Monomer                chi4        chi4        chi4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4     chi_4                    
Spec1               torsion     torsion    circular   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion   Torsion                    
CALB1             min_value   max_value    variance     CALB1     CALB2     CALB3     CALB4     CALB5     CALB6     CALB7     CALB8     CALB9    CALB10    CALB11    CALB12    CALB13    CALB14    CALB15    CALB16    CALB17    CALB18    CALB19    CALB20    CALB21    CALB22    CALB23    CALB24    CALB25    CALB26    CALB27    CALB28    CALB29    CALB30    CALB31    CALB32    CALB33                    
LYS_1                -178.8       179.8      0.9499     -53.7     177.9      60.7      69.1     -60.1     -62.7     -86.3     -89.2     178.4     -59.6      66.5     -61.1     -61.6      65.9      62.3     176.6    -173.1      63.3     179.5    -178.2    -178.8     176.5     -55.5     -59.2     174.5      69.9     -63.1     179.8      62.0      62.4      67.3      62.7    -168.8                    
SER_2                   ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
PRO_3                   ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLU_4                   ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLU_5                   ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_6                   ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LYS_7                -176.7       180.0      0.7948     171.7    -176.0     167.8     -56.0     177.3     -53.0      45.0    -176.7     -55.0    -168.4     167.7      47.6     170.6    -175.8     -56.6     -52.9     -54.6      45.2    -176.4     180.0     -53.2     -52.6     -56.7     -52.1      63.6    -168.1     -53.8     -54.6    -176.5      47.4    -168.7      93.6     167.7                    
GLY_8                   ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
ILE_9                   ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
PHE_10                  0.3        13.5      0.0014       2.5       5.4       6.4       4.2       0.7       1.9       5.0       7.4       5.8       6.1       2.6       4.3       1.5       4.1      13.5       9.8       5.0       4.1       4.4       5.7       3.1       1.8       6.3       3.9       2.0       4.8       9.8       9.2       9.8       4.2       0.3       9.9       5.3                    
GLU_11                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LYS_12               -178.9       179.2      0.7847      62.0     -69.6      62.1      62.6      61.5      62.0     -84.3     -69.2     -65.2    -168.5     -67.7      51.3     -82.5      56.1     -61.2      62.0      61.7      55.4    -178.9      60.9     -78.6     -64.6      62.7    -173.8      54.5    -176.7     -66.1     -66.1      61.7      57.0     -64.4     179.2     -66.5                    
TYR_13                 -0.7         6.1      0.0004       3.1       2.7       1.6       1.6       5.8       3.1       2.4       1.7       3.1       3.8       2.7       1.7       2.8       1.9       0.3       1.4       3.5      -0.7       4.7       1.8       2.8      -0.7       1.6       6.1       1.2       1.3       3.4      -0.4       0.4       0.5       4.0       3.0       2.0                    
ALA_14                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
ALA_15                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LYS_16               -178.7       178.3      0.9405     176.9     169.5    -178.7     157.2     -53.3     -54.4     -48.9      45.9     176.1     175.4     -69.9      60.0      81.3      53.6      53.2      74.3      57.1      56.7     -51.6     -66.2      64.7      44.2     -52.9     -66.6     176.7     178.3    -178.6     -87.1     177.7     -60.3     -63.1      76.0      58.5                    
GLU_17                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLY_18                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
ASP_19                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
PRO_20                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
ASN_21                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLN_22                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_23                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
SER_24                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LYS_25               -180.0       177.3      0.8393    -178.6     -56.0    -178.1     -57.3     -55.4     -64.9     -60.9    -177.1    -169.4    -179.2     -58.2     -67.5      66.6      62.5    -176.3     -63.8      67.0    -177.0     -62.3      63.8    -176.3    -180.0    -178.7     -76.8      63.5     -56.1    -175.8     177.3     -61.7     -62.4      64.5      64.0      67.4                    
GLU_26                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLU_27                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_28                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LYS_29               -179.6       178.6      0.9343     -61.6      48.3    -176.4      62.8     -62.0    -179.6      67.4     -60.8    -179.5      61.5    -168.9      61.0    -173.9     -67.2     -68.4     -53.5    -174.4     -49.0      63.4     178.6     -64.1     -65.3      63.5      62.8     -53.4    -173.0    -179.6      63.8    -179.2     -61.4     170.9      61.1     177.1                    
LEU_30                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_31                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_32                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLN_33                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
THR_34                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLU_35                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
PHE_36                 -3.1        11.9      0.0042       0.3       8.9      -1.9      -1.8      11.2      10.6      -1.6      -0.8      -0.6      -0.9      11.6       2.3      -1.4       2.4      10.6      -0.3      -2.8      -2.6       2.5       0.4      11.6      -0.6       1.2      10.2      -1.1      -3.1       1.2      -1.5      -1.1      -0.6      10.5      11.9      -0.9                    
PRO_37                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
SER_38                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_39                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_40                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LYS_41               -179.8       178.1      0.8912     -58.2    -173.7      69.5      69.9      62.0    -175.5      66.7      58.0     -61.0    -172.1     174.9      61.8      67.2      61.4     -61.9     -55.2     -66.9     178.1     -56.5     -57.0    -175.6    -175.4      69.8    -178.4    -179.2     -51.1      66.8     -58.2      66.0    -177.6      62.4    -179.8      50.8                    
GLY_42                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLY_43                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
SER_44                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
THR_45                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_46                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
ASP_47                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLU_48                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_49                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
PHE_50                 -2.8         6.2      0.0009      -2.8       2.1      -2.2       1.1      -1.6       2.7       1.6       4.8       2.3      -2.8       2.0      -1.3       0.7      -0.6      -2.5       0.6       3.7       1.0       3.8      -1.2       2.5      -0.8       6.1      -0.9      -1.5      -1.1       0.4       0.6       6.2      -1.6       0.6       1.7       1.2                    
GLU_51                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLU_52                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_53                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
ASP_54                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LYS_55               -179.1       179.7      0.8952      75.0     -71.4    -171.7      59.0      64.0     -47.4      74.4     -58.9    -179.1      65.9     179.5     -69.3      63.9     -48.2     -55.7    -178.9    -173.7      55.7     178.4     -63.5     -62.5     -62.3      64.8      56.7      55.6      64.8    -177.3     -54.5     -88.2      63.6     -66.0     179.7      56.0                    
ASN_56                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLY_57                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
ASP_58                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLY_59                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLU_60                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
VAL_61                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
SER_62                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
PHE_63                 -8.0        -5.2      0.0001      -6.0      -6.2      -7.8      -6.3      -7.0      -5.2      -6.8      -5.9      -6.5      -6.8      -6.6      -5.3      -5.9      -6.8      -6.7      -6.9      -5.8      -6.4      -7.2      -6.9      -5.8      -6.0      -6.2      -5.8      -7.0      -5.4      -8.0      -7.2      -5.9      -5.4      -6.4      -5.3      -7.4                    
GLU_64                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLU_65                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
PHE_66                 -5.0        -0.7      0.0002      -5.0      -2.1      -4.1      -4.0      -1.9      -0.7      -3.5      -3.3      -4.9      -2.9      -1.7      -1.8      -3.9      -2.7      -1.5      -3.1      -4.0      -3.5      -1.5      -3.8      -2.4      -4.5      -1.2      -1.8      -2.9      -3.8      -2.7      -3.0      -3.2      -4.0      -2.7      -0.9      -3.7                    
GLN_67                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
VAL_68                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LEU_69                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
VAL_70                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
LYS_71               -177.8       177.5      0.6341     170.0      54.1     -65.4      58.7    -177.8      54.3      62.4      62.0     174.9    -171.0     -57.4     177.5      54.0      55.2     -84.6      65.7      63.1      53.0      56.4      64.3      50.1     -54.4      55.1     -68.5      61.6      54.2    -172.9     176.1      62.1    -174.9     174.8      61.5      61.9                    
LYS_72               -176.3       178.7      0.7838      84.5      56.6     176.5      62.6     -84.1      62.6      55.2     -55.4      56.2      60.7     -54.7     -59.5      64.5     -61.6     174.5     -62.5     -58.4      61.6     178.0     -55.7    -176.3     177.8     -59.8     -83.5      57.3     -61.2     -54.0     -65.3     -70.0    -173.5     -56.6     -65.6     178.7                    
ILE_73                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
SER_74                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
GLN_75                  ---         ---         ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---       ---                    
                                                                                                                                                                                                                                                                                                                                                                                                                 


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