6.155  -4.523
  438    HA   VAL  57           HA       VAL  57  -7.227  -3.669  -6.172
  439    HB   VAL  57           HB       VAL  57  -6.133  -6.450  -6.796
  440   HG11  VAL  57          HG11      VAL  57  -4.994  -5.314  -8.675
  441   HG12  VAL  57          HG12      VAL  57  -6.738  -5.237  -8.833
  442   HG13  VAL  57          HG13      VAL  57  -5.854  -3.804  -8.270
  443   HG21  VAL  57          HG21      VAL  57  -3.887  -5.485  -6.570
  444   HG22  VAL  57          HG22      VAL  57  -4.592  -3.957  -6.010
  445   HG23  VAL  57          HG23      VAL  57  -4.758  -5.430  -5.033
  446    H    ILE  58           H        ILE  58  -8.973  -3.379  -7.485
  447    HA   ILE  58           HA       ILE  58 -10.491  -5.786  -8.447
  448    HB   ILE  58           HB       ILE  58 -12.606  -4.356  -7.847
  449   HG12  ILE  58          HG12      ILE  58 -10.709  -3.311  -5.710
  450   HG13  ILE  58          HG13      ILE  58 -11.105  -2.360  -7.155
  451   HG21  ILE  58          HG21      ILE  58 -11.050  -5.713  -5.621
  452   HG22  ILE  58          HG22      ILE  58 -12.804  -5.486  -5.731
  453   HG23  ILE  58          HG23      ILE  58 -11.987  -6.552  -6.878
  454   HD11  ILE  58          HD11      ILE  58 -13.125  -3.290  -5.078
  455   HD12  ILE  58          HD12      ILE  58 -12.490  -1.648  -5.295
  456   HD13  ILE  58          HD13      ILE  58 -13.487  -2.373  -6.564
  457    H    GLU  59           H        GLU  59  -8.688  -3.820  -9.830
  458    HA   GLU  59           HA       GLU  59 -10.046  -4.131 -12.300
  459    HB2  GLU  59           HB2      GLU  59 -10.915  -1.793 -11.276
  460    HB3  GLU  59           HB3      GLU  59  -9.327  -1.248 -11.748
  461    HG2  GLU  59           HG2      GLU  59 -10.753  -0.701 -13.501
  462    HG3  GLU  59           HG3      GLU  59  -9.777  -2.027 -14.104
  463    H    GLY  60           H        GLY  60  -8.483  -4.174 -13.975
  464    HA2  GLY  60           HA2      GLY  60  -6.581  -3.502 -15.131
  465    HA3  GLY  60           HA3      GLY  60  -5.986  -2.658 -13.713
  466    H    HIS  61           H        HIS  61  -4.031  -3.632 -14.700
  467    HA   HIS  61           HA       HIS  61  -3.275  -6.146 -13.343
  468    HB2  HIS  61           HB2      HIS  61  -2.371  -7.112 -15.499
  469    HB3  HIS  61           HB3      HIS  61  -4.107  -7.176 -15.253
  470    HD1  HIS  61           HD1      HIS  61  -5.644  -5.757 -16.941
  471    HD2  HIS  61           HD2      HIS  61  -1.488  -5.615 -17.589
  472    HE1  HIS  61           HE1      HIS  61  -5.306  -4.666 -19.229
  473    H    SER  62           H        SER  62  -1.416  -5.846 -12.443
  474    HA   SER  62           HA       SER  62   0.742  -4.222 -13.678
  475    HB2  SER  62           HB2      SER  62  -0.580  -2.600 -12.347
  476    HB3  SER  62           HB3      SER  62  -0.457  -3.603 -10.966
  477    HG   SER  62           HG       SER  62   1.732  -2.392 -12.243
  478    H    MET  63           H        MET  63   2.813  -4.316 -12.390
  479    HA   MET  63           HA       MET  63   3.131  -6.918 -10.989
  480    HB2  MET  63           HB2      MET  63   4.057  -7.069 -13.214
  481    HB3  MET  63           HB3      MET  63   5.033  -5.615 -12.965
  482    HG2  MET  63           HG2      MET  63   6.407  -6.668 -11.360
  483    HG3  MET  63           HG3      MET  63   5.281  -8.010 -11.116
  484    HE1  MET  63           HE1      MET  63   5.324 -10.209 -12.296
  485    HE2  MET  63           HE2      MET  63   4.487  -9.346 -13.609
  486    HE3  MET  63           HE3      MET  63   5.850 -10.422 -13.983
  487    H    VAL  64           H        VAL  64   3.919  -6.792  -9.053
  488    HA   VAL  64           HA       VAL  64   4.853  -4.170  -7.974
  489    HB   VAL  64           HB       VAL  64   3.136  -6.293  -6.637
  490   HG11  VAL  64          HG11      VAL  64   3.941  -3.515  -5.663
  491   HG12  VAL  64          HG12      VAL  64   2.747  -4.575  -4.887
  492   HG13  VAL  64          HG13      VAL  64   4.436  -5.064  -4.945
  493   HG21  VAL  64          HG21      VAL  64   1.846  -5.119  -8.358
  494   HG22  VAL  64          HG22      VAL  64   1.346  -4.540  -6.766
  495   HG23  VAL  64          HG23      VAL  64   2.428  -3.552  -7.773
  496    H    ASP  65           H        ASP  65   6.440  -4.044  -6.504
  497    HA   ASP  65           HA       ASP  65   8.267  -6.365  -6.177
  498    HB2  ASP  65           HB2      ASP  65   9.081  -4.348  -7.242
  499    HB3  ASP  65           HB3      ASP  65   8.568  -3.357  -5.876
  500    H    GLU  66           H        GLU  66   7.241  -7.502  -4.482
  501    HA   GLU  66           HA       GLU  66   6.576  -6.128  -1.968
  502    HB2  GLU  66           HB2      GLU  66   6.315  -9.097  -2.506
  503    HB3  GLU  66           HB3      GLU  66   5.458  -8.100  -1.323
  504    HG2  GLU  66           HG2      GLU  66   4.465  -6.881  -3.394
  505    HG3  GLU  66           HG3      GLU  66   5.066  -8.282  -4.309
  506    H    SER  67           H        SER  67   9.474  -6.921  -2.996
  507    HA   SER  67           HA       SER  67  10.674  -8.918  -1.631
  508    HB2  SER  67           HB2      SER  67  11.704  -7.608  -3.411
  509    HB3  SER  67           HB3      SER  67  11.843  -6.203  -2.344
  510    HG   SER  67           HG       SER  67  13.772  -7.539  -2.578
  511    H    LEU  68           H        LEU  68  10.456  -5.566  -0.228
  512    HA   LEU  68           HA       LEU  68  12.029  -6.474   2.069
  513    HB2  LEU  68           HB2      LEU  68  12.111  -4.184   1.076
  514    HB3  LEU  68           HB3      LEU  68  10.460  -3.889   1.574
  515    HG   LEU  68           HG       LEU  68  12.194  -2.763   2.920
  516   HD11  LEU  68          HD11      LEU  68  10.781  -4.665   4.799
  517   HD12  LEU  68          HD12      LEU  68  11.227  -2.980   5.024
  518   HD13  LEU  68          HD13      LEU  68   9.918  -3.398   3.900
  519   HD21  LEU  68          HD21      LEU  68  13.912  -4.537   2.912
  520   HD22  LEU  68          HD22      LEU  68  13.549  -3.939   4.542
  521   HD23  LEU  68          HD23      LEU  68  12.908  -5.505   4.018
  522    H    ILE  69           H        ILE  69   8.627  -6.118   1.408
  523    HA   ILE  69           HA       ILE  69   7.823  -6.282   4.243
  524    HB   ILE  69           HB       ILE  69   6.029  -6.654   1.825
  525   HG12  ILE  69          HG12      ILE  69   7.205  -4.447   1.648
  526   HG13  ILE  69          HG13      ILE  69   5.475  -4.372   1.780
  527   HG21  ILE  69          HG21      ILE  69   4.295  -5.823   3.525
  528   HG22  ILE  69          HG22      ILE  69   4.975  -7.421   3.852
  529   HG23  ILE  69          HG23      ILE  69   5.537  -6.011   4.766
  530   HD11  ILE  69          HD11      ILE  69   7.346  -3.832   4.105
  531   HD12  ILE  69          HD12      ILE  69   6.574  -2.606   3.067
  532   HD13  ILE  69          HD13      ILE  69   5.568  -3.645   4.083
  533    H    THR  70           H        THR  70   7.657  -8.436   1.414
  534    HA   THR  70           HA       THR  70   6.947 -10.725   3.171
  535    HB   THR  70           HB       THR  70   6.089 -11.783   1.190
  536    HG1  THR  70           HG1      THR  70   7.069  -9.478  -0.170
  537   HG21  THR  70          HG21      THR  70   4.672 -10.066   2.372
  538   HG22  THR  70          HG22      THR  70   5.159  -8.881   1.144
  539   HG23  THR  70          HG23      THR  70   4.253 -10.330   0.671
  540    H    GLY  71           H        GLY  71   9.745  -9.658   1.518
  541    HA2  GLY  71           HA2      GLY  71  11.856 -10.528   1.740
  542    HA3  GLY  71           HA3      GLY  71  11.206 -12.032   2.386
  543    H    GLU  72           H        GLU  72   9.507 -11.739  -0.375
  544    HA   GLU  72           HA       GLU  72  10.588 -13.975  -1.570
  545    HB2  GLU  72           HB2      GLU  72   9.174 -11.786  -3.129
  546    HB3  GLU  72           HB3      GLU  72   9.264 -13.488  -3.554
  547    HG2  GLU  72           HG2      GLU  72   7.827 -12.409  -1.113
  548    HG3  GLU  72           HG3      GLU  72   7.085 -12.685  -2.679
  549    H    ALA  73           H        ALA  73  11.125 -10.670  -2.858
  550    HA   ALA  73           HA       ALA  73  12.721  -9.678  -4.008
  551    HB1  ALA  73           HB1      ALA  73  14.287 -10.300  -2.280
  552    HB2  ALA  73           HB2      ALA  73  14.620 -11.837  -3.082
  553    HB3  ALA  73           HB3      ALA  73  15.061 -10.311  -3.875
  554    H    MET  74           H        MET  74  10.876 -10.871  -5.213
  555    HA   MET  74           HA       MET  74  11.853 -11.243  -7.888
  556    HB2  MET  74           HB2      MET  74  10.377 -13.233  -8.286
  557    HB3  MET  74           HB3      MET  74  11.883 -13.553  -7.427
  558    HG2  MET  74           HG2      MET  74  10.679 -13.718  -5.312
  559    HG3  MET  74           HG3      MET  74   9.168 -13.236  -6.089
  560    HE1  MET  74           HE1      MET  74  11.237 -17.349  -6.541
  561    HE2  MET  74           HE2      MET  74  11.937 -15.920  -7.328
  562    HE3  MET  74           HE3      MET  74  11.833 -15.999  -5.552
  563    HA   PRO  75           HA       PRO  75   8.241  -8.620  -8.105
  564    HB2  PRO  75           HB2      PRO  75   8.278  -9.357 -11.026
  565    HB3  PRO  75           HB3      PRO  75   8.118  -7.733 -10.269
  566    HG2  PRO  75           HG2      PRO  75  10.484  -8.510 -11.313
  567    HG3  PRO  75           HG3      PRO  75  10.442  -7.695  -9.713
  568    HD2  PRO  75           HD2      PRO  75  10.659 -10.665 -10.299
  569    HD3  PRO  75           HD3      PRO  75  11.578  -9.652  -9.146
  570    H    VAL  76           H        VAL  76   6.021  -8.759  -8.083
  571    HA   VAL  76           HA       VAL  76   4.764 -11.425  -8.639
  572    HB   VAL  76           HB       VAL  76   4.061  -9.423  -6.458
  573   HG11  VAL  76          HG11      VAL  76   3.121 -12.287  -6.933
  574   HG12  VAL  76          HG12      VAL  76   2.731 -11.291  -5.517
  575   HG13  VAL  76          HG13      VAL  76   2.130 -10.820  -7.110
  576   HG21  VAL  76          HG21      VAL  76   6.236 -10.422  -5.931
  577   HG22  VAL  76          HG22      VAL  76   4.998 -11.109  -4.883
  578   HG23  VAL  76          HG23      VAL  76   5.604 -12.049  -6.265
  579    H    ALA  77           H        ALA  77   3.003 -11.522  -9.946
  580    HA   ALA  77           HA       ALA  77   2.038  -9.021 -11.157
  581    HB1  ALA  77           HB1      ALA  77   0.915 -10.528 -12.732
  582    HB2  ALA  77           HB2      ALA  77   2.628 -10.950 -12.561
  583    HB3  ALA  77           HB3      ALA  77   1.387 -11.931 -11.750
  584    H    LYS  78           H        LYS  78   0.043  -8.184 -11.046
  585    HA   LYS  78           HA       LYS  78  -1.991  -9.352  -9.162
  586    HB2  LYS  78           HB2      LYS  78  -1.467  -6.426  -9.793
  587    HB3  LYS  78           HB3      LYS  78  -2.606  -7.043  -8.603
  588    HG2  LYS  78           HG2      LYS  78   0.434  -7.283  -8.466
  589    HG3  LYS  78           HG3      LYS  78  -0.556  -6.130  -7.586
  590    HD2  LYS  78           HD2      LYS  78  -1.621  -7.879  -6.287
  591    HD3  LYS  78           HD3      LYS  78  -0.789  -9.148  -7.208
  592    HE2  LYS  78           HE2      LYS  78   1.381  -8.417  -6.388
  593    HE3  LYS  78           HE3      LYS  78   0.663  -7.007  -5.599
  594    HZ1  LYS  78           HZ1      LYS  78   0.118  -9.831  -4.834
  595    HZ2  LYS  78           HZ2      LYS  78   1.063  -8.773  -3.997
  596    HZ3  LYS  78           HZ3      LYS  78  -0.541  -8.512  -4.118
  597    H    LYS  79           H        LYS  79  -4.229  -8.779  -9.491
  598    HA   LYS  79           HA       LYS  79  -5.212  -8.155 -12.201
  599    HB2  LYS  79           HB2      LYS  79  -6.374 -10.305 -12.359
  600    HB3  LYS  79           HB3      LYS  79  -4.639 -10.557 -12.278
  601    HG2  LYS  79           HG2      LYS  79  -4.767 -11.285  -9.984
  602    HG3  LYS  79           HG3      LYS  79  -6.484 -10.863  -9.866
  603    HD2  LYS  79           HD2      LYS  79  -5.287 -12.979 -11.693
  604    HD3  LYS  79           HD3      LYS  79  -6.064 -13.284 -10.130
  605    HE2  LYS  79           HE2      LYS  79  -8.168 -12.199 -11.049
  606    HE3  LYS  79           HE3      LYS  79  -7.383 -12.156 -12.640
  607    HZ1  LYS  79           HZ1      LYS  79  -7.157 -14.593 -12.484
  608    HZ2  LYS  79           HZ2      LYS  79  -7.947 -14.604 -11.055
  609    HZ3  LYS  79           HZ3      LYS  79  -8.731 -14.135 -12.436
  610    HA   PRO  80           HA       PRO  80  -8.818  -6.990  -9.627
  611    HB2  PRO  80           HB2      PRO  80 -11.019  -8.052 -10.933
  612    HB3  PRO  80           HB3      PRO  80 -10.187  -6.551 -11.436
  613    HG2  PRO  80           HG2      PRO  80  -9.761  -9.358 -12.515
  614    HG3  PRO  80           HG3      PRO  80 -10.022  -7.842 -13.441
  615    HD2  PRO  80           HD2      PRO  80  -7.533  -8.759 -13.087
  616    HD3  PRO  80           HD3      PRO  80  -7.867  -7.027 -12.877
  617    H    GLY  81           H        GLY  81  -9.267  -7.971  -7.737
  618    HA2  GLY  81           HA2      GLY  81  -9.755  -9.679  -6.200
  619    HA3  GLY  81           HA3      GLY  81  -9.720 -10.895  -7.478
  620    H    SER  82           H        SER  82  -7.278  -8.433  -6.459
  621    HA   SER  82           HA       SER  82  -5.476 -10.576  -5.422
  622    HB2  SER  82           HB2      SER  82  -4.583  -8.116  -6.989
  623    HB3  SER  82           HB3      SER  82  -3.523  -9.238  -6.131
  624    HG   SER  82           HG       SER  82  -4.148 -10.879  -7.580
  625    H    THR  83           H        THR  83  -3.874  -9.522  -3.834
  626    HA   THR  83           HA       THR  83  -4.938  -6.951  -2.679
  627    HB   THR  83           HB       THR  83  -4.215  -7.645  -0.433
  628    HG1  THR  83           HG1      THR  83  -4.368 -10.292  -1.290
  629   HG21  THR  83          HG21      THR  83  -6.127  -9.158   0.035
  630   HG22  THR  83          HG22      THR  83  -6.576  -7.734  -0.906
  631   HG23  THR  83          HG23      THR  83  -6.433  -9.306  -1.712
  632    H    VAL  84           H        VAL  84  -3.499  -5.572  -1.613
  633    HA   VAL  84           HA       VAL  84  -0.610  -5.878  -2.241
  634    HB   VAL  84           HB       VAL  84  -0.562  -3.474  -2.957
  635   HG11  VAL  84          HG11      VAL  84  -2.158  -5.323  -4.759
  636   HG12  VAL  84          HG12      VAL  84  -1.245  -3.884  -5.259
  637   HG13  VAL  84          HG13      VAL  84  -0.390  -5.282  -4.586
  638   HG21  VAL  84          HG21      VAL  84  -2.556  -2.373  -3.764
  639   HG22  VAL  84          HG22      VAL  84  -3.575  -3.754  -3.322
  640   HG23  VAL  84          HG23      VAL  84  -2.792  -2.778  -2.062
  641    H    ILE  85           H        ILE  85   0.742  -4.329  -1.182
  642    HA   ILE  85           HA       ILE  85  -0.233  -3.425   1.457
  643    HB   ILE  85           HB       ILE  85   1.680  -4.247   2.564
  644   HG12  ILE  85          HG12      ILE  85   3.451  -4.064   1.024
  645   HG13  ILE  85          HG13      ILE  85   3.350  -5.738   1.553
  646   HG21  ILE  85          HG21      ILE  85   1.311  -6.623   2.527
  647   HG22  ILE  85          HG22      ILE  85  -0.232  -5.769   2.351
  648   HG23  ILE  85          HG23      ILE  85   0.526  -6.532   0.939
  649   HD11  ILE  85          HD11      ILE  85   2.644  -4.624  -1.162
  650   HD12  ILE  85          HD12      ILE  85   3.919  -5.768  -0.725
  651   HD13  ILE  85          HD13      ILE  85   2.226  -6.287  -0.651
  652    H    ALA  86           H        ALA  86   0.993  -1.799   2.514
  653    HA   ALA  86           HA       ALA  86   1.736   0.255   0.665
  654    HB1  ALA  86           HB1      ALA  86   2.022   0.311   3.693
  655    HB2  ALA  86           HB2      ALA  86   1.799   1.677   2.589
  656    HB3  ALA  86           HB3      ALA  86   0.477   0.537   2.853
  657    H    GLY  87           H        GLY  87   3.667   1.526   0.696
  658    HA2  GLY  87           HA2      GLY  87   5.964   1.962   0.831
  659    HA3  GLY  87           HA3      GLY  87   6.145   0.579   1.921
  660    H    SER  88           H        SER  88   4.594  -0.750  -0.620
  661    HA   SER  88           HA       SER  88   7.057  -1.792  -1.902
  662    HB2  SER  88           HB2      SER  88   4.146  -2.623  -2.123
  663    HB3  SER  88           HB3      SER  88   5.504  -3.396  -2.972
  664    HG   SER  88           HG       SER  88   5.278  -3.076  -0.157
  665    H    ILE  89           H        ILE  89   7.048  -2.023  -4.290
  666    HA   ILE  89           HA       ILE  89   6.319   0.622  -5.458
  667    HB   ILE  89           HB       ILE  89   8.481  -1.066  -6.642
  668   HG12  ILE  89          HG12      ILE  89   9.143  -1.230  -4.298
  669   HG13  ILE  89          HG13      ILE  89  10.243  -0.265  -5.247
  670   HG21  ILE  89          HG21      ILE  89   7.818   1.025  -7.715
  671   HG22  ILE  89          HG22      ILE  89   8.120   1.934  -6.226
  672   HG23  ILE  89          HG23      ILE  89   9.464   1.154  -7.093
  673   HD11  ILE  89          HD11      ILE  89   8.142   0.941  -3.392
  674   HD12  ILE  89          HD12      ILE  89   9.841   0.656  -2.978
  675   HD13  ILE  89          HD13      ILE  89   9.434   1.800  -4.264
  676    H    ASN  90           H        ASN  90   5.401   0.809  -7.454
  677    HA   ASN  90           HA       ASN  90   4.407  -1.606  -8.884
  678    HB2  ASN  90           HB2      ASN  90   2.751   0.060  -8.321
  679    HB3  ASN  90           HB3      ASN  90   3.710   1.374  -8.969
  680   HD21  ASN  90          HD22      ASN  90   0.976   0.738  -9.636
  681   HD22  ASN  90          HD21      ASN  90   0.963   0.364 -11.351
  682    H    GLN  91           H        GLN  91   5.257  -2.218 -10.841
  683    HA   GLN  91           HA       GLN  91   7.551  -0.726 -11.987
  684    HB2  GLN  91           HB2      GLN  91   7.678  -3.164 -11.800
  685    HB3  GLN  91           HB3      GLN  91   6.218  -3.342 -12.767
  686    HG2  GLN  91           HG2      GLN  91   8.204  -3.782 -14.101
  687    HG3  GLN  91           HG3      GLN  91   7.339  -2.385 -14.731
  688   HE21  GLN  91          HE22      GLN  91   8.427  -0.327 -14.793
  689   HE22  GLN  91          HE21      GLN  91  10.032  -0.113 -14.131
  690    H    ASN  92           H        ASN  92   4.631  -2.186 -13.502
  691    HA   ASN  92           HA       ASN  92   3.776   0.354 -14.594
  692    HB2  ASN  92           HB2      ASN  92   5.258  -0.559 -16.404
  693    HB3  ASN  92           HB3      ASN  92   4.338  -2.070 -16.386
  694   HD21  ASN  92          HD22      ASN  92   2.779  -2.136 -18.033
  695   HD22  ASN  92          HD21      ASN  92   1.821  -0.731 -18.468
  696    H    GLY  93           H        GLY  93   1.420   0.034 -15.411
  697    HA2  GLY  93           HA2      GLY  93  -0.442  -1.270 -15.633
  698    HA3  GLY  93           HA3      GLY  93  -0.001  -2.222 -14.236
  699    H    SER  94           H        SER  94  -2.408  -0.543 -14.952
  700    HA   SER  94           HA       SER  94  -2.342   1.635 -12.886
  701    HB2  SER  94           HB2      SER  94  -3.767   1.413 -15.562
  702    HB3  SER  94           HB3      SER  94  -4.088   2.676 -14.361
  703    HG   SER  94           HG       SER  94  -1.640   2.157 -15.744
  704    H    LEU  95           H        LEU  95  -3.188   0.656 -11.117
  705    HA   LEU  95           HA       LEU  95  -5.587  -1.118 -11.376
  706    HB2  LEU  95           HB2      LEU  95  -3.546  -0.802  -9.175
  707    HB3  LEU  95           HB3      LEU  95  -4.885  -1.931  -9.136
  708    HG   LEU  95           HG       LEU  95  -2.428  -2.007 -10.929
  709   HD11  LEU  95          HD11      LEU  95  -1.908  -2.551  -8.627
  710   HD12  LEU  95          HD12      LEU  95  -3.323  -3.612  -8.494
  711   HD13  LEU  95          HD13      LEU  95  -1.970  -4.073  -9.529
  712   HD21  LEU  95          HD21      LEU  95  -4.314  -2.958 -12.094
  713   HD22  LEU  95          HD22      LEU  95  -3.247  -4.271 -11.551
  714   HD23  LEU  95          HD23      LEU  95  -4.766  -3.943 -10.694
  715    H    LEU  96           H        LEU  96  -7.282  -1.046  -9.988
  716    HA   LEU  96           HA       LEU  96  -7.754   1.492  -8.481
  717    HB2  LEU  96           HB2      LEU  96  -9.240   0.682 -10.416
  718    HB3  LEU  96           HB3      LEU  96  -9.825  -0.566  -9.317
  719    HG   LEU  96           HG       LEU  96  -9.973   2.440  -8.836
  720   HD11  LEU  96          HD11      LEU  96 -12.171   0.490  -9.653
  721   HD12  LEU  96          HD12      LEU  96 -12.338   2.248  -9.445
  722   HD13  LEU  96          HD13      LEU  96 -11.369   1.599 -10.778
  723   HD21  LEU  96          HD21      LEU  96 -10.105   1.402  -6.712
  724   HD22  LEU  96          HD22      LEU  96 -11.722   1.881  -7.208
  725   HD23  LEU  96          HD23      LEU  96 -11.252   0.166  -7.311
  726    H    ILE  97           H        ILE  97  -7.339   1.354  -6.336
  727    HA   ILE  97           HA       ILE  97  -7.507  -1.270  -4.983
  728    HB   ILE  97           HB       ILE  97  -6.061   1.174  -3.970
  729   HG12  ILE  97          HG12      ILE  97  -5.095   0.944  -6.169
  730   HG13  ILE  97          HG13      ILE  97  -3.964   0.537  -4.900
  731   HG21  ILE  97          HG21      ILE  97  -5.689  -1.808  -3.499
  732   HG22  ILE  97          HG22      ILE  97  -4.665  -0.525  -2.814
  733   HG23  ILE  97          HG23      ILE  97  -6.372  -0.624  -2.372
  734   HD11  ILE  97          HD11      ILE  97  -5.454  -1.502  -6.598
  735   HD12  ILE  97          HD12      ILE  97  -3.767  -0.979  -6.810
  736   HD13  ILE  97          HD13      ILE  97  -4.237  -1.848  -5.345
  737    H    CYS  98           H        CYS  98  -9.005  -1.582  -3.393
  738    HA   CYS  98           HA       CYS  98 -10.203   0.809  -2.040
  739    HB2  CYS  98           HB2      CYS  98 -11.952  -0.739  -1.257
  740    HB3  CYS  98           HB3      CYS  98 -11.878  -0.620  -3.021
  741    HG   CYS  98           HG       CYS  98 -10.304  -2.885  -1.219
  742    H    ALA  99           H        ALA  99  -9.574   1.335  -0.047
  743    HA   ALA  99           HA       ALA  99  -7.405  -0.199   1.153
  744    HB1  ALA  99           HB1      ALA  99  -8.813   2.334   2.085
  745    HB2  ALA  99           HB2      ALA  99  -7.270   1.699   2.703
  746    HB3  ALA  99           HB3      ALA  99  -7.388   2.263   1.025
  747    H    THR 100           H        THR 100  -7.294  -1.185   3.186
  748    HA   THR 100           HA       THR 100  -9.798  -1.249   4.813
  749    HB   THR 100           HB       THR 100  -9.404  -3.570   5.474
  750    HG1  THR 100           HG1      THR 100  -7.862  -4.748   4.732
  751   HG21  THR 100          HG21      THR 100 -10.883  -3.198   3.526
  752   HG22  THR 100          HG22      THR 100  -9.491  -3.382   2.435
  753   HG23  THR 100          HG23      THR 100 -10.028  -4.744   3.441
  754    H    HIS 101           H        HIS 101  -6.529  -0.431   4.865
  755    HA   HIS 101           HA       HIS 101  -6.897   0.138   7.765
  756    HB2  HIS 101           HB2      HIS 101  -4.342  -0.824   6.433
  757    HB3  HIS 101           HB3      HIS 101  -4.503  -0.279   8.093
  758    HD1  HIS 101           HD1      HIS 101  -4.127  -3.345   6.353
  759    HD2  HIS 101           HD2      HIS 101  -6.508  -1.962   9.535
  760    HE1  HIS 101           HE1      HIS 101  -4.895  -5.428   7.640
  761    H    VAL 102           H        VAL 102  -6.218   2.194   8.367
  762    HA   VAL 102           HA       VAL 102  -5.188   4.084   6.331
  763    HB   VAL 102           HB       VAL 102  -5.094   5.712   8.179
  764   HG11  VAL 102          HG11      VAL 102  -7.719   4.288   7.663
  765   HG12  VAL 102          HG12      VAL 102  -7.589   5.872   8.420
  766   HG13  VAL 102          HG13      VAL 102  -6.996   5.636   6.759
  767   HG21  VAL 102          HG21      VAL 102  -4.782   4.154  10.094
  768   HG22  VAL 102          HG22      VAL 102  -6.116   5.278  10.321
  769   HG23  VAL 102          HG23      VAL 102  -6.464   3.595   9.887
  770    H    GLY 103           H        GLY 103  -3.077   5.462   7.339
  771    HA2  GLY 103           HA2      GLY 103  -1.055   3.541   6.538
  772    HA3  GLY 103           HA3      GLY 103  -0.786   5.183   7.019
  773    H    ALA 104           H        ALA 104  -1.868   5.112   9.672
  774    HA   ALA 104           HA       ALA 104   0.272   3.880  11.170
  775    HB1  ALA 104           HB1      ALA 104  -2.424   4.967  12.098
  776    HB2  ALA 104           HB2      ALA 104  -0.993   4.689  13.111
  777    HB3  ALA 104           HB3      ALA 104  -0.951   5.927  11.847
  778    H    ASP 105           H        ASP 105  -3.028   2.940  10.544
  779    HA   ASP 105           HA       ASP 105  -3.122   0.517  12.135
  780    HB2  ASP 105           HB2      ASP 105  -4.973   2.178  11.418
  781    HB3  ASP 105           HB3      ASP 105  -4.997   1.312   9.890
  782    H    THR 106           H        THR 106  -1.529   1.065   9.174
  783    HA   THR 106           HA       THR 106  -2.320  -1.220   7.644
  784    HB   THR 106           HB       THR 106  -0.162  -0.973   6.415
  785    HG1  THR 106           HG1      THR 106   0.293   1.333   7.928
  786   HG21  THR 106          HG21      THR 106  -1.759   1.535   6.600
  787   HG22  THR 106          HG22      THR 106  -0.584   1.127   5.343
  788   HG23  THR 106          HG23      THR 106  -2.058   0.151   5.552
  789    H    THR 107           H        THR 107  -1.189  -3.074   7.042
  790    HA   THR 107           HA       THR 107  -0.309  -4.784   9.066
  791    HB   THR 107           HB       THR 107  -1.104  -5.314   6.757
  792    HG1  THR 107           HG1      THR 107  -0.324  -6.927   8.016
  793   HG21  THR 107          HG21      THR 107   1.805  -4.993   5.926
  794   HG22  THR 107          HG22      THR 107   0.459  -5.600   4.943
  795   HG23  THR 107          HG23      THR 107   0.477  -3.902   5.445
  796    H    LEU 108           H        LEU 108   1.684  -2.317   7.549
  797    HA   LEU 108           HA       LEU 108   4.305  -3.312   8.141
  798    HB2  LEU 108           HB2      LEU 108   3.126  -0.510   7.926
  799    HB3  LEU 108           HB3      LEU 108   4.812  -0.789   8.322
  800    HG   LEU 108           HG       LEU 108   5.199  -1.914   6.163
  801   HD11  LEU 108          HD11      LEU 108   2.337  -1.084   5.586
  802   HD12  LEU 108          HD12      LEU 108   3.533  -1.591   4.359
  803   HD13  LEU 108          HD13      LEU 108   2.991  -2.756   5.570
  804   HD21  LEU 108          HD21      LEU 108   5.543   0.500   6.503
  805   HD22  LEU 108          HD22      LEU 108   5.016   0.169   4.839
  806   HD23  LEU 108          HD23      LEU 108   3.858   0.811   6.036
  807    H    SER 109           H        SER 109   1.979  -1.439  10.182
  808    HA   SER 109           HA       SER 109   3.942  -1.103  12.321
  809    HB2  SER 109           HB2      SER 109   2.149  -0.117  13.596
  810    HB3  SER 109           HB3      SER 109   2.186   0.560  11.960
  811    HG   SER 109           HG       SER 109   0.118   0.115  12.201
  812    H    GLN 110           H        GLN 110   1.881  -3.644  11.301
  813    HA   GLN 110           HA       GLN 110   1.606  -4.918  13.956
  814    HB2  GLN 110           HB2      GLN 110  -0.100  -5.255  12.192
  815    HB3  GLN 110           HB3      GLN 110   1.083  -6.031  11.179
  816    HG2  GLN 110           HG2      GLN 110  -0.055  -7.808  12.073
  817    HG3  GLN 110           HG3      GLN 110   1.424  -7.783  13.022
  818   HE21  GLN 110          HE22      GLN 110  -1.898  -6.400  13.023
  819   HE22  GLN 110          HE21      GLN 110  -2.109  -6.562  14.762
  820    H    ILE 111           H        ILE 111   3.765  -5.179  11.109
  821    HA   ILE 111           HA       ILE 111   5.247  -7.452  11.987
  822    HB   ILE 111           HB       ILE 111   6.093  -5.114  10.233
  823   HG12  ILE 111          HG12      ILE 111   5.285  -7.958   9.461
  824   HG13  ILE 111          HG13      ILE 111   4.154  -6.616   9.484
  825   HG21  ILE 111          HG21      ILE 111   7.495  -7.796  10.677
  826   HG22  ILE 111          HG22      ILE 111   7.942  -6.596   9.445
  827   HG23  ILE 111          HG23      ILE 111   8.121  -6.206  11.146
  828   HD11  ILE 111          HD11      ILE 111   6.587  -6.825   7.676
  829   HD12  ILE 111          HD12      ILE 111   4.882  -6.952   7.225
  830   HD13  ILE 111          HD13      ILE 111   5.520  -5.403   7.802
  831    H    VAL 112           H        VAL 112   6.165  -3.954  12.428
  832    HA   VAL 112           HA       VAL 112   8.340  -4.600  14.143
  833    HB   VAL 112           HB       VAL 112   8.437  -2.251  14.729
  834   HG11  VAL 112          HG11      VAL 112   7.725  -2.589  11.787
  835   HG12  VAL 112          HG12      VAL 112   8.739  -1.323  12.508
  836   HG13  VAL 112          HG13      VAL 112   9.293  -3.003  12.519
  837   HG21  VAL 112          HG21      VAL 112   5.801  -1.911  13.240
  838   HG22  VAL 112          HG22      VAL 112   6.038  -1.703  14.992
  839   HG23  VAL 112          HG23      VAL 112   6.839  -0.612  13.861
  840    H    LYS 113           H        LYS 113   5.002  -4.537  14.895
  841    HA   LYS 113           HA       LYS 113   5.381  -4.331  17.826
  842    HB2  LYS 113           HB2      LYS 113   2.936  -4.725  16.118
  843    HB3  LYS 113           HB3      LYS 113   2.934  -4.970  17.875
  844    HG2  LYS 113           HG2      LYS 113   3.862  -2.688  18.221
  845    HG3  LYS 113           HG3      LYS 113   3.789  -2.392  16.479
  846    HD2  LYS 113           HD2      LYS 113   1.387  -3.045  18.238
  847    HD3  LYS 113           HD3      LYS 113   1.888  -1.402  17.777
  848    HE2  LYS 113           HE2      LYS 113   1.630  -1.935  15.417
  849    HE3  LYS 113           HE3      LYS 113   1.217  -3.609  15.805
  850    HZ1  LYS 113           HZ1      LYS 113  -0.372  -1.223  16.584
  851    HZ2  LYS 113           HZ2      LYS 113  -0.745  -2.281  15.382
  852    HZ3  LYS 113           HZ3      LYS 113  -0.761  -2.816  16.934
  853    H    LEU 114           H        LEU 114   4.905  -6.921  15.382
  854    HA   LEU 114           HA       LEU 114   4.621  -9.032  17.330
  855    HB2  LEU 114           HB2      LEU 114   5.150  -8.759  14.372
  856    HB3  LEU 114           HB3      LEU 114   5.507 -10.311  15.121
  857    HG   LEU 114           HG       LEU 114   2.841  -8.880  15.211
  858   HD11  LEU 114          HD11      LEU 114   3.807 -11.167  13.448
  859   HD12  LEU 114          HD12      LEU 114   2.121 -10.594  13.554
  860   HD13  LEU 114          HD13      LEU 114   3.385  -9.524  12.931
  861   HD21  LEU 114          HD21      LEU 114   1.995 -11.187  15.870
  862   HD22  LEU 114          HD22      LEU 114   3.691 -11.710  16.022
  863   HD23  LEU 114          HD23      LEU 114   3.035 -10.455  17.087
  864    H    VAL 115           H        VAL 115   7.385  -7.632  15.670
  865    HA   VAL 115           HA       VAL 115   9.334  -9.461  16.827
  866    HB   VAL 115           HB       VAL 115   9.757  -6.706  15.616
  867   HG11  VAL 115          HG11      VAL 115  11.758  -8.875  16.426
  868   HG12  VAL 115          HG12      VAL 115  12.151  -7.487  15.397
  869   HG13  VAL 115          HG13      VAL 115  11.667  -7.218  17.074
  870   HG21  VAL 115          HG21      VAL 115  10.589  -7.999  13.674
  871   HG22  VAL 115          HG22      VAL 115  10.175  -9.517  14.499
  872   HG23  VAL 115          HG23      VAL 115   8.900  -8.386  14.011
  873    H    GLU 116           H        GLU 116   8.669  -5.991  17.753
  874    HA   GLU 116           HA       GLU 116  10.070  -6.262  20.174
  875    HB2  GLU 116           HB2      GLU 116   8.148  -4.248  19.072
  876    HB3  GLU 116           HB3      GLU 116   8.672  -4.100  20.751
  877    HG2  GLU 116           HG2      GLU 116  10.662  -4.432  18.478
  878    HG3  GLU 116           HG3      GLU 116  10.001  -2.857  18.918
  879    H    GLU 117           H        GLU 117   6.808  -7.454  19.685
  880    HA   GLU 117           HA       GLU 117   6.194  -7.574  22.559
  881    HB2  GLU 117           HB2      GLU 117   5.087  -8.883  20.054
  882    HB3  GLU 117           HB3      GLU 117   4.549  -9.368  21.654
  883    HG2  GLU 117           HG2      GLU 117   4.505  -6.411  21.114
  884    HG3  GLU 117           HG3      GLU 117   3.392  -7.407  20.191
  885    H    ALA 118           H        ALA 118   7.845  -9.624  20.161
  886    HA   ALA 118           HA       ALA 118   8.122 -11.917  21.902
  887    HB1  ALA 118           HB1      ALA 118   9.647 -11.118  19.383
  888    HB2  ALA 118           HB2      ALA 118   9.664 -12.717  20.152
  889    HB3  ALA 118           HB3      ALA 118   8.163 -12.086  19.454
  890    H    GLN 119           H        GLN 119  10.670  -9.639  20.766
  891    HA   GLN 119           HA       GLN 119  12.724 -10.050  22.392
  892    HB2  GLN 119           HB2      GLN 119  11.492  -7.441  21.451
  893    HB3  GLN 119           HB3      GLN 119  13.038  -7.519  22.284
  894    HG2  GLN 119           HG2      GLN 119  12.657  -7.564  19.571
  895    HG3  GLN 119           HG3      GLN 119  14.157  -7.738  20.486
  896   HE21  GLN 119          HE22      GLN 119  11.463  -9.413  18.994
  897   HE22  GLN 119          HE21      GLN 119  12.211 -10.991  19.093
  Start of MODEL   27
    1    H    SER   1           H        SER   1  18.896  -4.170  14.373
    2    HA   SER   1           HA       SER   1  16.153  -3.163  15.006
    3    HB2  SER   1           HB2      SER   1  18.961  -2.061  15.525
    4    HB3  SER   1           HB3      SER   1  17.461  -1.244  15.978
    5    HG   SER   1           HG       SER   1  16.970  -2.821  17.379
    6    H    GLU   2           H        GLU   2  18.923  -2.612  12.836
    7    HA   GLU   2           HA       GLU   2  17.950  -0.266  11.497
    8    HB2  GLU   2           HB2      GLU   2  19.777  -2.551  10.666
    9    HB3  GLU   2           HB3      GLU   2  19.505  -1.123   9.659
   10    HG2  GLU   2           HG2      GLU   2  20.479   0.350  11.249
   11    HG3  GLU   2           HG3      GLU   2  20.476  -0.865  12.523
   12    H    ALA   3           H        ALA   3  17.337  -3.786  10.926
   13    HA   ALA   3           HA       ALA   3  15.991  -3.363   8.391
   14    HB1  ALA   3           HB1      ALA   3  17.140  -5.466   8.963
   15    HB2  ALA   3           HB2      ALA   3  16.076  -5.690  10.372
   16    HB3  ALA   3           HB3      ALA   3  15.408  -5.763   8.729
   17    H    LEU   4           H        LEU   4  15.101  -3.320  11.796
   18    HA   LEU   4           HA       LEU   4  12.198  -3.498  11.446
   19    HB2  LEU   4           HB2      LEU   4  13.312  -4.297  13.491
   20    HB3  LEU   4           HB3      LEU   4  14.055  -2.728  13.732
   21    HG   LEU   4           HG       LEU   4  11.827  -1.699  14.159
   22   HD11  LEU   4          HD11      LEU   4  10.954  -4.603  14.087
   23   HD12  LEU   4          HD12      LEU   4   9.979  -3.242  14.716
   24   HD13  LEU   4          HD13      LEU   4  10.416  -3.310  12.990
   25   HD21  LEU   4          HD21      LEU   4  13.221  -2.397  15.991
   26   HD22  LEU   4          HD22      LEU   4  11.535  -2.757  16.376
   27   HD23  LEU   4          HD23      LEU   4  12.631  -4.072  15.883
   28    H    ALA   5           H        ALA   5  14.595  -0.971  11.149
   29    HA   ALA   5           HA       ALA   5  12.747   1.221  11.850
   30    HB1  ALA   5           HB1      ALA   5  14.776   2.617  11.411
   31    HB2  ALA   5           HB2      ALA   5  15.036   1.418  12.692
   32    HB3  ALA   5           HB3      ALA   5  15.698   1.145  11.069
   33    H    LYS   6           H        LYS   6  14.287  -0.428   9.058
   34    HA   LYS   6           HA       LYS   6  13.639   1.546   7.114
   35    HB2  LYS   6           HB2      LYS   6  15.325  -0.338   6.971
   36    HB3  LYS   6           HB3      LYS   6  13.987  -1.444   6.633
   37    HG2  LYS   6           HG2      LYS   6  13.442  -0.205   4.579
   38    HG3  LYS   6           HG3      LYS   6  14.614   1.061   4.994
   39    HD2  LYS   6           HD2      LYS   6  16.457  -0.616   4.847
   40    HD3  LYS   6           HD3      LYS   6  15.277  -1.847   4.354
   41    HE2  LYS   6           HE2      LYS   6  14.716  -0.554   2.343
   42    HE3  LYS   6           HE3      LYS   6  15.763   0.776   2.864
   43    HZ1  LYS   6           HZ1      LYS   6  17.674  -0.694   2.635
   44    HZ2  LYS   6           HZ2      LYS   6  16.736  -1.967   2.253
   45    HZ3  LYS   6           HZ3      LYS   6  16.839  -0.680   1.222
   46    H    LEU   7           H        LEU   7  11.650  -1.027   8.437
   47    HA   LEU   7           HA       LEU   7   9.479  -0.886   6.562
   48    HB2  LEU   7           HB2      LEU   7   9.784  -1.764   9.436
   49    HB3  LEU   7           HB3      LEU   7   8.167  -1.554   8.797
   50    HG   LEU   7           HG       LEU   7   8.893  -3.874   8.729
   51   HD11  LEU   7          HD11      LEU   7   8.185  -4.404   6.475
   52   HD12  LEU   7          HD12      LEU   7   7.237  -3.049   7.112
   53   HD13  LEU   7          HD13      LEU   7   8.531  -2.758   5.923
   54   HD21  LEU   7          HD21      LEU   7  11.278  -3.608   8.289
   55   HD22  LEU   7          HD22      LEU   7  10.529  -4.693   7.117
   56   HD23  LEU   7          HD23      LEU   7  10.939  -3.036   6.634
   57    H    ILE   8           H        ILE   8  10.322   1.351   9.183
   58    HA   ILE   8           HA       ILE   8   7.826   2.877   8.927
   59    HB   ILE   8           HB       ILE   8  10.445   3.525  10.283
   60   HG12  ILE   8          HG12      ILE   8   9.259   1.681  11.356
   61   HG13  ILE   8          HG13      ILE   8   9.255   3.116  12.367
   62   HG21  ILE   8          HG21      ILE   8   7.844   5.099  10.283
   63   HG22  ILE   8          HG22      ILE   8   9.185   5.354  11.420
   64   HG23  ILE   8          HG23      ILE   8   9.430   5.631   9.698
   65   HD11  ILE   8          HD11      ILE   8   6.902   2.042  10.738
   66   HD12  ILE   8          HD12      ILE   8   7.099   2.017  12.499
   67   HD13  ILE   8          HD13      ILE   8   6.872   3.558  11.673
   68    H    SER   9           H        SER   9  11.062   2.936   7.465
   69    HA   SER   9           HA       SER   9  10.760   5.511   6.157
   70    HB2  SER   9           HB2      SER   9  12.636   3.220   5.453
   71    HB3  SER   9           HB3      SER   9  12.783   4.917   4.985
   72    HG   SER   9           HG       SER   9  14.114   4.586   6.686
   73    H    LEU  10           H        LEU  10  10.064   2.172   5.282
   74    HA   LEU  10           HA       LEU  10   9.793   2.294   2.503
   75    HB2  LEU  10           HB2      LEU  10   9.580   0.394   4.488
   76    HB3  LEU  10           HB3      LEU  10   7.890   0.611   4.103
   77    HG   LEU  10           HG       LEU  10   8.604   0.204   1.625
   78   HD11  LEU  10          HD11      LEU  10  11.049  -0.902   3.094
   79   HD12  LEU  10          HD12      LEU  10  10.689  -1.105   1.367
   80   HD13  LEU  10          HD13      LEU  10  11.070   0.499   2.018
   81   HD21  LEU  10          HD21      LEU  10   7.408  -1.459   3.034
   82   HD22  LEU  10          HD22      LEU  10   8.596  -2.236   1.974
   83   HD23  LEU  10          HD23      LEU  10   8.952  -1.999   3.703
   84    H    GLN  11           H        GLN  11   7.666   3.571   4.880
   85    HA   GLN  11           HA       GLN  11   5.191   3.250   3.470
   86    HB2  GLN  11           HB2      GLN  11   6.032   4.546   6.033
   87    HB3  GLN  11           HB3      GLN  11   4.377   4.706   5.447
   88    HG2  GLN  11           HG2      GLN  11   4.129   2.274   5.248
   89    HG3  GLN  11           HG3      GLN  11   5.794   2.030   5.810
   90   HE21  GLN  11          HE22      GLN  11   6.089   1.795   7.995
   91   HE22  GLN  11          HE21      GLN  11   4.895   2.429   9.156
   92    H    ALA  12           H        ALA  12   3.656   4.891   2.916
   93    HA   ALA  12           HA       ALA  12   4.977   6.800   1.082
   94    HB1  ALA  12           HB1      ALA  12   2.151   5.688   1.129
   95    HB2  ALA  12           HB2      ALA  12   2.906   6.613  -0.184
   96    HB3  ALA  12           HB3      ALA  12   3.512   4.995   0.216
   97    H    THR  13           H        THR  13   2.598   6.861   3.713
   98    HA   THR  13           HA       THR  13   1.967   8.510   5.113
   99    HB   THR  13           HB       THR  13   3.911  10.437   3.851
  100    HG1  THR  13           HG1      THR  13   5.386   9.149   4.394
  101   HG21  THR  13          HG21      THR  13   2.544  11.437   5.610
  102   HG22  THR  13          HG22      THR  13   2.879  10.065   6.696
  103   HG23  THR  13          HG23      THR  13   4.182  11.173   6.219
  104    H    GLU  14           H        GLU  14   1.887   9.521   1.693
  105    HA   GLU  14           HA       GLU  14  -0.648  10.957   2.221
  106    HB2  GLU  14           HB2      GLU  14   0.026  12.824   0.857
  107    HB3  GLU  14           HB3      GLU  14   1.133  12.608   2.209
  108    HG2  GLU  14           HG2      GLU  14   2.612  11.296   0.464
  109    HG3  GLU  14           HG3      GLU  14   1.603  12.100  -0.739
  110    H    ALA  15           H        ALA  15  -2.127  11.047   0.446
  111    HA   ALA  15           HA       ALA  15  -1.665   9.098  -1.728
  112    HB1  ALA  15           HB1      ALA  15  -3.768   8.742   0.453
  113    HB2  ALA  15           HB2      ALA  15  -3.593   7.731  -0.996
  114    HB3  ALA  15           HB3      ALA  15  -2.314   7.739   0.231
  115    H    THR  16           H        THR  16  -3.313   9.011  -3.292
  116    HA   THR  16           HA       THR  16  -5.163  11.385  -3.378
  117    HB   THR  16           HB       THR  16  -4.005   9.859  -5.711
  118    HG1  THR  16           HG1      THR  16  -2.500  11.141  -4.775
  119   HG21  THR  16          HG21      THR  16  -6.193  10.769  -6.328
  120   HG22  THR  16          HG22      THR  16  -5.797  12.331  -5.577
  121   HG23  THR  16          HG23      THR  16  -4.922  11.783  -7.026
  122    H    ILE  17           H        ILE  17  -7.151  11.028  -2.970
  123    HA   ILE  17           HA       ILE  17  -8.459   8.388  -3.097
  124    HB   ILE  17           HB       ILE  17  -9.421  11.168  -2.264
  125   HG12  ILE  17          HG12      ILE  17  -8.560   8.839  -0.522
  126   HG13  ILE  17          HG13      ILE  17  -7.682  10.345  -0.754
  127   HG21  ILE  17          HG21      ILE  17 -10.805   8.468  -2.028
  128   HG22  ILE  17          HG22      ILE  17 -11.358   9.960  -1.227
  129   HG23  ILE  17          HG23      ILE  17 -11.346   9.881  -2.961
  130   HD11  ILE  17          HD11      ILE  17  -9.665  11.560   0.257
  131   HD12  ILE  17          HD12      ILE  17 -10.317   9.955   0.697
  132   HD13  ILE  17          HD13      ILE  17  -8.777  10.479   1.345
  133    H    VAL  18           H        VAL  18 -10.101   7.873  -4.546
  134    HA   VAL  18           HA       VAL  18 -10.906   9.995  -6.532
  135    HB   VAL  18           HB       VAL  18 -11.090   7.016  -6.967
  136   HG11  VAL  18          HG11      VAL  18 -11.667   9.383  -8.788
  137   HG12  VAL  18          HG12      VAL  18 -11.651   7.677  -9.285
  138   HG13  VAL  18          HG13      VAL  18 -12.861   8.247  -8.132
  139   HG21  VAL  18          HG21      VAL  18  -9.349   7.440  -8.722
  140   HG22  VAL  18          HG22      VAL  18  -9.104   9.048  -8.006
  141   HG23  VAL  18          HG23      VAL  18  -8.769   7.592  -7.058
  142    H    THR  19           H        THR  19 -12.746  10.904  -6.088
  143    HA   THR  19           HA       THR  19 -14.779   9.560  -4.342
  144    HB   THR  19           HB       THR  19 -14.016  12.470  -4.690
  145    HG1  THR  19           HG1      THR  19 -13.374  12.319  -2.673
  146   HG21  THR  19          HG21      THR  19 -16.364  11.198  -3.238
  147   HG22  THR  19          HG22      THR  19 -15.784  12.850  -2.920
  148   HG23  THR  19          HG23      THR  19 -16.432  12.444  -4.508
  149    H    LEU  20           H        LEU  20 -16.902   9.436  -5.007
  150    HA   LEU  20           HA       LEU  20 -17.458  10.058  -7.846
  151    HB2  LEU  20           HB2      LEU  20 -19.259   8.733  -5.789
  152    HB3  LEU  20           HB3      LEU  20 -19.525   8.843  -7.515
  153    HG   LEU  20           HG       LEU  20 -17.196   7.325  -6.242
  154   HD11  LEU  20          HD11      LEU  20 -19.823   6.272  -7.356
  155   HD12  LEU  20          HD12      LEU  20 -18.439   5.294  -6.825
  156   HD13  LEU  20          HD13      LEU  20 -19.320   6.283  -5.655
  157   HD21  LEU  20          HD21      LEU  20 -18.247   7.381  -9.107
  158   HD22  LEU  20          HD22      LEU  20 -16.691   8.025  -8.539
  159   HD23  LEU  20          HD23      LEU  20 -16.994   6.285  -8.485
  160    H    ASP  21           H        ASP  21 -17.575  12.249  -7.985
  161    HA   ASP  21           HA       ASP  21 -18.838  13.856  -5.930
  162    HB2  ASP  21           HB2      ASP  21 -17.003  14.323  -8.057
  163    HB3  ASP  21           HB3      ASP  21 -18.382  15.370  -8.357
  164    H    SER  22           H        SER  22 -20.122  12.201  -8.434
  165    HA   SER  22           HA       SER  22 -22.776  13.030  -7.816
  166    HB2  SER  22           HB2      SER  22 -22.158  13.386 -10.756
  167    HB3  SER  22           HB3      SER  22 -23.741  13.416 -10.008
  168    HG   SER  22           HG       SER  22 -22.763  15.468 -10.453
  169    H    ASP  23           H        ASP  23 -24.203  11.550  -8.183
  170    HA   ASP  23           HA       ASP  23 -24.301   9.179  -7.584
  171    HB2  ASP  23           HB2      ASP  23 -26.226  10.479  -8.373
  172    HB3  ASP  23           HB3      ASP  23 -25.892   9.998 -10.034
  173    H    ASN  24           H        ASN  24 -22.045   8.490  -8.302
  174    HA   ASN  24           HA       ASN  24 -20.594   7.043  -9.251
  175    HB2  ASN  24           HB2      ASN  24 -22.623   5.444  -8.906
  176    HB3  ASN  24           HB3      ASN  24 -22.788   5.526 -10.667
  177   HD21  ASN  24          HD22      ASN  24 -19.798   5.524 -11.030
  178   HD22  ASN  24          HD21      ASN  24 -19.432   3.838 -10.675
  179    H    ILE  25           H        ILE  25 -22.693   8.860 -11.299
  180    HA   ILE  25           HA       ILE  25 -21.502   8.439 -13.809
  181    HB   ILE  25           HB       ILE  25 -22.798  10.634 -14.232
  182   HG12  ILE  25          HG12      ILE  25 -23.906  10.240 -11.472
  183   HG13  ILE  25          HG13      ILE  25 -22.740  11.487 -11.926
  184   HG21  ILE  25          HG21      ILE  25 -24.264   8.228 -13.048
  185   HG22  ILE  25          HG22      ILE  25 -24.921   9.375 -14.237
  186   HG23  ILE  25          HG23      ILE  25 -23.594   8.301 -14.684
  187   HD11  ILE  25          HD11      ILE  25 -24.970  12.424 -11.908
  188   HD12  ILE  25          HD12      ILE  25 -24.372  12.387 -13.579
  189   HD13  ILE  25          HD13      ILE  25 -25.563  11.185 -13.021
  190    H    LEU  26           H        LEU  26 -20.455  10.538 -11.198
  191    HA   LEU  26           HA       LEU  26 -18.592  11.963 -13.060
  192    HB2  LEU  26           HB2      LEU  26 -20.450  13.384 -12.352
  193    HB3  LEU  26           HB3      LEU  26 -20.085  12.986 -10.674
  194    HG   LEU  26           HG       LEU  26 -17.898  14.142 -10.841
  195   HD11  LEU  26          HD11      LEU  26 -18.967  14.910 -13.579
  196   HD12  LEU  26          HD12      LEU  26 -17.552  15.648 -12.788
  197   HD13  LEU  26          HD13      LEU  26 -17.506  13.941 -13.257
  198   HD21  LEU  26          HD21      LEU  26 -19.927  15.331 -10.040
  199   HD22  LEU  26          HD22      LEU  26 -18.791  16.410 -10.861
  200   HD23  LEU  26          HD23      LEU  26 -20.262  15.861 -11.698
  201    H    LEU  27           H        LEU  27 -16.608  11.876 -12.609
  202    HA   LEU  27           HA       LEU  27 -15.614  10.888  -9.940
  203    HB2  LEU  27           HB2      LEU  27 -14.583  10.408 -12.732
  204    HB3  LEU  27           HB3      LEU  27 -13.468  10.421 -11.374
  205    HG   LEU  27           HG       LEU  27 -14.767   8.657 -10.226
  206   HD11  LEU  27          HD11      LEU  27 -16.390   8.569 -12.806
  207   HD12  LEU  27          HD12      LEU  27 -16.359   7.272 -11.589
  208   HD13  LEU  27          HD13      LEU  27 -17.001   8.849 -11.159
  209   HD21  LEU  27          HD21      LEU  27 -12.819   8.131 -11.633
  210   HD22  LEU  27          HD22      LEU  27 -14.021   6.834 -11.703
  211   HD23  LEU  27          HD23      LEU  27 -13.871   7.980 -13.055
  212    H    SER  28           H        SER  28 -14.304  12.007  -8.735
  213    HA   SER  28           HA       SER  28 -12.556  14.094  -9.910
  214    HB2  SER  28           HB2      SER  28 -14.553  15.290  -9.018
  215    HB3  SER  28           HB3      SER  28 -14.255  14.553  -7.431
  216    HG   SER  28           HG       SER  28 -13.136  16.387  -7.270
  217    H    GLU  29           H        GLU  29 -10.521  13.893  -9.184
  218    HA   GLU  29           HA       GLU  29 -10.007  12.033  -6.952
  219    HB2  GLU  29           HB2      GLU  29  -7.923  13.044  -8.889
  220    HB3  GLU  29           HB3      GLU  29  -7.902  11.642  -7.826
  221    HG2  GLU  29           HG2      GLU  29  -8.325  10.569  -9.763
  222    HG3  GLU  29           HG3      GLU  29  -9.975  10.832  -9.259
  223    H    GLU  30           H        GLU  30  -8.935  12.559  -5.097
  224    HA   GLU  30           HA       GLU  30  -8.464  15.460  -4.518
  225    HB2  GLU  30           HB2      GLU  30  -9.785  13.621  -2.513
  226    HB3  GLU  30           HB3      GLU  30  -9.863  15.369  -2.653
  227    HG2  GLU  30           HG2      GLU  30 -11.217  14.917  -4.844
  228    HG3  GLU  30           HG3      GLU  30 -11.331  13.250  -4.268
  229    H    GLN  31           H        GLN  31  -6.591  15.921  -3.174
  230    HA   GLN  31           HA       GLN  31  -4.978  13.511  -2.507
  231    HB2  GLN  31           HB2      GLN  31  -3.941  16.332  -2.839
  232    HB3  GLN  31           HB3      GLN  31  -3.028  14.813  -2.784
  233    HG2  GLN  31           HG2      GLN  31  -4.327  14.149  -4.901
  234    HG3  GLN  31           HG3      GLN  31  -4.683  15.889  -5.079
  235   HE21  GLN  31          HE22      GLN  31  -2.517  13.345  -5.302
  236   HE22  GLN  31          HE21      GLN  31  -1.168  14.233  -4.778
  237    H    VAL  32           H        VAL  32  -4.397  13.003  -0.503
  238    HA   VAL  32           HA       VAL  32  -4.771  14.910   1.773
  239    HB   VAL  32           HB       VAL  32  -6.107  13.350   3.000
  240   HG11  VAL  32          HG11      VAL  32  -7.332  14.811   1.386
  241   HG12  VAL  32          HG12      VAL  32  -7.379  13.445   0.240
  242   HG13  VAL  32          HG13      VAL  32  -8.182  13.313   1.810
  243   HG21  VAL  32          HG21      VAL  32  -5.140  11.208   2.128
  244   HG22  VAL  32          HG22      VAL  32  -6.894  11.241   2.173
  245   HG23  VAL  32          HG23      VAL  32  -6.039  11.452   0.619
  246    H    ASP  33           H        ASP  33  -4.271  13.611   3.899
  247    HA   ASP  33           HA       ASP  33  -1.640  12.193   3.669
  248    HB2  ASP  33           HB2      ASP  33  -3.053  13.477   6.012
  249    HB3  ASP  33           HB3      ASP  33  -1.748  12.323   6.224
  250    H    VAL  34           H        VAL  34  -1.389  10.112   4.340
  251    HA   VAL  34           HA       VAL  34  -3.574   8.334   4.068
  252    HB   VAL  34           HB       VAL  34  -1.143   7.831   3.667
  253   HG11  VAL  34          HG11      VAL  34  -1.117   7.041   6.613
  254   HG12  VAL  34          HG12      VAL  34   0.172   6.798   5.420
  255   HG13  VAL  34          HG13      VAL  34  -0.269   8.434   5.921
  256   HG21  VAL  34          HG21      VAL  34  -1.377   5.446   4.070
  257   HG22  VAL  34          HG22      VAL  34  -2.717   5.720   5.188
  258   HG23  VAL  34          HG23      VAL  34  -2.903   6.127   3.468
  259    H    GLU  35           H        GLU  35  -2.536   9.827   7.061
  260    HA   GLU  35           HA       GLU  35  -4.074   8.180   8.864
  261    HB2  GLU  35           HB2      GLU  35  -2.354   9.759   9.598
  262    HB3  GLU  35           HB3      GLU  35  -3.269  11.125   8.947
  263    HG2  GLU  35           HG2      GLU  35  -5.028  10.806  10.585
  264    HG3  GLU  35           HG3      GLU  35  -4.311   9.277  11.126
  265    H    LEU  36           H        LEU  36  -5.054  10.541   6.451
  266    HA   LEU  36           HA       LEU  36  -7.684  11.007   7.716
  267    HB2  LEU  36           HB2      LEU  36  -6.374  12.459   5.398
  268    HB3  LEU  36           HB3      LEU  36  -7.739  12.995   6.364
  269    HG   LEU  36           HG       LEU  36  -4.852  12.753   7.326
  270   HD11  LEU  36          HD11      LEU  36  -6.588  15.198   6.804
  271   HD12  LEU  36          HD12      LEU  36  -4.909  15.188   7.382
  272   HD13  LEU  36          HD13      LEU  36  -5.282  14.624   5.746
  273   HD21  LEU  36          HD21      LEU  36  -6.433  12.359   9.193
  274   HD22  LEU  36          HD22      LEU  36  -5.619  13.921   9.346
  275   HD23  LEU  36          HD23      LEU  36  -7.295  13.852   8.762
  276    H    VAL  37           H        VAL  37  -6.422   9.121   5.094
  277    HA   VAL  37           HA       VAL  37  -8.502   9.447   3.211
  278    HB   VAL  37           HB       VAL  37  -7.962   7.267   2.283
  279   HG11  VAL  37          HG11      VAL  37  -5.528   8.880   3.072
  280   HG12  VAL  37          HG12      VAL  37  -5.537   7.583   1.857
  281   HG13  VAL  37          HG13      VAL  37  -6.528   9.014   1.605
  282   HG21  VAL  37          HG21      VAL  37  -6.225   6.821   4.732
  283   HG22  VAL  37          HG22      VAL  37  -7.632   5.858   4.222
  284   HG23  VAL  37          HG23      VAL  37  -6.167   5.848   3.251
  285    H    GLN  38           H        GLN  38  -8.491   7.429   6.105
  286    HA   GLN  38           HA       GLN  38  -9.816   6.150   7.144
  287    HB2  GLN  38           HB2      GLN  38 -11.921   8.041   6.104
  288    HB3  GLN  38           HB3      GLN  38 -12.183   6.838   7.376
  289    HG2  GLN  38           HG2      GLN  38 -10.485   7.840   8.799
  290    HG3  GLN  38           HG3      GLN  38  -9.915   8.906   7.513
  291   HE21  GLN  38          HE22      GLN  38 -12.998   8.179   9.172
  292   HE22  GLN  38          HE21      GLN  38 -13.487   9.863   9.002
  293    H    ARG  39           H        ARG  39 -11.163   4.423   7.290
  294    HA   ARG  39           HA       ARG  39 -10.607   2.610   5.170
  295    HB2  ARG  39           HB2      ARG  39 -11.295   0.899   6.734
  296    HB3  ARG  39           HB3      ARG  39 -10.312   2.129   7.524
  297    HG2  ARG  39           HG2      ARG  39 -12.748   3.139   8.111
  298    HG3  ARG  39           HG3      ARG  39 -13.225   1.456   7.842
  299    HD2  ARG  39           HD2      ARG  39 -11.701   0.688   9.580
  300    HD3  ARG  39           HD3      ARG  39 -10.984   2.319   9.701
  301    HE   ARG  39           HE       ARG  39 -13.721   2.654  10.173
  302   HH11  ARG  39          HH11      ARG  39 -11.225   0.861  11.956
  303   HH12  ARG  39          HH12      ARG  39 -11.946   1.334  13.475
  304   HH21  ARG  39          HH21      ARG  39 -14.403   3.266  12.030
  305   HH22  ARG  39          HH22      ARG  39 -13.643   2.733  13.522
  306    H    GLY  40           H        GLY  40 -12.327   4.288   4.011
  307    HA2  GLY  40           HA2      GLY  40 -14.233   2.402   2.817
  308    HA3  GLY  40           HA3      GLY  40 -14.997   3.777   3.610
  309    H    ASP  41           H        ASP  41 -11.934   4.527   2.120
  310    HA   ASP  41           HA       ASP  41 -13.274   5.360  -0.426
  311    HB2  ASP  41           HB2      ASP  41 -11.209   6.669   1.299
  312    HB3  ASP  41           HB3      ASP  41 -10.972   6.791  -0.431
  313    H    ILE  42           H        ILE  42 -11.693   5.615  -2.253
  314    HA   ILE  42           HA       ILE  42 -10.031   3.169  -2.547
  315    HB   ILE  42           HB       ILE  42 -11.984   4.271  -4.600
  316   HG12  ILE  42          HG12      ILE  42 -12.003   1.780  -2.843
  317   HG13  ILE  42          HG13      ILE  42 -13.194   3.074  -2.885
  318   HG21  ILE  42          HG21      ILE  42 -10.138   1.848  -4.776
  319   HG22  ILE  42          HG22      ILE  42 -11.251   2.437  -6.030
  320   HG23  ILE  42          HG23      ILE  42  -9.852   3.405  -5.589
  321   HD11  ILE  42          HD11      ILE  42 -12.739   0.966  -5.023
  322   HD12  ILE  42          HD12      ILE  42 -14.111   1.123  -3.928
  323   HD13  ILE  42          HD13      ILE  42 -13.855   2.352  -5.187
  324    H    ILE  43           H        ILE  43  -8.017   3.554  -3.251
  325    HA   ILE  43           HA       ILE  43  -7.254   6.326  -3.911
  326    HB   ILE  43           HB       ILE  43  -5.681   3.958  -2.817
  327   HG12  ILE  43          HG12      ILE  43  -7.312   4.431  -1.132
  328   HG13  ILE  43          HG13      ILE  43  -5.747   5.001  -0.595
  329   HG21  ILE  43          HG21      ILE  43  -4.922   6.898  -2.887
  330   HG22  ILE  43          HG22      ILE  43  -4.000   5.600  -2.111
  331   HG23  ILE  43          HG23      ILE  43  -4.206   5.603  -3.858
  332   HD11  ILE  43          HD11      ILE  43  -7.493   6.576   0.023
  333   HD12  ILE  43          HD12      ILE  43  -6.422   7.348  -1.162
  334   HD13  ILE  43          HD13      ILE  43  -8.020   6.729  -1.654
  335    H    LYS  44           H        LYS  44  -6.364   6.792  -5.918
  336    HA   LYS  44           HA       LYS  44  -5.533   4.626  -7.723
  337    HB2  LYS  44           HB2      LYS  44  -6.737   6.546  -8.581
  338    HB3  LYS  44           HB3      LYS  44  -5.351   7.590  -8.187
  339    HG2  LYS  44           HG2      LYS  44  -3.890   6.261  -9.647
  340    HG3  LYS  44           HG3      LYS  44  -5.175   5.089  -9.960
  341    HD2  LYS  44           HD2      LYS  44  -5.397   8.015 -10.690
  342    HD3  LYS  44           HD3      LYS  44  -4.650   6.800 -11.745
  343    HE2  LYS  44           HE2      LYS  44  -6.775   5.481 -11.697
  344    HE3  LYS  44           HE3      LYS  44  -7.533   6.798 -10.779
  345    HZ1  LYS  44           HZ1      LYS  44  -6.472   6.950 -13.549
  346    HZ2  LYS  44           HZ2      LYS  44  -8.040   7.079 -13.055
  347    HZ3  LYS  44           HZ3      LYS  44  -6.978   8.266 -12.678
  348    H    VAL  45           H        VAL  45  -3.607   3.698  -7.830
  349    HA   VAL  45           HA       VAL  45  -1.198   5.116  -6.821
  350    HB   VAL  45           HB       VAL  45  -1.878   2.798  -5.993
  351   HG11  VAL  45          HG11      VAL  45  -0.586   1.863  -8.593
  352   HG12  VAL  45          HG12      VAL  45  -1.127   0.862  -7.246
  353   HG13  VAL  45          HG13      VAL  45  -2.319   1.753  -8.214
  354   HG21  VAL  45          HG21      VAL  45   0.320   3.787  -5.532
  355   HG22  VAL  45          HG22      VAL  45   0.468   2.049  -5.827
  356   HG23  VAL  45          HG23      VAL  45   0.940   3.204  -7.092
  357    H    VAL  46           H        VAL  46   0.377   5.825  -8.162
  358    HA   VAL  46           HA       VAL  46  -0.086   5.573 -11.064
  359    HB   VAL  46           HB       VAL  46   1.442   7.413 -11.325
  360   HG11  VAL  46          HG11      VAL  46  -0.913   7.869 -10.753
  361   HG12  VAL  46          HG12      VAL  46  -0.453   7.977  -9.038
  362   HG13  VAL  46          HG13      VAL  46   0.198   9.136 -10.209
  363   HG21  VAL  46          HG21      VAL  46   2.530   8.562  -9.520
  364   HG22  VAL  46          HG22      VAL  46   1.882   7.425  -8.332
  365   HG23  VAL  46          HG23      VAL  46   3.085   6.885  -9.519
  366    HA   PRO  47           HA       PRO  47   3.462   3.031 -12.147
  367    HB2  PRO  47           HB2      PRO  47   4.428   5.274 -13.915
  368    HB3  PRO  47           HB3      PRO  47   4.225   3.540 -14.307
  369    HG2  PRO  47           HG2      PRO  47   2.401   5.335 -15.176
  370    HG3  PRO  47           HG3      PRO  47   1.827   3.793 -14.448
  371    HD2  PRO  47           HD2      PRO  47   2.103   6.488 -13.129
  372    HD3  PRO  47           HD3      PRO  47   0.695   5.383 -13.126
  373    H    GLY  48           H        GLY  48   5.421   2.734 -11.079
  374    HA2  GLY  48           HA2      GLY  48   7.281   3.179  -9.822
  375    HA3  GLY  48           HA3      GLY  48   7.181   4.882 -10.261
  376    H    GLY  49           H        GLY  49   4.167   4.308  -9.026
  377    HA2  GLY  49           HA2      GLY  49   4.737   5.649  -6.524
  378    HA3  GLY  49           HA3      GLY  49   3.165   5.105  -7.110
  379    H    LYS  50           H        LYS  50   3.917   4.952  -4.423
  380    HA   LYS  50           HA       LYS  50   4.248   2.016  -3.934
  381    HB2  LYS  50           HB2      LYS  50   4.466   4.297  -1.940
  382    HB3  LYS  50           HB3      LYS  50   4.755   2.575  -1.632
  383    HG2  LYS  50           HG2      LYS  50   6.608   2.656  -3.341
  384    HG3  LYS  50           HG3      LYS  50   6.371   4.406  -3.436
  385    HD2  LYS  50           HD2      LYS  50   6.783   4.514  -0.926
  386    HD3  LYS  50           HD3      LYS  50   7.253   2.798  -0.998
  387    HE2  LYS  50           HE2      LYS  50   8.964   3.375  -2.730
  388    HE3  LYS  50           HE3      LYS  50   8.493   5.074  -2.615
  389    HZ1  LYS  50           HZ1      LYS  50  10.407   4.704  -1.294
  390    HZ2  LYS  50           HZ2      LYS  50   9.171   4.976  -0.238
  391    HZ3  LYS  50           HZ3      LYS  50   9.762   3.445  -0.487
  392    H    PHE  51           H        PHE  51   2.814   0.872  -2.754
  393    HA   PHE  51           HA       PHE  51   0.066   1.832  -2.581
  394    HB2  PHE  51           HB2      PHE  51   1.372  -0.683  -1.518
  395    HB3  PHE  51           HB3      PHE  51  -0.351  -0.341  -1.437
  396    HD1  PHE  51           HD2      PHE  51  -1.752  -0.351  -3.496
  397    HD2  PHE  51           HD1      PHE  51   2.443  -1.266  -3.646
  398    HE1  PHE  51           HE2      PHE  51  -2.020  -1.294  -5.788
  399    HE2  PHE  51           HE1      PHE  51   2.199  -2.103  -5.949
  400    HZ   PHE  51           HZ       PHE  51  -0.035  -2.132  -7.032
  401    HA   PRO  52           HA       PRO  52   1.006   3.672   1.389
  402    HB2  PRO  52           HB2      PRO  52  -1.154   5.237   1.747
  403    HB3  PRO  52           HB3      PRO  52  -0.082   5.451   0.333
  404    HG2  PRO  52           HG2      PRO  52  -2.706   3.928   0.456
  405    HG3  PRO  52           HG3      PRO  52  -2.193   5.172  -0.731
  406    HD2  PRO  52           HD2      PRO  52  -1.924   2.461  -1.185
  407    HD3  PRO  52           HD3      PRO  52  -0.802   3.687  -1.849
  408    H    VAL  53           H        VAL  53  -1.561   1.368   1.182
  409    HA   VAL  53           HA       VAL  53  -1.664   0.914   4.069
  410    HB   VAL  53           HB       VAL  53  -4.095   0.832   4.196
  411   HG11  VAL  53          HG11      VAL  53  -3.212   3.593   3.301
  412   HG12  VAL  53          HG12      VAL  53  -4.562   3.184   4.375
  413   HG13  VAL  53          HG13      VAL  53  -2.896   2.891   4.903
  414   HG21  VAL  53          HG21      VAL  53  -4.103   2.132   1.442
  415   HG22  VAL  53          HG22      VAL  53  -4.662   0.487   1.827
  416   HG23  VAL  53          HG23      VAL  53  -5.512   1.887   2.498
  417    H    ASP  54           H        ASP  54  -3.251  -1.154   4.375
  418    HA   ASP  54           HA       ASP  54  -2.684  -3.016   2.127
  419    HB2  ASP  54           HB2      ASP  54  -2.833  -4.869   3.487
  420    HB3  ASP  54           HB3      ASP  54  -1.712  -3.746   4.233
  421    H    GLY  55           H        GLY  55  -4.240  -4.068   1.019
  422    HA2  GLY  55           HA2      GLY  55  -7.051  -4.007   1.533
  423    HA3  GLY  55           HA3      GLY  55  -6.597  -2.541   0.669
  424    H    ARG  56           H        ARG  56  -8.254  -3.713  -0.666
  425    HA   ARG  56           HA       ARG  56  -7.008  -5.671  -2.542
  426    HB2  ARG  56           HB2      ARG  56  -9.140  -6.153  -1.161
  427    HB3  ARG  56           HB3      ARG  56  -9.986  -5.184  -2.373
  428    HG2  ARG  56           HG2      ARG  56  -9.188  -6.681  -4.163
  429    HG3  ARG  56           HG3      ARG  56  -8.171  -7.562  -3.017
  430    HD2  ARG  56           HD2      ARG  56 -11.202  -7.504  -2.965
  431    HD3  ARG  56           HD3      ARG  56 -10.160  -8.806  -3.584
  432    HE   ARG  56           HE       ARG  56  -9.602  -8.102  -0.795
  433   HH11  ARG  56          HH11      ARG  56 -11.510 -10.256  -2.818
  434   HH12  ARG  56          HH12      ARG  56 -11.803 -11.340  -1.491
  435   HH21  ARG  56          HH21      ARG  56 -10.012  -9.439   0.768
  436   HH22  ARG  56          HH22      ARG  56 -11.141 -10.784   0.570
  437    H    VAL  57           H        VAL  57  -6.889  -5.476  -4.654
  438    HA   VAL  57           HA       VAL  57  -7.291  -2.825  -5.934
  439    HB   VAL  57           HB       VAL  57  -5.893  -5.274  -7.092
  440   HG11  VAL  57          HG11      VAL  57  -5.705  -2.298  -7.741
  441   HG12  VAL  57          HG12      VAL  57  -4.814  -3.609  -8.547
  442   HG13  VAL  57          HG13      VAL  57  -6.563  -3.521  -8.704
  443   HG21  VAL  57          HG21      VAL  57  -4.599  -3.063  -5.466
  444   HG22  VAL  57          HG22      VAL  57  -4.626  -4.795  -5.103
  445   HG23  VAL  57          HG23      VAL  57  -3.728  -4.211  -6.503
  446    H    ILE  58           H        ILE  58  -9.053  -2.622  -7.270
  447    HA   ILE  58           HA       ILE  58 -10.104  -5.035  -8.685
  448    HB   ILE  58           HB       ILE  58 -12.467  -4.337  -8.145
  449   HG12  ILE  58          HG12      ILE  58 -11.221  -2.914  -5.775
  450   HG13  ILE  58          HG13      ILE  58 -11.635  -2.030  -7.252
  451   HG21  ILE  58          HG21      ILE  58 -10.874  -5.313  -5.749
  452   HG22  ILE  58          HG22      ILE  58 -12.604  -5.546  -6.065
  453   HG23  ILE  58          HG23      ILE  58 -11.418  -6.314  -7.116
  454   HD11  ILE  58          HD11      ILE  58 -13.460  -1.748  -5.745
  455   HD12  ILE  58          HD12      ILE  58 -13.998  -2.811  -7.052
  456   HD13  ILE  58          HD13      ILE  58 -13.596  -3.498  -5.458
  457    H    GLU  59           H        GLU  59  -8.544  -2.704  -9.504
  458    HA   GLU  59           HA       GLU  59  -9.828  -2.455 -12.043
  459    HB2  GLU  59           HB2      GLU  59 -10.436  -0.317 -10.193
  460    HB3  GLU  59           HB3      GLU  59  -9.256   0.304 -11.308
  461    HG2  GLU  59           HG2      GLU  59 -10.700  -0.673 -13.207
  462    HG3  GLU  59           HG3      GLU  59 -11.949  -0.931 -11.991
  463    H    GLY  60           H        GLY  60  -8.201  -2.539 -13.461
  464    HA2  GLY  60           HA2      GLY  60  -6.208  -1.966 -14.489
  465    HA3  GLY  60           HA3      GLY  60  -5.651  -1.136 -13.041
  466    H    HIS  61           H        HIS  61  -3.940  -2.613 -14.406
  467    HA   HIS  61           HA       HIS  61  -3.259  -4.801 -12.536
  468    HB2  HIS  61           HB2      HIS  61  -2.793  -6.443 -14.251
  469    HB3  HIS  61           HB3      HIS  61  -4.483  -5.962 -14.296
  470    HD1  HIS  61           HD1      HIS  61  -5.278  -4.585 -16.493
  471    HD2  HIS  61           HD2      HIS  61  -1.270  -5.866 -16.388
  472    HE1  HIS  61           HE1      HIS  61  -4.329  -4.194 -18.841
  473    H    SER  62           H        SER  62  -1.202  -4.890 -12.006
  474    HA   SER  62           HA       SER  62   0.896  -3.938 -13.780
  475    HB2  SER  62           HB2      SER  62   0.048  -2.210 -11.627
  476    HB3  SER  62           HB3      SER  62   1.660  -2.771 -11.256
  477    HG   SER  62           HG       SER  62   1.071  -0.882 -12.813
  478    H    MET  63           H        MET  63   3.087  -4.406 -12.978
  479    HA   MET  63           HA       MET  63   3.156  -6.810 -11.240
  480    HB2  MET  63           HB2      MET  63   4.196  -6.987 -13.429
  481    HB3  MET  63           HB3      MET  63   5.260  -5.616 -13.082
  482    HG2  MET  63           HG2      MET  63   6.563  -6.810 -11.640
  483    HG3  MET  63           HG3      MET  63   5.260  -7.869 -11.104
  484    HE1  MET  63           HE1      MET  63   5.242 -10.863 -13.354
  485    HE2  MET  63           HE2      MET  63   5.064 -10.271 -11.691
  486    HE3  MET  63           HE3      MET  63   4.066  -9.580 -12.992
  487    H    VAL  64           H        VAL  64   4.187  -6.803  -9.320
  488    HA   VAL  64           HA       VAL  64   5.044  -4.185  -8.171
  489    HB   VAL  64           HB       VAL  64   3.078  -6.226  -7.071
  490   HG11  VAL  64          HG11      VAL  64   4.120  -3.715  -5.701
  491   HG12  VAL  64          HG12      VAL  64   2.733  -4.682  -5.163
  492   HG13  VAL  64          HG13      VAL  64   4.343  -5.396  -5.157
  493   HG21  VAL  64          HG21      VAL  64   2.030  -4.766  -8.695
  494   HG22  VAL  64          HG22      VAL  64   1.549  -4.196  -7.094
  495   HG23  VAL  64          HG23      VAL  64   2.804  -3.335  -7.992
  496    H    ASP  65           H        ASP  65   6.552  -4.120  -6.642
  497    HA   ASP  65           HA       ASP  65   8.179  -6.550  -6.134
  498    HB2  ASP  65           HB2      ASP  65   9.342  -4.507  -6.799
  499    HB3  ASP  65           HB3      ASP  65   8.677  -3.644  -5.406
  500    H    GLU  66           H        GLU  66   7.611  -7.837  -4.519
  501    HA   GLU  66           HA       GLU  66   6.911  -6.662  -1.853
  502    HB2  GLU  66           HB2      GLU  66   6.326  -9.466  -2.863
  503    HB3  GLU  66           HB3      GLU  66   5.936  -8.809  -1.265
  504    HG2  GLU  66           HG2      GLU  66   4.580  -7.004  -2.454
  505    HG3  GLU  66           HG3      GLU  66   4.770  -7.949  -3.936
  506    H    SER  67           H        SER  67   9.635  -7.335  -3.363
  507    HA   SER  67           HA       SER  67  10.925  -9.421  -2.073
  508    HB2  SER  67           HB2      SER  67  11.745  -8.271  -4.095
  509    HB3  SER  67           HB3      SER  67  12.176  -6.852  -3.123
  510    HG   SER  67           HG       SER  67  13.926  -8.384  -3.528
  511    H    LEU  68           H        LEU  68  10.778  -5.997  -0.855
  512    HA   LEU  68           HA       LEU  68  12.503  -6.808   1.389
  513    HB2  LEU  68           HB2      LEU  68  12.572  -4.563   0.265
  514    HB3  LEU  68           HB3      LEU  68  10.972  -4.203   0.869
  515    HG   LEU  68           HG       LEU  68  12.905  -3.108   2.015
  516   HD11  LEU  68          HD11      LEU  68  11.380  -4.746   4.047
  517   HD12  LEU  68          HD12      LEU  68  12.029  -3.116   4.182
  518   HD13  LEU  68          HD13      LEU  68  10.648  -3.426   3.111
  519   HD21  LEU  68          HD21      LEU  68  14.470  -5.025   2.072
  520   HD22  LEU  68          HD22      LEU  68  14.234  -4.280   3.660
  521   HD23  LEU  68          HD23      LEU  68  13.436  -5.816   3.290
  522    H    ILE  69           H        ILE  69   9.061  -6.470   0.804
  523    HA   ILE  69           HA       ILE  69   8.147  -6.501   3.523
  524    HB   ILE  69           HB       ILE  69   6.754  -7.625   1.066
  525   HG12  ILE  69          HG12      ILE  69   7.381  -5.278   0.649
  526   HG13  ILE  69          HG13      ILE  69   5.657  -5.545   0.703
  527   HG21  ILE  69          HG21      ILE  69   5.739  -8.334   3.235
  528   HG22  ILE  69          HG22      ILE  69   5.561  -6.645   3.698
  529   HG23  ILE  69          HG23      ILE  69   4.692  -7.303   2.289
  530   HD11  ILE  69          HD11      ILE  69   5.489  -4.517   2.912
  531   HD12  ILE  69          HD12      ILE  69   7.263  -4.355   3.001
  532   HD13  ILE  69          HD13      ILE  69   6.331  -3.440   1.797
  533    H    THR  70           H        THR  70   8.273  -9.217   1.172
  534    HA   THR  70           HA       THR  70   8.244 -11.143   3.469
  535    HB   THR  70           HB       THR  70   7.029 -12.633   2.077
  536    HG1  THR  70           HG1      THR  70   6.516 -11.645  -0.129
  537   HG21  THR  70          HG21      THR  70   5.859  -9.910   1.390
  538   HG22  THR  70          HG22      THR  70   5.027 -11.461   1.437
  539   HG23  THR  70          HG23      THR  70   5.617 -10.749   2.951
  540    H    GLY  71           H        GLY  71  10.466 -10.068   1.193
  541    HA2  GLY  71           HA2      GLY  71  12.594 -10.853   0.828
  542    HA3  GLY  71           HA3      GLY  71  12.195 -12.388   1.597
  543    H    GLU  72           H        GLU  72   9.938 -11.632  -0.877
  544    HA   GLU  72           HA       GLU  72  10.332 -13.924  -2.385
  545    HB2  GLU  72           HB2      GLU  72   9.270 -11.202  -3.222
  546    HB3  GLU  72           HB3      GLU  72   9.369 -12.511  -4.391
  547    HG2  GLU  72           HG2      GLU  72   7.851 -12.659  -1.797
  548    HG3  GLU  72           HG3      GLU  72   7.119 -12.278  -3.337
  549    H    ALA  73           H        ALA  73  11.545 -10.786  -3.571
  550    HA   ALA  73           HA       ALA  73  13.232 -10.131  -4.834
  551    HB1  ALA  73           HB1      ALA  73  14.632 -12.727  -4.152
  552    HB2  ALA  73           HB2      ALA  73  15.361 -11.321  -4.958
  553    HB3  ALA  73           HB3      ALA  73  14.760 -11.174  -3.298
  554    H    MET  74           H        MET  74  10.969 -11.905  -5.714
  555    HA   MET  74           HA       MET  74  11.612 -11.810  -8.583
  556    HB2  MET  74           HB2      MET  74  11.693 -14.185  -8.053
  557    HB3  MET  74           HB3      MET  74  10.201 -14.058  -7.107
  558    HG2  MET  74           HG2      MET  74   8.906 -13.562  -9.106
  559    HG3  MET  74           HG3      MET  74  10.377 -13.543 -10.084
  560    HE1  MET  74           HE1      MET  74   7.903 -15.793  -7.967
  561    HE2  MET  74           HE2      MET  74   8.581 -17.415  -8.226
  562    HE3  MET  74           HE3      MET  74   9.461 -16.239  -7.231
  563    HA   PRO  75           HA       PRO  75   8.168  -9.111  -7.864
  564    HB2  PRO  75           HB2      PRO  75   7.538  -8.295 -10.343
  565    HB3  PRO  75           HB3      PRO  75   9.109  -7.904  -9.595
  566    HG2  PRO  75           HG2      PRO  75   8.496 -10.215 -11.489
  567    HG3  PRO  75           HG3      PRO  75   9.788  -8.980 -11.651
  568    HD2  PRO  75           HD2      PRO  75  10.285 -11.399 -10.497
  569    HD3  PRO  75           HD3      PRO  75  11.010  -9.903  -9.829
  570    H    VAL  76           H        VAL  76   5.926  -8.874  -7.977
  571    HA   VAL  76           HA       VAL  76   4.466 -11.428  -8.501
  572    HB   VAL  76           HB       VAL  76   3.855  -9.205  -6.512
  573   HG11  VAL  76          HG11      VAL  76   2.630 -11.977  -6.866
  574   HG12  VAL  76          HG12      VAL  76   2.303 -10.877  -5.513
  575   HG13  VAL  76          HG13      VAL  76   1.815 -10.425  -7.148
  576   HG21  VAL  76          HG21      VAL  76   5.895 -10.394  -5.824
  577   HG22  VAL  76          HG22      VAL  76   4.546 -10.843  -4.780
  578   HG23  VAL  76          HG23      VAL  76   5.082 -11.958  -6.055
  579    H    ALA  77           H        ALA  77   2.710 -11.451  -9.811
  580    HA   ALA  77           HA       ALA  77   1.948  -8.997 -11.263
  581    HB1  ALA  77           HB1      ALA  77   0.419 -10.517 -12.480
  582    HB2  ALA  77           HB2      ALA  77   2.089 -11.107 -12.466
  583    HB3  ALA  77           HB3      ALA  77   0.879 -11.846 -11.393
  584    H    LYS  78           H        LYS  78   0.263  -7.661 -10.812
  585    HA   LYS  78           HA       LYS  78  -1.900  -8.578  -8.958
  586    HB2  LYS  78           HB2      LYS  78  -0.865  -5.739  -9.261
  587    HB3  LYS  78           HB3      LYS  78  -2.133  -6.283  -8.170
  588    HG2  LYS  78           HG2      LYS  78   0.795  -7.118  -7.995
  589    HG3  LYS  78           HG3      LYS  78   0.039  -5.812  -7.088
  590    HD2  LYS  78           HD2      LYS  78  -1.452  -7.428  -5.960
  591    HD3  LYS  78           HD3      LYS  78  -0.691  -8.764  -6.854
  592    HE2  LYS  78           HE2      LYS  78   1.493  -8.233  -5.849
  593    HE3  LYS  78           HE3      LYS  78   0.808  -6.816  -5.041
  594    HZ1  LYS  78           HZ1      LYS  78   0.048  -9.632  -4.481
  595    HZ2  LYS  78           HZ2      LYS  78   0.945  -8.640  -3.501
  596    HZ3  LYS  78           HZ3      LYS  78  -0.651  -8.331  -3.791
  597    H    LYS  79           H        LYS  79  -3.922  -8.008  -9.459
  598    HA   LYS  79           HA       LYS  79  -4.724  -6.836 -12.051
  599    HB2  LYS  79           HB2      LYS  79  -5.800  -9.022 -12.749
  600    HB3  LYS  79           HB3      LYS  79  -4.065  -8.970 -12.768
  601    HG2  LYS  79           HG2      LYS  79  -4.525 -11.045 -11.987
  602    HG3  LYS  79           HG3      LYS  79  -4.088 -10.183 -10.532
  603    HD2  LYS  79           HD2      LYS  79  -5.896 -11.650 -10.020
  604    HD3  LYS  79           HD3      LYS  79  -6.536 -10.008  -9.960
  605    HE2  LYS  79           HE2      LYS  79  -7.475 -10.301 -12.249
  606    HE3  LYS  79           HE3      LYS  79  -6.778 -11.930 -12.334
  607    HZ1  LYS  79           HZ1      LYS  79  -8.776 -11.049 -10.341
  608    HZ2  LYS  79           HZ2      LYS  79  -9.171 -11.833 -11.694
  609    HZ3  LYS  79           HZ3      LYS  79  -8.254 -12.612 -10.553
  610    HA   PRO  80           HA       PRO  80  -8.434  -5.921  -9.788
  611    HB2  PRO  80           HB2      PRO  80 -10.570  -6.711 -11.387
  612    HB3  PRO  80           HB3      PRO  80  -9.619  -5.214 -11.611
  613    HG2  PRO  80           HG2      PRO  80  -9.285  -7.887 -13.000
  614    HG3  PRO  80           HG3      PRO  80  -9.314  -6.241 -13.726
  615    HD2  PRO  80           HD2      PRO  80  -6.981  -7.481 -13.249
  616    HD3  PRO  80           HD3      PRO  80  -7.156  -5.747 -12.919
  617    H    GLY  81           H        GLY  81  -9.429  -6.906  -8.085
  618    HA2  GLY  81           HA2      GLY  81 -10.230  -8.609  -6.713
  619    HA3  GLY  81           HA3      GLY  81 -10.071  -9.781  -8.020
  620    H    SER  82           H        SER  82  -7.413  -7.669  -6.945
  621    HA   SER  82           HA       SER  82  -5.916 -10.042  -5.838
  622    HB2  SER  82           HB2      SER  82  -5.013  -9.191  -7.986
  623    HB3  SER  82           HB3      SER  82  -4.838  -7.588  -7.251
  624    HG   SER  82           HG       SER  82  -3.418  -9.979  -6.653
  625    H    THR  83           H        THR  83  -4.481  -9.606  -3.958
  626    HA   THR  83           HA       THR  83  -5.274  -7.164  -2.434
  627    HB   THR  83           HB       THR  83  -4.617  -8.400  -0.410
  628    HG1  THR  83           HG1      THR  83  -4.347 -10.513  -0.454
  629   HG21  THR  83          HG21      THR  83  -6.851  -9.638  -2.080
  630   HG22  THR  83          HG22      THR  83  -6.648  -9.812  -0.322
  631   HG23  THR  83          HG23      THR  83  -6.969  -8.219  -1.020
  632    H    VAL  84           H        VAL  84  -3.795  -6.039  -1.187
  633    HA   VAL  84           HA       VAL  84  -0.918  -6.336  -1.851
  634    HB   VAL  84           HB       VAL  84  -0.776  -3.895  -2.366
  635   HG11  VAL  84          HG11      VAL  84  -0.751  -5.538  -4.178
  636   HG12  VAL  84          HG12      VAL  84  -2.518  -5.468  -4.301
  637   HG13  VAL  84          HG13      VAL  84  -1.534  -4.037  -4.678
  638   HG21  VAL  84          HG21      VAL  84  -2.945  -3.162  -1.371
  639   HG22  VAL  84          HG22      VAL  84  -2.728  -2.641  -3.049
  640   HG23  VAL  84          HG23      VAL  84  -3.801  -4.000  -2.688
  641    H    ILE  85           H        ILE  85   0.456  -4.860  -0.636
  642    HA   ILE  85           HA       ILE  85  -0.650  -3.886   1.932
  643    HB   ILE  85           HB       ILE  85   1.108  -4.673   3.286
  644   HG12  ILE  85          HG12      ILE  85   3.071  -4.685   2.010
  645   HG13  ILE  85          HG13      ILE  85   2.787  -6.311   2.597
  646   HG21  ILE  85          HG21      ILE  85  -0.822  -6.171   2.986
  647   HG22  ILE  85          HG22      ILE  85   0.058  -7.047   1.718
  648   HG23  ILE  85          HG23      ILE  85   0.667  -7.041   3.381
  649   HD11  ILE  85          HD11      ILE  85   2.455  -5.274  -0.235
  650   HD12  ILE  85          HD12      ILE  85   3.599  -6.487   0.339
  651   HD13  ILE  85          HD13      ILE  85   1.877  -6.883   0.271
  652    H    ALA  86           H        ALA  86   0.597  -2.313   3.024
  653    HA   ALA  86           HA       ALA  86   1.444  -0.309   1.263
  654    HB1  ALA  86           HB1      ALA  86   1.935   0.972   3.344
  655    HB2  ALA  86           HB2      ALA  86   0.382   0.126   3.439
  656    HB3  ALA  86           HB3      ALA  86   1.783  -0.530   4.287
  657    H    GLY  87           H        GLY  87   3.393   0.702   0.864
  658    HA2  GLY  87           HA2      GLY  87   5.716   1.024   0.788
  659    HA3  GLY  87           HA3      GLY  87   5.941  -0.262   1.970
  660    H    SER  88           H        SER  88   4.063  -1.669  -0.375
  661    HA   SER  88           HA       SER  88   6.337  -2.742  -1.921
  662    HB2  SER  88           HB2      SER  88   4.705  -4.111  -3.081
  663    HB3  SER  88           HB3      SER  88   4.626  -4.317  -1.332
  664    HG   SER  88           HG       SER  88   2.699  -3.109  -1.314
  665    H    ILE  89           H        ILE  89   6.566  -2.463  -4.225
  666    HA   ILE  89           HA       ILE  89   5.756   0.306  -5.007
  667    HB   ILE  89           HB       ILE  89   8.117  -1.012  -6.270
  668   HG12  ILE  89          HG12      ILE  89   8.605  -1.513  -3.924
  669   HG13  ILE  89          HG13      ILE  89   9.700  -0.348  -4.631
  670   HG21  ILE  89          HG21      ILE  89   7.484   1.848  -5.399
  671   HG22  ILE  89          HG22      ILE  89   8.927   1.326  -6.294
  672   HG23  ILE  89          HG23      ILE  89   7.326   1.194  -7.029
  673   HD11  ILE  89          HD11      ILE  89   7.400   0.427  -2.792
  674   HD12  ILE  89          HD12      ILE  89   9.087   0.202  -2.296
  675   HD13  ILE  89          HD13      ILE  89   8.679   1.487  -3.431
  676    H    ASN  90           H        ASN  90   4.786   0.751  -6.902
  677    HA   ASN  90           HA       ASN  90   3.867  -1.492  -8.588
  678    HB2  ASN  90           HB2      ASN  90   2.288   0.124  -7.480
  679    HB3  ASN  90           HB3      ASN  90   3.037   1.440  -8.377
  680   HD21  ASN  90          HD22      ASN  90   2.045   1.929 -10.258
  681   HD22  ASN  90          HD21      ASN  90   0.946   0.832 -11.097
  682    H    GLN  91           H        GLN  91   4.372  -1.755 -10.768
  683    HA   GLN  91           HA       GLN  91   6.676  -0.264 -11.643
  684    HB2  GLN  91           HB2      GLN  91   6.519  -2.710 -11.714
  685    HB3  GLN  91           HB3      GLN  91   5.304  -2.607 -12.978
  686    HG2  GLN  91           HG2      GLN  91   7.478  -3.123 -13.935
  687    HG3  GLN  91           HG3      GLN  91   6.998  -1.521 -14.480
  688   HE21  GLN  91          HE22      GLN  91   8.334   0.275 -13.880
  689   HE22  GLN  91          HE21      GLN  91   9.687   0.115 -12.750
  690    H    ASN  92           H        ASN  92   4.457  -1.212 -14.172
  691    HA   ASN  92           HA       ASN  92   4.851   1.491 -15.346
  692    HB2  ASN  92           HB2      ASN  92   5.829  -0.431 -16.460
  693    HB3  ASN  92           HB3      ASN  92   4.253  -1.208 -16.590
  694   HD21  ASN  92          HD22      ASN  92   2.936  -0.689 -18.311
  695   HD22  ASN  92          HD21      ASN  92   3.414   0.465 -19.548
  696    H    GLY  93           H        GLY  93   2.028  -0.569 -14.632
  697    HA2  GLY  93           HA2      GLY  93   0.220   1.425 -15.928
  698    HA3  GLY  93           HA3      GLY  93  -0.176  -0.243 -15.549
  699    H    SER  94           H        SER  94  -1.615   2.199 -14.849
  700    HA   SER  94           HA       SER  94  -1.271   2.558 -11.933
  701    HB2  SER  94           HB2      SER  94  -1.270   4.483 -13.495
  702    HB3  SER  94           HB3      SER  94  -2.930   4.105 -13.952
  703    HG   SER  94           HG       SER  94  -2.234   4.518 -11.229
  704    H    LEU  95           H        LEU  95  -2.843   2.185 -10.421
  705    HA   LEU  95           HA       LEU  95  -5.231   0.532 -11.205
  706    HB2  LEU  95           HB2      LEU  95  -3.727  -0.136  -8.723
  707    HB3  LEU  95           HB3      LEU  95  -4.602  -1.184  -9.802
  708    HG   LEU  95           HG       LEU  95  -1.808  -0.068 -10.346
  709   HD11  LEU  95          HD11      LEU  95  -1.839  -1.504  -8.361
  710   HD12  LEU  95          HD12      LEU  95  -2.689  -2.778  -9.260
  711   HD13  LEU  95          HD13      LEU  95  -1.033  -2.317  -9.703
  712   HD21  LEU  95          HD21      LEU  95  -3.070  -2.511 -11.552
  713   HD22  LEU  95          HD22      LEU  95  -3.432  -0.931 -12.260
  714   HD23  LEU  95          HD23      LEU  95  -1.773  -1.481 -12.219
  715    H    LEU  96           H        LEU  96  -6.802   0.231  -9.483
  716    HA   LEU  96           HA       LEU  96  -6.820   2.434  -7.453
  717    HB2  LEU  96           HB2      LEU  96  -9.162   1.343  -9.035
  718    HB3  LEU  96           HB3      LEU  96  -9.317   2.239  -7.544
  719    HG   LEU  96           HG       LEU  96  -7.819   4.062  -8.754
  720   HD11  LEU  96          HD11      LEU  96  -7.404   2.813 -10.857
  721   HD12  LEU  96          HD12      LEU  96  -9.152   2.640 -11.104
  722   HD13  LEU  96          HD13      LEU  96  -8.404   4.235 -11.167
  723   HD21  LEU  96          HD21      LEU  96 -10.097   4.445  -7.964
  724   HD22  LEU  96          HD22      LEU  96  -9.897   5.134  -9.582
  725   HD23  LEU  96          HD23      LEU  96 -10.759   3.596  -9.379
  726    H    ILE  97           H        ILE  97  -6.841   1.902  -5.450
  727    HA   ILE  97           HA       ILE  97  -7.431  -0.918  -4.634
  728    HB   ILE  97           HB       ILE  97  -5.414   0.962  -3.359
  729   HG12  ILE  97          HG12      ILE  97  -3.857  -0.933  -4.507
  730   HG13  ILE  97          HG13      ILE  97  -5.135  -0.898  -5.712
  731   HG21  ILE  97          HG21      ILE  97  -5.783  -2.059  -3.140
  732   HG22  ILE  97          HG22      ILE  97  -4.549  -1.084  -2.321
  733   HG23  ILE  97          HG23      ILE  97  -6.242  -0.873  -1.893
  734   HD11  ILE  97          HD11      ILE  97  -3.280   0.591  -6.286
  735   HD12  ILE  97          HD12      ILE  97  -4.729   1.553  -6.032
  736   HD13  ILE  97          HD13      ILE  97  -3.481   1.487  -4.767
  737    H    CYS  98           H        CYS  98  -8.723  -1.322  -2.936
  738    HA   CYS  98           HA       CYS  98 -10.272   0.907  -1.778
  739    HB2  CYS  98           HB2      CYS  98 -10.594  -2.093  -1.376
  740    HB3  CYS  98           HB3      CYS  98 -11.764  -0.831  -0.984
  741    HG   CYS  98           HG       CYS  98 -10.551  -1.752  -3.921
  742    H    ALA  99           H        ALA  99  -9.578   1.894   0.072
  743    HA   ALA  99           HA       ALA  99  -7.763   0.572   1.915
  744    HB1  ALA  99           HB1      ALA  99  -9.211   3.252   2.039
  745    HB2  ALA  99           HB2      ALA  99  -7.890   2.729   3.104
  746    HB3  ALA  99           HB3      ALA  99  -7.590   2.966   1.368
  747    H    THR 100           H        THR 100  -8.522  -0.965   3.218
  748    HA   THR 100           HA       THR 100 -11.007  -0.496   4.817
  749    HB   THR 100           HB       THR 100 -10.952  -2.531   3.497
  750    HG1  THR 100           HG1      THR 100 -10.852  -2.753   6.297
  751   HG21  THR 100          HG21      THR 100  -8.655  -3.400   5.311
  752   HG22  THR 100          HG22      THR 100  -9.541  -4.416   4.160
  753   HG23  THR 100          HG23      THR 100  -8.551  -3.081   3.561
  754    H    HIS 101           H        HIS 101  -7.899   0.233   5.296
  755    HA   HIS 101           HA       HIS 101  -8.108   0.304   8.227
  756    HB2  HIS 101           HB2      HIS 101  -5.788  -0.940   6.658
  757    HB3  HIS 101           HB3      HIS 101  -5.689  -0.468   8.342
  758    HD1  HIS 101           HD1      HIS 101  -5.941  -3.528   6.538
  759    HD2  HIS 101           HD2      HIS 101  -7.839  -1.836   9.898
  760    HE1  HIS 101           HE1      HIS 101  -6.947  -5.463   7.858
  761    H    VAL 102           H        VAL 102  -6.991   2.168   9.015
  762    HA   VAL 102           HA       VAL 102  -5.590   3.898   7.000
  763    HB   VAL 102           HB       VAL 102  -5.242   5.497   8.844
  764   HG11  VAL 102          HG11      VAL 102  -8.140   4.778   8.260
  765   HG12  VAL 102          HG12      VAL 102  -7.524   6.364   8.793
  766   HG13  VAL 102          HG13      VAL 102  -7.038   5.724   7.213
  767   HG21  VAL 102          HG21      VAL 102  -7.302   3.927  10.422
  768   HG22  VAL 102          HG22      VAL 102  -5.557   3.890  10.783
  769   HG23  VAL 102          HG23      VAL 102  -6.467   5.410  10.893
  770    H    GLY 103           H        GLY 103  -3.285   4.726   7.779
  771    HA2  GLY 103           HA2      GLY 103  -1.695   2.448   7.373
  772    HA3  GLY 103           HA3      GLY 103  -1.099   3.998   7.911
  773    H    ALA 104           H        ALA 104  -2.271   4.155  10.484
  774    HA   ALA 104           HA       ALA 104  -0.638   2.644  12.179
  775    HB1  ALA 104           HB1      ALA 104  -3.427   3.791  12.713
  776    HB2  ALA 104           HB2      ALA 104  -2.223   3.370  13.947
  777    HB3  ALA 104           HB3      ALA 104  -1.900   4.690  12.817
  778    H    ASP 105           H        ASP 105  -3.903   1.760  11.004
  779    HA   ASP 105           HA       ASP 105  -4.101  -0.584  12.738
  780    HB2  ASP 105           HB2      ASP 105  -5.931   1.140  11.479
  781    HB3  ASP 105           HB3      ASP 105  -6.106  -0.378  10.617
  782    H    THR 106           H        THR 106  -2.479  -0.104   9.817
  783    HA   THR 106           HA       THR 106  -3.207  -2.518   8.417
  784    HB   THR 106           HB       THR 106  -1.249  -2.128   7.010
  785    HG1  THR 106           HG1      THR 106  -0.582   0.055   8.646
  786   HG21  THR 106          HG21      THR 106  -3.202  -0.830   6.467
  787   HG22  THR 106          HG22      THR 106  -2.723   0.436   7.606
  788   HG23  THR 106          HG23      THR 106  -1.720   0.113   6.179
  789    H    THR 107           H        THR 107  -1.857  -4.340   7.877
  790    HA   THR 107           HA       THR 107  -0.616  -5.656  10.107
  791    HB   THR 107           HB       THR 107  -1.641  -6.856   8.224
  792    HG1  THR 107           HG1      THR 107  -0.229  -8.504   8.329
  793   HG21  THR 107          HG21      THR 107  -0.435  -7.334   6.195
  794   HG22  THR 107          HG22      THR 107  -0.639  -5.582   6.307
  795   HG23  THR 107          HG23      THR 107   0.934  -6.326   6.692
  796    H    LEU 108           H        LEU 108   0.767  -3.605   7.554
  797    HA   LEU 108           HA       LEU 108   3.518  -4.191   7.988
  798    HB2  LEU 108           HB2      LEU 108   2.352  -2.780   6.120
  799    HB3  LEU 108           HB3      LEU 108   2.384  -1.460   7.280
  800    HG   LEU 108           HG       LEU 108   4.979  -2.037   7.447
  801   HD11  LEU 108          HD11      LEU 108   4.984  -4.072   6.088
  802   HD12  LEU 108          HD12      LEU 108   4.175  -3.229   4.746
  803   HD13  LEU 108          HD13      LEU 108   5.833  -2.793   5.190
  804   HD21  LEU 108          HD21      LEU 108   3.980   0.049   6.516
  805   HD22  LEU 108          HD22      LEU 108   5.484  -0.457   5.725
  806   HD23  LEU 108          HD23      LEU 108   3.931  -0.737   4.916
  807    H    SER 109           H        SER 109   1.398  -1.762   9.530
  808    HA   SER 109           HA       SER 109   3.370  -0.858  11.465
  809    HB2  SER 109           HB2      SER 109   0.350  -0.582  11.388
  810    HB3  SER 109           HB3      SER 109   1.426   0.253  12.529
  811    HG   SER 109           HG       SER 109   0.735   1.167  10.251
  812    H    GLN 110           H        GLN 110   0.930  -3.461  11.445
  813    HA   GLN 110           HA       GLN 110   0.876  -4.012  14.255
  814    HB2  GLN 110           HB2      GLN 110  -0.679  -4.823  12.339
  815    HB3  GLN 110           HB3      GLN 110   0.553  -6.002  11.976
  816    HG2  GLN 110           HG2      GLN 110  -0.875  -7.243  13.216
  817    HG3  GLN 110           HG3      GLN 110   0.304  -6.780  14.448
  818   HE21  GLN 110          HE22      GLN 110  -2.736  -5.408  12.930
  819   HE22  GLN 110          HE21      GLN 110  -3.396  -4.895  14.449
  820    H    ILE 111           H        ILE 111   2.915  -5.269  11.586
  821    HA   ILE 111           HA       ILE 111   4.408  -7.197  13.031
  822    HB   ILE 111           HB       ILE 111   5.038  -5.550  10.557
  823   HG12  ILE 111          HG12      ILE 111   4.414  -8.526  10.755
  824   HG13  ILE 111          HG13      ILE 111   3.138  -7.337  10.630
  825   HG21  ILE 111          HG21      ILE 111   6.857  -7.237  10.091
  826   HG22  ILE 111          HG22      ILE 111   7.213  -6.195  11.458
  827   HG23  ILE 111          HG23      ILE 111   6.651  -7.856  11.741
  828   HD11  ILE 111          HD11      ILE 111   3.579  -8.179   8.428
  829   HD12  ILE 111          HD12      ILE 111   4.130  -6.497   8.488
  830   HD13  ILE 111          HD13      ILE 111   5.310  -7.829   8.559
  831    H    VAL 112           H        VAL 112   5.424  -3.781  12.286
  832    HA   VAL 112           HA       VAL 112   7.798  -4.070  13.847
  833    HB   VAL 112           HB       VAL 112   8.126  -1.685  13.670
  834   HG11  VAL 112          HG11      VAL 112   7.031  -2.722  11.032
  835   HG12  VAL 112          HG12      VAL 112   8.311  -1.515  11.314
  836   HG13  VAL 112          HG13      VAL 112   8.590  -3.212  11.729
  837   HG21  VAL 112          HG21      VAL 112   5.832  -0.822  13.985
  838   HG22  VAL 112          HG22      VAL 112   6.535  -0.234  12.475
  839   HG23  VAL 112          HG23      VAL 112   5.342  -1.542  12.434
  840    H    LYS 113           H        LYS 113   4.585  -3.325  14.903
  841    HA   LYS 113           HA       LYS 113   5.340  -2.394  17.592
  842    HB2  LYS 113           HB2      LYS 113   2.717  -3.384  16.405
  843    HB3  LYS 113           HB3      LYS 113   2.907  -2.801  18.065
  844    HG2  LYS 113           HG2      LYS 113   3.546  -0.571  17.282
  845    HG3  LYS 113           HG3      LYS 113   3.594  -1.122  15.621
  846    HD2  LYS 113           HD2      LYS 113   1.575   0.026  15.771
  847    HD3  LYS 113           HD3      LYS 113   1.127  -1.686  15.786
  848    HE2  LYS 113           HE2      LYS 113   1.020  -1.615  18.269
  849    HE3  LYS 113           HE3      LYS 113   1.494   0.097  18.228
  850    HZ1  LYS 113           HZ1      LYS 113  -0.899  -0.081  18.451
  851    HZ2  LYS 113           HZ2      LYS 113  -0.556   0.535  16.980
  852    HZ3  LYS 113           HZ3      LYS 113  -1.001  -1.048  17.109
  853    H    LEU 114           H        LEU 114   4.169  -5.537  16.220
  854    HA   LEU 114           HA       LEU 114   4.332  -6.910  18.734
  855    HB2  LEU 114           HB2      LEU 114   3.951  -7.604  15.833
  856    HB3  LEU 114           HB3      LEU 114   4.478  -8.908  16.883
  857    HG   LEU 114           HG       LEU 114   2.016  -7.200  17.291
  858   HD11  LEU 114          HD11      LEU 114   2.276 -10.063  16.275
  859   HD12  LEU 114          HD12      LEU 114   0.757  -9.192  16.573
  860   HD13  LEU 114          HD13      LEU 114   1.851  -8.640  15.297
  861   HD21  LEU 114          HD21      LEU 114   2.763  -8.125  19.449
  862   HD22  LEU 114          HD22      LEU 114   1.385  -9.071  18.902
  863   HD23  LEU 114          HD23      LEU 114   3.033  -9.719  18.722
  864    H    VAL 115           H        VAL 115   6.708  -6.309  16.260
  865    HA   VAL 115           HA       VAL 115   8.766  -8.031  17.455
  866    HB   VAL 115           HB       VAL 115   9.057  -5.692  15.540
  867   HG11  VAL 115          HG11      VAL 115  11.135  -7.689  16.563
  868   HG12  VAL 115          HG12      VAL 115  11.374  -6.614  15.178
  869   HG13  VAL 115          HG13      VAL 115  11.162  -5.924  16.788
  870   HG21  VAL 115          HG21      VAL 115   9.347  -8.710  15.128
  871   HG22  VAL 115          HG22      VAL 115   7.946  -7.758  14.620
  872   HG23  VAL 115          HG23      VAL 115   9.522  -7.452  13.885
  873    H    GLU 116           H        GLU 116   8.366  -4.436  17.564
  874    HA   GLU 116           HA       GLU 116  10.234  -3.893  19.492
  875    HB2  GLU 116           HB2      GLU 116   8.845  -2.356  18.101
  876    HB3  GLU 116           HB3      GLU 116   7.523  -2.496  19.256
  877    HG2  GLU 116           HG2      GLU 116  10.213  -1.724  20.328
  878    HG3  GLU 116           HG3      GLU 116   9.473  -0.593  19.207
  879    H    GLU 117           H        GLU 117   7.040  -5.204  20.181
  880    HA   GLU 117           HA       GLU 117   7.053  -4.765  23.064
  881    HB2  GLU 117           HB2      GLU 117   5.556  -6.659  21.218
  882    HB3  GLU 117           HB3      GLU 117   5.270  -6.596  22.948
  883    HG2  GLU 117           HG2      GLU 117   5.079  -3.967  21.510
  884    HG3  GLU 117           HG3      GLU 117   3.878  -5.178  21.084
  885    H    ALA 118           H        ALA 118   8.417  -7.235  20.955
  886    HA   ALA 118           HA       ALA 118   8.501  -9.302  22.945
  887    HB1  ALA 118           HB1      ALA 118   9.833 -10.516  21.209
  888    HB2  ALA 118           HB2      ALA 118   8.304  -9.837  20.600
  889    HB3  ALA 118           HB3      ALA 118   9.838  -9.043  20.229
  890    H    GLN 119           H        GLN 119  11.298  -7.584  21.450
  891    HA   GLN 119           HA       GLN 119  13.163  -8.546  23.345
  892    HB2  GLN 119           HB2      GLN 119  13.359  -6.253  21.375
  893    HB3  GLN 119           HB3      GLN 119  14.698  -6.966  22.236
  894    HG2  GLN 119           HG2      GLN 119  14.768  -7.946  20.112
  895    HG3  GLN 119           HG3      GLN 119  14.073  -9.204  21.191
  896   HE21  GLN 119          HE22      GLN 119  12.749  -6.390  19.433
  897   HE22  GLN 119          HE21      GLN 119  11.379  -7.327  18.971
  Start of MODEL   28
    1    H    SER   1           H        SER   1  19.179  -4.922  12.575
    2    HA   SER   1           HA       SER   1  16.955  -3.554  13.948
    3    HB2  SER   1           HB2      SER   1  18.761  -2.337  15.099
    4    HB3  SER   1           HB3      SER   1  18.946  -4.102  15.209
    5    HG   SER   1           HG       SER   1  20.912  -3.413  14.594
    6    H    GLU   2           H        GLU   2  18.715  -3.034  10.986
    7    HA   GLU   2           HA       GLU   2  17.961  -0.155  10.883
    8    HB2  GLU   2           HB2      GLU   2  19.251  -1.919   8.757
    9    HB3  GLU   2           HB3      GLU   2  18.905  -0.194   8.634
   10    HG2  GLU   2           HG2      GLU   2  20.392   0.219  10.610
   11    HG3  GLU   2           HG3      GLU   2  20.825  -1.497  10.606
   12    H    ALA   3           H        ALA   3  16.911  -3.320   9.640
   13    HA   ALA   3           HA       ALA   3  14.734  -2.396   8.049
   14    HB1  ALA   3           HB1      ALA   3  15.566  -4.679   7.942
   15    HB2  ALA   3           HB2      ALA   3  15.072  -4.981   9.625
   16    HB3  ALA   3           HB3      ALA   3  13.848  -4.687   8.370
   17    H    LEU   4           H        LEU   4  15.075  -2.675  11.522
   18    HA   LEU   4           HA       LEU   4  12.274  -2.516  12.249
   19    HB2  LEU   4           HB2      LEU   4  14.267  -3.219  13.741
   20    HB3  LEU   4           HB3      LEU   4  14.630  -1.506  13.879
   21    HG   LEU   4           HG       LEU   4  12.166  -1.240  14.727
   22   HD11  LEU   4          HD11      LEU   4  12.634  -4.208  15.211
   23   HD12  LEU   4          HD12      LEU   4  11.271  -3.242  15.828
   24   HD13  LEU   4          HD13      LEU   4  11.441  -3.543  14.084
   25   HD21  LEU   4          HD21      LEU   4  14.211  -2.736  16.410
   26   HD22  LEU   4          HD22      LEU   4  14.128  -0.975  16.177
   27   HD23  LEU   4          HD23      LEU   4  12.817  -1.811  17.018
   28    H    ALA   5           H        ALA   5  14.661  -0.094  11.282
   29    HA   ALA   5           HA       ALA   5  12.884   2.176  11.858
   30    HB1  ALA   5           HB1      ALA   5  15.321   2.440  12.110
   31    HB2  ALA   5           HB2      ALA   5  15.547   2.052  10.389
   32    HB3  ALA   5           HB3      ALA   5  14.663   3.515  10.868
   33    H    LYS   6           H        LYS   6  13.977   0.218   9.034
   34    HA   LYS   6           HA       LYS   6  12.854   1.803   7.004
   35    HB2  LYS   6           HB2      LYS   6  14.566  -0.033   6.798
   36    HB3  LYS   6           HB3      LYS   6  13.258  -1.213   6.930
   37    HG2  LYS   6           HG2      LYS   6  12.284  -0.511   4.866
   38    HG3  LYS   6           HG3      LYS   6  13.255   0.965   4.813
   39    HD2  LYS   6           HD2      LYS   6  15.293  -0.299   4.401
   40    HD3  LYS   6           HD3      LYS   6  14.432  -1.848   4.578
   41    HE2  LYS   6           HE2      LYS   6  13.082  -1.411   2.613
   42    HE3  LYS   6           HE3      LYS   6  13.619   0.266   2.558
   43    HZ1  LYS   6           HZ1      LYS   6  15.779  -0.414   1.880
   44    HZ2  LYS   6           HZ2      LYS   6  15.441  -2.030   2.039
   45    HZ3  LYS   6           HZ3      LYS   6  14.723  -1.109   0.879
   46    H    LEU   7           H        LEU   7  11.242  -0.839   8.850
   47    HA   LEU   7           HA       LEU   7   8.906  -0.944   7.256
   48    HB2  LEU   7           HB2      LEU   7   9.605  -1.666  10.090
   49    HB3  LEU   7           HB3      LEU   7   7.906  -1.572   9.675
   50    HG   LEU   7           HG       LEU   7   8.537  -3.830   9.518
   51   HD11  LEU   7          HD11      LEU   7   7.085  -2.821   7.685
   52   HD12  LEU   7          HD12      LEU   7   8.479  -2.988   6.605
   53   HD13  LEU   7          HD13      LEU   7   7.782  -4.425   7.374
   54   HD21  LEU   7          HD21      LEU   7  10.922  -3.739   9.221
   55   HD22  LEU   7          HD22      LEU   7  10.220  -4.696   7.915
   56   HD23  LEU   7          HD23      LEU   7  10.750  -3.030   7.594
   57    H    ILE   8           H        ILE   8   9.661   1.438   9.795
   58    HA   ILE   8           HA       ILE   8   7.063   2.779   9.466
   59    HB   ILE   8           HB       ILE   8   9.608   3.609  10.865
   60   HG12  ILE   8          HG12      ILE   8   8.429   1.813  12.012
   61   HG13  ILE   8          HG13      ILE   8   8.327   3.309  12.920
   62   HG21  ILE   8          HG21      ILE   8   6.980   5.124  10.599
   63   HG22  ILE   8          HG22      ILE   8   8.185   5.448  11.861
   64   HG23  ILE   8          HG23      ILE   8   8.611   5.676  10.166
   65   HD11  ILE   8          HD11      ILE   8   6.194   2.203  13.053
   66   HD12  ILE   8          HD12      ILE   8   5.968   3.628  12.040
   67   HD13  ILE   8          HD13      ILE   8   6.094   2.013  11.298
   68    H    SER   9           H        SER   9  10.299   3.102   7.976
   69    HA   SER   9           HA       SER   9   9.825   5.676   6.753
   70    HB2  SER   9           HB2      SER   9  11.716   3.446   5.901
   71    HB3  SER   9           HB3      SER   9  11.799   5.146   5.417
   72    HG   SER   9           HG       SER   9  12.133   5.712   7.585
   73    H    LEU  10           H        LEU  10   9.117   2.364   5.832
   74    HA   LEU  10           HA       LEU  10   8.571   2.623   3.042
   75    HB2  LEU  10           HB2      LEU  10   8.097   0.690   5.326
   76    HB3  LEU  10           HB3      LEU  10   7.127   0.457   3.892
   77    HG   LEU  10           HG       LEU  10  10.130   0.748   3.597
   78   HD11  LEU  10          HD11      LEU  10   8.599  -1.815   4.235
   79   HD12  LEU  10          HD12      LEU  10  10.279  -1.719   3.654
   80   HD13  LEU  10          HD13      LEU  10   9.856  -1.053   5.236
   81   HD21  LEU  10          HD21      LEU  10   8.533   0.765   1.616
   82   HD22  LEU  10          HD22      LEU  10   9.709  -0.555   1.594
   83   HD23  LEU  10          HD23      LEU  10   8.035  -0.880   2.089
   84    H    GLN  11           H        GLN  11   6.665   3.554   5.835
   85    HA   GLN  11           HA       GLN  11   4.091   3.217   4.464
   86    HB2  GLN  11           HB2      GLN  11   4.956   4.007   7.235
   87    HB3  GLN  11           HB3      GLN  11   3.294   4.258   6.704
   88    HG2  GLN  11           HG2      GLN  11   3.059   1.908   6.044
   89    HG3  GLN  11           HG3      GLN  11   4.757   1.599   6.441
   90   HE21  GLN  11          HE22      GLN  11   5.402   1.387   8.632
   91   HE22  GLN  11          HE21      GLN  11   4.165   1.418   9.907
   92    H    ALA  12           H        ALA  12   3.205   4.631   3.223
   93    HA   ALA  12           HA       ALA  12   4.737   6.742   2.160
   94    HB1  ALA  12           HB1      ALA  12   2.835   7.020   0.632
   95    HB2  ALA  12           HB2      ALA  12   3.172   5.300   0.899
   96    HB3  ALA  12           HB3      ALA  12   1.800   6.082   1.728
   97    H    THR  13           H        THR  13   2.293   7.021   4.656
   98    HA   THR  13           HA       THR  13   1.655   8.768   5.953
   99    HB   THR  13           HB       THR  13   3.601  10.653   4.641
  100    HG1  THR  13           HG1      THR  13   4.919   9.047   5.209
  101   HG21  THR  13          HG21      THR  13   3.764  11.515   6.984
  102   HG22  THR  13          HG22      THR  13   2.146  11.702   6.312
  103   HG23  THR  13          HG23      THR  13   2.477  10.394   7.468
  104    H    GLU  14           H        GLU  14   1.526   9.265   2.475
  105    HA   GLU  14           HA       GLU  14  -0.930  10.903   2.912
  106    HB2  GLU  14           HB2      GLU  14  -0.505  12.217   1.041
  107    HB3  GLU  14           HB3      GLU  14   0.882  12.335   2.129
  108    HG2  GLU  14           HG2      GLU  14   2.164  10.847   0.618
  109    HG3  GLU  14           HG3      GLU  14   0.771  10.765  -0.475
  110    H    ALA  15           H        ALA  15  -2.616  10.819   1.315
  111    HA   ALA  15           HA       ALA  15  -2.692   8.339  -0.293
  112    HB1  ALA  15           HB1      ALA  15  -3.646   7.766   1.879
  113    HB2  ALA  15           HB2      ALA  15  -4.737   9.169   1.792
  114    HB3  ALA  15           HB3      ALA  15  -4.915   7.826   0.638
  115    H    THR  16           H        THR  16  -3.842   8.536  -2.113
  116    HA   THR  16           HA       THR  16  -4.891  11.239  -2.829
  117    HB   THR  16           HB       THR  16  -3.588   9.184  -4.610
  118    HG1  THR  16           HG1      THR  16  -2.082  10.000  -3.255
  119   HG21  THR  16          HG21      THR  16  -4.443  12.074  -5.073
  120   HG22  THR  16          HG22      THR  16  -3.345  11.160  -6.141
  121   HG23  THR  16          HG23      THR  16  -5.024  10.633  -5.934
  122    H    ILE  17           H        ILE  17  -7.006  11.287  -2.699
  123    HA   ILE  17           HA       ILE  17  -8.720   8.936  -3.117
  124    HB   ILE  17           HB       ILE  17  -9.414  11.775  -2.257
  125   HG12  ILE  17          HG12      ILE  17  -8.762   9.348  -0.584
  126   HG13  ILE  17          HG13      ILE  17  -7.865  10.858  -0.654
  127   HG21  ILE  17          HG21      ILE  17 -11.013   9.178  -2.057
  128   HG22  ILE  17          HG22      ILE  17 -11.528  10.759  -1.426
  129   HG23  ILE  17          HG23      ILE  17 -11.369  10.542  -3.143
  130   HD11  ILE  17          HD11      ILE  17 -10.613  10.446   0.579
  131   HD12  ILE  17          HD12      ILE  17  -9.101  10.834   1.390
  132   HD13  ILE  17          HD13      ILE  17  -9.852  12.041   0.328
  133    H    VAL  18           H        VAL  18 -10.003   8.561  -4.793
  134    HA   VAL  18           HA       VAL  18 -10.354  10.666  -6.898
  135    HB   VAL  18           HB       VAL  18 -11.404   8.911  -8.287
  136   HG11  VAL  18          HG11      VAL  18  -9.075   9.562  -8.597
  137   HG12  VAL  18          HG12      VAL  18  -8.546   8.376  -7.389
  138   HG13  VAL  18          HG13      VAL  18  -9.292   7.841  -8.918
  139   HG21  VAL  18          HG21      VAL  18 -10.196   6.912  -6.373
  140   HG22  VAL  18          HG22      VAL  18 -11.935   7.293  -6.390
  141   HG23  VAL  18          HG23      VAL  18 -11.158   6.601  -7.827
  142    H    THR  19           H        THR  19 -12.244  11.526  -7.553
  143    HA   THR  19           HA       THR  19 -14.690  11.128  -5.881
  144    HB   THR  19           HB       THR  19 -13.204  13.698  -6.466
  145    HG1  THR  19           HG1      THR  19 -12.998  13.728  -4.258
  146   HG21  THR  19          HG21      THR  19 -15.914  13.207  -5.163
  147   HG22  THR  19          HG22      THR  19 -14.988  14.714  -4.978
  148   HG23  THR  19          HG23      THR  19 -15.574  14.234  -6.574
  149    H    LEU  20           H        LEU  20 -16.345  10.655  -7.175
  150    HA   LEU  20           HA       LEU  20 -16.510  11.827  -9.926
  151    HB2  LEU  20           HB2      LEU  20 -18.128   9.490  -8.899
  152    HB3  LEU  20           HB3      LEU  20 -18.133  10.217 -10.468
  153    HG   LEU  20           HG       LEU  20 -15.852   9.498 -10.941
  154   HD11  LEU  20          HD11      LEU  20 -14.703   9.261  -8.801
  155   HD12  LEU  20          HD12      LEU  20 -15.950   8.127  -8.214
  156   HD13  LEU  20          HD13      LEU  20 -14.842   7.672  -9.522
  157   HD21  LEU  20          HD21      LEU  20 -17.870   8.134 -11.404
  158   HD22  LEU  20          HD22      LEU  20 -16.436   7.127 -11.102
  159   HD23  LEU  20          HD23      LEU  20 -17.670   7.322  -9.839
  160    H    ASP  21           H        ASP  21 -17.068  13.904  -8.931
  161    HA   ASP  21           HA       ASP  21 -19.608  14.225  -7.558
  162    HB2  ASP  21           HB2      ASP  21 -17.383  15.903  -7.999
  163    HB3  ASP  21           HB3      ASP  21 -18.610  16.575  -9.043
  164    H    SER  22           H        SER  22 -18.796  13.773 -10.827
  165    HA   SER  22           HA       SER  22 -21.589  14.041 -11.721
  166    HB2  SER  22           HB2      SER  22 -19.297  15.238 -13.292
  167    HB3  SER  22           HB3      SER  22 -21.007  15.225 -13.742
  168    HG   SER  22           HG       SER  22 -20.006  17.178 -12.751
  169    H    ASP  23           H        ASP  23 -22.069  12.356 -12.716
  170    HA   ASP  23           HA       ASP  23 -21.600   9.997 -12.891
  171    HB2  ASP  23           HB2      ASP  23 -23.329  11.363 -14.280
  172    HB3  ASP  23           HB3      ASP  23 -22.314  11.020 -15.657
  173    H    ASN  24           H        ASN  24 -19.106  10.098 -12.696
  174    HA   ASN  24           HA       ASN  24 -17.035   9.447 -13.217
  175    HB2  ASN  24           HB2      ASN  24 -18.152   8.075 -15.703
  176    HB3  ASN  24           HB3      ASN  24 -16.570   7.819 -15.014
  177   HD21  ASN  24          HD22      ASN  24 -19.933   7.300 -14.410
  178   HD22  ASN  24          HD21      ASN  24 -19.566   5.812 -13.592
  179    H    ILE  25           H        ILE  25 -18.764  11.154 -15.709
  180    HA   ILE  25           HA       ILE  25 -16.861  12.128 -17.428
  181    HB   ILE  25           HB       ILE  25 -18.642  13.964 -17.708
  182   HG12  ILE  25          HG12      ILE  25 -20.205  12.443 -15.650
  183   HG13  ILE  25          HG13      ILE  25 -19.390  13.982 -15.349
  184   HG21  ILE  25          HG21      ILE  25 -19.449  11.033 -17.726
  185   HG22  ILE  25          HG22      ILE  25 -20.246  12.317 -18.658
  186   HG23  ILE  25          HG23      ILE  25 -18.571  11.879 -19.002
  187   HD11  ILE  25          HD11      ILE  25 -20.765  14.999 -17.183
  188   HD12  ILE  25          HD12      ILE  25 -21.659  13.465 -17.311
  189   HD13  ILE  25          HD13      ILE  25 -21.718  14.397 -15.809
  190    H    LEU  26           H        LEU  26 -16.511  12.706 -14.320
  191    HA   LEU  26           HA       LEU  26 -15.060  15.325 -14.692
  192    HB2  LEU  26           HB2      LEU  26 -17.113  15.679 -13.479
  193    HB3  LEU  26           HB3      LEU  26 -16.813  14.281 -12.446
  194    HG   LEU  26           HG       LEU  26 -14.837  15.502 -11.457
  195   HD11  LEU  26          HD11      LEU  26 -14.486  17.224 -13.244
  196   HD12  LEU  26          HD12      LEU  26 -16.090  17.903 -12.855
  197   HD13  LEU  26          HD13      LEU  26 -14.798  17.930 -11.642
  198   HD21  LEU  26          HD21      LEU  26 -17.014  15.355 -10.405
  199   HD22  LEU  26          HD22      LEU  26 -16.252  16.913 -10.054
  200   HD23  LEU  26          HD23      LEU  26 -17.564  16.818 -11.253
  201    H    LEU  27           H        LEU  27 -15.172  12.340 -13.105
  202    HA   LEU  27           HA       LEU  27 -13.792  11.434 -11.273
  203    HB2  LEU  27           HB2      LEU  27 -13.664  10.216 -13.415
  204    HB3  LEU  27           HB3      LEU  27 -12.270  11.182 -13.892
  205    HG   LEU  27           HG       LEU  27 -10.924  10.164 -12.073
  206   HD11  LEU  27          HD11      LEU  27 -13.442   8.565 -11.456
  207   HD12  LEU  27          HD12      LEU  27 -11.829   8.234 -10.803
  208   HD13  LEU  27          HD13      LEU  27 -12.645   9.739 -10.372
  209   HD21  LEU  27          HD21      LEU  27 -11.060   9.065 -14.286
  210   HD22  LEU  27          HD22      LEU  27 -10.827   7.893 -12.978
  211   HD23  LEU  27          HD23      LEU  27 -12.432   8.096 -13.713
  212    H    SER  28           H        SER  28 -13.369  13.534 -10.131
  213    HA   SER  28           HA       SER  28 -10.822  14.897 -10.583
  214    HB2  SER  28           HB2      SER  28 -13.042  15.129  -8.513
  215    HB3  SER  28           HB3      SER  28 -11.563  16.090  -8.466
  216    HG   SER  28           HG       SER  28 -13.309  17.150  -9.565
  217    H    GLU  29           H        GLU  29  -9.158  15.003  -9.073
  218    HA   GLU  29           HA       GLU  29  -9.047  12.804  -7.047
  219    HB2  GLU  29           HB2      GLU  29  -6.593  13.602  -8.617
  220    HB3  GLU  29           HB3      GLU  29  -6.805  12.294  -7.446
  221    HG2  GLU  29           HG2      GLU  29  -7.110  10.922  -9.135
  222    HG3  GLU  29           HG3      GLU  29  -8.705  11.622  -9.336
  223    H    GLU  30           H        GLU  30  -7.960  13.120  -5.111
  224    HA   GLU  30           HA       GLU  30  -7.236  15.915  -4.341
  225    HB2  GLU  30           HB2      GLU  30  -8.895  14.152  -2.529
  226    HB3  GLU  30           HB3      GLU  30  -8.669  15.900  -2.500
  227    HG2  GLU  30           HG2      GLU  30 -10.057  16.020  -4.621
  228    HG3  GLU  30           HG3      GLU  30 -10.316  14.267  -4.468
  229    H    GLN  31           H        GLN  31  -5.579  16.027  -2.807
  230    HA   GLN  31           HA       GLN  31  -4.469  13.403  -1.836
  231    HB2  GLN  31           HB2      GLN  31  -2.994  16.005  -2.323
  232    HB3  GLN  31           HB3      GLN  31  -2.334  14.583  -1.500
  233    HG2  GLN  31           HG2      GLN  31  -3.026  13.256  -3.597
  234    HG3  GLN  31           HG3      GLN  31  -3.062  14.838  -4.419
  235   HE21  GLN  31          HE22      GLN  31  -1.282  12.294  -3.168
  236   HE22  GLN  31          HE21      GLN  31  -0.102  13.279  -2.414
  237    H    VAL  32           H        VAL  32  -4.388  12.912   0.197
  238    HA   VAL  32           HA       VAL  32  -4.797  14.990   2.297
  239    HB   VAL  32           HB       VAL  32  -6.391  13.627   3.442
  240   HG11  VAL  32          HG11      VAL  32  -7.317  13.748   0.544
  241   HG12  VAL  32          HG12      VAL  32  -8.319  13.738   2.001
  242   HG13  VAL  32          HG13      VAL  32  -7.281  15.134   1.661
  243   HG21  VAL  32          HG21      VAL  32  -7.327  11.564   2.611
  244   HG22  VAL  32          HG22      VAL  32  -6.284  11.600   1.172
  245   HG23  VAL  32          HG23      VAL  32  -5.587  11.356   2.787
  246    H    ASP  33           H        ASP  33  -4.538  13.897   4.488
  247    HA   ASP  33           HA       ASP  33  -1.954  12.451   4.611
  248    HB2  ASP  33           HB2      ASP  33  -2.264  14.308   6.091
  249    HB3  ASP  33           HB3      ASP  33  -3.725  13.604   6.773
  250    H    VAL  34           H        VAL  34  -1.666  10.428   5.291
  251    HA   VAL  34           HA       VAL  34  -3.672   8.530   4.798
  252    HB   VAL  34           HB       VAL  34  -1.213   8.234   4.608
  253   HG11  VAL  34          HG11      VAL  34  -1.359   7.440   7.535
  254   HG12  VAL  34          HG12      VAL  34   0.047   7.321   6.481
  255   HG13  VAL  34          HG13      VAL  34  -0.600   8.925   6.927
  256   HG21  VAL  34          HG21      VAL  34  -1.221   5.857   4.857
  257   HG22  VAL  34          HG22      VAL  34  -2.594   5.904   5.968
  258   HG23  VAL  34          HG23      VAL  34  -2.808   6.372   4.266
  259    H    GLU  35           H        GLU  35  -3.485  10.292   7.725
  260    HA   GLU  35           HA       GLU  35  -5.051   8.291   9.265
  261    HB2  GLU  35           HB2      GLU  35  -3.442  10.001  10.256
  262    HB3  GLU  35           HB3      GLU  35  -4.627  11.240   9.796
  263    HG2  GLU  35           HG2      GLU  35  -6.316   9.958  11.207
  264    HG3  GLU  35           HG3      GLU  35  -4.955   9.009  11.815
  265    H    LEU  36           H        LEU  36  -5.651  10.967   7.020
  266    HA   LEU  36           HA       LEU  36  -8.364  11.495   8.020
  267    HB2  LEU  36           HB2      LEU  36  -6.752  12.774   5.779
  268    HB3  LEU  36           HB3      LEU  36  -8.242  13.396   6.479
  269    HG   LEU  36           HG       LEU  36  -5.561  13.157   7.913
  270   HD11  LEU  36          HD11      LEU  36  -7.136  15.581   6.953
  271   HD12  LEU  36          HD12      LEU  36  -5.591  15.612   7.832
  272   HD13  LEU  36          HD13      LEU  36  -5.664  14.945   6.193
  273   HD21  LEU  36          HD21      LEU  36  -7.372  12.890   9.530
  274   HD22  LEU  36          HD22      LEU  36  -6.607  14.469   9.699
  275   HD23  LEU  36          HD23      LEU  36  -8.186  14.340   8.885
  276    H    VAL  37           H        VAL  37  -6.904   9.683   5.457
  277    HA   VAL  37           HA       VAL  37  -9.090   9.756   3.569
  278    HB   VAL  37           HB       VAL  37  -6.946   9.165   2.773
  279   HG11  VAL  37          HG11      VAL  37  -6.960   6.649   4.507
  280   HG12  VAL  37          HG12      VAL  37  -5.722   7.134   3.349
  281   HG13  VAL  37          HG13      VAL  37  -5.962   8.090   4.808
  282   HG21  VAL  37          HG21      VAL  37  -8.839   8.105   1.623
  283   HG22  VAL  37          HG22      VAL  37  -7.355   7.133   1.546
  284   HG23  VAL  37          HG23      VAL  37  -8.661   6.659   2.641
  285    H    GLN  38           H        GLN  38  -8.313   7.349   6.186
  286    HA   GLN  38           HA       GLN  38  -9.439   5.816   7.189
  287    HB2  GLN  38           HB2      GLN  38 -11.910   7.405   6.500
  288    HB3  GLN  38           HB3      GLN  38 -11.767   6.171   7.749
  289    HG2  GLN  38           HG2      GLN  38 -10.096   7.517   8.960
  290    HG3  GLN  38           HG3      GLN  38 -10.143   8.773   7.709
  291   HE21  GLN  38          HE22      GLN  38 -12.531   9.586   7.287
  292   HE22  GLN  38          HE21      GLN  38 -13.480   9.595   8.769
  293    H    ARG  39           H        ARG  39 -11.076   4.129   7.177
  294    HA   ARG  39           HA       ARG  39 -10.455   2.519   4.874
  295    HB2  ARG  39           HB2      ARG  39 -11.235   0.678   6.211
  296    HB3  ARG  39           HB3      ARG  39 -10.244   1.769   7.176
  297    HG2  ARG  39           HG2      ARG  39 -12.585   2.778   7.908
  298    HG3  ARG  39           HG3      ARG  39 -13.225   1.251   7.277
  299    HD2  ARG  39           HD2      ARG  39 -11.693   0.001   8.780
  300    HD3  ARG  39           HD3      ARG  39 -11.045   1.525   9.391
  301    HE   ARG  39           HE       ARG  39 -13.717   0.329   9.919
  302   HH11  ARG  39          HH11      ARG  39 -11.546   3.005  10.683
  303   HH12  ARG  39          HH12      ARG  39 -12.505   3.420  12.098
  304   HH21  ARG  39          HH21      ARG  39 -14.897   1.121  11.708
  305   HH22  ARG  39          HH22      ARG  39 -14.183   2.443  12.631
  306    H    GLY  40           H        GLY  40 -12.398   4.549   4.189
  307    HA2  GLY  40           HA2      GLY  40 -14.620   2.807   3.120
  308    HA3  GLY  40           HA3      GLY  40 -14.879   4.438   3.708
  309    H    ASP  41           H        ASP  41 -12.060   4.845   2.071
  310    HA   ASP  41           HA       ASP  41 -13.499   5.682  -0.411
  311    HB2  ASP  41           HB2      ASP  41 -11.271   6.857   1.213
  312    HB3  ASP  41           HB3      ASP  41 -11.236   7.121  -0.519
  313    H    ILE  42           H        ILE  42 -11.971   6.024  -2.344
  314    HA   ILE  42           HA       ILE  42 -10.440   3.519  -2.903
  315    HB   ILE  42           HB       ILE  42 -12.382   5.050  -4.676
  316   HG12  ILE  42          HG12      ILE  42 -12.476   2.231  -3.500
  317   HG13  ILE  42          HG13      ILE  42 -13.506   3.588  -3.046
  318   HG21  ILE  42          HG21      ILE  42 -10.454   4.293  -6.002
  319   HG22  ILE  42          HG22      ILE  42 -10.645   2.640  -5.358
  320   HG23  ILE  42          HG23      ILE  42 -11.880   3.374  -6.412
  321   HD11  ILE  42          HD11      ILE  42 -13.563   2.054  -5.662
  322   HD12  ILE  42          HD12      ILE  42 -14.823   2.189  -4.431
  323   HD13  ILE  42          HD13      ILE  42 -14.412   3.602  -5.418
  324    H    ILE  43           H        ILE  43  -8.401   3.791  -3.635
  325    HA   ILE  43           HA       ILE  43  -7.404   6.462  -4.388
  326    HB   ILE  43           HB       ILE  43  -6.082   4.004  -3.166
  327   HG12  ILE  43          HG12      ILE  43  -7.686   4.694  -1.563
  328   HG13  ILE  43          HG13      ILE  43  -6.090   5.124  -0.991
  329   HG21  ILE  43          HG21      ILE  43  -5.006   6.840  -3.256
  330   HG22  ILE  43          HG22      ILE  43  -4.233   5.433  -2.516
  331   HG23  ILE  43          HG23      ILE  43  -4.456   5.494  -4.265
  332   HD11  ILE  43          HD11      ILE  43  -7.985   7.123  -2.287
  333   HD12  ILE  43          HD12      ILE  43  -7.923   6.818  -0.567
  334   HD13  ILE  43          HD13      ILE  43  -6.490   7.480  -1.398
  335    H    LYS  44           H        LYS  44  -6.741   6.667  -6.505
  336    HA   LYS  44           HA       LYS  44  -5.948   4.230  -7.991
  337    HB2  LYS  44           HB2      LYS  44  -7.635   6.058  -8.815
  338    HB3  LYS  44           HB3      LYS  44  -6.173   6.912  -9.343
  339    HG2  LYS  44           HG2      LYS  44  -5.460   4.834 -10.566
  340    HG3  LYS  44           HG3      LYS  44  -6.890   4.014  -9.941
  341    HD2  LYS  44           HD2      LYS  44  -8.188   5.975 -11.227
  342    HD3  LYS  44           HD3      LYS  44  -6.666   6.006 -12.163
  343    HE2  LYS  44           HE2      LYS  44  -6.882   3.439 -12.259
  344    HE3  LYS  44           HE3      LYS  44  -8.486   3.634 -11.579
  345    HZ1  LYS  44           HZ1      LYS  44  -8.568   3.439 -13.971
  346    HZ2  LYS  44           HZ2      LYS  44  -9.143   4.886 -13.539
  347    HZ3  LYS  44           HZ3      LYS  44  -7.624   4.783 -14.184
  348    H    VAL  45           H        VAL  45  -3.950   3.641  -8.404
  349    HA   VAL  45           HA       VAL  45  -1.720   5.458  -7.630
  350    HB   VAL  45           HB       VAL  45  -2.141   3.236  -6.488
  351   HG11  VAL  45          HG11      VAL  45  -0.845   2.060  -8.983
  352   HG12  VAL  45          HG12      VAL  45  -1.306   1.209  -7.501
  353   HG13  VAL  45          HG13      VAL  45  -2.558   1.921  -8.540
  354   HG21  VAL  45          HG21      VAL  45   0.024   4.435  -6.278
  355   HG22  VAL  45          HG22      VAL  45   0.234   2.674  -6.279
  356   HG23  VAL  45          HG23      VAL  45   0.623   3.607  -7.735
  357    H    VAL  46           H        VAL  46  -0.003   5.949  -8.946
  358    HA   VAL  46           HA       VAL  46  -0.416   5.569 -11.817
  359    HB   VAL  46           HB       VAL  46   1.208   7.255 -12.168
  360   HG11  VAL  46          HG11      VAL  46   0.297   9.116 -10.969
  361   HG12  VAL  46          HG12      VAL  46  -1.012   7.976 -11.313
  362   HG13  VAL  46          HG13      VAL  46  -0.323   8.077  -9.683
  363   HG21  VAL  46          HG21      VAL  46   2.484   8.314 -10.291
  364   HG22  VAL  46          HG22      VAL  46   2.034   6.930  -9.270
  365   HG23  VAL  46          HG23      VAL  46   3.024   6.688 -10.709
  366    HA   PRO  47           HA       PRO  47   2.819   2.601 -12.721
  367    HB2  PRO  47           HB2      PRO  47   3.926   4.532 -14.747
  368    HB3  PRO  47           HB3      PRO  47   3.512   2.803 -14.949
  369    HG2  PRO  47           HG2      PRO  47   1.888   4.749 -15.923
  370    HG3  PRO  47           HG3      PRO  47   1.186   3.307 -15.121
  371    HD2  PRO  47           HD2      PRO  47   1.671   6.057 -13.966
  372    HD3  PRO  47           HD3      PRO  47   0.213   5.026 -13.839
  373    H    GLY  48           H        GLY  48   4.837   2.231 -11.769
  374    HA2  GLY  48           HA2      GLY  48   6.811   2.688 -10.656
  375    HA3  GLY  48           HA3      GLY  48   6.753   4.351 -11.213
  376    H    GLY  49           H        GLY  49   3.798   3.890  -9.682
  377    HA2  GLY  49           HA2      GLY  49   4.539   5.480  -7.381
  378    HA3  GLY  49           HA3      GLY  49   2.950   4.815  -7.747
  379    H    LYS  50           H        LYS  50   3.520   4.881  -5.189
  380    HA   LYS  50           HA       LYS  50   4.323   2.112  -4.338
  381    HB2  LYS  50           HB2      LYS  50   4.793   4.813  -3.022
  382    HB3  LYS  50           HB3      LYS  50   5.037   3.275  -2.194
  383    HG2  LYS  50           HG2      LYS  50   6.895   2.689  -3.452
  384    HG3  LYS  50           HG3      LYS  50   6.436   3.673  -4.841
  385    HD2  LYS  50           HD2      LYS  50   6.992   5.731  -3.657
  386    HD3  LYS  50           HD3      LYS  50   7.470   4.807  -2.215
  387    HE2  LYS  50           HE2      LYS  50   9.330   3.803  -3.336
  388    HE3  LYS  50           HE3      LYS  50   8.691   4.220  -4.926
  389    HZ1  LYS  50           HZ1      LYS  50   9.756   6.224  -3.010
  390    HZ2  LYS  50           HZ2      LYS  50  10.504   5.664  -4.373
  391    HZ3  LYS  50           HZ3      LYS  50   9.139   6.538  -4.499
  392    H    PHE  51           H        PHE  51   3.101   1.094  -2.753
  393    HA   PHE  51           HA       PHE  51   0.315   1.998  -2.640
  394    HB2  PHE  51           HB2      PHE  51   1.657  -0.532  -1.688
  395    HB3  PHE  51           HB3      PHE  51  -0.059  -0.205  -1.501
  396    HD1  PHE  51           HD1      PHE  51  -1.580  -0.116  -3.476
  397    HD2  PHE  51           HD2      PHE  51   2.587  -1.111  -3.873
  398    HE1  PHE  51           HE1      PHE  51  -1.998  -1.041  -5.747
  399    HE2  PHE  51           HE2      PHE  51   2.177  -1.998  -6.133
  400    HZ   PHE  51           HZ       PHE  51  -0.116  -1.969  -7.086
  401    HA   PRO  52           HA       PRO  52   0.998   3.706   1.446
  402    HB2  PRO  52           HB2      PRO  52  -1.291   5.096   1.811
  403    HB3  PRO  52           HB3      PRO  52  -0.150   5.499   0.494
  404    HG2  PRO  52           HG2      PRO  52  -2.665   3.813   0.308
  405    HG3  PRO  52           HG3      PRO  52  -2.169   5.182  -0.737
  406    HD2  PRO  52           HD2      PRO  52  -1.694   2.553  -1.403
  407    HD3  PRO  52           HD3      PRO  52  -0.585   3.883  -1.859
  408    H    VAL  53           H        VAL  53  -1.463   1.276   1.020
  409    HA   VAL  53           HA       VAL  53  -1.604   0.629   3.850
  410    HB   VAL  53           HB       VAL  53  -4.051   0.526   3.966
  411   HG11  VAL  53          HG11      VAL  53  -3.101   3.378   3.519
  412   HG12  VAL  53          HG12      VAL  53  -4.470   2.832   4.507
  413   HG13  VAL  53          HG13      VAL  53  -2.816   2.422   4.989
  414   HG21  VAL  53          HG21      VAL  53  -5.460   1.832   2.467
  415   HG22  VAL  53          HG22      VAL  53  -4.051   2.266   1.474
  416   HG23  VAL  53          HG23      VAL  53  -4.599   0.576   1.559
  417    H    ASP  54           H        ASP  54  -2.871  -1.541   4.099
  418    HA   ASP  54           HA       ASP  54  -2.528  -3.136   1.630
  419    HB2  ASP  54           HB2      ASP  54  -2.635  -5.114   2.870
  420    HB3  ASP  54           HB3      ASP  54  -1.473  -4.041   3.629
  421    H    GLY  55           H        GLY  55  -4.124  -3.853   0.414
  422    HA2  GLY  55           HA2      GLY  55  -6.949  -3.852   1.157
  423    HA3  GLY  55           HA3      GLY  55  -6.478  -2.430   0.236
  424    H    ARG  56           H        ARG  56  -8.144  -3.426  -1.210
  425    HA   ARG  56           HA       ARG  56  -6.978  -5.533  -3.000
  426    HB2  ARG  56           HB2      ARG  56  -8.950  -6.158  -1.597
  427    HB3  ARG  56           HB3      ARG  56  -9.923  -5.021  -2.542
  428    HG2  ARG  56           HG2      ARG  56  -9.468  -6.278  -4.593
  429    HG3  ARG  56           HG3      ARG  56  -8.392  -7.375  -3.718
  430    HD2  ARG  56           HD2      ARG  56 -11.352  -7.056  -3.121
  431    HD3  ARG  56           HD3      ARG  56 -10.624  -8.288  -4.173
  432    HE   ARG  56           HE       ARG  56  -9.954  -8.088  -1.248
  433   HH11  ARG  56          HH11      ARG  56 -11.199 -10.103  -3.845
  434   HH12  ARG  56          HH12      ARG  56 -10.816 -11.556  -2.972
  435   HH21  ARG  56          HH21      ARG  56  -9.562  -9.935  -0.232
  436   HH22  ARG  56          HH22      ARG  56  -9.714 -11.477  -1.067
  437    H    VAL  57           H        VAL  57  -6.938  -5.380  -5.086
  438    HA   VAL  57           HA       VAL  57  -7.182  -2.777  -6.444
  439    HB   VAL  57           HB       VAL  57  -6.075  -5.480  -7.335
  440   HG11  VAL  57          HG11      VAL  57  -5.974  -2.755  -8.691
  441   HG12  VAL  57          HG12      VAL  57  -5.035  -4.188  -9.186
  442   HG13  VAL  57          HG13      VAL  57  -6.785  -4.218  -9.292
  443   HG21  VAL  57          HG21      VAL  57  -4.672  -4.447  -5.565
  444   HG22  VAL  57          HG22      VAL  57  -3.856  -4.503  -7.127
  445   HG23  VAL  57          HG23      VAL  57  -4.538  -2.973  -6.548
  446    H    ILE  58           H        ILE  58  -8.901  -2.366  -7.758
  447    HA   ILE  58           HA       ILE  58 -10.470  -4.607  -8.955
  448    HB   ILE  58           HB       ILE  58 -12.585  -3.260  -8.278
  449   HG12  ILE  58          HG12      ILE  58 -10.770  -2.359  -6.013
  450   HG13  ILE  58          HG13      ILE  58 -11.113  -1.310  -7.405
  451   HG21  ILE  58          HG21      ILE  58 -11.096  -4.756  -6.092
  452   HG22  ILE  58          HG22      ILE  58 -12.846  -4.531  -6.252
  453   HG23  ILE  58          HG23      ILE  58 -11.984  -5.515  -7.435
  454   HD11  ILE  58          HD11      ILE  58 -13.538  -1.422  -6.921
  455   HD12  ILE  58          HD12      ILE  58 -13.193  -2.374  -5.454
  456   HD13  ILE  58          HD13      ILE  58 -12.599  -0.709  -5.598
  457    H    GLU  59           H        GLU  59  -8.571  -2.675 -10.094
  458    HA   GLU  59           HA       GLU  59  -9.950  -2.519 -12.575
  459    HB2  GLU  59           HB2      GLU  59 -10.514  -0.193 -11.269
  460    HB3  GLU  59           HB3      GLU  59  -8.913   0.204 -11.865
  461    HG2  GLU  59           HG2      GLU  59  -9.932  -0.770 -14.163
  462    HG3  GLU  59           HG3      GLU  59 -11.449  -0.306 -13.397
  463    H    GLY  60           H        GLY  60  -8.342  -2.872 -14.124
  464    HA2  GLY  60           HA2      GLY  60  -6.403  -2.260 -15.304
  465    HA3  GLY  60           HA3      GLY  60  -5.806  -1.391 -13.903
  466    H    HIS  61           H        HIS  61  -3.923  -2.493 -14.920
  467    HA   HIS  61           HA       HIS  61  -3.289  -5.108 -13.646
  468    HB2  HIS  61           HB2      HIS  61  -2.939  -4.529 -16.607
  469    HB3  HIS  61           HB3      HIS  61  -2.527  -6.009 -15.770
  470    HD1  HIS  61           HD1      HIS  61  -5.460  -4.171 -17.271
  471    HD2  HIS  61           HD2      HIS  61  -4.663  -7.590 -14.974
  472    HE1  HIS  61           HE1      HIS  61  -7.644  -5.529 -17.227
  473    H    SER  62           H        SER  62  -1.343  -4.988 -12.706
  474    HA   SER  62           HA       SER  62   0.915  -3.736 -14.038
  475    HB2  SER  62           HB2      SER  62  -0.361  -2.080 -12.272
  476    HB3  SER  62           HB3      SER  62   0.792  -2.850 -11.191
  477    HG   SER  62           HG       SER  62   1.390  -0.903 -12.524
  478    H    MET  63           H        MET  63   2.939  -4.150 -12.773
  479    HA   MET  63           HA       MET  63   2.799  -6.681 -11.180
  480    HB2  MET  63           HB2      MET  63   3.932  -6.962 -13.262
  481    HB3  MET  63           HB3      MET  63   4.982  -5.576 -12.973
  482    HG2  MET  63           HG2      MET  63   6.225  -6.650 -11.372
  483    HG3  MET  63           HG3      MET  63   4.999  -7.882 -11.031
  484    HE1  MET  63           HE1      MET  63   4.113  -9.296 -13.477
  485    HE2  MET  63           HE2      MET  63   5.369 -10.519 -13.753
  486    HE3  MET  63           HE3      MET  63   4.838 -10.162 -12.100
  487    H    VAL  64           H        VAL  64   3.907  -6.845  -9.246
  488    HA   VAL  64           HA       VAL  64   4.639  -4.262  -7.942
  489    HB   VAL  64           HB       VAL  64   3.028  -6.566  -6.808
  490   HG11  VAL  64          HG11      VAL  64   3.833  -3.897  -5.560
  491   HG12  VAL  64          HG12      VAL  64   2.633  -5.021  -4.886
  492   HG13  VAL  64          HG13      VAL  64   4.313  -5.523  -5.008
  493   HG21  VAL  64          HG21      VAL  64   1.702  -5.247  -8.384
  494   HG22  VAL  64          HG22      VAL  64   1.211  -4.824  -6.737
  495   HG23  VAL  64          HG23      VAL  64   2.269  -3.734  -7.662
  496    H    ASP  65           H        ASP  65   6.395  -4.112  -6.714
  497    HA   ASP  65           HA       ASP  65   8.128  -6.516  -6.309
  498    HB2  ASP  65           HB2      ASP  65   8.931  -4.492  -7.589
  499    HB3  ASP  65           HB3      ASP  65   8.840  -3.566  -6.098
  500    H    GLU  66           H        GLU  66   7.661  -7.506  -4.415
  501    HA   GLU  66           HA       GLU  66   7.189  -5.878  -1.945
  502    HB2  GLU  66           HB2      GLU  66   5.650  -7.604  -1.186
  503    HB3  GLU  66           HB3      GLU  66   5.124  -6.800  -2.665
  504    HG2  GLU  66           HG2      GLU  66   5.664  -8.686  -4.015
  505    HG3  GLU  66           HG3      GLU  66   6.518  -9.491  -2.686
  506    H    SER  67           H        SER  67   9.493  -7.665  -3.189
  507    HA   SER  67           HA       SER  67  10.354  -9.677  -1.623
  508    HB2  SER  67           HB2      SER  67  12.677  -9.145  -2.152
  509    HB3  SER  67           HB3      SER  67  11.632  -8.888  -3.541
  510    HG   SER  67           HG       SER  67  11.592  -6.622  -2.938
  511    H    LEU  68           H        LEU  68  10.451  -6.365  -0.302
  512    HA   LEU  68           HA       LEU  68  12.046  -7.238   2.012
  513    HB2  LEU  68           HB2      LEU  68  12.172  -4.977   0.993
  514    HB3  LEU  68           HB3      LEU  68  10.506  -4.665   1.425
  515    HG   LEU  68           HG       LEU  68  12.150  -3.489   2.799
  516   HD11  LEU  68          HD11      LEU  68  10.747  -5.403   4.673
  517   HD12  LEU  68          HD12      LEU  68  11.164  -3.711   4.906
  518   HD13  LEU  68          HD13      LEU  68   9.889  -4.145   3.752
  519   HD21  LEU  68          HD21      LEU  68  13.936  -5.177   2.850
  520   HD22  LEU  68          HD22      LEU  68  13.521  -4.574   4.465
  521   HD23  LEU  68          HD23      LEU  68  12.957  -6.178   3.949
  522    H    ILE  69           H        ILE  69   8.604  -6.718   1.336
  523    HA   ILE  69           HA       ILE  69   7.834  -6.647   4.157
  524    HB   ILE  69           HB       ILE  69   6.018  -7.058   1.746
  525   HG12  ILE  69          HG12      ILE  69   7.387  -4.929   1.532
  526   HG13  ILE  69          HG13      ILE  69   5.647  -4.794   1.474
  527   HG21  ILE  69          HG21      ILE  69   4.860  -7.643   3.763
  528   HG22  ILE  69          HG22      ILE  69   5.536  -6.262   4.649
  529   HG23  ILE  69          HG23      ILE  69   4.333  -6.000   3.387
  530   HD11  ILE  69          HD11      ILE  69   7.273  -4.200   3.970
  531   HD12  ILE  69          HD12      ILE  69   6.691  -2.994   2.791
  532   HD13  ILE  69          HD13      ILE  69   5.524  -3.946   3.715
  533    H    THR  70           H        THR  70   7.037  -8.913   1.518
  534    HA   THR  70           HA       THR  70   6.311 -11.083   3.371
  535    HB   THR  70           HB       THR  70   5.695 -12.133   1.079
  536    HG1  THR  70           HG1      THR  70   5.460 -10.468  -0.533
  537   HG21  THR  70          HG21      THR  70   3.668 -10.827   0.851
  538   HG22  THR  70          HG22      THR  70   4.005 -11.056   2.574
  539   HG23  THR  70          HG23      THR  70   4.353  -9.489   1.796
  540    H    GLY  71           H        GLY  71   9.109 -10.129   1.629
  541    HA2  GLY  71           HA2      GLY  71  11.210 -11.180   1.625
  542    HA3  GLY  71           HA3      GLY  71  10.512 -12.577   2.431
  543    H    GLU  72           H        GLU  72   9.218 -11.239  -0.568
  544    HA   GLU  72           HA       GLU  72   9.665 -13.694  -2.121
  545    HB2  GLU  72           HB2      GLU  72   8.795 -10.897  -2.975
  546    HB3  GLU  72           HB3      GLU  72   8.774 -12.320  -4.007
  547    HG2  GLU  72           HG2      GLU  72   7.099 -11.816  -1.545
  548    HG3  GLU  72           HG3      GLU  72   6.524 -11.908  -3.194
  549    H    ALA  73           H        ALA  73  10.664 -13.097  -4.489
  550    HA   ALA  73           HA       ALA  73  13.151 -11.557  -4.215
  551    HB1  ALA  73           HB1      ALA  73  14.629 -13.422  -4.793
  552    HB2  ALA  73           HB2      ALA  73  13.788 -13.701  -3.265
  553    HB3  ALA  73           HB3      ALA  73  13.253 -14.548  -4.744
  554    H    MET  74           H        MET  74  10.531 -12.106  -5.993
  555    HA   MET  74           HA       MET  74  11.664 -10.829  -8.278
  556    HB2  MET  74           HB2      MET  74  10.668 -12.353  -9.949
  557    HB3  MET  74           HB3      MET  74  11.941 -13.138  -9.022
  558    HG2  MET  74           HG2      MET  74  10.152 -14.205  -7.586
  559    HG3  MET  74           HG3      MET  74   8.945 -13.476  -8.643
  560    HE1  MET  74           HE1      MET  74  12.425 -15.391  -9.294
  561    HE2  MET  74           HE2      MET  74  11.520 -16.323  -8.078
  562    HE3  MET  74           HE3      MET  74  11.778 -16.989  -9.705
  563    HA   PRO  75           HA       PRO  75   7.790  -8.907  -7.548
  564    HB2  PRO  75           HB2      PRO  75   7.278  -7.479  -9.772
  565    HB3  PRO  75           HB3      PRO  75   8.676  -7.153  -8.719
  566    HG2  PRO  75           HG2      PRO  75   8.656  -8.791 -11.276
  567    HG3  PRO  75           HG3      PRO  75   9.773  -7.464 -10.824
  568    HD2  PRO  75           HD2      PRO  75  10.408 -10.093 -10.443
  569    HD3  PRO  75           HD3      PRO  75  10.912  -8.832  -9.278
  570    H    VAL  76           H        VAL  76   5.522  -8.772  -8.045
  571    HA   VAL  76           HA       VAL  76   4.482 -11.316  -9.240
  572    HB   VAL  76           HB       VAL  76   3.308  -9.805  -6.883
  573   HG11  VAL  76          HG11      VAL  76   3.025 -12.691  -7.834
  574   HG12  VAL  76          HG12      VAL  76   2.280 -12.007  -6.384
  575   HG13  VAL  76          HG13      VAL  76   1.785 -11.417  -7.969
  576   HG21  VAL  76          HG21      VAL  76   5.552 -10.464  -6.152
  577   HG22  VAL  76          HG22      VAL  76   4.347 -11.496  -5.395
  578   HG23  VAL  76          HG23      VAL  76   5.295 -12.115  -6.763
  579    H    ALA  77           H        ALA  77   2.701 -11.286 -10.525
  580    HA   ALA  77           HA       ALA  77   1.817  -8.737 -11.620
  581    HB1  ALA  77           HB1      ALA  77   0.782 -11.554 -12.122
  582    HB2  ALA  77           HB2      ALA  77   0.430 -10.122 -13.109
  583    HB3  ALA  77           HB3      ALA  77   2.088 -10.744 -13.016
  584    H    LYS  78           H        LYS  78  -0.168  -7.746 -11.585
  585    HA   LYS  78           HA       LYS  78  -2.322  -8.738  -9.766
  586    HB2  LYS  78           HB2      LYS  78  -1.417  -5.835 -10.086
  587    HB3  LYS  78           HB3      LYS  78  -2.767  -6.378  -9.098
  588    HG2  LYS  78           HG2      LYS  78   0.151  -7.061  -8.633
  589    HG3  LYS  78           HG3      LYS  78  -0.769  -5.835  -7.762
  590    HD2  LYS  78           HD2      LYS  78  -2.194  -7.445  -6.712
  591    HD3  LYS  78           HD3      LYS  78  -1.629  -8.742  -7.772
  592    HE2  LYS  78           HE2      LYS  78   0.644  -8.557  -6.798
  593    HE3  LYS  78           HE3      LYS  78   0.027  -7.392  -5.617
  594    HZ1  LYS  78           HZ1      LYS  78  -1.009 -10.158  -5.975
  595    HZ2  LYS  78           HZ2      LYS  78   0.064  -9.704  -4.835
  596    HZ3  LYS  78           HZ3      LYS  78  -1.467  -9.098  -4.779
  597    H    LYS  79           H        LYS  79  -4.369  -7.998 -10.116
  598    HA   LYS  79           HA       LYS  79  -5.300  -6.769 -12.590
  599    HB2  LYS  79           HB2      LYS  79  -6.619  -8.734 -13.270
  600    HB3  LYS  79           HB3      LYS  79  -4.904  -9.070 -13.340
  601    HG2  LYS  79           HG2      LYS  79  -4.944 -10.553 -11.545
  602    HG3  LYS  79           HG3      LYS  79  -6.419  -9.876 -10.854
  603    HD2  LYS  79           HD2      LYS  79  -6.755 -12.101 -11.873
  604    HD3  LYS  79           HD3      LYS  79  -7.799 -10.842 -12.531
  605    HE2  LYS  79           HE2      LYS  79  -6.293 -10.626 -14.515
  606    HE3  LYS  79           HE3      LYS  79  -5.267 -11.913 -13.864
  607    HZ1  LYS  79           HZ1      LYS  79  -8.120 -12.204 -14.632
  608    HZ2  LYS  79           HZ2      LYS  79  -6.835 -12.771 -15.489
  609    HZ3  LYS  79           HZ3      LYS  79  -7.174 -13.404 -14.008
  610    HA   PRO  80           HA       PRO  80  -8.799  -5.967  -9.888
  611    HB2  PRO  80           HB2      PRO  80 -10.718  -7.411 -11.707
  612    HB3  PRO  80           HB3      PRO  80 -10.887  -5.801 -10.937
  613    HG2  PRO  80           HG2      PRO  80 -10.193  -5.979 -13.497
  614    HG3  PRO  80           HG3      PRO  80  -9.282  -4.839 -12.453
  615    HD2  PRO  80           HD2      PRO  80  -8.506  -7.649 -13.293
  616    HD3  PRO  80           HD3      PRO  80  -7.509  -6.163 -13.348
  617    H    GLY  81           H        GLY  81  -9.936  -6.793  -8.262
  618    HA2  GLY  81           HA2      GLY  81 -10.632  -8.281  -6.622
  619    HA3  GLY  81           HA3      GLY  81 -10.582  -9.607  -7.787
  620    H    SER  82           H        SER  82  -7.686  -7.601  -7.285
  621    HA   SER  82           HA       SER  82  -6.322 -10.006  -6.080
  622    HB2  SER  82           HB2      SER  82  -5.584  -9.318  -8.407
  623    HB3  SER  82           HB3      SER  82  -5.026  -7.791  -7.687
  624    HG   SER  82           HG       SER  82  -4.017 -10.378  -7.478
  625    H    THR  83           H        THR  83  -4.544  -9.511  -4.410
  626    HA   THR  83           HA       THR  83  -5.306  -7.049  -2.908
  627    HB   THR  83           HB       THR  83  -4.887  -8.458  -0.865
  628    HG1  THR  83           HG1      THR  83  -5.361 -10.738  -1.345
  629   HG21  THR  83          HG21      THR  83  -7.217  -9.275  -2.681
  630   HG22  THR  83          HG22      THR  83  -7.135  -9.423  -0.911
  631   HG23  THR  83          HG23      THR  83  -7.154  -7.830  -1.657
  632    H    VAL  84           H        VAL  84  -3.832  -5.958  -1.718
  633    HA   VAL  84           HA       VAL  84  -0.945  -6.425  -2.348
  634    HB   VAL  84           HB       VAL  84  -0.732  -3.994  -2.825
  635   HG11  VAL  84          HG11      VAL  84  -2.518  -5.531  -4.750
  636   HG12  VAL  84          HG12      VAL  84  -1.488  -4.134  -5.138
  637   HG13  VAL  84          HG13      VAL  84  -0.748  -5.653  -4.619
  638   HG21  VAL  84          HG21      VAL  84  -2.665  -2.688  -3.517
  639   HG22  VAL  84          HG22      VAL  84  -3.769  -4.015  -3.120
  640   HG23  VAL  84          HG23      VAL  84  -2.867  -3.184  -1.832
  641    H    ILE  85           H        ILE  85   0.550  -5.283  -1.068
  642    HA   ILE  85           HA       ILE  85  -0.413  -4.426   1.615
  643    HB   ILE  85           HB       ILE  85   1.639  -5.065   2.598
  644   HG12  ILE  85          HG12      ILE  85   3.341  -4.729   1.012
  645   HG13  ILE  85          HG13      ILE  85   3.365  -6.427   1.463
  646   HG21  ILE  85          HG21      ILE  85   0.637  -7.435   1.014
  647   HG22  ILE  85          HG22      ILE  85   1.512  -7.436   2.563
  648   HG23  ILE  85          HG23      ILE  85  -0.121  -6.747   2.469
  649   HD11  ILE  85          HD11      ILE  85   2.356  -5.284  -1.147
  650   HD12  ILE  85          HD12      ILE  85   3.812  -6.229  -0.854
  651   HD13  ILE  85          HD13      ILE  85   2.228  -7.004  -0.678
  652    H    ALA  86           H        ALA  86   0.659  -2.744   2.687
  653    HA   ALA  86           HA       ALA  86   1.369  -0.540   1.035
  654    HB1  ALA  86           HB1      ALA  86   1.828  -0.919   4.033
  655    HB2  ALA  86           HB2      ALA  86   1.742   0.630   3.165
  656    HB3  ALA  86           HB3      ALA  86   0.300  -0.391   3.311
  657    H    GLY  87           H        GLY  87   3.296   0.553   0.759
  658    HA2  GLY  87           HA2      GLY  87   5.585   1.002   0.842
  659    HA3  GLY  87           HA3      GLY  87   5.827  -0.380   1.908
  660    H    SER  88           H        SER  88   4.156  -1.675  -0.605
  661    HA   SER  88           HA       SER  88   6.528  -2.649  -2.055
  662    HB2  SER  88           HB2      SER  88   4.992  -4.117  -3.205
  663    HB3  SER  88           HB3      SER  88   4.728  -4.225  -1.469
  664    HG   SER  88           HG       SER  88   2.800  -3.157  -1.680
  665    H    ILE  89           H        ILE  89   6.637  -2.511  -4.385
  666    HA   ILE  89           HA       ILE  89   5.854   0.227  -5.277
  667    HB   ILE  89           HB       ILE  89   8.096  -1.212  -6.608
  668   HG12  ILE  89          HG12      ILE  89   8.693  -1.748  -4.321
  669   HG13  ILE  89          HG13      ILE  89   9.785  -0.582  -5.029
  670   HG21  ILE  89          HG21      ILE  89   7.675   1.669  -5.703
  671   HG22  ILE  89          HG22      ILE  89   8.999   1.067  -6.721
  672   HG23  ILE  89          HG23      ILE  89   7.325   1.030  -7.309
  673   HD11  ILE  89          HD11      ILE  89   7.544   0.211  -3.116
  674   HD12  ILE  89          HD12      ILE  89   9.208  -0.141  -2.643
  675   HD13  ILE  89          HD13      ILE  89   8.855   1.230  -3.715
  676    H    ASN  90           H        ASN  90   4.679   0.588  -7.052
  677    HA   ASN  90           HA       ASN  90   3.593  -1.660  -8.602
  678    HB2  ASN  90           HB2      ASN  90   2.196   0.195  -7.564
  679    HB3  ASN  90           HB3      ASN  90   3.000   1.339  -8.632
  680   HD21  ASN  90          HD22      ASN  90   1.796   1.794 -10.423
  681   HD22  ASN  90          HD21      ASN  90   0.645   0.679 -11.128
  682    H    GLN  91           H        GLN  91   3.944  -2.030 -10.789
  683    HA   GLN  91           HA       GLN  91   6.192  -0.566 -11.999
  684    HB2  GLN  91           HB2      GLN  91   6.144  -3.079 -11.505
  685    HB3  GLN  91           HB3      GLN  91   5.114  -3.221 -12.919
  686    HG2  GLN  91           HG2      GLN  91   7.357  -3.669 -13.617
  687    HG3  GLN  91           HG3      GLN  91   7.018  -2.052 -14.226
  688   HE21  GLN  91          HE22      GLN  91   8.296  -0.291 -13.404
  689   HE22  GLN  91          HE21      GLN  91   9.577  -0.549 -12.224
  690    H    ASN  92           H        ASN  92   4.507  -2.182 -14.547
  691    HA   ASN  92           HA       ASN  92   4.343   0.501 -15.753
  692    HB2  ASN  92           HB2      ASN  92   5.881  -1.288 -16.619
  693    HB3  ASN  92           HB3      ASN  92   4.465  -2.210 -17.113
  694   HD21  ASN  92          HD22      ASN  92   2.956  -1.051 -18.583
  695   HD22  ASN  92          HD21      ASN  92   3.568   0.184 -19.666
  696    H    GLY  93           H        GLY  93   2.271   0.425 -14.282
  697    HA2  GLY  93           HA2      GLY  93   0.287   1.271 -16.100
  698    HA3  GLY  93           HA3      GLY  93  -0.143  -0.385 -15.721
  699    H    SER  94           H        SER  94  -1.792   1.803 -15.263
  700    HA   SER  94           HA       SER  94  -1.601   2.528 -12.410
  701    HB2  SER  94           HB2      SER  94  -1.973   4.279 -14.120
  702    HB3  SER  94           HB3      SER  94  -3.530   3.537 -14.529
  703    HG   SER  94           HG       SER  94  -2.864   4.274 -11.857
  704    H    LEU  95           H        LEU  95  -2.891   1.842 -10.842
  705    HA   LEU  95           HA       LEU  95  -5.146  -0.049 -11.445
  706    HB2  LEU  95           HB2      LEU  95  -3.086  -0.030  -9.227
  707    HB3  LEU  95           HB3      LEU  95  -4.442  -1.131  -9.278
  708    HG   LEU  95           HG       LEU  95  -2.064  -1.019 -11.182
  709   HD11  LEU  95          HD11      LEU  95  -1.420  -3.121 -10.053
  710   HD12  LEU  95          HD12      LEU  95  -1.491  -1.770  -8.916
  711   HD13  LEU  95          HD13      LEU  95  -2.809  -2.968  -8.952
  712   HD21  LEU  95          HD21      LEU  95  -4.493  -2.847 -10.996
  713   HD22  LEU  95          HD22      LEU  95  -3.963  -1.829 -12.344
  714   HD23  LEU  95          HD23      LEU  95  -3.014  -3.261 -11.874
  715    H    LEU  96           H        LEU  96  -6.847  -0.133 -10.000
  716    HA   LEU  96           HA       LEU  96  -7.258   2.298  -8.289
  717    HB2  LEU  96           HB2      LEU  96  -8.758   1.828 -10.330
  718    HB3  LEU  96           HB3      LEU  96  -9.331   0.415  -9.437
  719    HG   LEU  96           HG       LEU  96 -10.048   2.006  -7.592
  720   HD11  LEU  96          HD11      LEU  96  -8.727   3.980  -8.145
  721   HD12  LEU  96          HD12      LEU  96  -9.403   4.027  -9.794
  722   HD13  LEU  96          HD13      LEU  96 -10.429   4.387  -8.401
  723   HD21  LEU  96          HD21      LEU  96 -11.291   2.323 -10.358
  724   HD22  LEU  96          HD22      LEU  96 -11.647   1.036  -9.186
  725   HD23  LEU  96          HD23      LEU  96 -12.090   2.710  -8.822
  726    H    ILE  97           H        ILE  97  -7.026   1.910  -6.139
  727    HA   ILE  97           HA       ILE  97  -7.605  -0.831  -5.106
  728    HB   ILE  97           HB       ILE  97  -5.681   1.220  -3.958
  729   HG12  ILE  97          HG12      ILE  97  -4.077  -0.819  -4.794
  730   HG13  ILE  97          HG13      ILE  97  -5.317  -0.930  -6.033
  731   HG21  ILE  97          HG21      ILE  97  -6.075  -1.749  -3.360
  732   HG22  ILE  97          HG22      ILE  97  -4.850  -0.691  -2.638
  733   HG23  ILE  97          HG23      ILE  97  -6.555  -0.406  -2.297
  734   HD11  ILE  97          HD11      ILE  97  -3.617   1.509  -5.350
  735   HD12  ILE  97          HD12      ILE  97  -3.478   0.467  -6.781
  736   HD13  ILE  97          HD13      ILE  97  -4.890   1.507  -6.587
  737    H    CYS  98           H        CYS  98  -9.097  -1.114  -3.579
  738    HA   CYS  98           HA       CYS  98 -10.489   1.239  -2.427
  739    HB2  CYS  98           HB2      CYS  98 -12.073  -0.379  -1.520
  740    HB3  CYS  98           HB3      CYS  98 -11.916  -0.520  -3.269
  741    HG   CYS  98           HG       CYS  98 -10.169  -2.560  -3.156
  742    H    ALA  99           H        ALA  99  -9.993   2.101  -0.439
  743    HA   ALA  99           HA       ALA  99  -8.024   0.734   1.224
  744    HB1  ALA  99           HB1      ALA  99  -9.433   3.417   1.503
  745    HB2  ALA  99           HB2      ALA  99  -8.075   2.834   2.490
  746    HB3  ALA  99           HB3      ALA  99  -7.843   3.137   0.755
  747    H    THR 100           H        THR 100  -8.548  -0.612   2.721
  748    HA   THR 100           HA       THR 100 -11.186  -0.602   4.138
  749    HB   THR 100           HB       THR 100 -10.685  -3.139   4.142
  750    HG1  THR 100           HG1      THR 100  -9.158  -3.754   2.530
  751   HG21  THR 100          HG21      THR 100 -10.922  -1.929   1.353
  752   HG22  THR 100          HG22      THR 100 -11.549  -3.486   1.943
  753   HG23  THR 100          HG23      THR 100 -12.267  -1.978   2.517
  754    H    HIS 101           H        HIS 101  -7.940  -0.133   4.747
  755    HA   HIS 101           HA       HIS 101  -8.180  -0.692   7.624
  756    HB2  HIS 101           HB2      HIS 101  -5.799  -1.619   5.962
  757    HB3  HIS 101           HB3      HIS 101  -6.075  -1.891   7.673
  758    HD1  HIS 101           HD1      HIS 101  -6.809  -3.335   4.290
  759    HD2  HIS 101           HD2      HIS 101  -7.930  -3.873   8.309
  760    HE1  HIS 101           HE1      HIS 101  -8.076  -5.555   4.385
  761    H    VAL 102           H        VAL 102  -6.785   0.714   8.831
  762    HA   VAL 102           HA       VAL 102  -5.194   2.733   7.263
  763    HB   VAL 102           HB       VAL 102  -5.291   4.210   9.217
  764   HG11  VAL 102          HG11      VAL 102  -6.814   4.504   7.317
  765   HG12  VAL 102          HG12      VAL 102  -8.015   3.454   8.104
  766   HG13  VAL 102          HG13      VAL 102  -7.560   5.004   8.847
  767   HG21  VAL 102          HG21      VAL 102  -6.866   3.912  11.002
  768   HG22  VAL 102          HG22      VAL 102  -7.471   2.401  10.306
  769   HG23  VAL 102          HG23      VAL 102  -5.822   2.482  10.970
  770    H    GLY 103           H        GLY 103  -3.259   3.662   8.793
  771    HA2  GLY 103           HA2      GLY 103  -1.290   1.743   8.462
  772    HA3  GLY 103           HA3      GLY 103  -1.154   3.188   9.453
  773    H    ALA 104           H        ALA 104  -3.022   2.501  11.517
  774    HA   ALA 104           HA       ALA 104  -1.496   0.948  13.287
  775    HB1  ALA 104           HB1      ALA 104  -4.486   1.551  13.338
  776    HB2  ALA 104           HB2      ALA 104  -3.489   1.068  14.727
  777    HB3  ALA 104           HB3      ALA 104  -3.192   2.622  13.927
  778    H    ASP 105           H        ASP 105  -3.992  -0.266  11.005
  779    HA   ASP 105           HA       ASP 105  -4.023  -2.952  12.212
  780    HB2  ASP 105           HB2      ASP 105  -6.006  -2.044  11.138
  781    HB3  ASP 105           HB3      ASP 105  -5.137  -2.002   9.599
  782    H    THR 106           H        THR 106  -1.681  -1.342  10.235
  783    HA   THR 106           HA       THR 106  -1.301  -3.463   8.303
  784    HB   THR 106           HB       THR 106   0.778  -2.370   7.657
  785    HG1  THR 106           HG1      THR 106   0.224  -0.484   9.677
  786   HG21  THR 106          HG21      THR 106  -0.136  -0.156   6.993
  787   HG22  THR 106          HG22      THR 106  -1.224  -1.514   6.640
  788   HG23  THR 106          HG23      THR 106  -1.557  -0.461   8.023
  789    H    THR 107           H        THR 107   0.199  -5.069   8.105
  790    HA   THR 107           HA       THR 107   1.375  -6.204  10.486
  791    HB   THR 107           HB       THR 107   0.755  -7.466   8.396
  792    HG1  THR 107           HG1      THR 107   3.130  -8.517   8.696
  793   HG21  THR 107          HG21      THR 107   1.986  -6.092   6.721
  794   HG22  THR 107          HG22      THR 107   3.524  -6.679   7.408
  795   HG23  THR 107          HG23      THR 107   2.377  -7.809   6.661
  796    H    LEU 108           H        LEU 108   2.607  -3.960   8.035
  797    HA   LEU 108           HA       LEU 108   5.348  -3.889   8.641
  798    HB2  LEU 108           HB2      LEU 108   3.397  -1.636   7.923
  799    HB3  LEU 108           HB3      LEU 108   5.127  -1.415   8.067
  800    HG   LEU 108           HG       LEU 108   5.465  -3.068   6.181
  801   HD11  LEU 108          HD11      LEU 108   2.447  -2.761   5.900
  802   HD12  LEU 108          HD12      LEU 108   3.535  -3.291   4.604
  803   HD13  LEU 108          HD13      LEU 108   3.381  -4.278   6.057
  804   HD21  LEU 108          HD21      LEU 108   5.543  -0.618   5.964
  805   HD22  LEU 108          HD22      LEU 108   4.863  -1.362   4.507
  806   HD23  LEU 108          HD23      LEU 108   3.781  -0.589   5.695
  807    H    SER 109           H        SER 109   2.756  -1.932  10.145
  808    HA   SER 109           HA       SER 109   4.470  -0.780  12.182
  809    HB2  SER 109           HB2      SER 109   1.442  -0.877  11.929
  810    HB3  SER 109           HB3      SER 109   2.346   0.045  13.145
  811    HG   SER 109           HG       SER 109   2.136   0.460  10.372
  812    H    GLN 110           H        GLN 110   2.540  -3.694  11.942
  813    HA   GLN 110           HA       GLN 110   2.378  -4.207  14.772
  814    HB2  GLN 110           HB2      GLN 110   0.987  -5.222  12.805
  815    HB3  GLN 110           HB3      GLN 110   2.299  -6.373  12.651
  816    HG2  GLN 110           HG2      GLN 110   0.685  -7.385  14.022
  817    HG3  GLN 110           HG3      GLN 110   1.976  -6.913  15.133
  818   HE21  GLN 110          HE22      GLN 110  -1.173  -5.759  13.780
  819   HE22  GLN 110          HE21      GLN 110  -1.445  -4.617  15.084
  820    H    ILE 111           H        ILE 111   4.612  -5.309  12.274
  821    HA   ILE 111           HA       ILE 111   6.279  -7.039  13.793
  822    HB   ILE 111           HB       ILE 111   6.923  -5.204  11.453
  823   HG12  ILE 111          HG12      ILE 111   6.675  -8.239  11.398
  824   HG13  ILE 111          HG13      ILE 111   5.253  -7.225  11.256
  825   HG21  ILE 111          HG21      ILE 111   8.658  -7.413  12.655
  826   HG22  ILE 111          HG22      ILE 111   8.963  -6.628  11.095
  827   HG23  ILE 111          HG23      ILE 111   9.058  -5.684  12.572
  828   HD11  ILE 111          HD11      ILE 111   6.011  -7.811   9.040
  829   HD12  ILE 111          HD12      ILE 111   6.243  -6.070   9.281
  830   HD13  ILE 111          HD13      ILE 111   7.633  -7.180   9.357
  831    H    VAL 112           H        VAL 112   6.808  -3.521  13.192
  832    HA   VAL 112           HA       VAL 112   9.038  -3.377  14.947
  833    HB   VAL 112           HB       VAL 112   8.869  -0.949  14.794
  834   HG11  VAL 112          HG11      VAL 112   8.334  -2.326  12.126
  835   HG12  VAL 112          HG12      VAL 112   9.123  -0.755  12.371
  836   HG13  VAL 112          HG13      VAL 112   9.906  -2.230  12.950
  837   HG21  VAL 112          HG21      VAL 112   6.394  -0.673  14.842
  838   HG22  VAL 112          HG22      VAL 112   7.139   0.132  13.460
  839   HG23  VAL 112          HG23      VAL 112   6.304  -1.412  13.225
  840    H    LYS 113           H        LYS 113   5.639  -3.218  15.778
  841    HA   LYS 113           HA       LYS 113   6.125  -2.284  18.515
  842    HB2  LYS 113           HB2      LYS 113   3.765  -3.624  17.186
  843    HB3  LYS 113           HB3      LYS 113   3.810  -3.228  18.909
  844    HG2  LYS 113           HG2      LYS 113   4.205  -0.849  18.409
  845    HG3  LYS 113           HG3      LYS 113   4.160  -1.179  16.675
  846    HD2  LYS 113           HD2      LYS 113   1.851  -1.683  18.607
  847    HD3  LYS 113           HD3      LYS 113   2.012  -0.259  17.556
  848    HE2  LYS 113           HE2      LYS 113   2.054  -1.722  15.569
  849    HE3  LYS 113           HE3      LYS 113   1.913  -3.148  16.600
  850    HZ1  LYS 113           HZ1      LYS 113  -0.262  -2.436  17.284
  851    HZ2  LYS 113           HZ2      LYS 113  -0.139  -1.002  16.478
  852    HZ3  LYS 113           HZ3      LYS 113  -0.229  -2.421  15.646
  853    H    LEU 114           H        LEU 114   5.551  -5.533  17.036
  854    HA   LEU 114           HA       LEU 114   5.610  -6.949  19.493
  855    HB2  LEU 114           HB2      LEU 114   5.941  -7.607  16.551
  856    HB3  LEU 114           HB3      LEU 114   6.203  -8.863  17.753
  857    HG   LEU 114           HG       LEU 114   3.661  -7.261  17.382
  858   HD11  LEU 114          HD11      LEU 114   4.320 -10.134  16.615
  859   HD12  LEU 114          HD12      LEU 114   2.737  -9.348  16.443
  860   HD13  LEU 114          HD13      LEU 114   4.114  -8.770  15.492
  861   HD21  LEU 114          HD21      LEU 114   3.789  -8.050  19.695
  862   HD22  LEU 114          HD22      LEU 114   2.671  -9.107  18.833
  863   HD23  LEU 114          HD23      LEU 114   4.332  -9.656  19.164
  864    H    VAL 115           H        VAL 115   8.189  -6.277  17.180
  865    HA   VAL 115           HA       VAL 115  10.214  -7.848  18.569
  866    HB   VAL 115           HB       VAL 115  10.537  -5.606  16.540
  867   HG11  VAL 115          HG11      VAL 115  12.591  -7.594  17.622
  868   HG12  VAL 115          HG12      VAL 115  12.832  -6.542  16.213
  869   HG13  VAL 115          HG13      VAL 115  12.633  -5.825  17.811
  870   HG21  VAL 115          HG21      VAL 115  10.698  -8.644  16.264
  871   HG22  VAL 115          HG22      VAL 115   9.388  -7.622  15.646
  872   HG23  VAL 115          HG23      VAL 115  11.012  -7.465  14.970
  873    H    GLU 116           H        GLU 116   9.794  -4.268  18.438
  874    HA   GLU 116           HA       GLU 116  11.579  -3.551  20.380
  875    HB2  GLU 116           HB2      GLU 116  10.063  -2.092  18.943
  876    HB3  GLU 116           HB3      GLU 116   8.797  -2.348  20.135
  877    HG2  GLU 116           HG2      GLU 116  11.014  -1.458  21.658
  878    HG3  GLU 116           HG3      GLU 116  11.131  -0.547  20.156
  879    H    GLU 117           H        GLU 117   8.358  -4.921  21.097
  880    HA   GLU 117           HA       GLU 117   8.530  -4.416  23.984
  881    HB2  GLU 117           HB2      GLU 117   6.644  -6.000  22.213
  882    HB3  GLU 117           HB3      GLU 117   6.421  -5.805  23.950
  883    HG2  GLU 117           HG2      GLU 117   6.682  -3.345  22.156
  884    HG3  GLU 117           HG3      GLU 117   5.183  -4.230  22.249
  885    H    ALA 118           H        ALA 118   9.585  -6.934  21.816
  886    HA   ALA 118           HA       ALA 118   9.475  -9.105  23.689
  887    HB1  ALA 118           HB1      ALA 118   9.419  -9.440  21.269
  888    HB2  ALA 118           HB2      ALA 118  11.089  -8.842  21.125
  889    HB3  ALA 118           HB3      ALA 118  10.756 -10.342  22.008
  890    H    GLN 119           H        GLN 119  12.360  -7.132  22.665
  891    HA   GLN 119           HA       GLN 119  14.152  -8.075  24.578
  892    HB2  GLN 119           HB2      GLN 119  13.819  -5.360  23.241
  893    HB3  GLN 119           HB3      GLN 119  15.158  -5.734  24.285
  894    HG2  GLN 119           HG2      GLN 119  16.269  -6.425  22.488
  895    HG3  GLN 119           HG3      GLN 119  15.257  -7.883  22.575
  896   HE21  GLN 119          HE22      GLN 119  13.623  -8.178  21.106
  897   HE22  GLN 119          HE21      GLN 119  12.923  -6.808  20.262
  Start of MODEL   29
    1    H    SER   1           H        SER   1  18.656  -4.243  13.363
    2    HA   SER   1           HA       SER   1  16.174  -3.301  14.674
    3    HB2  SER   1           HB2      SER   1  19.041  -2.360  15.042
    4    HB3  SER   1           HB3      SER   1  17.634  -1.830  15.966
    5    HG   SER   1           HG       SER   1  17.353  -3.840  16.780
    6    H    GLU   2           H        GLU   2  18.583  -2.117  12.256
    7    HA   GLU   2           HA       GLU   2  17.198   0.357  11.703
    8    HB2  GLU   2           HB2      GLU   2  19.432   0.007  10.820
    9    HB3  GLU   2           HB3      GLU   2  18.903  -1.389   9.871
   10    HG2  GLU   2           HG2      GLU   2  17.451   0.015   8.493
   11    HG3  GLU   2           HG3      GLU   2  17.781   1.418   9.509
   12    H    ALA   3           H        ALA   3  16.775  -2.963  10.300
   13    HA   ALA   3           HA       ALA   3  14.655  -2.406   8.605
   14    HB1  ALA   3           HB1      ALA   3  14.954  -4.891  10.327
   15    HB2  ALA   3           HB2      ALA   3  14.077  -4.756   8.794
   16    HB3  ALA   3           HB3      ALA   3  15.843  -4.577   8.813
   17    H    LEU   4           H        LEU   4  14.489  -2.615  12.144
   18    HA   LEU   4           HA       LEU   4  11.584  -2.787  12.301
   19    HB2  LEU   4           HB2      LEU   4  13.214  -3.589  14.070
   20    HB3  LEU   4           HB3      LEU   4  13.605  -1.910  14.394
   21    HG   LEU   4           HG       LEU   4  11.174  -1.514  15.010
   22   HD11  LEU   4          HD11      LEU   4   9.873  -3.529  15.622
   23   HD12  LEU   4          HD12      LEU   4  10.217  -3.500  13.884
   24   HD13  LEU   4          HD13      LEU   4  11.165  -4.553  14.947
   25   HD21  LEU   4          HD21      LEU   4  11.419  -2.523  17.215
   26   HD22  LEU   4          HD22      LEU   4  12.709  -3.594  16.613
   27   HD23  LEU   4          HD23      LEU   4  12.959  -1.835  16.673
   28    H    ALA   5           H        ALA   5  13.858  -0.173  11.815
   29    HA   ALA   5           HA       ALA   5  11.867   1.937  12.382
   30    HB1  ALA   5           HB1      ALA   5  13.654   3.467  11.658
   31    HB2  ALA   5           HB2      ALA   5  14.183   2.432  12.996
   32    HB3  ALA   5           HB3      ALA   5  14.725   2.091  11.338
   33    H    LYS   6           H        LYS   6  13.621   0.365   9.607
   34    HA   LYS   6           HA       LYS   6  12.724   1.850   7.474
   35    HB2  LYS   6           HB2      LYS   6  14.484   0.125   7.512
   36    HB3  LYS   6           HB3      LYS   6  13.233  -1.132   7.615
   37    HG2  LYS   6           HG2      LYS   6  12.332  -0.504   5.452
   38    HG3  LYS   6           HG3      LYS   6  13.461   0.863   5.334
   39    HD2  LYS   6           HD2      LYS   6  15.368  -0.672   5.274
   40    HD3  LYS   6           HD3      LYS   6  14.297  -2.074   5.526
   41    HE2  LYS   6           HE2      LYS   6  13.117  -1.614   3.445
   42    HE3  LYS   6           HE3      LYS   6  14.029  -0.117   3.211
   43    HZ1  LYS   6           HZ1      LYS   6  15.950  -1.291   2.736
   44    HZ2  LYS   6           HZ2      LYS   6  15.438  -2.727   3.356
   45    HZ3  LYS   6           HZ3      LYS   6  14.784  -2.147   1.946
   46    H    LEU   7           H        LEU   7  11.008  -0.980   8.881
   47    HA   LEU   7           HA       LEU   7   8.878  -1.225   7.094
   48    HB2  LEU   7           HB2      LEU   7   9.275  -1.689  10.023
   49    HB3  LEU   7           HB3      LEU   7   7.614  -1.632   9.466
   50    HG   LEU   7           HG       LEU   7   8.511  -3.914   9.665
   51   HD11  LEU   7          HD11      LEU   7   7.633  -4.773   7.564
   52   HD12  LEU   7          HD12      LEU   7   6.632  -3.465   8.196
   53   HD13  LEU   7          HD13      LEU   7   7.745  -3.160   6.831
   54   HD21  LEU   7          HD21      LEU   7  10.784  -3.753   8.961
   55   HD22  LEU   7          HD22      LEU   7   9.958  -4.822   7.842
   56   HD23  LEU   7          HD23      LEU   7  10.328  -3.157   7.347
   57    H    ILE   8           H        ILE   8   8.984   1.128   9.816
   58    HA   ILE   8           HA       ILE   8   6.434   2.314   9.032
   59    HB   ILE   8           HB       ILE   8   8.529   3.151  11.047
   60   HG12  ILE   8          HG12      ILE   8   7.416   1.066  11.637
   61   HG13  ILE   8          HG13      ILE   8   6.941   2.356  12.717
   62   HG21  ILE   8          HG21      ILE   8   5.807   4.407  10.510
   63   HG22  ILE   8          HG22      ILE   8   6.746   4.644  11.999
   64   HG23  ILE   8          HG23      ILE   8   7.402   5.189  10.459
   65   HD11  ILE   8          HD11      ILE   8   5.245   1.163  10.476
   66   HD12  ILE   8          HD12      ILE   8   5.012   0.986  12.218
   67   HD13  ILE   8          HD13      ILE   8   4.760   2.563  11.466
   68    H    SER   9           H        SER   9   9.775   3.026   8.219
   69    HA   SER   9           HA       SER   9   9.168   5.713   7.172
   70    HB2  SER   9           HB2      SER   9  11.669   4.063   7.419
   71    HB3  SER   9           HB3      SER   9  11.614   5.439   6.306
   72    HG   SER   9           HG       SER   9  10.983   5.541   9.100
   73    H    LEU  10           H        LEU  10   9.394   2.467   5.782
   74    HA   LEU  10           HA       LEU  10   9.554   3.070   3.035
   75    HB2  LEU  10           HB2      LEU  10   8.177   0.917   4.679
   76    HB3  LEU  10           HB3      LEU  10   8.003   0.918   2.934
   77    HG   LEU  10           HG       LEU  10  10.754   0.909   4.216
   78   HD11  LEU  10          HD11      LEU  10  10.739  -1.541   3.818
   79   HD12  LEU  10          HD12      LEU  10   9.517  -1.076   5.012
   80   HD13  LEU  10          HD13      LEU  10   9.029  -1.460   3.348
   81   HD21  LEU  10          HD21      LEU  10   9.715   0.010   1.497
   82   HD22  LEU  10          HD22      LEU  10  10.602   1.516   1.807
   83   HD23  LEU  10          HD23      LEU  10  11.403  -0.042   2.041
   84    H    GLN  11           H        GLN  11   6.941   3.769   5.154
   85    HA   GLN  11           HA       GLN  11   4.794   3.692   3.221
   86    HB2  GLN  11           HB2      GLN  11   4.931   4.772   6.023
   87    HB3  GLN  11           HB3      GLN  11   3.459   4.724   5.031
   88    HG2  GLN  11           HG2      GLN  11   3.721   2.270   4.741
   89    HG3  GLN  11           HG3      GLN  11   5.162   2.298   5.775
   90   HE21  GLN  11          HE22      GLN  11   4.727   3.497   7.995
   91   HE22  GLN  11          HE21      GLN  11   3.156   3.112   8.711
   92    H    ALA  12           H        ALA  12   3.752   5.237   2.148
   93    HA   ALA  12           HA       ALA  12   5.008   7.692   1.419
   94    HB1  ALA  12           HB1      ALA  12   2.154   6.683   1.094
   95    HB2  ALA  12           HB2      ALA  12   2.833   8.081   0.253
   96    HB3  ALA  12           HB3      ALA  12   3.492   6.460  -0.061
   97    H    THR  13           H        THR  13   4.359   9.850   1.772
   98    HA   THR  13           HA       THR  13   3.163  10.480   4.405
   99    HB   THR  13           HB       THR  13   3.840  12.866   3.484
  100    HG1  THR  13           HG1      THR  13   4.441  12.241   1.369
  101   HG21  THR  13          HG21      THR  13   5.879  10.725   4.208
  102   HG22  THR  13          HG22      THR  13   6.131  12.483   4.344
  103   HG23  THR  13          HG23      THR  13   4.923  11.679   5.366
  104    H    GLU  14           H        GLU  14   2.140  10.273   1.200
  105    HA   GLU  14           HA       GLU  14  -0.436  11.641   1.749
  106    HB2  GLU  14           HB2      GLU  14  -0.327  12.761  -0.409
  107    HB3  GLU  14           HB3      GLU  14   0.982  13.280   0.635
  108    HG2  GLU  14           HG2      GLU  14   1.240  11.215  -1.602
  109    HG3  GLU  14           HG3      GLU  14   1.644  12.922  -1.763
  110    H    ALA  15           H        ALA  15  -2.077  11.252   0.170
  111    HA   ALA  15           HA       ALA  15  -1.788   8.864  -1.559
  112    HB1  ALA  15           HB1      ALA  15  -4.006   9.217   0.503
  113    HB2  ALA  15           HB2      ALA  15  -3.887   7.903  -0.694
  114    HB3  ALA  15           HB3      ALA  15  -2.676   8.047   0.600
  115    H    THR  16           H        THR  16  -3.449   8.701  -3.137
  116    HA   THR  16           HA       THR  16  -4.966  11.237  -3.747
  117    HB   THR  16           HB       THR  16  -3.998   9.133  -5.710
  118    HG1  THR  16           HG1      THR  16  -2.388  10.569  -4.853
  119   HG21  THR  16          HG21      THR  16  -4.731  10.794  -7.413
  120   HG22  THR  16          HG22      THR  16  -6.101  10.217  -6.463
  121   HG23  THR  16          HG23      THR  16  -5.409  11.816  -6.120
  122    H    ILE  17           H        ILE  17  -7.000  11.026  -3.074
  123    HA   ILE  17           HA       ILE  17  -8.401   8.397  -3.119
  124    HB   ILE  17           HB       ILE  17  -9.291  11.127  -2.119
  125   HG12  ILE  17          HG12      ILE  17  -8.507   8.585  -0.625
  126   HG13  ILE  17          HG13      ILE  17  -7.549  10.057  -0.719
  127   HG21  ILE  17          HG21      ILE  17 -10.739   8.440  -1.959
  128   HG22  ILE  17          HG22      ILE  17 -11.288   9.970  -1.237
  129   HG23  ILE  17          HG23      ILE  17 -11.225   9.821  -2.972
  130   HD11  ILE  17          HD11      ILE  17 -10.219   9.740   0.698
  131   HD12  ILE  17          HD12      ILE  17  -8.631   9.968   1.428
  132   HD13  ILE  17          HD13      ILE  17  -9.368  11.285   0.484
  133    H    VAL  18           H        VAL  18  -9.825   7.848  -4.701
  134    HA   VAL  18           HA       VAL  18 -10.555   9.932  -6.730
  135    HB   VAL  18           HB       VAL  18  -9.700   7.098  -7.391
  136   HG11  VAL  18          HG11      VAL  18 -10.631   9.425  -9.140
  137   HG12  VAL  18          HG12      VAL  18  -9.891   7.935  -9.749
  138   HG13  VAL  18          HG13      VAL  18 -11.448   7.861  -8.931
  139   HG21  VAL  18          HG21      VAL  18  -7.728   8.318  -6.894
  140   HG22  VAL  18          HG22      VAL  18  -7.886   8.446  -8.658
  141   HG23  VAL  18          HG23      VAL  18  -8.347   9.801  -7.620
  142    H    THR  19           H        THR  19 -12.579  10.249  -6.833
  143    HA   THR  19           HA       THR  19 -14.542   8.095  -6.170
  144    HB   THR  19           HB       THR  19 -14.567  10.994  -5.260
  145    HG1  THR  19           HG1      THR  19 -13.889  10.317  -3.406
  146   HG21  THR  19          HG21      THR  19 -16.423   8.666  -4.597
  147   HG22  THR  19          HG22      THR  19 -16.400  10.226  -3.745
  148   HG23  THR  19          HG23      THR  19 -16.851  10.170  -5.451
  149    H    LEU  20           H        LEU  20 -16.445   8.133  -7.274
  150    HA   LEU  20           HA       LEU  20 -16.477   9.839  -9.708
  151    HB2  LEU  20           HB2      LEU  20 -17.887   7.187  -9.279
  152    HB3  LEU  20           HB3      LEU  20 -17.683   8.067 -10.791
  153    HG   LEU  20           HG       LEU  20 -15.440   6.777  -9.152
  154   HD11  LEU  20          HD11      LEU  20 -16.527   5.959 -11.862
  155   HD12  LEU  20          HD12      LEU  20 -15.218   5.193 -10.952
  156   HD13  LEU  20          HD13      LEU  20 -16.861   5.139 -10.317
  157   HD21  LEU  20          HD21      LEU  20 -14.564   8.723 -10.350
  158   HD22  LEU  20          HD22      LEU  20 -14.010   7.240 -11.125
  159   HD23  LEU  20          HD23      LEU  20 -15.339   8.171 -11.852
  160    H    ASP  21           H        ASP  21 -18.022  11.355  -9.966
  161    HA   ASP  21           HA       ASP  21 -20.003  11.553  -7.743
  162    HB2  ASP  21           HB2      ASP  21 -17.952  13.346  -8.656
  163    HB3  ASP  21           HB3      ASP  21 -19.492  14.112  -8.937
  164    H    SER  22           H        SER  22 -20.445  10.501 -10.598
  165    HA   SER  22           HA       SER  22 -23.106  11.841 -10.920
  166    HB2  SER  22           HB2      SER  22 -21.233  11.223 -13.226
  167    HB3  SER  22           HB3      SER  22 -22.963  11.538 -13.411
  168    HG   SER  22           HG       SER  22 -21.607  13.353 -13.759
  169    H    ASP  23           H        ASP  23 -22.083   9.452 -13.144
  170    HA   ASP  23           HA       ASP  23 -23.334   7.182 -11.692
  171    HB2  ASP  23           HB2      ASP  23 -24.962   8.397 -13.184
  172    HB3  ASP  23           HB3      ASP  23 -23.898   8.108 -14.554
  173    H    ASN  24           H        ASN  24 -20.793   7.237 -11.482
  174    HA   ASN  24           HA       ASN  24 -18.740   6.557 -11.894
  175    HB2  ASN  24           HB2      ASN  24 -19.904   4.679 -13.963
  176    HB3  ASN  24           HB3      ASN  24 -18.301   4.585 -13.266
  177   HD21  ASN  24          HD22      ASN  24 -21.515   3.668 -12.799
  178   HD22  ASN  24          HD21      ASN  24 -21.093   2.832 -11.293
  179    H    ILE  25           H        ILE  25 -20.345   7.745 -14.754
  180    HA   ILE  25           HA       ILE  25 -18.109   7.886 -16.458
  181    HB   ILE  25           HB       ILE  25 -19.502   9.323 -17.854
  182   HG12  ILE  25          HG12      ILE  25 -21.490   9.368 -15.534
  183   HG13  ILE  25          HG13      ILE  25 -20.507  10.737 -16.059
  184   HG21  ILE  25          HG21      ILE  25 -21.155   7.076 -16.604
  185   HG22  ILE  25          HG22      ILE  25 -21.218   7.675 -18.275
  186   HG23  ILE  25          HG23      ILE  25 -19.786   6.820 -17.698
  187   HD11  ILE  25          HD11      ILE  25 -22.685   9.371 -17.688
  188   HD12  ILE  25          HD12      ILE  25 -22.738  10.976 -16.948
  189   HD13  ILE  25          HD13      ILE  25 -21.620  10.665 -18.291
  190    H    LEU  26           H        LEU  26 -18.431   9.775 -13.760
  191    HA   LEU  26           HA       LEU  26 -16.785  12.043 -14.830
  192    HB2  LEU  26           HB2      LEU  26 -19.014  12.742 -14.315
  193    HB3  LEU  26           HB3      LEU  26 -18.941  12.046 -12.701
  194    HG   LEU  26           HG       LEU  26 -16.712  13.952 -13.284
  195   HD11  LEU  26          HD11      LEU  26 -19.586  14.927 -13.113
  196   HD12  LEU  26          HD12      LEU  26 -18.119  15.946 -13.070
  197   HD13  LEU  26          HD13      LEU  26 -18.514  15.025 -14.533
  198   HD21  LEU  26          HD21      LEU  26 -17.129  13.061 -11.028
  199   HD22  LEU  26          HD22      LEU  26 -17.310  14.818 -11.077
  200   HD23  LEU  26          HD23      LEU  26 -18.758  13.785 -11.066
  201    H    LEU  27           H        LEU  27 -14.882  12.194 -13.977
  202    HA   LEU  27           HA       LEU  27 -14.108  10.605 -11.541
  203    HB2  LEU  27           HB2      LEU  27 -12.539  11.469 -13.978
  204    HB3  LEU  27           HB3      LEU  27 -11.729  11.143 -12.451
  205    HG   LEU  27           HG       LEU  27 -12.655   8.843 -12.435
  206   HD11  LEU  27          HD11      LEU  27 -13.490   7.900 -14.590
  207   HD12  LEU  27          HD12      LEU  27 -14.629   9.048 -13.888
  208   HD13  LEU  27          HD13      LEU  27 -13.604   9.546 -15.251
  209   HD21  LEU  27          HD21      LEU  27 -10.406   9.359 -13.311
  210   HD22  LEU  27          HD22      LEU  27 -11.140   7.998 -14.165
  211   HD23  LEU  27          HD23      LEU  27 -11.085   9.600 -14.934
  212    H    SER  28           H        SER  28 -13.562  11.574  -9.714
  213    HA   SER  28           HA       SER  28 -12.738  14.454  -9.689
  214    HB2  SER  28           HB2      SER  28 -15.196  14.087  -9.310
  215    HB3  SER  28           HB3      SER  28 -14.804  13.133  -7.875
  216    HG   SER  28           HG       SER  28 -15.313  15.409  -7.572
  217    H    GLU  29           H        GLU  29 -10.537  14.050  -9.148
  218    HA   GLU  29           HA       GLU  29  -9.977  12.232  -6.900
  219    HB2  GLU  29           HB2      GLU  29  -7.903  13.828  -8.393
  220    HB3  GLU  29           HB3      GLU  29  -7.706  12.422  -7.371
  221    HG2  GLU  29           HG2      GLU  29  -7.470  11.359  -9.320
  222    HG3  GLU  29           HG3      GLU  29  -9.224  11.235  -9.190
  223    H    GLU  30           H        GLU  30  -8.968  12.735  -5.043
  224    HA   GLU  30           HA       GLU  30  -8.431  15.604  -4.331
  225    HB2  GLU  30           HB2      GLU  30  -9.164  13.459  -2.319
  226    HB3  GLU  30           HB3      GLU  30  -9.041  15.190  -2.060
  227    HG2  GLU  30           HG2      GLU  30 -11.185  13.703  -3.619
  228    HG3  GLU  30           HG3      GLU  30 -11.359  14.452  -2.037
  229    H    GLN  31           H        GLN  31  -6.438  16.059  -3.334
  230    HA   GLN  31           HA       GLN  31  -4.500  13.808  -2.958
  231    HB2  GLN  31           HB2      GLN  31  -4.039  16.773  -3.275
  232    HB3  GLN  31           HB3      GLN  31  -2.836  15.541  -2.883
  233    HG2  GLN  31           HG2      GLN  31  -3.797  14.306  -5.044
  234    HG3  GLN  31           HG3      GLN  31  -4.390  15.920  -5.468
  235   HE21  GLN  31          HE21      GLN  31  -1.441  14.177  -4.361
  236   HE22  GLN  31          HE22      GLN  31  -0.329  15.279  -5.139
  237    H    VAL  32           H        VAL  32  -4.162  13.171  -0.910
  238    HA   VAL  32           HA       VAL  32  -4.848  14.963   1.386
  239    HB   VAL  32           HB       VAL  32  -6.001  13.188   2.511
  240   HG11  VAL  32          HG11      VAL  32  -7.178  13.334  -0.291
  241   HG12  VAL  32          HG12      VAL  32  -8.022  13.059   1.248
  242   HG13  VAL  32          HG13      VAL  32  -7.297  14.634   0.917
  243   HG21  VAL  32          HG21      VAL  32  -4.819  11.209   1.642
  244   HG22  VAL  32          HG22      VAL  32  -6.561  11.048   1.464
  245   HG23  VAL  32          HG23      VAL  32  -5.568  11.449   0.045
  246    H    ASP  33           H        ASP  33  -4.067  14.192   3.458
  247    HA   ASP  33           HA       ASP  33  -1.344  13.073   3.354
  248    HB2  ASP  33           HB2      ASP  33  -1.994  14.966   4.869
  249    HB3  ASP  33           HB3      ASP  33  -2.903  13.796   5.822
  250    H    VAL  34           H        VAL  34  -0.657  11.156   4.409
  251    HA   VAL  34           HA       VAL  34  -2.383   8.874   4.166
  252    HB   VAL  34           HB       VAL  34   0.084   8.840   3.966
  253   HG11  VAL  34          HG11      VAL  34   0.108   8.859   7.016
  254   HG12  VAL  34          HG12      VAL  34   1.492   8.605   5.945
  255   HG13  VAL  34          HG13      VAL  34   0.679  10.176   5.968
  256   HG21  VAL  34          HG21      VAL  34  -1.282   6.764   4.236
  257   HG22  VAL  34          HG22      VAL  34   0.380   6.618   4.836
  258   HG23  VAL  34          HG23      VAL  34  -0.961   6.814   5.978
  259    H    GLU  35           H        GLU  35  -1.868  11.037   6.895
  260    HA   GLU  35           HA       GLU  35  -3.184   9.420   8.915
  261    HB2  GLU  35           HB2      GLU  35  -1.692  11.286   9.397
  262    HB3  GLU  35           HB3      GLU  35  -2.781  12.425   8.582
  263    HG2  GLU  35           HG2      GLU  35  -4.512  11.982  10.303
  264    HG3  GLU  35           HG3      GLU  35  -3.421  10.842  11.104
  265    H    LEU  36           H        LEU  36  -4.393  11.412   6.276
  266    HA   LEU  36           HA       LEU  36  -7.074  11.712   7.485
  267    HB2  LEU  36           HB2      LEU  36  -5.828  13.003   5.036
  268    HB3  LEU  36           HB3      LEU  36  -7.357  13.449   5.790
  269    HG   LEU  36           HG       LEU  36  -4.607  13.721   7.083
  270   HD11  LEU  36          HD11      LEU  36  -5.004  15.310   5.238
  271   HD12  LEU  36          HD12      LEU  36  -6.522  15.824   6.009
  272   HD13  LEU  36          HD13      LEU  36  -4.963  16.119   6.810
  273   HD21  LEU  36          HD21      LEU  36  -5.744  15.041   8.796
  274   HD22  LEU  36          HD22      LEU  36  -7.320  14.588   8.098
  275   HD23  LEU  36          HD23      LEU  36  -6.247  13.351   8.808
  276    H    VAL  37           H        VAL  37  -5.660   9.559   5.316
  277    HA   VAL  37           HA       VAL  37  -8.153   9.049   3.800
  278    HB   VAL  37           HB       VAL  37  -6.117   8.752   2.588
  279   HG11  VAL  37          HG11      VAL  37  -5.323   6.613   4.604
  280   HG12  VAL  37          HG12      VAL  37  -4.498   6.964   3.068
  281   HG13  VAL  37          HG13      VAL  37  -4.534   8.185   4.337
  282   HG21  VAL  37          HG21      VAL  37  -6.433   6.525   1.708
  283   HG22  VAL  37          HG22      VAL  37  -7.351   6.025   3.134
  284   HG23  VAL  37          HG23      VAL  37  -8.009   7.273   2.048
  285    H    GLN  38           H        GLN  38  -9.547   7.390   4.135
  286    HA   GLN  38           HA       GLN  38  -9.443   6.054   6.813
  287    HB2  GLN  38           HB2      GLN  38 -11.831   7.252   5.344
  288    HB3  GLN  38           HB3      GLN  38 -11.861   6.459   6.908
  289    HG2  GLN  38           HG2      GLN  38 -10.638   8.237   7.956
  290    HG3  GLN  38           HG3      GLN  38 -10.219   8.938   6.395
  291   HE21  GLN  38          HE22      GLN  38 -12.969   8.333   8.533
  292   HE22  GLN  38          HE21      GLN  38 -14.033   9.382   7.570
  293    H    ARG  39           H        ARG  39 -10.782   4.185   7.046
  294    HA   ARG  39           HA       ARG  39 -10.311   2.366   4.836
  295    HB2  ARG  39           HB2      ARG  39 -10.665   0.584   6.265
  296    HB3  ARG  39           HB3      ARG  39  -9.861   1.829   7.220
  297    HG2  ARG  39           HG2      ARG  39 -12.258   2.457   8.001
  298    HG3  ARG  39           HG3      ARG  39 -12.761   0.921   7.291
  299    HD2  ARG  39           HD2      ARG  39 -11.147  -0.278   8.741
  300    HD3  ARG  39           HD3      ARG  39 -10.641   1.266   9.449
  301    HE   ARG  39           HE       ARG  39 -12.952   1.584  10.284
  302   HH11  ARG  39          HH11      ARG  39 -12.123  -1.805   9.606
  303   HH12  ARG  39          HH12      ARG  39 -13.582  -2.328  10.408
  304   HH21  ARG  39          HH21      ARG  39 -14.572   0.869  11.279
  305   HH22  ARG  39          HH22      ARG  39 -14.921  -0.840  11.481
  306    H    GLY  40           H        GLY  40 -12.560   4.358   4.658
  307    HA2  GLY  40           HA2      GLY  40 -14.476   2.548   3.220
  308    HA3  GLY  40           HA3      GLY  40 -14.950   4.085   3.945
  309    H    ASP  41           H        ASP  41 -11.913   4.701   2.726
  310    HA   ASP  41           HA       ASP  41 -13.001   6.037   0.340
  311    HB2  ASP  41           HB2      ASP  41 -10.225   6.045   1.575
  312    HB3  ASP  41           HB3      ASP  41 -10.736   7.023   0.204
  313    H    ILE  42           H        ILE  42 -12.084   5.826  -1.776
  314    HA   ILE  42           HA       ILE  42 -10.510   3.351  -2.301
  315    HB   ILE  42           HB       ILE  42 -12.654   4.480  -4.121
  316   HG12  ILE  42          HG12      ILE  42 -12.448   1.969  -2.405
  317   HG13  ILE  42          HG13      ILE  42 -13.637   3.256  -2.271
  318   HG21  ILE  42          HG21      ILE  42 -10.786   2.097  -4.519
  319   HG22  ILE  42          HG22      ILE  42 -12.053   2.647  -5.640
  320   HG23  ILE  42          HG23      ILE  42 -10.645   3.654  -5.362
  321   HD11  ILE  42          HD11      ILE  42 -14.593   2.589  -4.479
  322   HD12  ILE  42          HD12      ILE  42 -13.452   1.216  -4.517
  323   HD13  ILE  42          HD13      ILE  42 -14.665   1.310  -3.242
  324    H    ILE  43           H        ILE  43  -8.648   3.643  -3.110
  325    HA   ILE  43           HA       ILE  43  -7.679   6.301  -3.751
  326    HB   ILE  43           HB       ILE  43  -6.157   3.759  -3.086
  327   HG12  ILE  43          HG12      ILE  43  -7.740   3.829  -1.287
  328   HG13  ILE  43          HG13      ILE  43  -6.186   4.327  -0.682
  329   HG21  ILE  43          HG21      ILE  43  -4.527   5.267  -1.966
  330   HG22  ILE  43          HG22      ILE  43  -4.652   5.568  -3.683
  331   HG23  ILE  43          HG23      ILE  43  -5.451   6.664  -2.534
  332   HD11  ILE  43          HD11      ILE  43  -8.083   5.662   0.201
  333   HD12  ILE  43          HD12      ILE  43  -6.876   6.674  -0.629
  334   HD13  ILE  43          HD13      ILE  43  -8.419   6.284  -1.410
  335    H    LYS  44           H        LYS  44  -5.558   6.116  -5.113
  336    HA   LYS  44           HA       LYS  44  -5.761   4.367  -7.457
  337    HB2  LYS  44           HB2      LYS  44  -6.999   6.313  -8.165
  338    HB3  LYS  44           HB3      LYS  44  -5.574   7.342  -7.880
  339    HG2  LYS  44           HG2      LYS  44  -4.297   6.129  -9.550
  340    HG3  LYS  44           HG3      LYS  44  -5.547   4.884  -9.708
  341    HD2  LYS  44           HD2      LYS  44  -5.992   7.809 -10.372
  342    HD3  LYS  44           HD3      LYS  44  -5.449   6.585 -11.538
  343    HE2  LYS  44           HE2      LYS  44  -7.514   5.237 -10.980
  344    HE3  LYS  44           HE3      LYS  44  -8.093   6.597 -10.011
  345    HZ1  LYS  44           HZ1      LYS  44  -8.032   7.947 -12.063
  346    HZ2  LYS  44           HZ2      LYS  44  -7.553   6.615 -12.926
  347    HZ3  LYS  44           HZ3      LYS  44  -9.039   6.659 -12.201
  348    H    VAL  45           H        VAL  45  -3.759   3.576  -7.909
  349    HA   VAL  45           HA       VAL  45  -1.394   4.940  -6.712
  350    HB   VAL  45           HB       VAL  45  -2.166   2.664  -5.889
  351   HG11  VAL  45          HG11      VAL  45  -0.914   1.639  -8.466
  352   HG12  VAL  45          HG12      VAL  45  -1.514   0.681  -7.106
  353   HG13  VAL  45          HG13      VAL  45  -2.648   1.635  -8.080
  354   HG21  VAL  45          HG21      VAL  45   0.078   3.554  -5.405
  355   HG22  VAL  45          HG22      VAL  45   0.162   1.812  -5.695
  356   HG23  VAL  45          HG23      VAL  45   0.688   2.942  -6.959
  357    H    VAL  46           H        VAL  46   0.237   5.645  -7.975
  358    HA   VAL  46           HA       VAL  46  -0.277   5.631 -10.841
  359    HB   VAL  46           HB       VAL  46   1.272   7.432 -11.012
  360   HG11  VAL  46          HG11      VAL  46  -0.987   7.904 -10.108
  361   HG12  VAL  46          HG12      VAL  46  -0.319   7.830  -8.459
  362   HG13  VAL  46          HG13      VAL  46   0.244   9.066  -9.595
  363   HG21  VAL  46          HG21      VAL  46   2.064   6.995  -8.116
  364   HG22  VAL  46          HG22      VAL  46   3.092   6.690  -9.533
  365   HG23  VAL  46          HG23      VAL  46   2.565   8.333  -9.160
  366    HA   PRO  47           HA       PRO  47   3.053   3.040 -12.335
  367    HB2  PRO  47           HB2      PRO  47   3.972   5.329 -14.069
  368    HB3  PRO  47           HB3      PRO  47   3.646   3.634 -14.526
  369    HG2  PRO  47           HG2      PRO  47   1.849   5.568 -15.131
  370    HG3  PRO  47           HG3      PRO  47   1.258   4.016 -14.440
  371    HD2  PRO  47           HD2      PRO  47   1.845   6.610 -12.980
  372    HD3  PRO  47           HD3      PRO  47   0.355   5.622 -12.927
  373    H    GLY  48           H        GLY  48   5.046   2.601 -11.340
  374    HA2  GLY  48           HA2      GLY  48   6.943   2.930 -10.114
  375    HA3  GLY  48           HA3      GLY  48   7.031   4.599 -10.687
  376    H    GLY  49           H        GLY  49   3.987   4.107  -9.228
  377    HA2  GLY  49           HA2      GLY  49   4.550   5.706  -6.936
  378    HA3  GLY  49           HA3      GLY  49   3.036   4.902  -7.336
  379    H    LYS  50           H        LYS  50   3.688   5.165  -4.753
  380    HA   LYS  50           HA       LYS  50   4.510   2.425  -3.843
  381    HB2  LYS  50           HB2      LYS  50   5.122   5.068  -2.466
  382    HB3  LYS  50           HB3      LYS  50   5.568   3.450  -1.894
  383    HG2  LYS  50           HG2      LYS  50   6.977   3.118  -3.904
  384    HG3  LYS  50           HG3      LYS  50   6.535   4.723  -4.489
  385    HD2  LYS  50           HD2      LYS  50   7.525   5.710  -2.409
  386    HD3  LYS  50           HD3      LYS  50   8.148   4.108  -1.983
  387    HE2  LYS  50           HE2      LYS  50   9.525   4.023  -3.982
  388    HE3  LYS  50           HE3      LYS  50   8.727   5.453  -4.660
  389    HZ1  LYS  50           HZ1      LYS  50   9.693   6.790  -2.908
  390    HZ2  LYS  50           HZ2      LYS  50  10.399   5.494  -2.208
  391    HZ3  LYS  50           HZ3      LYS  50  10.900   5.992  -3.693
  392    H    PHE  51           H        PHE  51   3.341   1.460  -2.285
  393    HA   PHE  51           HA       PHE  51   0.607   2.378  -2.093
  394    HB2  PHE  51           HB2      PHE  51   1.995  -0.075  -1.027
  395    HB3  PHE  51           HB3      PHE  51   0.290   0.252  -0.749
  396    HD1  PHE  51           HD2      PHE  51  -1.330   0.374  -2.664
  397    HD2  PHE  51           HD1      PHE  51   2.758  -0.852  -3.213
  398    HE1  PHE  51           HE2      PHE  51  -1.892  -0.577  -4.886
  399    HE2  PHE  51           HE1      PHE  51   2.192  -1.810  -5.412
  400    HZ   PHE  51           HZ       PHE  51  -0.138  -1.664  -6.273
  401    HA   PRO  52           HA       PRO  52   1.217   4.442   1.854
  402    HB2  PRO  52           HB2      PRO  52  -1.165   5.723   2.100
  403    HB3  PRO  52           HB3      PRO  52   0.002   6.137   0.814
  404    HG2  PRO  52           HG2      PRO  52  -2.439   4.365   0.598
  405    HG3  PRO  52           HG3      PRO  52  -1.917   5.681  -0.497
  406    HD2  PRO  52           HD2      PRO  52  -1.374   3.021  -0.971
  407    HD3  PRO  52           HD3      PRO  52  -0.290   4.345  -1.486
  408    H    VAL  53           H        VAL  53  -1.242   1.997   1.467
  409    HA   VAL  53           HA       VAL  53  -1.357   1.298   4.269
  410    HB   VAL  53           HB       VAL  53  -3.827   1.281   4.406
  411   HG11  VAL  53          HG11      VAL  53  -2.734   4.106   4.132
  412   HG12  VAL  53          HG12      VAL  53  -4.087   3.550   5.138
  413   HG13  VAL  53          HG13      VAL  53  -2.432   3.038   5.512
  414   HG21  VAL  53          HG21      VAL  53  -5.173   2.737   3.023
  415   HG22  VAL  53          HG22      VAL  53  -3.754   3.250   2.095
  416   HG23  VAL  53          HG23      VAL  53  -4.337   1.569   1.976
  417    H    ASP  54           H        ASP  54  -2.968  -0.768   4.393
  418    HA   ASP  54           HA       ASP  54  -2.388  -2.363   1.939
  419    HB2  ASP  54           HB2      ASP  54  -2.009  -4.254   3.106
  420    HB3  ASP  54           HB3      ASP  54  -1.177  -3.030   4.051
  421    H    GLY  55           H        GLY  55  -3.888  -3.660   0.972
  422    HA2  GLY  55           HA2      GLY  55  -6.619  -3.962   1.784
  423    HA3  GLY  55           HA3      GLY  55  -6.471  -2.463   0.875
  424    H    ARG  56           H        ARG  56  -7.849  -3.291  -0.686
  425    HA   ARG  56           HA       ARG  56  -6.759  -5.478  -2.440
  426    HB2  ARG  56           HB2      ARG  56  -8.869  -5.904  -0.955
  427    HB3  ARG  56           HB3      ARG  56  -9.737  -5.047  -2.234
  428    HG2  ARG  56           HG2      ARG  56  -8.845  -6.671  -3.907
  429    HG3  ARG  56           HG3      ARG  56  -7.933  -7.481  -2.629
  430    HD2  ARG  56           HD2      ARG  56 -10.938  -7.384  -2.938
  431    HD3  ARG  56           HD3      ARG  56  -9.869  -8.779  -3.156
  432    HE   ARG  56           HE       ARG  56 -10.692  -7.516  -0.595
  433   HH11  ARG  56          HH11      ARG  56  -9.130 -10.353  -2.036
  434   HH12  ARG  56          HH12      ARG  56  -9.011 -11.093  -0.463
  435   HH21  ARG  56          HH21      ARG  56 -10.351  -8.455   1.235
  436   HH22  ARG  56          HH22      ARG  56  -9.410  -9.954   1.361
  437    H    VAL  57           H        VAL  57  -6.900  -5.451  -4.579
  438    HA   VAL  57           HA       VAL  57  -7.211  -2.882  -6.024
  439    HB   VAL  57           HB       VAL  57  -6.163  -5.610  -6.926
  440   HG11  VAL  57          HG11      VAL  57  -6.051  -2.877  -8.270
  441   HG12  VAL  57          HG12      VAL  57  -5.185  -4.330  -8.831
  442   HG13  VAL  57          HG13      VAL  57  -6.938  -4.311  -8.839
  443   HG21  VAL  57          HG21      VAL  57  -4.652  -4.587  -5.218
  444   HG22  VAL  57          HG22      VAL  57  -3.924  -4.777  -6.814
  445   HG23  VAL  57          HG23      VAL  57  -4.474  -3.184  -6.296
  446    H    ILE  58           H        ILE  58  -9.031  -2.589  -7.309
  447    HA   ILE  58           HA       ILE  58 -10.305  -5.003  -8.505
  448    HB   ILE  58           HB       ILE  58 -12.600  -4.033  -8.075
  449   HG12  ILE  58          HG12      ILE  58 -11.196  -2.679  -5.756
  450   HG13  ILE  58          HG13      ILE  58 -11.598  -1.796  -7.248
  451   HG21  ILE  58          HG21      ILE  58 -11.139  -5.054  -5.614
  452   HG22  ILE  58          HG22      ILE  58 -12.862  -5.201  -5.999
  453   HG23  ILE  58          HG23      ILE  58 -11.673  -6.073  -6.966
  454   HD11  ILE  58          HD11      ILE  58 -14.012  -2.444  -6.955
  455   HD12  ILE  58          HD12      ILE  58 -13.598  -3.076  -5.343
  456   HD13  ILE  58          HD13      ILE  58 -13.385  -1.352  -5.719
  457    H    GLU  59           H        GLU  59  -8.534  -2.945  -9.606
  458    HA   GLU  59           HA       GLU  59  -9.894  -3.015 -12.152
  459    HB2  GLU  59           HB2      GLU  59 -10.587  -0.754 -10.906
  460    HB3  GLU  59           HB3      GLU  59  -8.982  -0.237 -11.385
  461    HG2  GLU  59           HG2      GLU  59  -9.490  -0.612 -13.734
  462    HG3  GLU  59           HG3      GLU  59 -11.021  -1.393 -13.330
  463    H    GLY  60           H        GLY  60  -8.365  -3.290 -13.767
  464    HA2  GLY  60           HA2      GLY  60  -6.531  -2.563 -15.001
  465    HA3  GLY  60           HA3      GLY  60  -5.816  -1.862 -13.568
  466    H    HIS  61           H        HIS  61  -3.970  -2.691 -14.534
  467    HA   HIS  61           HA       HIS  61  -3.174  -5.432 -13.663
  468    HB2  HIS  61           HB2      HIS  61  -2.241  -5.929 -15.940
  469    HB3  HIS  61           HB3      HIS  61  -3.984  -5.966 -15.802
  470    HD1  HIS  61           HD1      HIS  61  -5.358  -4.281 -17.351
  471    HD2  HIS  61           HD2      HIS  61  -1.161  -3.908 -17.447
  472    HE1  HIS  61           HE1      HIS  61  -4.807  -2.748 -19.321
  473    H    SER  62           H        SER  62  -1.431  -5.106 -12.443
  474    HA   SER  62           HA       SER  62   0.899  -3.879 -13.677
  475    HB2  SER  62           HB2      SER  62  -0.409  -2.098 -12.171
  476    HB3  SER  62           HB3      SER  62   0.488  -2.876 -10.870
  477    HG   SER  62           HG       SER  62   1.527  -1.103 -11.978
  478    H    MET  63           H        MET  63   2.807  -4.091 -12.240
  479    HA   MET  63           HA       MET  63   2.747  -6.663 -10.730
  480    HB2  MET  63           HB2      MET  63   3.759  -6.768 -13.033
  481    HB3  MET  63           HB3      MET  63   5.055  -5.708 -12.457
  482    HG2  MET  63           HG2      MET  63   5.797  -7.331 -10.896
  483    HG3  MET  63           HG3      MET  63   4.309  -8.267 -11.003
  484    HE1  MET  63           HE1      MET  63   4.542 -10.445 -14.052
  485    HE2  MET  63           HE2      MET  63   3.990 -10.332 -12.365
  486    HE3  MET  63           HE3      MET  63   3.473  -9.109 -13.554
  487    H    VAL  64           H        VAL  64   3.884  -6.751  -8.852
  488    HA   VAL  64           HA       VAL  64   4.900  -4.167  -7.733
  489    HB   VAL  64           HB       VAL  64   3.031  -6.197  -6.458
  490   HG11  VAL  64          HG11      VAL  64   4.454  -5.312  -4.689
  491   HG12  VAL  64          HG12      VAL  64   4.223  -3.652  -5.277
  492   HG13  VAL  64          HG13      VAL  64   2.868  -4.538  -4.585
  493   HG21  VAL  64          HG21      VAL  64   1.871  -4.717  -8.052
  494   HG22  VAL  64          HG22      VAL  64   1.436  -4.281  -6.395
  495   HG23  VAL  64          HG23      VAL  64   2.606  -3.297  -7.295
  496    H    ASP  65           H        ASP  65   6.577  -4.191  -6.417
  497    HA   ASP  65           HA       ASP  65   8.023  -6.788  -6.028
  498    HB2  ASP  65           HB2      ASP  65   9.256  -5.000  -7.173
  499    HB3  ASP  65           HB3      ASP  65   9.115  -3.988  -5.728
  500    H    GLU  66           H        GLU  66   8.110  -7.772  -4.185
  501    HA   GLU  66           HA       GLU  66   7.409  -6.378  -1.637
  502    HB2  GLU  66           HB2      GLU  66   6.650  -9.211  -2.434
  503    HB3  GLU  66           HB3      GLU  66   6.135  -8.315  -0.994
  504    HG2  GLU  66           HG2      GLU  66   4.899  -6.726  -2.498
  505    HG3  GLU  66           HG3      GLU  66   5.307  -7.769  -3.868
  506    H    SER  67           H        SER  67  10.127  -7.164  -2.787
  507    HA   SER  67           HA       SER  67  11.050  -9.537  -1.574
  508    HB2  SER  67           HB2      SER  67  13.229  -8.919  -2.280
  509    HB3  SER  67           HB3      SER  67  12.074  -8.353  -3.502
  510    HG   SER  67           HG       SER  67  13.514  -6.776  -3.128
  511    H    LEU  68           H        LEU  68  10.883  -6.352  -0.062
  512    HA   LEU  68           HA       LEU  68  12.338  -7.382   2.310
  513    HB2  LEU  68           HB2      LEU  68  12.735  -5.099   1.606
  514    HB3  LEU  68           HB3      LEU  68  11.031  -4.721   1.583
  515    HG   LEU  68           HG       LEU  68  12.278  -3.633   3.354
  516   HD11  LEU  68          HD11      LEU  68  10.268  -5.491   4.647
  517   HD12  LEU  68          HD12      LEU  68  10.730  -3.856   5.114
  518   HD13  LEU  68          HD13      LEU  68   9.844  -4.107   3.605
  519   HD21  LEU  68          HD21      LEU  68  13.911  -5.376   3.928
  520   HD22  LEU  68          HD22      LEU  68  13.062  -4.740   5.347
  521   HD23  LEU  68          HD23      LEU  68  12.619  -6.334   4.689
  522    H    ILE  69           H        ILE  69   9.013  -6.564   1.279
  523    HA   ILE  69           HA       ILE  69   7.826  -6.856   3.839
  524    HB   ILE  69           HB       ILE  69   6.421  -7.171   1.164
  525   HG12  ILE  69          HG12      ILE  69   7.784  -5.068   1.147
  526   HG13  ILE  69          HG13      ILE  69   6.063  -4.851   0.986
  527   HG21  ILE  69          HG21      ILE  69   5.507  -6.408   3.970
  528   HG22  ILE  69          HG22      ILE  69   4.528  -6.123   2.531
  529   HG23  ILE  69          HG23      ILE  69   4.965  -7.776   2.977
  530   HD11  ILE  69          HD11      ILE  69   5.836  -4.054   3.237
  531   HD12  ILE  69          HD12      ILE  69   7.524  -4.466   3.626
  532   HD13  ILE  69          HD13      ILE  69   7.158  -3.168   2.465
  533    H    THR  70           H        THR  70   7.409  -9.124   1.053
  534    HA   THR  70           HA       THR  70   6.846 -11.351   2.951
  535    HB   THR  70           HB       THR  70   5.920 -12.490   0.955
  536    HG1  THR  70           HG1      THR  70   5.514 -10.565  -0.684
  537   HG21  THR  70          HG21      THR  70   4.740  -9.700   1.276
  538   HG22  THR  70          HG22      THR  70   3.921 -11.186   0.742
  539   HG23  THR  70          HG23      THR  70   4.481 -11.043   2.415
  540    H    GLY  71           H        GLY  71   9.415 -10.239   1.013
  541    HA2  GLY  71           HA2      GLY  71  11.570 -11.154   1.010
  542    HA3  GLY  71           HA3      GLY  71  10.954 -12.666   1.658
  543    H    GLU  72           H        GLU  72   9.204 -11.614  -1.057
  544    HA   GLU  72           HA       GLU  72   9.691 -13.936  -2.586
  545    HB2  GLU  72           HB2      GLU  72   8.457 -11.258  -3.229
  546    HB3  GLU  72           HB3      GLU  72   8.732 -12.405  -4.536
  547    HG2  GLU  72           HG2      GLU  72   7.162 -13.081  -2.023
  548    HG3  GLU  72           HG3      GLU  72   6.429 -12.475  -3.501
  549    H    ALA  73           H        ALA  73  11.015 -10.700  -3.516
  550    HA   ALA  73           HA       ALA  73  13.001 -10.108  -4.387
  551    HB1  ALA  73           HB1      ALA  73  14.122 -11.504  -2.716
  552    HB2  ALA  73           HB2      ALA  73  14.071 -12.877  -3.846
  553    HB3  ALA  73           HB3      ALA  73  15.004 -11.427  -4.253
  554    H    MET  74           H        MET  74  10.749 -11.407  -5.791
  555    HA   MET  74           HA       MET  74  11.793 -10.944  -8.419
  556    HB2  MET  74           HB2      MET  74  12.012 -13.413  -8.233
  557    HB3  MET  74           HB3      MET  74  10.284 -13.508  -7.819
  558    HG2  MET  74           HG2      MET  74   9.645 -12.586  -9.926
  559    HG3  MET  74           HG3      MET  74  11.334 -12.290 -10.370
  560    HE1  MET  74           HE1      MET  74   9.020 -13.815 -12.091
  561    HE2  MET  74           HE2      MET  74  10.640 -13.450 -12.728
  562    HE3  MET  74           HE3      MET  74   9.982 -15.101 -12.842
  563    HA   PRO  75           HA       PRO  75   8.011  -8.612  -7.984
  564    HB2  PRO  75           HB2      PRO  75   7.795  -8.784 -10.969
  565    HB3  PRO  75           HB3      PRO  75   7.739  -7.335  -9.910
  566    HG2  PRO  75           HG2      PRO  75   9.966  -7.956 -11.343
  567    HG3  PRO  75           HG3      PRO  75  10.088  -7.333  -9.664
  568    HD2  PRO  75           HD2      PRO  75  10.336 -10.203 -10.627
  569    HD3  PRO  75           HD3      PRO  75  11.273  -9.283  -9.412
  570    H    VAL  76           H        VAL  76   5.749  -8.671  -8.050
  571    HA   VAL  76           HA       VAL  76   4.504 -11.328  -8.643
  572    HB   VAL  76           HB       VAL  76   3.852  -9.451  -6.336
  573   HG11  VAL  76          HG11      VAL  76   3.284 -12.423  -6.713
  574   HG12  VAL  76          HG12      VAL  76   2.770 -11.406  -5.351
  575   HG13  VAL  76          HG13      VAL  76   2.101 -11.123  -6.961
  576   HG21  VAL  76          HG21      VAL  76   6.163 -10.188  -5.964
  577   HG22  VAL  76          HG22      VAL  76   5.072 -10.998  -4.847
  578   HG23  VAL  76          HG23      VAL  76   5.694 -11.878  -6.264
  579    H    ALA  77           H        ALA  77   2.488 -11.378  -9.590
  580    HA   ALA  77           HA       ALA  77   1.661  -8.897 -10.915
  581    HB1  ALA  77           HB1      ALA  77   0.219 -10.335 -12.242
  582    HB2  ALA  77           HB2      ALA  77   1.831 -11.061 -12.120
  583    HB3  ALA  77           HB3      ALA  77   0.496 -11.690 -11.134
  584    H    LYS  78           H        LYS  78  -0.149  -7.712 -10.701
  585    HA   LYS  78           HA       LYS  78  -2.321  -8.554  -8.807
  586    HB2  LYS  78           HB2      LYS  78  -1.454  -5.698  -9.377
  587    HB3  LYS  78           HB3      LYS  78  -2.632  -6.232  -8.190
  588    HG2  LYS  78           HG2      LYS  78   0.376  -6.683  -8.102
  589    HG3  LYS  78           HG3      LYS  78  -0.531  -5.505  -7.168
  590    HD2  LYS  78           HD2      LYS  78  -1.652  -7.222  -5.873
  591    HD3  LYS  78           HD3      LYS  78  -0.945  -8.503  -6.865
  592    HE2  LYS  78           HE2      LYS  78   1.334  -7.824  -6.141
  593    HE3  LYS  78           HE3      LYS  78   0.637  -6.548  -5.134
  594    HZ1  LYS  78           HZ1      LYS  78   0.156  -9.453  -4.775
  595    HZ2  LYS  78           HZ2      LYS  78   1.143  -8.516  -3.830
  596    HZ3  LYS  78           HZ3      LYS  78  -0.493  -8.273  -3.841
  597    H    LYS  79           H        LYS  79  -4.403  -8.217  -9.382
  598    HA   LYS  79           HA       LYS  79  -5.212  -7.141 -12.026
  599    HB2  LYS  79           HB2      LYS  79  -6.470  -9.272 -12.439
  600    HB3  LYS  79           HB3      LYS  79  -4.740  -9.522 -12.388
  601    HG2  LYS  79           HG2      LYS  79  -4.831 -10.520 -10.231
  602    HG3  LYS  79           HG3      LYS  79  -6.518 -10.041  -9.970
  603    HD2  LYS  79           HD2      LYS  79  -5.647 -11.945 -12.175
  604    HD3  LYS  79           HD3      LYS  79  -6.038 -12.465 -10.533
  605    HE2  LYS  79           HE2      LYS  79  -8.293 -11.482 -10.715
  606    HE3  LYS  79           HE3      LYS  79  -7.969 -10.996 -12.387
  607    HZ1  LYS  79           HZ1      LYS  79  -7.926 -13.253 -13.063
  608    HZ2  LYS  79           HZ2      LYS  79  -7.672 -13.815 -11.550
  609    HZ3  LYS  79           HZ3      LYS  79  -9.148 -13.261 -11.985
  610    HA   PRO  80           HA       PRO  80  -8.861  -6.072  -9.553
  611    HB2  PRO  80           HB2      PRO  80 -11.090  -6.985 -10.932
  612    HB3  PRO  80           HB3      PRO  80 -10.180  -5.496 -11.335
  613    HG2  PRO  80           HG2      PRO  80  -9.848  -8.252 -12.565
  614    HG3  PRO  80           HG3      PRO  80 -10.035  -6.675 -13.403
  615    HD2  PRO  80           HD2      PRO  80  -7.590  -7.689 -13.063
  616    HD3  PRO  80           HD3      PRO  80  -7.875  -5.962 -12.739
  617    H    GLY  81           H        GLY  81  -9.535  -7.022  -7.745
  618    HA2  GLY  81           HA2      GLY  81 -10.190  -8.675  -6.244
  619    HA3  GLY  81           HA3      GLY  81 -10.109  -9.909  -7.505
  620    H    SER  82           H        SER  82  -7.479  -7.627  -6.533
  621    HA   SER  82           HA       SER  82  -5.888  -9.986  -5.491
  622    HB2  SER  82           HB2      SER  82  -4.786  -7.567  -6.965
  623    HB3  SER  82           HB3      SER  82  -3.834  -8.854  -6.211
  624    HG   SER  82           HG       SER  82  -4.953 -10.326  -7.682
  625    H    THR  83           H        THR  83  -4.427  -9.512  -3.639
  626    HA   THR  83           HA       THR  83  -5.134  -6.950  -2.281
  627    HB   THR  83           HB       THR  83  -4.312  -7.968  -0.222
  628    HG1  THR  83           HG1      THR  83  -3.088  -9.588  -0.635
  629   HG21  THR  83          HG21      THR  83  -6.235  -9.469   0.114
  630   HG22  THR  83          HG22      THR  83  -6.701  -7.976  -0.709
  631   HG23  THR  83          HG23      THR  83  -6.546  -9.484  -1.637
  632    H    VAL  84           H        VAL  84  -3.652  -5.680  -1.263
  633    HA   VAL  84           HA       VAL  84  -0.800  -5.901  -2.090
  634    HB   VAL  84           HB       VAL  84  -0.807  -3.423  -2.517
  635   HG11  VAL  84          HG11      VAL  84  -1.668  -3.595  -4.812
  636   HG12  VAL  84          HG12      VAL  84  -0.705  -5.006  -4.354
  637   HG13  VAL  84          HG13      VAL  84  -2.477  -5.124  -4.405
  638   HG21  VAL  84          HG21      VAL  84  -2.983  -2.856  -1.433
  639   HG22  VAL  84          HG22      VAL  84  -2.871  -2.288  -3.102
  640   HG23  VAL  84          HG23      VAL  84  -3.836  -3.727  -2.729
  641    H    ILE  85           H        ILE  85   0.669  -4.677  -0.849
  642    HA   ILE  85           HA       ILE  85  -0.279  -3.907   1.862
  643    HB   ILE  85           HB       ILE  85   2.151  -4.768   2.545
  644   HG12  ILE  85          HG12      ILE  85   2.606  -7.003   1.617
  645   HG13  ILE  85          HG13      ILE  85   1.351  -6.798   0.404
  646   HG21  ILE  85          HG21      ILE  85  -0.296  -6.548   2.342
  647   HG22  ILE  85          HG22      ILE  85   1.090  -6.787   3.421
  648   HG23  ILE  85          HG23      ILE  85   0.053  -5.374   3.639
  649   HD11  ILE  85          HD11      ILE  85   3.692  -6.377  -0.420
  650   HD12  ILE  85          HD12      ILE  85   2.588  -5.010  -0.663
  651   HD13  ILE  85          HD13      ILE  85   3.766  -4.958   0.655
  652    H    ALA  86           H        ALA  86   0.650  -2.305   2.953
  653    HA   ALA  86           HA       ALA  86   1.495  -0.072   1.488
  654    HB1  ALA  86           HB1      ALA  86   1.829  -0.653   4.462
  655    HB2  ALA  86           HB2      ALA  86   1.832   0.952   3.695
  656    HB3  ALA  86           HB3      ALA  86   0.364  -0.037   3.697
  657    H    GLY  87           H        GLY  87   3.429   0.988   1.220
  658    HA2  GLY  87           HA2      GLY  87   5.725   1.421   1.314
  659    HA3  GLY  87           HA3      GLY  87   5.945   0.037   2.391
  660    H    SER  88           H        SER  88   4.322  -1.323  -0.126
  661    HA   SER  88           HA       SER  88   6.747  -2.192  -1.567
  662    HB2  SER  88           HB2      SER  88   5.298  -3.693  -2.774
  663    HB3  SER  88           HB3      SER  88   5.076  -3.878  -1.034
  664    HG   SER  88           HG       SER  88   3.092  -2.823  -1.201
  665    H    ILE  89           H        ILE  89   6.770  -2.150  -3.943
  666    HA   ILE  89           HA       ILE  89   5.945   0.549  -4.911
  667    HB   ILE  89           HB       ILE  89   8.118  -1.056  -6.223
  668   HG12  ILE  89          HG12      ILE  89   8.848  -1.173  -3.918
  669   HG13  ILE  89          HG13      ILE  89   9.865  -0.114  -4.865
  670   HG21  ILE  89          HG21      ILE  89   7.552   1.923  -5.856
  671   HG22  ILE  89          HG22      ILE  89   8.977   1.255  -6.681
  672   HG23  ILE  89          HG23      ILE  89   7.357   0.968  -7.334
  673   HD11  ILE  89          HD11      ILE  89   9.404   0.718  -2.569
  674   HD12  ILE  89          HD12      ILE  89   8.940   1.864  -3.834
  675   HD13  ILE  89          HD13      ILE  89   7.696   0.915  -2.984
  676    H    ASN  90           H        ASN  90   4.699   0.816  -6.669
  677    HA   ASN  90           HA       ASN  90   3.706  -1.542  -8.172
  678    HB2  ASN  90           HB2      ASN  90   2.106   0.104  -7.103
  679    HB3  ASN  90           HB3      ASN  90   2.801   1.377  -8.096
  680   HD21  ASN  90          HD22      ASN  90   1.868   1.661 -10.092
  681   HD22  ASN  90          HD21      ASN  90   0.652   0.563 -10.726
  682    H    GLN  91           H        GLN  91   4.210  -1.883 -10.327
  683    HA   GLN  91           HA       GLN  91   6.328  -0.173 -11.408
  684    HB2  GLN  91           HB2      GLN  91   5.318  -2.894 -12.253
  685    HB3  GLN  91           HB3      GLN  91   6.598  -2.017 -13.083
  686    HG2  GLN  91           HG2      GLN  91   6.702  -2.813 -10.136
  687    HG3  GLN  91           HG3      GLN  91   7.477  -3.679 -11.462
  688   HE21  GLN  91          HE22      GLN  91   9.184  -2.513 -12.706
  689   HE22  GLN  91          HE21      GLN  91  10.134  -1.291 -11.881
  690    H    ASN  92           H        ASN  92   4.377  -1.678 -13.902
  691    HA   ASN  92           HA       ASN  92   4.542   0.893 -15.218
  692    HB2  ASN  92           HB2      ASN  92   5.242  -1.107 -16.362
  693    HB3  ASN  92           HB3      ASN  92   3.683  -1.887 -16.099
  694   HD21  ASN  92          HD22      ASN  92   2.041  -1.539 -17.550
  695   HD22  ASN  92          HD21      ASN  92   2.113  -0.328 -18.839
  696    H    GLY  93           H        GLY  93   1.693  -1.106 -14.270
  697    HA2  GLY  93           HA2      GLY  93  -0.105   0.808 -15.631
  698    HA3  GLY  93           HA3      GLY  93  -0.543  -0.743 -14.941
  699    H    SER  94           H        SER  94  -1.541   2.199 -14.638
  700    HA   SER  94           HA       SER  94  -1.471   2.465 -11.717
  701    HB2  SER  94           HB2      SER  94  -3.008   4.369 -12.060
  702    HB3  SER  94           HB3      SER  94  -1.480   4.500 -12.938
  703    HG   SER  94           HG       SER  94  -3.280   5.102 -14.190
  704    H    LEU  95           H        LEU  95  -3.024   1.973 -10.265
  705    HA   LEU  95           HA       LEU  95  -5.353   0.305 -11.187
  706    HB2  LEU  95           HB2      LEU  95  -3.610  -0.261  -8.791
  707    HB3  LEU  95           HB3      LEU  95  -4.865  -1.279  -9.448
  708    HG   LEU  95           HG       LEU  95  -2.165  -0.684 -10.741
  709   HD11  LEU  95          HD11      LEU  95  -1.676  -3.047 -10.089
  710   HD12  LEU  95          HD12      LEU  95  -1.882  -1.977  -8.699
  711   HD13  LEU  95          HD13      LEU  95  -3.191  -3.088  -9.170
  712   HD21  LEU  95          HD21      LEU  95  -2.727  -2.494 -12.227
  713   HD22  LEU  95          HD22      LEU  95  -4.286  -2.765 -11.404
  714   HD23  LEU  95          HD23      LEU  95  -3.995  -1.275 -12.330
  715    H    LEU  96           H        LEU  96  -7.079   0.055  -9.686
  716    HA   LEU  96           HA       LEU  96  -7.443   2.362  -7.814
  717    HB2  LEU  96           HB2      LEU  96  -9.420   0.606  -9.295
  718    HB3  LEU  96           HB3      LEU  96  -9.887   1.531  -7.897
  719    HG   LEU  96           HG       LEU  96 -10.538   2.655  -9.927
  720   HD11  LEU  96          HD11      LEU  96  -9.759   4.866  -9.369
  721   HD12  LEU  96          HD12      LEU  96  -9.956   3.940  -7.875
  722   HD13  LEU  96          HD13      LEU  96  -8.331   4.215  -8.533
  723   HD21  LEU  96          HD21      LEU  96  -8.681   1.974 -11.446
  724   HD22  LEU  96          HD22      LEU  96  -9.013   3.703 -11.461
  725   HD23  LEU  96          HD23      LEU  96  -7.598   3.085 -10.583
  726    H    ILE  97           H        ILE  97  -7.209   2.016  -5.745
  727    HA   ILE  97           HA       ILE  97  -7.380  -0.763  -4.674
  728    HB   ILE  97           HB       ILE  97  -5.908   1.528  -3.376
  729   HG12  ILE  97          HG12      ILE  97  -4.919   1.508  -5.577
  730   HG13  ILE  97          HG13      ILE  97  -3.812   0.919  -4.357
  731   HG21  ILE  97          HG21      ILE  97  -5.611  -1.494  -3.217
  732   HG22  ILE  97          HG22      ILE  97  -4.575  -0.314  -2.384
  733   HG23  ILE  97          HG23      ILE  97  -6.292  -0.424  -1.982
  734   HD11  ILE  97          HD11      ILE  97  -5.390  -0.884  -6.241
  735   HD12  ILE  97          HD12      ILE  97  -3.700  -0.396  -6.446
  736   HD13  ILE  97          HD13      ILE  97  -4.165  -1.386  -5.052
  737    H    CYS  98           H        CYS  98  -8.958  -1.226  -3.203
  738    HA   CYS  98           HA       CYS  98 -10.459   0.942  -1.824
  739    HB2  CYS  98           HB2      CYS  98 -10.662  -2.094  -1.675
  740    HB3  CYS  98           HB3      CYS  98 -11.688  -0.964  -0.778
  741    HG   CYS  98           HG       CYS  98 -12.661   0.237  -2.924
  742    H    ALA  99           H        ALA  99  -9.595   1.835   0.032
  743    HA   ALA  99           HA       ALA  99  -7.526   0.421   1.535
  744    HB1  ALA  99           HB1      ALA  99  -9.030   3.033   2.012
  745    HB2  ALA  99           HB2      ALA  99  -7.653   2.449   2.963
  746    HB3  ALA  99           HB3      ALA  99  -7.434   2.856   1.248
  747    H    THR 100           H        THR 100  -8.090  -1.239   2.850
  748    HA   THR 100           HA       THR 100 -10.611  -1.067   4.457
  749    HB   THR 100           HB       THR 100 -10.265  -3.504   4.837
  750    HG1  THR 100           HG1      THR 100  -8.761  -4.574   3.691
  751   HG21  THR 100          HG21      THR 100 -10.295  -2.756   1.880
  752   HG22  THR 100          HG22      THR 100 -10.915  -4.252   2.610
  753   HG23  THR 100          HG23      THR 100 -11.704  -2.705   2.965
  754    H    HIS 101           H        HIS 101  -7.393  -0.313   4.883
  755    HA   HIS 101           HA       HIS 101  -7.718  -0.499   7.819
  756    HB2  HIS 101           HB2      HIS 101  -5.147  -0.994   6.267
  757    HB3  HIS 101           HB3      HIS 101  -5.335  -1.022   8.018
  758    HD1  HIS 101           HD1      HIS 101  -6.200  -3.109   4.909
  759    HD2  HIS 101           HD2      HIS 101  -6.258  -3.274   9.117
  760    HE1  HIS 101           HE1      HIS 101  -6.740  -5.531   5.527
  761    H    VAL 102           H        VAL 102  -7.111   1.345   8.934
  762    HA   VAL 102           HA       VAL 102  -5.993   3.656   7.437
  763    HB   VAL 102           HB       VAL 102  -5.957   4.790   9.669
  764   HG11  VAL 102          HG11      VAL 102  -8.658   3.748   8.735
  765   HG12  VAL 102          HG12      VAL 102  -8.364   5.212   9.704
  766   HG13  VAL 102          HG13      VAL 102  -7.751   5.118   8.045
  767   HG21  VAL 102          HG21      VAL 102  -5.959   2.750  11.130
  768   HG22  VAL 102          HG22      VAL 102  -7.215   3.933  11.532
  769   HG23  VAL 102          HG23      VAL 102  -7.649   2.465  10.649
  770    H    GLY 103           H        GLY 103  -3.899   4.724   8.420
  771    HA2  GLY 103           HA2      GLY 103  -1.877   2.860   7.668
  772    HA3  GLY 103           HA3      GLY 103  -1.645   4.464   8.296
  773    H    ALA 104           H        ALA 104  -2.859   4.073  10.897
  774    HA   ALA 104           HA       ALA 104  -0.724   2.774  12.327
  775    HB1  ALA 104           HB1      ALA 104  -3.433   3.791  13.278
  776    HB2  ALA 104           HB2      ALA 104  -2.033   3.410  14.302
  777    HB3  ALA 104           HB3      ALA 104  -1.942   4.755  13.149
  778    H    ASP 105           H        ASP 105  -3.827   1.619  11.236
  779    HA   ASP 105           HA       ASP 105  -3.801  -0.806  12.901
  780    HB2  ASP 105           HB2      ASP 105  -5.908   0.474  12.400
  781    HB3  ASP 105           HB3      ASP 105  -5.755  -0.058  10.723
  782    H    THR 106           H        THR 106  -2.218   0.056  10.093
  783    HA   THR 106           HA       THR 106  -2.750  -2.010   8.248
  784    HB   THR 106           HB       THR 106  -0.435  -1.531   7.333
  785    HG1  THR 106           HG1      THR 106  -0.199   0.643   8.990
  786   HG21  THR 106          HG21      THR 106  -0.886   0.830   6.719
  787   HG22  THR 106          HG22      THR 106  -2.212  -0.313   6.405
  788   HG23  THR 106          HG23      THR 106  -2.307   0.762   7.795
  789    H    THR 107           H        THR 107  -1.576  -3.814   7.512
  790    HA   THR 107           HA       THR 107  -0.515  -5.663   9.409
  791    HB   THR 107           HB       THR 107   0.158  -5.520   6.442
  792    HG1  THR 107           HG1      THR 107  -1.706  -6.927   6.321
  793   HG21  THR 107          HG21      THR 107   0.248  -7.970   6.592
  794   HG22  THR 107          HG22      THR 107   1.414  -7.258   7.705
  795   HG23  THR 107          HG23      THR 107  -0.115  -7.898   8.335
  796    H    LEU 108           H        LEU 108   1.069  -3.160   7.450
  797    HA   LEU 108           HA       LEU 108   3.768  -3.951   7.864
  798    HB2  LEU 108           HB2      LEU 108   2.618  -2.256   6.195
  799    HB3  LEU 108           HB3      LEU 108   2.819  -1.089   7.496
  800    HG   LEU 108           HG       LEU 108   5.334  -1.731   7.463
  801   HD11  LEU 108          HD11      LEU 108   4.415  -2.932   4.809
  802   HD12  LEU 108          HD12      LEU 108   6.097  -2.580   5.235
  803   HD13  LEU 108          HD13      LEU 108   5.197  -3.818   6.138
  804   HD21  LEU 108          HD21      LEU 108   5.742  -0.312   5.452
  805   HD22  LEU 108          HD22      LEU 108   4.018  -0.424   5.052
  806   HD23  LEU 108          HD23      LEU 108   4.544   0.324   6.588
  807    H    SER 109           H        SER 109   1.687  -1.695   9.711
  808    HA   SER 109           HA       SER 109   3.692  -1.227  11.773
  809    HB2  SER 109           HB2      SER 109   1.878  -0.116  12.986
  810    HB3  SER 109           HB3      SER 109   2.121   0.513  11.346
  811    HG   SER 109           HG       SER 109   0.309  -0.540  10.654
  812    H    GLN 110           H        GLN 110   1.348  -3.772  11.186
  813    HA   GLN 110           HA       GLN 110   1.171  -4.689  13.928
  814    HB2  GLN 110           HB2      GLN 110  -0.413  -5.166  11.905
  815    HB3  GLN 110           HB3      GLN 110   0.745  -6.406  11.471
  816    HG2  GLN 110           HG2      GLN 110  -0.761  -7.587  12.735
  817    HG3  GLN 110           HG3      GLN 110   0.485  -7.242  13.929
  818   HE21  GLN 110          HE22      GLN 110  -2.624  -6.075  12.617
  819   HE22  GLN 110          HE21      GLN 110  -3.107  -5.210  14.068
  820    H    ILE 111           H        ILE 111   3.214  -5.505  11.147
  821    HA   ILE 111           HA       ILE 111   4.770  -7.583  12.287
  822    HB   ILE 111           HB       ILE 111   5.440  -5.507  10.175
  823   HG12  ILE 111          HG12      ILE 111   4.888  -8.495   9.871
  824   HG13  ILE 111          HG13      ILE 111   3.607  -7.299   9.802
  825   HG21  ILE 111          HG21      ILE 111   7.359  -6.978   9.530
  826   HG22  ILE 111          HG22      ILE 111   7.589  -6.270  11.117
  827   HG23  ILE 111          HG23      ILE 111   7.069  -7.966  10.971
  828   HD11  ILE 111          HD11      ILE 111   4.759  -6.176   7.885
  829   HD12  ILE 111          HD12      ILE 111   5.948  -7.502   7.871
  830   HD13  ILE 111          HD13      ILE 111   4.241  -7.841   7.553
  831    H    VAL 112           H        VAL 112   5.626  -4.022  12.271
  832    HA   VAL 112           HA       VAL 112   7.854  -4.458  13.997
  833    HB   VAL 112           HB       VAL 112   7.953  -2.106  14.452
  834   HG11  VAL 112          HG11      VAL 112   7.154  -2.552  11.558
  835   HG12  VAL 112          HG12      VAL 112   8.227  -1.287  12.207
  836   HG13  VAL 112          HG13      VAL 112   8.732  -2.981  12.257
  837   HG21  VAL 112          HG21      VAL 112   5.567  -1.534  14.761
  838   HG22  VAL 112          HG22      VAL 112   6.343  -0.491  13.574
  839   HG23  VAL 112          HG23      VAL 112   5.291  -1.814  13.028
  840    H    LYS 113           H        LYS 113   4.466  -4.246  14.850
  841    HA   LYS 113           HA       LYS 113   4.957  -3.704  17.684
  842    HB2  LYS 113           HB2      LYS 113   2.555  -4.728  16.170
  843    HB3  LYS 113           HB3      LYS 113   2.619  -4.751  17.937
  844    HG2  LYS 113           HG2      LYS 113   3.092  -2.336  18.007
  845    HG3  LYS 113           HG3      LYS 113   3.037  -2.247  16.246
  846    HD2  LYS 113           HD2      LYS 113   0.703  -3.074  18.035
  847    HD3  LYS 113           HD3      LYS 113   0.951  -1.448  17.369
  848    HE2  LYS 113           HE2      LYS 113   0.912  -2.363  15.074
  849    HE3  LYS 113           HE3      LYS 113   0.658  -3.983  15.731
  850    HZ1  LYS 113           HZ1      LYS 113  -1.278  -1.740  16.105
  851    HZ2  LYS 113           HZ2      LYS 113  -1.431  -2.944  15.012
  852    HZ3  LYS 113           HZ3      LYS 113  -1.462  -3.267  16.627
  853    H    LEU 114           H        LEU 114   4.745  -6.646  15.670
  854    HA   LEU 114           HA       LEU 114   4.979  -8.486  17.887
  855    HB2  LEU 114           HB2      LEU 114   4.175  -8.650  15.270
  856    HB3  LEU 114           HB3      LEU 114   5.788  -9.338  15.130
  857    HG   LEU 114           HG       LEU 114   3.554 -10.264  16.975
  858   HD11  LEU 114          HD11      LEU 114   4.688 -11.503  14.429
  859   HD12  LEU 114          HD12      LEU 114   3.423 -12.207  15.463
  860   HD13  LEU 114          HD13      LEU 114   3.106 -10.704  14.591
  861   HD21  LEU 114          HD21      LEU 114   5.001 -12.305  17.275
  862   HD22  LEU 114          HD22      LEU 114   6.305 -11.450  16.417
  863   HD23  LEU 114          HD23      LEU 114   5.701 -10.843  17.980
  864    H    VAL 115           H        VAL 115   7.338  -7.231  15.482
  865    HA   VAL 115           HA       VAL 115   9.557  -8.753  16.574
  866    HB   VAL 115           HB       VAL 115   9.578  -6.404  14.653
  867   HG11  VAL 115          HG11      VAL 115  11.734  -8.465  15.328
  868   HG12  VAL 115          HG12      VAL 115  11.801  -7.332  13.951
  869   HG13  VAL 115          HG13      VAL 115  11.834  -6.718  15.601
  870   HG21  VAL 115          HG21      VAL 115   9.847  -8.165  12.923
  871   HG22  VAL 115          HG22      VAL 115   9.672  -9.421  14.169
  872   HG23  VAL 115          HG23      VAL 115   8.317  -8.351  13.770
  873    H    GLU 116           H        GLU 116   8.194  -5.700  17.521
  874    HA   GLU 116           HA       GLU 116  10.615  -4.701  18.865
  875    HB2  GLU 116           HB2      GLU 116   8.867  -3.184  17.981
  876    HB3  GLU 116           HB3      GLU 116   7.711  -3.827  19.159
  877    HG2  GLU 116           HG2      GLU 116   9.041  -2.934  20.992
  878    HG3  GLU 116           HG3      GLU 116  10.358  -2.506  19.892
  879    H    GLU 117           H        GLU 117   7.999  -6.921  19.658
  880    HA   GLU 117           HA       GLU 117   8.260  -6.753  22.550
  881    HB2  GLU 117           HB2      GLU 117   7.051  -8.913  20.789
  882    HB3  GLU 117           HB3      GLU 117   6.864  -8.801  22.526
  883    HG2  GLU 117           HG2      GLU 117   6.035  -6.297  21.212
  884    HG3  GLU 117           HG3      GLU 117   5.196  -7.705  20.552
  885    H    ALA 118           H        ALA 118  10.237  -8.337  20.126
  886    HA   ALA 118           HA       ALA 118  10.998 -10.614  21.772
  887    HB1  ALA 118           HB1      ALA 118  11.001 -10.901  19.424
  888    HB2  ALA 118           HB2      ALA 118  12.020  -9.478  19.155
  889    HB3  ALA 118           HB3      ALA 118  12.695 -10.927  19.940
  890    H    GLN 119           H        GLN 119  13.028  -7.912  20.585
  891    HA   GLN 119           HA       GLN 119  15.064  -8.241  22.373
  892    HB2  GLN 119           HB2      GLN 119  14.250  -5.675  21.002
  893    HB3  GLN 119           HB3      GLN 119  15.791  -5.958  21.741
  894    HG2  GLN 119           HG2      GLN 119  16.100  -6.237  19.419
  895    HG3  GLN 119           HG3      GLN 119  16.221  -7.861  20.154
  896   HE21  GLN 119          HE22      GLN 119  13.721  -5.606  18.934
  897   HE22  GLN 119          HE21      GLN 119  12.778  -6.917  18.256
  Start of MODEL   30
    1    H    SER   1           H        SER   1  16.691  -7.799  14.510
    2    HA   SER   1           HA       SER   1  15.763  -5.300  14.767
    3    HB2  SER   1           HB2      SER   1  18.509  -6.175  15.702
    4    HB3  SER   1           HB3      SER   1  17.641  -4.756  16.297
    5    HG   SER   1           HG       SER   1  16.938  -7.497  16.542
    6    H    GLU   2           H        GLU   2  18.049  -5.779  12.233
    7    HA   GLU   2           HA       GLU   2  18.662  -2.846  12.109
    8    HB2  GLU   2           HB2      GLU   2  20.568  -4.352  12.037
    9    HB3  GLU   2           HB3      GLU   2  19.937  -5.153  10.607
   10    HG2  GLU   2           HG2      GLU   2  20.282  -2.172  10.445
   11    HG3  GLU   2           HG3      GLU   2  21.748  -3.127  10.607
   12    H    ALA   3           H        ALA   3  17.205  -5.487  10.344
   13    HA   ALA   3           HA       ALA   3  16.099  -3.912   8.158
   14    HB1  ALA   3           HB1      ALA   3  16.283  -6.391   8.111
   15    HB2  ALA   3           HB2      ALA   3  15.012  -6.484   9.352
   16    HB3  ALA   3           HB3      ALA   3  14.640  -5.817   7.753
   17    H    LEU   4           H        LEU   4  14.801  -4.824  11.326
   18    HA   LEU   4           HA       LEU   4  12.347  -3.971  11.606
   19    HB2  LEU   4           HB2      LEU   4  13.973  -4.756  13.374
   20    HB3  LEU   4           HB3      LEU   4  14.573  -3.112  13.489
   21    HG   LEU   4           HG       LEU   4  12.228  -2.412  14.238
   22   HD11  LEU   4          HD11      LEU   4  11.999  -5.434  14.553
   23   HD12  LEU   4          HD12      LEU   4  10.871  -4.235  15.224
   24   HD13  LEU   4          HD13      LEU   4  11.021  -4.437  13.460
   25   HD21  LEU   4          HD21      LEU   4  14.136  -2.678  15.789
   26   HD22  LEU   4          HD22      LEU   4  12.615  -3.185  16.532
   27   HD23  LEU   4          HD23      LEU   4  13.767  -4.409  15.952
   28    H    ALA   5           H        ALA   5  14.845  -1.538  10.965
   29    HA   ALA   5           HA       ALA   5  13.228   0.759  11.826
   30    HB1  ALA   5           HB1      ALA   5  15.674   0.788  12.035
   31    HB2  ALA   5           HB2      ALA   5  15.847   0.540  10.281
   32    HB3  ALA   5           HB3      ALA   5  15.130   2.035  10.901
   33    H    LYS   6           H        LYS   6  13.859  -0.995   8.860
   34    HA   LYS   6           HA       LYS   6  13.145   1.087   6.995
   35    HB2  LYS   6           HB2      LYS   6  13.464  -1.929   6.690
   36    HB3  LYS   6           HB3      LYS   6  12.945  -0.906   5.363
   37    HG2  LYS   6           HG2      LYS   6  15.257  -1.273   5.105
   38    HG3  LYS   6           HG3      LYS   6  15.020   0.425   5.523
   39    HD2  LYS   6           HD2      LYS   6  15.788   0.008   7.809
   40    HD3  LYS   6           HD3      LYS   6  15.881  -1.739   7.492
   41    HE2  LYS   6           HE2      LYS   6  17.665  -1.425   5.887
   42    HE3  LYS   6           HE3      LYS   6  17.448   0.333   5.909
   43    HZ1  LYS   6           HZ1      LYS   6  18.169   0.369   8.204
   44    HZ2  LYS   6           HZ2      LYS   6  18.431  -1.284   8.196
   45    HZ3  LYS   6           HZ3      LYS   6  19.331  -0.296   7.272
   46    H    LEU   7           H        LEU   7  11.150  -1.340   8.562
   47    HA   LEU   7           HA       LEU   7   8.832  -1.373   7.022
   48    HB2  LEU   7           HB2      LEU   7   9.293  -1.443  10.034
   49    HB3  LEU   7           HB3      LEU   7   7.700  -1.669   9.346
   50    HG   LEU   7           HG       LEU   7   8.780  -3.764  10.011
   51   HD11  LEU   7          HD11      LEU   7   8.234  -5.055   8.013
   52   HD12  LEU   7          HD12      LEU   7   7.047  -3.775   8.291
   53   HD13  LEU   7          HD13      LEU   7   8.279  -3.588   7.015
   54   HD21  LEU   7          HD21      LEU   7  11.135  -3.233   9.395
   55   HD22  LEU   7          HD22      LEU   7  10.568  -4.784   8.764
   56   HD23  LEU   7          HD23      LEU   7  10.684  -3.395   7.673
   57    H    ILE   8           H        ILE   8   9.835   1.112   9.349
   58    HA   ILE   8           HA       ILE   8   7.404   2.701   9.093
   59    HB   ILE   8           HB       ILE   8  10.058   3.181  10.449
   60   HG12  ILE   8          HG12      ILE   8   8.834   1.405  11.495
   61   HG13  ILE   8          HG13      ILE   8   8.726   2.824  12.524
   62   HG21  ILE   8          HG21      ILE   8   7.556   4.900  10.580
   63   HG22  ILE   8          HG22      ILE   8   8.957   5.041  11.655
   64   HG23  ILE   8          HG23      ILE   8   9.140   5.375   9.934
   65   HD11  ILE   8          HD11      ILE   8   6.377   3.198  11.549
   66   HD12  ILE   8          HD12      ILE   8   6.540   1.610  10.771
   67   HD13  ILE   8          HD13      ILE   8   6.581   1.743  12.534
   68    H    SER   9           H        SER   9  10.584   2.706   7.500
   69    HA   SER   9           HA       SER   9  10.341   5.383   6.434
   70    HB2  SER   9           HB2      SER   9  12.145   3.065   5.639
   71    HB3  SER   9           HB3      SER   9  12.269   4.722   5.027
   72    HG   SER   9           HG       SER   9  13.651   4.666   6.654
   73    H    LEU  10           H        LEU  10   9.601   2.132   5.061
   74    HA   LEU  10           HA       LEU  10   9.437   3.011   2.333
   75    HB2  LEU  10           HB2      LEU  10   8.627   0.536   3.878
   76    HB3  LEU  10           HB3      LEU  10   7.962   0.787   2.282
   77    HG   LEU  10           HG       LEU  10  10.329   1.065   1.386
   78   HD11  LEU  10          HD11      LEU  10  11.008  -0.300   4.021
   79   HD12  LEU  10          HD12      LEU  10  12.121  -0.012   2.665
   80   HD13  LEU  10          HD13      LEU  10  11.493   1.361   3.588
   81   HD21  LEU  10          HD21      LEU  10  10.676  -1.404   1.334
   82   HD22  LEU  10          HD22      LEU  10   9.438  -1.581   2.607
   83   HD23  LEU  10          HD23      LEU  10   9.001  -0.949   1.010
   84    H    GLN  11           H        GLN  11   7.159   3.515   4.850
   85    HA   GLN  11           HA       GLN  11   4.726   3.152   3.375
   86    HB2  GLN  11           HB2      GLN  11   5.406   4.389   6.027
   87    HB3  GLN  11           HB3      GLN  11   3.752   4.318   5.396
   88    HG2  GLN  11           HG2      GLN  11   3.924   1.877   5.064
   89    HG3  GLN  11           HG3      GLN  11   5.549   1.891   5.777
   90   HE21  GLN  11          HE22      GLN  11   5.593   1.440   7.930
   91   HE22  GLN  11          HE21      GLN  11   4.227   1.849   8.988
   92    H    ALA  12           H        ALA  12   3.382   4.601   2.328
   93    HA   ALA  12           HA       ALA  12   4.674   7.051   1.392
   94    HB1  ALA  12           HB1      ALA  12   3.051   7.068  -0.349
   95    HB2  ALA  12           HB2      ALA  12   3.647   5.408  -0.136
   96    HB3  ALA  12           HB3      ALA  12   2.051   5.866   0.480
   97    H    THR  13           H        THR  13   4.084   9.108   1.662
   98    HA   THR  13           HA       THR  13   2.450   9.736   3.992
   99    HB   THR  13           HB       THR  13   3.894  11.772   2.311
  100    HG1  THR  13           HG1      THR  13   5.109  10.017   4.179
  101   HG21  THR  13          HG21      THR  13   4.504  12.680   4.553
  102   HG22  THR  13          HG22      THR  13   2.759  12.627   4.286
  103   HG23  THR  13          HG23      THR  13   3.527  11.397   5.311
  104    H    GLU  14           H        GLU  14   1.743   9.705   0.672
  105    HA   GLU  14           HA       GLU  14  -0.692  11.352   1.109
  106    HB2  GLU  14           HB2      GLU  14  -0.412  12.485  -0.979
  107    HB3  GLU  14           HB3      GLU  14   0.974  12.806   0.044
  108    HG2  GLU  14           HG2      GLU  14   0.960  10.733  -2.206
  109    HG3  GLU  14           HG3      GLU  14   1.413  12.413  -2.425
  110    H    ALA  15           H        ALA  15  -2.345  11.141  -0.493
  111    HA   ALA  15           HA       ALA  15  -2.399   8.681  -2.123
  112    HB1  ALA  15           HB1      ALA  15  -3.280   8.029   0.115
  113    HB2  ALA  15           HB2      ALA  15  -4.481   9.332   0.017
  114    HB3  ALA  15           HB3      ALA  15  -4.544   7.976  -1.127
  115    H    THR  16           H        THR  16  -4.173   8.669  -3.598
  116    HA   THR  16           HA       THR  16  -5.525  11.317  -4.092
  117    HB   THR  16           HB       THR  16  -4.928   9.221  -6.190
  118    HG1  THR  16           HG1      THR  16  -3.650  11.163  -6.898
  119   HG21  THR  16          HG21      THR  16  -6.960  10.607  -6.665
  120   HG22  THR  16          HG22      THR  16  -5.997  12.077  -6.412
  121   HG23  THR  16          HG23      THR  16  -5.637  10.977  -7.764
  122    H    ILE  17           H        ILE  17  -7.519  11.306  -3.281
  123    HA   ILE  17           HA       ILE  17  -9.169   8.831  -3.193
  124    HB   ILE  17           HB       ILE  17  -9.825  11.625  -2.172
  125   HG12  ILE  17          HG12      ILE  17  -8.874   9.197  -0.607
  126   HG13  ILE  17          HG13      ILE  17  -7.932  10.650  -0.917
  127   HG21  ILE  17          HG21      ILE  17 -11.217   8.947  -1.669
  128   HG22  ILE  17          HG22      ILE  17 -11.698  10.518  -0.996
  129   HG23  ILE  17          HG23      ILE  17 -11.840  10.247  -2.711
  130   HD11  ILE  17          HD11      ILE  17  -8.764  10.745   1.335
  131   HD12  ILE  17          HD12      ILE  17  -9.639  11.968   0.386
  132   HD13  ILE  17          HD13      ILE  17 -10.418  10.426   0.824
  133    H    VAL  18           H        VAL  18 -10.761   8.406  -4.697
  134    HA   VAL  18           HA       VAL  18 -11.449  10.620  -6.595
  135    HB   VAL  18           HB       VAL  18 -11.077   7.738  -7.422
  136   HG11  VAL  18          HG11      VAL  18 -11.058   8.755  -9.691
  137   HG12  VAL  18          HG12      VAL  18 -12.583   9.060  -8.843
  138   HG13  VAL  18          HG13      VAL  18 -11.384  10.346  -8.969
  139   HG21  VAL  18          HG21      VAL  18  -9.117  10.049  -7.569
  140   HG22  VAL  18          HG22      VAL  18  -8.874   8.468  -6.806
  141   HG23  VAL  18          HG23      VAL  18  -8.988   8.581  -8.565
  142    H    THR  19           H        THR  19 -13.478  11.059  -6.870
  143    HA   THR  19           HA       THR  19 -15.630   9.174  -5.998
  144    HB   THR  19           HB       THR  19 -15.749  12.098  -6.796
  145    HG1  THR  19           HG1      THR  19 -15.018  11.771  -4.738
  146   HG21  THR  19          HG21      THR  19 -17.954  10.147  -5.994
  147   HG22  THR  19          HG22      THR  19 -18.129  11.918  -5.998
  148   HG23  THR  19          HG23      THR  19 -17.844  11.065  -7.517
  149    H    LEU  20           H        LEU  20 -16.729   7.994  -7.379
  150    HA   LEU  20           HA       LEU  20 -16.267   8.340 -10.313
  151    HB2  LEU  20           HB2      LEU  20 -16.407   5.826  -8.617
  152    HB3  LEU  20           HB3      LEU  20 -16.212   5.878 -10.364
  153    HG   LEU  20           HG       LEU  20 -14.215   7.016  -8.358
  154   HD11  LEU  20          HD11      LEU  20 -14.345   4.521  -8.373
  155   HD12  LEU  20          HD12      LEU  20 -13.948   4.548 -10.109
  156   HD13  LEU  20          HD13      LEU  20 -12.795   5.177  -8.926
  157   HD21  LEU  20          HD21      LEU  20 -12.727   7.084 -10.401
  158   HD22  LEU  20          HD22      LEU  20 -14.159   6.752 -11.389
  159   HD23  LEU  20          HD23      LEU  20 -14.055   8.245 -10.429
  160    H    ASP  21           H        ASP  21 -18.665   8.731  -8.266
  161    HA   ASP  21           HA       ASP  21 -20.858   8.029  -7.997
  162    HB2  ASP  21           HB2      ASP  21 -20.449  10.375  -8.986
  163    HB3  ASP  21           HB3      ASP  21 -21.143   9.724 -10.463
  164    H    SER  22           H        SER  22 -21.637   8.268 -11.447
  165    HA   SER  22           HA       SER  22 -23.132   6.543 -12.059
  166    HB2  SER  22           HB2      SER  22 -20.540   6.670 -13.617
  167    HB3  SER  22           HB3      SER  22 -22.129   6.243 -14.268
  168    HG   SER  22           HG       SER  22 -22.832   8.346 -13.888
  169    H    ASP  23           H        ASP  23 -19.762   5.292 -11.628
  170    HA   ASP  23           HA       ASP  23 -20.542   2.774 -10.678
  171    HB2  ASP  23           HB2      ASP  23 -21.248   2.190 -12.946
  172    HB3  ASP  23           HB3      ASP  23 -19.744   2.790 -13.621
  173    H    ASN  24           H        ASN  24 -17.846   2.866 -12.908
  174    HA   ASN  24           HA       ASN  24 -15.950   3.787 -10.820
  175    HB2  ASN  24           HB2      ASN  24 -16.169   1.329 -11.659
  176    HB3  ASN  24           HB3      ASN  24 -15.452   1.862 -13.156
  177   HD21  ASN  24          HD22      ASN  24 -14.815   0.776  -9.984
  178   HD22  ASN  24          HD21      ASN  24 -13.089   0.868 -10.295
  179    H    ILE  25           H        ILE  25 -17.397   5.221 -13.363
  180    HA   ILE  25           HA       ILE  25 -14.990   5.919 -14.921
  181    HB   ILE  25           HB       ILE  25 -16.597   6.330 -16.720
  182   HG12  ILE  25          HG12      ILE  25 -18.745   5.314 -14.788
  183   HG13  ILE  25          HG13      ILE  25 -18.561   6.998 -15.275
  184   HG21  ILE  25          HG21      ILE  25 -17.017   3.609 -15.412
  185   HG22  ILE  25          HG22      ILE  25 -17.067   3.998 -17.143
  186   HG23  ILE  25          HG23      ILE  25 -15.539   4.098 -16.265
  187   HD11  ILE  25          HD11      ILE  25 -19.289   4.667 -17.086
  188   HD12  ILE  25          HD12      ILE  25 -20.314   6.022 -16.586
  189   HD13  ILE  25          HD13      ILE  25 -18.930   6.314 -17.658
  190    H    LEU  26           H        LEU  26 -17.107   7.630 -12.757
  191    HA   LEU  26           HA       LEU  26 -17.227   9.986 -14.317
  192    HB2  LEU  26           HB2      LEU  26 -18.726   9.437 -12.386
  193    HB3  LEU  26           HB3      LEU  26 -17.405   9.889 -11.297
  194    HG   LEU  26           HG       LEU  26 -17.418  12.196 -12.207
  195   HD11  LEU  26          HD11      LEU  26 -19.871  11.235 -13.754
  196   HD12  LEU  26          HD12      LEU  26 -19.372  12.927 -13.562
  197   HD13  LEU  26          HD13      LEU  26 -18.349  11.829 -14.476
  198   HD21  LEU  26          HD21      LEU  26 -18.842  11.468 -10.249
  199   HD22  LEU  26          HD22      LEU  26 -19.406  12.907 -11.109
  200   HD23  LEU  26          HD23      LEU  26 -20.205  11.352 -11.398
  201    H    LEU  27           H        LEU  27 -14.530   9.070 -12.055
  202    HA   LEU  27           HA       LEU  27 -12.617   9.975 -11.628
  203    HB2  LEU  27           HB2      LEU  27 -12.892  10.463 -14.588
  204    HB3  LEU  27           HB3      LEU  27 -11.462  10.984 -13.712
  205    HG   LEU  27           HG       LEU  27 -11.148   8.640 -12.851
  206   HD11  LEU  27          HD11      LEU  27 -12.099   6.786 -14.168
  207   HD12  LEU  27          HD12      LEU  27 -13.383   7.647 -13.339
  208   HD13  LEU  27          HD13      LEU  27 -13.100   7.920 -15.076
  209   HD21  LEU  27          HD21      LEU  27  -9.822   9.601 -14.687
  210   HD22  LEU  27          HD22      LEU  27 -10.125   7.882 -14.967
  211   HD23  LEU  27          HD23      LEU  27 -11.057   9.101 -15.861
  212    H    SER  28           H        SER  28 -13.816  11.422 -10.116
  213    HA   SER  28           HA       SER  28 -12.788  14.214 -10.560
  214    HB2  SER  28           HB2      SER  28 -15.179  14.329 -10.222
  215    HB3  SER  28           HB3      SER  28 -15.069  13.301  -8.775
  216    HG   SER  28           HG       SER  28 -15.051  15.788  -8.608
  217    H    GLU  29           H        GLU  29 -10.764  14.277  -9.647
  218    HA   GLU  29           HA       GLU  29 -10.174  12.425  -7.420
  219    HB2  GLU  29           HB2      GLU  29  -8.206  13.833  -9.232
  220    HB3  GLU  29           HB3      GLU  29  -7.936  12.460  -8.144
  221    HG2  GLU  29           HG2      GLU  29  -9.403  11.064  -9.573
  222    HG3  GLU  29           HG3      GLU  29  -9.600  12.406 -10.688
  223    H    GLU  30           H        GLU  30  -9.239  13.010  -5.574
  224    HA   GLU  30           HA       GLU  30  -8.450  15.855  -5.061
  225    HB2  GLU  30           HB2      GLU  30  -9.462  13.812  -3.052
  226    HB3  GLU  30           HB3      GLU  30  -9.111  15.497  -2.731
  227    HG2  GLU  30           HG2      GLU  30 -11.362  14.459  -4.521
  228    HG3  GLU  30           HG3      GLU  30 -11.536  14.906  -2.835
  229    H    GLN  31           H        GLN  31  -6.304  16.166  -4.328
  230    HA   GLN  31           HA       GLN  31  -4.567  13.766  -3.859
  231    HB2  GLN  31           HB2      GLN  31  -3.979  16.641  -4.601
  232    HB3  GLN  31           HB3      GLN  31  -2.792  15.525  -3.937
  233    HG2  GLN  31           HG2      GLN  31  -3.716  13.924  -5.908
  234    HG3  GLN  31           HG3      GLN  31  -4.157  15.476  -6.631
  235   HE21  GLN  31          HE21      GLN  31  -1.412  13.946  -4.875
  236   HE22  GLN  31          HE22      GLN  31  -0.158  14.608  -5.885
  237    H    VAL  32           H        VAL  32  -4.184  13.267  -1.717
  238    HA   VAL  32           HA       VAL  32  -4.578  15.372   0.378
  239    HB   VAL  32           HB       VAL  32  -5.864  13.849   1.712
  240   HG11  VAL  32          HG11      VAL  32  -7.107  13.891  -1.060
  241   HG12  VAL  32          HG12      VAL  32  -7.936  13.783   0.502
  242   HG13  VAL  32          HG13      VAL  32  -7.076  15.271   0.064
  243   HG21  VAL  32          HG21      VAL  32  -4.914  11.675   0.980
  244   HG22  VAL  32          HG22      VAL  32  -6.670  11.694   0.953
  245   HG23  VAL  32          HG23      VAL  32  -5.770  11.841  -0.572
  246    H    ASP  33           H        ASP  33  -3.803  14.899   2.476
  247    HA   ASP  33           HA       ASP  33  -1.275  13.438   2.644
  248    HB2  ASP  33           HB2      ASP  33  -1.797  15.590   3.851
  249    HB3  ASP  33           HB3      ASP  33  -2.928  14.717   4.861
  250    H    VAL  34           H        VAL  34  -0.831  11.573   3.810
  251    HA   VAL  34           HA       VAL  34  -2.710   9.491   3.774
  252    HB   VAL  34           HB       VAL  34  -0.295   9.168   3.754
  253   HG11  VAL  34          HG11      VAL  34  -0.347   9.655   6.765
  254   HG12  VAL  34          HG12      VAL  34   1.034   9.097   5.810
  255   HG13  VAL  34          HG13      VAL  34   0.394  10.729   5.562
  256   HG21  VAL  34          HG21      VAL  34  -1.865   7.292   4.316
  257   HG22  VAL  34          HG22      VAL  34  -0.207   7.085   4.907
  258   HG23  VAL  34          HG23      VAL  34  -1.492   7.559   6.030
  259    H    GLU  35           H        GLU  35  -2.350  11.860   6.344
  260    HA   GLU  35           HA       GLU  35  -3.735  10.287   8.362
  261    HB2  GLU  35           HB2      GLU  35  -2.183  12.345   8.577
  262    HB3  GLU  35           HB3      GLU  35  -3.628  13.300   8.204
  263    HG2  GLU  35           HG2      GLU  35  -4.739  12.377  10.217
  264    HG3  GLU  35           HG3      GLU  35  -3.355  11.315  10.505
  265    H    LEU  36           H        LEU  36  -4.894  11.773   5.489
  266    HA   LEU  36           HA       LEU  36  -7.610  12.294   6.574
  267    HB2  LEU  36           HB2      LEU  36  -6.464  13.109   3.906
  268    HB3  LEU  36           HB3      LEU  36  -7.880  13.762   4.723
  269    HG   LEU  36           HG       LEU  36  -4.972  14.127   5.574
  270   HD11  LEU  36          HD11      LEU  36  -5.678  15.344   3.550
  271   HD12  LEU  36          HD12      LEU  36  -7.002  16.093   4.463
  272   HD13  LEU  36          HD13      LEU  36  -5.304  16.427   4.897
  273   HD21  LEU  36          HD21      LEU  36  -5.802  15.764   7.207
  274   HD22  LEU  36          HD22      LEU  36  -7.475  15.333   6.807
  275   HD23  LEU  36          HD23      LEU  36  -6.404  14.146   7.579
  276    H    VAL  37           H        VAL  37  -6.130   9.751   5.020
  277    HA   VAL  37           HA       VAL  37  -8.629   8.896   3.620
  278    HB   VAL  37           HB       VAL  37  -6.702   8.684   2.242
  279   HG11  VAL  37          HG11      VAL  37  -4.876   8.546   3.822
  280   HG12  VAL  37          HG12      VAL  37  -5.438   6.965   4.416
  281   HG13  VAL  37          HG13      VAL  37  -4.826   7.142   2.758
  282   HG21  VAL  37          HG21      VAL  37  -8.420   6.906   2.104
  283   HG22  VAL  37          HG22      VAL  37  -6.808   6.362   1.609
  284   HG23  VAL  37          HG23      VAL  37  -7.446   5.889   3.189
  285    H    GLN  38           H        GLN  38  -9.732   7.030   4.200
  286    HA   GLN  38           HA       GLN  38  -8.980   5.683   6.751
  287    HB2  GLN  38           HB2      GLN  38 -11.353   5.916   7.484
  288    HB3  GLN  38           HB3      GLN  38 -10.430   7.413   7.432
  289    HG2  GLN  38           HG2      GLN  38 -11.588   8.045   5.329
  290    HG3  GLN  38           HG3      GLN  38 -12.470   6.507   5.346
  291   HE21  GLN  38          HE22      GLN  38 -14.052   6.258   7.076
  292   HE22  GLN  38          HE21      GLN  38 -14.608   7.727   7.895
  293    H    ARG  39           H        ARG  39 -10.365   3.788   7.229
  294    HA   ARG  39           HA       ARG  39  -9.803   1.879   5.217
  295    HB2  ARG  39           HB2      ARG  39 -10.263   0.274   6.908
  296    HB3  ARG  39           HB3      ARG  39  -9.525   1.669   7.683
  297    HG2  ARG  39           HG2      ARG  39 -12.039   2.362   8.148
  298    HG3  ARG  39           HG3      ARG  39 -12.391   0.671   7.800
  299    HD2  ARG  39           HD2      ARG  39 -10.739  -0.023   9.545
  300    HD3  ARG  39           HD3      ARG  39 -10.411   1.674   9.887
  301    HE   ARG  39           HE       ARG  39 -12.451   1.900  10.988
  302   HH11  ARG  39          HH11      ARG  39 -12.450  -1.296   9.466
  303   HH12  ARG  39          HH12      ARG  39 -13.691  -1.853  10.576
  304   HH21  ARG  39          HH21      ARG  39 -14.070   1.115  12.190
  305   HH22  ARG  39          HH22      ARG  39 -14.898  -0.343  11.625
  306    H    GLY  40           H        GLY  40 -11.986   3.567   4.323
  307    HA2  GLY  40           HA2      GLY  40 -13.503   1.423   3.019
  308    HA3  GLY  40           HA3      GLY  40 -14.480   2.628   3.871
  309    H    ASP  41           H        ASP  41 -11.596   4.025   2.565
  310    HA   ASP  41           HA       ASP  41 -13.078   5.360   0.390
  311    HB2  ASP  41           HB2      ASP  41 -10.286   5.664   1.542
  312    HB3  ASP  41           HB3      ASP  41 -10.841   6.545   0.121
  313    H    ILE  42           H        ILE  42 -12.266   5.470  -1.776
  314    HA   ILE  42           HA       ILE  42 -10.597   3.134  -2.617
  315    HB   ILE  42           HB       ILE  42 -12.686   4.427  -4.375
  316   HG12  ILE  42          HG12      ILE  42 -12.804   1.868  -2.721
  317   HG13  ILE  42          HG13      ILE  42 -13.854   3.273  -2.572
  318   HG21  ILE  42          HG21      ILE  42 -11.097   1.840  -4.687
  319   HG22  ILE  42          HG22      ILE  42 -12.182   2.578  -5.884
  320   HG23  ILE  42          HG23      ILE  42 -10.667   3.369  -5.471
  321   HD11  ILE  42          HD11      ILE  42 -14.628   2.795  -4.976
  322   HD12  ILE  42          HD12      ILE  42 -13.813   1.218  -4.793
  323   HD13  ILE  42          HD13      ILE  42 -15.132   1.666  -3.708
  324    H    ILE  43           H        ILE  43  -8.723   3.565  -3.369
  325    HA   ILE  43           HA       ILE  43  -7.944   6.321  -4.129
  326    HB   ILE  43           HB       ILE  43  -6.389   4.044  -2.820
  327   HG12  ILE  43          HG12      ILE  43  -8.008   4.735  -1.194
  328   HG13  ILE  43          HG13      ILE  43  -6.425   5.312  -0.721
  329   HG21  ILE  43          HG21      ILE  43  -4.875   5.513  -4.015
  330   HG22  ILE  43          HG22      ILE  43  -5.591   6.944  -3.257
  331   HG23  ILE  43          HG23      ILE  43  -4.686   5.767  -2.285
  332   HD11  ILE  43          HD11      ILE  43  -8.611   7.010  -2.000
  333   HD12  ILE  43          HD12      ILE  43  -8.157   6.992  -0.299
  334   HD13  ILE  43          HD13      ILE  43  -7.009   7.603  -1.504
  335    H    LYS  44           H        LYS  44  -7.068   6.600  -6.167
  336    HA   LYS  44           HA       LYS  44  -6.161   4.184  -7.648
  337    HB2  LYS  44           HB2      LYS  44  -7.671   6.046  -8.659
  338    HB3  LYS  44           HB3      LYS  44  -6.154   6.932  -8.860
  339    HG2  LYS  44           HG2      LYS  44  -5.189   5.015 -10.098
  340    HG3  LYS  44           HG3      LYS  44  -6.662   4.068  -9.837
  341    HD2  LYS  44           HD2      LYS  44  -6.750   6.695 -11.298
  342    HD3  LYS  44           HD3      LYS  44  -6.286   5.196 -12.118
  343    HE2  LYS  44           HE2      LYS  44  -8.398   4.143 -11.643
  344    HE3  LYS  44           HE3      LYS  44  -8.918   5.471 -10.608
  345    HZ1  LYS  44           HZ1      LYS  44  -8.456   5.522 -13.544
  346    HZ2  LYS  44           HZ2      LYS  44  -9.883   5.759 -12.760
  347    HZ3  LYS  44           HZ3      LYS  44  -8.692   6.907 -12.666
  348    H    VAL  45           H        VAL  45  -4.121   3.611  -7.947
  349    HA   VAL  45           HA       VAL  45  -1.992   5.323  -6.741
  350    HB   VAL  45           HB       VAL  45  -2.460   3.055  -5.774
  351   HG11  VAL  45          HG11      VAL  45  -1.118   1.989  -8.291
  352   HG12  VAL  45          HG12      VAL  45  -1.610   1.068  -6.858
  353   HG13  VAL  45          HG13      VAL  45  -2.834   1.825  -7.889
  354   HG21  VAL  45          HG21      VAL  45  -0.101   2.435  -5.519
  355   HG22  VAL  45          HG22      VAL  45   0.351   3.439  -6.909
  356   HG23  VAL  45          HG23      VAL  45  -0.285   4.196  -5.429
  357    H    VAL  46           H        VAL  46  -0.290   6.021  -7.912
  358    HA   VAL  46           HA       VAL  46  -0.430   5.718 -10.842
  359    HB   VAL  46           HB       VAL  46   1.246   7.527 -10.895
  360   HG11  VAL  46          HG11      VAL  46  -1.112   8.188  -9.089
  361   HG12  VAL  46          HG12      VAL  46  -0.199   9.311 -10.111
  362   HG13  VAL  46          HG13      VAL  46  -1.175   8.037 -10.860
  363   HG21  VAL  46          HG21      VAL  46   1.042   7.577  -7.854
  364   HG22  VAL  46          HG22      VAL  46   2.475   7.102  -8.799
  365   HG23  VAL  46          HG23      VAL  46   1.869   8.759  -8.880
  366    HA   PRO  47           HA       PRO  47   3.177   3.059 -11.224
  367    HB2  PRO  47           HB2      PRO  47   4.475   4.142 -13.407
  368    HB3  PRO  47           HB3      PRO  47   3.095   3.021 -13.490
  369    HG2  PRO  47           HG2      PRO  47   3.096   6.036 -13.695
  370    HG3  PRO  47           HG3      PRO  47   2.195   4.844 -14.693
  371    HD2  PRO  47           HD2      PRO  47   1.005   6.190 -12.648
  372    HD3  PRO  47           HD3      PRO  47   0.605   4.481 -12.976
  373    H    GLY  48           H        GLY  48   5.273   3.035 -10.560
  374    HA2  GLY  48           HA2      GLY  48   7.116   3.720  -9.320
  375    HA3  GLY  48           HA3      GLY  48   6.869   5.372  -9.912
  376    H    GLY  49           H        GLY  49   3.912   4.786  -8.605
  377    HA2  GLY  49           HA2      GLY  49   4.362   6.246  -6.197
  378    HA3  GLY  49           HA3      GLY  49   2.870   5.440  -6.681
  379    H    LYS  50           H        LYS  50   4.095   5.639  -4.060
  380    HA   LYS  50           HA       LYS  50   4.570   2.767  -3.368
  381    HB2  LYS  50           HB2      LYS  50   5.196   5.328  -1.857
  382    HB3  LYS  50           HB3      LYS  50   5.307   3.699  -1.157
  383    HG2  LYS  50           HG2      LYS  50   7.006   3.051  -2.726
  384    HG3  LYS  50           HG3      LYS  50   6.891   4.584  -3.605
  385    HD2  LYS  50           HD2      LYS  50   7.762   5.835  -1.748
  386    HD3  LYS  50           HD3      LYS  50   7.618   4.447  -0.647
  387    HE2  LYS  50           HE2      LYS  50   9.318   3.220  -1.837
  388    HE3  LYS  50           HE3      LYS  50   9.431   4.459  -3.099
  389    HZ1  LYS  50           HZ1      LYS  50  11.169   4.492  -1.294
  390    HZ2  LYS  50           HZ2      LYS  50  10.452   5.933  -1.577
  391    HZ3  LYS  50           HZ3      LYS  50  10.034   5.061  -0.249
  392    H    PHE  51           H        PHE  51   3.244   1.697  -1.965
  393    HA   PHE  51           HA       PHE  51   0.536   2.690  -1.766
  394    HB2  PHE  51           HB2      PHE  51   1.902   0.155  -0.875
  395    HB3  PHE  51           HB3      PHE  51   0.247   0.514  -0.405
  396    HD1  PHE  51           HD2      PHE  51  -1.581   0.613  -2.013
  397    HD2  PHE  51           HD1      PHE  51   2.424  -0.323  -3.282
  398    HE1  PHE  51           HE2      PHE  51  -2.440  -0.173  -4.194
  399    HE2  PHE  51           HE1      PHE  51   1.568  -1.113  -5.455
  400    HZ   PHE  51           HZ       PHE  51  -0.882  -1.062  -5.921
  401    HA   PRO  52           HA       PRO  52   1.195   4.613   2.275
  402    HB2  PRO  52           HB2      PRO  52  -1.215   5.842   2.599
  403    HB3  PRO  52           HB3      PRO  52   0.000   6.406   1.419
  404    HG2  PRO  52           HG2      PRO  52  -2.441   4.695   0.916
  405    HG3  PRO  52           HG3      PRO  52  -1.843   6.090  -0.031
  406    HD2  PRO  52           HD2      PRO  52  -1.349   3.467  -0.715
  407    HD3  PRO  52           HD3      PRO  52  -0.220   4.802  -1.088
  408    H    VAL  53           H        VAL  53  -1.238   2.209   1.633
  409    HA   VAL  53           HA       VAL  53  -1.427   1.262   4.345
  410    HB   VAL  53           HB       VAL  53  -3.876   1.320   4.488
  411   HG11  VAL  53          HG11      VAL  53  -2.764   4.145   4.375
  412   HG12  VAL  53          HG12      VAL  53  -4.131   3.548   5.330
  413   HG13  VAL  53          HG13      VAL  53  -2.488   2.994   5.702
  414   HG21  VAL  53          HG21      VAL  53  -3.748   3.344   2.223
  415   HG22  VAL  53          HG22      VAL  53  -4.455   1.711   2.131
  416   HG23  VAL  53          HG23      VAL  53  -5.176   2.940   3.191
  417    H    ASP  54           H        ASP  54  -3.078  -0.716   4.277
  418    HA   ASP  54           HA       ASP  54  -2.489  -2.205   1.780
  419    HB2  ASP  54           HB2      ASP  54  -2.435  -4.132   2.948
  420    HB3  ASP  54           HB3      ASP  54  -1.773  -3.012   4.108
  421    H    GLY  55           H        GLY  55  -4.114  -3.473   0.710
  422    HA2  GLY  55           HA2      GLY  55  -6.898  -3.325   1.363
  423    HA3  GLY  55           HA3      GLY  55  -6.513  -2.024   0.247
  424    H    ARG  56           H        ARG  56  -8.244  -3.259  -0.824
  425    HA   ARG  56           HA       ARG  56  -7.299  -5.612  -2.408
  426    HB2  ARG  56           HB2      ARG  56  -9.275  -5.783  -0.837
  427    HB3  ARG  56           HB3      ARG  56 -10.166  -4.737  -1.946
  428    HG2  ARG  56           HG2      ARG  56  -9.979  -6.424  -3.724
  429    HG3  ARG  56           HG3      ARG  56  -8.852  -7.377  -2.745
  430    HD2  ARG  56           HD2      ARG  56 -11.032  -8.418  -2.671
  431    HD3  ARG  56           HD3      ARG  56 -10.596  -7.824  -1.071
  432    HE   ARG  56           HE       ARG  56 -12.629  -6.636  -2.934
  433   HH11  ARG  56          HH11      ARG  56 -11.471  -6.761   0.452
  434   HH12  ARG  56          HH12      ARG  56 -12.818  -5.778   0.937
  435   HH21  ARG  56          HH21      ARG  56 -14.143  -5.437  -2.206
  436   HH22  ARG  56          HH22      ARG  56 -14.246  -4.941  -0.532
  437    H    VAL  57           H        VAL  57  -7.257  -5.624  -4.571
  438    HA   VAL  57           HA       VAL  57  -7.279  -3.013  -5.983
  439    HB   VAL  57           HB       VAL  57  -6.217  -5.724  -6.886
  440   HG11  VAL  57          HG11      VAL  57  -5.729  -2.909  -7.945
  441   HG12  VAL  57          HG12      VAL  57  -4.934  -4.394  -8.528
  442   HG13  VAL  57          HG13      VAL  57  -6.663  -4.187  -8.750
  443   HG21  VAL  57          HG21      VAL  57  -4.632  -3.444  -5.648
  444   HG22  VAL  57          HG22      VAL  57  -4.904  -5.046  -4.932
  445   HG23  VAL  57          HG23      VAL  57  -3.951  -4.894  -6.409
  446    H    ILE  58           H        ILE  58  -8.892  -2.565  -7.420
  447    HA   ILE  58           HA       ILE  58 -10.581  -4.789  -8.511
  448    HB   ILE  58           HB       ILE  58 -12.600  -3.310  -7.827
  449   HG12  ILE  58          HG12      ILE  58 -10.650  -2.333  -5.712
  450   HG13  ILE  58          HG13      ILE  58 -10.984  -1.377  -7.169
  451   HG21  ILE  58          HG21      ILE  58 -12.823  -4.405  -5.699
  452   HG22  ILE  58          HG22      ILE  58 -12.061  -5.520  -6.835
  453   HG23  ILE  58          HG23      ILE  58 -11.081  -4.705  -5.594
  454   HD11  ILE  58          HD11      ILE  58 -12.341  -0.565  -5.346
  455   HD12  ILE  58          HD12      ILE  58 -13.367  -1.263  -6.612
  456   HD13  ILE  58          HD13      ILE  58 -13.069  -2.166  -5.101
  457    H    GLU  59           H        GLU  59  -8.622  -2.886  -9.740
  458    HA   GLU  59           HA       GLU  59  -9.958  -2.947 -12.205
  459    HB2  GLU  59           HB2      GLU  59 -10.445  -0.459 -10.904
  460    HB3  GLU  59           HB3      GLU  59  -9.186  -0.113 -12.050
  461    HG2  GLU  59           HG2      GLU  59 -11.925  -1.314 -12.610
  462    HG3  GLU  59           HG3      GLU  59 -11.352   0.280 -13.066
  463    H    GLY  60           H        GLY  60  -8.423  -3.092 -13.834
  464    HA2  GLY  60           HA2      GLY  60  -6.532  -2.395 -15.011
  465    HA3  GLY  60           HA3      GLY  60  -5.876  -1.635 -13.571
  466    H    HIS  61           H        HIS  61  -4.014  -2.653 -14.603
  467    HA   HIS  61           HA       HIS  61  -3.423  -5.396 -13.601
  468    HB2  HIS  61           HB2      HIS  61  -2.572  -5.795 -16.128
  469    HB3  HIS  61           HB3      HIS  61  -4.124  -6.301 -15.499
  470    HD1  HIS  61           HD1      HIS  61  -6.143  -5.646 -16.922
  471    HD2  HIS  61           HD2      HIS  61  -2.798  -3.145 -17.449
  472    HE1  HIS  61           HE1      HIS  61  -6.735  -4.050 -18.813
  473    H    SER  62           H        SER  62  -1.640  -5.075 -12.483
  474    HA   SER  62           HA       SER  62   0.657  -3.673 -13.701
  475    HB2  SER  62           HB2      SER  62  -0.939  -2.051 -12.381
  476    HB3  SER  62           HB3      SER  62  -0.154  -2.762 -10.956
  477    HG   SER  62           HG       SER  62   0.703  -0.823 -12.216
  478    H    MET  63           H        MET  63   2.525  -3.548 -12.004
  479    HA   MET  63           HA       MET  63   2.769  -6.202 -10.696
  480    HB2  MET  63           HB2      MET  63   3.734  -6.274 -12.933
  481    HB3  MET  63           HB3      MET  63   4.767  -4.885 -12.576
  482    HG2  MET  63           HG2      MET  63   6.092  -6.074 -11.097
  483    HG3  MET  63           HG3      MET  63   4.882  -7.334 -10.807
  484    HE1  MET  63           HE1      MET  63   4.583  -9.473 -12.119
  485    HE2  MET  63           HE2      MET  63   3.938  -8.506 -13.466
  486    HE3  MET  63           HE3      MET  63   5.175  -9.739 -13.772
  487    H    VAL  64           H        VAL  64   3.602  -6.156  -8.763
  488    HA   VAL  64           HA       VAL  64   4.499  -3.549  -7.598
  489    HB   VAL  64           HB       VAL  64   2.751  -5.725  -6.400
  490   HG11  VAL  64          HG11      VAL  64   3.636  -3.073  -5.179
  491   HG12  VAL  64          HG12      VAL  64   2.414  -4.167  -4.501
  492   HG13  VAL  64          HG13      VAL  64   4.088  -4.697  -4.614
  493   HG21  VAL  64          HG21      VAL  64   2.148  -2.862  -7.264
  494   HG22  VAL  64          HG22      VAL  64   1.535  -4.340  -8.031
  495   HG23  VAL  64          HG23      VAL  64   1.019  -3.920  -6.391
  496    H    ASP  65           H        ASP  65   6.196  -3.442  -6.246
  497    HA   ASP  65           HA       ASP  65   7.956  -5.823  -6.095
  498    HB2  ASP  65           HB2      ASP  65   8.550  -3.497  -7.067
  499    HB3  ASP  65           HB3      ASP  65   8.668  -2.960  -5.398
  500    H    GLU  66           H        GLU  66   7.568  -7.083  -4.371
  501    HA   GLU  66           HA       GLU  66   6.739  -5.887  -1.758
  502    HB2  GLU  66           HB2      GLU  66   6.302  -8.717  -2.773
  503    HB3  GLU  66           HB3      GLU  66   5.635  -7.983  -1.308
  504    HG2  GLU  66           HG2      GLU  66   4.438  -6.320  -2.817
  505    HG3  GLU  66           HG3      GLU  66   4.919  -7.324  -4.188
  506    H    SER  67           H        SER  67   9.475  -7.101  -3.107
  507    HA   SER  67           HA       SER  67  10.396  -9.180  -1.597
  508    HB2  SER  67           HB2      SER  67  12.674  -8.530  -2.305
  509    HB3  SER  67           HB3      SER  67  11.477  -8.477  -3.596
  510    HG   SER  67           HG       SER  67  12.728  -6.680  -3.689
  511    H    LEU  68           H        LEU  68  10.623  -5.804  -0.404
  512    HA   LEU  68           HA       LEU  68  12.199  -6.733   1.904
  513    HB2  LEU  68           HB2      LEU  68  12.381  -4.458   0.873
  514    HB3  LEU  68           HB3      LEU  68  10.734  -4.101   1.340
  515    HG   LEU  68           HG       LEU  68  12.451  -2.993   2.695
  516   HD11  LEU  68          HD11      LEU  68  10.966  -4.881   4.540
  517   HD12  LEU  68          HD12      LEU  68  11.495  -3.223   4.830
  518   HD13  LEU  68          HD13      LEU  68  10.185  -3.537   3.678
  519   HD21  LEU  68          HD21      LEU  68  13.818  -4.156   4.314
  520   HD22  LEU  68          HD22      LEU  68  13.151  -5.726   3.828
  521   HD23  LEU  68          HD23      LEU  68  14.154  -4.791   2.696
  522    H    ILE  69           H        ILE  69   8.856  -5.926   1.210
  523    HA   ILE  69           HA       ILE  69   7.804  -5.935   3.860
  524    HB   ILE  69           HB       ILE  69   6.293  -6.600   1.299
  525   HG12  ILE  69          HG12      ILE  69   7.564  -4.485   0.943
  526   HG13  ILE  69          HG13      ILE  69   5.826  -4.320   0.888
  527   HG21  ILE  69          HG21      ILE  69   4.441  -5.409   2.636
  528   HG22  ILE  69          HG22      ILE  69   4.906  -7.026   3.189
  529   HG23  ILE  69          HG23      ILE  69   5.483  -5.591   4.048
  530   HD11  ILE  69          HD11      ILE  69   7.507  -3.594   3.316
  531   HD12  ILE  69          HD12      ILE  69   6.903  -2.455   2.090
  532   HD13  ILE  69          HD13      ILE  69   5.755  -3.349   3.096
  533    H    THR  70           H        THR  70   7.564  -8.461   1.342
  534    HA   THR  70           HA       THR  70   6.873 -10.481   3.410
  535    HB   THR  70           HB       THR  70   5.817 -11.659   1.547
  536    HG1  THR  70           HG1      THR  70   5.843 -10.737  -0.463
  537   HG21  THR  70          HG21      THR  70   4.024 -10.153   1.058
  538   HG22  THR  70          HG22      THR  70   4.581  -9.705   2.686
  539   HG23  THR  70          HG23      THR  70   5.041  -8.722   1.282
  540    H    GLY  71           H        GLY  71   9.604  -9.705   1.647
  541    HA2  GLY  71           HA2      GLY  71  11.661 -10.763   1.710
  542    HA3  GLY  71           HA3      GLY  71  10.923 -12.234   2.374
  543    H    GLU  72           H        GLU  72   9.504 -10.929  -0.479
  544    HA   GLU  72           HA       GLU  72  10.206 -13.103  -2.279
  545    HB2  GLU  72           HB2      GLU  72   9.172 -10.305  -2.869
  546    HB3  GLU  72           HB3      GLU  72   9.238 -11.582  -4.045
  547    HG2  GLU  72           HG2      GLU  72   7.646 -11.895  -1.487
  548    HG3  GLU  72           HG3      GLU  72   7.013 -10.991  -2.856
  549    H    ALA  73           H        ALA  73  11.098 -12.155  -4.561
  550    HA   ALA  73           HA       ALA  73  13.608 -10.644  -4.217
  551    HB1  ALA  73           HB1      ALA  73  13.580 -13.518  -5.223
  552    HB2  ALA  73           HB2      ALA  73  14.976 -12.418  -5.244
  553    HB3  ALA  73           HB3      ALA  73  14.282 -12.920  -3.695
  554    H    MET  74           H        MET  74  11.178 -12.012  -6.303
  555    HA   MET  74           HA       MET  74  11.746  -9.864  -8.288
  556    HB2  MET  74           HB2      MET  74  10.752 -11.322 -10.034
  557    HB3  MET  74           HB3      MET  74  12.230 -11.984  -9.338
  558    HG2  MET  74           HG2      MET  74  10.924 -13.509  -7.936
  559    HG3  MET  74           HG3      MET  74   9.413 -12.845  -8.575
  560    HE1  MET  74           HE1      MET  74   8.849 -15.505  -8.939
  561    HE2  MET  74           HE2      MET  74   9.920 -16.582  -9.866
  562    HE3  MET  74           HE3      MET  74  10.489 -15.863  -8.350
  563    HA   PRO  75           HA       PRO  75   7.842  -8.275  -7.194
  564    HB2  PRO  75           HB2      PRO  75   6.988  -6.900  -9.352
  565    HB3  PRO  75           HB3      PRO  75   8.439  -6.451  -8.423
  566    HG2  PRO  75           HG2      PRO  75   8.344  -8.116 -10.964
  567    HG3  PRO  75           HG3      PRO  75   9.352  -6.665 -10.632
  568    HD2  PRO  75           HD2      PRO  75  10.337  -9.158 -10.298
  569    HD3  PRO  75           HD3      PRO  75  10.723  -7.872  -9.116
  570    H    VAL  76           H        VAL  76   5.545  -8.114  -7.598
  571    HA   VAL  76           HA       VAL  76   4.431 -10.748  -8.456
  572    HB   VAL  76           HB       VAL  76   3.695  -8.868  -6.185
  573   HG11  VAL  76          HG11      VAL  76   1.652 -10.015  -6.992
  574   HG12  VAL  76          HG12      VAL  76   2.488 -11.581  -6.863
  575   HG13  VAL  76          HG13      VAL  76   2.165 -10.604  -5.413
  576   HG21  VAL  76          HG21      VAL  76   5.758 -10.145  -5.731
  577   HG22  VAL  76          HG22      VAL  76   4.433 -10.760  -4.744
  578   HG23  VAL  76          HG23      VAL  76   4.937 -11.657  -6.187
  579    H    ALA  77           H        ALA  77   2.674 -10.869  -9.802
  580    HA   ALA  77           HA       ALA  77   1.683  -8.439 -11.057
  581    HB1  ALA  77           HB1      ALA  77   0.405 -10.091 -12.426
  582    HB2  ALA  77           HB2      ALA  77   2.148 -10.401 -12.392
  583    HB3  ALA  77           HB3      ALA  77   1.046 -11.394 -11.408
  584    H    LYS  78           H        LYS  78  -0.222  -7.500 -10.903
  585    HA   LYS  78           HA       LYS  78  -2.379  -8.562  -9.095
  586    HB2  LYS  78           HB2      LYS  78  -1.721  -5.641  -9.594
  587    HB3  LYS  78           HB3      LYS  78  -2.861  -6.281  -8.417
  588    HG2  LYS  78           HG2      LYS  78   0.176  -6.551  -8.321
  589    HG3  LYS  78           HG3      LYS  78  -0.797  -5.417  -7.398
  590    HD2  LYS  78           HD2      LYS  78  -1.853  -7.197  -6.130
  591    HD3  LYS  78           HD3      LYS  78  -1.039  -8.444  -7.097
  592    HE2  LYS  78           HE2      LYS  78   1.151  -7.722  -6.333
  593    HE3  LYS  78           HE3      LYS  78   0.463  -6.311  -5.526
  594    HZ1  LYS  78           HZ1      LYS  78   0.917  -8.052  -3.939
  595    HZ2  LYS  78           HZ2      LYS  78  -0.714  -7.846  -4.008
  596    HZ3  LYS  78           HZ3      LYS  78  -0.037  -9.132  -4.731
  597    H    LYS  79           H        LYS  79  -4.508  -8.157  -9.640
  598    HA   LYS  79           HA       LYS  79  -5.267  -6.997 -12.263
  599    HB2  LYS  79           HB2      LYS  79  -6.429  -9.059 -12.895
  600    HB3  LYS  79           HB3      LYS  79  -4.739  -9.395 -12.639
  601    HG2  LYS  79           HG2      LYS  79  -5.145 -10.579 -10.618
  602    HG3  LYS  79           HG3      LYS  79  -6.755  -9.876 -10.416
  603    HD2  LYS  79           HD2      LYS  79  -7.013 -12.154 -11.107
  604    HD3  LYS  79           HD3      LYS  79  -7.564 -11.093 -12.405
  605    HE2  LYS  79           HE2      LYS  79  -5.256 -11.398 -13.480
  606    HE3  LYS  79           HE3      LYS  79  -4.932 -12.629 -12.247
  607    HZ1  LYS  79           HZ1      LYS  79  -7.032 -12.671 -14.325
  608    HZ2  LYS  79           HZ2      LYS  79  -5.772 -13.716 -14.177
  609    HZ3  LYS  79           HZ3      LYS  79  -7.019 -13.749 -13.081
  610    HA   PRO  80           HA       PRO  80  -8.984  -5.959  -9.843
  611    HB2  PRO  80           HB2      PRO  80 -11.176  -6.926 -11.237
  612    HB3  PRO  80           HB3      PRO  80 -10.309  -5.409 -11.633
  613    HG2  PRO  80           HG2      PRO  80  -9.906  -8.160 -12.862
  614    HG3  PRO  80           HG3      PRO  80 -10.121  -6.589 -13.704
  615    HD2  PRO  80           HD2      PRO  80  -7.658  -7.545 -13.359
  616    HD3  PRO  80           HD3      PRO  80  -7.983  -5.832 -13.024
  617    H    GLY  81           H        GLY  81  -9.711  -6.913  -8.059
  618    HA2  GLY  81           HA2      GLY  81 -10.460  -8.552  -6.584
  619    HA3  GLY  81           HA3      GLY  81 -10.359  -9.781  -7.847
  620    H    SER  82           H        SER  82  -7.615  -7.624  -6.925
  621    HA   SER  82           HA       SER  82  -6.167 -10.018  -5.789
  622    HB2  SER  82           HB2      SER  82  -5.009  -7.599  -7.216
  623    HB3  SER  82           HB3      SER  82  -4.061  -8.821  -6.373
  624    HG   SER  82           HG       SER  82  -4.801 -10.377  -7.889
  625    H    THR  83           H        THR  83  -4.386  -9.230  -4.114
  626    HA   THR  83           HA       THR  83  -5.354  -6.851  -2.567
  627    HB   THR  83           HB       THR  83  -4.618  -8.053  -0.497
  628    HG1  THR  83           HG1      THR  83  -4.812 -10.435  -0.857
  629   HG21  THR  83          HG21      THR  83  -7.005  -7.870  -1.119
  630   HG22  THR  83          HG22      THR  83  -6.884  -9.395  -2.033
  631   HG23  THR  83          HG23      THR  83  -6.650  -9.376  -0.269
  632    H    VAL  84           H        VAL  84  -3.854  -5.710  -1.333
  633    HA   VAL  84           HA       VAL  84  -0.955  -6.125  -1.899
  634    HB   VAL  84           HB       VAL  84  -0.773  -3.597  -2.159
  635   HG11  VAL  84          HG11      VAL  84  -2.188  -5.116  -4.376
  636   HG12  VAL  84          HG12      VAL  84  -1.220  -3.634  -4.550
  637   HG13  VAL  84          HG13      VAL  84  -0.441  -5.130  -4.016
  638   HG21  VAL  84          HG21      VAL  84  -3.070  -2.971  -1.421
  639   HG22  VAL  84          HG22      VAL  84  -2.677  -2.363  -3.030
  640   HG23  VAL  84          HG23      VAL  84  -3.738  -3.768  -2.862
  641    H    ILE  85           H        ILE  85   0.452  -5.422  -0.451
  642    HA   ILE  85           HA       ILE  85  -0.424  -4.557   2.243
  643    HB   ILE  85           HB       ILE  85   2.191  -4.910   2.635
  644   HG12  ILE  85          HG12      ILE  85   3.026  -6.927   1.500
  645   HG13  ILE  85          HG13      ILE  85   1.618  -6.987   0.455
  646   HG21  ILE  85          HG21      ILE  85   0.277  -7.262   2.496
  647   HG22  ILE  85          HG22      ILE  85   1.742  -7.075   3.505
  648   HG23  ILE  85          HG23      ILE  85   0.333  -6.054   3.795
  649   HD11  ILE  85          HD11      ILE  85   3.515  -4.621   0.506
  650   HD12  ILE  85          HD12      ILE  85   3.752  -6.031  -0.552
  651   HD13  ILE  85          HD13      ILE  85   2.307  -5.021  -0.739
  652    H    ALA  86           H        ALA  86   0.630  -2.869   3.360
  653    HA   ALA  86           HA       ALA  86   0.941  -0.465   1.785
  654    HB1  ALA  86           HB1      ALA  86  -0.044  -0.584   4.082
  655    HB2  ALA  86           HB2      ALA  86   1.545  -0.997   4.726
  656    HB3  ALA  86           HB3      ALA  86   1.282   0.591   3.963
  657    H    GLY  87           H        GLY  87   2.817   0.859   1.585
  658    HA2  GLY  87           HA2      GLY  87   5.047   1.462   1.588
  659    HA3  GLY  87           HA3      GLY  87   5.438   0.057   2.586
  660    H    SER  88           H        SER  88   3.784  -1.136  -0.090
  661    HA   SER  88           HA       SER  88   6.260  -1.984  -1.433
  662    HB2  SER  88           HB2      SER  88   4.741  -3.262  -2.884
  663    HB3  SER  88           HB3      SER  88   4.573  -3.646  -1.175
  664    HG   SER  88           HG       SER  88   2.579  -2.710  -1.141
  665    H    ILE  89           H        ILE  89   6.488  -1.777  -3.767
  666    HA   ILE  89           HA       ILE  89   5.795   0.986  -4.654
  667    HB   ILE  89           HB       ILE  89   7.939  -0.544  -6.048
  668   HG12  ILE  89          HG12      ILE  89   8.557  -1.181  -3.776
  669   HG13  ILE  89          HG13      ILE  89   9.715  -0.121  -4.547
  670   HG21  ILE  89          HG21      ILE  89   7.373   1.713  -6.741
  671   HG22  ILE  89          HG22      ILE  89   7.647   2.339  -5.105
  672   HG23  ILE  89          HG23      ILE  89   8.999   1.699  -6.056
  673   HD11  ILE  89          HD11      ILE  89   9.404   0.412  -2.166
  674   HD12  ILE  89          HD12      ILE  89   8.992   1.773  -3.219
  675   HD13  ILE  89          HD13      ILE  89   7.703   0.805  -2.459
  676    H    ASN  90           H        ASN  90   4.782   1.370  -6.627
  677    HA   ASN  90           HA       ASN  90   3.886  -0.923  -8.285
  678    HB2  ASN  90           HB2      ASN  90   2.351   0.916  -7.686
  679    HB3  ASN  90           HB3      ASN  90   3.396   2.081  -8.476
  680   HD21  ASN  90          HD22      ASN  90   0.523   1.108  -8.954
  681   HD22  ASN  90          HD21      ASN  90   0.538   0.861 -10.698
  682    H    GLN  91           H        GLN  91   4.790  -1.547 -10.224
  683    HA   GLN  91           HA       GLN  91   6.607   0.331 -11.583
  684    HB2  GLN  91           HB2      GLN  91   7.761  -1.348  -9.851
  685    HB3  GLN  91           HB3      GLN  91   7.623  -2.490 -11.174
  686    HG2  GLN  91           HG2      GLN  91   9.441  -1.535 -12.141
  687    HG3  GLN  91           HG3      GLN  91   8.532  -0.036 -12.345
  688   HE21  GLN  91          HE22      GLN  91   8.338   1.191  -9.969
  689   HE22  GLN  91          HE21      GLN  91   9.899   1.336  -9.175
  690    H    ASN  92           H        ASN  92   4.322   0.045 -12.659
  691    HA   ASN  92           HA       ASN  92   4.938  -0.847 -15.277
  692    HB2  ASN  92           HB2      ASN  92   4.380  -3.111 -14.338
  693    HB3  ASN  92           HB3      ASN  92   2.777  -2.527 -13.932
  694   HD21  ASN  92          HD22      ASN  92   1.193  -2.951 -15.497
  695   HD22  ASN  92          HD21      ASN  92   1.651  -3.547 -17.074
  696    H    GLY  93           H        GLY  93   2.250   0.198 -13.112
  697    HA2  GLY  93           HA2      GLY  93   1.284   2.278 -14.749
  698    HA3  GLY  93           HA3      GLY  93   0.509   0.828 -15.363
  699    H    SER  94           H        SER  94  -1.114   2.783 -14.520
  700    HA   SER  94           HA       SER  94  -1.612   2.897 -11.734
  701    HB2  SER  94           HB2      SER  94  -3.436   3.680 -14.035
  702    HB3  SER  94           HB3      SER  94  -3.716   4.071 -12.331
  703    HG   SER  94           HG       SER  94  -1.574   4.932 -13.986
  704    H    LEU  95           H        LEU  95  -2.886   1.848 -10.347
  705    HA   LEU  95           HA       LEU  95  -5.116   0.044 -11.283
  706    HB2  LEU  95           HB2      LEU  95  -3.216  -0.113  -8.937
  707    HB3  LEU  95           HB3      LEU  95  -4.642  -1.126  -9.065
  708    HG   LEU  95           HG       LEU  95  -2.219  -1.173 -10.888
  709   HD11  LEU  95          HD11      LEU  95  -3.042  -2.876  -8.496
  710   HD12  LEU  95          HD12      LEU  95  -1.736  -3.302  -9.607
  711   HD13  LEU  95          HD13      LEU  95  -1.615  -1.827  -8.626
  712   HD21  LEU  95          HD21      LEU  95  -4.627  -3.029 -10.612
  713   HD22  LEU  95          HD22      LEU  95  -4.201  -2.011 -11.997
  714   HD23  LEU  95          HD23      LEU  95  -3.175  -3.393 -11.562
  715    H    LEU  96           H        LEU  96  -6.899  -0.102  -9.810
  716    HA   LEU  96           HA       LEU  96  -7.214   2.240  -7.962
  717    HB2  LEU  96           HB2      LEU  96  -8.635   2.220 -10.053
  718    HB3  LEU  96           HB3      LEU  96  -9.339   0.716  -9.462
  719    HG   LEU  96           HG       LEU  96 -10.162   1.937  -7.445
  720   HD11  LEU  96          HD11      LEU  96  -9.239   4.394  -8.950
  721   HD12  LEU  96          HD12      LEU  96 -10.318   4.412  -7.547
  722   HD13  LEU  96          HD13      LEU  96  -8.654   3.842  -7.365
  723   HD21  LEU  96          HD21      LEU  96 -11.499   1.566  -9.544
  724   HD22  LEU  96          HD22      LEU  96 -12.030   2.937  -8.556
  725   HD23  LEU  96          HD23      LEU  96 -11.073   3.221 -10.030
  726    H    ILE  97           H        ILE  97  -7.360   1.783  -5.856
  727    HA   ILE  97           HA       ILE  97  -7.974  -1.013  -4.987
  728    HB   ILE  97           HB       ILE  97  -5.898   0.947  -3.919
  729   HG12  ILE  97          HG12      ILE  97  -4.452  -1.243  -4.638
  730   HG13  ILE  97          HG13      ILE  97  -5.727  -1.367  -5.838
  731   HG21  ILE  97          HG21      ILE  97  -6.408  -1.927  -3.060
  732   HG22  ILE  97          HG22      ILE  97  -5.119  -0.865  -2.474
  733   HG23  ILE  97          HG23      ILE  97  -6.789  -0.479  -2.101
  734   HD11  ILE  97          HD11      ILE  97  -3.728  -0.139  -6.621
  735   HD12  ILE  97          HD12      ILE  97  -5.159   0.899  -6.671
  736   HD13  ILE  97          HD13      ILE  97  -3.983   1.092  -5.366
  737    H    CYS  98           H        CYS  98  -9.361  -1.296  -3.322
  738    HA   CYS  98           HA       CYS  98 -10.478   1.102  -1.926
  739    HB2  CYS  98           HB2      CYS  98 -12.100  -0.521  -2.850
  740    HB3  CYS  98           HB3      CYS  98 -11.394  -1.795  -1.845
  741    HG   CYS  98           HG       CYS  98 -11.759  -0.451   0.473
  742    H    ALA  99           H        ALA  99  -9.636   1.677  -0.024
  743    HA   ALA  99           HA       ALA  99  -7.481   0.062   1.178
  744    HB1  ALA  99           HB1      ALA  99  -8.618   2.826   1.792
  745    HB2  ALA  99           HB2      ALA  99  -7.216   2.092   2.593
  746    HB3  ALA  99           HB3      ALA  99  -7.146   2.466   0.853
  747    H    THR 100           H        THR 100  -7.737  -1.236   2.922
  748    HA   THR 100           HA       THR 100 -10.285  -0.972   4.495
  749    HB   THR 100           HB       THR 100 -10.323  -3.387   4.773
  750    HG1  THR 100           HG1      THR 100  -8.413  -4.165   4.469
  751   HG21  THR 100          HG21      THR 100 -11.060  -3.972   2.547
  752   HG22  THR 100          HG22      THR 100 -11.561  -2.307   2.896
  753   HG23  THR 100          HG23      THR 100 -10.168  -2.612   1.832
  754    H    HIS 101           H        HIS 101  -7.180  -0.248   5.021
  755    HA   HIS 101           HA       HIS 101  -7.742  -0.276   7.922
  756    HB2  HIS 101           HB2      HIS 101  -5.215  -1.353   6.601
  757    HB3  HIS 101           HB3      HIS 101  -5.239  -0.804   8.260
  758    HD1  HIS 101           HD1      HIS 101  -4.907  -3.853   6.892
  759    HD2  HIS 101           HD2      HIS 101  -7.805  -2.211   9.455
  760    HE1  HIS 101           HE1      HIS 101  -5.918  -5.825   8.201
  761    H    VAL 102           H        VAL 102  -6.647   1.399   9.058
  762    HA   VAL 102           HA       VAL 102  -5.333   3.530   7.422
  763    HB   VAL 102           HB       VAL 102  -5.070   4.747   9.567
  764   HG11  VAL 102          HG11      VAL 102  -6.883   5.220   8.008
  765   HG12  VAL 102          HG12      VAL 102  -7.907   3.997   8.798
  766   HG13  VAL 102          HG13      VAL 102  -7.405   5.455   9.684
  767   HG21  VAL 102          HG21      VAL 102  -6.343   4.131  11.533
  768   HG22  VAL 102          HG22      VAL 102  -6.951   2.673  10.742
  769   HG23  VAL 102          HG23      VAL 102  -5.226   2.812  11.148
  770    H    GLY 103           H        GLY 103  -3.088   4.366   8.439
  771    HA2  GLY 103           HA2      GLY 103  -1.342   2.209   7.762
  772    HA3  GLY 103           HA3      GLY 103  -0.847   3.757   8.402
  773    H    ALA 104           H        ALA 104  -2.092   3.691  10.968
  774    HA   ALA 104           HA       ALA 104  -0.355   2.102  12.523
  775    HB1  ALA 104           HB1      ALA 104  -3.099   3.256  13.212
  776    HB2  ALA 104           HB2      ALA 104  -1.868   2.737  14.380
  777    HB3  ALA 104           HB3      ALA 104  -1.540   4.108  13.319
  778    H    ASP 105           H        ASP 105  -3.516   1.223  11.187
  779    HA   ASP 105           HA       ASP 105  -3.700  -1.251  12.738
  780    HB2  ASP 105           HB2      ASP 105  -5.668   0.255  12.096
  781    HB3  ASP 105           HB3      ASP 105  -5.565  -0.515  10.514
  782    H    THR 106           H        THR 106  -1.893  -0.448  10.057
  783    HA   THR 106           HA       THR 106  -2.213  -2.851   8.459
  784    HB   THR 106           HB       THR 106  -0.022  -2.328   7.484
  785    HG1  THR 106           HG1      THR 106   0.047  -0.113   9.195
  786   HG21  THR 106          HG21      THR 106  -1.882   0.043   7.706
  787   HG22  THR 106          HG22      THR 106  -0.519  -0.081   6.568
  788   HG23  THR 106          HG23      THR 106  -1.872  -1.226   6.476
  789    H    THR 107           H        THR 107  -0.982  -4.754   8.430
  790    HA   THR 107           HA       THR 107   0.122  -5.721  10.941
  791    HB   THR 107           HB       THR 107   0.377  -6.832   8.130
  792    HG1  THR 107           HG1      THR 107  -1.225  -8.208   8.826
  793   HG21  THR 107          HG21      THR 107   0.856  -8.990   9.324
  794   HG22  THR 107          HG22      THR 107   2.128  -7.796   9.540
  795   HG23  THR 107          HG23      THR 107   0.961  -8.090  10.851
  796    H    LEU 108           H        LEU 108   1.525  -4.316   7.973
  797    HA   LEU 108           HA       LEU 108   4.232  -4.464   8.397
  798    HB2  LEU 108           HB2      LEU 108   2.840  -3.355   6.532
  799    HB3  LEU 108           HB3      LEU 108   2.704  -1.957   7.578
  800    HG   LEU 108           HG       LEU 108   5.354  -2.038   7.600
  801   HD11  LEU 108          HD11      LEU 108   4.644  -3.568   5.046
  802   HD12  LEU 108          HD12      LEU 108   6.257  -2.919   5.467
  803   HD13  LEU 108          HD13      LEU 108   5.542  -4.238   6.426
  804   HD21  LEU 108          HD21      LEU 108   3.862  -1.286   5.064
  805   HD22  LEU 108          HD22      LEU 108   3.920  -0.302   6.533
  806   HD23  LEU 108          HD23      LEU 108   5.414  -0.630   5.626
  807    H    SER 109           H        SER 109   2.129  -1.883   9.780
  808    HA   SER 109           HA       SER 109   4.214  -0.796  11.476
  809    HB2  SER 109           HB2      SER 109   1.215  -0.317  11.534
  810    HB3  SER 109           HB3      SER 109   2.457   0.640  12.363
  811    HG   SER 109           HG       SER 109   1.961   0.356   9.598
  812    H    GLN 110           H        GLN 110   1.793  -3.278  11.978
  813    HA   GLN 110           HA       GLN 110   2.015  -3.450  14.843
  814    HB2  GLN 110           HB2      GLN 110   0.196  -4.392  13.307
  815    HB3  GLN 110           HB3      GLN 110   1.302  -5.646  12.874
  816    HG2  GLN 110           HG2      GLN 110  -0.262  -6.429  14.481
  817    HG3  GLN 110           HG3      GLN 110   1.381  -6.513  15.130
  818   HE21  GLN 110          HE22      GLN 110  -0.957  -3.757  14.869
  819   HE22  GLN 110          HE21      GLN 110  -0.903  -3.443  16.582
  820    H    ILE 111           H        ILE 111   3.737  -5.154  12.209
  821    HA   ILE 111           HA       ILE 111   5.154  -7.056  13.661
  822    HB   ILE 111           HB       ILE 111   5.880  -5.495  11.174
  823   HG12  ILE 111          HG12      ILE 111   5.304  -8.469  11.566
  824   HG13  ILE 111          HG13      ILE 111   4.020  -7.302  11.323
  825   HG21  ILE 111          HG21      ILE 111   7.539  -7.748  12.403
  826   HG22  ILE 111          HG22      ILE 111   7.744  -7.107  10.761
  827   HG23  ILE 111          HG23      ILE 111   8.072  -6.071  12.136
  828   HD11  ILE 111          HD11      ILE 111   4.529  -8.352   9.211
  829   HD12  ILE 111          HD12      ILE 111   5.011  -6.646   9.131
  830   HD13  ILE 111          HD13      ILE 111   6.238  -7.921   9.332
  831    H    VAL 112           H        VAL 112   6.351  -3.670  13.156
  832    HA   VAL 112           HA       VAL 112   8.633  -4.046  14.781
  833    HB   VAL 112           HB       VAL 112   8.891  -1.662  14.870
  834   HG11  VAL 112          HG11      VAL 112   7.849  -2.489  12.126
  835   HG12  VAL 112          HG12      VAL 112   8.979  -1.173  12.491
  836   HG13  VAL 112          HG13      VAL 112   9.467  -2.849  12.767
  837   HG21  VAL 112          HG21      VAL 112   6.520  -0.956  15.248
  838   HG22  VAL 112          HG22      VAL 112   7.299  -0.086  13.930
  839   HG23  VAL 112          HG23      VAL 112   6.155  -1.388  13.560
  840    H    LYS 113           H        LYS 113   5.377  -3.604  15.849
  841    HA   LYS 113           HA       LYS 113   6.071  -2.909  18.630
  842    HB2  LYS 113           HB2      LYS 113   3.443  -4.000  17.579
  843    HB3  LYS 113           HB3      LYS 113   3.770  -3.316  19.164
  844    HG2  LYS 113           HG2      LYS 113   4.265  -1.099  18.091
  845    HG3  LYS 113           HG3      LYS 113   3.880  -1.810  16.524
  846    HD2  LYS 113           HD2      LYS 113   1.870  -0.775  17.109
  847    HD3  LYS 113           HD3      LYS 113   1.618  -2.481  17.509
  848    HE2  LYS 113           HE2      LYS 113   2.639  -1.657  19.857
  849    HE3  LYS 113           HE3      LYS 113   2.040  -0.091  19.301
  850    HZ1  LYS 113           HZ1      LYS 113   0.297  -1.151  20.557
  851    HZ2  LYS 113           HZ2      LYS 113  -0.161  -1.327  18.969
  852    HZ3  LYS 113           HZ3      LYS 113   0.517  -2.580  19.762
  853    H    LEU 114           H        LEU 114   5.209  -5.836  16.755
  854    HA   LEU 114           HA       LEU 114   4.934  -7.597  19.002
  855    HB2  LEU 114           HB2      LEU 114   5.263  -7.942  15.991
  856    HB3  LEU 114           HB3      LEU 114   5.055  -9.301  17.082
  857    HG   LEU 114           HG       LEU 114   3.069  -7.076  16.613
  858   HD11  LEU 114          HD11      LEU 114   3.092  -9.993  15.726
  859   HD12  LEU 114          HD12      LEU 114   1.764  -8.854  15.462
  860   HD13  LEU 114          HD13      LEU 114   3.326  -8.575  14.675
  861   HD21  LEU 114          HD21      LEU 114   2.839  -9.642  18.245
  862   HD22  LEU 114          HD22      LEU 114   2.764  -7.972  18.862
  863   HD23  LEU 114          HD23      LEU 114   1.477  -8.575  17.824
  864    H    VAL 115           H        VAL 115   7.524  -7.141  16.598
  865    HA   VAL 115           HA       VAL 115   9.255  -9.226  17.551
  866    HB   VAL 115           HB       VAL 115   9.954  -6.631  16.122
  867   HG11  VAL 115          HG11      VAL 115  11.705  -9.036  16.796
  868   HG12  VAL 115          HG12      VAL 115  12.110  -7.848  15.539
  869   HG13  VAL 115          HG13      VAL 115  11.999  -7.339  17.222
  870   HG21  VAL 115          HG21      VAL 115  10.171  -8.081  14.167
  871   HG22  VAL 115          HG22      VAL 115   9.774  -9.517  15.135
  872   HG23  VAL 115          HG23      VAL 115   8.550  -8.264  14.844
  873    H    GLU 116           H        GLU 116   9.456  -5.717  18.323
  874    HA   GLU 116           HA       GLU 116  11.296  -5.811  20.299
  875    HB2  GLU 116           HB2      GLU 116   9.758  -3.893  19.185
  876    HB3  GLU 116           HB3      GLU 116   8.910  -4.032  20.721
  877    HG2  GLU 116           HG2      GLU 116  11.392  -3.838  21.698
  878    HG3  GLU 116           HG3      GLU 116  11.739  -3.159  20.105
  879    H    GLU 117           H        GLU 117   7.997  -7.014  20.739
  880    HA   GLU 117           HA       GLU 117   8.164  -7.188  23.687
  881    HB2  GLU 117           HB2      GLU 117   6.115  -8.032  21.628
  882    HB3  GLU 117           HB3      GLU 117   5.983  -8.415  23.341
  883    HG2  GLU 117           HG2      GLU 117   6.460  -5.522  22.633
  884    HG3  GLU 117           HG3      GLU 117   4.935  -6.221  22.176
  885    H    ALA 118           H        ALA 118   8.619  -9.190  20.766
  886    HA   ALA 118           HA       ALA 118   8.251 -11.723  22.062
  887    HB1  ALA 118           HB1      ALA 118   9.548 -11.002  19.396
  888    HB2  ALA 118           HB2      ALA 118   8.923 -12.598  19.869
  889    HB3  ALA 118           HB3      ALA 118   7.806 -11.249  19.657
  890    H    GLN 119           H        GLN 119  11.079  -9.686  21.901
  891    HA   GLN 119           HA       GLN 119  13.143 -11.658  22.149
  892    HB2  GLN 119           HB2      GLN 119  12.906  -8.731  22.902
  893    HB3  GLN 119           HB3      GLN 119  14.426  -9.635  22.972
  894    HG2  GLN 119           HG2      GLN 119  13.044  -8.293  20.741
  895    HG3  GLN 119           HG3      GLN 119  14.765  -8.646  20.945
  896   HE21  GLN 119          HE22      GLN 119  11.819  -9.534  19.486
  897   HE22  GLN 119          HE21      GLN 119  12.097 -11.228  19.399