ic93.sln

A program to find frequent molecular substructures and discriminative fragments in a database of mol

Graph_1,0,N[+1](=O)(O[-1])C[4]:C(:CH:CH:CH:CH:@4)SC[15]:NH:C[18]:C(:C:@15CH2CH(NHC(=O)CH2SC(=O)NHCH2CH3)C(=O)NHCH(CH2CH2CH2CH2NH2)C(=O)OCH3):CH:CH:CH:CH:@18
Graph_2,0,N[+1](=O)(O[-1])C[4]:C(:CH:CH:CH:CH:@4)SC[15]:NH:C[18]:C(:C:@15CH2CH(NHC(=O)CH2CH2SC(=O)NHCH2CH3)C(=O)NHCH(CH2CH2CH2CH2NH2)C(=O)OCH3):CH:CH:CH:CH:@18
Graph_3,0,N[+1](=O)(O[-1])C[4]:C(:CH:CH:CH:CH:@4)SC[15]:NH:C[18]:C(:C:@15CH2CH(NHC(=O)CH3)C(=O)NHCH(CH2CH2CH2CH2NH2)C(=O)OCH3):CH:CH:CH:CH:@18
Graph_4,0,N[+1](=O)(O[-1])C[4]:C(:CH:CH:CH:CH:@4)SC[15]:NH:C[18]:C(:C:@15CH2CH(NHC(=O)CH2SH)C(=O)NHCH(CH2CH2CH2CH2NH2)C(=O)OCH3):CH:CH:CH:CH:@18
Graph_5,0,N[+1](=O)(O[-1])C[4]:C(:CH:CH:CH:CH:@4)SC[15]:NH:C[18]:C(:C:@15CH2CH(NHC(=O)CH2CH2SH)C(=O)NHCH(CH2CH2CH2CH2NH2)C(=O)OCH3):CH:CH:CH:CH:@18
Graph_6,0,N[+1](=O)(O[-1])C[4]:C(:CH:CH:CH:CH:@4)SC[15]:NH:C[18]:C(:C:@15CH2CH(NHCH2C(=O)OCH3)C(=O)NHCH(CH2CH2CH2CH2NH2)C(=O)OCH3):CH:CH:CH:CH:@18
Graph_7,0,N[+1](=O)(O[-1])C[4]:C(:CH:CH:CH:CH:@4)SC[15]:NH:C[18]:C(:C:@15CH2CH(NHCH2CH2C(=O)OCH3)C(=O)NHCH(CH2CH2CH2CH2NH2)C(=O)OCH3):CH:CH:CH:CH:@18
Graph_8,0,N[+1](=O)(O[-1])C[4]:C(:CH:CH:CH:CH:@4)SC[15]:NH:C[18]:C(:C:@15CH2CH(C(=O)NHCH(CH2CH2CH2CH2NH2)C(=O)OCH3)C(=O)OCH3):CH:CH:CH:CH:@18
Graph_9,0,N[+1](=O)(O[-1])C[4]:C(:CH:CH:CH:CH:@4)SC[15]:NH:C[18]:C(:C:@15CH2CH(C(=O)NHOH)C(=O)NHCH(CH2CH2CH2CH2NH2)C(=O)OCH3):CH:CH:CH:CH:@18
Graph_10,0,NH2C[4]:N:CH:C(:N:C:@4C(=O)NHC(=NH)NH2)OC[22]:CH:CH:CH:CH:CH:@22
Graph_11,0,NH2C[4]:N:C(:C(:N:C:@4C(=O)OCH3)C#CC[19]:CH:CH:CH:CH:CH:@19)NH2
Graph_12,0,NH2C[4]:N:C(:C(:N:C:@4C(=O)NHC(=NH)NH2)C#CC[22]:CH:CH:CH:CH:CH:@22)NH2
Graph_13,0,NH2C[4]:N:C(:C(:N:C:@4C(=O)OCH3)C(=O)CH3)NH2
Graph_14,0,NH2C[4]:N:C(:C(:N:C:@4C(=O)OCH3)C(=O)C[19]:CH:CH:CH:CH:CH:@19)NH2
Graph_15,0,NH2C[4]:N:C(:C(:N:C:@4C(=O)NHC(=NH)NH2)C(=O)CH3)NH2
Graph_16,0,NH2C[4]:N:C(:C(:N:C:@4C(=O)NHC(=NH)NH2)C(=O)C[22]:CH:CH:CH:CH:CH:@22)NH2
Graph_17,0,NH2C[4]:N:C(:C(:N:C:@4CH(OH)C[14]:CH:CH:CH:CH:CH:@14)C(=O)NHC(=NH)NH2)NH2
Graph_18,0,N[1]HCH2CH2N=C@1NHN=CHCH2OC[20]:CH:N:CH:CH:CH:@20
Graph_19,0,N[1]HCH2CH2N=C@1NHN=CHCH2OC[20]:CH:CH:CH:CH:CH:@20
Graph_20,0,NH(N=CHC[6]:C(:CH:CH:CH:CH:@6)OCH2CH2CH2CH2CH2C(=O)OH)C(=NH)NH2
Graph_21,0,NH(N=C(CH2CH2CH2CH2CH3)CH=CHC[25]:N:CH:CH:CH:C:@25OCH2CH2CH2CH2CH2C(=O)OH)C(=NH)NH2
Graph_22,0,NH(N=C(CH3)CH=CHC[13]:N:CH:CH:CH:C:@13OCH2CH2CH2CH2CH2C(=O)OH)C(=NH)NH2
Graph_23,0,N[1]HCH2CH2N=C@1NHN=CHC[16]:C(:CH:CH:CH:CH:@16)OCH2CH2CH2CH2CH2C(=O)OH
Graph_24,0,N[1]HCH2CH2N=C@1NHN=C(CH2CH2CH2CH2CH3)CH=CHC[35]:N:CH:CH:CH:C:@35OCH2CH2CH2CH2CH2C(=O)OH
Graph_25,0,N[1]HCH2CH2N=C@1NHN=C(CH3)CH=CHC[23]:N:CH:CH:CH:C:@23OCH2CH2CH2CH2CH2C(=O)OH
Graph_26,0,S[1]:C(:C(:C(:C:@1C(=O)CH3)OH)CH2CH2CH3)OCH2CH2CH2CH2CH2OC[41]:C(:CH:C[45]:C(:CH:@41)OCH(CH2CH2@45)C(=O)OH)C(=O)CH3
Graph_27,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N(CH2CH2CH3)CH2CH2CH3
Graph_28,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N(CH(CH3)CH3)CH(CH3)CH3
Graph_29,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N(CH2CH2CH2CH3)CH2CH2CH2CH3
Graph_30,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH2CH2CH2@31
Graph_31,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH2CH2CH2CH2@31
Graph_32,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH2CH2CH2CH2CH2@31
Graph_33,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH(CH2CH2CH2CH2@31)CH3
Graph_34,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH(CH2CH2CH2@31)CH3
Graph_35,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH2CH(CH2CH2@31)CH3
Graph_36,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH(CH2CH2CH2CH@31CH3)CH3
Graph_37,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH(CH2CH(CH2@31)CH3)CH3
Graph_38,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH2N(CH2CH2@31)CH3
Graph_39,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH2N(CH2CH2@31)C[45]:CH:CH:CH:CH:CH:@45
Graph_40,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH2N(CH2CH2@31)C[45]:C(:CH:CH:CH:CH:@45)OCH3
Graph_41,0,FC(F)(F)C[5]:CH:C(:CH:CH:CH:@5)N[15]CH2CH2N(CH2CH2@15)C(=S)SCH2C(=O)N[37]C[38]:C(:CH:CH:CH:CH:@38)SC[49]:C@37:CH:CH:CH:CH:@49
Graph_42,0,S[1]C[2]:C(:CH:CH:CH:CH:@2)N(C[13]:C@1:CH:CH:CH:CH:@13)C(=O)CH2SC(=S)N[31]CH2CH2N(CH2CH2@31)CH2C[48]:CH:CH:CH:CH:CH:@48
Graph_43,0,S(CH(CH2C(=O)OCH2CH3)C(=O)OCH2CH3)CH2CH(NHC(=O)CH2CH2CH(NH2)C(=O)OH)C(=O)NHCH2C(=O)OH
Graph_44,0,S(CH(CH2C(=O)OH)C(=O)OCH2CH3)CH2CH(NHC(=O)CH2CH2CH(NH2)C(=O)OH)C(=O)NHCH2C(=O)OH
Graph_45,0,S(CH(CH2C(=O)OCH2CH2CH2CH3)C(=O)OCH2CH2CH2CH3)CH2CH(NHC(=O)CH2CH2CH(NH2)C(=O)OH)C(=O)NHCH2C(=O)OH
Graph_46,0,S(CH(CH2C(=O)OH)C(=O)NH2)CH2CH(NHC(=O)CH2CH2CH(NH2)C(=O)OH)C(=O)NHCH2C(=O)OH
Graph_47,0,S(C[2]HCH2C(N(C@2=O)CH2CH3)=O)CH2CH(NHC(=O)CH2CH2CH(NH2)C(=O)OH)C(=O)NHCH2C(=O)OH
Graph_48,0,S(CH(CH2C(=O)NH2)C(=O)NH2)CH2CH(NHC(=O)CH2CH2CH(NH2)C(=O)OH)C(=O)NHCH2C(=O)OH
Graph_49,0,N[+1](#C[-1])CH(C[5]:CH:CH:C(:CH:CH:@5)F)C(=O)NHC[20]HCH2CH2CH2CH2CH2@20
Graph_50,0,N[+1](#C[-1])CH(C[5]:C(:CH:CH:CH:CH:@5)Cl)C(=O)NHC[20]HCH2CH2CH2CH2CH2@20
Graph_51,0,N[+1](#C[-1])CH(C[5]:CH:C(:CH:CH:CH:@5)Cl)C(=O)NHC[20]HCH2CH2CH2CH2CH2@20
Graph_52,0,NH(N=NC[5]:CH:CH:C(:CH:CH:@5)C(=NOC(=O)CH=CHC(=O)OH)NH2)C[31]:CH:CH:C(:CH:CH:@31)C(=NOC(=O)CH=CHC(=O)OH)NH2
Graph_53,0,ClCH2CH2N(N=O)C(=O)NHNHC(=O)C[19]:CH:CH:CH:CH:CH:@19
Graph_54,0,ClCH2CH2N(N=O)C(=O)NHNHC(=O)CH2C[22]:CH:CH:CH:CH:CH:@22
Graph_55,0,ClCH2CH2N(N=O)C(=O)NHNHC(=O)C[19]:C(:CH:CH:CH:CH:@19)OH
Graph_56,0,ClCH2CH2N(N=O)C(=O)NHNHC(=O)C[19]:CH:CH:C(:CH:CH:@19)NH2
Graph_57,0,ClCH2CH2N(N=O)C(=O)NHNHC(=O)C[19]:CH:CH:C(:CH:CH:@19)Cl
Graph_58,0,NH(CH(CH3)CH3)CH2CH(OH)C[20]HON=C(CH2@20)C[28]:CH:CH:CH:CH:CH:@28
Graph_59,0,NH(CH(CH3)CH3)CH2CH(OH)C[20]HON=C(CH2@20)C[28]:CH:CH:CH:CH:CH:@28
Graph_60,0,NH(CH(CH3)CH3)CH2CH(OH)C[20]HON=C(CH2@20)CH(CH3)CH3
Graph_61,0,NH(CH(CH3)CH3)CH2CH(OH)C[20]HON=C(CH2@20)CH(CH3)CH3
Graph_62,0,NH(C(CH3)(CH3)CH3)CH2CH(OH)C[23]HON=C(CH2@23)C[31]:CH:CH:CH:CH:CH:@31
Graph_63,0,NH(C(CH3)(CH3)CH3)CH2CH(OH)C[23]HON=C(CH2@23)C[31]:CH:CH:CH:CH:CH:@31
Graph_64,0,NH(C(CH3)(CH3)CH3)CH2CH(OH)C[23]HON=C(CH2@23)CH(CH3)CH3
Graph_65,0,NH(C(CH3)(CH3)CH3)CH2CH(OH)C[23]HON=C(CH2@23)CH(CH3)CH3
Graph_66,0,NH(CH(CH3)CH3)CH2CH(OH)CH2ON=C(CH(CH3)CH3)CH3
Graph_67,0,N(CH2CH2ON=C(NH2)C[14]HOC[17]:C(:CH:CH:CH:CH:@17)OCH2@14)(CH3)CH3
Graph_68,0,N(CH2CH2ON=C(NH2)C[14]HOC[17]:C(:CH:CH:CH:CH:@17)OCH2@14)(CH2CH3)CH2CH3
Graph_69,0,N(CH2CH2ON=C(NHC(=O)CH3)C[19]HOC[22]:C(:CH:CH:CH:CH:@22)OCH2@19)(CH2CH3)CH2CH3
Graph_70,0,N(CH2CH2ON=C(NHC(=O)CH3)C[19]HOC[22]:C(:CH:CH:CH:CH:@22)OCH2@19)(CH3)CH3
Graph_71,0,N(CH2CH2ON=C(OCH2CH3)C[19]HOC[22]:C(:CH:CH:CH:CH:@22)OCH2@19)(CH3)CH3
Graph_72,0,N(CH2CH2ON=C(OCH2CH3)C[19]HOC[22]:C(:CH:CH:CH:CH:@22)OCH2@19)(CH2CH3)CH2CH3
Graph_73,0,N[1](C[2]:C(:CH:CH:CH:CH:@2)N(C@1=O)CH2C(=O)OH)CH2C[25]:CH:CH:CH:CH:CH:@25
Graph_74,0,N[1](C[2]:C(:CH:CH:CH:CH:@2)N(C@1=O)CH2C(=O)OH)CH2C[25]:CH:CH:C(:CH:CH:@25)CH3
Graph_75,0,ClC[2]:CH:CH:C(:CH:CH:@2)CH2N[15]C[16]:C(:CH:CH:CH:CH:@16)N(C@15=O)CH2C(=O)OH
Graph_76,0,N[1](C[2]:C(:CH:CH:CH:CH:@2)N(C@1=O)CH2C(=O)OH)CH2C[25]:CH:CH:C(:CH:CH:@25)OCH3
Graph_77,0,ClC[2]:C(:CH:CH:C(:CH:@2)Cl)CH2N[15]C[16]:C(:CH:CH:CH:CH:@16)N(C@15=O)CH2C(=O)OH
Graph_78,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2C(=O)OH)Cl
Graph_79,0,BrC[2]:CH:C(:C(:CH:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2C(=O)OH)F
Graph_80,0,N[1](C[2]:C(:CH:CH:CH:CH:@2)N(C@1=O)CH2C(=O)OH)CH2C[25]:C[26]:C(:CH:CH:CH:@25):CH:CH:CH:CH:@26
Graph_81,0,N[1](C[2]:C(:CH:CH:CH:CH:@2)N(C@1=O)CH2C(=O)OH)CH2C[25]:CH:C[28]:C(:CH:CH:@25):CH:CH:CH:CH:@28
Graph_82,0,ClC[2]:C(:CH:CH:C(:CH:@2)Cl)C(=O)CH2N[17]C[18]:C(:CH:CH:CH:CH:@18)N(C@17=O)CH2C(=O)OH
Graph_83,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH(CH3)C(=O)OH)Cl
Graph_84,0,S[1]:C(:N:C[4]:C:@1:CH:CH:CH:CH:@4)CH2N[17]C[18]:C(:CH:CH:CH:CH:@18)N(C@17=O)CH2C(=O)OH
Graph_85,0,ClC[2]:CH:C[5]:S:C(:N:C:@5:CH:CH:@2)CH2N[17]C[18]:C(:CH:CH:CH:CH:@18)N(C@17=O)CH2C(=O)OH
Graph_86,0,S[1]:C(:N:C[4]:C:@1:CH:C(:CH:CH:@4)OCH3)CH2N[21]C[22]:C(:CH:CH:CH:CH:@22)N(C@21=O)CH2C(=O)OH
Graph_87,0,ClC[2]:C(:CH:C[6]:C(:CH:@2)N(C(N@6CH2C(=O)OH)=O)CH2C[24]:CH:CH:CH:CH:CH:@24)Cl
Graph_88,0,ClC[2]:C(:CH:C[6]:C(:CH:@2)N(C(N@6CH2C(=O)OH)=O)CH2C[24]:CH:CH:C(:CH:CH:@24)Cl)Cl
Graph_89,0,ClC[2]:C(:CH:C[6]:C(:CH:@2)N(C(N@6CH2C(=O)OH)=O)CH2C[24]:CH:C(:C(:CH:CH:@24)Cl)Cl)Cl
Graph_90,0,ClC[2]:C(:CH:C[6]:C(:CH:@2)N(C(N@6CH2C(=O)OH)=O)CH2C[24]:S:C[26]:C(:N:@24):CH:CH:CH:CH:@26)Cl
Graph_91,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2C[14](C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2C(=O)OH)CH2C[38]:CH:C(:C(:CH:CH:@38)Cl)Cl)Cl
Graph_92,0,N[1](C[2]:C(:CH:CH:CH:CH:@2)C[12](CH2C[16]:C(:CH:CH:CH:CH:@16)CH2@12)C@1=O)CH2C(=O)OH
Graph_93,0,ClC[2]:CH:C[5]:C(:CH:CH:@2)CH2C[14](CH2@5)C[18]:C(:CH:CH:CH:CH:@18)N(C@14=O)CH2C(=O)OH
Graph_94,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH(C[13](C[14]:C(:CH:CH:CH:CH:@14)N(C@13=O)CH2C(=O)OH)CH3)CH3)Cl
Graph_95,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2C[14]HC[16]:C(:CH:CH:CH:CH:@16)N(C@14=O)CH2C(=O)OH)Cl
Graph_96,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2C[14]HC[16]:C(:CH:CH:C(:CH:@16)Cl)N(C@14=O)CH2C(=O)OH)Cl
Graph_97,0,FC[2]:CH:C[5]:C(:CH:CH:@2)CH(C(N@5CH2C(=O)OH)=O)CH2C[26]:CH:C(:C(:CH:CH:@26)Cl)Cl
Graph_98,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2C[14]HC[16]:C(:CH:C(:C(:CH:@16)OCH3)OCH3)N(C@14=O)CH2C(=O)OH)Cl
Graph_99,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2C[14]HC[16]:C(:CH:C(:CH:CH:@16)OCH3)N(C@14=O)CH2C(=O)OH)Cl
Graph_100,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH(CH2C[16]HC[18]:C(:CH:CH:CH:CH:@18)N(C@16=O)CH2C(=O)OH)CH3)Cl
Graph_101,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2C[14]HC[16]:C(:CH:C(:CH:CH:@16)OH)N(C@14=O)CH2C(=O)OH)Cl
Graph_102,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2C[14]HC[16]:C(:CH:CH:CH:CH:@16)N(C@14=O)CH(CH3)C(=O)OH)Cl
Graph_103,0,S[1]:C(:N:C[4]:C:@1:CH:CH:CH:CH:@4)CH=C[16]C[17]:C(:CH:CH:CH:CH:@17)N(C@16=O)CH2C(=O)OH
Graph_104,0,ClC[2]:CH:C[5]:C(:CH:CH:@2)N(C(C@5=CHC[16]:S:C[18]:C(:N:@16):CH:CH:CH:CH:@18)=O)CH2C(=O)OH
Graph_105,0,ClC[2]:CH:C[5]:C(:CH:CH:@2)N(C(C@5=CHC[16]:S:C[18]:C(:N:@16):CH:CH:CH:CH:@18)=O)CH2C(=O)OH
Graph_106,0,FC[2]:CH:C[5]:C(:CH:CH:@2)C(C(N@5CH2C(=O)OH)=O)=CHC[24]:S:C[26]:C(:N:@24):CH:CH:CH:CH:@26
Graph_107,0,FC[2]:C[3]:C(:CH:CH:CH:@2)C(C(N@3CH2C(=O)OH)=O)=CHC[24]:S:C[26]:C(:N:@24):CH:CH:CH:CH:@26
Graph_108,0,FC[2]:C(:CH:C[6]:C(:CH:@2)N(C(C@6=CHC[15]:S:C[17]:C(:N:@15):CH:CH:CH:CH:@17)=O)CH2C(=O)OH)F
Graph_109,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2C(=O)NHOCH3)Cl
Graph_110,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2C(=O)NHOH)Cl
Graph_111,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2C(=O)N(OH)CH3)Cl
Graph_112,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2C(=O)NHC[35]:N:CH:CH:CH:CH:@35)Cl
Graph_113,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2C(=O)NHC[35]:S:N:C(:CH:@35)CH3)Cl
Graph_114,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2C(=O)NHC[35]:NH:N:N:N:@35)Cl
Graph_115,0,ClC[2]:C(:CH:CH:C(:CH:@2)CH2N[14]C[15]:C(:CH:CH:CH:CH:@15)N(C@14=O)CH2CH(OH)C(=O)NH2)Cl
Graph_116,0,NH(CH(CH(CH3)CH3)C(=O)NHCH2C(=O)NH2)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[61]:CH:CH:C(:CH:CH:@61)OH)CH3)CH2C[80]:CH:CH:CH:CH:CH:@80)CH2C(=O)OH)CH(CH3)CH3
Graph_117,0,NH(CH(CH(CH3)CH3)C(=O)NHCH(CH2C(=O)OH)C(=O)NHCH(CH(CH3)CH3)C(=O)NHCH2C(=O)NH2)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[78]:CH:CH:C(:CH:CH:@78)OH)CH3)CH2C[97]:CH:CH:CH:CH:CH:@97
Graph_118,0,NH(CH(CH(CH3)CH3)C(=O)NHCH(CH2C(=O)OH)C(=O)NHCH2C(=O)NH2)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[68]:CH:CH:C(:CH:CH:@68)OH)CH3)CH2C[87]:CH:CH:CH:CH:CH:@87)CH(CH3)CH3
Graph_119,0,NH(CH(CH(CH3)CH3)C(=O)NHCH(CH2C(=O)OH)C(=O)NH2)C(=O)CH(NHC(=O)CH2NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[68]:CH:CH:C(:CH:CH:@68)OH)CH3)CH2C[87]:CH:CH:CH:CH:CH:@87)CH(CH3)CH3
Graph_120,0,NH(CH(CH(CH3)CH3)C(=O)NH2)C(=O)CH(NHC(=O)CH2NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[61]:CH:CH:C(:CH:CH:@61)OH)CH3)CH2C[80]:CH:CH:CH:CH:CH:@80)CH2C(=O)OH)CH(CH3)CH3
Graph_121,0,NH(CH(CH(CH3)CH3)C(=O)NHCH2C(=O)NHCH(CH(CH3)CH3)C(=O)NH2)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[71]:CH:CH:C(:CH:CH:@71)OH)CH3)CH2C[90]:CH:CH:CH:CH:CH:@90)CH2C(=O)OH
Graph_122,0,NH(CH(CH(CH3)CH3)C(=O)NHCH2C(=O)OH)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[60]:CH:CH:C(:CH:CH:@60)OH)CH3)CH2C[79]:CH:CH:CH:CH:CH:@79)CH2C(=O)OH)CH(CH3)CH3
Graph_123,0,NH(CH(CH(CH3)CH3)C(=O)NHCH2C(=O)OCH2CH3)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[66]:CH:CH:C(:CH:CH:@66)OH)CH3)CH2C[85]:CH:CH:CH:CH:CH:@85)CH2C(=O)OH)CH(CH3)CH3
Graph_124,0,NH(CH(CH(CH3)CH3)C(=O)NHCH2C(=O)OCH2CH3)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[66]:CH:CH:C(:CH:CH:@66)OH)CH3)CH2C[85]:CH:CH:CH:CH:CH:@85)CH2C(=O)NH2)CH(CH3)CH3
Graph_125,0,NH(CH(CH(CH3)CH3)C(=O)NHCH2C(=O)OCH2CH3)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[66]:CH:CH:C(:CH:CH:@66)OH)CH3)CH2C[85]:CH:CH:CH:CH:CH:@85)CH2C(=O)OC(CH3)(CH3)CH3)CH(CH3)CH3
Graph_126,0,NH(CH(CH(CH3)CH3)C(=O)NHCH2C(=O)OC(CH3)(CH3)CH3)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[72]:CH:CH:C(:CH:CH:@72)OH)CH3)CH2C[91]:CH:CH:CH:CH:CH:@91)CH2C(=O)OC(CH3)(CH3)CH3)CH(CH3)CH3
Graph_127,0,NH(CH(CH(CH3)CH3)C(=O)NHCH2C(=O)NH2)C(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NHC(=O)CH(NH2)CH2C[61]:CH:CH:C(:CH:CH:@61)OH)CH3)CH2C[80]:CH:CH:CH:CH:CH:@80)CH2C(=O)OCH2C[100]:CH:CH:CH:CH:CH:@100)CH(CH3)CH3
Graph_128,0,S=C(NHC[5]:CH:CH:C(:CH:CH:@5)OCH2CH2CH2OC[26]:CH:CH:C(:CH:CH:@26)NHC(=S)NH2)NH2