-logKd/Ki
float64
0.4
15.2
inputs
stringlengths
181
9.73k
12.68
M K I G I I G A M E E E V T L L R D K I E N R Q T I S L G G C E I Y T G Q L N G T E V A L L K S G I G K V A A A L G A T L L L E H C K P D V I I N T G S A G G L A P T L K V G D I V V S D E A R Y H D A D V T A F G Y E Y G Q L P G C P A G F K A D D K L I A A A E A C I A E L N L N A V R G L I V S G D A F I N G S V G L A K I R H N F P Q A I A V E M E A T A I A H V C H N F N V P F V V V R A I S D V A D Q Q S H L S F D E F L A V A A K Q S S L M V E S L V Q K L A H G M K I G I I G A M E E E V T L L R D K I E N R Q T I S L G G C E I Y T G Q L N G T E V A L L K S G I G K V A A A L G A T L L L E H C K P D V I I N T G S A G G L A P T L K V G D I V V S D E A R Y H D A D V T A F G Y E Y G Q L P G C P A G F K A D D K L I A A A E A C I A E L N L N A V R G L I V S G D A F I N G S V G L A K I R H N F P Q A I A V E M E A T A I A H V C H N F N V P F V V V R A I S D V A D Q Q S H L S F D E F L A V A A K Q S S L M V E S L V Q K L A H G </s> G A M E E S G I G N T G S A G G L H V S G D A F I N G L I A V E M E A R A I S D V A D S H S F D L A D V T A F G Y L P G </s> C C C C S C [ C @ H ] 1 C [ N @ @ H + ] ( C c 2 c [ n H ] c 3 c ( N ) n c n c 2 3 ) C [ C @ @ H ] 1 O
12.7
P Q I T L W K R P L V T I R I G G Q L K E A L L D T G A D D T V L E E M N L P G K W K P K M I G G I G G F I K V R Q Y D Q I P I E I C G H K A I G T V L V G P T P V N I I G R N L L T Q I G C T L N F P Q I T L W K R P L V T I R I G G Q L K E A L L D T G A D D T V L E E M N L P G K W K P K M I G G I G G F I K V R Q Y D Q I P I E I C G H K A I G T V L V G P T P V N I I G R N L L T Q I G C T L N F </s> R L L L D T G A D D T V I G G I G G F I V L P T P V N I I G R N R P L L L D T G A D D T V K M I G G I G G F I V L T P V N I I G R N </s> C C C ( C C ) C N ( C [ C @ @ H ] ( O ) [ C @ H ] ( C c 1 c c c c c 1 ) N C ( = O ) O [ C @ H ] 1 C O [ C @ H ] 2 O C C [ C @ H ] 2 1 ) S ( = O ) ( = O ) c 1 c c c ( O C ) c c 1
12.7
P Q I T L W K R P L V T I R I G G Q L K E A L L D T G A D D T V L E E M N L P G K W K P K M I G G I G G F I K V R Q Y D Q I P I E I C G H K A I G T V L V G P T P V N I I G R N L L T Q I G C T L N F P Q I T L W K R P L V T I R I G G Q L K E A L L D T G A D D T V L E E M N L P G K W K P K M I G G I G G F I K V R Q Y D Q I P I E I C G H K A I G T V L V G P T P V N I I G R N L L T Q I G C T L N F </s> R L D T G A D D T V I G G I G L T P V I G R R L D T G A D D T V K I G G I G L T P V I G </s> C C C ( C C ) C N ( C [ C @ @ H ] ( O ) [ C @ H ] ( C c 1 c c c c c 1 ) N C ( = O ) O [ C @ H ] 1 C O [ C @ H ] 2 O C C [ C @ H ] 2 1 ) S ( = O ) ( = O ) c 1 c c c ( O C ) c c 1
12.72
A S V G F K A G V K D Y K L T Y Y T P E Y E T L D T D I L A A F R V S P Q P G V P P E E A G A A V A A E S S T G T W T T V W T D G L T N L D R Y K G R C Y H I E P V A G E E N Q Y I C Y V A Y P L D L F E E G S V T N M F T S I V G N V F G F K A L R A L R L E D L R I P V A Y V K T F Q G P P H G I Q V E R D K L N K Y G R P L L G C T I K P K L G L S A K N Y G R A V Y E C L R G G L D F T K D D E N V N S Q P F M R W R D R F L F C A E A L Y K A Q A E T G E I K G H Y L N A T A G T C E D M M K R A V F A R E L G V P I V M H D Y L T G G F T A N T T L S H Y C R D N G L L L H I H R A M H A V I D R Q K N H G M H F R V L A K A L R L S G G D H I H S G T V V G K L E G E R D I T L G F V D L L R D D Y T E K D R S R G I Y F T Q S W V S T P G V L P V A S G G I H V W H M P A L T E I F G D D S V L Q F G G G T L G H P W G N A P G A V A N R V A L E A C V Q A R N E G R D L A R E G N T I I R E A T K W S P E L A A A C E V W K E I K F E F P A M D T V M Q V W P I L N L K K Y E T L S Y L P P L T T D Q L A R Q V D Y L L N N K W V P C L E F E T D H G F V Y R E H H N S P G Y Y D G R Y W T M W K L P M F G C T D P A Q V L N E L E E C K K E Y P N A F I R I I G F D S N R E V Q C I S F I A Y K P A G Y A S V G F K A G V K D Y K L T Y Y T P E Y E T L D T D I L A A F R V S P Q P G V P P E E A G A A V A A E S S T G T W T T V W T D G L T N L D R Y K G R C Y H I E P V A G E E N Q Y I C Y V A Y P L D L F E E G S V T N M F T S I V G N V F G F K A L R A L R L E D L R I P V A Y V K T F Q G P P H G I Q V E R D K L N K Y G R P L L G C T I K P K L G L S A K N Y G R A V Y E C L R G G L D F T K D D E N V N S Q P F M R W R D R F L F C A E A L Y K A Q A E T G E I K G H Y L N A T A G T C E D M M K R A V F A R E L G V P I V M H D Y L T G G F T A N T T L S H Y C R D N G L L L H I H R A M H A V I D R Q K N H G M H F R V L A K A L R L S G G D H I H S G T V V G K L E G E R D I T L G F V D L L R D D Y T E K D R S R G I Y F T Q S W V S T P G V L P V A S G G I H V W H M P A L T E I F G D D S V L Q F G G G T L G H P W G N A P G A V A N R V A L E A C V Q A R N E G R D L A R E G N T I I R E A T K W S P E L A A A C E V W K E I K F E F P A M D T V M Q V W P I L N L K K Y E T L S Y L P P L T T D Q L A R Q V D Y L L N N K W V P C L E F E T D H G F V Y R E H H N S P G Y Y D G R Y W T M W K L P M F G C T D P A Q V L N E L E E C K K E Y P N A F I R I I G F D S N R E V Q C I S F I A Y K P A G Y A S V G F K A G V K D Y K L T Y Y T P E Y E T L D T D I L A A F R V S P Q P G V P P E E A G A A V A A E S S T G T W T T V W T D G L T N L D R Y K G R C Y H I E P V A G E E N Q Y I C Y V A Y P L D L F E E G S V T N M F T S I V G N V F G F K A L R A L R L E D L R I P V A Y V K T F Q G P P H G I Q V E R D K L N K Y G R P L L G C T I K P K L G L S A K N Y G R A V Y E C L R G G L D F T K D D E N V N S Q P F M R W R D R F L F C A E A L Y K A Q A E T G E I K G H Y L N A T A G T C E D M M K R A V F A R E L G V P I V M H D Y L T G G F T A N T T L S H Y C R D N G L L L H I H R A M H A V I D R Q K N H G M H F R V L A K A L R L S G G D H I H S G T V V G K L E G E R D I T L G F V D L L R D D Y T E K D R S R G I Y F T Q S W V S T P G V L P V A S G G I H V W H M P A L T E I F G D D S V L Q F G G G T L G H P W G N A P G A V A N R V A L E A C V Q A R N E G R D L A R E G N T I I R E A T K W S P E L A A A C E V W K E I K F E F P A M D T V M Q V W P I L N L K K Y E T L S Y L P P L T T D Q L A R Q V D Y L L N N K W V P C L E F E T D H G F V Y R E H H N S P G Y Y D G R Y W T M W K L P M F G C T D P A Q V L N E L E E C K K E Y P N A F I R I I G F D S N R E V Q C I S F I A Y K P A G Y A S V G F K A G V K D Y K L T Y Y T P E Y E T L D T D I L A A F R V S P Q P G V P P E E A G A A V A A E S S T G T W T T V W T D G L T N L D R Y K G R C Y H I E P V A G E E N Q Y I C Y V A Y P L D L F E E G S V T N M F T S I V G N V F G F K A L R A L R L E D L R I P V A Y V K T F Q G P P H G I Q V E R D K L N K Y G R P L L G C T I K P K L G L S A K N Y G R A V Y E C L R G G L D F T K D D E N V N S Q P F M R W R D R F L F C A E A L Y K A Q A E T G E I K G H Y L N A T A G T C E D M M K R A V F A R E L G V P I V M H D Y L T G G F T A N T T L S H Y C R D N G L L L H I H R A M H A V I D R Q K N H G M H F R V L A K A L R L S G G D H I H S G T V V G K L E G E R D I T L G F V D L L R D D Y T E K D R S R G I Y F T Q S W V S T P G V L P V A S G G I H V W H M P A L T E I F G D D S V L Q F G G G T L G H P W G N A P G A V A N R V A L E A C V Q A R N E G R D L A R E G N T I I R E A T K W S P E L A A A C E V W K E I K F E F P A M D T V M Q V W P I L N L K K Y E T L S Y L P P L T T D Q L A R Q V D Y L L N N K W V P C L E F E T D H G F V Y R E H H N S P G Y Y D G R Y W T M W K L P M F G C T D P A Q V L N E L E E C K K E Y P N A F I R I I G F D S N R E V Q C I S F I A Y K P A G Y A S V G F K A G V K D Y K L T Y Y T P E Y E T L D T D I L A A F R V S P Q P G V P P E E A G A A V A A E S S T G T W T T V W T D G L T N L D R Y K G R C Y H I E P V A G E E N Q Y I C Y V A Y P L D L F E E G S V T N M F T S I V G N V F G F K A L R A L R L E D L R I P V A Y V K T F Q G P P H G I Q V E R D K L N K Y G R P L L G C T I K P K L G L S A K N Y G R A V Y E C L R G G L D F T K D D E N V N S Q P F M R W R D R F L F C A E A L Y K A Q A E T G E I K G H Y L N A T A G T C E D M M K R A V F A R E L G V P I V M H D Y L T G G F T A N T T L S H Y C R D N G L L L H I H R A M H A V I D R Q K N H G M H F R V L A K A L R L S G G D H I H S G T V V G K L E G E R D I T L G F V D L L R D D Y T E K D R S R G I Y F T Q S W V S T P G V L P V A S G G I H V W H M P A L T E I F G D D S V L Q F G G G T L G H P W G N A P G A V A N R V A L E A C V Q A R N E G R D L A R E G N T I I R E A T K W S P E L A A A C E V W K E I K F E F P A M D T V M Q V W P I L N L K K Y E T L S Y L P P L T T D Q L A R Q V D Y L L N N K W V P C L E F E T D H G F V Y R E H H N S P G Y Y D G R Y W T M W K L P M F G C T D P A Q V L N E L E E C K K E Y P N A F I R I I G F D S N R E V Q C I S F I A Y K P A G Y A S V G F K A G V K D Y K L T Y Y T P E Y E T L D T D I L A A F R V S P Q P G V P P E E A G A A V A A E S S T G T W T T V W T D G L T N L D R Y K G R C Y H I E P V A G E E N Q Y I C Y V A Y P L D L F E E G S V T N M F T S I V G N V F G F K A L R A L R L E D L R I P V A Y V K T F Q G P P H G I Q V E R D K L N K Y G R P L L G C T I K P K L G L S A K N Y G R A V Y E C L R G G L D F T K D D E N V N S Q P F M R W R D R F L F C A E A L Y K A Q A E T G E I K G H Y L N A T A G T C E D M M K R A V F A R E L G V P I V M H D Y L T G G F T A N T T L S H Y C R D N G L L L H I H R A M H A V I D R Q K N H G M H F R V L A K A L R L S G G D H I H S G T V V G K L E G E R D I T L G F V D L L R D D Y T E K D R S R G I Y F T Q S W V S T P G V L P V A S G G I H V W H M P A L T E I F G D D S V L Q F G G G T L G H P W G N A P G A V A N R V A L E A C V Q A R N E G R D L A R E G N T I I R E A T K W S P E L A A A C E V W K E I K F E F P A M D T V M Q V W P I L N L K K Y E T L S Y L P P L T T D Q L A R Q V D Y L L N N K W V P C L E F E T D H G F V Y R E H H N S P G Y Y D G R Y W T M W K L P M F G C T D P A Q V L N E L E E C K K E Y P N A F I R I I G F D S N R E V Q C I S F I A Y K P A G Y A S V G F K A G V K D Y K L T Y Y T P E Y E T L D T D I L A A F R V S P Q P G V P P E E A G A A V A A E S S T G T W T T V W T D G L T N L D R Y K G R C Y H I E P V A G E E N Q Y I C Y V A Y P L D L F E E G S V T N M F T S I V G N V F G F K A L R A L R L E D L R I P V A Y V K T F Q G P P H G I Q V E R D K L N K Y G R P L L G C T I K P K L G L S A K N Y G R A V Y E C L R G G L D F T K D D E N V N S Q P F M R W R D R F L F C A E A L Y K A Q A E T G E I K G H Y L N A T A G T C E D M M K R A V F A R E L G V P I V M H D Y L T G G F T A N T T L S H Y C R D N G L L L H I H R A M H A V I D R Q K N H G M H F R V L A K A L R L S G G D H I H S G T V V G K L E G E R D I T L G F V D L L R D D Y T E K D R S R G I Y F T Q S W V S T P G V L P V A S G G I H V W H M P A L T E I F G D D S V L Q F G G G T L G H P W G N A P G A V A N R V A L E A C V Q A R N E G R D L A R E G N T I I R E A T K W S P E L A A A C E V W K E I K F E F P A M D T V M Q V W P I L N L K K Y E T L S Y L P P L T T D Q L A R Q V D Y L L N N K W V P C L E F E T D H G F V Y R E H H N S P G Y Y D G R Y W T M W K L P M F G C T D P A Q V L N E L E E C K K E Y P N A F I R I I G F D S N R E V Q C I S F I A Y K P A G Y A S V G F K A G V K D Y K L T Y Y T P E Y E T L D T D I L A A F R V S P Q P G V P P E E A G A A V A A E S S T G T W T T V W T D G L T N L D R Y K G R C Y H I E P V A G E E N Q Y I C Y V A Y P L D L F E E G S V T N M F T S I V G N V F G F K A L R A L R L E D L R I P V A Y V K T F Q G P P H G I Q V E R D K L N K Y G R P L L G C T I K P K L G L S A K N Y G R A V Y E C L R G G L D F T K D D E N V N S Q P F M R W R D R F L F C A E A L Y K A Q A E T G E I K G H Y L N A T A G T C E D M M K R A V F A R E L G V P I V M H D Y L T G G F T A N T T L S H Y C R D N G L L L H I H R A M H A V I D R Q K N H G M H F R V L A K A L R L S G G D H I H S G T V V G K L E G E R D I T L G F V D L L R D D Y T E K D R S R G I Y F T Q S W V S T P G V L P V A S G G I H V W H M P A L T E I F G D D S V L Q F G G G T L G H P W G N A P G A V A N R V A L E A C V Q A R N E G R D L A R E G N T I I R E A T K W S P E L A A A C E V W K E I K F E F P A M D T V M Q V W P I L N L K K Y E T L S Y L P P L T T D Q L A R Q V D Y L L N N K W V P C L E F E T D H G F V Y R E H H N S P G Y Y D G R Y W T M W K L P M F G C T D P A Q V L N E L E E C K K E Y P N A F I R I I G F D S N R E V Q C I S F I A Y K P A G Y </s> G C T I K P K K D D E N Y M Y L H I H R A M H A F I H S G T V G K L E G F V A S G G I Q F G G G T L G F Y A E S S T G T W T V S G N V G F </s> O = C ( [ O - ] ) [ C @ @ ] ( O ) ( C O [ P + ] ( = O ) ( = O ) [ O - ] ) [ C @ @ H ] ( O ) [ C @ H ] ( O ) C O [ P + ] ( = O ) ( = O ) [ O - ]
13
T P A F N K P K V E L H V H L D G A I K P E T I L Y F G K K R G I A L P A D T V E E L R N I I G M D K P L S L P G F L A K F D Y Y M P V I A G C R E A I K R I A Y E F V E M K A K E G V V Y V E V R Y S P H L L A N S K V D P M P W N Q T E G D V T P D D V V D L V N Q G L Q E G E Q A F G I K V R S I L C C M R H Q P S W S L E V L E L C K K Y N Q K T V V A M D L A G D E T I E G S S L F P G H V E A Y E G A V K N G I H R T V H A G E V G S P E V V R E A V D I L K T E R V G H G Y H T I E D E A L Y N R L L K E N M H F E V C P W S S Y L T G A W D P K T T H A V V R F K N D K A N Y S L N T D D P L I F K S T L D T D Y Q M T K K D M G F T E E E F K R L N I N A A K S S F L P E E E K K E L L E R L Y R E Y Q </s> H V H L D G A L F L A F D Y M V R Y S P H L L W I L C C M R H W D L A G D E T H A E V G H Y E C S S T A T D D P I F </s> O = c 1 [ n H ] c n c 2 c 1 n c n 2 [ C @ @ H ] 1 O [ C @ H ] ( C O ) [ C @ @ H ] ( O ) [ C @ H ] 1 O
13
T P A F N K P K V E L H V H L D G A I K P E T I L Y F G K K R G I A L P A D T V E E L R N I I G M D K P L S L P G F L A K F D Y Y M P V I A G C R E A I K R I A Y E F V E M K A K E G V V Y V E V R Y S P H L L A N S K V D P M P W N Q T E G D V T P D D V V D L V N Q G L Q E G E Q A F G I K V R S I L C C M R H Q P S W S L E V L E L C K K Y N Q K T V V A M D L A G D E T I E G S S L F P G H V E A Y E G A V K N G I H R T V H A G E V G S P E V V R E A V D I L K T E R V G H G Y H T I E D E A L Y N R L L K E N M H F E V C P W S S Y L T G A W D P K T T H A V V R F K N D K A N Y S L N T D D P L I F K S T L D T D Y Q M T K K D M G F T E E E F K R L N I N A A K S S F L P E E E K K E L L E R L Y R E Y Q </s> H V H L D G A L F L A F D Y M V R Y S P L L W I L C C M R H W D L A G D E T H A E V G H Y C S S T A T D D P I F </s> O = c 1 [ n H ] c n c 2 c 1 n c n 2 [ C @ @ H ] 1 O [ C @ H ] ( C O ) [ C @ @ H ] ( O ) [ C @ H ] 1 O
13
T P A F N K P K V E L H V H L D G A I K P E T I L Y F G K K R G I A L P A D T V E E L R N I I G M D K P L S L P G F L A K F D Y Y M P V I A G C R E A I K R I A Y E F V E M K A K E G V V Y V E V R Y S P H L L A N S K V D P M P W N Q T E G D V T P D D V V D L V N Q G L Q E G E Q A F G I K V R S I L C C M R H Q P S W S L E V L E L C K K Y N Q K T V V A M D L A G D E T I E G S S L F P G H V E A Y E G A V K N G I H R T V H A G E V G S P E V V R E A V D I L K T E R V G H G Y H T I E D E A L Y N R L L K E N M H F E V C P W S S Y L T G A W D P K T T H A V V R F K N D K A N Y S L N T D D P L I F K S T L D T D Y Q M T K K D M G F T E E E F K R L N I N A A K S S F L P E E E K K E L L E R L Y R E Y Q </s> H V H L D G L F L F M R Y S L W C C M D L A G D E H E H C S T D D F </s> O C [ C @ H ] 1 O [ C @ @ H ] ( n 2 c [ n H + ] c 3 c 2 N = C N [ C @ H ] 3 O ) [ C @ H ] ( O ) [ C @ @ H ] 1 O
13
T R K C E L Q G L W R N E L G S N M T I S A L D V A G T F S G S Y Q T A V T A T N K Q I L V S P L K G A Q Q P P K G Q Q P T F G F T V Q W Q F A D S T T V F V G Q C F V D R R G K E M L E M A W L L R E E V P S R K D T W K A T R V G T N V F T R V K T R K C E L Q G L W R N E L G S N M T I S A L D V A G T F S G S Y Q T A V T A T N K Q I L V S P L K G A Q Q P P K G Q Q P T F G F T V Q W Q F A D S T T V F V G Q C F V D R R G K E M L E M A W L L R E E V P S R K D T W K A T R V G T N V F T R V K T R K C E L Q G L W R N E L G S N M T I S A L D V A G T F S G S Y Q T A V T A T N K Q I L V S P L K G A Q Q P P K G Q Q P T F G F T V Q W Q F A D S T T V F V G Q C F V D R R G K E M L E M A W L L R E E V P S R K D T W K A T R V G T N V F T R V K T R K C E L Q G L W R N E L G S N M T I S A L D V A G T F S G S Y Q T A V T A T N K Q I L V S P L K G A Q Q P P K G Q Q P T F G F T V Q W Q F A D S T T V F V G Q C F V D R R G K E M L E M A W L L R E E V P S R K D T W K A T R V G T N V F T R V K </s> R N E L G S N M Y Q T A V T A T N K I L S F V Q W Q F A D S T T V F M A W L L R E E R V G T N V F Q W K </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
13
E A G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V K G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V K P E A G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V K G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V K P </s> Y N Q L G S T F Y E S A V G N A E Y W V A W K R N A H S A T T W T Q W L L T S G L V G H D T F W K </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
13
E A G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V K G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V K P E A G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V K G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V K P </s> Y N Q L G S T F Y E S A V G N A E Y W V A W K R N A H S A T T W T Q W L L T S G L V G H D T F W K </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
13
Q K C N L Q G Q W R N K L G S N L I I E S V S Q N G E F T G T Y F T S V S L T N S T I R I S P L T G Y Q K L T E K P T F G F T V H W A F S D S I T V W T G Q C F L N E K G E E I L H T M W L L R S S Q E K E Q D N W T G T R V G A N T F T R L K C N L Q G Q W R N K L G S N L I I E S V S Q N G E F T G T Y F T S V S L T N S T I R I S P L T G Y Q K L T E K P T F G F T V H W A F S D S I T V W T G Q C F L N E K G E E I L H T M W L L R S S Q E K E Q D N W T G T R V G A N T F T R L S Q K C N L Q G Q W R N K L G S N L I I E S V S Q N G E F T G T Y F T S V S L T N S T I R I S P L T G Y Q K L T E K P T F G F T V H W A F S D S I T V W T G Q C F L N E K G E E I L H T M W L L R S S Q E K E Q D N W T G T R V G A N T F T R L K C N L Q G Q W R N K L G S N L I I E S V S Q N G E F T G T Y F T S V S L T N S T I R I S P L T G Y Q K L T E K P T F G F T V H W A F S D S I T V W T G Q C F L N E K G E E I L H T M W L L R S S Q E K E Q D N W T G T R V G A N T F T R L S </s> R N K L G S N L Y F T S V S L T N S I R S F V H W A F S D S I T V W T M W L L R S S R V G A N T F K W T </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
13
Q K C N L Q G Q W R N K L G S N L I I E S V S Q N G E F T G T Y F T S V S L T N S T I R I S P L T G Y Q K L T E K P T F G F T V H W A F S D S I T V W T G Q C F L N E K G E E I L H T M W L L R S S Q E K E Q D N W T G T R V G A N T F T R L K C N L Q G Q W R N K L G S N L I I E S V S Q N G E F T G T Y F T S V S L T N S T I R I S P L T G Y Q K L T E K P T F G F T V H W A F S D S I T V W T G Q C F L N E K G E E I L H T M W L L R S S Q E K E Q D N W T G T R V G A N T F T R L S </s> N L G S N Y F T S V S L T I W F S D S I T W W L L R S A N F </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
13.4
A E A G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V A E A G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V A E A G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V A E A G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V </s> Y N Q L G S T F Y E S A V G N A E Y W V A W K R N A H S A T T W T Q W L L T S G L V G H D T F W K A </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
13.4
A E A G I T G T W Y N Q L G S T F I V T A G A D G A L T G T Y E S A V G N A E S R Y V L T G R Y D S A P A T D G S G T A L G W T V A W K N N Y R N A H S A T T W S G Q Y V G G A E A R I N T Q W L L T S G T T E A N A W K S T L V G H D T F T K V </s> N Q L G S T Y E S A V G N A W A H S A T W W L T S D F </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
13.42
G G A D C G L R P L F E K K S L E D K T E R E L L E S Y I I V E G S D A E I G M S P W Q V M L F R K S P Q E L L C G A S L I S D R W V L T A A H C L L Y P P W D K N F T E N D L L V R I G K H S R T R Y E R N I E K I S M L E K I Y I H P R Y N W R E N L D R D I A L M K L K K P V A F S D Y I H P V C L P D R E T A A S L L Q A G Y K G R V T G W G N L K E G Q P S V L Q V V N L P I V E R P V C K D S T R I R I T D N M F C A G Y K P D E G K R G D A C E G D S G G P F V M K S P F N N R W Y Q M G I V S W G E G C D R D G K Y G F Y T H V F R L K K W I Q K V I D Q F </s> I V M L F R K P Q E L L C G A A H C L L Y P P W D K N F L L V R K S R T R Y E R N E K I S M Y W L D V W G N E G Q P S L I A G D A C E G D S G G I V S W G E G C D R K Y G F Y </s> C C C C [ C @ H ] ( N C ( = O ) [ C @ H ] 1 C C C C N 1 C ( = O ) [ C @ @ H ] ( [ N H 3 + ] ) C C C N C ( N ) = [ N H 2 + ] ) C ( = O ) N C C C C C C C C C C C C ( = O ) N [ C @ @ H ] ( C C ( = O ) [ O - ] ) C ( = O ) N [ C @ @ H ] ( C c 1 c c c ( O ) c c 1 ) C ( = O ) N [ C @ @ H ] ( C C C ( = O ) [ O - ] ) C ( = O ) N 1 C C C [ C @ H ] 1 C ( = O ) N [ C @ H ] ( C ( = O ) N 1 C C C [ C @ H ] 1 C ( = O ) N [ C @ @ H ] ( C C C ( = O ) [ O - ] ) C ( = O ) N [ C @ @ H ] ( C C C ( = O ) [ O - ] ) C ( = O ) N [ C @ @ H ] ( C ) C ( = O ) N [ C @ @ H ] ( C ) C ( = O ) [ O - ] ) [ C @ @ H ] ( C ) C C
13.77
G G A D C G L R P L F E K K S L E D K T E R E L L E S Y I I V E G S D A E I G M S P W Q V M L F R K S P Q E L L C G A S L I S D R W V L T A A H C L L Y P P W D K N F T E N D L L V R I G K H S R T R Y E R N I E K I S M L E K I Y I H P R Y N W R E N L D R D I A L M K L K K P V A F S D Y I H P V C L P D R E T A A S L L Q A G Y K G R V T G W G N L K E G Q P S V L Q V V N L P I V E R P V C K D S T R I R I T D N M F C A G Y K P D E G K R G D A C E G D S G G P F V M K S P F N N R W Y Q M G I V S W G E G C D R D G K Y G F Y T H V F R L K K W I Q K V I D Q F </s> I V M L F R K P Q E L L C G A A H C L L Y P P W D K N F L L V R K S R T R Y E R N E K I S M Y W N L D K V W G N E G Q P S L I A G D A C E G D S G G I V S W G E G C D R K Y G F Y </s> C C [ C @ H ] ( C ) [ C @ H ] ( N C ( = O ) [ C @ @ H ] 1 C C C N 1 C ( = O ) [ C @ H ] ( C C C ( = O ) [ O - ] ) N C ( = O ) [ C @ H ] ( C c 1 c c c ( O ) c c 1 ) N C ( = O ) [ C @ H ] ( C C ( = O ) [ O - ] ) N C ( = O ) C C C C C C C C C C C N C ( = O ) [ C @ H ] ( C c 1 c c c s 1 ) N C ( = O ) [ C @ H ] 1 C C C C N 1 C ( = O ) [ C @ @ H ] ( [ N H 3 + ] ) C C C N C ( N ) = [ N H 2 + ] ) C ( = O ) N 1 C C C [ C @ H ] 1 C ( = O ) N [ C @ @ H ] ( C C C ( = O ) [ O - ] ) C ( = O ) N [ C @ @ H ] ( C C C ( = O ) [ O - ] ) C ( = O ) N [ C @ @ H ] ( C ) C ( = O ) [ O - ]
13.82
S E L L V N T K S G K V M G T R V P V L S S H I S A F L G I P F A E P P V G N M R F R R P E P K K P W S G V W N A S T Y P N N C Q Q Y V D E Q F P G F S G S E M W N P N R E M S E D C L Y L N I W V P S P R P K S T T V M V W I Y G G G F Y S G S S T L D V Y N G K Y L A Y T E E V V L V S L S Y R V G A F G F L A L H G S Q E A P G N V G L L D Q R M A L Q W V H D N I Q F F G G D P K T V T I F G E S A G G A S V G M H I L S P G S R D L F R R A I L Q S G S P N C P W A S V S V A E G R R R A V E L G R N L N C N L N S D E E L I H C L R E K K P Q E L I D V E W N V L P F D S I F R F S F V P V I D G E F F P T S L E S M L N S G N F K K T Q I L L G V N K D E G S F F L L Y G A P G F S K D S E S K I S R E D F M S G V K L S V P H A N D L G L D A V T L Q Y T D W M D D N N G I K N R D G L D D I V G D H N V I C P L M H F V N K Y T K F G N G T Y L Y F F N H R A S N L V W P E W M G V I H G Y E I E F V F G L P L V K E L N Y T A E E E A L S R R I M H Y W A T F A K T G N P N E S K W P L F T T K E Q K F I D L N T E P M K V H Q R L R V Q M C V F W N Q F L P K L L N A </s> D G S M W N W Y G G G F Y S G S L V Y Y G E S A G G A S Q S G S C P W A W F R F V E F F Y V N V W I H G Y E I </s> C [ N + ] ( C ) ( C ) c 1 c c c c ( C ( O ) ( O ) C ( F ) ( F ) F ) c 1
13.96
A R S T N T F N Y A T Y H T L D E I Y D F M D L L V A Q H P E L V S K L Q I G R S Y E G R P I Y V L K F S T G G S N R P A I W I D L G I H S R E W I T Q A T G V W F A K K F T E N Y G Q N P S F T A I L D S M D I F L E I V T N P N G F A F T H S E N R L W R K T R S V T S S S L C V G V D A N R N W D A G F G K A G A S S S P C S E T Y H G K Y A N S E V E V K S I V D F V K N H G N F K A F L S I H S Y S Q L L L Y P Y G Y T T Q S I P D K T E L N Q V A K S A V A A L K S L Y G T S Y K Y G S I I T T I Y Q A S G G S I D W S Y N Q G I K Y S F T F E L R D T G R Y G F L L P A S Q I I P T A Q E T W L G V L T I M E H T V N N </s> I H R E T L R K D A N R W G A S S E T Y S I H S Y S Q L L Y P Y G Y I I T I Y Q A S G G S I D W F T F E L D T G G F </s> C C ( C ) [ C @ H ] ( N C ( = O ) [ C @ H ] ( C c 1 c c c c c 1 ) N C ( = O ) O C c 1 c c c c c 1 ) [ P @ ] ( = O ) ( [ O - ] ) O [ C @ @ H ] ( C c 1 c c c c c 1 ) C ( = O ) [ O - ]
14.39
R E D P Q L L V R V R G G Q L R G I R L K A P G G P V S A F L G I P F A E P P V G S R R F M P P E P K R P W S G V L D A T T F Q N V C Y Q Y V D T L Y P G F E G T E M W N P N R E L S E D C L Y L N V W T P Y P R P A S P T P V L I W I Y G G G F Y S G A A S L D V Y D G R F L A Q V E G A V L V S M N Y R V G T F G F L A L P G S R E A P G N V G L L D Q R L A L Q W V Q E N I A A F G G D P M S V T L F G E S A G A A S V G M H I L S L P S R S L F H R A V L Q S G T P N G P W A T V S A G E A R R R A T L L A R L V G C P G N D T E L I A C L R T R P A Q D L V D H E W H V L P Q E S I F R F S F V P V V D G D F L S D T P E A L I N T G D F Q D L Q V L V G V V K D E G S A F L V Y G V P G F S K D N E S L I S R A Q F L A G V R I G V P Q A S D L A A E A V V L H Y T D W L H P E D P T H L R D A M S A V V G D H N V V C P V A Q L A G R L A A Q G A R V Y A Y I F E H R A S T L T W P L W M G V P H G Y E I E F I F G L P L D P S L N Y T T E E R I F A Q R L M K Y W T N F A R T G D P N D P R D S K S P Q W P P Y T T A A Q Q Y V S L N L K P L E V R R G L R A Q T C A F W N R F L P K L L S </s> Q Y V D T L Y F E G T E M W N P W Y G G G F Y S G A L V Y V G T E S A G Q S Q L V D H E W H V L E S I F R F S F V D E G S A F L V Y G V L W M P H G Y E I </s> N c 1 c c c 2 c ( c 1 ) C ( c 1 c c c c c 1 ) N ( C C C C C C c 1 c n ( C C N c 3 c 4 c c c c c 4 n c 4 c c c c c 3 4 ) n n 1 ) c 1 c c ( N ) c c c 1 - 2
14.39
R E D P Q L L V R V R G G Q L R G I R L K A P G G P V S A F L G I P F A E P P V G S R R F M P P E P K R P W S G V L D A T T F Q N V C Y Q Y V D T L Y P G F E G T E M W N P N R E L S E D C L Y L N V W T P Y P R P A S P T P V L I W I Y G G G F Y S G A A S L D V Y D G R F L A Q V E G A V L V S M N Y R V G T F G F L A L P G S R E A P G N V G L L D Q R L A L Q W V Q E N I A A F G G D P M S V T L F G E S A G A A S V G M H I L S L P S R S L F H R A V L Q S G T P N G P W A T V S A G E A R R R A T L L A R L V G C P G N D T E L I A C L R T R P A Q D L V D H E W H V L P Q E S I F R F S F V P V V D G D F L S D T P E A L I N T G D F Q D L Q V L V G V V K D E G S A F L V Y G V P G F S K D N E S L I S R A Q F L A G V R I G V P Q A S D L A A E A V V L H Y T D W L H P E D P T H L R D A M S A V V G D H N V V C P V A Q L A G R L A A Q G A R V Y A Y I F E H R A S T L T W P L W M G V P H G Y E I E F I F G L P L D P S L N Y T T E E R I F A Q R L M K Y W T N F A R T G D P N D P R D S K S P Q W P P Y T T A A Q Q Y V S L N L K P L E V R R G L R A Q T C A F W N R F L P K L L S </s> Y D T L G T W N Y G G G Y S Y E S A V D H E W H S I F R F S E S A F V Y G W P H G Y I </s> N c 1 c c c 2 c ( c 1 ) c ( - c 1 c c c c c 1 ) [ n + ] ( C C C C C C c 1 c n ( C C N c 3 c 4 c c c c c 4 n c 4 c c c c c 3 4 ) n n 1 ) c 1 c c ( N ) c c c 2 1
15
K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L R T R K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L R T K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L R T R K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L R T </s> N D L G S N M Y T T A V T A T S N I K S F V W K F S E S T T V F M W L L R S S R V G I N I F W K N T </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
15
K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L R T R K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L R T </s> N L G S N Y T T A V T A T S I V W F S E S T T F W L L R S R I N F </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
15
E G R E D P Q L L V R V R G G Q L R G I R L K A P G G P V S A F L G I P F A E P P V G S R R F M P P E P K R P W S G V L D A T T F Q N V C Y Q Y V D T L Y P G F E G T E M W N P N R E L S E D C L Y L N V W T P Y P R P A S P T P V L I W I Y G G G F Y S G A A S L D V Y D G R F L A Q V E G A V L V S M N Y R V G T F G F L A L P G S R E A P G N V G L L D Q R L A L Q W V Q E N I A A F G G D P M S V T L F G E S A G A A S V G M H I L S L P S R S L F H R A V L Q S G T P N G P W A T V S A G E A R R R A T L L A R L V G C P G N D T E L I A C L R T R P A Q D L V D H E W H V L P Q E S I F R F S F V P V V D G D F L S D T P E A L I N T G D F Q D L Q V L V G V V K D E G S A F L V Y G V P G F S K D N E S L I S R A Q F L A G V R I G V P Q A S D L A A E A V V L H Y T D W L H P E D P T H L R D A M S A V V G D H N V V C P V A Q L A G R L A A Q G A R V Y A Y I F E H R A S T L T W P L W M G V P H G Y E I E F I F G L P L D P S L N Y T T E E R I F A Q R L M K Y W T N F A R T G D P N D P R D S K S P Q W P P Y T T A A Q Q Y V S L N L K P L E V R R G L R A Q T C A F W N R F L P K L L S </s> Q Y V D T L Y P F E G T E M W N P W Y G G G F Y S G A L V Y Y E S A G A Q S W V D E W L P Q E S I F R F S V E S A F L V Y G V I G P L W M P H G Y E I </s> N c 1 c c c 2 c ( c 1 ) C ( c 1 c c c c c 1 ) N ( C C C C C C c 1 c n n n 1 C C N c 1 c 3 c c c c c 3 n c 3 c c c c c 1 3 ) c 1 c c ( N ) c c c 1 - 2
15
E D P Q L L V R V R G G Q L R G I R L K A P G G P V S A F L G I P F A E P P V G S R R F M P P E P K R P W S G V L D A T T F Q N V C Y Q Y V D T L Y P G F E G T E M W N P N R E L S E D C L Y L N V W T P Y P R P A S P T P V L I W I Y G G G F Y S G A A S L D V Y D G R F L A Q V E G A V L V S M N Y R V G T F G F L A L P G S R E A P G N V G L L D Q R L A L Q W V Q E N I A A F G G D P M S V T L F G E S A G A A S V G M H I L S L P S R S L F H R A V L Q S G T P N G P W A T V S A G E A R R R A T L L A R L V G C P N D T E L I A C L R T R P A Q D L V D H E W H V L P Q E S I F R F S F V P V V D G D F L S D T P E A L I N T G D F Q D L Q V L V G V V K D E G S A F L V Y G V P G F S K D N E S L I S R A Q F L A G V R I G V P Q A S D L A A E A V V L H Y T D W L H P E D P T H L R D A M S A V V G D H N V V C P V A Q L A G R L A A Q G A R V Y A Y I F E H R A S T L T W P L W M G V P H G Y E I E F I F G L P L D P S L N Y T T E E R I F A Q R L M K Y W T N F A R T G D P N D P R D S K S P Q W P P Y T T A A Q Q Y V S L N L K P L E V R R G L R A Q T C A F W N R F L P K L L S </s> Y V D T L G T W N Y G G G Y S G L Y E S A E W L Q E S I F R F A F V Y G V W M P H G Y I </s> N c 1 c c c 2 c ( c 1 ) c ( - c 1 c c c c c 1 ) [ n + ] ( C C C C C C c 1 c n n n 1 C C N c 1 c 3 c c c c c 3 [ n H + ] c 3 c c c c c 1 3 ) c 1 c c ( N ) c c c 2 1
15.22
K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L </s> N D L G S N M Y T T A V T A T S N I K S F V W K F S E S T T V F T M W L L R S S R V G I N F W K N T </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1
15.22
K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L K C S L T G K W T N D L G S N M T I G A V N S R G E F T G T Y T T A V T A T S N E I K E S P L H G T E N T I N K R T Q P T F G F T V N W K F S E S T T V F T G Q C F I D R N G K E V L K T M W L L R S S V N D I G D D W K A T R V G I N I F T R L </s> N L G S Y T A V T A T S I V W F S E S T T F W L L R S I N F </s> O = C ( [ O - ] ) C C C C [ C @ @ H ] 1 S C [ C @ @ H ] 2 N C ( = O ) N [ C @ @ H ] 2 1