NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type subtype subsubtype
10333 1pk2 cing 1-original 4 unknown distance general distance simple


Asp-1     NH             Asp-1     CHb2          5.0
Asp-1     NH             Asp-1     CHb3          3.5
Asp-1     CHb3           Cys1      NH            5.0
Asp-1     HA             Cys1      NH            2.7
Cys1      NH             Cys1      Cb            6.0
Cys1      Cb             Tyr2      NH            3.7
Cys1      Cb             Cys80     NH            3.7
Cys1      CHa            Tyr2      NH            2.7
Cys1      CHa            Val77     Cb            4.6
Cys1      CHa            Pro78     Cb            6.0
Cys1      CHa            Pro78     Cg            4.5
Cys1      CHa            Pro78     Cd            4.5
Tyr2      NH             Tyr2      Cb            4.5
Tyr2      NH             Tyr2      Cg            4.7
Tyr2      Cb             Tyr2      Cz            8.0
Tyr2      CHa            Tyr2      Cg            7.0
Tyr2      Cb             Gly6      NH            6.0
Tyr2      Cg             Gly6      NH            4.7
Tyr2      Cz             Gly6      NH            7.0
Tyr2      NH             Val77     Cb            6.4
Tyr2      HN             Ser79     CHa           2.7
Tyr2      Cb             Phe3      NH            3.7
Tyr2      CHa            Phe3      NH            2.7
Tyr2      Cg             Phe3      NH            7.0
Tyr2      Cg             Asn5      NH            8.0
Tyr2      Cz             Val77     Cb            8.4
Tyr2      Cg             Asn5      CHa           5.5
Tyr2      Cz             Asn5      Cb            6.5
Tyr2      Cg             Pro61     Cd            8.0
Tyr2      Cz             Pro61     Cd            8.0
Tyr2      Cg             Gly6      Ca            5.7
Tyr2      Cg             Ser79     CHa           5.5
Tyr2      Cg             Pro61     Cg            8.0
Tyr2      Cg             Val77     Cb            7.6
Tyr2      Cg             Val77     CHb           4.7
Tyr2      Cz             Val77     CHb           5.5
Tyr2      Cz             Ser79     Cb            8.0
Tyr2      Cz             Ser79     CHa           7.0
Tyr2      Cz             Asn5      CHa           5.5
Tyr2      CHa            Gly6      Ca            6.0
Tyr2      Cb             Gly6      Ca            5.5
Phe3      NH             Phe3      Cb            4.5
Phe3      Cg             Phe3      CHa           5.5
Phe3      NH             Phe3      Cg            7.0
Phe3      Cb             Gly4      NH            6.0
Phe3      CHa            Gly4      NH            2.7
Phe3      Cg             Gly4      NH            7.0
Phe3      Cz             Ala8      Cb            8.5
Phe3      CHz            Ala8      Cb            6.5
Gly4      Ca             Gly6      NH            6.0
Gly4      Ca             Asn5      HN            3.7
Asn5      NH             Asn5      Cb            6.0
Asn5      NH             Gly6      NH            3.5
Asn5      Cb             Ala58     CHa           6.0
Asn5      CHa            Lys60     CHa           5.0
Asn5      CHa            Gly6      NH            3.5
Asn5      Cb             Asn53     Nd            5.5
Gly6      NH             Ser7      NH            3.5
Gly6      Ca             Tyr9      NH            6.0
Gly6      Ca             Ser7      NH            4.5
Ser7      NH             Ser7      Cb            4.5
Ser7      NH             Ala8      NH            5.0
Ser7      CHa            Asn53     CHb2          3.5
Ser7      CHa            Asn53     CHb3          5.0
Ala8      Cb             Tyr9      NH            6.5
Ala8      NH             Tyr9      NH            5.0
Tyr9      NH             Tyr9      CHb2          2.7
Tyr9      NH             Tyr9      CHb3          2.7
Gly11     Ca             Thr12     NH            3.7
Thr12     NH             Thr12     Cg2           5.0
Thr12     CHa            Thr12     Cg2           4.2
Thr12     CHa            His13     NH            3.5
Thr12     Cg2            Tyr50     Cz            6.2
Thr12     CHa            Tyr50     Cz            7.0
Thr12     CHa            Tyr50     Cg            5.5
Thr12     CHb            Tyr50     Cg            7.0
Thr12     Cg             Tyr50     Cg            8.5
Thr12     CHb            Tyr50     Cz            5.5
His13     Cb             His13     CH4           4.5
His13     Cb             His13     NH            3.7
His13     CHa            Ser14     NH            5.0
His13     CH4            Val77     Cb            5.6
His13     CH4            Cys75     CHb3          2.7
His13     CH4            Cys75     CHa           5.0
His13     CH4            Leu15     NH            2.7
His13     CH4            Asp76     NH            5.0
His13     NH             Val77     Cb            7.9
His13     CHe            Leu15     Cb            6.0
His13     Cb             Val77     Cb            8.9
Ser14     CHa            Cys51     NH            5.0
Ser14     NH             Leu15     NH            2.7
Ser14     Cb             Tyr50     Cg            8.0
Ser14     CHa            Tyr50     CHa           5.0
Ser14     CHa            Tyr50     Cg            7.0
Ser14     CHa            Leu15     NH            5.0
Ser14     CHa            Tyr50     CHb3          5.0
Ser14     CHa            Tyr50     CHb2          5.0
Leu15     Cg             Thr16     NH            7.9
Leu15     Cb             Thr16     NH            4.5
Leu15     CHa            Thr16     NH            2.7
Leu15     Cg             Cys22     NH            6.4
Leu15     CHa            Cys22     NH            3.5
Leu15     CHa            Ser21     CHa           2.7
Leu15     Cg             Ser21     CHa           5.6
Leu15     CHa            Thr16     Cg            6.5
Leu15     Cg             Glu73     NH            7.9
Leu15     NH             Leu15     Cb            3.7
Thr16     Cg             Glu17     NH            6.5
Thr16     CHa            Glu17     NH            2.7
Thr16     CHb            Glu17     NH            2.7
Thr16     CHa            Cys75     CHa           2.7
Thr16     CHa            Cys75     CHb3          5.0
Thr16     Cg             Val75     Cb            9.4
Thr16     CHb            Cys75     CHa           3.5
Thr16     NH             Ala20     NH            5.0
Thr16     CHa            Asp76     NH            5.0
Thr16     NH             Ser21     CHa           5.0
Thr16     CHg            Ala20     Cb            4.2
Thr16     CHg            Glu73     Cb            6.0
Thr16     Cg             Glu73     NH            6.5
Thr16     Cg             Glu73     Cb            7.5
Thr16     NH             Thr16     Cg            4.2
Thr16     CHa            Thr16     Cg            4.2
Glu17     NH             Glu17     Cb            4.5
Glu17     NH             Glu17     Cg            6.0
Glu17     NH             Glu73     Cb            4.5
Glu17     NH             Cys75     CHa           2.7
Glu17     CHa            Gly19     NH            5.0
Glu17     CHa            Asp76     Cb            4.5
Glu17     NH             Ser18     NH            3.5
Glu17     Cb             Ser18     NH            4.5
Glu17     CHa            Ser18     NH            5.0
Ser18     NH             Gly19     NH            3.5
Ser18     NH             Ser18     Cb            6.0
Gly19     NH             Ala20     NH            2.7
Gly19     Ca             Ala20     NH            6.0
Ala20     NH             Ala20     Cb            4.2
Al20      Cb             Ser21     NH            4.2
Ala20     CHa            Ser21     NH            2.7
Ser21     NH             Ser21     Cb            3.7
Ser21     Cb             Cys22     NH            4.5
Ser21     CHa            Cys22     NH            2.7
Cys22     NH             Cys22     Cb            3.7
Cys22     Cb             Leu23     NH            6.0
Cys22     CHa            Leu23     NH            5.0
Leu23     NH             Leu23     CHg           2.7
Leu23     NH             Leu23     CHb3          5.0
Leu23     NH             Leu23     CHb2          2.7
Leu23     CHg            Leu66     NH            5.0
Leu23     Cg             Leu31     Cg            10.8
Leu23     CHg            Leu31     Cg            6.4
Leu23     Cg             Leu66     Cb            7.4
Leu23     Cg             His64     CHb2          7.9
Leu23     Cg             His64     CHb3          6.4
Leu23     CHa            Pro24     Cd            3.7
Leu23     Cg             Pro24     Cd            7.4
Leu23     NH             Val65     Cb            6.4
Leu23     CHg            His64     CHe           5.0
Pro24     Cb             Asn26     NH            4.5
Pro24     Cb             Trp25     NH            6.0
Pro24     CHa            Trp25     NH            2.7
Pro24     CHa            Asn49     CHa           2.7
Pro24     Cb             Ser27     NH            4.5
Trp25     NH1            Trp25     CH7           3.5
Trp25     CHb3           Trp25     CH4           3.5
Trp25     NH             Trp25     CHb3          5.0
Trp25     NH             Trp25     CHb2          2.7
Trp25     CHb2           Trp25     CH4           5.0
Trp25     NH             Trp25     CH2           3.5
Trp25     CHb3           Trp25     CH2           3.5
Trp25     CHb2           Trp25     CH2           2.7
Trp25     NH1            Leu46     Cg            7.9
Trp25     NH1            Arg52     Cg            6.0
Trp25     NH1            Arg52     Cb            7.0
Trp25     NH1            Tyr50     Cb            6.0
Trp25     NH1            Asn49     CHa           5.0
Trp25     NH1            Tyr50     NH            3.5
Trp25     CH2            Tyr50     NH            3.5
Trp25     NH1            His48a    CH2           2.7
Trp25     CH7            Arg52     NH            3.5
Trp25     NH             Asn26     NH            6.0
Trp25     CH5            Leu46     Cg            7.9
Trp25     CH4            Leu46     Cg            6.4
Trp25     CH4            Leu31     Cg            6.4
trp25     CH7            Leu46     Cg            7.9
Trp25     CH7            Arg52     Cb            3.7
Trp25     CH7            Arg52     Cg            6.0
Trp25     CHb3           Ala39     NH            2.7
Trp25     CH7            Arg52     Cg            4.5
Trp25     CH4            Thr37     CHb           5.0
Trp25     NH             Asn49     CHa           5.0
Trp25     CH4            Thr37     CHa           2.7
Trp25     CH7            Arg52     CHa           5.0
Trp25     CH7            Cys63     CHa           5.0
Trp25     CH6            Cys63     CHa           2.7
Trp25     CH5            Trp62     CH5           5.0
Trp25     CH4            His64     CH4           3.5
Trp25     CH2            His48a    CH2           5.0
Trp25     NH             His48a    NH            5.0
Trp25     CH2            Leu53     Cg            7.9
Trp25     CH2            Leu53     CHb3          6.0
Trp25     CH2            Tyr50     CHb2          5.0
Trp25     CH2            Leu46     CHa           6.0
Trp25     CH5            Tyr36     Cb            6.0
Trp25     CH2            Gly47     NH            3.5
Trp25     CH2            Asn49     CHa           3.5
Trp25     CH6            Leu46     Cg            7.9
Trp25     CH6            Arg52     Cb            6.0
Trp25     CHb2           Thr37     CHa           5.0
Trp25     CHb3           Thr37     CHa           3.5
Trp25     CHa            Thr37     CHa           5.0
Trp25     CHb2           Gly47     NH            3.5
Trp25     CHb2           Ala39     NH            6.0
Trp25     CHa            Ala39     NH            5.0
Trp25     CHa            Leu31     Cg            5.6
Trp25     CH7            Arg52     Cd            4.5
Trp25     CHb3           Leu53     CHb3          5.0
Asn26     NH             Asn26     Cb            4.5
Asn26     NH             Ala39     Cb            6.5
Asn26     CHa            Ala39     NH            3.5
Asn26     CHa            Ser27     NH            3.5
Asn26     NH             Ser27     NH            2.7
Asn26     Nd             Lys48     Cg            7.0
Asn26     Nd             Lys48     Cb            7.0
Asn26     Nd             Lys48     CHa           6.0
Asn26     CHa            Ala39     Cb            4.2
Asn26     Cb             Ala39     Cb            5.2
Asn26     Cb             Ser27     CHa           6.0
Asn26     Cb             Ser27     NH            7.0
Ser27     NH             Ser27     CHb3          2.7
Ser27     NH             Ser27     CHb2          2.7
Ser27     CHa            Met28     NH            3.5
Ser27     NH             Leu31     Cg            5.6
Ser27     NH             Leu31     Cb            6.0
Met28     CHa            Ile30     NH            6.0
Ile30     NH             Ile30     Cg2           5.0
Ile30     NH             Ile30     Cg1           4.5
Ile30     NH             Ile30     CHb           2.7
Ile30     NH             Leu31     NH            3.5
Ile30     CHa            Leu31     NH            6.0
Ile30     CGg2           Leu31     NH            6.5
Leu31     NH             Leu31     CHg           2.7
Leu31     NH             Leu31     Cb            3.7
Leu31     Cg             His64     CH4           6.4
Leu31     Cb             Ile32     NH            6.0
Leu31     CHa            Ile32     NH            6.0
Leu31     Cg             Leu70     Cg            8.5
Leu31     Cg             His64     CHb2          6.4
Leu31     Cg             His64     CHb3          6.4
Leu31     CHa            Leu70     Cg            7.9
Leu31     CHg            Leu70     Cg            8.9
Leu31     NH             Ile32     NH            6.0
Leu31     Cg             His64     CH2           7.9
Leu31     Cg             Thr37     CHa           6.4
Ile32     NH             Ile32     Cg1           4.5
Ile32     NH             Ile32     CHb           2.7
Ile32     NH             Ile32     Cg2           4.2
Ile32     Cg2            Gly33     NH            5.0
Ile32     CHa            Gly33     NH            2.7
Ile32     CHa            Lys34     NH            5.0
Gly33     NH             Lys34     NH            3.5
Gly33     Ca             Lys34     NH            6.0
Lys34     NH             Lys34     Cg            4.5
Lys34     NH             Lys34     Cb            3.7
Lys34     Ce             Leu70     Cg            7.4
Lys34     Cb             Val35     NH            6.0
Lys34     CHa            Val35     NH            2.7
Lys34     Cg             His64     Ne            7.0
Lys34     Cb             His64     Ne            7.0
Val35     NH             Val35     CHb           3.5
Val35     Cb             Asn41     Nd            7.4
Val35     Cb             Tyr36     Cg            8.4
Val35     Cb             Tyr36     Cz            8.4
Val35     NH             Tyr36     NH            5.0
Val35     Cb             His64     Ne            8.9
Val35     CHb            His64     Ne            3.5
Val35     CHb            Tyr36     Cg            5.5
Val35     NH             His64     Ne            6.0
Tyr36     Cz             Leu46     Cg            9.9
Tyr36     Cg             Leu46     Cg            7.6
Tyr36     Cz             Asp55     Cb            5.7
Tyr36     CHa            Thr37     NH            2.7
Tyr36     Cg             His64     Ne            6.5
Tyr36     Cz             Leu44c    Cg            8.4
Tyr36     Cg             Leu44c    Cg            7.6
Tyr36     Cb             Trp62     CH7           6.0
Tyr36     Cb             Trp62     CH6           3.7
Tyr36     Cb             Trp62     CH5           6.0
Tyr36     Cg             Trp62     CH7           7.0
Tyr36     Cb             His64     Ne            5.5
Tyr36     Cb             Leu46     Cg            7.4
Thr37     NH             Thr37     Cg            5.0
Thr37     NH             Leu46     Cg            6.4
Thr37     CHb            Ala39     NH            2.7
Thr37     CHb            Gln40     NH            5.0
Thr37     CHa            Ala39     NH            2.7
Thr37     NH             Asn41     CHb2          2.7
Thr37     NH             Asn41     CHb3          5.0
Thr37     CHa            Leu46     Cg            6.4
Thr37     NH             Leu44c    CHa           5.0
Ala39     NH             Ala39     Cb            4.2
Ala39     Cb             Gln40     NH            5.0
Ala39     CHa            Ala44     Cb            4.2
Ala39     CHa            Leu46     CHb2          5.0
Ala39     Cb             Asn41     NH            6.5
Ala39     Cb             Gly47     NH            6.5
Ala39     CHa            Asn41     NH            3.5
Ala39     CHa            Leu46     CHb3          5.0
Gln40     NH             Gln40     CHb3          5.0
Gln40     NH             Gln40     CHb2          2.7
Gln40     NH             Gln40     Cg            6.0
Gln40     CHb3           Asn41     NH            5.0
Gln40     CHb2           Asn41     NH            5.0
Gln40     CHa            Asn41     NH            3.5
Gln40     NH             Asn41     NH            2.7
Asn41     NH             Asn41     CHb2          2.7
Asn41     NH             Asn41     CHb3          2.7
Asn41     NH             Leu46     Cg            7.9
Asn41     CHb3           Ala44     NH            3.5
Asn41     CHb2           Ala44     NH            5.0
Asn41     CHa            Pro42     Cd            3.7
Asn41     CHb3           Ala44     Cb            6.5
Asn41     CHb2           Ala44     Cb            6.5
Asn41     NH             Ala44     Cb            4.2
Asn41     CHb3           Ser43     NH            6.0
Pro42     Cd             Ser43     NH            6.0
Pro42     Cg             Ser43     NH            4.5
Ser43     NH             Ser43     CHb2          2.7
Ser43     NH             Leu44c    Cg            8.9
Ser43     CHb3           Ala44     NH            5.0
Ser43     CHa            Ala44b    NH            5.0
Ser43     CHa            Ala44b    Cb            6.5
Ser43     NH             Ala44     NH            2.7
Ala44     NH             Ala44     Cb            4.2
Ala44     Cb             Gln44a    NH            4.2
Ala44     NH             Gln44a    NH            3.5
Ala44     Cb             Leu46     NH            6.5
Ala44     CHa            Leu44c    NH            5.0
Ala44     Cb             Leu46     Cg            9.4
Ala44     CHa            Leu46     Cg            6.4
Ala44     CHa            Leu44c    Cb            4.5
Ala44     Cb             Leu46     CHb2          7.5
Gln44a    NH             Gln44a    Cb            3.7
Gln44a    NH             Ala44b    NH            3.5
Gln44a    CHa            Leu46     NH            5.0
Gln44a    CHa            Gly45     NH            5.0
Gln44a    Cb             Ala44b    NH            3.7
Ala44b    NH             Ala44b    Cb            4.2
Ala44b    Cb             Leu44c    NH            4.2
Ala44b    CHa            Leu44c    NH            3.5
Ala44b    NH             Leu44c    NH            2.7
Leu44c    NH             Leu44c    CHg           2.7
Leu44c    HN             Gly45     NH            3.5
Gly45     Ca             Leu46     NH            4.5
Gly45     Ca             Arg52     CHe           6.0
Gly45     NH             Leu46     NH            2.7
Leu46     NH             Leu46     CHb3          3.5
Leu46     NH             Leu46     CHb2          2.7
Leu46     Cg             His48a    CH2           6.4
Leu46     Cg             Arg52     Cg            6.6
Leu46     Cg             Arg52     Cb            6.6
Leu46     CHa            His48a    CH2           2.7
Leu46     Cg             Gly47     NH            7.9
Leu46     CHb3           Gly47     NH            3.5
Leu46     CHa            Gly47     NH            2.7
Leu46     CHb2           Gly47     NH            5.0
Gly47     Ca             Lys48     NH            4.5
Gly47     NH             His48a    CH2           3.5
Gly47     Ca             His48a    CH4           4.5
Lys48     NH             Lys48     Cg            4.5
Lys48     NH             Lys48     Cb            4.5
Lys48     CHa            His48a    NH            2.7
Lys48     Cb             His48a    NH            6.0
His48a    CH4            His48a    Cb            4.5
His48a    Cb             Tyr50     NH            6.0
His48a    CH2            Tyr50     CHb2          2.7
His48a    CH2            Tyr50     CHb3          3.5
His48a    CH2            Arg52     Cg            3.7
His48a    CH2            Tyr50     Cg            7.0
His48a    Cb             Asn49     NH            3.7
His48a    Cb             Tyr50     Cz            6.5
His48a    CH4            Tyr50     Cg            7.0
His48a    CHa            Asn49     HN            2.7
His48a    CH2            Tyr50     NH            3.5
His48a    Cb             Tyr50     Cg            8.0
His48a    CH2            Arg52     Cg            3.7
Asn49     CHb2           Asn49     Nd            3.7
Asn49     CHb3           Asn49     Nd            6.0
Asn49     CHa            Tyr50     NH            3.5
Asn49     NH             Tyr50     NH            3.5
Tyr50     NH             Tyr50     CHb2          2.7
Tyr50     NH             Tyr50     CHb3          5.0
Tyr50     CHb3           Cys51     NH            3.5
Tyr50     CHa            Cys51     NH            2.7
Tyr50     Cg             Cys51     NH            7.0
Cys51     CHb2           Cys51     NH            2.7
Cys51     CHb3           Cys51     NH            3.5
Cys51     CHb2           Arg52     NH            5.0
Cys51     CHa            Arg52     NH            2.7
Cys51     CHa            Cys63     Cb            4.5
Arg52     NH             Arg52     Cb            4.5
Arg52     CHa            Arg52     Cd            4.5
Arg52     NH             Trp62     NH            3.5
Arg52     Cb             Asn53     NH            4.5
Arg52     Ca             Asn53     NH            2.7
Asn53     CHb3           Asn53     NH            5.0
Asn53     CHb2           Asn53     NH            3.5
Asn53     CHb3           Asn53     Nd            4.5
Asn53     CHb2           Asn53     Nd            3.7
Asn53     CHa            Trp62     NH1           2.7
Asn53     CHa            Trp62     CH2           2.7
Asn53     CHa            Pro54     Cd            3.7
Asn53     CHa            Pro61     CHa           5.0
Asn53     CHb2           Pro61     CHa           3.5
Asn53     CHb3           Pro61     CHa           3.5
Asn53     CHb2           Trp62     CH4           5.0
Asn53     CHb3           Trp62     CH4           5.0
Asn53     Nd             Asp57     NH            4.5
Pro54     Cd             Trp62     NH1           3.7
Pro54     Cd             Trp62     CH7           3.7
Pro54     Cg             Trp62     CH7           3.7
Pro54     Cd             Asp55     NH            4.5
Pro54     Cg             Asp55     NH            4.5
Asp55     NH             Asp55     Cb            4.5
Asp55     NH             Gly56     NH            2.7
Asp55     NH             Trp62     NH1           3.5
Gly56     Ca             Asp57     NH            4.5
Gly56     NH             Asp57     NH            2.7
Asp57     NH             Asp57     Cb            3.7
Asp57     Cb             Trp62     NH1           4.5
Asp57     CHa            Ala58     HN            2.7
Asp57     Cb             Ala58     NH            4.5
Asp57     Cb             Trp62     CH2           3.7
Asp57     Cb             Tyr74     Cz            6.5
Asp57     NH             Trp62     NH1           5.0
Ala58     NH             Ala58     Cb            4.2
Ala58     NH             Lys60     NH            3.5
Ala58     NH             Tyr74     Cz            5.5
Ala58     Cb             Lys60     NH            4.2
Ala58     CHa            Lys60     NH            3.5
Ala58     NH             Trp62     CH2           5.0
Lys60     NH             Lys60     Cb            4.5
Lys60     Cb             Tyr74     Cg            5.7
Lys60     Cb             Tyr74     Cz            8.0
Lys60     Cg             Tyr74     Cg            5.7
Lys60     Cg             Tyr74     Cz            5.7
Lys60     CHa            Pro61     Cd            3.7
Pro61     Cb             Trp62     NH            6.0
Pro61     CHa            Trp62     NH            2.7
Pro61     CHa            Trp62     CH2           2.7
Trp62     NH1            Trp62     CH7           3.5
Trp62     NH             Trp62     CH2           3.5
Trp62     Cb             Trp62     CH2           3.7
Trp62     Cb             Trp62     CH4           4.5
Trp62     Cb             Cys75     NH            6.0
Trp62     CHa            Cys75     NH            2.7
Trp62     CH4            Cys63     NH            2.7
Trp62     Cb             Cys63     NH            3.7
Trp62     CHa            Cys63     NH            2.7
Trp62     CH4            Glu73     NH            5.0
Trp62     CH2            Trp72     CH5           6.0
Trp62     CH2            Tyr74     Cg            7.0
Trp62     CH2            Tyr74     Cz            7.0
Trp62     CH4            Trp72     Cb            3.7
Trp62     Cb             Tyr74     Cg            5.7
Trp62     Cb             Tyr74     Cz            8.0
Trp62     Cb             Trp72     CH4           3.7
Trp62     CHa            Tyr74     Cg            7.0
Trp62     CH4            Trp72     CHa           3.5
Trp62     CH4            Cys63     CHa           3.5
Trp62     CH5            Trp72     Cb            6.0
Trp62     Cb             Trp72     CH5           4.5
Trp62     CHa            Glu73     Cb            6.0
Trp62     CHa            Tyr74     CHa           2.7
Trp62     Cb             Tyr74     CHa           3.7
Trp62     CH5            His64     CH2           5.0
Cys63     NH             Trp72     CH4           5.0
Cys63     Cb             His64     NH            4.5
Cys63     Ca             His64     NH            3.5
Cys63     NH             Tyr74     NH            6.0
Cys63     NH             Glu73     NH            5.0
Cys63     NH             Tyr74     CHa           5.0
His64     NH             His64     CHb2          2.7
His64     NH             His64     CHb3          5.0
His64     CHb2           His64     CH4           3.5
His64     CHb3           His64     CH4           3.5
His64     CHb3           Val65     NH            3.5
His64     CHb2           Val65     HN            5.0
His64     CHa            Val65     NH            2.7
His64     CHa            Glu73     NH            5.0
His64     CHa            Trp72     CH2           6.0
His64     CHa            Trp72     Cb            4.5
His64     CHb3           Trp72     CHa           6.0
His64     CHa            Trp72     CHa           2.7
Val65     NH             Val65     Cb            5.6
Val65     Cb             Thr71     NH            7.9
Val65     NH             Thr71     NH            3.5
Val65     Cb             Glu73     NH            7.9
Val65     Cb             Leu66     NH            6.4
Val65     CHb            Leu66     NH            2.7
Val65     Cb             Trp72     CHa           5.6
Val65     Cb             Thr71     Cg            9.4
val65     Cb             Glu73     Cb            8.9
Val65     NH             Trp72     CHa           2.7
Val65     CHa            Leu66     NH            3.5
Leu66     NH             Leu66     Cb            3.7
Leu66     CHa            Thr71     NH            5.0
Leu66     CHa            Lys66a    NH            2.7
Leu66     Cg             Leu70     CHa           5.6
Leu66     CHa            Leu70     CHa           2.7
Leu66     Cg             Lys66a    NH            6.4
Leu66     Cg             Leu70     NH            7.9
Lys66a    NH             Lys66a    Cb            3.7
Lys66a    NH             Arg69     NH            3.5
Lys66a    NH             Thr71     Cg            5.0
Lys66a    NH             Leu70     CHa           6.0
Asn67     Cb             Arg68     NH            6.0
Asn67     CHa            Arg68     NH            3.5
Asn67     CHa            Arg69     NH            6.0
Arg68     NH             Arg68     Cg            4.5
Arg68     CHa            Arg68     Cg            4.5
Arg68     NH             Arg69     NH            3.5
Arg68     CHa            Arg69     NH            5.0
Arg69     NH             Arg69     CHb3          2.7
Arg69     NH             Arg69     Cg            6.0
Arg69     NH             Arg69     CHb2          3.5
Arg69     CHb2           Leu70     NH            3.5
Arg69     CHa            Leu70     NH            3.5
Leu70     NH             Leu70     CHb2          2.7
Leu70     NH             Leu70     CHb3          2.7
Leu70     CHb2           Thr71     NH            5.0
Leu70     CHb3           Thr71     NH            5.0
Leu70     CHg            Thr71     NH            5.0
Leu70     CHa            Thr71     NH            2.7
Leu70     NH             Thr71     NH            5.0
Leu70     Cg             Thr71     CHa           7.9
Leu70     Cg             Thr71     NH            5.6
Thr71     NH             Thr71     Cg            4.2
Thr71     CHb            Trp72     NH            3.5
Thr71     CHa            Trp72     NH            2.7
Thr71     CHa            Trp72     CH2           3.5
Thr71     Cg             Trp72     CHa           6.5
Thr71     Cg             Trp72     NH            4.2
Trp72     CH7            Trp72     NH1           2.7
Trp72     NH             Trp72     CH2           3.5
Trp72     Cb             Trp72     CH4           3.7
Trp72     Cb             Trp72     CH2           3.7
Trp72     Cb             Glu73     NH            4.5
Trp72     CHa            Glu73     NH            2.7
Trp72     CH4            Glu73     NH            3.5
Trp72     CH4            Glu73     CHa           3.5
Trp72     CH5            Tyr74     Cg            5.5
Trp72     CH5            Tyr74     Cz            4.7
Trp72     CH5            Glu73     CHa           5.0
Glu73     NH             Glu73     Cb            4.5
Glu73     CHa            Tyr74     NH            2.7
Glu73     Cb             Tyr74     NH            3.7
Tyr74     NH             Tyr74     Cb            3.7
Tyr74     Cb             Cys75     NH            6.0
Tyr74     CHa            Cys75     NH            2.7
Tyr74     Cg             Cys75     NH            7.0
Cys75     NH             Cys75     CHb2          2.7
Cys75     NH             Cys75     CHb3          2.7
Cys75     CHa            Asp76     NH            2.7
Cys75     CHb3           Asp76     NH            3.5
Cys75     CHb3           Val77     NH            5.0
Cys75     CHb2           Val77     Cb            5.6
Cys75     CHb3           Val77     Cb            6.4
Cys75     CHb2           Val77     NH            5.0
Asp76     NH             Asp76     Cb            4.5
Asp76     CHa            Val77     NH            2.7
Val77     NH             Val77     CHb           2.7
Val77     NH             Val77     Cb            5.6
Val77     Cb             Pro78     Cd            7.4
Val77     CHa            Pro78     Cd            3.7
Pro78     Cb             Ser79     NH            6.0
Pro78     CHa            Ser79     NH            2.7
Ser79     CHa            Cys80     NH            2.7
Ser79     Cb             Cys80     NH            6.0
Cys80     NH             Cys80     Cb            3.7
Cys80     Cb             Ser81     NH            6.0
Cys80     CHa            Ser81     NH            3.5
SEr81     NH             Ser81     Cb            4.5
Ser81     CHa            Thr82     NH            4.5
Tyr36     Cz             6-AHA     Ca            8.0
Tyr36     Cg             6-AHA     Ca            8.0
Tyr36     Ca             6-AHA     Cb            8.0
Trp62     CH6            6-AHA     Cb            4.5
Trp62     CH6            6-AHA     Ca            4.5
Trp62     CH5            6-AHA     Cb            6.0
Trp62     CH5            6-AHA     Ca            6.0
His64     CH2            6-AHA     Cg            4.5
His64     CH2            6-AHA     Cb            3.7
His64     CH2            6-AHA     Ca            3.7
Trp72     CH2            6-AHA     Cg            4.5
Trp72     CH2            6-AHA     Ca            4.5
Trp72     CH2            6-AHA     Cb            4.5
Trp72     NH1            6-AHA     Cg            6.0
                                                 
Thr16     NH             Ala20     O             2.2b
Thr16     N              Ala20     O             3.4b
Trp25     NH             His48a    O             2.2b
Trp25     N              His48a    O             3.4b
Ser43     O              Leu44c    NH            2.2b
Ser43     O              Leu44c    N             3.4b
Ala44     O              Gly45     NH            2.2b
Ala44     O              Gly45     N             3.4b
Arg52     O              Trp62     NH            2.2b
Arg52     O              Trp62     N             3.4b
Cys63     NH             Glu73     O             2.2b
Cys63     N              Glu73     O             3.4b
Cys63     O              Glu73     NH            2.2b
Cys63     O              Glu73     N             3.4b
Val65     NH             Thr71     O             2.2b
Val65     N              Thr71     O             3.4b
Val65     O              Thr71     NH            2.2b
Val65     O              Thr71     N             3.4b
Lys66a    NH             Arg69     O             2.2b
Lys66a    N              Arg69     O             3.4b
Lys66a    O              Arg69     NH            2.2b
Lys66a    O              Arg69     N             3.4b
                                                 
Cys1      Sg             Cys80     Sg            2.12c
Cys22     Sg             Cys63     Sg            2.12c
Cys51     Sg             Cys75     Sg            2.12c



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